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4080 SMILES Strings for Cathepsin D

Compound NameSMILES String
BDBM201 CC(C)[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(CC1CCCCC1)NC(=O)[C@@H](NC(C)=O)C(C)C |r|
BDBM148173 NC1=N[C@]2(CO[C@H](C[C@H]2CS1)c1ncco1)c1ccc(F)cc1F |r,t:1|
BDBM150693 NC1=N[C@]2(CN(C[C@H]2CS1)c1ncc(F)cn1)c1cc(NC(=O)c2ncc(F)cc2F)ccc1F |r,t:1|
BDBM150688 NC1=N[C@]2(CN(C[C@H]2CS1)c1ncc(F)cn1)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |r,t:1|
BDBM160666 NC1=N[C@]2(CO[C@@H](CF)C[C@H]2CS1)c1cc(CNCC(F)(F)F)c(F)cc1F |t:1|
BDBM7987 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](COCc1ccc(Br)cc1)NC(=O)c1ccc(Cl)c(Cl)c1)C(N)=O |r|
BDBM7988 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](COCc1ccc(Br)cc1)NC(=O)c1c(F)cc(F)cc1F)C(N)=O |r|
BDBM7989 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](COCc1ccc(Br)cc1)NC(=O)C(c1ccccc1)c1ccccc1)C(N)=O |r|
BDBM7990 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](COCc1ccc(Br)cc1)NC(=O)CC(c1ccccc1)c1ccccc1)C(N)=O |r|
BDBM7991 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](COCc1ccc(Br)cc1)NC(=O)Cc1cccs1)C(N)=O |r|
BDBM7992 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](COCc1ccc(Br)cc1)NC(=O)c1ccc2OCOc2c1)C(N)=O |r|
BDBM7993 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](COCc1ccc(Br)cc1)NC(=O)[C@@H]1Cc2ccccc2N1)C(N)=O |r|
BDBM7994 COc1cccc(CCNC(=O)C[C@H](O)[C@H](COCc2ccc(Br)cc2)NC(=O)c2c(F)cc(F)cc2F)c1 |r|
BDBM7995 O[C@@H](CC(=O)NC1CCCCC1)[C@H](COCc1ccc(Br)cc1)NC(=O)c1c(F)cc(F)cc1F |r|
BDBM7998 O[C@H]([C@@H](O)[C@@H](OCC=C)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@@H](OCC=C)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM7999 O[C@H]([C@@H](O)[C@@H](OCC=C)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@H](CN[C@@H]1[C@H](O)Cc2ccccc12)OCC=C |r|
BDBM8001 O[C@H]([C@@H](O)[C@@H](OC\C=C\Br)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@@H](OC\C=C\Br)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM8002 O[C@H]([C@@H](O)[C@@H](OC\C=C\c1ccccc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@@H](OC\C=C\c1ccccc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM8003 O[C@H]([C@@H](O)[C@@H](OC\C=C\c1ccc(F)cc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@@H](OC\C=C\c1ccc(F)cc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM8004 Cc1ccc(\C=C\CO[C@H]([C@H](O)[C@@H](O)[C@@H](OC\C=C\c2ccc(C)cc2)C(=O)N[C@@H]2[C@H](O)Cc3ccccc23)C(=O)N[C@@H]2[C@H](O)Cc3ccccc23)cc1 |r|
BDBM8087 CC(C)[C@H](NC(=O)C=Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(Br)cc1)C(N)=O |r,w:7.6|
BDBM8088 CC(C)[C@H](NC(=O)c1cc(C)oc1C(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(Br)cc1)C(N)=O |r|
BDBM8089 COc1cccc(C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc2ccccc2)[C@@H](O)CN[C@@H](Cc2ccc(Br)cc2)C(N)=O)c1OC |r|
BDBM8090 CC(C)[C@H](NC(=O)\C=C\c1c(F)c(F)c(F)c(F)c1F)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(Br)cc1)C(N)=O |r|
BDBM8091 CCOc1cccc(NC(=O)\C=C\C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc2ccccc2)[C@@H](O)CN[C@@H](Cc2ccc(Br)cc2)C(N)=O)c1 |r|
BDBM8092 CC(C)[C@H](NC(=O)C1CCCCC1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1ccccc1)C(N)=O |r|
BDBM8093 CC(C)[C@H](NC(=O)c1cnc(C)cn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1ccccc1)C(N)=O |r|
BDBM8094 CC(C)[C@H](NC(=O)c1ccoc1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1ccccc1)C(N)=O |r|
BDBM8095 CCCc1c(cnn1-c1ccccc1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1ccccc1)C(N)=O |r|
BDBM8096 CC(C)[C@H](NC(=O)C=Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1ccccc1)C(N)=O |r,w:7.6|
BDBM8097 CC(C)[C@H](NC(=O)c1cc(C)oc1C(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1ccccc1)C(N)=O |r|
BDBM8098 COc1cccc(C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc2ccccc2)[C@@H](O)CN[C@@H](Cc2ccc(cc2)-c2ccccc2)C(N)=O)c1OC |r|
BDBM8099 CC(C)[C@H](NC(=O)\C=C\c1c(F)c(F)c(F)c(F)c1F)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1ccccc1)C(N)=O |r|
BDBM8100 COc1ncc(-c2ccc(C[C@H](NC[C@H](O)[C@H](Cc3ccccc3)NC(=O)[C@@H](NC(=O)c3ccccn3)C(C)C)C(N)=O)cc2)c(OC)n1 |r|
BDBM8101 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1ccc2OCOc2c1)C(N)=O |r|
BDBM8102 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1cc2ccccc2o1)C(N)=O |r|
BDBM8103 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1cccc2c3ccccc3sc12)C(N)=O |r|
BDBM8104 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1cccc(NC(C)=O)c1)C(N)=O |r|
BDBM8105 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1cccc(\C=C\C(O)=O)c1)C(N)=O |r|
BDBM8106 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1ccccc1N)C(N)=O |r|
BDBM8107 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)C1CCCC1)C(N)=O |r|
BDBM8108 CC(C)[C@H](NC(=O)C1CCCCC1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1ccc2OCOc2c1)C(N)=O |r|
BDBM8109 CC(C)[C@H](NC(=O)CCc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1ccc2OCOc2c1)C(N)=O |r|
BDBM8110 CC(C)[C@H](NC(=O)C1CCCCC1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1cc2ccccc2o1)C(N)=O |r|
BDBM8111 CC(C)[C@H](NC(=O)CCc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1cc2ccccc2o1)C(N)=O |r|
BDBM8112 CC(C)[C@H](NC(=O)c1ccoc1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1cc2ccccc2o1)C(N)=O |r|
BDBM8113 CCCc1c(cnn1-c1ccccc1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1cc2ccccc2o1)C(N)=O |r|
BDBM8114 CC(C)[C@H](NC(=O)c1cc(C)oc1C(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1cc2ccccc2o1)C(N)=O |r|
BDBM8115 COc1cccc(C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc2ccccc2)[C@@H](O)CN[C@@H](Cc2ccc(cc2)-c2cc3ccccc3o2)C(N)=O)c1OC |r|
BDBM8082 CC(C)[C@H](NC(=O)C1CCCCC1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(Br)cc1)C(N)=O |r|
BDBM8083 CC(C)[C@H](NC(=O)c1cnc(C)cn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(Br)cc1)C(N)=O |r|
BDBM8084 CC(C)[C@H](NC(=O)CCc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(Br)cc1)C(N)=O |r|
BDBM8085 CC(C)[C@H](NC(=O)c1ccoc1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(Br)cc1)C(N)=O |r|
BDBM8086 CCCc1c(cnn1-c1ccccc1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(Br)cc1)C(N)=O |r|
BDBM8005 CC(=O)c1ccc(\C=C\CO[C@H]([C@H](O)[C@@H](O)[C@@H](OC\C=C\c2ccc(cc2)C(C)=O)C(=O)N[C@@H]2[C@H](O)Cc3ccccc23)C(=O)N[C@@H]2[C@H](O)Cc3ccccc23)cc1 |r|
BDBM8006 COc1ncc(\C=C\CO[C@H]([C@H](O)[C@@H](O)[C@@H](OC\C=C\c2cnc(OC)nc2OC)C(=O)N[C@@H]2[C@H](O)Cc3ccccc23)C(=O)N[C@@H]2[C@H](O)Cc3ccccc23)c(OC)n1 |r|
BDBM8007 O[C@H]([C@@H](O)[C@@H](OC\C=C\c1ccc2OCOc2c1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@@H](OC\C=C\c1ccc2OCOc2c1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM8008 O[C@H]([C@@H](O)[C@@H](OC\C=C\c1ccsc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@@H](OC\C=C\c1ccsc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM8009 Cc1noc(C)c1\C=C\CO[C@H]([C@H](O)[C@@H](O)[C@@H](OC\C=C\c1c(C)noc1C)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM8010 O[C@H]([C@@H](O)[C@@H](OC\C=C\C=C\c1ccccc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@@H](OC\C=C\C=C\c1ccccc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM8011 COC(=O)\C=C\C=C\CO[C@H]([C@H](O)[C@@H](O)[C@@H](OC\C=C\C=C\C(=O)OC)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM8012 O[C@H]([C@@H](O)[C@@H](OC\C=C\C#Cc1ccccc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@@H](OC\C=C\C#Cc1ccccc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM8013 C[Si](C)(C)C#C\C=C\CO[C@H]([C@H](O)[C@@H](O)[C@@H](OC\C=C\C#C[Si](C)(C)C)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM8014 O[C@H]([C@@H](O)[C@@H](OC\C=C\C#C)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@@H](OC\C=C\C#C)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM8015 CC(C)[C@H](NC(=O)CCc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1ccccc1)C(N)=O |r|
BDBM8016 CC(C)C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)c1ccccn1)C(N)=O |r|
BDBM8018 CCCCNC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)Cc1ccc2ccccc2c1)C(C)CC |r|
BDBM8019 COc1ccc(CCN(C[C@H](O)[C@H](Cc2ccccc2)NC(=O)COc2cccc(Cl)c2)C(=O)C2CCNCC2)cc1 |r|
BDBM8020 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](C)C(N)=O |r|
BDBM8021 CC(C)C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C)C(N)=O |r|
BDBM8022 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H](C(N)=O)c1ccccc1 |r|
BDBM8023 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM8024 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H](Cc1ccccc1)C(N)=O |r|
BDBM8025 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(Br)cc1)C(N)=O |r|
BDBM8026 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1ccccc1)C(N)=O |r|
BDBM8027 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1ccc(C)cc1)C(N)=O |r|
BDBM8028 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1ccc(cc1)-c1cccc(N)c1)C(N)=O |r|
BDBM7974 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C)C(N)=O |r|
BDBM7975 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CCc1ccccc1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C)C(N)=O |r|
BDBM7976 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](COCc1ccccc1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C)C(N)=O |r|
BDBM7977 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](COCc1ccc(Br)cc1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C)C(N)=O |r|
BDBM7978 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](COCc1ccc(Br)cc1)[C@@H](O)CC(=O)NCCCc1ccccc1 |r|
BDBM7979 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](COCc1ccc(Br)cc1)[C@@H](O)CC(=O)NCC1CCCCC1 |r|
BDBM7980 COCCCNC(=O)C[C@H](O)[C@H](COCc1ccc(Br)cc1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C |r|
BDBM7981 COc1cccc(CCNC(=O)C[C@H](O)[C@H](COCc2ccc(Br)cc2)NC(=O)[C@@H](NC(=O)c2ccccn2)C(C)C)c1 |r|
BDBM7982 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](COCc1ccc(Br)cc1)[C@@H](O)CC(=O)NCCNc1ccccc1 |r|
BDBM7983 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](COCc1ccc(Br)cc1)[C@@H](O)CC(=O)NC1CCCCC1 |r|
BDBM7984 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](COCc1ccc(Br)cc1)[C@@H](O)CC(=O)NCc1ccc(cc1)C#N |r|
BDBM7985 CCCCNC(=O)C[C@H](O)[C@H](COCc1ccc(Br)cc1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C |r|
BDBM7986 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](COCc1ccc(Br)cc1)NC(=O)[C@H](NC(=O)c1ccccn1)C(C)C)C(N)=O |r|
BDBM8029 COc1ccccc1-c1ccc(C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)c2ccccn2)C(C)C)C(N)=O)cc1 |r|
BDBM8030 COc1ccccc1-c1cccc(C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)c2ccccn2)C(C)C)C(N)=O)c1 |r|
BDBM8031 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1cccc(OS(=O)(=O)C(F)(F)F)c1)C(N)=O |r|
BDBM8032 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1cccc(c1)-c1ccc(C)cc1)C(N)=O |r|
BDBM8033 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1cccc(c1)-c1ccccc1)C(N)=O |r|
BDBM8034 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H](Cc1cccc(c1)-c1cccc(N)c1)C(N)=O |r|
BDBM8035 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)Cn1c(Cc2ccc(Br)cc2)c(O)[nH]c1=O |r|
BDBM10145 CC[C@@H](C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc2N(C)S(=O)(=O)CCc3cn(CC)c(c1)c23 |r|
BDBM10149 COC(=O)N[C@@H](C(c1ccccc1)c1ccccc1)C(=O)NCCCCC(CO)N(CC(C)C)S(=O)(=O)c1ccc(N)cc1 |r|
BDBM16034 C[C@@H](NC(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CC1)N(C)S(C)(=O)=O)c1ccccc1 |r|
BDBM16047 CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(O)=O)C(C)C)[C@@H](O)C[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
BDBM16058 [H][C@]1(CN(C)C[C@H]1C(=O)N[C@@H](C(C)C)C(=O)NCCCC)[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(C)=O |r|
BDBM16059 [H][C@]1(CN(CC)C(=O)[C@H]1C(=O)N[C@@H](C(C)C)C(=O)NCCCC)[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(C)=O |r|
BDBM16060 [H][C@]1(CC(=O)N(C)[C@H]1C(=O)N[C@@H](C(C)C)C(=O)NCCCC)[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(C)=O |r|
BDBM16061 [H][C@]1(CCO[C@H]1C(=O)N[C@@H](C(C)C)C(=O)NCCCC)[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(C)=O |r|
BDBM16062 [H][C@]1(CC(=O)C[C@H]1C(=O)N[C@@H](C)C(O)=O)[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(C)=O |r|
BDBM16063 [H][C@]1(CC(=C)C[C@H]1C(=O)N[C@@H](C)C(O)=O)[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(C)=O |r|
BDBM16064 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSCCCCSC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)C(=O)N1 |r|
BDBM16065 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSCCCCCSC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)C(=O)N1 |r|
BDBM16066 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSCCCCCCSC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)C(=O)N1 |r|
BDBM16067 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSCc2ccc(CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)C(=O)N1)cc2 |r|
BDBM16068 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSC\C=C/CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)C(=O)N1 |r,c:16|
BDBM16069 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSC\C=C\CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)C(=O)N1 |r,t:16|
BDBM16070 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSCCCCSC[C@H](NC(C)=O)C(=O)N[C@@H](C)C(=O)N1 |r|
BDBM16071 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSCCCCCSC[C@H](NC(C)=O)C(=O)N[C@@H](C)C(=O)N1 |r|
BDBM16072 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSCCCCCCSC[C@H](NC(C)=O)C(=O)N[C@@H](C)C(=O)N1 |r|
BDBM16073 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSCc2ccc(CSC[C@H](NC(C)=O)C(=O)N[C@@H](C)C(=O)N1)cc2 |r|
BDBM16074 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSC\C=C/CSCCC(=O)N[C@@H](C)C(=O)N1 |r,c:16|
BDBM16075 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSC\C=C\CSCCC(=O)N[C@@H](C)C(=O)N1 |r,t:16|
BDBM16076 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSC\C=C\CSC[C@H](N)C(=O)N[C@@H](C)C(=O)N1 |r,t:16|
BDBM16077 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(C)=O |r|
BDBM16078 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](C)N(C)C(=O)[C@H](CC(C)C)NC(C)=O |r|
BDBM16079 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1COCCCCOC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)C(=O)N1 |r|
BDBM16080 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1COC\C=C/COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)C(=O)N1 |r,c:16|
BDBM16081 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1COC\C=C/CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)C(=O)N1 |r,c:16|
BDBM16082 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1COC\C=C/CSC[C@H](NC(C)=O)C(=O)N[C@@H](C)C(=O)N1 |r,c:16|
BDBM16083 CCCCNC(=O)[C@@H](NC(=O)[C@H](C)C[C@H](O)[C@@H]1CSC\C=C/CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)C(=O)N1)C(C)C |r,c:20|
BDBM16084 CCCCNC(=O)[C@@H](NC(=O)[C@H](C)C[C@H](O)[C@@H]1CSC\C=C\CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)C(=O)N1)C(C)C |r,t:20|
BDBM16048 CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(O)=O)C(C)C)[C@@H](O)C[C@@H](C)C(=O)N[C@@H](C)C(O)=O |r|
BDBM16049 [H][C@]1(CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O)[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(O)=O)C(C)C |r|
BDBM16050 [H][C@]1(CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(O)=O)C(O)=O)[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(O)=O)C(C)C |r|
BDBM16051 [H][C@]1(CCC[C@H]1C(=O)N[C@@H](C)C(O)=O)[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(O)=O)C(C)C |r|
BDBM16052 [H][C@]1(CCC[C@H]1C(=O)N[C@@H](C)C(O)=O)[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(C)=O |r|
BDBM16053 [H][C@]1(CCC[C@H]1C(=O)N[C@@H](C(C)C)C(O)=O)[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(C)=O |r|
BDBM16054 [H][C@]1(CCC[C@H]1C(=O)N[C@@H](C)C(=O)NCCCC)[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(C)=O |r|
BDBM16055 [H][C@]1(CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)NCCCC)[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(C)=O |r|
BDBM16056 [H][C@]1(CCC[C@H]1C(=O)NCCCC)[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(C)=O |r|
BDBM16057 [H][C@]1(CC(=O)C[C@H]1C(=O)N[C@@H](C(C)C)C(=O)NCCCC)[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(C)=O |r|
BDBM16085 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSC\C=C\CS[C@@H]2CNCC[C@@H]2C(=O)N[C@@H](C)C(=O)N1 |r,t:16|
BDBM16086 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSC\C=C\CS[C@H]2CNCC[C@H]2C(=O)N[C@@H](C)C(=O)N1 |r,t:16|
BDBM16087 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSC\C=C\CS[C@@H]2CCCN[C@@H]2C(=O)N[C@@H](C)C(=O)N1 |r,t:16|
BDBM16088 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSC\C=C\CS[C@H]2CCCN[C@H]2C(=O)N[C@@H](C)C(=O)N1 |r,t:16|
BDBM16089 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSC\C=C\CC[C@@H]2CNCC[C@@H]2C(=O)N[C@@H](C)C(=O)N1 |r,t:16|
BDBM16090 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSC\C=C\CC[C@H]2CNCC[C@H]2C(=O)N[C@@H](C)C(=O)N1 |r,t:16|
BDBM16091 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSC\C=C\CC[C@@H]2CCCN[C@@H]2C(=O)N[C@@H](C)C(=O)N1 |r,t:16|
BDBM16092 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CSC\C=C\CC[C@H]2CCCN[C@H]2C(=O)N[C@@H](C)C(=O)N1 |r,t:16|
BDBM16251 CSCC[C@H](NC(=O)OCn1nc(C)cc1C)C(=O)N[C@@H](CC(C)C)[C@@H](O)C[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)NCc1ccccc1 |r|
BDBM16252 CSC[C@H](NC(=O)OCn1nc(C)cc1C)C(=O)N[C@@H](CC(C)C)[C@@H](O)C[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)NCC(C)C |r|
BDBM16253 CC(C)CNC(=O)[C@@H](NC(=O)[C@H](C)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CS(C)(=O)=O)NC(=O)OCn1nc(C)cc1C)C(C)C |r|
BDBM16254 CC(C)CNC(=O)[C@@H](NC(=O)[C@H](C)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CS(C)(=O)=O)NC(=O)OCc1nc(C)oc1C)C(C)C |r|
BDBM16256 CCCNC(=O)c1cc(cc(c1)C(=O)N[C@@H](CC(C)C)[C@@H](O)C[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)NC(C)C)N(C)S(C)(=O)=O |r|
BDBM16257 CC(C)C[C@H](NC(=O)c1cc(cc(c1)C(=O)NCc1nc(C)oc1C)N(C)S(C)(=O)=O)[C@@H](O)C[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)NC(C)C |r|
BDBM16259 CC(C)C[C@H](NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)[C@@H](O)C[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)NC(C)C |r|
BDBM16261 CC(C)C[C@H](NC(=O)c1cc(cc(c1)C(=O)N[C@H](CO)c1ccccc1)N(C)S(C)(=O)=O)[C@@H](O)C[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)NC(C)C |r|
BDBM16262 CC(C)C[C@H](NC(=O)c1cc(cc(c1)C(=O)NC(C)c1nc(C)oc1C)N(C)S(C)(=O)=O)[C@@H](O)C[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)NC(C)C |r|
BDBM16509 [H][C@@]1(O[C@]1([H])C(=O)N[C@@H]([C@@H](C)CC)C(=O)N1CCC[C@H]1C(O)=O)C(=O)NCCC |r|
BDBM16751 NC(=N)NC(=O)Cn1c(ccc1-c1ccccc1)-c1ccccc1
BDBM16752 NC(=N)NC(=O)Cn1c(ccc1C12CC3CC(CC(C3)C1)C2)-c1ccccc1 |TLB:19:14:21:18.17.20,19:18:14.15.13:21,THB:17:18:13:16.15.21,17:16:13:18.19.20|
BDBM16753 CC(=O)c1ccc(Oc2ccc(cc2)-c2ccc(-c3ccccc3Cl)n2CC(=O)NC(N)=N)cc1
BDBM16754 OCCCNC(=N)NC(=O)Cn1c(ccc1C12CC3CC(CC(C3)C1)C2)-c1ccccc1 |TLB:23:18:25:22.21.24,23:22:18.19.17:25,THB:21:22:17:20.19.25,21:20:17:22.23.24|
BDBM16755 CCCOc1ccc(cc1)-c1ccc(-c2ccccc2Cl)n1CC(=O)NC(=N)NCCCO
BDBM17786 CN(C1CCCCC1)C(=O)CC[C@@H](C1CCCCC1)N1Cc2cc(Oc3ccccc3)ccc2N=C1N |r,c:38|
BDBM17941 CCCCNC(=O)[C@@H](C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)CS(=O)(=O)C(C)(C)C)C(C)C |r|
BDBM17949 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)C[C@H](Cc1ccc(OC)c(OCCCOC)c1)C(C)C |r|
BDBM17950 COCCCOc1cc(C[C@@H](C[C@H](N)[C@@H](O)C[C@@H](C(C)C)C(=O)NCC(C)(C)C(N)=O)C(C)C)ccc1OC |r|
BDBM19855 CCCN1CCN(CC1)c1ccc(cc1)C(=O)NC1(CCCCC1)C(=O)NCC#N
BDBM23703 [O-][N+](=O)c1cnn(c1)C(=O)c1ccccc1
BDBM23704 O=C(Nc1ccccc1)c1ccn(n1)C(=O)c1ccccc1
BDBM23705 Cc1ccc(cc1)C(=O)n1cc(Br)cn1
BDBM23706 Clc1ccc(cc1Cl)C(=O)n1cccn1
BDBM23707 Cc1cc(nn1C(=O)c1ccccc1F)[N+]([O-])=O
BDBM23708 Fc1cccc(F)c1C(=O)n1cc(Br)cn1
BDBM23709 COc1cc(cc(OC)c1OC)C(=O)n1ccc(C)n1
BDBM23710 Cc1ccc(cc1)C(=O)n1ccc(n1)[N+]([O-])=O
BDBM23711 [O-][N+](=O)c1ccn(n1)C(=O)c1ccccc1
BDBM23712 Cc1ccccc1C(=O)n1cc(cn1)[N+]([O-])=O
BDBM23713 Cc1ccccc1C(=O)n1cc(Cl)cn1
BDBM23714 Cc1cccc(c1)C(=O)n1cc(Br)cn1
BDBM23715 Cc1ccccc1C(=O)n1cc(Br)cn1
BDBM23716 CC(=O)Nc1ccc(cc1)C(=O)n1ccc(C)n1
BDBM23717 Clc1cnn(c1)C(=O)c1ccccc1Cl
BDBM23718 Cc1ccccc1C(=O)n1cccn1
BDBM23719 Fc1cc(Cl)c(cc1F)C(=O)n1cc(Br)cn1
BDBM23720 CC(C)(C)c1ccc(cc1)C(=O)n1cc(Cl)cn1
BDBM23721 Cc1nn(C(=O)c2ccccc2F)c(C)c1Cl
BDBM23722 Cc1nn(C(=O)c2ccc(Cl)cc2)c(C)c1Cl
BDBM23723 COc1ccc(cc1)C(=O)n1nc(C)c(Br)c1C
BDBM23724 Brc1ccccc1C(=O)n1cccn1
BDBM23725 COc1cc(cc(OC)c1OC)C(=O)n1nc(C)c(C)c1C
BDBM23926 Oc1ccc(\C=C\c2cc(O)cc(O)c2)cc1
BDBM23698 Fc1ccc(cc1)C(=O)n1cc(Cl)cn1
BDBM23700 COC(=O)c1ccnn1C(=O)c1ccc(Cl)cc1
BDBM23701 [O-][N+](=O)c1cccc(c1)C(=O)n1cc(Cl)cn1
BDBM23702 Cc1ccc(C(=O)c2ccn(n2)C(=O)c2ccc(F)cc2)c(C)c1
BDBM26768 CCOc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N1CCCC1=O |r|
BDBM26769 CCOc1cc(cc(c1)C1=C(C)CCC1=O)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F |r,c:10|
BDBM26770 CCOc1cc(cc(c1)-c1ccccc1C(C)=O)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F |r|
BDBM26771 CCOc1cc(cc(c1)-c1ccccc1C#N)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F |r|
BDBM26772 CCOc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N1CCCS1(=O)=O |r|
BDBM26773 CCOc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N1CCCCS1(=O)=O |r|
BDBM26774 CCCc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N1CCCCS1(=O)=O |r|
BDBM26775 CC(C)Nc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N1CCCCS1(=O)=O |r|
BDBM26502 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N1CCCCS1(=O)=O |r|
BDBM26503 CCc1cn2CCS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F |r|
BDBM26776 CCOc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC(F)(F)F)c1)N1CCCCS1(=O)=O |r|
BDBM26504 CCc1cn2CCS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1ccccc1 |r|
BDBM26505 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1ccccc1)N1CCCCS1(=O)=O |r|
BDBM26506 CCc1cn2CCS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)CCCC(C)C |r|
BDBM26507 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)CCCC(C)C)N1CCCCS1(=O)=O |r|
BDBM26508 CCc1cn2CCS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCCCC1 |r|
BDBM26509 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCCCC1)N1CCCCS1(=O)=O |r|
BDBM26510 CCc1cn2CCS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CC1 |r|
BDBM26511 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CC1)N1CCCCS1(=O)=O |r|
BDBM26512 CCc1cn2CCS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC |r|
BDBM26513 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC)N1CCCCS1(=O)=O |r|
BDBM26777 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC(F)(F)F)c1)N1CCCCS1(=O)=O |r|
BDBM26778 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@H]1CCc2ccccc12)N1CCCCS1(=O)=O |r|
BDBM26779 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCc2ccc(OC)cc12)N1CCCCS1(=O)=O |r|
BDBM26780 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cnn(CC)c1)N1CCCCS1(=O)=O |r|
BDBM26781 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1)N1CCCCS1(=O)=O |r|
BDBM26782 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNCc1cccc(OC)c1)N1CCCCS1(=O)=O |r|
BDBM26783 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccco1)[C@H](O)CNCc1cccc(OC)c1)N1CCCCS1(=O)=O |r|
BDBM26784 CCNc1cc(cc(c1)C(=O)N[C@@H](Cn1cccn1)[C@H](O)CNCc1cccc(OC)c1)N1CCCCS1(=O)=O |r|
BDBM26785 CCNc1cc(cc(c1)C(=O)N[C@@H](CC(C)C)[C@H](O)CNCc1cccc(OC)c1)N1CCCCS1(=O)=O |r|
BDBM26786 CCNc1cc(N2CCCCS2(=O)=O)c(F)c(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1 |r|
BDBM26787 CCNc1cc(N2CCCCS2(=O)=O)c(F)c(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cnn(CC)c1 |r|
BDBM26788 CCNc1cc(N2CCCCS2(=O)=O)c(F)c(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F |r|
BDBM29766 CCc1cn(C)c2c(cc(cc12)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N1CCCC1=O |r|
BDBM29767 CCc1coc2c(cc(cc12)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N1CCCC1=O |r|
BDBM29744 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)CCC(C)C |r|
BDBM29745 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)CCC(C)C |r|
BDBM29746 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](C)N(C)C(=O)CCC(C)C |r|
BDBM29747 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1C[C@H](C)CCCCCCC(=O)N[C@@H](C)C(=O)N1 |r|
BDBM29748 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1C[C@H](C)CCCCCCCC(=O)N[C@@H](C)C(=O)N1 |r|
BDBM29749 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CCCCCCCCCC(=O)N[C@@H](C)C(=O)N1 |r|
BDBM29750 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1C[C@H](C)CCCCCCCCC(=O)N[C@@H](C)C(=O)N1 |r|
BDBM29751 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1CCCCCCCCCCC(=O)N[C@@H](C)C(=O)N1 |r|
BDBM29752 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1C[C@H](C)CCCCCCCCCC(=O)N[C@@H](C)C(=O)N1 |r|
BDBM29753 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1C[C@H](C)CCCCCCCC(=O)N(C)[C@@H](C)C(=O)N1 |r|
BDBM29754 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1C[C@H](C)CCCCCCCCC(=O)N(C)[C@@H](C)C(=O)N1 |r|
BDBM29756 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N1CCCC1=O |r|
BDBM29757 CCNc1cc(cc(N2CCCC2=O)c1C)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F |r|
BDBM29768 CCc1ccnc2c(cc(cc12)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N1CCCC1=O |r|
BDBM29769 CCn1c2cc(cc(N3CCCC3=O)c2[nH]c1=O)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1 |r|
BDBM29758 CCNc1cc(cc(N2CCCC2=O)c1OC)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F |r|
BDBM29759 CCNc1cc(cc(N2CCCCS2(=O)=O)c1C)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F |r|
BDBM29760 CCNc1cc(cc(N2CCCCS2(=O)=O)c1OC)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F |r|
BDBM29770 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccc(c1)C(F)(F)F)N1CCCCS1(=O)=O |r|
BDBM29761 CCn1cnc2c(cc(cc12)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N1CCCC1=O |r|
BDBM29771 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cncc(c1)C#N)N1CCCCS1(=O)=O |r|
BDBM29772 CCN1CCN2CCS(=O)(=O)N(C)C3C=C(C=C1C23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F |r,c:14,t:16|
BDBM29773 CCNc1cc(cc2N(C)S(=O)(=O)CCCc12)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F |r|
BDBM29774 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCOCC1)N1CCCCS1(=O)=O |r|
BDBM29775 CCc1cn2CCS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCOCC1 |r|
BDBM29776 CCNc1cc(cc2N(C)S(=O)(=O)CCCc12)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCOCC1 |r|
BDBM29777 CCc1cn2CCS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCCC(F)(F)F |r|
BDBM29778 CCNc1cc(cc2N(C)S(=O)(=O)CCCc12)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCCC(F)(F)F |r|
BDBM29779 CCN1CCN2CCS(=O)(=O)N(C)C3C=C(C=C1C23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CC1 |r,c:14,t:16|
BDBM29780 CCNc1cc(cc2N(C)S(=O)(=O)CCCc12)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CC1 |r|
BDBM29762 CCn1ccc2c(cc(cc12)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N1CCCC1=O |r|
BDBM29781 CCc1cn2CS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1 |r|
BDBM29782 CCc1cn2CCS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1 |r|
BDBM29783 CCc1cn2CS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)CCCC(C)C |r|
BDBM29784 CCc1cn2CS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCCCC1 |r|
BDBM29785 CCc1cn2CS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC |r|
BDBM29786 CCc1cn2CCCS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1 |r|
BDBM29787 CCc1cn2CCCS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CC1 |r|
BDBM29788 CCc1cn2CCS(=O)(=O)Nc3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1 |r|
BDBM29789 CCN1c2cc(cc3c(CC)cn(CCS1(=O)=O)c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCOCC1 |r|
BDBM29790 CCc1cn2CCS(=O)(=O)N(C(C)C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCOCC1 |r|
BDBM29791 CCc1cn2CCS(=O)(=O)N(CC(F)(F)F)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCOCC1 |r|
BDBM29792 CCN1c2cc(cc3c(CC)cn(CCS1(=O)=O)c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCCCC1 |r|
BDBM29793 CCN1c2cc(cc3c(CC)cn(CCS1(=O)=O)c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CC1 |r|
BDBM29794 CCn1cc2CCS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCOCC1 |r|
BDBM29796 CCn1cc2CCS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCCC(F)(F)F |r|
BDBM29799 CC[C@@H](C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc2N(C)S(=O)(=O)CCn3cc(CC)c(c1)c23 |r|
BDBM29800 CCn1cc2CCS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCC#C |r|
BDBM29801 CCc1cn2CCS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCC#C |r|
BDBM29802 CCNC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc2N(C)S(=O)(=O)CCc3cn(CC)c(c1)c23 |r|
BDBM29803 CCNC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc2N(C)S(=O)(=O)CCn3cc(CC)c(c1)c23 |r|
BDBM29804 CCn1cc2CCS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CC1 |r|
BDBM29805 CCc1cn2CCS(=O)(=O)Oc3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F |r|
BDBM29806 CCc1cn2CCS(=O)(=O)Oc3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCOCC1 |r|
BDBM29807 CCc1cn2CCS(=O)(=O)Oc3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCC#C |r|
BDBM29763 CCc1c[nH]c2c(cc(cc12)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N1CCCC1=O |r|
BDBM29808 CCc1cn2CCS(=O)(=O)Oc3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CC1 |r|
BDBM29764 CCn1ncc2c(cc(cc12)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N1CCCC1=O |r|
BDBM29765 CCn1nnc2c(cc(cc12)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N1CCCC1=O |r|
BDBM36559 OC(CN(CCc1ccc2OCOc2c1)C(=O)CCN1C(=O)c2ccccc2C1=O)[C@@H](NC(=O)COc1cc(Cl)c(Cl)cc1Cl)c1ccccc1 |r|
BDBM36560 O[C@H](CN(CCc1ccc2OCOc2c1)C(=O)CCN1C(=O)c2ccccc2C1=O)[C@@H](NC(=O)COc1cc(Cl)c(Cl)cc1Cl)c1ccccc1 |r|
BDBM36561 COc1ccc(C(=O)N[C@H](C(O)CN(CCc2ccc3OCOc3c2)C(=O)CCN2C(=O)c3ccccc3C2=O)c2ccccc2)c(Cl)c1OC |r|
BDBM36562 OC(CN(CCc1ccc2OCOc2c1)C(=O)CCN1C(=O)c2ccccc2C1=O)[C@@H](NC(=O)CCn1c2ccccc2oc1=O)c1ccccc1 |r|
BDBM36563 OC(CN(CCc1ccc2OCOc2c1)C(=O)CCc1ccc(Cl)c(Cl)c1)[C@@H](NC(=O)CCn1c2ccccc2oc1=O)c1ccccc1 |r|
BDBM36564 OC(CN(CCc1ccc(Cl)cc1Cl)C(=O)CCN1C(=O)c2ccccc2C1=O)[C@@H](NC(=O)CCn1c2ccccc2oc1=O)c1ccccc1 |r|
BDBM36565 COc1cccc(CCN(CC(O)[C@@H](NC(=O)Cn2c(O)csc2=S)c2ccccc2)C(=O)NC2CCCCC2)c1 |r|
BDBM36566 CCCCCCC(=O)N(CCc1cccc(OC)c1)CC(O)[C@@H](NC(=O)Cn1c(O)csc1=S)c1ccccc1 |r|
BDBM36567 OC(CN(CCc1ccc2OCOc2c1)C(=O)CCN1C(=O)c2ccccc2C1=O)[C@@H](NC(=O)COc1ccc(Cl)c(Cl)c1)c1ccccc1 |r|
BDBM36568 O[C@H](CN(CCc1ccc2OCOc2c1)C(=O)CCN1C(=O)c2ccccc2C1=O)[C@@H](NC(=O)COc1ccc(Cl)c(Cl)c1)c1ccccc1 |r|
BDBM36569 OC(CN(CCc1ccc(Cl)cc1Cl)C(=O)CCN1C(=O)c2ccccc2C1=O)[C@@H](NC(=O)COc1ccc(Cl)c(Cl)c1)c1ccccc1 |r|
BDBM36570 OC(CN(CCc1ccc2OCOc2c1)C(=O)CCN1C(=O)c2ccccc2C1=O)[C@@H](NC(=O)COc1ccc(Cl)cc1Cl)c1ccccc1 |r|
BDBM36571 OC(CN(CCc1ccc2OCOc2c1)C(=O)CCN1C(=O)c2ccccc2C1=O)[C@@H](NC(=O)COc1cccc(Cl)c1)c1ccccc1 |r|
BDBM36572 COc1cc(Br)c(cc1OC)C(=O)N[C@H](C(O)CN(CCc1ccc2OCOc2c1)C(=O)CCN1C(=O)c2ccccc2C1=O)c1ccccc1 |r|
BDBM36573 Cc1ccc(CCN(CC(O)[C@@H](NC(=O)COc2cc(Cl)c(Cl)cc2Cl)c2ccccc2)C(=O)CCN2C(=O)c3ccccc3C2=O)cc1 |r|
BDBM50001676 COc1ccccc1C(=O)NN
BDBM97447 CC(C)CN(C[C@@H]1C[NH2+]CC1CN(Cc1ccccc1)C(=O)COc1c(C)cccc1C)S(=O)(=O)c1ccccc1 |r|
BDBM97448 CC(C)CN(C[C@@H]1C[NH2+]CC1CN(Cc1ccccc1)C(=O)COc1c(C)cccc1C)S(=O)(=O)c1ccc(N)cc1 |r|
BDBM97449 CC(C)CN(C[C@@H]1C[NH2+]CC1CN(Cc1ccccc1)C(=O)COc1c(C)cccc1C)S(=O)(=O)c1ccc(C)cc1 |r|
BDBM97450 COc1cc(Br)c(OC(=O)N(CC2C[NH2+]C[C@H]2CN(CCc2ccc(Cl)cc2Cl)C(=O)CCCc2ccccc2)Cc2ccccc2)cc1OC |r|
BDBM97451 COc1cc(Br)c(OC(=O)N(CC2C[NH2+]C[C@H]2CN(CCc2ccc(Cl)cc2Cl)C(=O)CCN2C(=O)c3ccccc3C2=O)Cc2ccccc2)cc1OC |r|
BDBM98678 CCOC[C@@H](CC(C)C)NC(=O)[C@@H]1CNC[C@@H]([C@@H]1O)C(=O)N(C1CC1)c1ccc(cn1)C(C)C |r|
BDBM327779 NC1=Nc2ccccc2CN1C1Cc2ccccc2C1 |t:1|
BDBM136570 C[C@H]1SC(N)=N[C@]2(CO[C@H](C[C@@H]12)c1cc(C)no1)c1ccc(F)cc1F |c:4|
BDBM136574 Cc1cc(on1)[C@H]1C[C@H]2[C@@H](CF)SC(N)=N[C@]2(CO1)c1ccc(F)cc1F |c:15|
BDBM136576 C[C@H]1SC(N)=N[C@]2(CO[C@H](C[C@@H]12)c1cnn(C)c1)c1ccc(F)cc1F |c:4|
BDBM136583 Cn1cc(cn1)[C@H]1C[C@H]2[C@@H](CF)SC(N)=N[C@]2(CO1)c1ccc(F)cc1F |c:15|
BDBM41536 Cn1cc(cn1)[C@H]1C[C@H]2CSC(N)=N[C@]2(CO1)c1ccc(F)cc1F |c:13|
BDBM50452260 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](NC(=O)CC(C)C)C(C)C
BDBM50405191 CC[C@](C)(N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NC(CC(C)C)C(O)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
BDBM50226132 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C
BDBM50025524 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@@H](Cc1ccccc1)NC(=O)[C@H](NC(=O)CC(C)C)C(C)C
BDBM50022518 CC[C@H](C)[C@H](NC(=O)[C@@H](NC[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(O)=O
BDBM116236 Cc1cc(cnc1C(=O)Nc1ccc(F)c(n1)[C@]1(C)CO[C@](C)(C(N)=N1)C(F)(F)F)C#N |r,c:26|
BDBM116240 Cc1cc(cnc1C(=O)Nc1cc(c(F)cn1)[C@]1(C)CO[C@](C)(C(N)=N1)C(F)(F)F)C#N |r,c:26|
BDBM116247 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1nc(NC(=O)c2ncc(cc2Cl)C#N)ccc1F |r,c:7|
BDBM116249 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1nc(NC(=O)c2ncc(OCC(F)(F)F)nc2N)ccc1F |r,c:7|
BDBM116250 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1nc(NC(=O)c2ncc(cc2N)C#N)ccc1F |r,c:7|
BDBM116253 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1nc(NC(=O)c2ncc(OC(F)F)cc2Cl)ccc1F |r,c:7|
BDBM116254 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1nc(NC(=O)c2ncc(Cl)cc2Cl)ccc1F |r,c:7|
BDBM116257 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1nc(NC(=O)c2ncc(cc2Cl)C(F)(F)F)ccc1F |r,c:7|
BDBM116267 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1nc(NC(=O)c2ncc(nc2N)C(F)(F)F)ccc1F |r,c:7|
BDBM50002967 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CSc1ccccn1
BDBM50002969 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ncc(CO)n1C
BDBM50002979 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1nnnn1C
BDBM50002980 CCCCC(NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ccccn1
BDBM50002981 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)Cn1ccc(=O)cc1
BDBM50002989 CSCC(NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ccccn1
BDBM50002990 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)COc1ccccn1
BDBM50002992 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CSc1nnc[nH]1
BDBM50002983 CC(C)CC(NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ccccn1
BDBM50002971 CC(NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ccccn1
BDBM50002972 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)Cn1ccccc1=O
BDBM50002985 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1nccs1
BDBM50002973 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ccncc1
BDBM50002986 CSCCC(NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ccccn1
BDBM50002987 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ncccn1
BDBM50002974 NC1CCN(CC1)C(=O)O[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ccccn1
BDBM50002975 CCCC(NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ccccn1
BDBM50002976 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)COc1ccncc1
BDBM50002977 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1nnc(C)s1
BDBM50004778 Cc1c(CCC(O)=O)c2cc3nc(cc4[nH]c(cc5[nH]c(cc1n2)c(C)c5C(COC(=O)C1=CC1)OC(=O)C1=CC1)c(C)c4C(COC(=O)C1=CC1)OC(=O)C1=CC1)c(C)c3CCC(O)=O |t:35,42,55,62|
BDBM50005417 CCSC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C
BDBM50005418 CCOC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CC(=O)NCCN1CCOCC1
BDBM50005420 O[C@@H](CC(=O)NCCN1CCOCC1)[C@H](CC1CCCCC1)NC(=O)C(Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50005422 CCCOC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50005423 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)OCC#C
BDBM50005425 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)N(C)CC=C
BDBM50005428 CCOC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C
BDBM50005431 CCCOC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C
BDBM50005433 CCCOC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50005436 O[C@@H](CC(=O)NCCN1CCOCC1)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)SCC=C
BDBM50005437 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)SCC=C
BDBM50005439 CCSC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C
BDBM50005442 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)OCC=C
BDBM50005443 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)OCC(F)(F)F
BDBM50005444 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)Sc1cccs1
BDBM50005445 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50008125 COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(O)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008126 OC([C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008127 CC[C@H](C)CNC(=O)C(F)(F)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCNCC1
BDBM50008128 CNC(=S)NCCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(O)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008129 FC(F)(C(=O)NCCc1ccccn1)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50008130 OC([C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCc1cccnc1)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008131 CN1CCN(CC1)S(=O)(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC=C)C(=O)N[C@@H](CC1CCCCC1)C(=O)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008132 FC(F)(C(=O)NCCN1CCOCC1)C(=O)[C@H](CC1CCCCC1)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50008133 CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008134 CCCO[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008135 CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC=C)C(=O)N[C@@H](CC1CCCCC1)C(O)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008136 FC(F)(C(=O)NCCN1CCOCC1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50008137 CN1CCN(CC1)S(=O)(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC=C)C(=O)N[C@@H](CC1CCCCC1)C(O)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008138 CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(O)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008139 FC(F)(C(=O)NCCN1CCOCC1)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50008140 CC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008141 OC([C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(F)(F)C(=O)NCCc1ccccn1
BDBM50008142 OC([C@H](Cc1ccccc1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008143 FC(F)(C(=O)NCCN1CCOCC1)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@@H](NS(=O)(=O)N1CCOCC1)C(=O)c1ccccc1
BDBM50008144 Nc1nc(C[C@H](NC(=O)[C@H](Cc2ccccc2)NS(=O)(=O)N2CCOCC2)C(=O)N[C@@H](CC2CCCCC2)C(O)C(F)(F)C(=O)NCCN2CCOCC2)cs1
BDBM50008145 FC(F)(C(=O)NCCN1CCOCC1)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1
BDBM50008146 COc1ccc(C[C@H](NS(=O)(=O)N2CCOCC2)C(=O)N[C@@H](CC=C)C(=O)N[C@@H](CC2CCCCC2)C(O)C(F)(F)C(=O)NCCN2CCOCC2)cc1
BDBM50008147 COc1ccc(C[C@H](NS(=O)(=O)N2CCOCC2)C(=O)N[C@@H](CC=C)C(=O)N[C@@H](CC2CCCCC2)C(=O)C(F)(F)C(=O)NCCN2CCOCC2)cc1
BDBM50008148 CCCO[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(O)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008149 CCS[C@H](C)CNC(=O)C(F)(F)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50008150 OC([C@H](CC1CCCCC1)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008151 FC(F)(C(=O)NCCN1CCOCC1)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCc1cccnc1
BDBM50008152 CC[C@H](C)CNC(=O)C(F)(F)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCN(CC1)C(=O)OC(C)(C)C
BDBM50008153 OC([C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008154 OC([C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCNCC1)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008155 OC([C@H](NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC=C)C(=O)N[C@@H](CC1CCCCC1)C(O)C(F)(F)C(=O)NCCN1CCOCC1)c1ccccc1
BDBM50008156 OC([C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008157 CC[C@H](C)CNC(=O)C(F)(F)C(O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCN(CC1)C(=O)OC(C)(C)C
BDBM50008158 CCS[C@H](C)CNC(=O)C(F)(F)C(O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50008160 CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC=C)C(=O)N[C@@H](CC1CCCCC1)C(=O)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008161 CCOC(=O)C(F)(F)C(O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50008162 COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008520 CC(C)(C)S(=O)(=O)CC(Cc1ccccc1)C(=O)NC(Cc1cnc[nH]1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO
BDBM50008120 OC([C@H](CC1CCCCC1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)c1csc(NC(=O)OCc2ccccc2)n1)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50008121 FC(F)(C(=O)NCCN1CCOCC1)C(=O)[C@@H](NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C1CCCCC1
BDBM50008122 CCOC(=O)C(F)(F)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50008123 FC(F)(C(=O)NCCN1CCOCC1)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50008124 OC([C@@H](NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C1CCCCC1)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50006202 COc1ccc(C[C@H](NC(=O)CC(C)(C)N)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](CC2CCCCC2)[C@@H](O)[C@@H](O)CC(C)C)cc1
BDBM50006843 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)c1csc(N)n1
BDBM50006844 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1csc(N)n1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50006845 COc1ccc(C[C@H](NS(=O)(=O)N2CCOCC2)C(=O)N[C@@H](Cc2csc(N)n2)C(=O)N[C@@H](CC2CCCCC2)[C@@H](O)[C@@H](O)CC(C)C)cc1
BDBM50006846 CCOC(=O)C(F)(F)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1csc(N)n1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50006847 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@@H](Cc1csc(N)n1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50006848 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1csc(N)n1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCNCC1
BDBM50006849 Nc1nc(C[C@H](NC(=O)[C@H](Cc2ccccc2)NS(=O)(=O)N2CCOCC2)C(=O)N[C@@H](CC2CCCCC2)[C@@H](O)C(F)(F)C(=O)NCCN2CCOCC2)cs1
BDBM50006850 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cscn1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50006851 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50006852 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCc1csc(N)n1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50006853 COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C
BDBM50006856 Nc1nc(C[C@H](NC(=O)[C@H](Cc2ccccc2)NS(=O)(=O)N2CCOCC2)C(=O)N[C@@H](CC2CCCCC2)C(=O)C(F)(F)C(=O)NCCN2CCOCC2)cs1
BDBM50006857 Nc1nc(C[C@H](NC(=O)[C@H](Cc2ccccc2)NS(=O)(=O)N2CCOCC2)C(=O)N[C@@H](CC2CCCCC2)[C@@H](O)CC(=O)NCCN(CCO)CCO)cs1
BDBM50006858 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50006859 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1csc(N)n1)NC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)N1CCOCC1
BDBM50006860 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1csc(N)n1)NC(=O)[C@H](Cc1ccccc1)NP(=O)(OC(C)C)OC(C)C
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BDBM50012252 CC(C)C[C@@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)OCC=C
BDBM50012253 CCCCCCOC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@H](O)CC(C)C
BDBM50012254 CC(C)C[C@@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(O)=O
BDBM50012255 COC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CC(=O)NCCN1CCOCC1
BDBM50012256 COC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)NCCN1CCOCC1
BDBM50012257 COC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)C(F)(F)C(=O)NCCN1CCOCC1
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BDBM50022862 CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)OC
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BDBM50023058 CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCS(=O)(=O)C(C)C
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BDBM50023070 CCS(=O)(=O)CC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C
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BDBM50025542 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C
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BDBM50025508 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](C)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C
BDBM50025515 COC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C |r|
BDBM50025526 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C |r|
BDBM50025509 COC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C |r|
BDBM50025517 CCOC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C |r|
BDBM50025525 CCC(C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)N[C@@H](C)C(=O)NCCC(C)C
BDBM50025532 CCC(CC)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)N[C@@H](C)C(=O)NCCC(C)C
BDBM50025534 [H][C@](O)(CC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)OC)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C
BDBM50025521 [H][C@](O)(CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OC)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C
BDBM50025518 CC(C)CCNC(=O)[C@H](C)NC(=O)CC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C
BDBM50025516 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C
BDBM50025530 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C
BDBM50025527 [H][C@](O)(CC(=O)N[C@@H](C)C(=O)OC)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C
BDBM50025506 [H][C@](O)(CC(=O)N[C@@H](C)C(=O)NCCC(C)C)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C(C)(C)C)C(C)C
BDBM50025539 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](C)[C@@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(C)C
BDBM50040380 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](C)OP(O)(=O)CCCc1ccccc1
BDBM50040382 CCCCNC(=O)[C@@H](C)C[C@@H](O)[C@@H](CC1CCCCC1)NC(=O)[C@H](CCCC)OP(O)(=O)CCCc1ccccc1
BDBM50040383 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCC)OP(O)(=O)CCCc1ccccc1
BDBM50040384 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCC)OP(O)(=O)CCCc1ccccc1
BDBM50040385 CCC[C@@H](OP(=O)(CCCc1ccccc1)OCC)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C
BDBM50040386 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCC)OP(=O)(CCCc1ccccc1)OCC
BDBM50040387 CCCC[C@H](OP(O)(=O)CCCc1ccccc1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ccccn1
BDBM50040388 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@@H](CCC)OP(O)(=O)CCCc1ccccc1
BDBM50040389 CCCC[C@H](OP(O)(=O)CCCc1ccccc1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)C(=O)OC(C)C
BDBM50040390 CCCCNC(=O)[C@@H](C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCCC)OP(O)(=O)CCCc1ccccc1)C(C)C
BDBM50040391 CCCCNC(=O)[C@@H](C)C[C@@H](O)[C@@H](CC1CCCCC1)NC(=O)[C@H](CCCC)OP(O)(=O)CCCCc1ccccc1
BDBM50040392 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@@H](CCCC)OP(=O)(CCCc1ccccc1)OCC
BDBM50040393 CCC[C@@H](OP(=O)(CCCc1ccccc1)OCC)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)C1CC1
BDBM50040394 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCC)OP(=O)(CCCc1ccccc1)OC(=O)c1ccccc1
BDBM50040395 CCCC[C@H](OP(O)(=O)CCCc1ccccc1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)C(O)CC(C)C
BDBM50040396 CCCCNC(=O)[C@@H](C)C[C@@H](O)[C@@H](CC1CCCCC1)NC(=O)[C@H](CCCC)OP(O)(=O)CCc1ccccc1
BDBM50040398 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@@H](C)OP(O)(=O)CCCc1ccccc1
BDBM50046833 CCC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C(C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NCCC(O)=O
BDBM50046841 CCC(C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)N1CCOCC1)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C
BDBM50046842 CCOC(=O)CCNC(=O)CC(O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)CC)C(C)CC
BDBM50046855 CCC(C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)CC(O)=O
BDBM50046856 CCC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C(C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NCCCCCO
BDBM50046857 CCC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C(C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NCCCCO
BDBM50046861 CCC(C)[C@H](NC(=O)[C@@H](N)CC1CCCCC1)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C
BDBM50046813 CCC(C)C(NC(=O)C(NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)NC(CC(C)C)C(O)CC(O)=O
BDBM50046820 CCC(C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)N1CCN(C)CC1)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C
BDBM50046821 CCC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C(C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(O)=O
BDBM50046825 CCOC(=O)CC(O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OC(C)(C)C)C(C)CC
BDBM50046826 CCOC(=O)CC(O)C(CC(C)C)NC(=O)C(NC(=O)C(NC(=O)OC(C)(C)C)C(C)(C)C)C(C)CC
BDBM50046828 CCC(C)[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)C(O)CC(O)=O
BDBM50045280 CC[C@@H](O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1csc(N)c1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50045281 CC(C)[C@@H](O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50045282 CC[C@@H](O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50045283 CC[C@H](O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50045284 CC[C@H](C)CNC(=O)C(F)(F)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50045285 O[C@@H](C[C@H](O)C1SCCCS1)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50045287 CC[C@H](O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)SCC=C
BDBM50045288 CC[C@@H](O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC(=O)OC)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50045289 CC[C@H](O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCCNC(=S)NC)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50045683 NC1CCN(CC1)C(=O)C[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CCc1ccccn1
BDBM50045290 CC[C@H](C)CNC(=O)C(F)(F)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50045291 O[C@H]([C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50045292 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50045293 CC[C@@H](O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50063698 [#7]\[#6](-[#7])=[#7]/c1ccc(cc1)-[#6](=O)-[#8]-c1ccc2cc(ccc2c1)-[#6](-[#7])=[#7]
BDBM50073850 CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC(Cc1ccccc1)C=O |r|
BDBM50071546 CCCCNC(=O)CC(O)C(CC(C)C)NC(=O)[C@@H](NC(=O)COc1ccc2ccccc2c1)c1ccccc1
BDBM50071547 CCCCNC(=O)CC(O)C(Cc1ccccc1)NC(=O)[C@H](NC(=O)COc1ccc2ccccc2c1)c1ccccc1
BDBM50071549 CCCCNC(=O)CC(O)C(Cc1ccccc1)NC(=O)[C@@H](NC(=O)c1ccc(OC)cc1OC)c1ccccc1
BDBM50071550 CCCCNC(=O)CC(O)C(Cc1ccccc1)NC(=O)[C@@H](NC(=O)c1ccc(OC)cc1OC)[C@@H](C)CC
BDBM50071551 CCCCNC(=O)CC(O)C(Cc1ccccc1)NC(=O)[C@@H](NC(=O)c1ccc(OC)cc1OC)C(C)C
BDBM50071552 CCCCNC(=O)CC(O)C(Cc1ccccc1)NC(=O)[C@@H](NC(=O)CN1CCC(CC1)(C(N)=O)c1ccccc1)[C@@H](C)CC
BDBM50071553 CC[C@H](C)[C@H](NC(=O)CN1CCC(CC1)(C(N)=O)c1ccccc1)C(=O)NC(Cc1ccccc1)C(O)CC(=O)NCCCc1ccccc1
BDBM50071554 CCCCNC(=O)CC(O)C(Cc1ccccc1)NC(=O)[C@@H](NC(=O)Cc1ccc2ccccc2c1)[C@@H](C)CC
BDBM50071555 CCCCNC(=O)CC(O)C(CC(C)C)NC(O)[C@@H](NC(=O)COc1ccc2ccccc2c1)[C@@H](C)CC
BDBM50071556 CCCCNC(=O)CC(O)C(Cc1ccccc1)NC(=O)[C@@H](NC(=O)c1ccc(CN2CCCC2)cc1)[C@@H](C)CC
BDBM50071557 CCCCNC(=O)CC(O)C(CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)COc1ccc2ccccc2c1
BDBM50071558 CCCCNC(=O)CC(O)C(CC(C)C)NC(=O)[C@@H](NC(=O)Cc1ccc2ccccc2c1)[C@@H](C)CC
BDBM50071559 CCCCNC(=O)CC(O)C(Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)COc1ccc2ccccc2c1
BDBM50071560 CCCCNC(=O)CC(O)C(CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc2ccccc2c1
BDBM50071561 CCCCNC(=O)CC(O)C(Cc1ccccc1)NC(=O)[C@@H](NC(=O)COc1ccc2ccccc2c1)[C@@H](C)CC
BDBM50071562 CCCCNC(=O)CC(O)C(Cc1ccccc1)NC(=O)[C@@H](NC(=O)COc1ccc2ccccc2c1)c1ccccc1
BDBM50072542 CCCCNC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)C1CN(CCOCCc2ccccc2)CCN1C(=O)CCc1cc(OC)c(OC)c(OC)c1
BDBM50072544 CCCCNC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)CC1CN(Cc2cc(OC)c(OC)c(OC)c2)CCN1C(=O)c1ccc(OC(C)C)cc1
BDBM50072545 CCCCNC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)C1CN(CCN1C(=O)CCc1cc(OC)c(OC)c(OC)c1)C(=O)CCCCC(=O)OCC
BDBM50076291 CN1CCC(CC1)C(=O)N(CCc1ccc2OCOc2c1)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)COc1cccc(Cl)c1
BDBM50076292 COc1ccc(CCN(C[C@H](O)[C@H](Cc2ccccc2)NC(=O)COc2cccc(Cl)c2)C(=O)C2CCN(C)CC2)cc1
BDBM50076293 COc1cc(cc(OC)c1OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(CCc1ccc2OCOc2c1)C(=O)C1CCN(CC1)C(C)=O
BDBM50076294 CC(=O)N1CCC(CC1)C(=O)N(CCc1ccc2OCOc2c1)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)COc1cccc(Cl)c1
BDBM50076285 CC(=O)N1CCC(CC1)C(=O)N(CCc1ccc2OCOc2c1)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)CNc1cccc(Cl)c1
BDBM50076286 O[C@@H](CN(CCc1ccc2OCOc2c1)C(=O)CCN1C(=O)c2ccccc2C1=O)[C@H](Cc1ccccc1)NC(=O)COc1cccc(Cl)c1
BDBM50076287 COc1ccc(CCN(C[C@H](O)[C@H](Cc2ccccc2)NC(=O)c2cc(OC)c(OCc3ccccc3)c(OC)c2)C(=O)C2CCN(C)CC2)cc1
BDBM50076288 COc1ccc(CCN(C[C@H](O)[C@H](Cc2ccccc2)NC(=O)c2cc(OC)c(OCc3ccccc3)c(OC)c2)C(=O)C2CCNCC2)cc1
BDBM50080991 CCCc1c(O)c(ccc1OCc1ccc(C=C2SC(S)=NC2=O)cc1)C(=O)c1ccccc1 |w:16.16,c:21|
BDBM50080992 CCOc1ccc2nc(Sc3ccc(NC(=O)c4cccc(Cl)c4O)cc3)sc2c1
BDBM50080951 Cc1cc(Sc2nc3ccccc3s2)ccc1NC(=O)c1cc(Cl)cc(Cl)c1O
BDBM50080952 COc1cc(NC(=O)c2cc(Cl)cc(Cl)c2O)ccc1Sc1nc2ccccc2s1
BDBM50080953 CCOc1ccc2nc(Sc3ccc(NC(=O)c4cc(C)cc(C)c4O)cc3)sc2c1
BDBM50080954 COc1ccc2sc(Sc3ccc(NC(=O)c4cc(Cl)cc(Cl)c4O)cc3)nc2c1
BDBM50080955 Oc1c(Cl)cc(Cl)cc1C(=O)Nc1ccc(Sc2nc3ccc(Cl)cc3s2)cc1
BDBM50080956 CCOc1ccc2nc(Sc3ccc(NC(=O)c4cc(Cl)ccc4NC(=O)c4ccccc4C(O)=O)cc3)sc2c1
BDBM50080957 Oc1c(Cl)cc(Cl)cc1C(=O)Nc1ccc(Sc2nc3ccccc3s2)cc1C#N
BDBM50080958 Oc1c(Cl)cc(Cl)cc1C(=O)Nc1ccc(Sc2ccc3ccccc3n2)cc1
BDBM50080959 COc1ccc2nc(Sc3ccc(NC(=O)c4cc(Cl)cc(Cl)c4O)cc3)sc2c1
BDBM50080960 COc1cc(Br)c(cc1OC)C(=O)N[C@@H](Cc1cccc(Oc2ccccc2)c1)[C@@H](O)CN(CCc1ccc(Cl)cc1Cl)C(=O)CCN1C(=O)c2ccccc2C1=O
BDBM50080961 CCOc1ccc2nc(Sc3ccc(NC(=O)c4cc(Cl)ccc4NS(=O)(=O)c4ccccc4C(O)=O)cc3)sc2c1
BDBM50080962 CCOc1ccc2nc(Sc3ccc(NC(=O)c4cc(Cl)ccc4O)cc3)sc2c1
BDBM50080963 CCOc1ccc2nc(Sc3ccc(NC(=O)c4cc(Cl)ccc4NC(=O)c4ccccc4S(O)(=O)=O)cc3)sc2c1
BDBM50080964 CCOc1ccc2nc(Sc3ccc(NC(=O)c4cc(Cl)ccc4NC(=O)c4ccccc4CC(O)=O)cc3)sc2c1
BDBM50080965 CCOc1ccc2nc(Sc3ccc(NC(=O)c4cc(Cl)cc(Cl)c4CS(=O)(=O)c4cc(Cl)cc(Cl)c4O)cc3)sc2c1
BDBM50080966 Oc1c(Cl)cc(Cl)cc1C(=O)Nc1ccc(Oc2nc3ccccc3s2)cc1
BDBM50080967 Oc1c(Cl)cc(Cl)cc1C(=O)Nc1ccc(Sc2nc3ccccc3s2)cc1
BDBM50080968 Cc1cc(NC(=O)c2cc(Cl)cc(Cl)c2O)ccc1Sc1nc2ccccc2s1
BDBM50080969 Oc1c(Cl)cc(Cl)cc1C(=O)Nc1ccc(Sc2nc3ccccc3s2)c(c1)C(F)(F)F
BDBM50080970 CCOc1ccc2nc(Sc3ccc(NC(=O)c4cc(Cl)cc(Cl)c4NC(=O)c4cc(Cl)cc(Cl)c4)cc3)sc2c1
BDBM50080971 Oc1c(Cl)cc(Cl)cc1C(=O)Nc1ccc(Sc2nc3ccccc3o2)cc1
BDBM50080972 CCOc1ccc2nc(Sc3ccc(NC(=O)c4cc(Cl)ccc4OS(=O)(=O)c4cc(Cl)cc(Cl)c4O)cc3)sc2c1
BDBM50080973 CCOc1ccc2nc(Sc3ccc(NC(=O)c4cc(Cl)cc(Cl)c4NS(=O)(=O)c4cc(Cl)cc(Cl)c4O)cc3)sc2c1
BDBM50080974 Oc1c(Cl)cc(Cl)cc1C(=O)Nc1ccc(Sc2nc3ccccc3s2)c(Cl)c1
BDBM50080975 CCOc1ccc2nc(Sc3ccc(NC(=O)c4cc(Cl)cc(Cl)c4OC)cc3)sc2c1
BDBM50080976 Oc1c(Cl)cc(Cl)cc1C(=O)Nc1ccc(Oc2nc3ccccc3o2)cc1
BDBM50080977 Oc1c(Cl)cc(Cl)cc1C(=O)Nc1ccc(Sc2nc3ccccc3s2)nc1
BDBM50080978 CCOc1ccc2nc(Sc3ccc(NC(=O)c4cc(Cl)cc(Cl)c4N)cc3)sc2c1
BDBM50080979 Oc1c(Cl)cc(Cl)cc1C(=O)Nc1cc(Cl)c(Sc2nc3ccccc3s2)c(Cl)c1
BDBM50080980 CCOc1ccc2nc(Sc3ccc(NS(=O)(=O)c4cc(Cl)cc(Cl)c4OS(=O)(=O)c4cc(Cl)cc(Cl)c4O)cc3)sc2c1
BDBM50080981 CCOc1ccc2nc(Sc3ccc(NC(=O)c4cc(Cl)cc(Cl)c4OS(=O)(=O)c4cc(Cl)cc(Cl)c4O)cc3)sc2c1
BDBM50080982 Oc1c(Cl)cc(Cl)cc1C(=O)Nc1ccc(Sc2nc3ccccc3s2)c(c1)C#N
BDBM50080983 CCOc1ccc2nc(Sc3ccc(NC(=O)c4ccccc4O)cc3)sc2c1
BDBM50080984 CCOc1ccc2nc(Sc3ccc(NS(=O)(=O)c4cc(Cl)cc(Cl)c4O)cc3)sc2c1
BDBM50080985 CCOc1ccc2sc(Sc3ccc(NC(=O)c4cc(Cl)cc(Cl)c4O)cc3)nc2c1
BDBM50080986 Oc1c(Cl)cc(Cl)cc1C(=O)Nc1ccc(Sc2nc3ccc(OC(F)(F)F)cc3s2)cc1
BDBM50080987 CCOc1ccc2nc(Sc3ccc(NC(=O)c4ccc(cc4O)C(F)(F)F)cc3)sc2c1
BDBM50080988 CCOc1ccc2nc(Sc3ccc(NC(=O)c4cccc(C)c4O)cc3)sc2c1
BDBM50080989 CCOc1ccc2nc(Sc3ccc(NC(=O)c4cc(Cl)ccc4NS(=O)(=O)c4cccc(c4)C(O)=O)cc3)sc2c1
BDBM50080990 CCOc1ccc2nc(Sc3ccc(NC(=O)c4cc(Cl)cc(Cl)c4NC(=O)c4cc(Cl)cc(Cl)c4O)cc3)sc2c1
BDBM50084636 CCCc1c(O)c(ccc1COc1ccc(C=C2SC(S)=NC2=O)cc1)C(=O)c1ccccc1 |w:16.16,c:21|
BDBM50084640 CCCC[C@H](N1CCN([C@H](Cc2ccccc2)C1=O)C(=O)N1CCN(C)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)C[C@@H](C(C)C)C(=O)NCCN(C)C
BDBM50084651 CNC1CCN(CC1)C(=O)C[C@@H](Cc1ccccc1)C(=O)N[C@@H](CSC)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)C(=O)OC(C)C
BDBM50084670 COc1cc(Br)c(OCC(=O)NC(Cc2cccc(Oc3ccccc3)c2)[C@@H](O)CN(CCc2ccc(Cl)cc2Cl)C(=O)CCN2C(=O)c3ccccc3C2=O)cc1OC
BDBM50084618 CCCC[C@H](N1CCN([C@H](Cc2ccccc2)C1=O)C(=O)N1CCN(C)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)C[C@@H](C(C)C)C(=O)NCCC
BDBM50084619 CCCCNC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)COc1ccc2ccccc2c1)c1ccccc1
BDBM50084626 O[C@@H](CN(CCc1ccc2OCOc2c1)C(=O)CCN1C(=O)c2ccccc2C1=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(Cl)cc1Cl
BDBM50084627 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@@H](CC(=O)N(CC1CCCCC1)CC(=O)N(C)CCc1ccccn1)Cc1csc(N)n1
BDBM228415 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Nc2nccc3cc(Cl)cnc23)cc(F)c1F |r,c:4|
BDBM47353 CN1C(=N)N[C@@](C)(CS1(=O)=O)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |r|
BDBM50110931 O[C@@H](CN(CCc1ccc(Cl)cc1Cl)C(=O)CCN1C(=O)c2ccccc2C1=O)[C@H](Cc1ccccc1)NC(=O)CCn1c2ccccc2oc1=O
BDBM50110932 O[C@@H](CN(CCc1ccc2OCOc2c1)C(=O)CCN1C(=O)c2ccccc2C1=O)[C@H](Cc1ccccc1)NC(=O)COc1c(Cl)cc(Cl)cc1Cl
BDBM50110933 O[C@H](CN(CCc1ccc2OCOc2c1)C(=O)CCN1C(=O)c2ccccc2C1=O)[C@H](Cc1ccccc1)NC(=O)COc1cc(Cl)c(Cl)cc1Cl
BDBM50110934 COc1cc(Br)c(cc1OC)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(CCc1ccc(Cl)cc1Cl)C(=O)CCN1C(=O)c2ccccc2C1=O
BDBM50110935 O[C@@H](CN(CCc1ccccn1)C(=O)COc1c(Cl)cc(Cl)cc1Cl)[C@H](Cc1ccccc1)NC(=O)\C=C\c1c(Cl)cccc1Cl
BDBM50139109 CC(C)CNC(=O)[C@H](CCOC(C)=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)CC(C)C)C(O)=O
BDBM50139110 CCC[C@H](C[C@H](O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)CC(C)C)C(O)=O)C(=O)NCC(C)C
BDBM50139111 CC(C)CNC(=O)[C@H](CCC(O)=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)CC(C)C)C(O)=O
BDBM50139112 CC(C)CNC(=O)[C@H](CCO)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)CC(C)C)C(O)=O
BDBM50148573 O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1
BDBM50146763 CCCCNC(=O)CC(O)C(CC(C)C)NC(=O)C(NC(=O)CN1CCC(CC1)(C(N)=O)c1ccccc1)C(C)CC
BDBM50146764 CCCCNC(=O)CC(O)C(Cc1ccccc1)NC(=O)C(NC(=O)COc1ccc2ccccc2c1)c1ccccc1
BDBM50146765 CCCCNC(=O)CC(O)C(Cc1ccccc1)NC(=O)C(NC(=O)Cc1ccc2ccccc2c1)C(C)CC
BDBM50146766 CCCCNC(=O)CC(O)C(CC(C)C)NC(=O)C(CCC(N)=O)NC(=O)COc1ccc2ccccc2c1
BDBM50146767 CCCCNC(=O)CC(O)C(Cc1ccccc1)NC(=O)C(CC(C)C)NC(=O)COc1ccc2ccccc2c1
BDBM50146768 CCCCNC(=O)CC(O)C(Cc1ccccc1)NC(=O)C(NC(=O)CO\C=C\C1C=CC=CC1C=C)C(C)CC |c:31,33|
BDBM50146770 CCC(C)C(NC(=O)c1ccc(CNC)cc1)C(=O)NC(CC(C)C)C(O)CC(=O)NCCCc1ccccc1
BDBM50146771 CCCCNC(=O)CC(O)C(CC(C)C)NC(=O)C(NC(=O)CO\C=C\C1C=CC=CC1C=C)C(C)CC |c:27,29|
BDBM50146773 CCC(C)C(NC(=O)CN1CCC(CC1)(C(N)=O)c1ccccc1)C(=O)NC(CC(C)C)C(O)CC(=O)NCCCc1ccccc1
BDBM50146775 CCCCNC(=O)CC(O)C(CC(C)C)NC(=O)C(NC(=O)Cc1cc(OC)ccc1C)C(C)CC
BDBM50146776 CCCCNC(=O)CC(O)C(CC(C)C)NC(=O)C(NC(=O)Cc1cc(OC)ccc1C)C(C)C
BDBM50146778 CCCCNC(=O)CC(O)C(CC(C)C)NC(=O)C(NC(=O)Cc1cc(OC)ccc1C)c1ccccc1
BDBM50146779 CCCCNC(=O)CC(O)C(CC(C)C)NC(=O)C(NC(=O)CO\C=C\c1ccccc1C=C)c1ccccc1
BDBM50146783 CCCCNC(=O)CC(O)C(CC(C)C)NC(=O)C(NC(=O)Cc1ccc2ccccc2c1)C(C)CC
BDBM50146793 CCCCNC(=O)CC(O)C(Cc1ccccc1)NC(=O)C(Cc1ccccc1)NC(=O)COc1ccc2ccccc2c1
BDBM50148911 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O |r,c:9|
BDBM209915 C[C@]1(CS(=O)(=O)CC(N)=N1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,c:8|
BDBM209917 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1F |r,c:4|
BDBM209918 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:30|
BDBM50169098 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](COCc1ccc(cc1)-c1ccccc1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C)C(N)=O
BDBM50169099 O[C@@H](CC(=O)NC1CCCCC1)[C@H](COCc1ccc(cc1)-c1ccccc1)NC(=O)c1c(F)cc(F)cc1F
BDBM50169100 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](COCc1ccc(cc1)-c1ccsc1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C)C(N)=O
BDBM50169101 O[C@@H](CC(=O)NC1CCCCC1)[C@H](COCc1ccc(cc1)-c1ccsc1)NC(=O)c1c(F)cc(F)cc1F
BDBM50169102 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](COCc1ccc(cc1)-c1ccc2OCOc2c1)NC(=O)c1c(F)cc(F)cc1F)C(N)=O
BDBM50169103 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](COCc1ccc(cc1)-c1ccc2OCOc2c1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C)C(N)=O
BDBM50169104 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](COCc1cccc(c1)-c1ccsc1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C)C(N)=O
BDBM50169105 CCCCNC(=O)C[C@H](O)[C@H](COCc1ccc(cc1)-c1ccsc1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C
BDBM50169106 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](COCc1cccc(c1)-c1ccccc1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C)C(N)=O
BDBM50169107 COc1cccc(CCNC(=O)C[C@H](O)[C@H](COCc2ccc(cc2)-c2ccccc2)NC(=O)c2c(F)cc(F)cc2F)c1
BDBM50169108 COc1cccc(CCNC(=O)C[C@H](O)[C@H](COCc2ccc(cc2)-c2ccsc2)NC(=O)c2c(F)cc(F)cc2F)c1
BDBM50169109 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](COCc1cccc(Br)c1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C)C(N)=O
BDBM50169110 CCCCNC(=O)C[C@H](O)[C@H](COCc1ccc(cc1)-c1ccccc1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C
BDBM50169111 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](COCc1ccc(cc1)-c1ccccc1)NC(=O)c1c(F)cc(F)cc1F)C(N)=O
BDBM50169112 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](COCc1ccc(cc1)-c1ccsc1)NC(=O)c1c(F)cc(F)cc1F)C(N)=O
BDBM50169113 CCCCNC(=O)C[C@H](O)[C@H](COCc1ccc(cc1)-c1ccc2OCOc2c1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C
BDBM50173740 O[C@H]([C@@H](O)[C@@H](OC\C=C\Br)c1nnc(CCCc2ccccc2)o1)[C@@H](OC\C=C\Br)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12
BDBM50173741 O[C@H]([C@@H](O)[C@@H](OC\C=C\Br)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@@H](OC\C=C\Br)C(=O)NNC(=O)Cc1ccccc1
BDBM50173742 CN1CCN(CCC(=O)NNC(=O)[C@H](OC\C=C\Br)[C@H](O)[C@@H](O)[C@@H](OC\C=C\Br)C(=O)N[C@@H]2[C@H](O)Cc3ccccc23)CC1
BDBM50173743 O[C@H]([C@@H](O)[C@@H](OC\C=C\Br)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@@H](OC\C=C\Br)C(=O)NNC(=O)CCc1c[nH]c2ccccc12
BDBM50173744 O[C@H]([C@@H](O)[C@@H](OC\C=C\Br)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@@H](OC\C=C\Br)C(=O)NNC(=O)c1ccccc1
BDBM50173745 O[C@H]([C@@H](O)[C@@H](OC\C=C\Br)c1nnc(o1)-c1ccccc1)[C@@H](OC\C=C\Br)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12
BDBM50173746 Cc1nnc([nH]1)[C@H](OC\C=C\Br)[C@H](O)[C@@H](O)[C@@H](OC\C=C\Br)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12
BDBM50173747 CC(C)(C)c1ccc(cc1)-c1nnc(o1)[C@H](OC\C=C\Br)[C@H](O)[C@@H](O)[C@@H](OC\C=C\Br)c1nnc(o1)-c1ccc(cc1)C(C)(C)C
BDBM50173748 CC(C)(C)c1ccc(cc1)-c1nnc(o1)[C@H](OC\C=C\Br)[C@H](O)[C@@H](O)[C@@H](OC\C=C\Br)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12
BDBM50173749 O[C@H]([C@@H](O)[C@@H](OC\C=C\Br)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@@H](OC\C=C\Br)C(=O)NNC(=O)CCCc1ccccc1
BDBM50173750 O[C@H]([C@@H](O)[C@@H](OC\C=C\Br)c1nnc(CCc2ccccc2)o1)[C@@H](OC\C=C\Br)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12
BDBM50173751 Cc1nnc(o1)[C@H](OC\C=C\Br)[C@H](O)[C@@H](O)[C@@H](OC\C=C\Br)c1nnc(C)o1
BDBM50173729 CC(=O)NNC(=O)[C@H](OC\C=C\Br)[C@H](O)[C@@H](O)[C@@H](OC\C=C\Br)C(=O)NNC(C)=O
BDBM50173730 O[C@H]([C@@H](O)[C@@H](OCC=C)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@@H](OCC=C)C(=O)NNC(=O)CCc1ccccc1
BDBM50173731 Cc1nnc(o1)[C@H](OC\C=C\Br)[C@H](O)[C@@H](O)[C@@H](OC\C=C\Br)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12
BDBM50173732 CC(=O)NNC(=O)[C@H](OC\C=C\Br)[C@H](O)[C@@H](O)[C@@H](OC\C=C\Br)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12
BDBM50173733 CC(C)(C)c1ccc(cc1)C(=O)NNC(=O)[C@H](OC\C=C\Br)[C@H](O)[C@@H](O)[C@@H](OC\C=C\Br)C(=O)NNC(=O)c1ccc(cc1)C(C)(C)C
BDBM50173734 O[C@H]([C@@H](O)[C@@H](OC\C=C\Br)c1nnc(Cc2ccccc2)o1)[C@@H](OC\C=C\Br)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12
BDBM50173735 CC(C)(C)c1ccc(cc1)C(=O)NNC(=O)[C@H](OC\C=C\Br)[C@H](O)[C@@H](O)[C@@H](OC\C=C\Br)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12
BDBM50173736 O[C@H]([C@@H](O)[C@@H](OC\C=C\Br)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@@H](OC\C=C\Br)C(=O)NNC(=O)CCc1ccccc1
BDBM50173737 O[C@H]([C@@H](O)[C@@H](OC\C=C\c1ccc2OCOc2c1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@@H](OC\C=C\c1ccc2OCOc2c1)C(=O)NNC(=O)CCc1ccccc1
BDBM50173738 CC(=O)c1ccc(\C=C\CO[C@H]([C@H](O)[C@@H](O)[C@@H](OC\C=C\c2ccc(cc2)C(C)=O)C(=O)N[C@@H]2[C@H](O)Cc3ccccc23)C(=O)NNC(=O)CCc2ccccc2)cc1
BDBM50173739 O[C@H]([C@@H](O)[C@@H](OC\C=C\Br)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@@H](OC\C=C\Br)C(=O)NNC(=O)CCN1CCOCC1
BDBM50189976 COc1ccc(NC(=O)\C=C\COc2ccc3ccccc3c2C(=O)c2cc(OC)c(OC)c(OC)c2)cc1
BDBM50189977 COc1cc(cc(OC)c1OC)C(=O)c1c(OC\C=C\C(O)=O)ccc2ccccc12
BDBM50189978 COc1ccc(NC(=O)COc2ccc3ccccc3c2C(=O)c2cc(OC)c(OC)c(OC)c2)cc1
BDBM50189979 COc1cc(cc(OC)c1OC)C(=O)c1c(OC\C=C\C(=O)Nc2ccccc2)ccc2ccccc12
BDBM50189980 CCCCCCCCNC(=O)COc1ccc2ccccc2c1C(=O)c1cc(OC)c(OC)c(OC)c1
BDBM50189981 COc1cc(cc(OC)c1OC)C(=O)c1c(OCC(O)=O)ccc2ccccc12
BDBM50189982 CCOC(=O)COc1ccc2ccccc2c1C(=O)c1cc(OC)c(OC)c(OC)c1
BDBM50189983 CCCCNC(=O)\C=C\COc1ccc2ccccc2c1C(=O)c1cc(OC)c(OC)c(OC)c1
BDBM50189984 COc1cc(cc(OC)c1OC)C(=O)c1c(OCC(=O)Nc2ccccc2)ccc2ccccc12
BDBM50189985 COc1cc(NC(=O)\C=C\COc2ccc3ccccc3c2C(=O)c2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC
BDBM50196574 CCCCN(CCCC)S(=O)(=O)CCC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1
BDBM50196575 COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)CCCS(=O)(=O)c2ccccc2)c1
BDBM50196576 CCCN(CCC)S(=O)(=O)CCC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1
BDBM50196577 COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)CCCS(=O)(=O)N2CCCCC2)c1
BDBM50196579 COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)CCS(C)(=O)=O)c1
BDBM50196580 COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)CCS(=O)(=O)NCCC(C)C)c1
BDBM50196581 CCCN(CCC)S(=O)(=O)CCCC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1
BDBM50196583 CCCC(C)S(=O)(=O)CCC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1 |w:3.3|
BDBM50196584 COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)CCS(=O)(=O)N2CCCCC2)c1
BDBM50196585 COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)CCCS(=O)(=O)CCC(C)C)c1
BDBM50196586 CCCC(CCC)S(=O)(=O)CCC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1
BDBM50196587 CCCC(CCC)S(=O)(=O)CC(NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1
BDBM50196588 COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)CCCCS(=O)(=O)c2ccccc2)c1
BDBM50196589 COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)CCS(=O)(=O)c2ccccc2)c1
BDBM50196590 COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)CCCS(=O)(=O)C2CCCCC2)c1
BDBM50196592 COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)CCS(=O)(=O)C2CCCCC2)c1
BDBM50210721 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNCc1cccc(CC)c1)C(N)=O
BDBM50210722 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1)C(N)=O
BDBM50210578 CC(C)C[C@H](NC(=O)[C@@H](N)CCC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)P(O)(=O)CC(C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
BDBM50210717 CCCN(CCC)C(=O)c1cc(C)cc(c1)C(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNCc1cccc(CC)c1
BDBM50210718 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1)C#N
BDBM50210719 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1)C(O)=O
BDBM50210720 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccc(O)cc1)[C@H](O)CNCc1cccc(OC)c1)C(N)=O
BDBM50210709 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNCc1cccc(OC)c1)C(N)=O
BDBM50210710 CCCN(CCC)C(=O)c1cc(CC#N)cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1
BDBM50210711 CCCNC(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1)C#N
BDBM50210712 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N(CCC)CCC)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1
BDBM50210713 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)OCC)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1
BDBM50210714 CCCN(CCC)C(=O)c1cc(C)cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1
BDBM50210715 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1
BDBM50210716 CCCNC(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1)C(N)=O
BDBM50209559 Cc1cccc(C)c1OCC(=O)N[C@@H](Cc1ccccc1)[C@H](O)C(=O)N1CSC(C)(C)[C@H]1C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM50212178 CCCN(c1cc2COC[C@](C)(N)Cc3cccc(CC[C@@H](NC(=O)c(c2)c1)c1ccccc1)c3)S(C)(=O)=O
BDBM50212180 CCCN(c1cc2COC(=O)[C@](C)(N)Cc3cccc(CC[C@@H](NC(=O)c(c2)c1)c1ccccc1)c3)S(C)(=O)=O
BDBM50212189 C[C@@]1(N)Cc2cccc(CC[C@@H](NC(=O)c3cc(COC1=O)cc(c3)-c1ccccc1C#N)c1ccccc1)c2
BDBM50231481 NC(=N)NC(=O)Cn1c(ccc1-c1ccc(NC(=O)c2cccc(Br)c2)cc1)-c1ccccc1
BDBM50231673 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cnn(CC)c1)N1CCCC1=O
BDBM50231674 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCCCCC1)N1CCCC1=O
BDBM50231675 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCCC1)N1CCCC1=O
BDBM50231676 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1(CCCCC1)c1cccc(OC)c1)N1CCCC1=O
BDBM50231677 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)n1)N1CCCC1=O
BDBM50231678 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCCCC1)N1CCCC1=O
BDBM50231679 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCSCC1)N1CCCC1=O
BDBM50231680 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1)N1CCCC1=O
BDBM50231681 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNc1ccccc1)N1CCCC1=O
BDBM50231682 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@@H](C)C(=O)NC1CCCCC1)N1CCCC1=O
BDBM50231683 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)COCC(C)C)N1CCCC1=O
BDBM50231684 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCCCCC(C)C)N1CCCC1=O
BDBM50231685 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccc(c1)C(F)(F)F)N1CCCC1=O
BDBM50231686 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cc(OC)cc(OC)c1)N1CCCC1=O
BDBM50231687 CCCCCC(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(NCC)cc(c1)N1CCCC1=O
BDBM50231688 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)CCCC(C)C)N1CCCC1=O
BDBM50231689 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(Cl)c1)N1CCCC1=O
BDBM50231690 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@H]1CCc2ccccc12)N1CCCC1=O
BDBM50231691 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)S(C)(=O)=O)C(=O)NC1CCCCC1
BDBM50231692 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@@H]1CCc2ccccc12)N1CCCC1=O
BDBM50231693 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1ccccc1OC)N1CCCC1=O
BDBM50231694 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC(F)(F)F)c1)N1CCCC1=O
BDBM50231695 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1ccc(OC)cc1)N1CCCC1=O
BDBM50231696 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCC1CCCCC1)N1CCCC1=O
BDBM50231697 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCCc1ccccc1)N1CCCC1=O
BDBM50231698 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)CCCC(C)C)N1CCCC1=O |w:24.26|
BDBM50231699 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1ccccc1)N1CCCC1=O
BDBM50249659 CC(=O)c1c(O)c2c(C)ccc(Cl)c2nc1Nc1ccc(Br)cc1Br
BDBM50250152 CC(=O)c1c(Nc2ccc(Cl)cc2)nc2c(Cl)cc(cc2c1O)[N+]([O-])=O
BDBM50250153 CC(=O)c1c(Nc2ccc(cc2)C(C)(C)C)nc2c(Cl)cc(cc2c1O)[N+]([O-])=O
BDBM50250190 CC(=O)c1c(Nc2ccc(C)cc2Cl)nc2c(cc(Cl)cc2c1O)[N+]([O-])=O
BDBM50250191 CC(=O)c1c(Nc2ccc(Cl)cc2Cl)nc2c(cc(Cl)cc2c1O)[N+]([O-])=O
BDBM50249736 FCC(=O)C(Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 |r|
BDBM50249605 CC(=O)c1c(Nc2ccc(Br)cc2)nc2c(Br)ccc(Br)c2c1O
BDBM50249606 CC(=O)c1c(O)c2c(Cl)ccc(Br)c2nc1Nc1ccc(Cl)cc1
BDBM50249607 CC(=O)c1c(Nc2ccc(Cl)cc2Cl)nc2c(Cl)ccc(Cl)c2c1O
BDBM50259465 Fc1ccc(F)c(OCCCc2ccc(cc2)C2=C([C@H]3CNC[C@@H](C2)N3)C(=O)N(Cc2cccc(Cl)c2Cl)C2CC2)c1Cl |r,wU:19.27,wD:23.26,t:18,TLB:14:17:25:21.20.22,THB:26:18:25:21.20.22,(15.78,2.08,;16.56,.76,;18.11,.78,;18.88,-.55,;18.12,-1.88,;18.89,-3.22,;16.57,-1.88,;15.81,-3.22,;14.27,-3.23,;13.5,-4.56,;11.96,-4.57,;11.2,-5.91,;11.97,-7.24,;11.21,-8.58,;9.67,-8.58,;8.89,-7.25,;9.65,-5.92,;8.9,-9.91,;7.71,-9.34,;8.43,-10.84,;10.24,-11.17,;11.35,-10.55,;10.81,-12.02,;9.09,-11.68,;9.43,-10.43,;7.9,-12.31,;6.17,-9.28,;5.45,-7.92,;5.36,-10.59,;3.82,-10.53,;3,-11.83,;3.73,-13.18,;2.92,-14.49,;1.37,-14.44,;.65,-13.08,;-.89,-13.02,;1.47,-11.77,;.75,-10.41,;6.08,-11.95,;6.03,-13.48,;7.39,-12.76,;15.8,-.57,;14.26,-.57,)|
BDBM50245647 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O |r,c:9|
BDBM50267295 COC(=O)N[C@H](C(=O)N[C@@H](C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N1CCN(Cc2cccc(n2)C(C)(C)O)C1=O)C(C)(C)C)Cc1ccc(cc1)-c1ccccn1)C(C)(C)C |r|
BDBM50267297 COC(=O)N[C@H](C(=O)N[C@H](C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N1CCN(Cc2ccccc2)C1=O)C(C)(C)C)Cc1ccc(cc1)-c1ccccn1)C(C)(C)C |r|
BDBM50282993 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)C(=O)OC(C)C
BDBM50294218 CC(C)c1ccc2OC(C)(C)C[C@H](NC[C@@H](O)[C@@H]3C[C@H](C)CCCCCCCCC(=O)N(C)[C@@H](C)C(=O)N3)c2c1 |r|
BDBM50294219 CC(C)c1cccc(CNC[C@@H](O)[C@@H]2C[C@H](C)CCCCCCCCC(=O)N(C)[C@@H](C)C(=O)N2)c1 |r|
BDBM50271626 CCCN(CCC)C(=O)c1cc(C)cc(c1)C(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)[C@@H]1NCCN(Cc2ccccc2)C1=O |r|
BDBM50271627 CCCN(CCC)C(=O)c1cc(C)cc(c1)C(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)[C@@H]1NCN(Cc2ccccc2)C1=O |r|
BDBM50274090 COC(=O)c1ccc(CNC(=O)[C@@H](NC(=O)C[C@H](O)[C@H](COc2cc(F)cc(F)c2)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(C)C)cc1 |r|
BDBM50274091 CSCC[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(=O)N[C@@H](COc1cc(F)cc(F)c1)[C@@H](O)CC(=O)N[C@@H](C(C)C)C(=O)NCc1ccc(cc1)C(O)=O |r|
BDBM50274092 COC(=O)c1ccc(CNC(=O)[C@@H](NC(=O)C[C@H](O)[C@H](COc2cc(F)cc(F)c2)NC(=O)c2cc(cc(c2)C(=O)N[C@H](C)c2ccccc2)N(C)S(C)(=O)=O)C(C)C)cc1 |r|
BDBM50274093 CC(C)[C@H](NC(=O)C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)NCc1ccc(cc1)C(O)=O |r|
BDBM50274094 CC(C)[C@H](NC(=O)C[C@H](O)[C@H](COc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)NCc1ccc(cc1)C(O)=O |r|
BDBM50274095 CC(C)[C@H](NC(=O)C[C@H](O)[C@H](COCc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)NCc1ccc(cc1)C(O)=O |r|
BDBM50274096 CC(C)[C@H](NC(=O)C[C@H](O)[C@H](COCc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)NCc1ccc(cc1)C(O)=O |r|
BDBM50274097 CC(C)[C@H](NC(=O)C[C@@H](O)[C@H](COCc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)NCc1ccc(cc1)C(O)=O |r|
BDBM50274098 COC(=O)c1cc(NC(=O)[C@@H](NC(=O)C[C@H](O)[C@H](COc2cc(F)cc(F)c2)NC(=O)c2cc(cc(c2)C(=O)N[C@H](C)c2ccccc2)N(C)S(C)(=O)=O)C(C)C)cc(c1)C(=O)OC |r|
BDBM50274099 CC(C)[C@H](NC(=O)C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)Nc1cc(cc(c1)C(O)=O)C(O)=O |r|
BDBM50274100 CC(C)[C@H](NC(=O)C[C@H](O)[C@H](COCc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)Nc1cc(cc(c1)C(O)=O)C(O)=O |r|
BDBM50274101 CC(C)[C@H](NC(=O)C[C@H](O)[C@H](COCc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)Nc1cc(cc(c1)C(O)=O)C(O)=O |r|
BDBM50274102 CCCN(CCC)C(=O)c1cccc(c1)C(=O)N[C@@H](COCc1cc(F)cc(F)c1)[C@@H](O)CC(=O)N[C@@H](C(C)C)C(=O)Nc1cc(cc(c1)C(O)=O)C(O)=O |r|
BDBM50274103 CCCN(CCC)C(=O)c1cccc(c1)C(=O)N[C@@H](COCc1ccccc1)[C@@H](O)CC(=O)N[C@@H](C(C)C)C(=O)Nc1cc(cc(c1)C(O)=O)C(O)=O |r|
BDBM50274104 CNC(=O)c1cc(cc(c1)C(=O)N[C@@H](COCc1cc(F)cc(F)c1)[C@@H](O)CC(=O)N[C@@H](C(C)C)C(=O)Nc1cc(cc(c1)C(O)=O)C(O)=O)N(C)S(C)(=O)=O |r|
BDBM50274105 C[C@@H](NC(=O)c1cc(cc(c1)C(=O)N[C@@H](COc1cc(F)cc(F)c1)[C@@H](O)CC(=O)NC1CC1)N(C)S(C)(=O)=O)c1ccccc1 |r|
BDBM50274106 C[C@@H](NC(=O)c1cc(cc(c1)C(=O)N[C@@H](COc1cc(F)cc(F)c1)[C@@H](O)CC(=O)NCc1ccc(cc1)C(O)=O)N(C)S(C)(=O)=O)c1ccccc1 |r|
BDBM50274107 C[C@@H](NC(=O)c1cc(cc(c1)C(=O)N[C@@H](COc1cc(F)cc(F)c1)[C@@H](O)CC(=O)NCC(=O)NCc1ccc(cc1)C(O)=O)N(C)S(C)(=O)=O)c1ccccc1 |r|
BDBM50274108 CC(C)[C@H](NC(=O)C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)NCc1ccccc1 |r|
BDBM50274109 CC(C)[C@H](NC(=O)C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)Nc1ccc(cc1)C(O)=O |r|
BDBM50274110 CC(C)[C@H](NC(=O)C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cccc(c1)C(=O)N[C@H](C)c1ccccc1)C(=O)NCc1ccc(cc1)C(O)=O |r|
BDBM50274111 CC(C)[C@H](NC(=O)C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cccc(c1)N(C)S(C)(=O)=O)C(=O)NCc1ccc(cc1)C(O)=O |r|
BDBM50290521 CCN(C(C)C)S(=O)(=O)CC[C@@H]1O[C@@H]1[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)c1ccc2ccccc2n1)C(C)(C)S(C)(=O)=O
BDBM50288947 CC(C)C(NC(=O)C[C@@H]1O[C@@H]1[C@H](Cc1ccccc1)NC(=O)C(CC(N)=O)NC(=O)c1ccc2ccccc2n1)C(C)C
BDBM50281636 CCC(C)[C@H](NC(=O)[C@@H](C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC(N)=O)NC(=O)c1ccc2ccccc2n1)C(C)C)C(=O)NCc1ccccn1
BDBM50281638 CCC(C)[C@H](NC(=O)[C@@H](C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)COc1cccc2ccccc12)C(C)C)C(=O)NCc1ccccn1
BDBM50281642 CCC(C)[C@H](NC(=O)[C@@H](C[C@H](O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(C)C)C(=O)NCc1ccccn1
BDBM50289714 CC(C)[C@@H](O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)c1cc2ccccc2[nH]1
BDBM50287742 CCCc1c(COc2ccc(C=C3SC(S)=NC3=O)cc2)ccc(C(C)=O)c1OC |w:11.10,c:15|
BDBM50287743 SC1=NC(=O)C(S1)=Cc1ccc(COc2ccc(cc2)C(=O)c2ccccc2)cc1 |w:7.8,t:1|
BDBM50287744 CCCc1c(COc2ccc(C=C3SC(S)=NC3=O)cc2)ccc(C(C)=O)c1OC(C)=O |w:11.10,c:15|
BDBM50287745 CCCc1c(O)c(ccc1COc1ccc(C=C2SC(S)=NC2=O)cc1)C(=O)CC |w:16.16,c:21|
BDBM50287746 CCCc1c(O)c(ccc1OCc1ccc(C=C2SC(S)=NC2=O)cc1)C(=O)OC |w:16.16,c:21|
BDBM50287747 Oc1c(Cc2ccccc2)c(OCc2ccc(C=C3SC(S)=NC3=O)cc2)ccc1C(=O)c1ccccc1 |w:17.17,c:22|
BDBM50287748 CCCc1c(O)c(ccc1OCc1ccc(C=C2SC(S)=NC2=O)cc1)C(=O)c1ccncc1 |w:16.16,c:21|
BDBM50287749 CCCc1c(O)c(ccc1COc1ccc(C=C2SC(S)=NC2=O)cc1)C(C)=O |w:16.16,c:21|
BDBM50287750 CCCc1c(O)c(ccc1OCc1ccc(C=C2SC(S)=NC2=O)cc1)C(C)=O |w:16.16,c:21|
BDBM50287751 CCCc1c(O)c(ccc1COc1cccc(C=C2SC(S)=NC2=O)c1)C(C)=O |w:17.17,c:22|
BDBM50287752 CCCc1c(OCc2ccc(C=C3SC(S)=NC3=O)cc2)ccc(C(C)=O)c1OC(C)=O |w:11.10,c:15|
BDBM50287753 Oc1cc(OCc2ccc(C=C3SC(S)=NC3=O)cc2)ccc1C(=O)c1ccccc1 |w:10.9,c:14|
BDBM50287754 CCc1c(O)c(ccc1COc1ccc(C=C2SC(S)=NC2=O)cc1)C(C)=O |w:15.15,c:20|
BDBM50287755 CC(=O)c1ccc(COc2ccc(C=C3SC(S)=NC3=O)cc2)cc1O |w:13.12,c:17|
BDBM50287756 CCCc1c(OCc2ccc(C=C3SC(S)=NC3=O)cc2)ccc(C(C)=O)c1OC |w:11.10,c:15|
BDBM50287757 CCCc1c(OC)cccc1OCc1ccc(C=C2SC(S)=NC2=O)cc1 |w:17.17,c:22|
BDBM50287758 CCCc1c(O)c(ccc1OCc1ccc(C=C2SC(S)=NC2=O)cc1)C(=O)c1cncc(c1)C(O)=O |w:16.16,c:21|
BDBM50287759 CCCc1c(O)c(ccc1OCc1ccc(C=C2SC(S)=NC2=O)cc1)C(=O)c1cccnc1 |w:16.16,c:21|
BDBM50287760 CCCc1c(O)c(ccc1OCc1ccc(C=C2SC(S)=NC2=O)cc1)C(O)=O |w:16.16,c:21|
BDBM50287761 SC1=NC(=O)C(S1)=Cc1ccc(OCc2ccc(cc2)C(=O)c2ccccc2)cc1 |w:7.8,t:1|
BDBM50287762 CCCc1c(O)cccc1OCc1ccc(C=C2SC(S)=NC2=O)cc1 |w:16.16,c:21|
BDBM50287763 CCCc1c(O)c(ccc1OCc1ccc(C=C2SC(S)=NC2=O)cc1)C(=O)c1ccccc1O |w:16.16,c:21|
BDBM50305533 CC(C)c1cccc(CNC[C@@H](O)[C@@H]2Cc3cccc(OCCCCOc4cc(cc(C)n4)C(=O)N2)c3)c1 |r|
BDBM50305536 COCc1cc2cc(OCCCCOc3cccc(C[C@H](NC2=O)[C@H](O)CNC2(CC2)c2cccc(c2)C(C)C)c3)n1 |r|
BDBM50305537 CC(C)c1cccc(c1)C1(CC1)NC[C@@H](O)[C@@H]1Cc2cccc(OCCCCOc3cc(cc(C)n3)C(=O)N1)c2 |r|
BDBM50305527 COCc1cc2NCCCCOc3cccc(C[C@H](NC(=O)c(c1)c2)[C@H](O)CNC1(CC1)c1cccc(c1)C(C)C)c3 |r|
BDBM50305469 CN1C(N)=NC(C2CCCCC2)(C1=O)c1cccc(NC(=O)c2occc2C)c1 |c:3|
BDBM50303716 COc1ccc(cc1C)C1(N=C(N)N(C)C1=O)c1ccc(F)c(c1)-c1cncnc1 |t:11|
BDBM50303717 COc1ccc(cc1C)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1F |t:11|
BDBM50303718 CN1C(N)=NC(C1=O)(c1ccccc1)C12CC3CC(CC(C3)C1)C2 |c:3,TLB:5:14:17:21.19.20,THB:19:18:15:21.20.22,19:20:17.18.23:15,22:20:17:23.14.15,22:14:17:21.19.20|
BDBM50303719 COc1ccc(cc1C)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1 |t:11|
BDBM50303720 COc1ccc(cc1C)C1(N=C(N)N(C)C1=O)c1ccc(C)c(c1)-c1cccnc1 |t:11|
BDBM50303721 CCOc1ccc(cc1)C1(N=C(N)N(C)C1=O)C12CC3CC(CC(C3)C1)C2 |t:11,TLB:9:17:20:24.22.23,THB:22:21:18:24.23.25,22:23:20.21.26:18,25:23:20:26.17.18,25:17:20:24.22.23|
BDBM50303722 CCCOc1cc(ccc1OC)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1 |t:14|
BDBM50303723 COc1ccc(cc1OC(C)C)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1 |t:14|
BDBM50303724 COc1ccc(cc1C1CCCC1)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1 |t:16|
BDBM50303725 COc1ccc(cc1C)C1(N=C(N)N(C)C1=O)c1ccc(C#N)c(c1)-c1cccnc1 |t:11|
BDBM50303726 CN1C(N)=NC(C1=O)(c1ccc2OCOc2c1)c1cccc(c1)-c1cccnc1 |c:3|
BDBM50303727 COc1ccc(cc1C)[C@@]1(N=C(N)N(C)C1=O)c1ccc(F)c(c1)-c1cccnc1F |r,t:11|
BDBM50303728 CN1C(N)=NC(C1=O)(c1ccccc1)c1cccc(Cl)c1 |c:3|
BDBM50303729 CN1C(N)=NC(C1=O)(c1ccc(OC(F)(F)F)cc1)c1cccc(-c2cncnc2)c1F |c:3|
BDBM50303730 COc1ccc(cn1)-c1cccc(c1)C1(N=C(N)N(C)C1=O)c1ccc(OC(F)(F)F)cc1 |t:17|
BDBM50303731 CN1C(N)=N[C@](C1=O)(c1ccc(OC(F)(F)F)cc1)c1ccc(F)c(c1)-c1cncnc1 |r,c:3|
BDBM50303732 CN1C(N)=NC(C1=O)(c1ccc(OC(F)(F)F)cc1)C12CC3CC(CC(C3)C1)C2 |c:3,TLB:5:19:22:26.24.25,THB:24:23:20:26.25.27,24:25:22.23.28:20,27:25:22:28.19.20,27:19:22:26.24.25|
BDBM50303733 COc1ccc(cc1OC)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1 |t:12|
BDBM50303734 COc1ccc(cc1C)[C@@]1(N=C(N)N(C)C1=O)C12CC3CC(CC(C3)C1)C2 |r,t:11,TLB:9:17:20:24.22.23,THB:22:21:18:24.23.25,22:23:20.21.26:18,25:23:20:26.17.18,25:17:20:24.22.23|
BDBM50303735 COc1ncccc1-c1cccc(c1)C1(N=C(N)N(C)C1=O)c1ccc(OC(F)(F)F)cc1 |t:17|
BDBM50303736 COc1ccc(cc1C#N)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1 |t:12|
BDBM50303737 CCCCOc1ccc(cc1)C1(N=C(N)N(C)C1=O)C12CC3CC(CC(C3)C1)C2 |t:13,TLB:11:19:22:26.24.25,THB:24:23:20:26.25.27,24:25:22.23.28:20,27:25:22:28.19.20,27:19:22:26.24.25|
BDBM50303738 COc1ccc(cc1C(F)(F)F)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1 |t:14|
BDBM50303739 COc1ccc(cc1C)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cncnc1 |t:11|
BDBM50303741 CN1C(N)=NC(C1=O)(c1ccccc1)c1ccc(Cl)cc1 |c:3|
BDBM50303742 COc1ccc(cc1OC)C1(N=C(N)N(C)C1=O)C12CC3CC(CC(C3)C1)C2 |t:12,TLB:10:18:21:25.23.24,THB:23:22:19:25.24.26,23:24:21.22.27:19,26:24:21:27.18.19,26:18:21:25.23.24|
BDBM50303743 CN1C(N)=NC(C1=O)(c1ccc(OC(F)(F)F)cc1)c1cc(F)cc(c1)-c1cncnc1 |c:3|
BDBM50303744 COc1ccc(cc1OC1CCCC1)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1 |t:17|
BDBM50303745 COc1ccc(cc1F)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1 |t:11|
BDBM50303747 COc1ccc(cc1C)[C@]1(N=C(N)N(C)C1=O)c1ccc(F)c(c1)-c1cccnc1F |r,t:11|
BDBM50303748 COc1ccc(cc1)[C@@]1(N=C(N)N(C)C1=O)C12CC3CC(CC(C3)C1)C2 |r,t:10,TLB:8:16:19:23.21.22,THB:21:20:17:23.22.24,21:22:19.20.25:17,24:22:19:25.16.17,24:16:19:23.21.22|
BDBM50303749 CCOc1cc(ccc1OC)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1 |t:13|
BDBM50303750 COc1ccc(cc1Cl)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1 |t:11|
BDBM50303751 CN1C(N)=NC(C1=O)(c1cccc(c1)-c1cccnc1)c1ccc2OCCOc2c1 |c:3|
BDBM50303752 CCCCOc1cc(ccc1OC)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1 |t:15|
BDBM50303755 COc1ccc(cc1C)[C@]1(N=C(N)N(C)C1=O)C12CC3CC(CC(C3)C1)C2 |r,t:11,TLB:9:17:20:24.22.23,THB:22:21:18:24.23.25,22:23:20.21.26:18,25:23:20:26.17.18,25:17:20:24.22.23|
BDBM50303756 CN1C(N)=N[C@@](C1=O)(c1ccc(OC(F)(F)F)cc1)c1ccc(F)c(c1)-c1cncnc1 |r,c:3|
BDBM50303757 CN1C(N)=NC(C1=O)(c1ccc(OC(F)(F)F)cc1)c1cccc(c1)-c1cccnc1F |c:3|
BDBM50303758 CN1C(N)=NC(C1=O)(c1ccc2OCCc2c1)c1cccc(c1)-c1cccnc1 |c:3|
BDBM50303759 CCc1cc(ccc1OC)C1(N=C(N)N(C)C1=O)C12CC3CC(CC(C3)C1)C2 |t:12,TLB:10:18:21:25.23.24,THB:23:22:19:25.24.26,23:24:21.22.27:19,26:24:21:27.18.19,26:18:21:25.23.24|
BDBM50303760 COc1ccc(cc1)[C@]1(N=C(N)N(C)C1=O)C12CC3CC(CC(C3)C1)C2 |r,t:10,TLB:8:16:19:23.21.22,THB:21:20:17:23.22.24,21:22:19.20.25:17,24:22:19:25.16.17,24:16:19:23.21.22|
BDBM50302109 CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](OC(=O)[C@@H](OC(=O)[C@H](C(C)C)N(C)C)C(C)C)C(C)C)[C@@H](C)O)C(=O)N(C)[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)OC |r|
BDBM50302835 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCNCC1)c1cccc(c1)C(C)(C)C |r|
BDBM50302836 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCOC1)c1cccc(c1)-n1cccn1 |r|
BDBM50302837 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCOC1)c1cccc(c1)-n1cccn1 |r|
BDBM50302838 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cccc(c1)-n1cccn1 |r|
BDBM50302839 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCOCC1)c1cccc(c1)C(C)(C)C |r|
BDBM50302840 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCC1)c1cccc(c1)C(C)(C)C |r|
BDBM50302841 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cccc(c1)C(C)(C)C |r|
BDBM50302842 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCN(CC1)C(N)=O)c1cccc(c1)C(C)(C)C |r|
BDBM50302843 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCNC(=O)C1)c1cccc(c1)C(C)(C)C |r|
BDBM50302844 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCNC1)c1cccc(c1)C(C)(C)C |r|
BDBM50302845 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCN(O)C1)c1cccc(c1)C(C)(C)C |r|
BDBM50302846 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCN(C1)C(=O)OCc1ccccc1)c1cccc(c1)C(C)(C)C |r|
BDBM50302847 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCN(C1)C(C)=O)c1cccc(c1)C(C)(C)C |r|
BDBM50302848 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCN(C1)C(N)=O)c1cccc(c1)C(C)(C)C |r|
BDBM50302849 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCC(=O)NC1)c1cccc(c1)C(C)(C)C |r|
BDBM50302850 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCC(=O)CC1)c1cccc(c1)C(C)(C)C |r|
BDBM50302851 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@@]1(CC[C@H](O)CC1)c1cccc(c1)C(C)(C)C |r,wU:14.15,18.18,21.22,wD:4.3,(22.91,-29.31,;21.58,-28.54,;21.58,-27,;20.24,-29.31,;20.24,-30.85,;18.9,-31.61,;17.57,-30.84,;16.23,-31.61,;14.9,-30.84,;13.56,-31.61,;14.9,-29.29,;16.23,-28.52,;16.23,-26.98,;17.57,-29.29,;21.57,-31.62,;21.57,-33.16,;22.91,-30.85,;24.24,-31.62,;25.57,-30.86,;26.91,-30.09,;26.91,-28.54,;25.57,-27.76,;25.57,-26.22,;24.24,-28.54,;24.24,-30.09,;26.91,-31.63,;26.91,-33.16,;28.24,-33.93,;29.57,-33.15,;29.56,-31.61,;28.23,-30.85,;30.89,-30.83,;32.23,-31.59,;30.88,-29.29,;32.21,-30.05,)|
BDBM50302852 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@]1(CC[C@H](O)CC1)c1cccc(c1)C(C)(C)C |r,wU:14.15,18.18,wD:4.3,21.22,(-.23,-39.94,;-1.56,-39.17,;-1.56,-37.63,;-2.89,-39.94,;-2.9,-41.48,;-4.23,-42.25,;-5.56,-41.48,;-6.91,-42.25,;-8.24,-41.48,;-9.57,-42.25,;-8.24,-39.93,;-6.91,-39.15,;-6.91,-37.61,;-5.56,-39.93,;-1.56,-42.25,;-1.57,-43.79,;-.23,-41.48,;1.1,-42.26,;2.44,-41.49,;1.1,-40.72,;1.1,-39.18,;2.44,-38.4,;2.44,-36.86,;3.78,-39.18,;3.78,-40.72,;3.77,-42.26,;3.77,-43.8,;5.1,-44.56,;6.44,-43.79,;6.43,-42.24,;5.09,-41.48,;7.76,-41.47,;9.09,-42.23,;7.75,-39.93,;9.08,-40.68,)|
BDBM50302853 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@]1(CC[C@H](CO)CC1)c1cccc(c1)C(C)(C)C |r,wU:14.15,18.18,wD:4.3,21.22,(23.1,-39.62,;21.76,-38.85,;21.76,-37.31,;20.43,-39.61,;20.43,-41.15,;19.09,-41.92,;17.76,-41.15,;16.42,-41.92,;15.08,-41.15,;13.75,-41.92,;15.08,-39.6,;16.42,-38.82,;16.41,-37.28,;17.76,-39.6,;21.76,-41.93,;21.76,-43.47,;23.09,-41.16,;24.43,-41.93,;25.76,-41.17,;24.43,-40.4,;24.43,-38.85,;25.76,-38.07,;25.76,-36.53,;27.09,-35.76,;27.1,-38.85,;27.1,-40.4,;27.09,-41.93,;27.09,-43.47,;28.43,-44.24,;29.76,-43.46,;29.75,-41.92,;28.42,-41.16,;31.08,-41.14,;32.42,-41.9,;31.07,-39.6,;32.4,-40.36,)|
BDBM50302854 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@]1(CC[C@H](CCO)CC1)c1cccc(c1)C(C)(C)C |r,wU:14.15,18.18,wD:4.3,21.22,(.89,-51.04,;-.44,-50.27,;-.44,-48.73,;-1.77,-51.04,;-1.77,-52.58,;-3.11,-53.34,;-4.44,-52.57,;-5.78,-53.34,;-7.12,-52.57,;-8.45,-53.34,;-7.12,-51.02,;-5.78,-50.25,;-5.79,-48.71,;-4.44,-51.02,;-.44,-53.35,;-.44,-54.89,;.89,-52.58,;2.22,-53.35,;3.56,-52.59,;2.22,-51.82,;2.22,-50.27,;3.56,-49.49,;3.56,-47.95,;4.89,-47.18,;4.89,-45.64,;4.9,-50.27,;4.9,-51.82,;4.89,-53.36,;4.89,-54.89,;6.22,-55.66,;7.56,-54.89,;7.55,-53.34,;6.21,-52.58,;8.88,-52.56,;10.22,-53.32,;8.87,-51.02,;10.2,-51.78,)|
BDBM50302855 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCC(C)=NC1)c1cccc(c1)C(C)(C)C |r,c:23|
BDBM50302856 C[C@H]1CC[C@@](CN1)(NC[C@@H](O)[C@H](Cc1cc(F)cc(F)c1)NC(C)=O)c1cccc(c1)C(C)(C)C |r|
BDBM50302857 CS[C@H]1CC[C@@](CN1)(NC[C@@H](O)[C@H](Cc1cc(F)cc(F)c1)NC(C)=O)c1cccc(c1)C(C)(C)C |r|
BDBM50302858 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@]1(CC[C@@H](NC1)C(F)(F)F)c1cccc(c1)C(C)(C)C |r|
BDBM50302859 CO[C@H]1CC[C@@](CN1)(NC[C@@H](O)[C@H](Cc1cc(F)cc(F)c1)NC(C)=O)c1cccc(c1)C(C)(C)C |r|
BDBM50302860 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@]1(CC[C@@H](NC1)C#N)c1cccc(c1)C(C)(C)C |r|
BDBM50302861 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@]1(CC[C@@H](NC1)S(C)(=O)=O)c1cccc(c1)C(C)(C)C |r|
BDBM50302862 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@]1(CCC(NO)=NC1)c1cccc(c1)C(C)(C)C |r,c:24|
BDBM50302863 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@]1(CC[C@H](NO)NC1)c1cccc(c1)C(C)(C)C |r|
BDBM50302864 CON[C@H]1CC[C@@](CN1)(NC[C@@H](O)[C@H](Cc1cc(F)cc(F)c1)NC(C)=O)c1cccc(c1)C(C)(C)C |r|
BDBM50302865 COC(=O)N[C@H]1CC[C@@](CN1)(NC[C@@H](O)[C@H](Cc1cc(F)cc(F)c1)NC(C)=O)c1cccc(c1)C(C)(C)C |r|
BDBM50302866 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@]1(CC[C@H](NC=O)NC1)c1cccc(c1)C(C)(C)C |r|
BDBM50302867 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@]1(CC[C@H](NS(C)(=O)=O)NC1)c1cccc(c1)C(C)(C)C |r|
BDBM50302868 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@]1(CC[C@@H](NC1)N(O)C(C)=O)c1cccc(c1)C(C)(C)C |r|
BDBM50302869 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@]1(CC[C@H](NC(C)=O)NC1)c1cccc(c1)C(C)(C)C |r|
BDBM50302870 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@]1(CC[C@H](Nc2ccccn2)NC1)c1cccc(c1)C(C)(C)C |r|
BDBM50302871 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@]1(CC[C@H](Nc2cccs2)NC1)c1cccc(c1)C(C)(C)C |r|
BDBM50302872 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@]1(CC[C@H](Nc2cccnc2)NC1)c1cccc(c1)C(C)(C)C |r|
BDBM50302107 COC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccccc1)N(C)C(=O)[C@H](C)NC(=O)[C@@H](NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](OC(=O)[C@@H](OC(=O)[C@H](C(C)C)N(C)C)C(C)C)C(C)C)[C@@H](C)O |r|
BDBM50302108 CC[C@H](C)[C@@H](O)C(=O)N[C@@H](CC(C)C)C(=O)N(C)[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N(C)[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)OC |r|
BDBM50298999 Cc1cccc(C)c1OCC(=O)NC[C@@](O)(Cc1ccccc1)C(=O)N1CSC(C)(C)[C@@H]1C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM50299000 Cc1cccc(C)c1OCC(=O)NC[C@](O)(Cc1ccccc1)C(=O)N1CSC(C)(C)[C@@H]1C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM50299001 Cc1cccc(C)c1OCC(=O)NCC(O)(CCc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM50298190 COCCCOc1cc(CN(C[C@H](N)[C@@H](O)C[C@@H](C(C)C)C(=O)NCC(C)(C)C(N)=O)C(C)C)ccc1OC |r|
BDBM50298191 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(OC)c(OCCCOC)c1 |r|
BDBM50298192 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(OC)c(CCCCOC)c1 |r|
BDBM50298193 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(OC)c(\C=C\CCOC)c1 |r|
BDBM50298194 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(OC)c(CNC(=O)OC)c1 |r|
BDBM50298195 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(OC)c(CCNC(=O)OC)c1 |r|
BDBM50298196 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(C)c(OCCCOC)c1 |r|
BDBM50298197 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(CC)c(OCCCOC)c1 |r|
BDBM50298198 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(Br)c(OCCCOC)c1 |r|
BDBM50298199 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(C#C)c(OCCCOC)c1 |r|
BDBM50298200 CCCCNC(=O)[C@@H](C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(CC)c(OCCCOC)c1)C(C)C |r|
BDBM50298201 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)S(=O)(=O)c1ccc(OC)c(OCCCOC)c1 |r|
BDBM50298202 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)S(=O)(=O)c1ccc(OC)cc1 |r|
BDBM50298203 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(Cc1ccc(OC)c(OCCCOC)c1)C(C)C |r|
BDBM50299002 Cc1cccc(C)c1OCC(=O)NC[C@@](O)(CCc1ccccc1)C(=O)N1CSC(C)(C)[C@H]1C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM50299003 Cc1cccc(C)c1OCC(=O)NC[C@](O)(CCc1ccccc1)C(=O)N1CSC(C)(C)[C@H]1C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM50299004 Cc1cccc(C)c1OCC(=O)NCC(O)(CCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM50297934 C[C@@H](NC(=O)c1cc(NC(=O)CCC(O)(CCc2ccccc2)C(=O)N[C@@H]2[C@H](O)Cc3ccccc23)cc(c1)N(C)S(C)(=O)=O)c1ccccc1 |r|
BDBM50297936 CC(C)[C@H](NC(=O)C(O)(CCC(=O)Nc1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)CCc1ccccc1)C(=O)Nc1ccccc1 |r|
BDBM50298995 Cc1cccc(C)c1OCC(=O)NC[C@@](O)(Cc1ccccc1)C(=O)N1CSC(C)(C)[C@H]1C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM50298996 Cc1cccc(C)c1OCC(=O)NC[C@](O)(Cc1ccccc1)C(=O)N1CSC(C)(C)[C@H]1C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM50298997 Cc1cccc(C)c1OCC(=O)NC[C@@](O)(CCc1ccccc1)C(=O)N1CSC(C)(C)[C@@H]1C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM50298998 Cc1cccc(C)c1OCC(=O)NC[C@](O)(CCc1ccccc1)C(=O)N1CSC(C)(C)[C@@H]1C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
BDBM50300229 CN1C(N)=NC(C1=O)(c1ccccc1)c1ccccc1 |c:3|
BDBM50310149 CN1C(N)=NC(C1=O)(c1ccncc1)c1cccc(c1)-c1ccccc1 |c:3|
BDBM50310150 CCc1cc(cc(CC)n1)[C@@]1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1F |r,t:12|
BDBM50307360 CCO[C@H](C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)N[C@@H](C(C)C)C(=O)NCc1ccccc1 |r|
BDBM50307361 COCCO[C@H](C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)N[C@@H](C(C)C)C(=O)NCc1ccccc1 |r|
BDBM50307374 CO[C@H](C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)CS(C)(=O)=O)C(=O)Nc1ccc(F)cc1 |r|
BDBM50307375 CO[C@H](C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)CS(C)(=O)=O)C(=O)Nc1ccccc1 |r|
BDBM50307376 CO[C@H](C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)CS(C)(=O)=O)C(=O)NCc1ccccc1 |r|
BDBM50307377 CO[C@H](C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)CS(C)(=O)=O)C(=O)NCC(C)C |r|
BDBM50307378 CO[C@H](C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)CS(C)(=O)=O)C(=O)NC1CC1 |r|
BDBM50307355 CO[C@H](CC[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)N[C@@H](C(C)C)C(=O)NCc1ccccc1 |r|
BDBM50307356 CO[C@H](C[C@@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)N[C@@H](C(C)C)C(=O)NCc1ccccc1 |r|
BDBM50307379 CO[C@H](C[C@H](O)[C@H](COc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)CS(C)(=O)=O)C(=O)N[C@@H](C(C)C)C(=O)NCc1ccccc1 |r|
BDBM50307380 CO[C@H](C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)CS(C)(=O)=O)C(=O)N[C@@H](C(C)C)C(=O)NCc1ccccc1 |r|
BDBM50307381 CO[C@H](C[C@H](O)[C@H](COc1ccc(Br)cc1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)CS(C)(=O)=O)C(=O)N[C@@H](C(C)C)C(=O)NCc1ccccc1 |r|
BDBM50307357 CO[C@H](C[C@H](N=[N+]=[N-])[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)N[C@@H](C(C)C)C(=O)NCc1ccccc1 |r|
BDBM50307358 CO[C@H](C[C@H](N)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)N[C@@H](C(C)C)C(=O)NCc1ccccc1 |r|
BDBM50307359 CC(C)[C@H](NC(=O)[C@@H](C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)OCc1ccccc1)C(=O)NCc1ccccc1 |r|
BDBM50307352 CC(C)[C@H](NC(=O)[C@@H](C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)OCC=C)C(=O)NCc1ccccc1 |r|
BDBM50307353 CCCO[C@H](C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)N[C@@H](C(C)C)C(=O)NCc1ccccc1 |r|
BDBM50305467 CN1C(N)=NC(C2CCCCC2)(C1=O)c1ccccc1 |c:3|
BDBM50300187 CO[C@H](C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)N[C@@H](C(C)C)C(=O)NCc1ccccc1 |r|
BDBM50300228 CN1C(N)=N[C@](CCC2CCCCC2)(CC2CCCCC2)C1=O |r,c:3|
BDBM50300708 CCCc1cccc(c1)C1(N=C(N)N2CCCN=C12)c1ccc(OC(F)(F)F)cc1 |t:11,18|
BDBM50300709 NC1=NC(C2=NCCCN12)(c1ccc(OC(F)(F)F)cc1)c1cccc(Br)c1 |t:1,4|
BDBM50300710 NC1=NC(C2=NCCCN12)(c1ccccc1)c1ccccc1 |t:1,4|
BDBM50300711 NC1=NC(C2=NOCCN12)(c1ccc(OC(F)(F)F)cc1)c1cccc(c1)-c1cccnc1F |t:1,4|
BDBM50300712 NC1=NC(\C2=N\CCCCCN12)(c1ccc(OC(F)(F)F)cc1)c1cccc(c1)-c1cccnc1F |t:1,4|
BDBM50300713 NC1=NC(C2=NCCCCN12)(c1ccc(OC(F)(F)F)cc1)c1cccc(c1)-c1cccnc1F |t:1,4|
BDBM50300714 NC1=NC(C2=NCCN12)(c1ccc(OC(F)(F)F)cc1)c1cccc(c1)-c1cccnc1F |t:1,4|
BDBM50300715 CCOc1ccc(cc1OCC)C1(N=C(N)N2CCCN=C12)c1cccc(c1)-c1cccnc1F |t:14,21|
BDBM50300716 NC1=NC(C2=NCCCN12)(c1ccc2OC(F)(F)Oc2c1)c1cccc(c1)-c1cccnc1F |t:1,4|
BDBM50300717 NC1=NC(C2=NCCCN12)(c1cccc(c1)-c1cccnc1F)c1ccc2OCCOc2c1 |t:1,4|
BDBM50300718 NC1=NC(C2=NCCCN12)(c1ccc2OCOc2c1)c1cccc(c1)-c1cccnc1F |t:1,4|
BDBM50300719 NC1=N[C@@](C2=NCCCN12)(c1ccc(OC(F)(F)F)cc1)c1cccc(c1)-c1cccnc1F |r,t:1,4|
BDBM50300720 COc1ccc(cc1)C1(N=C(N)N2CCCN=C12)c1cccc(c1)-c1cccnc1F |t:10,17|
BDBM50300721 COc1ccc(cc1)C1(N=C(N)N2CCCN=C12)c1cccc(c1)-c1cncnc1 |t:10,17|
BDBM50300722 NC1=NC(C2=NCCCN12)(c1ccc(OC(F)(F)F)cc1)c1cccc(CCC2CC2)c1 |t:1,4|
BDBM50300723 CC(C)(C)c1cccc(c1)C1(N=C(N)N2CCCN=C12)c1ccccc1 |t:12,19|
BDBM50300724 CC1(C)CN2C(N)=NC(C2=N1)(c1ccc(OC(F)(F)F)cc1)c1cccc(c1)-c1cccnc1F |c:6,10|
BDBM50300725 NC1=NC(C2=NCCCN12)(c1ccc(OC(F)(F)F)cc1)c1cccc(c1)-c1cncnc1 |t:1,4|
BDBM50300726 NC1=NC(C2=NCCCN12)(c1ccccc1)c1cccc(Cc2ccc(F)cc2)c1 |t:1,4|
BDBM50300727 NC1=NC(C2=NCCCN12)(c1ccccc1)c1cccc(Cc2ccccc2)c1 |t:1,4|
BDBM50300728 COc1ccc(Cc2cccc(c2)C2(N=C(N)N3CCCN=C23)c2ccccc2)cc1 |t:15,22|
BDBM50300732 NC1=N[C@](C2=NCCCN12)(c1ccc(OC(F)(F)F)cc1)c1cccc(c1)-c1cncnc1 |r,t:1,4|
BDBM50300733 NC1=N[C@](C2=NCCCN12)(c1ccc(OC(F)(F)F)cc1)c1cccc(c1)-c1cccnc1F |r,t:1,4|
BDBM50315003 Nc1cccc(Cn2c(ccc2-c2ccc(cc2)C(=O)NCC=C)-c2ccccc2)n1
BDBM50315008 CCCCCOc1ccc(cc1)-c1ccc(-c2ccccc2Cl)n1Cc1ccc(NCCCO)c(N)n1
BDBM50315009 CCCNC(=O)c1ccc(cc1)-c1ccc(-c2ccccc2)n1Cc1cccc(N)n1
BDBM50316596 CC(C)C[C@H](NC(=O)[C@H](CCl)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C)C(N)=O |r|
BDBM50316597 CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC#C |r|
BDBM50316598 CC(C)C[C@H](NC(=O)[C@H](CC#C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C)C(N)=O |r|
BDBM50316599 CC(C)C[C@H](NC(=O)[C@H](CC#N)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C)C(N)=O |r|
BDBM50314600 CN1C(N)=NC(C1=O)(c1ccncc1)c1cccc(c1)-c1cc(F)cc(F)c1 |c:3|
BDBM50314601 CN1C(N)=NC(C1=O)(c1ccncc1)c1cccc(c1)-c1ccsc1 |c:3|
BDBM50314602 CN1C(N)=NC(C1=O)(c1ccncc1)c1cccc(c1)-c1ccoc1 |c:3|
BDBM50314603 CN1C(N)=NC(C1=O)(c1ccncc1)c1cccc(c1)-c1cccnc1F |c:3|
BDBM50314604 CN1C(N)=NC(C1=O)(c1ccncc1)c1cccc(c1)-c1cc(F)ccc1F |c:3|
BDBM50314605 CN1C(N)=N[C@@](C1=O)(c1ccncc1)c1cccc(c1)-c1cc(F)ccc1F |r,c:3|
BDBM50314606 CN1C(N)=N[C@](C1=O)(c1ccncc1)c1cccc(c1)-c1cc(F)ccc1F |r,c:3|
BDBM50314607 COc1cccc(c1)-c1cccc(c1)C1(N=C(N)N(C)C1=O)c1ccncc1 |t:17|
BDBM50314608 CN1C(N)=NC(C1=O)(c1ccncc1)c1cccc(c1)-c1cccc(OC(F)(F)F)c1 |c:3|
BDBM50314609 CN1C(N)=NC(C1=O)(c1ccncc1)c1cccc(c1)-c1cccc(c1)C#N |c:3|
BDBM50314610 CN1C(N)=NC(C1=O)(c1ccncc1)c1cccc(c1)-c1cccc(F)c1 |c:3|
BDBM50314611 CN1C(N)=NC(C1=O)(c1ccncc1)c1cccc(c1)-c1cccc(F)c1F |c:3|
BDBM50328022 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cccc(CC(C)(C)C)c1 |r|
BDBM50328023 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cc(F)cc(c1)C(C)(C)C |r|
BDBM50328024 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cc(Br)cc(c1)C(C)(C)C |r|
BDBM50328025 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cc(I)cc(c1)C(C)(C)C |r|
BDBM50328026 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cc(C)cc(c1)C(C)(C)C |r|
BDBM50328027 COc1cc(cc(c1)C1(CCCCC1)NC[C@@H](O)[C@H](Cc1cc(F)cc(F)c1)NC(C)=O)C(C)(C)C |r|
BDBM50328028 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cc(O)cc(c1)C(C)(C)C |r|
BDBM50328029 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cc(N)cc(c1)C(C)(C)C |r|
BDBM50328030 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cc(NS(C)(=O)=O)cc(c1)C(C)(C)C |r|
BDBM50328031 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cc(cc(c1)C(C)(C)C)C(C)=O |r|
BDBM50328032 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1ccc(Br)c(c1)C(C)(C)C |r|
BDBM50328033 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cccs1 |r|
BDBM50328034 CC(C)c1ccc(s1)C1(CCCCC1)NC[C@@H](O)[C@H](Cc1cc(F)cc(F)c1)NC(C)=O |r|
BDBM50328035 CC(C)c1cc(cs1)C1(CCCCC1)NC[C@@H](O)[C@H](Cc1cc(F)cc(F)c1)NC(C)=O |r|
BDBM50328036 CC(C)c1csc(c1)C1(CCCCC1)NC[C@@H](O)[C@H](Cc1cc(F)cc(F)c1)NC(C)=O |r|
BDBM50328037 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cc(cs1)C(C)(C)C |r|
BDBM50328038 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cc(CC(C)(C)C)cs1 |r|
BDBM50328039 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cc(cs1)C#C |r|
BDBM50328040 CCc1csc(c1)C1(CCCCC1)NC[C@@H](O)[C@H](Cc1cc(F)cc(F)c1)NC(C)=O |r|
BDBM50328041 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cc(no1)C(C)(C)C |r|
BDBM50328042 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cc(CC(C)(C)C)no1 |r|
BDBM50328043 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1ncc(o1)C(C)(C)C |r|
BDBM50328044 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1nc(co1)C(C)(C)C |r|
BDBM50328045 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cnn(c1)C(C)(C)C |r|
BDBM50328046 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cnn(CC(C)(C)C)c1 |r|
BDBM50328047 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cn(C[Si](C)(C)C)nn1 |r|
BDBM50328048 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cn(nn1)C12CC3CC(CC(C3)C1)C2 |r,TLB:26:29:32.31.36:34,THB:30:31:34:38.29.37,30:29:32.31.36:34,26:29:32:36.35.34,37:29:32:36.35.34,37:35:32:38.30.29|
BDBM50328049 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cc(ncn1)C(C)(C)C |r|
BDBM50328050 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1cccc(c1)C(C)(C)C |r|
BDBM50328051 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1cccc(CC(C)(C)C)c1 |r|
BDBM50328052 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1cc(ccn1)C(C)(C)C |r|
BDBM50328053 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1cncc(CC(C)(C)C)c1 |r|
BDBM50328054 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1cc(CC(C)(C)C)c[n+]([O-])c1 |r|
BDBM50328055 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1ccc(CC(C)(C)C)s1 |r|
BDBM50328056 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1cc(CC(C)(C)C)cs1 |r|
BDBM50328057 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1ncc(o1)C(C)(C)C |r|
BDBM50328058 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1nc(co1)C(C)(C)C |r|
BDBM50328059 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1nc(CC(C)(C)C)cs1 |r|
BDBM50328060 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1csc(CC(C)(C)C)n1 |r|
BDBM50328061 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1cnn(CC(C)(C)C)c1 |r|
BDBM50328062 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1ccn(CC(C)(C)C)n1 |r|
BDBM50328063 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1cn(CC(C)(C)C)nn1 |r|
BDBM50317048 COC[C@H]1CCCN1C(=O)c1cc(C)cc(c1)C(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)[C@H]1CN(CCN1)S(=O)(=O)c1cccc(C)c1 |r|
BDBM50322883 CCOc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N(c1ccccc1)S(C)(=O)=O |r|
BDBM50322884 CC(C)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N(c1ccccc1)S(C)(=O)=O |r|
BDBM50322885 CS(=O)(=O)N(c1ccccc1)c1cc(cc(c1)-c1ccccc1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F |r|
BDBM50322886 CS(=O)(=O)N(c1ccccc1)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N1CCCC1=O |r|
BDBM50322887 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)N(c1ccc(cc1)C#N)S(C)(=O)=O)C(=O)NC1CCCCC1 |r|
BDBM50322888 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)N(c1ccc(Cl)cc1)S(C)(=O)=O)C(=O)NC1CCCCC1 |r|
BDBM50322889 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)N(c1ccc(cc1)C(F)(F)F)S(C)(=O)=O)C(=O)NC1CCCCC1 |r|
BDBM50322890 COc1ccc(cc1)N(c1cccc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@@H](C)C(=O)NC1CCCCC1)S(C)(=O)=O |r|
BDBM50322891 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)N(c1cccc(c1)C#N)S(C)(=O)=O)C(=O)NC1CCCCC1 |r|
BDBM50322892 COc1cccc(c1)N(c1cccc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@@H](C)C(=O)NC1CCCCC1)S(C)(=O)=O |r|
BDBM50322893 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)N(c1ccccc1C#N)S(C)(=O)=O)C(=O)NC1CCCCC1 |r|
BDBM50322894 COc1ccccc1N(c1cccc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@@H](C)C(=O)NC1CCCCC1)S(C)(=O)=O |r|
BDBM50322895 CS(=O)(=O)N(c1ccccc1)c1cccc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F |r|
BDBM50322896 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)S(=O)(=O)N(C)Cc1ccccc1)C(=O)NC1CCCCC1 |r|
BDBM50322897 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)S(=O)(=O)Cc1ccccc1)C(=O)NC1CCCCC1 |r|
BDBM50322898 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(CS(=O)(=O)c2ccccc2)c1)C(=O)NC1CCCCC1 |r|
BDBM50322899 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(OS(=O)(=O)Cc2ccccc2)c1)C(=O)NC1CCCCC1 |r|
BDBM50322900 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(NS(=O)(=O)Cc2ccccc2)c1)C(=O)NC1CCCCC1 |r|
BDBM50322901 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1)C(=O)NC1CCCCC1 |r|
BDBM50322902 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)N(Cc1ccccc1)S(C)(=O)=O)C(=O)NC1CCCCC1 |r|
BDBM50322903 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)N(C1CCCCC1)S(C)(=O)=O)C(=O)NC1CCCCC1 |r|
BDBM50322904 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)N(C(C)=O)c1ccccc1)C(=O)NC1CCCCC1 |r|
BDBM50322905 CS(=O)(=O)N(c1cccc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)c1ccccn1 |r|
BDBM50322906 CS(=O)(=O)N(c1cccnc1)c1cccc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F |r|
BDBM50322907 CS(=O)(=O)N(c1ccncc1)c1cccc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F |r|
BDBM50322908 Cc1ccc(cc1C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N(c1ccccc1)S(C)(=O)=O |r|
BDBM50322909 Cc1ccc(cc1N(c1ccccc1)S(C)(=O)=O)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F |r|
BDBM50322910 Cc1c(cccc1C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N(c1ccccc1)S(C)(=O)=O |r|
BDBM50322913 O[C@H](CNCc1cccc(c1)C(F)(F)F)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)N1c2ccccc2OS1(=O)=O |r|
BDBM50322914 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)N(c1cc(Cl)cc(Cl)c1)S(C)(=O)=O)C(=O)NC1CCCCC1 |r|
BDBM50322915 CCS(=O)(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)N(c1ccccc1)S(C)(=O)=O |r|
BDBM50322916 CS(=O)(=O)N(c1ccccc1)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(c1)C(F)(F)F)C1CCCC1 |r|
BDBM50323493 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCCCC1)c1cccc(c1)C1CCOC1 |r|
BDBM50322876 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(Nc2ccccc2)c1)C(=O)NC1CCCCC1 |r|
BDBM50322877 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)N(c1ccccc1)S(C)(=O)=O)C(=O)NC1CCCCC1 |r|
BDBM50322878 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)N1CCCC1=O)C(=O)NC1CCCCC1
BDBM50322879 CC(C)CCCC(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)N(c1ccccc1)S(C)(=O)=O |r|
BDBM50322880 CS(=O)(=O)N(c1ccccc1)c1cccc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCCCC1 |r|
BDBM50322881 CS(=O)(=O)N(c1ccccc1)c1cccc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CC1 |r|
BDBM50322882 CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@@H](C)C(=O)NC1CCCCC1)N(c1ccccc1)S(C)(=O)=O |r|
BDBM50324922 CC[C@@H](CC(=O)NCC1CCCCC1)n1c(N)nc2cc(Cl)ccc12 |r|
BDBM50312537 CC(C)[C@H](NC(=O)[C@H](C)C[C@H](O)[C@H](COCc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)NCc1ccccc1 |r|
BDBM50312538 CC(C)[C@H](NC(=O)[C@H](C)C[C@H](O)[C@H](COCc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)NCc1ccccc1 |r|
BDBM50312539 CC(C)[C@H](NC(=O)[C@H](C)C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)NCc1ccccc1 |r|
BDBM50312540 CC(C)[C@H](NC(=O)[C@@H](C)C[C@H](O)[C@H](COc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)NCc1ccccc1 |r|
BDBM50312541 CSCC[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(=O)N[C@@H](COCc1cc(F)cc(F)c1)[C@@H](O)C[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)NCc1ccccc1 |r|
BDBM50312542 CNC(=O)c1cc(cc(c1)C(=O)N[C@@H](COCc1cc(F)cc(F)c1)[C@@H](O)C[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)NCc1ccccc1)N(C)S(C)(=O)=O |r|
BDBM50312543 C[C@H](C[C@H](O)[C@H](COCc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)NC1CC1 |r|
BDBM50312544 CC(C)[C@H](NC(=O)[C@H](C)C[C@H](O)[C@H](COCc1cc(F)cc(F)c1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)NCc1ccc(F)cc1 |r|
BDBM50312665 OP([O-])(=O)OC1CC(=Nc2cc3OCOc3cc12)c1ccccc1F |c:7|
BDBM50313796 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(C)=O |r|
BDBM50313797 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(C)=O)C(C)C |r|
BDBM50313798 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(C)=O |r|
BDBM50313799 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCC[C@@H](C1)[C@@H](NC(C)=O)C(C)C |r|
BDBM50313800 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCC[C@@H](C1)C(C)(C)NC(C)=O |r|
BDBM50313801 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCC[C@@H](C1)C1(CCCC1)NC(C)=O |r|
BDBM50313802 CC(C)c1cccc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCC[C@@H](C2)C(C)(C)NC(C)=O)c1 |r|
BDBM50313803 CCC(=O)NC(C)(C)[C@H]1CCC[C@H](C1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(c1)C(C)C |r|
BDBM50313804 CCC(=O)N(C)C(C)(C)[C@H]1CCC[C@H](C1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(c1)C(C)C |r|
BDBM50313805 CC(C)c1cccc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCC[C@@H](C2)C(C)(C)N2CCCC2=O)c1 |r|
BDBM50313806 CC(C)c1cccc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCC[C@@H](C2)C(C)(C)N2CCCCC2=O)c1 |r|
BDBM50330180 COc1ccc2cc(ccc2c1)-c1cn(C[C@@H]2Cc3c(CN2)[nH]c2ccccc32)nn1 |r|
BDBM50333943 CC(C)[C@H](C[C@H](O)[C@H](COCc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)N[C@@H](C(C)C)C(=O)NCc1ccccc1 |r|
BDBM50333944 CC(C)S[C@H](NC(=O)[C@@H](C[C@H](O)[C@@H]1COCc2cccc(c2)C(C)NC(=O)c2cc(cc(c2)C(=O)N1)N(C)S(C)(=O)=O)C(C)C)C(=O)NCc1ccccc1 |r|
BDBM50333945 CC(C)S[C@H](NC(=O)[C@@H](C[C@H](O)[C@@H]1COCc2cccc(c2)C(NC(=O)c2cc(cc(c2)C(=O)N1)N(C)S(C)(=O)=O)c1ccccc1)C(C)C)C(=O)NCc1ccccc1 |r|
BDBM50333946 CC(C)CNC(=O)[C@@H](C[C@H](O)[C@@H]1COCc2cccc(c2)C(NC(=O)c2cc(cc(c2)C(=O)N1)N(C)S(C)(=O)=O)c1ccccc1)C(C)C |r|
BDBM50333947 CNC(=O)[C@@H](C[C@H](O)[C@@H]1COCc2cccc(c2)C(NC(=O)c2cc(cc(c2)C(=O)N1)N(C)S(C)(=O)=O)c1ccccc1)C(C)C |r|
BDBM50333948 COc1ccc(cc1)C1NC(=O)c2cc(cc(c2)C(=O)N[C@@H](COCc2cccc1c2)[C@@H](O)C[C@@H](C(C)C)C(=O)NCC(C)C)N(C)S(C)(=O)=O |r|
BDBM50333949 COCCCC1NC(=O)c2cc(cc(c2)C(=O)N[C@@H](COCc2cccc1c2)[C@@H](O)C[C@@H](C(C)C)C(=O)NCC(C)C)N(C)S(C)(=O)=O |r|
BDBM50333950 COCCOC1NC(=O)c2cc(cc(c2)C(=O)N[C@@H](COCc2cccc1c2)[C@@H](O)C[C@@H](C(C)C)C(=O)NCC(C)C)N(C)S(C)(=O)=O |r|
BDBM50333951 COCCOC1CCCc2cc(cc(c2)C(=O)N[C@@H](COCc2cccc1c2)[C@@H](O)C[C@@H](C(C)C)C(=O)NCC(C)C)N(C)S(C)(=O)=O |r|
BDBM50328776 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCC1)c1cccc(c1)C(C)(C)C |r|
BDBM50328777 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1cccc(c1)C(C)(CF)CF |r|
BDBM50328778 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1cccc(c1)C(C)(C)C(F)F |r|
BDBM50328779 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1cccc(c1)C(C)(C)CF |r|
BDBM50328780 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1cccc(c1)C(=C)C(F)(F)F |r|
BDBM50328781 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1cccc(c1)C1CCOC1 |r|
BDBM50328782 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1cccc(c1)-n1cccn1 |r|
BDBM50328783 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC(C)(C)c1cccc(c1)C(C)(C)C |r|
BDBM50328784 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNCc1cccc(c1)C(C)(C)C |r|
BDBM50328785 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCOCC1)c1cccc(c1)C1CCOC1 |r|
BDBM50328786 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CCOCC1)c1cccc(c1)-n1cccn1 |r|
BDBM50341162 CC(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3ccccc3)[C@@H]2O)c1 |r|
BDBM50341163 CC(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cccc(Br)c3)[C@@H]2O)c1 |r|
BDBM50341164 CCCOc1cccc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)C)[C@H]2O)c1 |r|
BDBM50341165 CCCOCc1cccc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)C)[C@H]2O)c1 |r|
BDBM50341166 COc1ccc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)C)[C@H]2O)cc1Br |r|
BDBM50341167 CC(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3ccc(O)cc3)[C@@H]2O)c1 |r|
BDBM50341168 CC(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3ccc(O)c(Cc4cccc(C)c4)c3)[C@@H]2O)c1 |r|
BDBM50341169 CC(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3ccc(O)c(CO)c3)[C@@H]2O)c1 |r|
BDBM50341170 CC(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3ccc(O)c(CCO)c3)[C@@H]2O)c1 |r|
BDBM50341171 CCCCc1cc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)C)[C@H]2O)ccc1O |r|
BDBM50341172 CCCc1cc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)C)[C@H]2O)ccc1O |r|
BDBM50341173 CCc1cc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)C)[C@H]2O)ccc1O |r|
BDBM50341174 CC(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3ccc(O)c(Br)c3)[C@@H]2O)c1 |r|
BDBM50341175 CNC(=O)Oc1ccc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)C)[C@H]2O)cc1Br |r|
BDBM50341176 CCCN1[C@@H](Cc2cc(C[C@@H]3CS(=O)(=O)C[C@H](NCc4cccc(c4)C(C)C)[C@H]3O)ccc2O)COC1=O |r|
BDBM50341177 CC(C)c1cccc(CNC[C@@H](O)[C@H](Cc2cc(F)cc(F)c2)NC(C)=O)c1 |r|
BDBM50341181 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3ccc(O)c(Br)c3)[C@@H]2O)c1 |r|
BDBM50341182 CC(C)Oc1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3ccc(O)c(Br)c3)[C@@H]2O)c1 |r|
BDBM50329515 CN1C(N)=N[C@](C1=O)(c1ccc(OC(F)(F)F)cc1)c1cccc(c1)-c1cccnc1F |r,c:3|
BDBM50329516 CN1C(N)=N[C@@](C1=O)(c1ccccc1)c1ccc(OC(F)F)c(C)c1 |r,c:3|
BDBM50329517 CN1C(N)=N[C@](C1=O)(c1ccc(OC(F)F)cc1)c1cccc(c1)-c1cccnc1F |r,c:3|
BDBM50329518 CN1C(N)=N[C@@](C1=O)(c1ccccc1)c1ccc(OC(F)F)cc1 |r,c:3|
BDBM50329519 COc1ccc(cc1)[C@@]1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1F |r,t:10|
BDBM50329520 CN1C(N)=N[C@](C1=O)(c1ccc(OCCF)cc1)c1cccc(c1)-c1cccnc1F |r,c:3|
BDBM50329521 CN1C(N)=N[C@@](C1=O)(c1ccccc1)c1ccc(OC(F)(F)F)cc1 |r,c:3|
BDBM50329522 CN1C(N)=N[C@@](C1=O)(c1ccccc1)c1ccc(OCCF)cc1 |r,c:3|
BDBM50329543 CC#Cc1cccc(c1)[C@]1(N=C(N)N(C)C1=O)c1ccc(OC(F)F)cc1 |r,t:11|
BDBM50329545 CCCC#Cc1cccc(c1)[C@]1(N=C(N)N(C)C1=O)c1ccc(OC(F)F)cc1 |r,t:13|
BDBM50329548 CN1C(N)=N[C@](C1=O)(c1ccc(OC(F)F)cc1)c1cccc(c1)C#CCCCCF |r,c:3|
BDBM50329549 CC(C)C#Cc1cccc(c1)[C@]1(N=C(N)N(C)C1=O)c1ccc(OC(F)F)cc1 |r,t:13|
BDBM50329550 CN1C(N)=N[C@](C1=O)(c1ccc(OC(F)F)cc1)c1cccc(c1)C#CC1CC1 |r,c:3|
BDBM50329552 COCC#Cc1cccc(c1)[C@]1(N=C(N)N(C)C1=O)c1ccc(OC(F)F)cc1 |r,t:13|
BDBM50329553 COCCC#Cc1cccc(c1)[C@]1(N=C(N)N(C)C1=O)c1ccc(OC(F)F)cc1 |r,t:14|
BDBM50329558 CN1C(N)=N[C@](C1=O)(c1ccc(OC(F)F)cc1)c1ccc(F)c(OCCCF)c1 |r,c:3|
BDBM50329564 CN1C(N)=N[C@](C1=O)(c1ccc(OC(F)F)cc1)c1ccc(F)c(OCC(F)F)c1 |r,c:3|
BDBM50329569 CN1C(N)=N[C@](C1=O)(c1ccc(OC(F)F)cc1)c1ccc(F)c(c1)C#CC1CC1 |r,c:3|
BDBM50329570 CN1C(N)=N[C@](C1=O)(c1ccc(OC(F)F)c(C)c1)c1ccc(F)c(c1)C#CC1CC1 |r,c:3|
BDBM50329572 CN1C(N)=N[C@](C1=O)(c1ccc(OC(F)F)c(C)c1)c1ccc(F)c(OCC(F)F)c1 |r,c:3|
BDBM50329573 CN1C(N)=N[C@@](C1=O)(c1cccc(c1)C#CC1CC1)c1ccc(OC(F)F)c(C)c1 |r,c:3|
BDBM50329574 CN1C(N)=N[C@](C1=O)(c1ccc(OC(F)F)c(C)c1)c1ccc(F)c(c1)C#CCF |r,c:3|
BDBM50329575 CCCC#Cc1cc(ccc1F)[C@]1(N=C(N)N(C)C1=O)c1ccc(OC(F)F)c(C)c1 |r,t:14|
BDBM50329576 CN1C(N)=N[C@](C1=O)(c1ccc(OC(F)F)cc1)c1ccc(F)c(c1)C#CCCCF |r,c:3|
BDBM50352847 COc1cncc(c1)-c1cccc(c1)C1(N=C(N)N(C)C1=O)c1ccsc1 |t:17|
BDBM50352848 CN1C(N)=NC(C1=O)(c1ccsc1)c1cccc(c1)-c1cnccn1 |c:3|
BDBM50352849 CCC(=O)c1cc(cs1)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1F |t:11|
BDBM50352850 CCn1cc(cn1)[C@]1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1F |r,t:9|
BDBM50352851 CCC(=O)c1cc(cs1)[C@]1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1F |r,t:11|
BDBM50352852 CCn1cc(cn1)[C@@]1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1F |r,t:9|
BDBM50352853 CN1C(N)=N[C@](C1=O)(c1cnn(CC(F)(F)F)c1)c1cccc(c1)-c1cccnc1F |r,c:3|
BDBM50352854 CCC(=O)c1cc(cs1)[C@@]1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1F |r,t:11|
BDBM50352855 CN1C(N)=NC(C1=O)(c1cnn(C)c1)c1cccc(c1)-c1cncnc1 |c:3|
BDBM50352856 CCn1cc(cn1)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cncnc1 |t:9|
BDBM50352857 CCn1cc(cn1)C1(N=C(N)N(C)C1=O)c1ccc(F)c(c1)-c1cncnc1 |t:9|
BDBM50352858 CN1C(N)=NC(C1=O)(c1cnn(CC(F)(F)F)c1)c1ccc(F)c(c1)-c1cncnc1 |c:3|
BDBM50352859 CC(C)n1cc(cn1)C1(N=C(N)N(C)C1=O)c1ccc(F)c(c1)-c1cncnc1 |t:10|
BDBM50352860 CC(C)Cn1cc(cn1)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cncnc1 |t:11|
BDBM50352861 CC(C)CCn1cc(cn1)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cncnc1 |t:12|
BDBM50352862 CN1C(N)=NC(C1=O)(c1cnn(CCC(C)(C)C)c1)c1cccc(c1)-c1cncnc1 |c:3|
BDBM50352863 CCCCn1cc(cn1)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cncnc1 |t:11|
BDBM50352864 CN1C(N)=NC(C1=O)(c1cnn(c1)C1CCCC1)c1cccc(c1)-c1cncnc1 |c:3|
BDBM50352865 CN1C(N)=NC(C1=O)(c1cnn(CCC2CCCCC2)c1)c1cccc(c1)-c1cncnc1 |c:3|
BDBM50352866 CN1C(N)=NC(C1=O)(c1ccsc1)c1ccc(F)c(c1)-c1cccnc1 |c:3|
BDBM50352867 CN1C(N)=NC(C1=O)(c1ccsc1)c1ccc(F)c(c1)-c1cccnc1F |c:3|
BDBM50352868 CCn1cc(cn1)C1(N=C(N)N(C)C1=O)c1ccc(F)c(c1)-c1cccnc1F |t:9|
BDBM50352869 CN1C(N)=NC(C1=O)(c1cnn(CCF)c1)c1cccc(c1)-c1cccnc1F |c:3|
BDBM50352870 CC(C)n1cc(cn1)C1(N=C(N)N(C)C1=O)c1ccc(F)c(c1)-c1cccnc1F |t:10|
BDBM50352871 CC(C)Cn1cc(cn1)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1F |t:11|
BDBM50352872 CC(C)CCn1cc(cn1)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1F |t:12|
BDBM50352873 CN1C(N)=NC(C1=O)(c1cnn(CCC(C)(C)C)c1)c1cccc(c1)-c1cccnc1F |c:3|
BDBM50352874 CCC(CC)Cn1cc(cn1)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1F |t:13|
BDBM50352875 CCCCn1cc(cn1)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cccnc1F |t:11|
BDBM50352876 CN1C(N)=NC(C1=O)(c1cnn(c1)C1CCCC1)c1cccc(c1)-c1cccnc1F |c:3|
BDBM50352877 CN1C(N)=NC(C1=O)(c1ccsc1)c1cccc(c1)-c1cncnc1 |c:3|
BDBM50352878 CN1C(N)=NC(C1=O)(c1csc(C)c1)c1cccc(c1)-c1cncnc1 |c:3|
BDBM50352879 CN1C(N)=NC(C1=O)(c1ccsc1C)c1cccc(c1)-c1cncnc1 |c:3|
BDBM50352880 CCc1cc(cs1)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cncnc1 |t:9|
BDBM50352881 CCc1cc(c(C)s1)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cncnc1 |t:10|
BDBM50352882 CN1C(N)=NC(C1=O)(c1csc(Cl)c1)c1cccc(c1)-c1cncnc1 |c:3|
BDBM50352883 CN1C(N)=NC(C1=O)(c1cc(C)sc1Cl)c1cccc(c1)-c1cncnc1 |c:3|
BDBM50352884 CCC(=O)c1cc(cs1)C1(N=C(N)N(C)C1=O)c1cccc(c1)-c1cncnc1 |t:11|
BDBM50352885 CN1C(N)=NC(C1=O)(c1ccsc1)c1cccc(c1)-c1cccnc1 |c:3|
BDBM50352886 CN1C(N)=NC(C1=O)(c1ccsc1)c1cccc(c1)-c1cccnc1F |c:3|
BDBM50351914 Cc1ccccc1-c1ccc2nc(N)ccc2c1
BDBM50360723 Clc1ccc2c(CCC[C@]22CNC[C@H]2C(=O)N2CC[C@H](C[C@H]2C2CCCCC2)c2ccccc2)n1 |r|
BDBM50362528 [O-][N+](=O)c1cccc(c1)C(=O)Cn1c(nc2ccccc12)-c1ccccn1
BDBM50362529 Oc1ccc(cc1O)C(=O)Cn1c(nc2ccccc12)-c1ccccn1
BDBM50362530 Clc1ccc(cc1)C(=O)Cn1c(nc2ccccc12)-c1ccccn1
BDBM50362531 [O-][N+](=O)c1ccccc1C(=O)Cn1c(nc2ccccc12)-c1ccccn1
BDBM50362532 [O-][N+](=O)c1ccc(cc1)C(=O)Cn1c(nc2ccccc12)-c1ccccn1
BDBM50362533 Fc1ccc(cc1)C(=O)Cn1c(nc2ccccc12)-c1ccccn1
BDBM50362534 Fc1ccc(C(=O)Cn2c(nc3ccccc23)-c2ccccn2)c(F)c1
BDBM50362535 O=C(Cn1c(nc2ccccc12)-c1ccccn1)c1ccccc1
BDBM50362536 O=C(Cn1c(nc2ccccc12)-c1ccccn1)c1ccc(cc1)-c1ccccc1
BDBM50362537 COc1ccc(cc1)C(=O)Cn1c(nc2ccccc12)-c1ccccn1
BDBM50362538 COc1ccc(OC)c(c1)C(=O)Cn1c(nc2ccccc12)-c1ccccn1
BDBM50373799 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)N1CCCC1=O)N1CCCC1)C(=O)NC1CCCCC1
BDBM50373800 CC(C)Oc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@@H](C)C(=O)NC1CCCCC1)N1CCCC1=O
BDBM50373801 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1ccc(NC(C)=O)cc1)C(=O)NC1CCCCC1
BDBM50373804 CCCc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@@H](C)C(=O)NC1CCCCC1)N1CCCC1=O
BDBM50373805 CC(C)CNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@@H](C)C(=O)NC1CCCCC1)N1CCCC1=O
BDBM50373806 CC(C)Nc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@@H](C)C(=O)NC1CCCCC1)N1CCCC1=O
BDBM50373807 CCCOc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@@H](C)C(=O)NC1CCCCC1)N1CCCC1=O
BDBM50373808 CCOc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@@H](C)C(=O)NC1CCCCC1)N1CCCC1
BDBM50373809 CCCCCOc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@@H](C)C(=O)NC1CCCCC1)N1CCCC1=O
BDBM50373810 CCOc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@@H](C)C(=O)NC1CCCCC1)N1CCCC1=O
BDBM50373811 COc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@@H](C)C(=O)NC1CCCCC1)N1CCCC1=O
BDBM50373812 CCCCCS(=O)(=O)c1cccc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@@H](C)C(=O)NC1CCCCC1 |r|
BDBM50373813 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)N1CCCS1(=O)=O)C(=O)NC1CCCCC1
BDBM50372181 CCCN(CCC)C(=O)c1cc(C)cc(c1)C(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)[C@H]1C[C@H](CN1)Oc1ccccc1 |r|
BDBM50372238 N=C(NCCCC#N)NC(=O)Cn1c(ccc1C12CC3CC(CC(C3)C1)C2)-c1ccccc1 |TLB:16:17:20.19.24:22,THB:18:19:22:26.17.25,18:17:20.19.24:22,25:17:20:24.23.22,25:23:20:26.18.17,16:17:20:24.23.22|
BDBM50372239 N=C(NCCc1ccsc1)NC(=O)Cn1c(ccc1C12CC3CC(CC(C3)C1)C2)-c1ccccc1 |TLB:18:19:22.21.26:24,THB:20:21:24:28.19.27,20:19:22.21.26:24,27:19:22:26.25.24,27:25:22:28.20.19,18:19:22:26.25.24|
BDBM50372240 Nc1cccc(CNC(=N)NC(=O)Cn2c(ccc2C23CC4CC(CC(C4)C2)C3)-c2ccccc2)c1 |TLB:18:19:22.21.26:24,THB:20:21:24:28.19.27,20:19:22.21.26:24,27:19:22:26.25.24,27:25:22:28.20.19,18:19:22:26.25.24|
BDBM50372241 N=C(NCCc1cccs1)NC(=O)Cn1c(ccc1C12CC3CC(CC(C3)C1)C2)-c1ccccc1 |TLB:18:19:22.21.26:24,THB:20:21:24:28.19.27,20:19:22.21.26:24,27:19:22:26.25.24,27:25:22:28.20.19,18:19:22:26.25.24|
BDBM50372242 Cc1csc(CNC(=N)NC(=O)Cn2c(ccc2C23CC4CC(CC(C4)C2)C3)-c2ccccc2)n1 |TLB:17:18:21.20.25:23,THB:19:20:23:27.18.26,19:18:21.20.25:23,26:18:21:25.24.23,26:24:21:27.19.18,17:18:21:25.24.23|
BDBM50372243 Cc1nnc(CNC(=N)NC(=O)Cn2c(ccc2C23CC4CC(CC(C4)C2)C3)-c2ccccc2)o1 |TLB:17:18:21.20.25:23,THB:19:20:23:27.18.26,19:18:21.20.25:23,26:18:21:25.24.23,26:24:21:27.19.18,17:18:21:25.24.23|
BDBM50372244 N=C(NC1CCCCC1)NC(=O)Cn1c(ccc1C12CC3CC(CC(C3)C1)C2)-c1ccccc1 |TLB:17:18:21.20.25:23,THB:19:20:23:27.18.26,19:18:21.20.25:23,26:18:21:25.24.23,26:24:21:27.19.18,17:18:21:25.24.23|
BDBM50372246 N=C(NCCCn1ccnc1)NC(=O)Cn1c(ccc1C12CC3CC(CC(C3)C1)C2)-c1ccccc1 |TLB:19:20:23.22.27:25,THB:21:22:25:29.20.28,21:20:23.22.27:25,28:20:23:27.26.25,28:26:23:29.21.20,19:20:23:27.26.25|
BDBM50372247 OCC(O)CNC(=N)NC(=O)Cn1c(ccc1C12CC3CC(CC(C3)C1)C2)-c1ccccc1 |TLB:16:17:20.19.24:22,THB:18:19:22:26.17.25,18:17:20.19.24:22,25:17:20:24.23.22,25:23:20:26.18.17,16:17:20:24.23.22|
BDBM50372248 C[C@H](O)CNC(=N)NC(=O)Cn1c(ccc1C12CC3CC(CC(C3)C1)C2)-c1ccccc1 |TLB:15:16:19.18.23:21,THB:17:18:21:25.16.24,17:16:19.18.23:21,24:16:19:23.22.21,24:22:19:25.17.16,15:16:19:23.22.21|
BDBM50372249 C[C@@H](O)CNC(=N)NC(=O)Cn1c(ccc1C12CC3CC(CC(C3)C1)C2)-c1ccccc1 |TLB:15:16:19.18.23:21,THB:17:18:21:25.16.24,17:16:19.18.23:21,24:16:19:23.22.21,24:22:19:25.17.16,15:16:19:23.22.21|
BDBM50372250 OCCCCNC(=N)NC(=O)Cn1c(ccc1C12CC3CC(CC(C3)C1)C2)-c1ccccc1 |TLB:16:17:20.19.24:22,THB:18:19:22:26.17.25,18:17:20.19.24:22,25:17:20:24.23.22,25:23:20:26.18.17,16:17:20:24.23.22|
BDBM50372251 N=C(NCCC#N)NC(=O)Cn1c(ccc1C12CC3CC(CC(C3)C1)C2)-c1ccccc1 |TLB:15:16:19.18.23:21,THB:17:18:21:25.16.24,17:16:19.18.23:21,24:16:19:23.22.21,24:22:19:25.17.16,15:16:19:23.22.21|
BDBM50372252 OCCNC(=N)NC(=O)Cn1c(ccc1C12CC3CC(CC(C3)C1)C2)-c1ccccc1 |TLB:14:15:18.17.22:20,THB:16:17:20:24.15.23,16:15:18.17.22:20,23:15:18:22.21.20,23:21:18:24.16.15,14:15:18:22.21.20|
BDBM50372198 CCCN(CCC)C(=O)c1cc(C)cc(c1)C(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)[C@H]1C[C@H](CN1)OCc1ccccc1 |r|
BDBM50025519 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C(C)C)C(C)C
BDBM50017485 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C
BDBM50377858 CN(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CN(CCc3ccccc3)C(=O)N2)c1
BDBM50377859 CC(C)(C)c1cccc(CNC[C@@H](O)[C@H](Cc2cc(F)cc(F)c2)NC(=O)[C@@H]2CN(Cc3cc(F)cc(F)c3)C(=O)N2)c1
BDBM50377837 CN(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CN(Cc3ccccc3)C(=O)N2)c1
BDBM50377838 CN(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CC(Cc3ccccc3)C(=O)N2)c1 |w:26.27|
BDBM50377839 CN(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CN(Cc3ccccc3)C(=O)C2)c1
BDBM50377840 CN(C)c1cccc(CNC[C@@H](O)[C@H](Cc2cc(F)cc(F)c2)NC(=O)[C@@H]2CN(Cc3ccccc3)C(=O)N2)c1
BDBM50377841 CC(C)(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CN(Cc3cc(F)cc(F)c3)C(=O)N2)c1
BDBM50377842 O[C@H](CNCc1cccc(OC(F)(F)F)c1)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CN(Cc2ccccc2)C(=O)N1
BDBM50377843 O[C@H](CNCc1cccc(c1)C(F)(F)F)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CN(Cc2ccccc2)C(=O)N1
BDBM50377844 CN(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CN(Cc3ccc(cc3)C(F)(F)F)C(=O)N2)c1
BDBM50377845 CN(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CN(Cc3ccccc3C(F)(F)F)C(=O)N2)c1
BDBM50377846 CN(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CN(Cc3cc(F)c(F)cc3F)C(=O)N2)c1
BDBM50377847 CN(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CN(Cc3cc(F)cc(F)c3)C(=O)N2)c1
BDBM50377848 CN(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CN(Cc3ccc(F)cc3F)C(=O)N2)c1
BDBM50377849 CN(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CN(Cc3ccc(F)c(F)c3)C(=O)N2)c1
BDBM50377850 CN(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CN(Cc3ccc(F)cc3)C(=O)N2)c1
BDBM50377851 COc1cc(CN2C[C@H](NC2=O)C(=O)N[C@@H](Cc2ccccc2)[C@H](O)CNCc2cccc(c2)N(C)C)cc(OC)c1
BDBM50377852 COc1cccc(CN2C[C@H](NC2=O)C(=O)N[C@@H](Cc2ccccc2)[C@H](O)CNCc2cccc(c2)N(C)C)c1 |r|
BDBM50377853 CN(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CN(C(=O)N2)c2ccccc2)c1
BDBM50377854 CN(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CN(C(=O)N2)c2cc(Br)cc(Br)c2)c1
BDBM50377855 CN(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@]2(Cc3ccccc3)CN(Cc3ccccc3)C(=O)N2)c1 |r|
BDBM50377856 CN(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@]2(C)CN(Cc3ccccc3)C(=O)N2)c1
BDBM50377857 CN(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CN(CCOc3ccccc3)C(=O)N2)c1
BDBM50377860 CC(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CN(Cc3cc(F)cc(F)c3)C(=O)N2)c1
BDBM50378120 CC(=O)NC(Cc1cc(F)cc(F)c1)C(O)CNC1(CCc2[nH]ncc2C1)c1cccc(c1)C(C)(C)C
BDBM50378121 CC(=O)NC(Cc1cc(F)cc(F)c1)C(O)CNC1(CCc2nc(N)ncc2C1)c1cccc(c1)C(C)(C)C
BDBM50378122 CC(=O)NC(Cc1cc(F)cc(F)c1)C(O)CNC1(CCc2nc(C)ncc2C1)c1cccc(c1)C(C)(C)C
BDBM50377587 Cc1cccc(c1)C(=O)NNc1c2ccccc2nc2c(C)c(C)ccc12
BDBM50377588 Cc1ccc2c(NNC(=O)c3ccccc3O)c3ccccc3nc2c1C
BDBM50368157 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)CCCCCN)C(=O)NCc1cnc(C)nc1N |r|
BDBM50368956 CCCC[C@H](OP(O)(=O)CCCc1ccccc1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CC(=O)N[C@H]([C@@H](C)CC)C(=O)NCc1cnc(C)nc1N
BDBM50368239 CN1CCC([C@@H](O)[C@H](CC2CCCCC2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O |r|
BDBM50368240 CN1CC[C@H]([C@H](O)[C@H](CC2CCCCC2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O |r|
BDBM50212827 CC[C@H](C)[C@H](NC(=O)[C@H](C(C)C)[C@@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)COc1cccc2ccccc12)C(=O)NCc1ccccn1
BDBM50368310 C[C@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(O)C(F)(F)C(=O)NCCN1CCOCC1
BDBM50368786 CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NC(C)C
BDBM50368788 CCOC(=O)CC(O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)[C@H](C)CC
BDBM50368795 CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)N(C)CC(C)C
BDBM50368797 CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)CC(O)=O
BDBM50368798 CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NCCC(C)C
BDBM50368799 CC[C@@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1cccc2ccccc12)[C@@H](O)[C@@H](O)CC(C)C
BDBM50368801 CC[C@@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(O)=O)[C@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)CC(=O)N[C@@H](C(C)C)C(O)=O
BDBM50368802 CC[C@@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)CCC(O)=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C
BDBM50368803 CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C
BDBM50368806 CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NC[C@@H](C)O
BDBM50368810 CC[C@@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)NCCN1CCOCC1
BDBM50368814 CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NCCCCCCO
BDBM50368815 CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](Cc1cccc2ccccc12)[C@@H](O)[C@@H](O)CC(C)C
BDBM50368816 CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)CC(=O)N[C@@H](C(C)C)C(O)=O
BDBM50368155 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](C)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CCCN(C)C)C(=O)NCc1cnc(C)nc1N |r|
BDBM50368156 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)CC(C)(C)N)C(=O)NCc1cnc(C)nc1N |r|
BDBM50398284 COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1cc(Cl)c(C)cc1F |c:18|
BDBM50398285 COc1ccc(cc1)C1(COC(N)=N1)c1cccc(c1)-c1cccnc1F |c:13|
BDBM50398286 COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1ccncc1 |c:18|
BDBM50398287 COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1cccc(OC(F)(F)F)c1 |c:18|
BDBM50398288 COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1ccccc1 |c:18|
BDBM50398289 COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1cccc(Cl)c1 |c:18|
BDBM50398290 COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1ccccc1Cl |c:18|
BDBM50398291 COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1ccc(Cl)cc1 |c:18|
BDBM50398292 COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1ccc(Cl)cc1F |c:18|
BDBM50398293 COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1cccc(OC)c1F |c:18|
BDBM50398294 COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1ccnc(Cl)c1 |c:18|
BDBM50398295 COc1ccc(cc1)C1(COC(N)=N1)c1cccc(c1)-c1cccc(Cl)c1 |c:13|
BDBM50398296 COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1cccnc1F |c:18|
BDBM50398297 COc1ccc(cc1)C1(COC(N)=N1)c1cccc(c1)-c1cc(Cl)ccc1F |c:13|
BDBM50398299 COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1ccc(C)cc1 |c:18|
BDBM50398300 NC1=N[C@](CO1)(c1ccc(OC(F)F)cc1)c1cccc(c1)-c1cccnc1F |r,t:1|
BDBM50398301 COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1cccc(C)c1 |c:18|
BDBM50398302 COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1cncnc1 |c:18|
BDBM50398303 COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1cnccc1F |c:18|
BDBM50398304 COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1cccc(Cl)c1F |c:18|
BDBM50398306 COc1ccc(F)c(c1)-c1ccc2Oc3ccc(OC)cc3C3(COC(N)=N3)c2c1 |c:28|
BDBM50398307 COc1ccc2Oc3ccc(cc3[C@@]3(COC(N)=N3)c2c1)-c1cncnc1 |r,c:18|
BDBM50398308 COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1cc(Cl)ccc1F |c:18|
BDBM50398310 CCCOc1ccc2Oc3ccc(cc3[C@@]3(COC(N)=N3)c2c1)-c1cncnc1 |r,c:20|
BDBM50398311 CC(C)COc1ccc2Oc3ccc(cc3[C@@]3(COC(N)=N3)c2c1)-c1cncnc1 |r,c:21|
BDBM50398313 COc1ccc2Oc3ccc(cc3[C@]3(COC(N)=N3)c2c1)-c1cncnc1 |r,c:18|
BDBM50398314 COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1ccc(OC(F)(F)F)cc1 |c:18|
BDBM50398315 COc1ccc(cc1)C1(COC(N)=N1)c1cccc(c1)-c1cncnc1 |c:13|
BDBM50398316 COc1ccc(cc1)C1(COC(N)=N1)c1cccc(c1)-c1cccnc1 |c:13|
BDBM50398317 COc1ccc(cc1)C1(COC(N)=N1)c1cccc(c1)-c1ccc(F)nc1 |c:13|
BDBM50398318 COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1ccccc1C |c:18|
BDBM50398473 CCC[C@H](O)[C@H](NC[C@H](Cc1ccccc1)NC(=O)c1cc2N(C)S(=O)(=O)CCn3cc(CC)c(c1)c23)C(=O)NCC(C)C |r|
BDBM50398474 CCc1cn2CCS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@H](CN[C@@H]([C@H](C)O)C(=O)NCC(C)C)Cc1ccccc1 |r|
BDBM50398475 CC(C)CNC(=O)[C@@H](NC[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)[C@H](C)O |r|
BDBM50398476 CC[C@H](NC[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(=O)NCC(C)C |r|
BDBM50398471 CCC[C@H](O)[C@H](NC[C@H](Cc1ccccc1)NC(=O)c1cc2N(C)S(=O)(=O)C3(CC3)Cn3cc(CC)c(c1)c23)C(=O)NC(C)C |r|
BDBM50398472 CCC[C@H](O)[C@H](NC[C@H](Cc1ccccc1)NC(=O)c1cc2N(C)S(=O)(=O)C(C)(C)Cn3cc(CC)c(c1)c23)C(=O)NCC(C)C |r|
BDBM50390633 CCCCNC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)c1ccc(Oc2ccc(cc2)C(=O)NCCCNc2ccnc3cc(Cl)ccc23)cc1)[C@@H](C)CC |r|
BDBM50390634 CCCCNC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)c1ccc(Oc2ccc(cc2)C(=O)N[C@@H](C)C(=O)NCCCNc2ccnc3cc(Cl)ccc23)cc1)[C@@H](C)CC |r|
BDBM50390635 CCCCNC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)c1ccc(Oc2ccc(cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)NCCCNc2ccnc3ccccc23)cc1)[C@@H](C)CC |r|
BDBM50383837 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CC2(CCC2)Oc2ncc(CC(C)(C)C)cc12 |r|
BDBM50383838 CC(=O)N[C@@H](Cc1cccc(F)c1)[C@H](O)CN[C@H]1CC2(CCC2)Oc2ncc(CC(C)(C)C)cc12 |r|
BDBM50383839 CC(=O)N[C@@H](Cc1ccc(F)cc1)[C@H](O)CN[C@H]1CC2(CCC2)Oc2ncc(CC(C)(C)C)cc12 |r|
BDBM50383840 CC(=O)N[C@@H](CC=C)[C@H](O)CN[C@H]1CC2(CCC2)Oc2ncc(CC(C)(C)C)cc12 |r|
BDBM50383841 C[C@H]1CC[C@]11C[C@H](NC[C@@H](O)[C@H](Cc2ccc(F)cc2)NC(C)=O)c2cc(CC(C)(C)C)cnc2O1 |r|
BDBM50383842 C[C@@H]1CC[C@]11C[C@H](NC[C@@H](O)[C@H](Cc2ccc(F)cc2)NC(C)=O)c2cc(CC(C)(C)C)cnc2O1 |r|
BDBM50383843 C[C@H]1CC[C@@]11C[C@H](NC[C@@H](O)[C@H](Cc2ccc(F)cc2)NC(C)=O)c2cc(CC(C)(C)C)cnc2O1 |r|
BDBM50383844 C[C@H]1C[C@]2(C1)C[C@H](NC[C@@H](O)[C@H](Cc1ccc(F)cc1)NC(C)=O)c1cc(CC(C)(C)C)cnc1O2 |r,wU:6.7,1.0,wD:9.10,11.21,3.3,(1.21,-19.22,;.12,-20.31,;.12,-21.85,;-1.42,-21.85,;-1.42,-20.31,;-2.77,-21.09,;-4.11,-21.86,;-5.44,-21.1,;-6.77,-21.87,;-8.11,-21.11,;-8.12,-19.57,;-9.44,-21.88,;-9.43,-23.42,;-10.77,-24.2,;-12.11,-23.43,;-13.44,-24.21,;-13.43,-25.75,;-14.76,-26.53,;-12.08,-26.51,;-10.75,-25.73,;-10.78,-21.12,;-10.79,-19.58,;-12.13,-18.82,;-9.46,-18.8,;-4.09,-23.4,;-5.42,-24.17,;-5.43,-25.72,;-6.76,-26.49,;-6.76,-28.03,;-8.1,-28.8,;-5.43,-28.8,;-6.77,-29.56,;-4.09,-26.49,;-2.75,-25.72,;-2.75,-24.17,;-1.42,-23.4,)|
BDBM50383845 C[C@H]1C[C@@]2(C1)C[C@H](NC[C@@H](O)[C@H](Cc1ccc(F)cc1)NC(C)=O)c1cc(CC(C)(C)C)cnc1O2 |r,wU:6.7,wD:9.10,11.21,3.2,1.0,(16.09,-18.99,;15,-20.08,;13.46,-20.08,;13.46,-21.62,;15,-21.62,;12.11,-20.86,;10.77,-21.64,;9.43,-20.87,;8.1,-21.65,;6.77,-20.88,;6.76,-19.34,;5.44,-21.66,;5.44,-23.2,;4.11,-23.97,;2.78,-23.21,;1.45,-23.98,;1.46,-25.52,;.13,-26.3,;2.8,-26.29,;4.13,-25.51,;4.1,-20.9,;4.09,-19.36,;2.76,-18.59,;5.42,-18.58,;10.78,-23.18,;9.46,-23.95,;9.45,-25.49,;8.12,-26.26,;8.12,-27.8,;6.78,-28.57,;9.45,-28.57,;8.1,-29.34,;10.79,-26.26,;12.12,-25.49,;12.12,-23.95,;13.45,-23.17,)|
BDBM50383846 C[C@H]1C[C@]2(C1)C[C@H](NC[C@@H](O)[C@H](Cc1ccc(F)c(F)c1)NC(C)=O)c1cc(CC(C)(C)C)cnc1O2 |r,wU:6.7,1.0,wD:9.10,11.22,3.3,(31.56,-19.68,;30.47,-20.77,;30.47,-22.31,;28.93,-22.31,;28.93,-20.77,;27.59,-21.54,;26.25,-22.32,;24.91,-21.56,;23.58,-22.33,;22.25,-21.57,;22.24,-20.03,;20.91,-22.34,;20.92,-23.88,;19.59,-24.66,;19.61,-26.19,;18.28,-26.97,;16.93,-26.21,;15.61,-26.99,;16.93,-24.67,;15.59,-23.9,;18.26,-23.89,;19.58,-21.58,;19.57,-20.04,;18.23,-19.28,;20.9,-19.26,;26.26,-23.86,;24.93,-24.63,;24.93,-26.18,;23.6,-26.95,;23.6,-28.49,;22.26,-29.25,;24.93,-29.26,;23.58,-30.02,;26.27,-26.95,;27.6,-26.18,;27.6,-24.63,;28.93,-23.86,)|
BDBM50383847 C[C@H]1C[C@@]2(C1)C[C@H](NC[C@@H](O)[C@H](Cc1ccc(F)c(F)c1)NC(C)=O)c1cc(CC(C)(C)C)cnc1O2 |r,wU:6.7,wD:9.10,11.22,3.2,1.0,(46.38,-21.19,;45.29,-22.27,;43.75,-22.27,;43.75,-23.81,;45.29,-23.81,;42.41,-23.05,;41.07,-23.83,;39.73,-23.06,;38.4,-23.84,;37.06,-23.08,;37.06,-21.54,;35.73,-23.85,;35.74,-25.39,;34.41,-26.17,;34.42,-27.7,;33.1,-28.48,;31.75,-27.72,;30.42,-28.5,;31.75,-26.18,;30.41,-25.41,;33.07,-25.4,;34.39,-23.09,;34.39,-21.55,;33.05,-20.78,;35.72,-20.77,;41.08,-25.37,;39.75,-26.14,;39.75,-27.69,;38.41,-28.45,;38.41,-29.99,;37.08,-30.76,;39.74,-30.77,;38.4,-31.53,;41.08,-28.46,;42.42,-27.68,;42.42,-26.14,;43.75,-25.37,)|
BDBM50383848 CC(=O)N[C@@H](Cc1ccc(F)cc1)[C@H](O)CN[C@H]1C[C@@]2(C[C@H](F)C2)Oc2ncc(CC(C)(C)C)cc12 |r,wU:17.17,21.22,wD:13.14,4.3,19.24,(-13.45,-30.2,;-12.11,-30.97,;-10.78,-30.19,;-12.1,-32.51,;-10.76,-33.27,;-10.76,-34.81,;-12.1,-35.59,;-13.43,-34.82,;-14.76,-35.59,;-14.75,-37.14,;-16.08,-37.91,;-13.4,-37.9,;-12.08,-37.12,;-9.43,-32.5,;-9.44,-30.96,;-8.1,-33.26,;-6.77,-32.48,;-5.43,-33.25,;-4.09,-32.47,;-2.74,-33.23,;-1.2,-33.23,;-1.2,-31.69,;-.12,-30.6,;-2.74,-31.69,;-2.75,-34.79,;-4.08,-35.56,;-4.08,-37.1,;-5.41,-37.88,;-6.75,-37.1,;-8.08,-37.87,;-8.08,-39.41,;-9.42,-40.18,;-6.75,-40.18,;-8.1,-40.95,;-6.75,-35.56,;-5.42,-34.79,)|
BDBM50383849 CC(=O)N[C@@H](Cc1ccc(F)cc1)[C@H](O)CN[C@H]1C[C@]2(C[C@H](F)C2)Oc2ncc(CC(C)(C)C)cc12 |r,wU:17.17,wD:13.14,4.3,19.20,21.22,(1.87,-30.75,;3.21,-31.51,;4.54,-30.74,;3.21,-33.05,;4.55,-33.82,;4.56,-35.36,;3.23,-36.13,;1.89,-35.36,;.56,-36.14,;.57,-37.68,;-.76,-38.46,;1.92,-38.44,;3.24,-37.67,;5.88,-33.04,;5.87,-31.5,;7.22,-33.8,;8.55,-33.03,;9.89,-33.79,;11.23,-33.02,;12.57,-33.78,;12.57,-32.24,;14.11,-32.24,;15.2,-31.15,;14.11,-33.78,;12.57,-35.33,;11.24,-36.1,;11.24,-37.65,;9.9,-38.42,;8.57,-37.65,;7.23,-38.42,;7.23,-39.96,;5.9,-40.73,;8.56,-40.73,;7.22,-41.49,;8.57,-36.1,;9.9,-35.33,)|
BDBM50383850 CC(=O)N[C@@H](Cc1cccc(F)c1)[C@H](O)CN[C@H]1C[C@@]2(C[C@H](F)C2)Oc2ncc(CC(C)(C)C)cc12 |r,wU:17.17,21.22,wD:13.14,4.3,19.24,(17.15,-31.3,;18.49,-32.06,;19.82,-31.29,;18.5,-33.6,;19.83,-34.37,;19.84,-35.91,;18.51,-36.68,;17.18,-35.92,;15.85,-36.69,;15.85,-38.23,;17.2,-39,;17.21,-40.54,;18.52,-38.22,;21.16,-33.59,;21.16,-32.05,;22.5,-34.36,;23.83,-33.58,;25.17,-34.34,;26.51,-33.57,;27.85,-34.33,;29.39,-34.33,;29.39,-32.79,;30.48,-31.7,;27.85,-32.79,;27.85,-35.88,;26.52,-36.65,;26.52,-38.2,;25.18,-38.97,;23.85,-38.2,;22.52,-38.97,;22.51,-40.51,;21.18,-41.28,;23.85,-41.28,;22.5,-42.05,;23.85,-36.66,;25.18,-35.89,)|
BDBM50383851 CC(=O)N[C@@H](Cc1cccc(F)c1)[C@H](O)CN[C@H]1C[C@]2(C[C@H](F)C2)Oc2ncc(CC(C)(C)C)cc12 |r,wU:17.17,wD:13.14,4.3,19.20,21.22,(32.88,-32.05,;34.22,-32.82,;35.55,-32.04,;34.22,-34.36,;35.56,-35.12,;35.57,-36.66,;34.24,-37.44,;32.9,-36.67,;31.57,-37.45,;31.58,-38.99,;32.93,-39.75,;32.94,-41.29,;34.25,-38.97,;36.89,-34.35,;36.88,-32.81,;38.23,-35.11,;39.56,-34.33,;40.9,-35.1,;42.24,-34.32,;43.58,-35.08,;43.58,-33.54,;45.12,-33.54,;46.21,-32.46,;45.12,-35.08,;43.58,-36.64,;42.25,-37.41,;42.25,-38.95,;40.91,-39.73,;39.58,-38.96,;38.24,-39.72,;38.24,-41.26,;36.91,-42.03,;39.57,-42.04,;38.23,-42.8,;39.58,-37.41,;40.91,-36.64,)|
BDBM50383852 CC(=O)N[C@@H](Cc1ccc(F)cc1)[C@H](O)CN[C@H]1CC2(CC(F)(F)C2)Oc2ncc(CC(C)(C)C)cc12 |r|
BDBM50383853 CC(=O)N[C@@H](Cc1ccc(F)cc1)[C@H](O)CN[C@H]1C[C@@]2(C[C@H](O)C2)Oc2ncc(CC(C)(C)C)cc12 |r,wU:17.17,21.22,wD:13.14,4.3,19.24,(2.1,-42.18,;3.44,-42.95,;4.77,-42.17,;3.45,-44.49,;4.78,-45.25,;4.79,-46.79,;3.46,-47.56,;2.13,-46.8,;.8,-47.57,;.8,-49.11,;-.53,-49.89,;2.15,-49.88,;3.47,-49.1,;6.11,-44.47,;6.11,-42.93,;7.45,-45.24,;8.78,-44.46,;10.12,-45.23,;11.46,-44.45,;12.8,-45.21,;14.34,-45.21,;14.34,-43.67,;15.43,-42.58,;12.8,-43.67,;12.8,-46.76,;11.47,-47.54,;11.47,-49.08,;10.13,-49.85,;8.8,-49.08,;7.47,-49.85,;7.46,-51.39,;6.13,-52.16,;8.8,-52.16,;7.45,-52.93,;8.8,-47.54,;10.13,-46.77,)|
BDBM50383854 CC(=O)N[C@@H](Cc1ccc(F)cc1)[C@H](O)CN[C@H]1C[C@]2(C[C@H](O)C2)Oc2ncc(CC(C)(C)C)cc12 |r,wU:17.17,wD:13.14,4.3,19.20,21.22,(16.97,-42.9,;18.31,-43.67,;19.64,-42.89,;18.32,-45.21,;19.65,-45.97,;19.66,-47.51,;18.33,-48.29,;17,-47.52,;15.67,-48.3,;15.67,-49.84,;14.35,-50.62,;17.02,-50.6,;18.35,-49.82,;20.99,-45.2,;20.98,-43.66,;22.32,-45.96,;23.65,-45.18,;24.99,-45.95,;26.33,-45.17,;27.67,-45.93,;27.67,-44.39,;29.21,-44.39,;30.3,-43.31,;29.21,-45.93,;27.67,-47.49,;26.34,-48.26,;26.34,-49.8,;25.01,-50.58,;23.67,-49.81,;22.34,-50.57,;22.34,-52.11,;21,-52.88,;23.67,-52.89,;22.32,-53.65,;23.67,-48.26,;25,-47.49,)|
BDBM50383855 COCC(=O)N[C@@H](Cc1ccc(F)cc1)[C@H](O)CN[C@H]1C[C@]2(C[C@H](O)C2)Oc2ncc(CC(C)(C)C)cc12 |r,wU:19.19,wD:15.16,6.5,21.22,23.24,(30.27,-40.49,;31.6,-41.26,;31.61,-42.8,;32.95,-43.56,;34.28,-42.78,;32.96,-45.1,;34.29,-45.86,;34.3,-47.4,;32.97,-48.18,;31.64,-47.41,;30.31,-48.19,;30.31,-49.73,;28.98,-50.51,;31.66,-50.49,;32.98,-49.71,;35.62,-45.09,;35.62,-43.55,;36.96,-45.85,;38.29,-45.08,;39.63,-45.84,;40.97,-45.06,;42.31,-45.83,;42.31,-44.29,;43.85,-44.29,;44.94,-43.2,;43.85,-45.83,;42.31,-47.38,;40.98,-48.15,;40.98,-49.7,;39.64,-50.47,;38.31,-49.7,;36.97,-50.47,;36.97,-52.01,;35.64,-52.77,;38.31,-52.78,;36.96,-53.54,;38.31,-48.15,;39.64,-47.38,)|
BDBM50383856 CC(C)(C)Cc1cnc2O[C@@]3(C[C@H](O)C3)C[C@H](NC[C@@H](O)[C@H](Cc3ccc(F)cc3)NC(=O)CF)c2c1 |r,wU:16.17,wD:19.20,21.31,10.10,12.12,(-3.79,-4.61,;-2.45,-3.84,;-1.12,-4.61,;-2.47,-5.37,;-2.45,-2.3,;-1.12,-1.53,;.22,-2.3,;1.55,-1.53,;1.55,.02,;2.88,.79,;2.89,2.34,;2.89,3.88,;4.43,3.88,;5.52,4.97,;4.43,2.34,;1.54,3.1,;.2,2.33,;-1.14,3.09,;-2.47,2.32,;-3.8,3.08,;-3.81,4.62,;-5.13,2.3,;-5.13,.76,;-6.46,-.01,;-7.79,.76,;-9.12,-.02,;-9.11,-1.56,;-10.44,-2.34,;-7.77,-2.32,;-6.44,-1.55,;-6.47,3.07,;-6.48,4.61,;-5.15,5.38,;-7.81,5.37,;-7.82,6.91,;.21,.79,;-1.11,.02,)|
BDBM50383857 CC(=O)N[C@@H](CC=C)[C@H](O)CN[C@H]1C[C@]2(C[C@H](O)C2)Oc2ncc(CC(C)(C)C)cc12 |r,wU:12.11,wD:8.8,4.3,14.14,16.16,(9.62,4.78,;10.96,4.02,;12.29,4.79,;10.97,2.48,;12.3,1.71,;12.31,.17,;10.98,-.6,;9.65,.16,;13.64,2.49,;13.63,4.03,;14.97,1.72,;16.3,2.5,;17.64,1.74,;18.98,2.51,;20.32,1.75,;20.32,3.29,;21.86,3.29,;22.95,4.38,;21.86,1.75,;20.32,.2,;18.99,-.57,;18.99,-2.12,;17.66,-2.89,;16.32,-2.12,;14.99,-2.89,;14.99,-4.43,;13.65,-5.2,;16.32,-5.2,;14.97,-5.97,;16.32,-.58,;17.65,.2,)|
BDBM50383858 C[C@@H]1CC[C@@]11C[C@H](NC[C@@H](O)[C@H](Cc2ccc(F)cc2)NC(C)=O)c2cc(CC(C)(C)C)cnc2O1 |r|
BDBM50388743 OC(CCn1c2ccccc2c2ccccc12)CSc1ccc2ccccc2c1
BDBM50388744 OC(CSc1ccccc1Cl)Cn1c2CCCCc2c2ccccc12
BDBM50388745 CCc1cccc2ccn(CC(O)CSc3ccccc3Cl)c12
BDBM50388746 OC(CSc1ccc2ccccc2c1)Cn1c2ccccc2c2ccccc12
BDBM50388747 OC(CSc1ccc2ccccc2c1)Cn1c(cc2ccccc12)-c1ccccc1
BDBM50388748 OC(COc1ccc(Cc2ccccc2)cc1)CSc1ccccc1Cl
BDBM50388749 C(CSc1ccc2ccccc2c1)Cn1c2ccccc2c2ccccc12
BDBM50388750 O[C@H](CSc1ccc2ccccc2c1)Cn1c2ccccc2c2ccccc12 |r|
BDBM50388751 O[C@@H](CSc1ccc2ccccc2c1)Cn1c2ccccc2c2ccccc12 |r|
BDBM50388754 NCCNC(CSc1ccc2ccccc2c1)Cn1c2ccccc2c2ccccc12
BDBM50388756 OC(CCSc1ccc2ccccc2c1)Cn1c2ccccc2c2ccccc12
BDBM50388758 OC(Cn1c2ccccc2c2ccccc12)Cn1c2ccccc2c2ccccc12
BDBM50388761 OC(Cn1c2ccccc2c2ccccc12)C(O)Cn1c2ccccc2c2ccccc12
BDBM50388766 OC(CSc1ccccc1F)Cn1c2ccccc2c2ccccc12
BDBM50392774 CCc1ccc2OC3(CCC3)C[C@H](NC[C@@H](O)[C@H](Cc3ccccc3)NC(C)=O)c2c1 |r|
BDBM50392776 CC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@H]1CC2(CCC2)Oc2ncc(CC(C)(C)C)cc12 |r|
BDBM50393886 CC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@H]1CC(C)(C)Cn2nc(CC(C)(C)C)cc12 |r|
BDBM50393887 CC(C)Cn1cc2[C@H](CC(C)(C)Cc2n1)NC[C@@H](O)[C@H](Cc1ccccc1)NC(C)=O |r|
BDBM50393888 CC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CC(C)(C)Cc2nn(CC(C)(C)C)cc12 |r|
BDBM50393889 CC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN[C@H]1CC(C)(C)Oc2ccc(CC(C)(C)C)cc12 |r|
BDBM50393890 CC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CC(C)(C)Cc2nc(CC(C)(C)C)[nH]c12 |r|
BDBM50393891 CC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CC(C)(C)Cc2oc(CC(C)(C)C)nc12 |r|
BDBM50393892 CC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CC(C)(C)Oc2sc(CC(C)(C)C)cc12 |r|
BDBM50393893 CC(C)Cn1cc2[C@@H](CC(C)(C)Cc2n1)NC[C@@H](O)[C@H](Cc1ccccc1)NC(C)=O |r|
BDBM50392953 CC[C@H](C[C@H](O)[C@@H](N)CN1CC(=O)N(CC1(C)C)c1ccccc1Cl)C(=O)NC1C2CC3CC1CC(O)(C3)C2 |r,wU:4.4,2.2,wD:6.6,TLB:38:35:28.29.30:32,36:35:28:30.31.32,27:28:34.38.35:30.31.32,27:28:32:34.35.37,THB:38:29:32:34.35.37,37:35:28:30.31.32,37:31:28:34.38.35,(13.51,-6.54,;12.17,-7.31,;12.17,-8.85,;10.84,-9.62,;9.51,-8.85,;9.51,-7.31,;8.17,-9.62,;6.84,-8.85,;8.17,-11.16,;6.84,-11.93,;5.5,-11.17,;4.16,-11.94,;2.83,-11.17,;4.18,-13.47,;5.51,-14.24,;6.84,-13.48,;7.61,-14.81,;8.38,-13.48,;2.85,-14.25,;1.51,-13.49,;.18,-14.26,;.18,-15.8,;1.52,-16.57,;2.85,-15.8,;4.19,-16.57,;13.51,-9.62,;13.51,-11.16,;14.84,-8.86,;16.17,-9.63,;17.67,-9.21,;17.67,-7.62,;18.71,-6.39,;17.36,-6.87,;17.37,-8.35,;18.7,-8.84,;20.09,-8.5,;21.42,-9.26,;20.1,-6.97,;19.08,-9.77,)|
BDBM50386478 N[C@H]1CS(=O)(=O)C[C@@H](Cc2cc(F)c(N)c(OC(C(F)(F)F)C(F)(F)F)c2)[C@@H]1O |r|
BDBM50386479 CC(C)(C)O[C@H]1C[C@@H]1CN[C@H]1CS(=O)(=O)C[C@@H](Cc2cc(F)c(N)c(OC(C(F)(F)F)C(F)(F)F)c2)[C@@H]1O |r|
BDBM50386480 CC(C)(C)c1ccnc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(OC(C(F)(F)F)C(F)(F)F)c3)[C@@H]2O)c1 |r|
BDBM50386481 CC(C)(O)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(OC(C(F)(F)F)C(F)(F)F)c3)[C@@H]2O)c1 |r|
BDBM50386482 CC(C)(CO)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(OC(C(F)(F)F)C(F)(F)F)c3)[C@@H]2O)c1 |r|
BDBM50386483 CC1(C)OCc2ccc(CN[C@H]3CS(=O)(=O)C[C@@H](Cc4cc(F)c(N)c(OC(C(F)(F)F)C(F)(F)F)c4)[C@@H]3O)cc12 |r|
BDBM50386484 Nc1c(F)cc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(OC(F)(F)F)c3)[C@H]2O)cc1OC(C(F)(F)F)C(F)(F)F |r|
BDBM50386485 CC(C)(C)Cn1cc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(OC(C(F)(F)F)C(F)(F)F)c3)[C@@H]2O)cn1 |r|
BDBM50386486 CC(C)(C)Cc1cc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(OC(C(F)(F)F)C(F)(F)F)c3)[C@@H]2O)no1 |r|
BDBM50386487 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(OC(C(F)(F)F)C(F)(F)F)c3)[C@@H]2O)c1 |r|
BDBM50386488 CN(C)CC(=O)Nc1ccc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)(C)C)[C@H]2O)cc1F |r|
BDBM50386489 CCc1cc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)(C)C)[C@H]2O)cc(F)c1N |r|
BDBM50386490 CCc1cc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)(C)C)[C@H]2O)cc(F)c1NC(C)=O |r|
BDBM50386491 CCc1cc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)(C)C)[C@H]2O)cc(F)c1NC(=O)CN(C)C |r|
BDBM50386492 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(c3)C3CC3)[C@@H]2O)c1 |r|
BDBM50386493 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(c3)-c3cc[nH]n3)[C@@H]2O)c1 |r|
BDBM50386494 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(c3)-c3ccoc3)[C@@H]2O)c1 |r|
BDBM50386495 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(CCC(F)(F)F)c3)[C@@H]2O)c1 |r|
BDBM50386496 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(C[C@H](O)C(F)(F)F)c3)[C@@H]2O)c1 |r|
BDBM50386497 CO[C@@H](Cc1cc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)(C)C)[C@H]2O)cc(F)c1N)C(F)(F)F |r|
BDBM50386498 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(c3)-c3ccco3)[C@@H]2O)c1 |r|
BDBM50386499 CCCOc1cccc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)(C)C)[C@H]2O)c1 |r|
BDBM50386500 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3ccc(N)c(OCC(F)(F)F)c3)[C@@H]2O)c1 |r|
BDBM50386501 CCCOc1cc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)(C)C)[C@H]2O)cc(F)c1N |r|
BDBM50386502 CCOc1cc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)(C)C)[C@H]2O)cc(F)c1N |r|
BDBM50386503 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(OC4CCC4)c3)[C@@H]2O)c1 |r|
BDBM50386504 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(OC4COC4)c3)[C@@H]2O)c1 |r|
BDBM50386505 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(O)c(N)c(F)c3)[C@@H]2O)c1 |r|
BDBM50386506 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(OCCF)c3)[C@@H]2O)c1 |r|
BDBM50386507 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(OCC(F)F)c3)[C@@H]2O)c1 |r|
BDBM50386508 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(OCC(F)(F)F)c3)[C@@H]2O)c1 |r|
BDBM50386509 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(OCCC(F)(F)F)c3)[C@@H]2O)c1 |r|
BDBM50386510 COCCOc1cc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)(C)C)[C@H]2O)cc(F)c1N |r|
BDBM50386511 CC(C)Oc1cc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)(C)C)[C@H]2O)cc(F)c1N |r|
BDBM50386512 C[C@@H](Oc1cc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)(C)C)[C@H]2O)cc(F)c1N)C(F)(F)F |r|
BDBM50386513 CCOC[C@@H](Oc1cc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)(C)C)[C@H]2O)cc(F)c1N)C(F)(F)F |r|
BDBM50386514 CCOC[C@H](Oc1cc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)(C)C)[C@H]2O)cc(F)c1N)C(F)(F)F |r|
BDBM50386515 COC[C@@H](Oc1cc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)(C)C)[C@H]2O)cc(F)c1N)C(F)(F)F |r|
BDBM50386516 COCCOC[C@@H](Oc1cc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)(C)C)[C@H]2O)cc(F)c1N)C(F)(F)F |r|
BDBM50386517 CCCOc1cc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)(C)C)[C@H]2O)ccc1N |r|
BDBM50386518 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3ccc(N)c(Br)c3)[C@@H]2O)c1 |r|
BDBM50386519 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3ccc4[nH]ccc4c3)[C@@H]2O)c1 |r|
BDBM50386520 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc4c(NCC44CCC4)c(F)c3)[C@@H]2O)c1 |r|
BDBM50386521 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3ccc4[nH]cc(CC(F)(F)F)c4c3)[C@@H]2O)c1 |r|
BDBM50386522 CCc1c[nH]c2ccc(C[C@@H]3CS(=O)(=O)C[C@H](NCc4cccc(c4)C(C)(C)C)[C@H]3O)cc12 |r|
BDBM50386523 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc4c(NCC44CCC(F)(F)CC4)c(F)c3)[C@@H]2O)c1 |r|
BDBM50386525 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3ccc(N)c(F)c3)[C@@H]2O)c1 |r|
BDBM50386526 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(Br)c3)[C@@H]2O)c1 |r|
BDBM50386527 CC(F)(F)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3cc(F)c(N)c(Br)c3)[C@@H]2O)c1 |r|
BDBM50386528 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3ccc(N)c(OC(F)(F)F)c3)[C@@H]2O)c1 |r|
BDBM50386529 CCCc1cc(C[C@@H]2CS(=O)(=O)C[C@H](NCc3cccc(c3)C(C)(C)C)[C@H]2O)cc(F)c1N |r|
BDBM50386530 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3ccc(N)nc3)[C@@H]2O)c1 |r|
BDBM50386531 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3ccc4[nH]ncc4c3)[C@@H]2O)c1 |r|
BDBM50386532 CCCc1n[nH]c2ccc(C[C@@H]3CS(=O)(=O)C[C@H](NCc4cccc(c4)C(C)(C)C)[C@H]3O)cc12 |r|
BDBM50386533 CC(C)(C)c1cccc(CN[C@H]2CS(=O)(=O)C[C@@H](Cc3ccc4[nH]cc(CC(F)F)c4c3)[C@@H]2O)c1 |r|
BDBM50407069 CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)N[C@@H](CC(N)=O)C(=O)NC[C@H](C)O
BDBM50407070 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)N(C)CCN(C)C)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C
BDBM50407071 CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C
BDBM50407072 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)NCCN(C)C
BDBM50407073 CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C1CCCCC1)C(=O)N[C@@H](CC(C)C)C(O)CC(O)=O
BDBM50407074 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NS(=O)(=O)N1CCN(C)CC1)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C
BDBM50407075 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)[C@@H](O)[C@@H](O)CC(C)C
BDBM50407076 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)NCC(C)C
BDBM50407077 CCOC(=O)C[C@@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)[C@@H](C)CC
BDBM50407078 CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NCC(C)C
BDBM50407079 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)C(O)CC(O)=O
BDBM50407080 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C
BDBM50407081 CCOC(=O)CC(O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C1CCCCC1)[C@@H](C)CC
BDBM50407082 CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)(C)C)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)C(O)CC(O)=O |r|
BDBM50407083 CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)N[C@@H](C(C)C)C(=O)NC(CC(N)=O)C(=O)NC[C@@H](C)O
BDBM50407084 CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NCC1CCCCC1
BDBM50407085 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)CC(=O)N[C@@H](C(C)C)C(O)=O
BDBM50407086 CCOC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@H](C)CC)[C@@H](C)CC
BDBM50407087 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)NCCc1ccccn1
BDBM50407088 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C
BDBM50407089 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(C)=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C
BDBM50407090 CCOC(=O)CC(O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)(C)C)NC(=O)OC(C)(C)C)[C@@H](C)CC |r|
BDBM50407091 CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(N)=O
BDBM50400207 COC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccccc1)N(C)C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O |r|
BDBM50400208 COC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccccc1)N(C)C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(NS(C)(=O)=O)cc(c1)C(=O)N[C@H](C)c1ccccc1 |r|
BDBM50400209 COC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccccc1)N(C)C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](N)C(C)C |r|
BDBM50400210 COC(=O)[C@@H](Cc1ccccc1)N(C)C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(C)=O |r|
BDBM50400211 COC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccccc1)N(C)C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(C)=O |r|
BDBM50400212 COC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccccc1)N(C)C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(C)=O |r|
BDBM50400213 COC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccccc1)N(C)C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C |r|
BDBM50400214 COC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccccc1)N(C)C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C |r|
BDBM50400215 COC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(=O)[C@H](C)O)C(C)C |r|
BDBM50400216 CC(C)C[C@H](NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(=O)[C@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N(C)[C@H](Cc1ccccc1)C(=O)NC(C)C |r|
BDBM50400217 CC(C)C[C@H](NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(=O)[C@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N(C)[C@H](Cc1ccccc1)C(=O)NCc1ccccc1 |r|
BDBM50400218 CC(C)C[C@H](NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(=O)[C@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N(C)[C@H](Cc1ccccc1)C(O)=O |r|
BDBM50400219 COC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccccc1)N(C)C(=O)[C@@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(=O)[C@H](C)O)C(C)C |r|
BDBM50400220 COC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)N(C)C(=O)[C@@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(=O)[C@H](C)O)C(C)C |r|
BDBM50400221 COC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccccc1)N(C)C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(=O)[C@H](C)O)C(C)C |r|
BDBM50400222 COC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)N(C)C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(=O)[C@H](C)O)C(C)C |r|
BDBM358 O[C@H]([C@@H](O)[C@@H](OCc1ccccc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@@H](OCc1ccccc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12
BDBM50405190 CC(C)C[C@H](NC(=O)CC(O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
BDBM577 CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)O[C@H]1CCOC1)S(=O)(=O)c1ccc(N)cc1 |r|
BDBM50427564 COCCCOc1cc(ccc1OC)C(=O)N(C[C@@H]1CNC[C@H]1Cc1ccccc1)C(C)C |r|
BDBM50427565 Clc1ccc(cc1)N(C[C@@H]1CNC[C@H]1Cc1ccccc1)c1ccccc1 |r|
BDBM50427040 COCCCCC1(CNC(=O)[C@@H]2CNC[C@@H](C2)NS(=O)(=O)c2ccc(C)cc2)c2ccccc2Oc2ccccc12 |r|
BDBM50432601 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1F |r,c:6|
BDBM50432603 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1F |r,t:1|
BDBM50432494 CN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2cccc(c2)C(F)(F)F)C1=O |c:3|
BDBM50432495 CCOc1cccc(c1)-c1ccc2OC(C)(C)CC3(N=C(N)N(C)C3=O)c2c1 |t:20|
BDBM50432496 CC(C)Oc1cccc(c1)-c1ccc2OC(C)(C)CC3(N=C(N)N(C)C3=O)c2c1 |t:21|
BDBM50432497 CN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2cc(Cl)ccc2F)C1=O |c:3|
BDBM50432498 CN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2cc(F)cc(Cl)c2)C1=O |c:3|
BDBM50432499 COc1ccc(F)c(c1)-c1ccc2OC(C)(C)CC3(N=C(N)N(C)C3=O)c2c1 |t:20|
BDBM50432500 COc1cc(F)cc(c1)-c1ccc2OC(C)(C)CC3(N=C(N)N(C)C3=O)c2c1 |t:20|
BDBM50432501 CN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2cc(Cl)cc(Cl)c2)C1=O |c:3|
BDBM50432502 COc1ccc(cc1)-c1ccc2OC(C)(C)CC3(N=C(N)N(C)C3=O)c2c1 |t:19|
BDBM50432503 COc1ccccc1-c1ccc2OC(C)(C)CC3(N=C(N)N(C)C3=O)c2c1 |t:19|
BDBM50432504 COc1cccc(c1)-c1ccc2OC(C)(C)CC3(N=C(N)N(C)C3=O)c2c1 |t:19|
BDBM50432505 CN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2cccc(c2)C#N)C1=O |c:3|
BDBM50432506 CN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2cccc(Cl)c2)C1=O |c:3|
BDBM50432507 CN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2ccccc2)C1=O |c:3|
BDBM50432509 CC1(C)Cc2ccc(cc2[C@@]2(COC(N)=N2)C1)-c1cncnc1 |r,c:15|
BDBM50432510 CN1C(N)=N[C@@]2(CC(C)(C)Cc3ccc(cc23)-c2cncnc2)C1=O |r,c:3|
BDBM50432511 CN1C(N)=N[C@@]2(CC(C)(C)Cc3ccc(cc23)-c2cccnc2F)C1=O |r,c:3|
BDBM50432512 CN1C(N)=N[C@@]2(CC(C)(C)Cc3ccc(cc23)-c2cccc(c2)C#N)C1=O |r,c:3|
BDBM50432513 CN1C(N)=N[C@@]2(CC(C)(C)Oc3ccc(cc23)-c2cncc(Cl)c2)C1=O |r,c:3|
BDBM50432514 CC1(C)Cc2ccc(cc2C2(COC(N)=N2)C1)-c1cccnc1F |c:15|
BDBM50432515 CC1(C)Cc2ccc(cc2C2(COC(N)=N2)C1)-c1cncc(F)c1 |c:15|
BDBM50432517 CC1(C)Cc2ccc(cc2C2(CCSC(N)=N2)C1)-c1cncc(Cl)c1 |c:16|
BDBM50432518 CC1(C)Cc2ccc(cc2C2(CSC(N)=N2)C1)-c1cncc(Cl)c1 |c:15|
BDBM50432519 CC1(C)Cc2ccc(cc2C2(COC(N)=N2)C1)-c1cncc(Cl)c1 |c:15|
BDBM50432520 CC(=O)N1CCC(CN2C(N)=NC3(CC(C)(C)Oc4ccc(cc34)-c3cccc(Cl)c3)C2=O)CC1 |c:10|
BDBM50432521 COCCN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2cccc(Cl)c2)C1=O |c:6|
BDBM50432522 CC1(C)CC2(N=C(N)N(CC(F)(F)F)C2=O)c2cc(ccc2O1)-c1cccc(Cl)c1 |t:5|
BDBM50432523 CCN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2cccc(Cl)c2)C1=O |c:4|
BDBM50432524 CN1C(N)=NC2(CC(C)(C)C(F)(F)c3ccc(cc23)-c2cncnc2)C1=O |c:3|
BDBM50432525 CN1C(N)=NC2(CC(C)(C)C(=O)c3ccc(cc23)-c2cncnc2)C1=O |c:3|
BDBM50432526 CN1C(N)=NC2(CC(C)(C)Sc3ccc(cc23)-c2cncnc2)C1=O |c:3|
BDBM50432527 CN1C(N)=NC2(CC(C)(C)Cc3ccc(cc23)-c2cncc(Cl)c2)C1=O |c:3|
BDBM50432528 CN1C(N)=NC2(CC(C)(C)Sc3ccc(cc23)-c2cncc(Cl)c2)C1=O |c:3|
BDBM50432529 CN1C(N)=NC2(CC(C)(C)Sc3ccc(cc23)-c2cccc(c2)C#N)C1=O |c:3|
BDBM50432530 CN1C(N)=NC2(CC(C)(C)Cc3ccc(cc23)-c2cc(F)cc(Cl)c2)C1=O |c:3|
BDBM50432531 CN1C(N)=NC2(CC(C)(C)Sc3ccc(cc23)-c2cc(F)cc(Cl)c2)C1=O |c:3|
BDBM50432532 CN1C(N)=NC2(CC(C)(C)Oc3ccc(NC(=O)c4ccc(C)o4)cc23)C1=O |c:3|
BDBM50432533 CN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2ccns2)C1=O |c:3|
BDBM50432534 CN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2cncnc2)C1=O |c:3|
BDBM50432535 CN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2cncc(F)c2)C1=O |c:3|
BDBM50432536 CN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2cccnc2F)C1=O |c:3|
BDBM50432537 CC#Cc1cncc(c1)-c1ccc2OC(C)(C)CC3(N=C(N)N(C)C3=O)c2c1 |t:20|
BDBM50432538 CN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2cncc(c2)C(F)(F)F)C1=O |c:3|
BDBM50432539 CN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2ccncc2)C1=O |c:3|
BDBM50432540 CN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2ccccn2)C1=O |c:3|
BDBM50432541 CN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2cccnc2)C1=O |c:3|
BDBM50432543 CC(C)COc1ccc2OC(C)(C)CC3(N=C(N)N(C)C3=O)c2c1 |t:15|
BDBM50432544 CN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)C2CCCCC2)C1=O |c:3|
BDBM50432545 CN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2cccc(F)c2)C1=O |c:3|
BDBM50432546 CN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2cccc(OC(F)F)c2)C1=O |c:3|
BDBM50432547 CSc1cccc(c1)-c1ccc2OC(C)(C)CC3(N=C(N)N(C)C3=O)c2c1 |t:19|
BDBM50433627 CCCc1scc(-c2cn[nH]c2)c1CC(NC1=NC(C)(C)Cc2cc(Cl)ccc12)c1nccc(=O)[nH]1 |t:18|
BDBM50433628 CCCc1scc(-c2cn[nH]c2)c1CC(NC1=NC(C)(C)Cc2cc(Cl)ccc12)C(O)=O |t:18|
BDBM50432508 CN1C(N)=NC2(CC(C)(C)Oc3ccc(Br)cc23)C1=O |c:3|
BDBM50441657 CC1(C)SCN(C1C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)C(=O)[C@@H](O)[C@H](Cc1ccccc1)NC(=O)COc1ccccc1 |r|
BDBM50437552 CC(C)(C)Cc1cnc2OC3(CCC3)C[C@H](NC[C@@H](O)[C@H](Cc3cccc(CC=C)c3)NC(=O)CCCC=C)c2c1 |r|
BDBM50438336 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CC2(COC2)Oc2ccc(CC(C)(C)C)cc12 |r|
BDBM50438337 CCc1ccc2CS(=O)(=O)C[C@H](NC[C@@H](O)[C@H](Cc3cc(F)cc(F)c3)NC(C)=O)c2c1 |r|
BDBM50438338 CC(C)c1ccc2CS(=O)(=O)C[C@H](NC[C@@H](O)[C@H](Cc3cc(F)cc(F)c3)NC(C)=O)c2c1 |r|
BDBM50438339 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CCOc2ccc(CC(C)(C)C(F)F)cc12 |r|
BDBM50438340 CC(C)Oc1ccc2OCC[C@H](NC[C@@H](O)[C@H](Cc3cc(F)cc(F)c3)NC(C)=O)c2c1 |r|
BDBM50438341 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CC(C)(C)Oc2ccc(OC(C)(C)C)cc12 |r|
BDBM50438342 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CS(=O)(=O)Cc2ccc(CC(C)(C)C)cc12 |r|
BDBM50438343 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CCOc2ccc(OC3CCCO3)cc12 |r|
BDBM50438344 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CCOc2ccc(OC3CCOC3)cc12 |r|
BDBM50438345 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CCCc2ccc(Cc3ccccc3)cc12 |r|
BDBM50438346 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CCOc2ccc(OC3CCCC3)cc12 |r|
BDBM50438347 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CCOc2ccc(CC(C)(F)F)cc12 |r|
BDBM50438348 CCc1ccc2CCC[C@H](NC[C@@H](O)[C@H](Cc3cc(F)cc(F)c3)NC(C)=O)c2c1 |r|
BDBM50438349 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CCOc2ccc(CC(C)(C)F)cc12 |r|
BDBM50438350 CCCCc1ccc2CCC[C@H](NC[C@@H](O)[C@H](Cc3cc(F)cc(F)c3)NC(C)=O)c2c1 |r|
BDBM50438351 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CCCc2ccc(cc12)C(C)(C)C |r|
BDBM50438352 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CCOc2ccc(CC(C)(C)C#N)cc12 |r|
BDBM50438353 CN1CC[C@H](NC[C@@H](O)[C@H](Cc2cc(F)cc(F)c2)NC(C)=O)c2cc(CC(C)(C)C)ccc12 |r|
BDBM50438354 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CC(C)(C)Oc2ccc(OC(F)(F)F)cc12 |r|
BDBM50438355 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CC(C)(C)Oc2ccc(CC(C)(C)C)cc12 |r|
BDBM50438356 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CC(C)(C)Oc2ccc(CC(C)(F)F)cc12 |r|
BDBM50438357 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CCOc2ccc(CC(C)(C)C)cc12 |r|
BDBM50438358 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CC(C)(C)Oc2ccc(CC(C)(C)C#N)cc12 |r|
BDBM50438359 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CCCc2ccc(CC(C)(C)C)cc12 |r|
BDBM50438360 CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CN[C@H]1CC2(CC2)Oc2ccc(CC(C)(C)C)cc12 |r|
BDBM50438361 COC[C@@]1(C)C[C@H](NC[C@@H](O)[C@H](Cc2cc(F)cc(F)c2)NC(C)=O)c2cc(CC(C)(C)C)ccc2O1 |r|
BDBM50438362 CCC[C@]1(C)C[C@H](NC[C@@H](O)[C@H](Cc2cc(F)cc(F)c2)NC(C)=O)c2cc(CC(C)(C)C)ccc2O1 |r|
BDBM50438363 CCC[C@@]1(C)C[C@H](NC[C@@H](O)[C@H](Cc2cc(F)cc(F)c2)NC(C)=O)c2cc(CC(C)(C)C)ccc2O1 |r|
BDBM50437553 CCc1ccc2OC3(CCC3)C[C@H](NC[C@@H](O)[C@H](Cc3cccc(CC=C)c3)NC(=O)CCCCC=C)c2c1 |r|
BDBM50437554 CCc1ccc2OC3(CCC3)C[C@H](NC[C@@H](O)[C@H](Cc3cccc(CC=C)c3)NC(=O)CCCC=C)c2c1 |r|
BDBM50437555 CCc1ccc2OC3(CCC3)C[C@H](NC[C@@H](O)[C@H](Cc3cccc(CC=C)c3)NC(=O)CCC=C)c2c1 |r|
BDBM50437556 O[C@H](CNCc1cccc(c1)C(F)(F)F)[C@H](Cc1ccccc1)NC(=O)c1cc(N2CCCC2=O)c(=O)n(c1)C1CCCC1 |r|
BDBM50437542 CC(C)(C)Cc1cnc2OC3(CCC3)C[C@H](NC[C@@H](O)[C@@H]3Cc4cccc(CCCn5cc(ccc5=O)C(=O)N3)c4)c2c1 |r|
BDBM50437543 CCc1ccc2OC3(CCC3)C[C@H](NC[C@@H](O)[C@@H]3Cc4cccc(CCCCn5cc(cc(N6CCCC6)c5=O)C(=O)N3)c4)c2c1 |r|
BDBM50437544 CCc1ccc2OC3(CCC3)C[C@H](NC[C@@H](O)[C@@H]3Cc4cccc(CCCCn5cc(cc(-c6ccccn6)c5=O)C(=O)N3)c4)c2c1 |r|
BDBM50437545 CCc1ccc2OC3(CCC3)C[C@H](NC[C@@H](O)[C@@H]3Cc4cccc(CCCCn5cc(ccc5=O)C(=O)N3)c4)c2c1 |r|
BDBM50437546 CC(C)(C)Cc1cnc2OC3(CCC3)C[C@H](NC[C@@H](O)[C@@H]3Cc4cccc(CCCCCCC(=O)N3)c4)c2c1 |r|
BDBM50437547 CCc1ccc2OC3(CCC3)C[C@H](NC[C@@H](O)[C@@H]3Cc4cccc(CCCCCCCC(=O)N3)c4)c2c1 |r|
BDBM50437548 CCc1ccc2OC3(CCC3)C[C@H](NC[C@@H](O)[C@@H]3Cc4cccc(CCCCCCC(=O)N3)c4)c2c1 |r|
BDBM50437549 CCc1ccc2OC3(CCC3)C[C@H](NC[C@@H](O)[C@@H]3Cc4cccc(CCCCCC(=O)N3)c4)c2c1 |r|
BDBM50437550 CCc1ccc2OC3(CCC3)C[C@H](NC[C@@H](O)[C@H](Cc3cccc(CC=C)c3)NC(=O)c3cc(N4CCCC4)c(=O)n(CC=C)c3)c2c1 |r|
BDBM50437551 CCc1ccc2OC3(CCC3)C[C@H](NC[C@@H](O)[C@H](Cc3cccc(CC=C)c3)NC(=O)c3cc(-c4ccccn4)c(=O)n(CC=C)c3)c2c1 |r|
BDBM50448519 NC1=N[C@]2(CO1)[C@H]1COCC[C@@H]1Oc1ccc(cc21)-c1cncnc1 |r,t:1|
BDBM50448520 NC1=N[C@]2(CO1)[C@@H]1COCC[C@H]1Oc1ccc(cc21)-c1cccnc1F |r,t:1|
BDBM50448521 NC1=N[C@]2(CO1)[C@H]1COCC[C@@H]1Oc1ccc(cc21)-c1cccnc1F |r,t:1|
BDBM50448522 NC1=N[C@]2(CO1)[C@@H]1COCC[C@H]1Oc1ccc(cc21)-c1cncnc1 |r,t:1|
BDBM50448523 CN1C(N)=N[C@@]2([C@H]3COCC[C@@H]3Oc3ccc(cc23)-c2cc(F)cc(Cl)c2)C1=O |r,c:3|
BDBM50448524 C[C@]12CCOC[C@@H]1[C@]1(COC(N)=N1)c1cc(ccc1O2)-c1cncc(F)c1 |r,c:12|
BDBM50448525 C[C@]12CCOC[C@@H]1[C@]1(COC(N)=N1)c1cc(ccc1O2)-c1cncc(Cl)c1 |r,c:12|
BDBM50448526 NC1=N[C@]2(CO1)[C@@H]1COCC[C@H]1Oc1ccc(cc21)-c1cncc(Cl)c1 |r,t:1|
BDBM50448527 NC1=N[C@]2(CS1)[C@@H]1COCC[C@H]1Oc1ccc(cc21)-c1cccnc1F |r,t:1|
BDBM50448528 C[C@]12CCOC[C@@H]1[C@]1(COC(N)=N1)c1cc(ccc1O2)-c1cccc(c1)C#N |r,c:12|
BDBM50448529 C[C@H]1OCC[C@H]2Oc3ccc(cc3[C@@]3(COC(N)=N3)[C@H]12)-c1cccnc1F |r,c:18|
BDBM50448530 NC1=N[C@]2(CS1)[C@@H]1COCC[C@H]1Oc1ccc(cc21)-c1cncc(Cl)c1 |r,t:1|
BDBM50448531 C[C@H]1OCC[C@H]2Oc3ccc(cc3[C@@]3(CSC(N)=N3)[C@H]12)-c1cccnc1F |r,c:18|
BDBM50448532 C[C@]12CCOC[C@@H]1[C@]1(COC(N)=N1)c1cc(ccc1O2)-c1cccnc1F |r,c:12|
BDBM50448533 CN1C(N)=N[C@@]2([C@H]3COCC[C@@H]3Oc3ccc(Br)cc23)C1=O |r,c:3|
BDBM50448534 CN1C(=N)N[C@]2([C@@H]3COCC[C@H]3Oc3ccc(cc23)-c2cccnc2F)C1=O |r|
BDBM50448535 NC1=N[C@]2(CO1)[C@H]1COCC[C@@H]1Oc1ccc(cc21)-c1cncc(Cl)c1 |r,t:1|
BDBM50448536 C[C@]12CCOC[C@@H]1[C@]1(COC(N)=N1)c1cc(c(F)cc1O2)-c1cncc(Cl)c1 |r,c:12|
BDBM50448537 CN1C(N)=N[C@@]2([C@H]3COCC[C@@H]3Oc3ccc(cc23)-c2cncnc2)C1=O |r,c:3|
BDBM50448538 C[C@]12CCOC[C@@H]1[C@]1(COC(N)=N1)c1cc(ccc1O2)-c1cc(F)cc(Cl)c1 |r,c:12|
BDBM50448539 CN1C(N)=N[C@@]2([C@H]3COCC[C@@H]3Oc3ccc(cc23)-c2cncc(c2)C#N)C1=O |r,c:3|
BDBM50448540 CN1C(N)=N[C@@]2([C@H]3COCC[C@@H]3Oc3ccc(cc23)-c2cncc(F)c2)C1=O |r,c:3|
BDBM50448541 COc1cncc(c1)-c1ccc2O[C@H]3CCOC[C@@H]3[C@@]3(N=C(N)N(C)C3=O)c2c1 |r,t:22|
BDBM50448542 C[C@H]1OCC[C@H]2Oc3ccc(cc3[C@]3(N=C(N)N(C)C3=O)[C@H]12)-c1cccnc1F |r,t:15|
BDBM50448543 C[C@]12CCOC[C@@H]1[C@]1(COC(N)=N1)c1cc(c(F)cc1O2)-c1cccnc1F |r,c:12|
BDBM50448544 CN1C(N)=N[C@@]2([C@H]3COCC[C@@H]3Oc3ccc(cc23)-c2cncc(Cl)c2)C1=O |r,c:3|
BDBM50448545 CN1C(N)=N[C@@]2([C@H]3COCC[C@@H]3Oc3ccc(cc23)-c2cccc(c2)C#N)C1=O |r,c:3|
BDBM50448546 CN1C(N)=N[C@@]2(C1=O)c1cc(ccc1O[C@H]1CCOC[C@]21C)-c1cncnc1 |r,c:3|
BDBM50448547 COc1cccc(c1)-c1ccc2O[C@H]3CCOC[C@@H]3[C@@]3(N=C(N)N(C)C3=O)c2c1 |r,t:22|
BDBM50448548 CN1C(N)=N[C@@]2(C1=O)c1cc(ccc1O[C@H]1CCOC[C@]21C)-c1cccc(c1)C#N |r,c:3|
BDBM50448549 CN1C(N)=N[C@@]2([C@H]3COCC[C@@H]3Oc3ccc(cc23)-c2cccnc2F)C1=O |r,c:3|
BDBM50448550 CN1C(N)=N[C@@]2([C@H]3COCC[C@@H]3Oc3cc(F)c(cc23)-c2cccnc2F)C1=O |r,c:3|
BDBM50448551 CN1C(N)=N[C@@]2([C@H]3COCC[C@@H]3Oc3ccc(cc23)-c2cccc(OC(F)F)c2)C1=O |r,c:3|
BDBM50448552 CN1C(N)=N[C@@]2([C@H]3COCC[C@@H]3Oc3cc(F)c(cc23)-c2cccc(OC(F)F)c2)C1=O |r,c:3|
BDBM50448553 CN1C(N)=N[C@@]2(C1=O)c1cc(ccc1O[C@H]1CCOC[C@]21C)-c1cccnc1F |r,c:3|
BDBM50448554 C[C@@]12COCC[C@H]1Oc1ccc(cc1[C@@]21COC(N)=N1)-c1cccnc1F |r,c:21|
BDBM50448555 C[C@]12CCOC[C@@H]1[C@]1(COC(N)=N1)c1cc(ccc1O2)-c1cncnc1 |r,c:12|
BDBM50448556 CN1C(N)=N[C@@]2([C@H]3COCC[C@@H]3Cc3ccc(cc23)-c2cccnc2F)C1=O |r,c:3|
BDBM50448557 COc1cccc(c1)-c1ccc2OC(C)(C)C[C@@]3(N=C(N)N(C)C3=O)c2c1 |r,t:19|
BDBM50440421 CC(C)(C)c1cccc(CN[C@H]2C[S@](=O)C[C@@H](Cc3cc(F)c(N)c(O[C@H](CO)C(F)(F)F)c3)[C@@H]2O)c1 |r|
BDBM50440422 CC(C)(C)c1cccc(CN[C@H]2C[S@](=O)C[C@@H](Cc3cc(F)c(N)c(OCC(F)(F)F)c3)[C@@H]2O)c1 |r|
BDBM50440423 COc1cc(C[C@@H]2C[S@@](=O)C[C@H](NCc3cccc(c3)C(C)(C)C)[C@H]2O)cc(F)c1N |r|
BDBM50440424 CC(C)(C)c1cccc(CN[C@H]2C[S@@](=O)C[C@@H](Cc3cc(F)c(N)c(OC(C(F)(F)F)C(F)(F)F)c3)[C@@H]2O)c1 |r|
BDBM50440425 CC(C)(C)c1cccc(CN[C@H]2C[S@](=O)C[C@@H](Cc3cc(F)c(N)c(OC(C(F)(F)F)C(F)(F)F)c3)[C@@H]2O)c1 |r|
BDBM50440409 COC[C@@H](Oc1cc(C[C@@H]2C[S@@](=O)C[C@H](NCc3cc(ccn3)C(C)(C)C)[C@H]2O)cc(F)c1N)C(F)(F)F |r|
BDBM50440410 COC[C@@H](Oc1cc(C[C@@H]2C[S@@](=O)C[C@H](NCc3cc(CC(C)(C)C)on3)[C@H]2O)cc(F)c1N)C(F)(F)F |r|
BDBM50440411 COC[C@@H](Oc1cc(C[C@@H]2C[S@@](=O)C[C@H](NCc3cnn(CC(C)(C)C)c3)[C@H]2O)cc(F)c1N)C(F)(F)F |r|
BDBM50440412 COC[C@@H](Oc1cc(C[C@@H]2C[S@@](=O)C[C@H](NCc3cccc(OC(F)(F)F)c3)[C@H]2O)cc(F)c1N)C(F)(F)F |r|
BDBM50440413 COC[C@@H](Oc1cc(C[C@@H]2C[S@@](=O)C[C@H](NCc3cccc(OC(C)C)c3)[C@H]2O)cc(F)c1N)C(F)(F)F |r|
BDBM50440414 COC[C@@H](Oc1cc(C[C@@H]2C[S@@](=O)C[C@H](NCc3cccc(c3)C(C)(C)O)[C@H]2O)cc(F)c1N)C(F)(F)F |r|
BDBM50440415 COC[C@@H](Oc1cc(C[C@@H]2C[S@@](=O)C[C@H](NCc3cccc(c3)C(C)(C)CO)[C@H]2O)cc(F)c1N)C(F)(F)F |r|
BDBM50440416 COC[C@@H](Oc1cc(C[C@@H]2C[S@@](=O)C[C@H](NCc3cc(ccc3F)C(C)(C)C)[C@H]2O)cc(F)c1N)C(F)(F)F |r|
BDBM50440417 COC[C@@H](Oc1cc(C[C@@H]2C[S@@](=O)C[C@H](N[C@H](C)c3cccc(c3)C(C)(C)C)[C@H]2O)cc(F)c1N)C(F)(F)F |r|
BDBM50440418 COC[C@@H](Oc1cc(C[C@@H]2C[S@@](=O)C[C@H](NCc3cccc(c3)C(C)C)[C@H]2O)cc(F)c1N)C(F)(F)F |r|
BDBM50440419 COC[C@@H](Oc1cc(C[C@@H]2C[S@@](=O)C[C@H](NCc3cccc(c3)C(C)(C)C)[C@H]2O)cc(F)c1N)C(F)(F)F |r|
BDBM50440420 CC(C)(C)c1cccc(CN[C@H]2C[S@](=O)C[C@@H](Cc3cc(O)c(N)c(F)c3)[C@@H]2O)c1 |r|
BDBM50010896 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1ccccc1)N1CCCCC1 |r|
BDBM50010899 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccnc1)N1CCCCC1 |r|
BDBM50010839 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1ccncc1)N1CCCCC1 |r|
BDBM50010845 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1)N1CCCCS1(=O)=O |r|
BDBM50010847 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1cccc(OC)c1)N1CCCCC1 |r|
BDBM50010849 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)N1CCCC1)N1CCCCC1 |r|
BDBM50010851 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccc(OC)c1)C1CCCCC1 |r|
BDBM50010853 CCCN(CCC)C(=O)c1cc(cc(c1)-c1ccccc1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccc(OC)c1 |r|
BDBM50010857 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC(C)(C)c1ccccc1)N1CCCCS1(=O)=O |r|
BDBM50010894 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccc(O)c1)N1CCCCC1 |r|
BDBM50010897 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1ccccn1)N1CCCCC1 |r|
BDBM50012647 [H][C@@]12COC[C@@]1(N=C(N)SC2)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |r,t:7|
BDBM50010843 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cncc(OC)c1)N1CCCCC1 |r|
BDBM50010846 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1(CC1)c1cccc(OC)c1)N1CCCCC1 |r|
BDBM50010848 CCCNC(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccc(OC)c1)N1CCCCC1 |r|
BDBM50010850 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(N)=O)N1CCCCC1 |r|
BDBM50012653 Cc1cc(cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(C)CO[C@](C)(C(N)=N1)C(F)(F)F)C#N |r,c:26|
BDBM50012660 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,c:4|
BDBM50010852 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccc(OC)c1)N1CCCC1 |r|
BDBM50010854 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccc(OC)c1)N1CCCCS1(=O)=O |r|
BDBM50010855 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC(C)(C)c1cccc(OC)c1)N1CCCCS1(=O)=O |r|
BDBM50010856 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1ccccc1)N1CCCCS1(=O)=O |r|
BDBM50010882 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccc(OC)c1)N1CCCCC1 |r|
BDBM50012632 C[C@]1(CCSC(N)=N1)c1cc(c(F)cc1F)-c1cncnc1 |r,c:6|
BDBM50023040 CC1=C(C)C(C)(C)C(=C)C1=O |c:1|
BDBM134293 C[C@]1(COCC(N)=N1)c1cccc(NC(=O)c2ccc(Br)cn2)c1 |r,c:6|
BDBM134348 CC1(COCC(N)=N1)c1cc(NC(=O)c2ccc(Br)cn2)ccc1F |c:6|
BDBM134354 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1cccc(NC(=O)c2ccc(Br)cn2)c1 |r,c:7|
BDBM134356 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ccc(Br)cn2)ccc1F |r,c:7|
BDBM134358 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ncc(cn2)C#N)ccc1F |r,c:7|
BDBM134359 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ncc(Br)cn2)ccc1F |r,c:7|
BDBM134360 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1F |r,c:7|
BDBM142394 NC1=N[C@]2(CO[C@@H](CF)C[C@H]2CS1)c1ccc(F)cc1F |t:1|
BDBM142369 NC1=N[C@]2(COCC[C@H]2CS1)c1ccc(F)cc1F |r,t:1|
BDBM143218 CN1C(=N)N[C@@](C)(CS1(=O)=O)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r|
BDBM148176 C[C@H]1SC(N)=N[C@]2(CO[C@H](C[C@@H]12)c1nc(C)co1)c1ccc(F)cc1F |r,c:4|
BDBM50030744 CN(N(CC(=O)N1CCOCC1)C#N)C(=O)OC(C)(C)C
BDBM50030745 CC(C)(C)OC(=O)NN(CC(=O)N(Cc1ccccc1)Cc1ccccc1)C#N
BDBM50030746 CN(Cc1ccccc1)C(=O)CN(NC(=O)OC(C)(C)C)C#N
BDBM50061583 CC1(C)CN(CCO1)c1cc2c(Oc3ccc(cc3[C@@]22COC(N)=N2)-c2cccnc2F)cn1 |r,c:26|
BDBM50061586 NC1=N[C@@]2(CO1)c1cc(ccc1Oc1cnc(cc21)N1CC[C@H](F)C1)-c1cccnc1F |r,t:1|
BDBM171432 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(cc2Cl)C#N)ccc1F |r,t:1|
BDBM171434 C[C@@]1(N=C(N)O[C@@H]2C[C@H]12)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,t:2|
BDBM171435 Cc1c(nc2ccc(Cl)cn12)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:25|
BDBM171436 COc1cnc(C(=O)Nc2ccc(F)c(c2)[C@]2(N=C(N)O[C@@H]3C[C@H]23)C(F)F)c(Cl)c1 |r,t:18|
BDBM171540 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCc3cocn3)cn2)ccc1F |r,t:1|
BDBM171541 C[C@H](F)c1nc(co1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:21|
BDBM171542 Cc1csc(c1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:19|
BDBM171543 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cc(Cl)cs2)ccc1F |r,t:1|
BDBM171544 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cc(cs2)C#N)ccc1F |r,t:1|
BDBM171545 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(Cl)s2)ccc1F |r,t:1|
BDBM171546 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(OCF)cn2)ccc1F |r,t:1|
BDBM171652 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cccc(Cl)n2)ccc1F |r,t:1|
BDBM171653 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cc(Cl)ccn2)ccc1F |r,t:1|
BDBM171654 CC(C)c1cccnc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:22|
BDBM171655 CC(C)c1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:23|
BDBM171656 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(Br)cc2C(F)F)ccc1F |r,t:1|
BDBM171657 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(cn2)-c2ccccc2)ccc1F |r,t:1|
BDBM171658 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccccn2)ccc1F |r,t:1|
BDBM171764 Cc1cc(NC(=O)c2ccc(cn2)C#N)cc(c1F)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:22|
BDBM171765 COCc1cc(cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F)C#N |r,t:22|
BDBM171767 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(Nc2ncnc3cc(cnc23)C#N)ccc1F |r,t:1|
BDBM171768 CC(C)c1cc(cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F)C#N |r,t:22|
BDBM171769 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(cc2C(F)F)C#N)ccc1F |r,t:1|
BDBM171770 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(cc2CO)C#N)ccc1F |r,t:1|
BDBM171437 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(Cl)cc2Cl)ccc1F |r,t:1|
BDBM171438 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:21|
BDBM171439 NC1=N[C@](C(F)F)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(Cl)cn2)cnc1F |r,t:1|
BDBM171440 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(Br)cn2)ccc1F |r,t:1|
BDBM171441 NC1=N[C@](C(F)F)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(cn2)C#N)cnc1F |r,t:1|
BDBM171442 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,t:1|
BDBM171443 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1F |r,t:1|
BDBM171547 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2csc(Cl)c2)ccc1F |r,t:1|
BDBM171548 CS(=O)(=O)c1ccc(nc1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:23|
BDBM171549 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(OCF)cn2)ccc1Cl |r,t:1|
BDBM171550 Cc1cc(OCC#N)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:24|
BDBM171551 Cc1cnc(C(=O)Nc2ccc(F)c(c2)[C@]2(N=C(N)O[C@@H]3C[C@H]23)C(F)F)c(C)c1 |r,t:17|
BDBM171552 Cc1cc(cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F)C(F)F |r,t:20|
BDBM171553 COc1ccc(nn1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:21|
BDBM171659 Cc1cccnc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:20|
BDBM171660 COc1cnc(cn1)C(=O)Nc1ccc(C)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:21|
BDBM171661 Cc1ccc(NC(=O)c2ccc(Cl)cn2)cc1[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:20|
BDBM171662 NC1=N[C@](C(F)F)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(Br)cn2)ccc1F |r,t:1|
BDBM171663 COc1cc(Cl)cnc1C(=O)Nc1ccc(Cl)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:24|
BDBM171664 Cc1cc(NC(=O)c2ncc(cn2)C#N)cc(c1F)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:22|
BDBM171665 COc1cnc(cn1)C(=O)Nc1cc(C)c(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:22|
BDBM171771 COc1cc(cnc1C(=O)Nc1ccc(Cl)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12)C#N |r,t:23|
BDBM171444 COc1ccc(nc1)C(=O)Nc1ccc(F)c(c1F)[C@]1(CF)N=C(N)O[C@H]2C[C@@H]12 |r,t:24|
BDBM171445 COc1ccc(nc1)C(=O)Nc1ccc(F)c(c1F)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:24|
BDBM171446 COC[C@@]1(N=C(N)O[C@@H]2C[C@H]12)c1cc(NC(=O)c2cnc(OC)cn2)ccc1F |r,t:4|
BDBM171447 COC[C@]1(N=C(N)O[C@H]2C[C@@H]12)c1cc(NC(=O)c2cnc(OC)cn2)ccc1F |r,t:4|
BDBM171448 COC[C@@]1(N=C(N)O[C@@H]2C[C@H]12)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,t:4|
BDBM171449 COC[C@]1(N=C(N)O[C@H]2C[C@@H]12)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,t:4|
BDBM171450 COc1cnc(C(=O)Nc2ccc(F)c(c2)[C@]2(N=C(N)O[C@@H]3C[C@H]23)C(F)F)c(OC)n1 |r,t:18|
BDBM171554 Cc1cc(cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F)C(F)(F)F |r,t:20|
BDBM171555 Cc1cc(OCC(F)(F)F)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:26|
BDBM171556 Cc1ccc(nc1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:20|
BDBM171557 CC(F)(F)Oc1ccc(nc1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:24|
BDBM171558 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1F |r,t:1|
BDBM171559 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(Cl)cc2Cl)ccc1F |r,t:1|
BDBM171560 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:23|
BDBM171666 COc1cnc(C(=O)Nc2cc(C)c(F)c(c2)[C@]2(N=C(N)O[C@@H]3C[C@H]23)C(F)F)c(C)n1 |r,t:19|
BDBM171667 COc1cnc(C(=O)Nc2ccc(Cl)c(c2)[C@@]2(CF)N=C(N)O[C@@H]3C[C@H]23)c(C)n1 |r,t:20|
BDBM171668 Cc1cc(NC(=O)c2ncc(Cl)cc2F)cc(c1F)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:22|
BDBM171669 Cc1cc(NC(=O)c2ncc(Cl)cc2C)cc(c1F)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:22|
BDBM171670 COc1ccc(nc1)C(=O)Nc1cc(C)c(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:22|
BDBM171671 COc1cnc(C(=O)Nc2cc(C)c(F)c(c2)[C@]2(N=C(N)O[C@@H]3C[C@H]23)C(F)F)c(C)c1 |r,t:19|
BDBM171672 COc1cnc(C(=O)Nc2ccc(F)c(c2)[C@]2(N=C(N)O[C@@H]3C[C@H]23)C(F)F)c(F)c1 |r,t:18|
BDBM171772 Cc1cc(NC(=O)c2ncc(cc2F)C#N)cc(c1F)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:23|
BDBM171773 COc1cc(cnc1C(=O)Nc1cc(C)c(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F)C#N |r,t:22|
BDBM171775 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(cc2F)C#N)ccc1Cl |r,t:1|
BDBM171776 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(N[C@@H]2CCc3cc(cnc23)[N+]#[C-])ccc1F |r,t:1|
BDBM171777 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(N[C@H]2CCc3cc(cnc23)C#N)ccc1F |r,t:1|
BDBM171778 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(N[C@@H]2CCCc3cc(cnc23)C#N)ccc1F |r,t:1|
BDBM171451 COc1cnc(cn1)C(=O)Nc1cc(Cl)c(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:24|
BDBM171452 COc1cc(cnc1C(=O)Nc1cc(Cl)c(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12)C#N |r,t:24|
BDBM171453 Cc1cc(OC(F)F)cnc1C(=O)Nc1cc(Cl)c(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:27|
BDBM171454 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(cn2)C#N)cc(Cl)c1F |r,t:1|
BDBM171455 COc1cnc(C(=O)Nc2cc(Cl)c(F)c(c2)[C@@]2(CF)N=C(N)O[C@@H]3C[C@H]23)c(C)n1 |r,t:21|
BDBM171456 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCC(F)(F)F)cn2)cc(Cl)c1F |r,t:1|
BDBM171457 Cc1cc(cnc1C(=O)Nc1cc(Cl)c(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12)C#N |r,t:23|
BDBM171561 COc1ccc(nc1)C(=O)Nc1ccc(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:23|
BDBM171562 Cc1cc(cnc1C(=O)Nc1ccc(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12)C#N |r,t:22|
BDBM171563 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCC#C)cn2)ccc1F |r,t:1|
BDBM171564 Cc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:23|
BDBM171565 CC#CCOc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:26|
BDBM171566 Cc1c(nc2ccc(Cl)cn12)C(=O)Nc1ccc(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:27|
BDBM171567 Cc1cc(cnc1C(=O)Nc1ccc(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:22|
BDBM171673 COc1cc(F)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:22|
BDBM171674 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(Cl)cc2CF)ccc1F |r,t:1|
BDBM171677 Cc1cc(cnc1C(=O)Nc1cc(F)c(C)c(c1)[C@@]1(N=C(N)O[C@H]2C[C@@H]12)C(F)F)C#N |r,t:21|
BDBM171678 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(OC(F)F)cn2)ccc1F |r,t:1|
BDBM171679 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(cn2)C#C)ccc1F |r,t:1|
BDBM171779 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(N[C@@H]2CCc3cc(cnc23)C#N)ccc1F |r,t:1|
BDBM171780 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(cn2)C#CC2CC2)ccc1F |r,t:1|
BDBM171781 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(Nc2nccc3cc(cnc23)C#CC2CC2)ccc1F |r,t:1|
BDBM171782 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(cn2)C#CC2CC2)ccc1F |r,t:1|
BDBM171783 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(Nc2ncc(F)c3cc(cnc23)C#CC2CC2)ccc1F |r,t:1|
BDBM171784 CC1(COC1)C#Cc1ccc(nc1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:27|
BDBM171458 NC1=N[C@](C(F)F)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1Cl |r,t:1|
BDBM171460 NC1=N[C@](C(F)F)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1Cl |r,t:1|
BDBM171461 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCC#C)cn2)ccc1F |r,t:1|
BDBM171462 CC#CCOc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:24|
BDBM171568 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cc3ccccc3cn2)ccc1F |r,t:1|
BDBM171569 CC#CCOc1ccc(nc1)C(=O)Nc1ccc(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:26|
BDBM171570 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(cn2)C#N)cnc1F |r,t:1|
BDBM171571 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(OCC#C)cn2)ccc1F |r,t:1|
BDBM171572 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCC#C)cn2)cnc1F |r,t:1|
BDBM171573 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2nn(cc2Cl)C(F)F)cnc1F |r,t:1|
BDBM171574 NC1=N[C@]([C@@H]2C[C@@H]2O1)(c1cccc(NC(=O)c2ccc(Cl)cn2)c1)C(F)(F)F |r,t:1|
BDBM171680 CC#Cc1ccc(nc1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:22|
BDBM171681 Cc1nc(OCC(F)(F)F)cnc1C(=O)Nc1cc(F)c(Cl)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:29|
BDBM171683 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCC#C)cn2)cc(F)c1Cl |r,t:1|
BDBM171684 NC1=N[C@](CF)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2cnc(OCC#C)cn2)cc(F)c1Cl |r,t:1|
BDBM171685 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(Cl)cc2CF)ccc1Cl |r,t:1|
BDBM171686 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(Cl)cc2F)ccc1Cl |r,t:1|
BDBM171786 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCC#CC3CC3)cn2)ccc1F |r,t:1|
BDBM171787 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCC3CCOCC3)cn2)ccc1F |r,t:1|
BDBM171788 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCC3CCOC3)cn2)ccc1F |r,t:1|
BDBM171789 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCC=C)cn2)ccc1F |r,t:1|
BDBM171790 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCC3CC3)cn2)ccc1F |r,t:1|
BDBM171466 COc1ccc(nc1)C(=O)Nc1ccc(Cl)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:21|
BDBM171467 COc1cnc(C(=O)Nc2ccc(Cl)c(c2)[C@]2(N=C(N)O[C@@H]3C[C@H]23)C(F)F)c(C)c1 |r,t:18|
BDBM171468 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCc3cocn3)cn2)ccc1Cl |r,t:1|
BDBM171469 COc1cnc(nc1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:21|
BDBM171470 COc1cnc(nc1)C(=O)Nc1ccc(Cl)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:21|
BDBM171471 NC1=N[C@](CF)([C@@H]2C[C@@H]2O1)c1nc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,t:1|
BDBM171575 Cc1cc(OC(F)F)cnc1C(=O)Nc1ccc(Cl)c(c1)C1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:24|
BDBM171577 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(Cl)cc2Cl)ccc1Cl |r,t:1|
BDBM171578 Cc1cc(OC(F)F)cnc1C(=O)Nc1ccc(Cl)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:24|
BDBM171579 Cc1cc(OC(F)F)cnc1C(=O)Nc1ccc(Cl)c(c1)[C@@]1(N=C(N)O[C@H]2C[C@@H]12)C(F)F |r,t:24|
BDBM171580 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(Br)cn2)ccc1Cl |r,t:1|
BDBM171581 CC#CCOc1cnc(cn1)C(=O)Nc1ccc(Cl)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:24|
BDBM171687 Cc1cc(Cl)cnc1C(=O)Nc1ccc(Cl)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:23|
BDBM171688 Cc1cc(NC(=O)c2ccc(Cl)cc2CF)cc(c1F)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:23|
BDBM171689 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(F)cn2)ccc1Cl |r,t:1|
BDBM171690 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)N=C(N)O[C@H]2C[C@@H]12 |t:22|
BDBM171691 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1nc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,t:1|
BDBM171692 COc1cnc(cn1)C(=O)Nc1ccc(F)c(n1)[C@@]1(C)N=C(N)O[C@@H]2C[C@H]12 |r,t:22|
BDBM171693 COc1cnc(cn1)C(=O)Nc1ccc(F)c(n1)[C@]1(C)N=C(N)O[C@H]2C[C@@H]12 |r,t:22|
BDBM171791 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCC3CCCCC3)cn2)ccc1F |r,t:1|
BDBM171792 CCOc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:22|
BDBM171793 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCC3CCCC3)cn2)ccc1F |r,t:1|
BDBM171794 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(Cl)cc2CO)ccc1F |r,t:1|
BDBM171795 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(Cl)cc2CO)ccc1Cl |r,t:1|
BDBM171796 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NS(=O)(=O)c2ccc(Cl)cn2)ccc1F |r,t:1|
BDBM171797 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(N[C@H](c2ccc(Cl)cn2)C(F)(F)F)ccc1F |r,t:1|
BDBM171472 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1nc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,t:1|
BDBM171473 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(Cl)cn2)cc(F)c1F |r,t:1|
BDBM171474 NC1=N[C@](C(F)F)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(Cl)cn2)cc(F)c1F |r,t:1|
BDBM171475 NC1=N[C@](C(F)F)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(cn2)C#N)cc(F)c1F |r,t:1|
BDBM171476 NC1=N[C@](C(F)F)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2nn(cc2Cl)C(F)F)cc(F)c1F |r,t:1|
BDBM171478 COc1cnc(cn1)C(=O)Nc1cc(F)c(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:22|
BDBM171583 Cc1cc(cnc1C(=O)Nc1ccc(Cl)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F)C(F)(F)F |r,t:20|
BDBM171584 NC1=N[C@]([C@@H]2C[C@@H]2O1)(c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F)C(F)(F)F |r,t:1|
BDBM171587 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCC#C)cn2)ccc1Cl |r,t:1|
BDBM171694 C[C@@]1(N=C(N)O[C@@H]2C[C@H]12)c1nc(NC(=O)c2ccc(cn2)C#N)ccc1F |r,t:2|
BDBM171695 C[C@]1(N=C(N)O[C@H]2C[C@@H]12)c1nc(NC(=O)c2ccc(cn2)C#N)ccc1F |r,t:2|
BDBM171696 C[C@@]1(N=C(N)O[C@@H]2C[C@H]12)c1nc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,t:2|
BDBM171697 C[C@]1(N=C(N)O[C@H]2C[C@@H]12)c1nc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,t:2|
BDBM171698 C[C@@]1(N=C(N)O[C@@H]2C[C@H]12)c1nc(NC(=O)c2ncc(Cl)cc2Cl)ccc1F |r,t:2|
BDBM171699 C[C@]1(N=C(N)O[C@H]2C[C@@H]12)c1nc(NC(=O)c2ncc(Cl)cc2Cl)ccc1F |r,t:2|
BDBM171798 NC1=NC(CF)(C2CC2O1)c1cccc(NC(=O)c2ccc(Cl)cn2)c1 |t:1|
BDBM171799 CS(=O)(=O)c1c(F)cc(NC(=O)c2ccc(Cl)cn2)cc1[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:26|
BDBM171800 NC1=N[C@](C(F)F)([C@@H]2C[C@@H]2O1)c1cc(ccc1F)-c1nc2ccc(Cl)cc2o1 |t:1|
BDBM171801 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(ccc1F)-c1nc2ccc(Cl)cc2o1 |t:1|
BDBM171802 COC[C@H](C)NC(=O)c1ccc(F)c(c1)[C@@]1(N=C(N)O[C@H]2C[C@@H]12)C(F)F |r,t:17|
BDBM171803 COC[C@H](C)NC(=O)c1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:17|
BDBM171479 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(cn2)C#N)cc(F)c1F |r,t:1|
BDBM171480 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2nn(cc2Cl)C(F)F)cc(F)c1F |r,t:1|
BDBM171482 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(Br)cn2)cc(F)c1F |r,t:1|
BDBM171483 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,t:1|
BDBM171484 NC1=N[C@](CF)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,t:1|
BDBM171485 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(Cl)cn2)ccc1F |r,t:1|
BDBM171589 Cc1cc(cnc1C(=O)Nc1ccc(Cl)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F)C#N |r,t:20|
BDBM171590 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2nn(cc2Cl)C(F)F)ccc1Cl |r,t:1|
BDBM171592 COc1cnc(cn1)C(=O)Nc1ccc(Cl)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:21|
BDBM171593 NC1=N[C@](CF)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ncc(cc2Cl)C#N)ccc1F |r,t:1|
BDBM171594 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(cc2Cl)C#N)ccc1F |r,t:1|
BDBM171595 COc1cnc(C(=O)Nc2ccc(F)c(c2)[C@@]2(CF)N=C(N)O[C@@H]3C[C@H]23)c(Cl)c1 |r,t:20|
BDBM171702 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC2(COC2)c2ccc(Cl)cn2)ccc1F |r,t:1|
BDBM171704 C[C@@]1(N=C(N)O[C@@H]2C[C@H]12)c1cc(NC(=O)c2ccc(Cl)cn2)cnc1F |r,t:2|
BDBM171706 COc1cnc(cn1)C(=O)Nc1cnc(F)c(c1)[C@]1(C)N=C(N)O[C@H]2C[C@@H]12 |r,t:22|
BDBM171707 COc1cnc2c(Nc3ccc(F)c(c3)[C@@]3(C)N=C(N)O[C@H]4C[C@@H]34)nccc2c1 |r,t:18|
BDBM171805 CC#Cc1cncc(c1)-c1ccc(F)c(c1)[C@@]1(N=C(N)O[C@H]2C[C@@H]12)C(F)F |r,t:19|
BDBM171807 CC#Cc1cncc(c1)-c1cc(c(F)cc1CO)C1(CF)N=C(N)OC2CC12 |t:23|
BDBM171808 OCc1cc(F)c(cc1-c1cncc(F)c1)C1(CF)NC(=N)OC2CC12
BDBM171809 CC#Cc1cnn(c1)-c1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:18|
BDBM171810 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(ccc1F)-n1cc(cn1)C#CC1CC1 |r,t:1|
BDBM171811 COC(=O)c1ccc(cc1)C(=O)Nc1cc(F)c(F)c(c1)[C@@]1(N=C(N)O[C@H]2C[C@@H]12)C(F)F |r,t:24|
BDBM50061591 NC1=N[C@@]2(CO1)c1cc(ccc1Oc1cnc(cc21)-c1ccncc1)-c1cccnc1F |r,t:1|
BDBM171486 Cc1nc(OCC(F)(F)F)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:26|
BDBM171487 COc1ccc(nc1)C(=O)Nc1cc(F)c(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:22|
BDBM171488 Cc1cc(cnc1C(=O)Nc1ccc(Cl)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:22|
BDBM171490 Cc1cc(NC(=O)c2ccc(Cl)cn2)cc(c1F)[C@@]1(N=C(N)O[C@H]2C[C@@H]12)C(F)F |r,t:21|
BDBM171491 Cc1cc(cnc1C(=O)Nc1ccc(Cl)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12)C(F)(F)F |r,t:22|
BDBM171492 Cc1cc(OC(F)F)cnc1C(=O)Nc1ccc(Cl)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:26|
BDBM171596 NC1=N[C@](CF)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(Cl)cn2)cnc1F |r,t:1|
BDBM171597 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(Cl)cn2)cnc1F |r,t:1|
BDBM171598 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(OCC#C)cn2)ccc1F |r,t:1|
BDBM171599 CC#CCOc1ccc(nc1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:24|
BDBM171600 Cc1cc(cnc1C(=O)Nc1cnc(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:22|
BDBM171601 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(Br)cn2)cnc1F |r,t:1|
BDBM171602 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(OCC(F)(F)F)cn2)ccc1F |r,t:1|
BDBM171708 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)N=C(N)O[C@@H]4C[C@H]34)nccc2c1 |r,t:18|
BDBM171709 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)N=C(N)O[C@H]4C[C@@H]34)nccc2c1 |r,t:18|
BDBM171710 COc1cnc2c(Nc3ccc(F)c(c3)[C@@]3(C)N=C(N)O[C@@H]4C[C@H]34)nccc2c1 |r,t:18|
BDBM171711 NC1=C[C@](CF)([C@@H]2C[C@@H]2O1)c1cc(Nc2nccc3cc(Cl)cnc23)cc(F)c1F |r,t:1|
BDBM171712 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(Nc2nccc3cc(Cl)cnc23)cc(F)c1F |r,t:1|
BDBM171713 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(Nc2ncc(F)c3cc(cnc23)C#N)ccc1F |r,t:1|
BDBM171714 COc1cnc2c(Nc3ccc(F)c(c3)[C@@]3(CF)N=C(N)O[C@@H]4C[C@H]34)ncc(F)c2c1 |r,t:19|
BDBM171812 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(ccc1F)N1Cc2cc(Cl)cnc2C1=O |r,t:1|
BDBM171813 COc1cnc(cn1)C(=O)Nc1cccc(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:20|
BDBM171814 CNc1cnc(nc1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |t:21|
BDBM171815 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2c(F)cc(F)cc2F)ccc1F |r,t:1|
BDBM171817 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@@]1(C)N=C(N)O[C@H]2C[C@@H]12 |t:22|
BDBM171493 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(cc2Cl)C#N)ccc1Cl |r,t:1|
BDBM171494 COCc1cc(Cl)cnc1C(=O)Nc1ccc(Cl)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:25|
BDBM171495 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(Cl)cc2F)ccc1F |r,t:1|
BDBM171496 COc1ccc(nc1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:21|
BDBM171497 COc1cnc(C(=O)Nc2ccc(F)c(c2)[C@]2(N=C(N)O[C@@H]3C[C@H]23)C(F)F)c(C)c1 |r,t:18|
BDBM171498 Cc1cc(NC(=O)c2ncc(cc2C)C#N)cc(c1F)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:23|
BDBM171499 Cc1cc(NC(=O)c2ncc(cc2Cl)C#N)cc(c1F)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:23|
BDBM171603 Cc1cc(OC(F)F)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:24|
BDBM171604 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OC(F)F)cn2)ccc1F |r,t:1|
BDBM171605 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)C2CCCCC2)ccc1F |r,t:1|
BDBM171606 COCC(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:15|
BDBM171607 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)CC2CCCCC2)ccc1F |r,t:1|
BDBM171608 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)C2CCOCC2)ccc1F |r,t:1|
BDBM171609 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)C2=CCCCC2)ccc1F |r,t:1,19|
BDBM171715 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(Nc2nccc3cc(Cl)cnc23)ccc1F |r,t:1|
BDBM171716 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(Nc2nccc3cc(cnc23)C#N)ccc1F |r,t:1|
BDBM171717 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(Nc2ncnc3cc(Cl)cnc23)ccc1F |r,t:1|
BDBM171718 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(N=C(N)O[C@@H]4C[C@H]34)C(F)F)nccc2c1 |r,t:17|
BDBM171720 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(Nc2ncc(F)c3cc(cnc23)C#N)ccc1Cl |r,t:1|
BDBM171819 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@@]1(C)N=C(N)O[C@@H]2C[C@H]12 |t:22|
BDBM171820 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(ccc1F)-c1nnc([nH]1)-c1ccc(F)cc1 |t:1|
BDBM171394 COc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:22|
BDBM171500 COc1cc(Cl)cnc1C(=O)Nc1cc(C)c(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:23|
BDBM171501 Cc1cc(NC(=O)c2ncc(Cl)cc2Cl)cc(c1F)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:22|
BDBM171502 NC1=N[C@](CF)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(cn2)C#N)cc(F)c1Cl |r,t:1|
BDBM171504 Cc1cc(cnc1C(=O)Nc1cc(F)c(Cl)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12)C#N |r,t:23|
BDBM171506 NC1=N[C@](CF)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(OCC#C)cn2)cc(F)c1Cl |r,t:1|
BDBM171610 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)[C@H]2CCCO2)ccc1F |r,t:1|
BDBM171611 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)C2(CC2)c2ccc(Cl)cc2)ccc1F |r,t:1|
BDBM171612 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)C2(CCC2)c2ccc(Cl)cc2)ccc1F |r,t:1|
BDBM171613 COCCC(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:16|
BDBM171614 Cn1cc(ccc1=O)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:21|
BDBM171615 Cn1ccc(cc1=O)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:21|
BDBM171616 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(OCC#CC3CC3)cn2)ccc1F |r,t:1|
BDBM171722 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(Nc2ncc(F)c3cc(cnc23)C#N)ccc1F |r,t:1|
BDBM171723 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(Nc2ncnc3cc(Cl)cnc23)ccc1F |r,t:1|
BDBM171724 COc1cnc2c(Nc3ccc(F)c(c3F)[C@]3(CF)N=C(N)O[C@H]4C[C@@H]34)nccc2n1 |r,t:20|
BDBM171725 COc1cnc2c(Nc3ccc(F)c(c3F)[C@@]3(CF)N=C(N)O[C@@H]4C[C@H]34)nccc2n1 |r,t:20|
BDBM171726 COc1cnc2c(Nc3cc(Cl)c(F)c(c3)[C@@]3(CF)N=C(N)O[C@@H]4C[C@H]34)nccc2n1 |r,t:20|
BDBM171727 CC(C)Oc1cnc2c(Nc3cc(Cl)c(F)c(c3)[C@@]3(CF)N=C(N)O[C@@H]4C[C@H]34)nccc2n1 |r,t:22|
BDBM171728 Cn1cc2ccnc(Nc3ccc(F)c(c3)[C@]3(N=C(N)O[C@@H]4C[C@H]34)C(F)F)c2n1 |r,t:18|
BDBM171395 Cc1cc(OCC#CC(C)(C)O)cnc1C(=O)Nc1ccc(F)c(c1)C1(C)N=C(N)O[C@H]2C[C@@H]12 |r,t:29|
BDBM171399 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCC#C)cn2)cc(F)c1F |r,t:1|
BDBM171400 NC1=N[C@](CF)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2cnc(OCC#C)cn2)cc(F)c1F |r,t:1|
BDBM171401 CC#CCOc1cnc(cn1)C(=O)Nc1cc(F)c(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:27|
BDBM171507 CSc1c(F)cc(NC(=O)c2ccc(Cl)cn2)cc1[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:24|
BDBM171509 COc1cnc(cn1)C(=O)Nc1cc(F)c(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:24|
BDBM171510 COc1cnc(cn1)C(=O)Nc1cc(F)c(F)c(c1)[C@]1(CF)N=C(N)O[C@H]2C[C@@H]12 |r,t:24|
BDBM171511 COc1c(F)cc(NC(=O)c2ccc(Cl)cn2)cc1[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:24|
BDBM171512 COc1c(F)cc(NC(=O)c2ccc(Cl)cn2)cc1[C@]1(CF)N=C(N)O[C@H]2C[C@@H]12 |r,t:24|
BDBM171513 CC(C)Oc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:23|
BDBM171617 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)CC(F)(F)F)ccc1F |r,t:1|
BDBM171618 C[C@H](C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F)c1ccc(Cl)cc1 |r,t:14|
BDBM171619 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)[C@@H]2CCOC2)ccc1F |r,t:1|
BDBM171620 CC(C)(C)OCC(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:18|
BDBM171621 COCCOCC(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:18|
BDBM171622 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)COc2ccccc2)ccc1F |r,t:1|
BDBM171623 CO[C@H](C)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:16|
BDBM171729 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(Nc2nccc3cc(Cl)cnc23)ccc1Cl |r,t:1|
BDBM171730 COc1cnc2c(Nc3ccc(Cl)c(c3)[C@@]3(CF)N=C(N)O[C@@H]4C[C@H]34)nccc2n1 |r,t:19|
BDBM171731 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(Nc2ncc(F)c3cc(Cl)cnc23)ccc1F |r,t:1|
BDBM171732 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(Nc2nccc3cc(Cl)cnc23)ccc1F |r,t:1|
BDBM171733 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(Nc2ncc(F)c3cc(cnc23)C#N)ccc1Cl |r,t:1|
BDBM171734 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(N=C(N)O[C@@H]4C[C@H]34)C(F)F)ncnc2c1 |r,t:17|
BDBM171735 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(Nc2nccc3nc(cnc23)C(F)(F)F)ccc1F |r,t:1|
BDBM171402 CC#CCOc1cnc(cn1)C(=O)Nc1cc(F)c(F)c(c1)[C@]1(CF)N=C(N)O[C@H]2C[C@@H]12 |r,t:27|
BDBM171403 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(cn2)C#N)cc(F)c1F |r,t:1|
BDBM171404 NC1=N[C@](CF)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(cn2)C#N)cc(F)c1F |r,t:1|
BDBM171405 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(Br)cn2)cc(F)c1F |r,t:1|
BDBM171406 NC1=N[C@](CF)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(Br)cn2)cc(F)c1F |r,t:1|
BDBM171407 COc1ccc(nc1)C(=O)Nc1cc(F)c(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:24|
BDBM171408 COCc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:23|
BDBM171514 C[C@@H](Oc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F)C#C |r,t:22|
BDBM171515 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2csc(n2)C(F)F)ccc1F |r,t:1|
BDBM171516 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2coc(n2)C(F)F)ccc1F |r,t:1|
BDBM171517 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2coc(n2)C#CC2CC2)ccc1F |r,t:1|
BDBM171520 Cn1nc(cc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F)C(F)F |r,t:19|
BDBM171624 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)C2CC(=O)C2)ccc1F |r,t:1|
BDBM171625 C[C@@H](Oc1ccc(nc1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F)C#N |r,t:22|
BDBM171626 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)C2CC2)ccc1F |r,t:1|
BDBM171627 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(Cl)cn2)ccc1F |r,t:1|
BDBM171628 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)C#Cc2ccccc2)ccc1F |r,t:1|
BDBM171630 NC1=N[C@](C(F)F)([C@@H]2C[C@@H]2O1)c1cccc(NC(=O)c2ccc(Cl)cn2)c1 |r,t:1|
BDBM171736 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(Nc2nccc3cc(cnc23)C#N)ccc1F |r,t:1|
BDBM171737 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(N=C(N)O[C@@H]4C[C@H]34)C(F)F)nccc2n1 |r,t:17|
BDBM171738 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(N=C(N)O[C@@H]4C[C@H]34)C(F)F)ncc(F)c2c1 |r,t:17|
BDBM171739 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(Nc2ncnc3cc(cnc23)C(F)(F)F)ccc1F |r,t:1|
BDBM171740 NC1=N[C@](C(F)F)([C@@H]2C[C@@H]2O1)c1cc(Nc2ncc(F)c3cc(cnc23)C#N)cc(F)c1F |r,t:1|
BDBM171741 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(Nc2ncc(F)c3cc(cnc23)C#N)cc(F)c1F |r,t:1|
BDBM171742 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NCC2CCC2)ccc1F |r,t:1|
BDBM171409 Cc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:21|
BDBM171410 Cc1cc(cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F)C#N |r,t:20|
BDBM171411 COc1cc(cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F)C#N |r,t:21|
BDBM171412 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2nn(cc2Cl)C(F)F)cc(F)c1F |r,t:1|
BDBM171413 NC1=N[C@](CF)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2nn(cc2Cl)C(F)F)cc(F)c1F |r,t:1|
BDBM171415 Cc1cc(cnc1C(=O)Nc1cc(F)c(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12)C#N |r,t:23|
BDBM171522 COc1cnc(cn1)C(=O)Nc1cc(F)c(Cl)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:24|
BDBM171524 Cc1cc(OC(F)F)cnc1C(=O)Nc1cc(F)c(Cl)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:27|
BDBM171632 Cc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:20|
BDBM171633 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(Br)cn2)ccc1F |r,t:1|
BDBM171635 Cc1ccc(NC(=O)c2ccc(cn2)C#N)cc1[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:21|
BDBM171636 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1Cl |r,t:1|
BDBM171743 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NCC#Cc2ccccc2)ccc1F |r,t:1|
BDBM171744 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NCC2(CC2)c2ccc(Cl)cc2)ccc1F |r,t:1|
BDBM171745 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC[C@@H]2C[C@H]2c2ccccc2)ccc1F |r,t:1|
BDBM171746 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC[C@H]2C[C@H]2c2ccccc2)ccc1F |r,t:1|
BDBM171747 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NCc2nn(cc2Cl)C(F)F)ccc1F |r,t:1|
BDBM171748 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NCc2nn(cc2Cl)C(F)F)ccc1F |r,t:1|
BDBM171749 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NCC2CC(=C)C2)ccc1F |r,t:1|
BDBM171416 Cc1cc(cnc1C(=O)Nc1cc(F)c(F)c(c1)[C@]1(CF)N=C(N)O[C@H]2C[C@@H]12)C#N |r,t:23|
BDBM171417 Cc1cc(cnc1C(=O)Nc1cc(F)c(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12)C(F)(F)F |r,t:23|
BDBM171418 Cc1cc(cnc1C(=O)Nc1cc(F)c(F)c(c1)[C@]1(CF)N=C(N)O[C@H]2C[C@@H]12)C(F)(F)F |r,t:23|
BDBM171419 Cc1nc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@@]1(N=C(N)O[C@H]2C[C@@H]12)C(F)F |r,t:21|
BDBM171420 Cc1ncc(Cl)nc1C(=O)Nc1ccc(F)c(c1)[C@@]1(N=C(N)O[C@H]2C[C@@H]12)C(F)F |r,t:21|
BDBM171422 CC#CCOc1cnc(C(=O)Nc2ccc(F)c(c2)[C@@]2(C)N=C(N)O[C@@H]3C[C@H]23)c(C)c1 |r,t:22|
BDBM171527 CC(C)n1cc(Cl)c(n1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:22|
BDBM171528 C[C@H](Oc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F)C#C |r,t:22|
BDBM171529 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2nn(cc2Cl)C(F)F)ccc1F |r,t:1|
BDBM171530 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2nn(cc2Cl)C(F)F)ccc1F |r,t:1|
BDBM171531 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCc3nccs3)cn2)ccc1F |r,t:1|
BDBM171532 Cc1nc(co1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:19|
BDBM171533 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCc3ncco3)cn2)ccc1F |r,t:1|
BDBM171638 COc1cnc(cn1)C(=O)Nc1ccc(Cl)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:23|
BDBM171639 COc1cnc(cn1)C(=O)Nc1ccc(Cl)c(c1)[C@]1(CF)N=C(N)O[C@H]2C[C@@H]12 |r,t:23|
BDBM171640 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(Br)cn2)ccc1Cl |r,t:1|
BDBM171641 NC1=N[C@](CF)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(Br)cn2)ccc1Cl |r,t:1|
BDBM171643 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1Cl |r,t:1|
BDBM171644 NC1=N[C@](CF)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1Cl |r,t:1|
BDBM171750 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NCC2(CC2)C(F)(F)F)ccc1F |r,t:1|
BDBM171751 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NCc2ccc(Cl)cn2)ccc1F |r,t:1|
BDBM171752 C[C@@H](Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F)c1ccc(Cl)cn1 |r,t:12|
BDBM171753 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NCC2CC2)ccc1F |r,t:1|
BDBM171756 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(N[C@H]2CCCc3cc(Br)cnc23)ccc1F |r,t:1|
BDBM171423 CC#CCOc1cnc(C(=O)Nc2ccc(F)c(c2)[C@]2(C)N=C(N)O[C@H]3C[C@@H]23)c(C)c1 |r,t:22|
BDBM171427 Cc1c(nc2ccc(Cl)cn12)C(=O)Nc1ccc(F)c(c1)[C@@]1(N=C(N)O[C@H]2C[C@@H]12)C(F)F |r,t:25|
BDBM171429 COc1cnc(C(=O)Nc2ccc(F)c(c2)[C@]2(N=C(N)O[C@@H]3C[C@H]23)C(F)F)c(C)n1 |r,t:18|
BDBM171534 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2coc(CF)n2)ccc1F |r,t:1|
BDBM171535 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCc3cscn3)cn2)ccc1F |r,t:1|
BDBM171536 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCc3cncs3)cn2)ccc1F |r,t:1|
BDBM171537 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCc3cnco3)cn2)ccc1F |r,t:1|
BDBM171538 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(OCc3nccs3)cn2)ccc1F |r,t:1|
BDBM171539 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(OCc3ncco3)cn2)ccc1F |r,t:1|
BDBM171645 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCC#C)cn2)ccc1Cl |r,t:1|
BDBM171646 NC1=N[C@](CF)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2cnc(OCC#C)cn2)ccc1Cl |r,t:1|
BDBM171647 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(Cl)cc2Cl)ccc1Cl |r,t:1|
BDBM171648 COc1ccc(nc1)C(=O)Nc1ccc(Cl)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:23|
BDBM171649 Cc1cc(cnc1C(=O)Nc1ccc(Cl)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12)C#N |r,t:22|
BDBM171650 COc1cnc(C(=O)Nc2ccc(Cl)c(c2)[C@@]2(CF)N=C(N)O[C@@H]3C[C@H]23)c(Cl)c1 |r,t:20|
BDBM171651 CC#CCOc1cnc(cn1)C(=O)Nc1ccc(Cl)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:26|
BDBM171757 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(N[C@H]2CCOc3cc(cnc23)C#N)ccc1F |r,t:1|
BDBM171758 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(N[C@@H]2CCc3cc(Br)ccc23)ccc1F |r,t:1|
BDBM171759 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(Nc2coc3cc(Cl)ccc23)ccc1F |r,t:1|
BDBM171760 COCc1cc(cnc1C(=O)Nc1ccc(Cl)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12)C#N |r,t:24|
BDBM171761 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(cc2CO)C#N)ccc1Cl |r,t:1|
BDBM171762 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ncc(cc2F)C#N)ccc1F |r,t:1|
BDBM171763 CN(C)c1cc(cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F)C#N |r,t:22|
BDBM50030747 CC(C)(C)OC(=O)NN(CC(=O)N1CCOCC1)C#N
BDBM50061594 NC1=N[C@@]2(CO1)c1cc(ccc1Oc1cnc(cc21)C1=CCCOC1)-c1cccnc1F |r,t:1,23|
BDBM171576 CC#CCOc1cnc(cn1)C(=O)Nc1ccc(Cl)c(c1)[C@@]1(N=C(N)O[C@H]2C[C@@H]12)C(F)F |r,t:24|
BDBM50036571 CN1C(=N)N[C@](CCC2CCCCC2)(C[C@H]2CCC[C@H](C2)NC(=O)c2ccncc2)C1=O |r|
BDBM50036574 CN1C(=N)N[C@](CCC2CCCCC2)(C[C@H]2CCC[C@H](C2)NC2CCCC2)C1=O |r|
BDBM193081 C[C@@H]([C@@H]1CC[C@@H](O1)c1cc(F)c(Cl)cc1C(F)(F)F)N1CCn2c(ccc(-n3cnc(C)c3)c2=O)C1=O
BDBM50055893 COc1ccc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)cc1F |r|
BDBM50055907 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)ccc1F |r|
BDBM50055908 COc1ccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)cc1OC |r|
BDBM50055914 COc1cc(CCCC(=O)NC(=N)NCc2ccccc2)c(cc1OC)[N+]([O-])=O
BDBM50055915 COc1cc(CC(=O)NC(=N)NCc2ccccc2)c(cc1OC)[N+]([O-])=O
BDBM50055917 COc1cc(CC(=O)NC(=N)NCc2ccccc2Cl)c(cc1OC)[N+]([O-])=O
BDBM50055922 COc1cc(CC(=O)NC(=N)NCc2ccc(Cl)c(Cl)c2)c(cc1OC)[N+]([O-])=O
BDBM50055923 COc1cc(Br)c(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2cccc(c2)-c2nnn[nH]2)cc1OC |r|
BDBM50055929 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2cccc(c2)-c2nnn[nH]2)cc1OC |r|
BDBM50055930 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(-c3nnn[nH]3)c(F)c2)cc1OC |r|
BDBM50055933 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(F)c(F)c2)cc1OC |r|
BDBM50055934 COc1ccc(CNC(=O)[C@@H](CC(C)C)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)cc1OC |r|
BDBM50055936 COc1ccc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)cc1OC |r|
BDBM50078320 [H][C@]12CSC(N)=N[C@]1(CO[C@H](C2)C(F)F)c1ccc(F)cc1F |r,c:5|
BDBM50078321 [H][C@]12CSC(N)=N[C@]1(CO[C@@H](CC(C)C)C2)c1ccc(F)cc1F |r,c:5|
BDBM50078322 [H][C@]12CSC(N)=N[C@]1(CO[C@H](C2)C1CC1)c1ccc(F)cc1F |r,c:5|
BDBM50078324 [H][C@]12CSC(N)=N[C@]1(CO[C@@H](COC)C2)c1ccc(F)cc1F |r,c:5|
BDBM50078349 [H][C@]12CSC(N)=N[C@]1(CO[C@@H](C)C2)c1ccc(F)cc1F |r,c:5|
BDBM50078350 COC[C@@H]1CSC(N)=N[C@]1(C)c1ccc(F)cc1F |r,c:7|
BDBM50078352 [H][C@@]12COC[C@@]1(N=C(N)SC2)c1ccc(F)cc1F |r,t:7|
BDBM171804 CC#Cc1cncc(c1)-c1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:19|
BDBM50061580 NC1=N[C@@]2(CO1)c1cc(ccc1Oc1cnc(cc21)-c1ccnc(F)c1)-c1cccnc1F |r,t:1|
BDBM50055892 COc1cc(CNC(=O)[C@@H](CC(C)C)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)ccc1F |r|
BDBM50055909 COc1ccc(CC(=O)NC(=N)N[C@@H](Cc2ccccc2)C(=O)NCCN2C(=O)c3ccccc3C2=O)cc1OC |r|
BDBM50055910 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCCN2C(=O)c3ccccc3C2=O)cc1OC |r|
BDBM50055913 COc1ccc(CCC(=O)NC(=N)NCc2ccccc2)cc1OC
BDBM50055918 COc1ccc(CNC(=N)NC(=O)Cc2cc(OC)c(OC)cc2[N+]([O-])=O)cc1OC
BDBM50055920 COc1ccc(CC(=O)NC(=N)NCc2ccc(C)cc2)cc1OC
BDBM50061582 NC1=N[C@@]2(CO1)c1cc(ccc1Oc1cnc(cc21)C1=CCOCC1)-c1cccnc1F |r,t:1,23|
BDBM50061584 NC1=N[C@@]2(CO1)c1cc(ccc1Oc1cnc(cc21)N1CCC(F)(F)CC1)-c1cccnc1F |r,t:1|
BDBM50061585 NC1=N[C@@]2(CO1)c1cc(ccc1Oc1cnc(cc21)N1CCC(F)(F)C1)-c1cccnc1F |r,t:1|
BDBM50061587 NC1=N[C@@]2(CO1)c1cc(ccc1Oc1cnc(cc21)N1CC[C@@H](F)C1)-c1cccnc1F |r,t:1|
BDBM50061588 NC1=N[C@@]2(CO1)c1cc(ccc1Oc1cnc(cc21)-c1ccccc1)-c1cccnc1F |r,t:1|
BDBM50061589 NC1=N[C@@]2(CO1)c1cc(ccc1Oc1cnc(cc21)-c1ccccn1)-c1cccnc1F |r,t:1|
BDBM50055924 COc1cc(Br)c(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2cccc(c2)-c2nnn[nH]2)cc1OC |r|
BDBM50055925 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2cc(OC)c(OC)cc2Br)ccc1F |r|
BDBM50055926 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2ccc(-c3nnn[nH]3)c(F)c2)cc1OC |r|
BDBM50055927 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2ccc(cc2)-c2nnn[nH]2)cc1OC |r|
BDBM50055931 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(cc2)-c2nnn[nH]2)cc1OC |r|
BDBM50055932 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2cccc(c2)-c2nnn[nH]2)cc1OC |r|
BDBM50061595 NC1=N[C@@]2(CO1)c1cc(ccc1Oc1cnc(cc21)C1CCOCC1)-c1cccnc1F |r,t:1|
BDBM50061596 NC1=N[C@@]2(CO1)c1cc(ccc1Oc1cnc(cc21)C1CCCOC1)-c1cccnc1F |r,t:1|
BDBM50061597 NC1=N[C@@]2(CO1)c1cc(ccc1Oc1cnc(cc21)[C@@H]1CCCCO1)-c1cccnc1F |r,t:1|
BDBM50061598 NC1=N[C@@]2(CO1)c1cc(ccc1Oc1cnc(cc21)[C@H]1CCCCO1)-c1cccnc1F |r,t:1|
BDBM50061599 NC1=N[C@@]2(CO1)c1cc(ccc1Oc1cnc(cc21)N1CCOCC1)-c1cccnc1F |r,t:1|
BDBM50036575 CN1C(=N)N[C@](CCC2CCCCC2)(C[C@H]2CCC[C@H](C2)NCC2CC2)C1=O |r|
BDBM50036576 CN1C(=N)N[C@](CCC2CCCCC2)(C[C@H]2CCC[C@H](C2)NC(=O)c2ccccc2)C1=O |r|
BDBM50036577 CN1C(=N)N[C@](CCC2CCCCC2)(C[C@H]2CCC[C@H](C2)NC2CCCCC2)C1=O |r|
BDBM50036579 [H][C@]1(C[C@@]2(CCC3CCCCC3)NC(=N)N(C)C2=O)CCN(C1)C(=O)CCCC |r|
BDBM50036581 [H][C@]1(C[C@@]2(CCC3CCCCC3)NC(=N)N(C)C2=O)CCN(C1)C(=O)CC1CCCC1 |r|
BDBM50036582 CN1C(=N)N[C@](CCC2CCCCC2)(C[C@H]2CCC[C@H](C2)NC(=O)Nc2ccccc2)C1=O |r|
BDBM50036583 CN1C(=N)N[C@](CCC2CCCCC2)(C[C@H]2CCC[C@H](C2)NC(=O)Cc2ccccc2)C1=O |r|
BDBM50036584 [H][C@]1(C[C@@]2(CCC3CCCCC3)NC(=N)N(C)C2=O)CCCN(C1)C(=O)CCCC |r|
BDBM50036585 [H][C@]1(C[C@@]2(CCC3CCCCC3)NC(=N)N(C)C2=O)CCCN(C1)S(=O)(=O)CCCC |r|
BDBM50036588 [H][C@]1(C[C@@]2(CCC3CCCCC3)NC(=N)N(C)C2=O)CCCNC1 |r|
BDBM50036589 [H][C@]1(C[C@@]2(CCC3CCCCC3)NC(=N)N(C)C2=O)CCCN(C1)C(=O)CC1CCCC1 |r|
BDBM50036590 [H][C@@]1(C[C@@]2(CCC3CCCCC3)NC(=N)N(C)C2=O)CCCNC1 |r|
BDBM50036591 [H][C@@]1(C[C@@]2(CCC3CCCCC3)NC(=N)N(C)C2=O)CCCN(C1)C(=O)CCCC |r|
BDBM50036592 [H][C@]1(C[C@@]2(CCC3CCCCC3)NC(=N)N(C)C2=O)CCCN(C1)C(=O)NCCC |r|
BDBM50036593 [H][C@]1(C[C@@]2(CCC3CCCCC3)NC(=N)N(C)C2=O)CCCN(CCCCC)C1 |r|
BDBM50036594 CN1C(=N)N[C@](CCC2CCCCC2)(C[C@H]2CCC[C@H](C2)NC(=O)NC2CCCCC2)C1=O |r|
BDBM50036596 CN1C(=N)N[C@](CCC2CCCCC2)(C[C@H]2CCC[C@H](C2)NC(=O)Nc2ccc(cc2)C#N)C1=O |r|
BDBM50036597 CN1C(=N)N[C@](CCC2CCCCC2)(C[C@H]2CCC[C@H](C2)NC(=O)Nc2cnc3ccccc3n2)C1=O |r|
BDBM50036598 [H][C@]1(C[C@@]2(CCC3CCCCC3)NC(=N)N(C)C2=O)CCCN(C1)C(=O)OC(C)(C)C |r|
BDBM50055911 COc1ccc(CC(=O)NC(=N)NCc2ccc(N)cc2)cc1OC
BDBM50036600 CN1C(=N)N[C@](CCC2CCCCC2)(C[C@H]2CCC[C@H](C2)NC(=O)Nc2ccc3ccccc3n2)C1=O |r|
BDBM50036601 [H][C@@]1(C[C@@]2(CCC3CCCCC3)NC(=N)N(C)C2=O)CCCN(C1)C(=O)OC(C)(C)C |r|
BDBM50036602 CN1C(=N)N[C@](CCC2CCCCC2)(C[C@H]2CCC[C@H](C2)NC(=O)Nc2ccc(Cl)cc2)C1=O |r|
BDBM50036604 CN1C(=N)N[C@](CCC2CCCCC2)(C[C@H]2CCC[C@H](C2)NC(=O)Nc2ccccc2Cl)C1=O |r|
BDBM50036606 COc1ccc(NC(=O)N[C@@H]2CCC[C@H](C[C@@]3(CCC4CCCCC4)NC(=N)N(C)C3=O)C2)cc1 |r|
BDBM50036607 COc1ccccc1NC(=O)N[C@@H]1CCC[C@H](C[C@@]2(CCC3CCCCC3)NC(=N)N(C)C2=O)C1 |r|
BDBM50036608 [H][C@@]1(C[C@@]2(CCC3CCCCC3)NC(=N)N(C)C2=O)CCCN(C1)C(=O)CC1CCCC1 |r|
BDBM50031612 CC(C)(C)COc1ccc2Oc3ccc(cc3[C@@]3(COC(N)=N3)c2c1)-c1cncnc1 |r,c:22|
BDBM50031613 CC1(COC1)C#Cc1cnc2Oc3ccc(cc3[C@@]3(COC(N)=N3)c2c1)-c1cccnc1F |r,c:24|
BDBM50061590 NC1=N[C@@]2(CO1)c1cc(ccc1Oc1cnc(cc21)-c1cccnc1)-c1cccnc1F |r,t:1|
BDBM50061592 Cc1cc(ccn1)-c1cc2c(Oc3ccc(cc3[C@@]22COC(N)=N2)-c2cccnc2F)cn1 |r,c:25|
BDBM50061593 CC1(C)OCCC(=C1)c1cc2c(Oc3ccc(cc3[C@@]22COC(N)=N2)-c2cccnc2F)cn1 |r,c:6,26|
BDBM50065390 CC(C)[C@]1(C)CC(=O)N(Cc2cccc(c2)C(=O)NCc2ccccc2)C(=N)N1 |r|
BDBM50078323 [H][C@]12CSC(N)=N[C@]1(CO[C@@H](CC)C2)c1ccc(F)cc1F |r,c:5|
BDBM50078351 COC[C@H]1CSC(N)=N[C@]1(C)c1ccc(F)cc1F |r,c:7|
BDBM50055916 COc1ccc(Cl)c(CC(=O)NC(=N)NCc2ccccc2)c1
BDBM50055928 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2cccc(-c3nnn[nH]3)c2F)cc1OC |r|
BDBM50058810 [H][C@@]12CC[C@]3(C)[C@]([H])(CC=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@@]5(CC[C@@]34C)C(=O)OC)[C@@]1(C)CC[C@H](O)C2(C)C |r,t:9|
BDBM50042296 CC(C)CNC(=O)[C@@H](NC(=O)[C@H](C)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CNC(=O)OC(C)(C)C)NC(=O)[C@@H](C)Cc1nc(C)cs1)C(C)C |r|
BDBM50081642 [H][C@@]12C[C@@H](OC[C@@]1(N=C(N)S[C@@H]2CF)c1ccc(F)cc1F)c1nc(C)co1 |r,t:8|
BDBM50081645 [H][C@]12CSC(N)=N[C@]1(CO[C@H](C2)c1cc(C)no1)c1ccc(F)cc1F |r,c:5|
BDBM50081646 [H][C@]12CSC(N)=N[C@]1(CO[C@H](C2)c1nc(C)co1)c1ccc(F)cc1F |r,c:5|
BDBM50065389 C[C@]1(CC(=O)N(Cc2cccc(c2)C(=O)NCc2ccccc2)C(=N)N1)c1ccc2sccc2c1 |r|
BDBM50055921 COc1cc(CC(=O)NC(=N)NCc2ccc(Cl)cc2)c(cc1OC)[N+]([O-])=O
BDBM171424 COc1cnc(C(=O)Nc2ccc(F)c(c2)[C@@]2(N=C(N)O[C@H]3C[C@@H]23)C(F)F)c(C)n1 |r,t:18|
BDBM171518 COc1cnc(cn1)C(=O)Nc1cc(F)c(Cl)c(c1)[C@]1(CF)N=C(N)O[C@H]2C[C@@H]12 |r,t:24|
BDBM171816 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)N=C(N)O[C@@H]2C[C@H]12 |t:22|
BDBM171703 C[C@]1(N=C(N)O[C@H]2C[C@@H]12)c1cc(NC(=O)c2ccc(Cl)cn2)cnc1F |r,t:2|
BDBM171396 Cc1cc(NC(=O)c2ccc(Cl)cn2)cc(c1F)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:21|
BDBM171519 Cc1cc(OC(F)F)cnc1C(=O)Nc1cc(F)c(Cl)c(c1)[C@]1(CF)N=C(N)O[C@H]2C[C@@H]12 |r,t:27|
BDBM171675 Cc1cc(cnc1C(=O)Nc1cc(F)c(C)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F)C#N |r,t:21|
BDBM171503 Cc1cc(cnc1C(=O)Nc1cc(F)c(Cl)c(c1)[C@]1(CF)N=C(N)O[C@H]2C[C@@H]12)C#N |r,t:23|
BDBM171525 Cc1nc(OCC(F)(F)F)cnc1C(=O)Nc1cc(F)c(Cl)c(c1)[C@]1(CF)N=C(N)O[C@H]2C[C@@H]12 |r,t:29|
BDBM171463 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1Cl |r,t:1|
BDBM171459 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1Cl |r,t:1|
BDBM171477 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCC#C)cn2)cc(F)c1F |r,t:1|
BDBM171754 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(N[C@H]2CCc3cc(Br)cnc23)ccc1F |r,t:1|
BDBM171629 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cccc(NC(=O)c2ccc(Cl)cn2)c1 |r,t:1|
BDBM50065428 CC(C)[C@]1(C)CC(=O)N(Cc2cc(F)cc(c2)C(=O)N[C@@H](C)c2ccccc2)C(=N)N1 |r|
BDBM171700 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1nc(NC(=O)c2ccc(cn2)[N+]#[C-])ccc1F |r,t:1|
BDBM171414 NC1=N[C@@](CF)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(Cl)cn2)cc(F)c1F |r,t:1|
BDBM171421 NC1=N[C@](C(F)F)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,t:1|
BDBM171425 NC1=N[C@](C(F)F)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1F |r,t:1|
BDBM171585 NC1=N[C@](C(F)F)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2cnc(OCC#C)cn2)ccc1Cl |r,t:1|
BDBM171428 NC1=N[C@](C(F)F)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ncc(cc2Cl)C#N)ccc1F |r,t:1|
BDBM171586 NC1=N[C@](C(F)F)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2nn(cc2Cl)C(F)F)ccc1Cl |r,t:1|
BDBM171719 NC1=N[C@](C(F)F)([C@@H]2C[C@@H]2O1)c1cc(Nc2ncc(F)c3cc(cnc23)C#N)ccc1Cl |r,t:1|
BDBM171397 NC1=N[C@](CF)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(Cl)cn2)cc(F)c1F |r,t:1|
BDBM171637 NC1=N[C@](CF)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1Cl |r,t:1|
BDBM50065660 COCCCOc1cc(ccc1OC)C(=O)N(C[C@@H]1CNC[C@H]1OC(=O)NCc1ccccc1)C(C)C |r|
BDBM50066260 COCCCOc1cc(ccc1OC)C(=O)N(C[C@@H]1CNC[C@H]1NCc1ccc2ccccc2c1)C(C)C |r|
BDBM223395 C[C@H]1C[C@H]2CSC(N)=N[C@]2(CO1)c1nc(NC(=O)c2ccc(OC(F)F)cn2)cs1 |r,c:7|
BDBM202620 C[C@]1(COCC(N)=N1)c1cc(Nc2cccc3cc(OC(F)F)cnc23)ccc1F |r,c:6|
BDBM202627 CC1(COCC(N)=N1)c1cccc(Nc2cc(F)cc3cc(Cl)cnc23)c1 |c:6|
BDBM50139140 Nc1nc2cc(ccc2c(=O)n1C[C@H]1CC[C@H](O1)c1ccccc1)-c1ccccc1 |r|
BDBM50139141 Nc1nc2cc(ccc2c(=O)n1C[C@@H]1CC[C@H](O1)c1ccccc1)-c1ccccc1 |r|
BDBM50139142 Nc1nc2cc(ccc2c(=O)n1C[C@@H]1CC[C@@H](O1)c1ccccc1)-c1ccccc1 |r|
BDBM50099388 OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)OCc1ccccc1)[C@@H](O)CC(=O)NCCc1ccccc1 |r|
BDBM50099395 OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NS(=O)(=O)c1ccccc1)[C@@H](O)CC(=O)NCCc1ccccc1 |r|
BDBM50092467 Cl.NC1=NC2CCC(CC2CS1)NC(=O)c1ccc(F)cn1 |t:1|
BDBM50092468 OC(=O)C(F)(F)F.NC1=NC2CCC(CC2CS1)OC(=O)c1cccc(Cl)c1 |t:7|
BDBM50092470 Cl.[H][C@@]12COC[C@]3(CC[C@@H](C[C@]13[H])NC(=O)c1cccc(Cl)c1)N=C(N)S2 |r,t:25|
BDBM50092471 Cl.NC1=NC2CCC(CC2CS1)NC(=O)c1cccc(Cl)c1 |t:1|
BDBM50092472 Cl.NC1=NC2CCC(CC2CS1)NC(=O)c1ccccc1 |t:1|
BDBM50134794 CC(C)(C)OC(=O)N1C[C@H](Nc2nc3cc(F)ccc3[nH]2)[C@H](C1)OC(=O)c1ccc(cc1)-c1ccccc1 |r|
BDBM50134818 CC(C)c1ccc(cc1)C(=O)O[C@H]1CN(C[C@@H]1Nc1nc2cc(F)ccc2[nH]1)C(=O)OC(C)(C)C |r|
BDBM50134822 Cc1ccc2[nH]c(N[C@H]3CNC[C@@H]3OC(=O)c3ccc(cc3)-c3ccccc3)nc2c1 |r|
BDBM50134824 Cc1ccc2[nH]c(N[C@H]3CN(C[C@@H]3OC(=O)c3ccc(cc3)-c3ccccc3)C(=O)c3ccccc3)nc2c1 |r|
BDBM214815 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Nc2cc(Cl)ccn2)ccc1F |r,t:1|
BDBM214814 COc1cccnc1Nc1ccc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:25|
BDBM214901 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Oc2cccc(Cl)n2)ccc1F |r,t:1|
BDBM214902 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Oc2ccccn2)ccc1F |r,t:1|
BDBM214903 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Oc2cc(ccn2)-c2ccccc2)ccc1F |r,t:1|
BDBM214904 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(ccc1F)-c1cncc(c1)C#N |r,t:1|
BDBM214905 CC#Cc1cncc(c1)-c1ccc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:25|
BDBM214906 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(ccc1F)-c1nc2ccc(Cl)cc2o1 |r,t:1|
BDBM214907 COC(=O)c1ccnc(Oc2ccc(F)c(c2)[C@]2(CF)C[C@H](OC(N)=N2)C(F)(F)F)c1 |r,c:25|
BDBM214914 CC#Cc1ccc(cn1)-c1ccc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:25|
BDBM214915 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(ccc1F)-c1ncc2cc(F)ccc2n1 |r,t:1|
BDBM214916 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Nc2cc(ccn2)-c2ccccc2)ccc1F |r,t:1|
BDBM214917 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(ccc1F)-c1ccc2cc(F)ccc2n1 |r,t:1|
BDBM214918 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(ccc1F)-c1ccc2ccc(F)cc2n1 |r,t:1|
BDBM214919 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(ccc1F)-c1cncc(c1)-c1nnco1 |r,t:1|
BDBM214920 COC1CCN(CC1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:26|
BDBM215018 Cc1cc(cnc1C(=O)Nc1cc(Cl)c(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F)C#N |r,c:26|
BDBM215019 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2cnc(cn2)C(F)F)cc(Cl)c1F |r,c:6|
BDBM215020 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2cnc(OCC#C)cn2)cc(Cl)c1F |r,c:6|
BDBM215021 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ccc(Br)cn2)cc(Cl)c1F |r,c:6|
BDBM215022 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2cnc(OCC(F)(F)F)cn2)cc(Cl)c1F |r,c:6|
BDBM215023 COc1cnc(C(=O)Nc2cc(Cl)c(F)c(c2)[C@]2(C)C[C@H](OC(N)=N2)C(F)(F)F)c(C)n1 |r,c:24|
BDBM214921 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)N2CCC(CC2)OCC#C)ccc1F |r,c:6|
BDBM214922 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)N2CCc3ccccc3C2)ccc1F |r,c:6|
BDBM214923 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)N2CCC(CC2)C(F)F)ccc1F |r,c:6|
BDBM214924 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)N2CCC=CC2)ccc1F |r,c:6,22|
BDBM214925 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)N2CCC(=CC2)C#CC2CC2)ccc1F |r,c:6,22|
BDBM214926 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(ccc1F)C#Cc1ccc(cn1)C#N |r,t:1|
BDBM214927 CNC(=O)c1ccc(nc1)C#Cc1ccc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:28|
BDBM214804 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ccc(OCC(F)(F)F)cn2)ccc1F |r,t:1|
BDBM214803 Cc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:27|
BDBM214805 Cc1c(nc2ccc(Cl)cn12)C(=O)Nc1ccc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:31|
BDBM214816 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Nc2ccnc(Br)c2)ccc1F |r,t:1|
BDBM214817 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Nc2nccc3nc(cnc23)C(F)(F)F)ccc1F |r,t:1|
BDBM214818 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Nc2ncc(F)c3cc(Cl)cnc23)ccc1F |r,t:1|
BDBM214819 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Nc2nccc3cn(nc23)C(F)F)ccc1F |r,t:1|
BDBM214928 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(ccc1F)C#Cc1ccc(OC(F)F)cn1 |r,t:1|
BDBM214929 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(ccc1F)C#Cc1ccc(OC2CCC2)cn1 |r,t:1|
BDBM214930 CNC(=O)c1ccnc(c1)C#Cc1ccc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:28|
BDBM214931 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(ccc1F)C#Cc1cccc2[nH]ccc12 |r,t:1|
BDBM214932 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(ccc1F)C#Cc1ccc2[nH]ccc2c1 |r,t:1|
BDBM214933 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(ccc1F)C#Cc1ccc2cc[nH]c2c1 |r,t:1|
BDBM214801 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:27|
BDBM214806 Cc1c(nc2ccccn12)C(=O)Nc1ccc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:30|
BDBM214820 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Nc2ncnc3sc(nc23)C(F)F)ccc1F |r,t:1|
BDBM214934 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(ccc1F)C#Cc1cccc2cc[nH]c12 |r,t:1|
BDBM214935 NC1=NC(C[C@H](O1)C(F)(F)F)(C(F)F)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,t:1|
BDBM214937 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1nc(NC(=O)c2nn(cc2Cl)C(F)F)ccc1F |r,t:1|
BDBM214938 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1nc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,t:1|
BDBM214822 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Nc2ncnc3cc(cnc23)[N+]#[C-])ccc1F |r,t:1|
BDBM214823 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Nc2ccnc(c2)C#N)ccc1F |r,t:1|
BDBM214824 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(CF)C[C@@H](OC(N)=N1)C(F)(F)F |r,c:27|
BDBM214941 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(N)cnc1F |t:1|
BDBM214943 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ccc(Cl)cn2)cnc1F |r,t:1|
BDBM214944 Cc1cc(cnc1C(=O)Nc1cnc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F)C#N |r,c:26|
BDBM214945 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ccc(cn2)C#N)cnc1F |r,t:1|
BDBM214946 COc1ccc(nc1)C(=O)Nc1cnc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:27|
BDBM214827 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)C[C@H](OC(NC(=O)c2ccccc2)=N1)C(F)(F)F |r,c:35|
BDBM214828 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ccc(OCC#C)cn2)ccc1F |r,c:6|
BDBM214829 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(Nc2nc3ccc(Cl)cc3o2)ccc1F |r,c:6|
BDBM214830 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(Nc2nc3cc(Cl)ccc3o2)ccc1F |r,c:6|
BDBM214831 Cc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:26|
BDBM214832 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ncc(cc2Cl)C#N)ccc1F |r,t:1|
BDBM214948 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cccc(NC(=O)c2ccc(Cl)cn2)c1 |r,t:1|
BDBM214949 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cccc(NC(=O)c2ccc(cn2)C#N)c1 |r,t:1|
BDBM214950 COc1ccc(nc1)C(=O)Nc1cccc(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:26|
BDBM214951 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cccc(Nc2nccc3cc(Cl)cnc23)c1 |r,t:1|
BDBM214952 COc1ncc(NC(=O)c2ccc(Cl)cn2)cc1[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:26|
BDBM214953 Cn1cc(NC(=O)c2ccc(Cl)cn2)cc(c1=O)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:26|
BDBM214833 COc1cnc(C(=O)Nc2ccc(F)c(c2)[C@]2(CF)C[C@H](OC(N)=N2)C(F)(F)F)c(C)n1 |r,c:24|
BDBM214834 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ncc(Cl)cc2F)ccc1F |r,t:1|
BDBM214835 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2cnc(OCC#C)cn2)ccc1F |r,t:1|
BDBM214836 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2nn(cc2Cl)C(F)F)ccc1F |r,t:1|
BDBM214837 Cc1cc(OCC2CC2)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:32|
BDBM214838 Cc1nc(OCC(F)(F)F)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:32|
BDBM214954 Cn1cc(NC(=O)c2ccc(cn2)[N+]#[C-])cc(c1=O)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:27|
BDBM214955 Cc1cc(cnc1C(=O)Nc1cc(c(=O)n(C)c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F)[N+]#[C-] |r,c:26|
BDBM214957 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ccc(cn2)[N+]#[C-])cc(F)c1F |r,t:1|
BDBM214958 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ccc(Cl)cn2)cc(F)c1F |r,t:1|
BDBM214959 COc1cnc(cn1)C(=O)Nc1cc(F)c(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:28|
BDBM214960 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2cnc(OCC#C)cn2)cc(F)c1F |r,t:1|
BDBM214839 CC#CCOc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:30|
BDBM214840 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ncc(cc2Cl)C(F)F)ccc1F |r,t:1|
BDBM214841 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ccc(cn2)C(F)F)ccc1F |r,t:1|
BDBM214842 Cc1cc(OC(F)F)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:30|
BDBM214843 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ncc(cc2Cl)C(F)(F)F)ccc1F |r,t:1|
BDBM214844 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2cnc(OCC#C)cn2)ccc1F |r,c:6|
BDBM214961 CC#CCOc1cnc(cn1)C(=O)Nc1cc(F)c(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:31|
BDBM214962 COc1ccc(nc1)C(=O)Nc1cc(F)c(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:28|
BDBM214963 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ccc(Br)cn2)cc(F)c1F |r,t:1|
BDBM214964 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ccc(cn2)C#CC2CC2)cc(F)c1F |r,t:1|
BDBM214965 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ccc(OCC#C)cn2)cc(F)c1F |r,t:1|
BDBM214966 CC#CCOc1ccc(nc1)C(=O)Nc1cc(F)c(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:31|
BDBM214845 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2cnc(OCc3ncco3)cn2)ccc1F |r,t:1|
BDBM214846 COc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:28|
BDBM214847 COc1cc(cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F)C#N |r,c:27|
BDBM214848 COc1ccc(nc1)C(=O)Nc1ccc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:27|
BDBM214849 COc1cnc(C(=O)Nc2ccc(F)c(c2)[C@]2(CF)C[C@H](OC(N)=N2)C(F)(F)F)c(Cl)c1 |r,c:24|
BDBM214851 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ccc(Br)cn2)ccc1F |r,t:1|
BDBM214967 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Nc2nccc3cc(Cl)cnc23)cc(F)c1F |r,t:1|
BDBM214968 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Nc2nccc3cc(cnc23)C#N)cc(F)c1F |r,t:1|
BDBM214970 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ccc(cn2)[N+]#[C-])cc(F)c1F |r,c:6|
BDBM214971 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ccc(Cl)cn2)cc(F)c1F |r,c:6|
BDBM214972 COc1cnc(cn1)C(=O)Nc1cc(F)c(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:27|
BDBM214973 Cc1cc(cnc1C(=O)Nc1cc(F)c(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F)C#N |r,c:26|
BDBM214852 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ccc(cn2)C#CC2CC2)ccc1F |r,t:1|
BDBM214853 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Nc2ncc(F)c3cc(cnc23)C#CC2CC2)ccc1F |r,t:1|
BDBM214854 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Nc2nccc3cc(cnc23)C#CC2CC2)ccc1F |r,t:1|
BDBM214855 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ncc(Br)cc2Cl)ccc1F |r,t:1|
BDBM214856 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |r,t:1|
BDBM214857 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ncc(Cl)cc2Cl)ccc1F |r,t:1|
BDBM214974 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ncc(cc2Cl)C#N)cc(F)c1F |r,c:6|
BDBM214975 COc1cc(cnc1C(=O)Nc1cc(F)c(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F)C#N |r,c:27|
BDBM214976 COc1cnc(C(=O)Nc2cc(F)c(F)c(c2)[C@]2(C)C[C@H](OC(N)=N2)C(F)(F)F)c(Cl)c1 |r,c:24|
BDBM214977 Cc1cc(Cl)cnc1C(=O)Nc1cc(F)c(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:27|
BDBM214978 Cc1cc(cnc1C(=O)Nc1cc(F)c(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F)C(F)F |r,c:26|
BDBM214979 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ncc(Cl)cc2Cl)cc(F)c1F |r,c:6|
BDBM215024 Cc1cc(NC(=O)c2ncc(cc2C)C(F)F)cc(c1F)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:30|
BDBM215025 COc1cnc(C(=O)Nc2cc(C)c(F)c(c2)[C@]2(CF)C[C@H](OC(N)=N2)C(F)(F)F)c(C)n1 |r,c:25|
BDBM214808 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(CF)C[C@H](OC(N)=N3)C(F)(F)F)nccc2n1 |r,c:23|
BDBM214810 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Nc2ncnc3cc(Cl)cnc23)ccc1F |r,t:1|
BDBM214860 Cc1cc(Cl)cnc1C(=O)Nc1cnc(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:26|
BDBM214861 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ccc(cn2)C#N)cnc1F |r,c:6|
BDBM214862 COc1ccc(nc1)C(=O)Nc1cnc(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:26|
BDBM214863 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ccc(F)cn2)cnc1F |r,c:6|
BDBM214864 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ccc(OCC(F)(F)F)cn2)cnc1F |r,c:6|
BDBM214865 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ncc(cc2Cl)C#N)cnc1F |r,c:6|
BDBM214980 COc1cnc(C(=O)Nc2cc(F)c(F)c(c2)[C@]2(C)C[C@H](OC(N)=N2)C(F)(F)F)c(C)n1 |r,c:24|
BDBM214981 Cc1cc(OC(F)F)cnc1C(=O)Nc1cc(F)c(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:30|
BDBM214982 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ccc(Br)cn2)cc(F)c1F |r,c:6|
BDBM214983 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(Nc2nccc3cc(Cl)cnc23)cc(F)c1F |r,c:6|
BDBM214984 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(Nc2ncc(F)c3cc(cnc23)C#N)cc(F)c1F |r,c:6|
BDBM214985 COc1cnc2c(Nc3cc(F)c(F)c(c3)[C@]3(C)C[C@H](OC(N)=N3)C(F)(F)F)nccc2n1 |r,c:23|
BDBM215026 Cc1cc(NC(=O)c2cnc(OCC#C)cn2)cc(c1F)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:30|
BDBM215027 Cc1cc(NC(=O)c2ncc(cc2C)C#N)cc(c1F)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:29|
BDBM215028 Cc1cc(NC(=O)c2ncc(OCC(F)(F)F)cc2C)cc(c1F)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:33|
BDBM215029 Cc1cc(NC(=O)c2ccc(cn2)C(F)F)cc(c1F)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:29|
BDBM215030 COc1cc(Cl)cnc1C(=O)Nc1cc(C)c(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:29|
BDBM215031 Cc1cc(NC(=O)c2ccc(F)cn2)cc(c1F)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:27|
BDBM214802 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,t:1|
BDBM214811 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(CF)C[C@H](OC(N)=N3)C(F)(F)F)nccc2c1 |r,c:23|
BDBM214812 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(CF)C[C@H](OC(N)=N3)C(F)(F)F)ncnc2c1 |r,c:23|
BDBM214813 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Nc2ncccc2F)ccc1F |r,t:1|
BDBM214866 Cc1cc(cnc1C(=O)Nc1cnc(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F)C#N |r,c:25|
BDBM214867 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ncc(Cl)cc2Cl)cnc1F |r,c:6|
BDBM214868 COc1cnc(C(=O)Nc2cnc(F)c(c2)[C@]2(C)C[C@H](OC(N)=N2)C(F)(F)F)c(Cl)c1 |r,c:23|
BDBM214869 COc1cnc(cn1)C(=O)Nc1cnc(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:26|
BDBM214870 CC(C)n1cc(Cl)c(n1)C(=O)Nc1cnc(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:27|
BDBM214871 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2nn(cc2Cl)C(F)F)cnc1F |r,c:6|
BDBM214872 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2cnc(OCC#C)cn2)cnc1F |r,c:6|
BDBM214986 COc1cnc2c(Nc3cc(F)c(F)c(c3)[C@]3(C)C[C@H](OC(N)=N3)C(F)(F)F)nccc2c1 |r,c:23|
BDBM214987 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(Nc2nccc3cc(cnc23)C#N)cc(F)c1F |r,c:6|
BDBM214989 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(ccc1F)C(=O)NC1CC1 |r,t:1|
BDBM214992 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ccc(cn2)[N+]#[C-])ccc1F |r,c:6|
BDBM215032 Cc1cc(NC(=O)c2ccc(Cl)cn2)cc(c1F)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:27|
BDBM215033 Cc1cc(NC(=O)c2ccc(cn2)C#N)cc(c1F)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:28|
BDBM215034 COc1cnc(C(=O)Nc2cc(C)c(F)c(c2)[C@]2(CF)C[C@H](OC(N)=N2)C(F)(F)F)c(C)c1 |r,c:25|
BDBM215035 COc1cnc(cn1)C(=O)Nc1cc(C)c(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:28|
BDBM215036 Cc1cc(NC(=O)c2ncc(OC(F)F)cc2C)cc(c1F)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:31|
BDBM215037 COc1ccc(nc1)C(=O)Nc1cc(C)c(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:28|
BDBM214809 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Nc2ncc(F)c3cc(cnc23)C#N)ccc1F |r,t:1|
BDBM214873 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(Nc2ncnc3cc(Cl)cnc23)cnc1F |r,c:6|
BDBM214874 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(Nc2ncnc3cc(cnc23)C#N)cnc1F |r,c:6|
BDBM214875 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(Nc2nccc3cc(Cl)cnc23)cnc1F |r,c:6|
BDBM214876 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(Nc2nccc3cc(cnc23)C#N)cnc1F |r,c:6|
BDBM214877 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(Nc2ncc(F)c3cc(cnc23)C#N)cnc1F |r,c:6|
BDBM214879 COc1cnc(C(=O)Nc2ccc(F)c(n2)[C@]2(C)C[C@H](OC(N)=N2)C(F)(F)F)c(Cl)c1 |r,c:23|
BDBM214993 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2cnc(OCC(F)(F)F)cn2)cc(F)c1F |r,c:6|
BDBM214994 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ncc(cc2Cl)C(F)(F)F)cc(F)c1F |r,c:6|
BDBM214995 CC#CCOc1cnc(C(=O)Nc2cc(F)c(F)c(c2)[C@]2(C)C[C@H](OC(N)=N2)C(F)(F)F)c(C)c1 |r,c:27|
BDBM214996 CC#CCOc1ccc(nc1)C(=O)Nc1cc(F)c(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:30|
BDBM214997 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2cnc(OCC#C)cn2)cc(F)c1F |r,c:6|
BDBM214998 Cc1cc(OCC2CC2)cnc1C(=O)Nc1cc(F)c(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:32|
BDBM215038 Cc1cc(Nc2ncnc3cc(Cl)cnc23)cc(c1F)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:30|
BDBM215039 COc1cccnc1Nc1cc(F)c(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:25|
BDBM215040 Cc1cc(cnc1C(=O)Nc1cc(F)c(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F)C#N |r,c:27|
BDBM215041 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ncc(Cl)cc2F)cc(F)c1F |r,t:1|
BDBM215042 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=O)c2ncc(cc2F)C#N)cc(F)c1F |r,t:1|
BDBM215043 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Oc2cc(cc(Cl)n2)-c2ccccc2)ccc1F |r,t:1|
BDBM214880 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1nc(NC(=O)c2ncc(cc2Cl)C(F)(F)F)ccc1F |r,c:6|
BDBM214881 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1nc(NC(=O)c2ncc(cc2Cl)C#N)ccc1F |r,c:6|
BDBM214882 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1nc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,c:6|
BDBM214883 Cc1cc(cnc1C(=O)Nc1ccc(F)c(n1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F)C#N |r,c:25|
BDBM214884 Cc1cc(OC(F)F)cnc1C(=O)Nc1ccc(F)c(n1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:29|
BDBM214885 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1nc(NC(=O)c2ncc(Br)cc2Cl)ccc1F |r,c:6|
BDBM214886 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1nc(NC(=O)c2cnc(OCC#C)cn2)ccc1F |r,c:6|
BDBM214999 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ccc(OCC#C)cn2)cc(F)c1F |r,c:6|
BDBM215000 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2cnc(cn2)C(F)F)cc(F)c1F |r,c:6|
BDBM215001 Cc1cc(OCC(F)(F)F)cnc1C(=O)Nc1cc(F)c(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:32|
BDBM215002 COc1cc(Cl)cnc1C(=O)Nc1cc(F)c(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:28|
BDBM215003 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2nn(cc2Cl)C(F)F)cc(F)c1F |r,c:6|
BDBM215004 Cc1nc(OCC(F)(F)F)cnc1C(=O)Nc1cc(F)c(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:32|
BDBM215045 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ccc(Cl)cn2)cc(F)c1Cl |r,c:6|
BDBM215046 COc1cnc(cn1)C(=O)Nc1cc(F)c(Cl)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:27|
BDBM215047 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ccc(cn2)C#N)cc(F)c1Cl |r,c:6|
BDBM215048 COc1cnc(C(=O)Nc2cc(F)c(F)c(c2)[C@]2(C)C[C@H](OC(N)=N2)C(F)(F)F)c(F)c1 |r,c:24|
BDBM215049 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ncc(Br)cc2F)cc(F)c1F |r,c:6|
BDBM214887 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1nc(NC(=O)c2nn(cc2Cl)C(F)F)ccc1F |r,c:6|
BDBM214888 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1nc(Nc2ncc(F)c3cc(cnc23)C#N)ccc1F |r,c:6|
BDBM214889 Cc1cc(Cl)cnc1C(=S)Nc1ccc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:27|
BDBM214890 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(NC(=S)c2ccc(Cl)cn2)ccc1F |r,t:1|
BDBM214892 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Oc2cnccn2)ccc1F |r,t:1|
BDBM214893 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Oc2cc(Br)ccn2)ccc1F |r,t:1|
BDBM215005 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ncc(cc2Cl)C(F)F)cc(F)c1F |r,c:6|
BDBM215006 COCc1cc(Cl)cnc1C(=O)Nc1cc(F)c(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:29|
BDBM215007 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ccc(cn2)C(F)F)cc(F)c1F |r,c:6|
BDBM215008 COc1ccc(nc1)C(=O)Nc1cc(F)c(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:27|
BDBM215009 COc1cnc(C(=O)Nc2cc(F)c(F)c(c2)[C@]2(C)C[C@H](OC(N)=N2)C(F)(F)F)c(C)c1 |r,c:24|
BDBM214895 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Oc2ncccc2F)ccc1F |r,t:1|
BDBM214896 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Oc2ncc(Cl)cc2F)ccc1F |r,t:1|
BDBM214897 CNC(=O)c1ccnc(Oc2ccc(F)c(c2)[C@]2(CF)C[C@H](OC(N)=N2)C(F)(F)F)c1 |r,c:25|
BDBM214898 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Oc2ncccc2Cl)ccc1F |r,t:1|
BDBM214899 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Oc2cc(Br)cc(Cl)n2)ccc1F |r,t:1|
BDBM214900 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Oc2cc(ccn2)C(F)(F)F)ccc1F |r,t:1|
BDBM214908 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Oc2ncccc2C#N)ccc1F |r,t:1|
BDBM214909 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Oc2ncccn2)ccc1F |r,t:1|
BDBM214910 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Oc2nccc(c2F)C(F)(F)F)ccc1F |r,t:1|
BDBM214911 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Oc2cccc(n2)C(F)(F)F)ccc1F |r,t:1|
BDBM214912 C[Si](C)(C)C#Cc1ccc(cn1)-c1ccc(F)c(c1)[C@]1(CF)C[C@H](OC(N)=N1)C(F)(F)F |r,c:28|
BDBM214913 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(ccc1F)-c1ccc(nc1)C#C |r,t:1|
BDBM215011 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2cnc(OCc3ncco3)cn2)cc(F)c1F |r,c:6|
BDBM215012 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ncc(Cl)cc2F)cc(F)c1F |r,c:6|
BDBM215014 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ccc(cn2)C#N)cc(Cl)c1F |r,c:6|
BDBM215015 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ccc(Cl)cn2)cc(Cl)c1F |r,c:6|
BDBM215016 COc1cnc(cn1)C(=O)Nc1cc(Cl)c(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:27|
BDBM215017 COc1ccc(nc1)C(=O)Nc1cc(Cl)c(F)c(c1)[C@]1(C)C[C@H](OC(N)=N1)C(F)(F)F |r,c:27|
BDBM50145182 Nc1nc2cc(ccc2c(=O)n1C[C@@H]1CC[C@@H](O1)c1ccc2ccccc2c1)-c1ccccc1 |r|
BDBM50145183 Nc1nc2cc(ccc2c(=O)n1C[C@@H]1CC[C@@H](O1)c1ccccc1)-c1ccc(CCCCc2ccccc2)cc1 |r|
BDBM50145186 Nc1nc2cc(ccc2c(=O)n1C[C@@H]1CC[C@@H](O1)c1ccccc1)-c1ccc(CCCCCc2ccccc2)cc1 |r|
BDBM210070 C[C@]1(C=CSC(N)=N1)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1F |r,c:2,6|
BDBM50099238 Cl.CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCN)NC(=O)OCc1ccccc1)[C@@H](O)CC(=O)NC1CCCCC1 |r|
BDBM214826 C[C@]1(C[C@H](OC(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,c:6|
BDBM50134917 CC(C)(C)OC(=O)N1C[C@H](Nc2nc3cc(F)ccc3[nH]2)[C@H](C1)OCc1ccc(cc1)-c1ccccc1 |r|
BDBM50099148 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(C)=O)[C@@H](O)CC(=O)N[C@@H](CCC(N)=O)C(N)=O |r|
BDBM50099171 OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(C)=O)[C@@H](O)CC(=O)N[C@@H](C)C(N)=O |r|
BDBM50099236 OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(C)=O)[C@@H](O)CC(=O)NCCCC(N)=O |r|
BDBM50099239 Cl.CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)OCc1ccccc1)[C@@H](O)CC(=O)NC1CCCCC1 |r|
BDBM50099240 OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)OCc1ccccc1)[C@@H](O)CC(=O)NC1CCCCC1 |r|
BDBM50099242 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCc1ccccc1)NC(=O)OCc1ccccc1)[C@@H](O)CC(=O)NC1CCCCC1 |r|
BDBM223396 C[C@H]1C[C@H]2CSC(N)=N[C@]2(CO1)c1nc(NC(=O)c2ccc(Cl)cn2)cs1 |r,c:7|
BDBM50099272 OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)OCc1ccccc1)C(C)C)[C@@H](O)CC(=O)NC1CCCCC1 |r|
BDBM50099378 OC(=O)C(F)(F)F.CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)NC1CCCCC1 |r|
BDBM50099380 OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)OCc1ccccc1)[C@@H](O)CC(=O)NC1CCCCC1 |r|
BDBM50099381 OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)OCc1ccccc1)[C@@H](O)CC(=O)NC1CCCCC1 |r|
BDBM50099387 OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)OCc1ccccc1)[C@@H](O)CC(=O)NCc1ccccc1 |r|
BDBM50099389 OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)OCc1ccccc1)[C@@H](O)CC(=O)NC1Cc2ccccc2C1 |r|
BDBM50099390 OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)OCc1ccccc1)[C@@H](O)CC(=O)NC(C)c1ccccc1 |r|
BDBM50099391 OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)OCc1ccccc1)[C@@H](O)CC(=O)NCCc1ccc(Cl)cc1 |r|
BDBM50099392 OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)OCc1ccccc1)[C@@H](O)CC(=O)N(C)CCc1ccc(Cl)cc1 |r|
BDBM50099393 OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccccc1)[C@@H](O)CC(=O)NCCc1ccccc1 |r|
BDBM50099394 OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)COCc1ccccc1)[C@@H](O)CC(=O)NCCc1ccccc1 |r|
BDBM50099403 OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NS(=O)(=O)Cc1ccccc1)[C@@H](O)CC(=O)NCCc1ccccc1 |r|
BDBM50099406 OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NS(=O)(=O)Cc1ccccc1)C(C)C)[C@@H](O)CC(=O)NCCc1ccccc1 |r|
BDBM223322 C[C@H]1C[C@H]2CSC(N)=N[C@]2(CO1)c1nc(NC(=O)c2ccc(F)cn2)cs1 |r,c:7|
BDBM223323 COc1cnc(cn1)C(=O)Nc1csc(n1)[C@]12CO[C@@H](C)C[C@H]1CSC(N)=N2 |r,c:29|
BDBM223326 C[C@H]1C[C@H]2CSC(N)=N[C@]2(CO1)c1nc(NC(=O)c2ncc(F)cc2C)cs1 |r,c:7|
BDBM214807 NC1=N[C@@](CF)(C[C@H](O1)C(F)(F)F)c1cc(Nc2nccc3cc(Cl)cnc23)ccc1F |r,t:1|
BDBM223330 C[C@H]1C[C@H]2CSC(N)=N[C@]2(CO1)c1nc(NC(=O)c2ccc(cn2)C(F)(F)F)cs1 |r,c:7|
BDBM223332 COc1ccc(nc1)C(=O)Nc1csc(n1)[C@]12CO[C@@H](C)C[C@H]1CSC(N)=N2 |r,c:29|
BDBM223333 C[C@H]1C[C@H]2CSC(N)=N[C@]2(CO1)c1nc(NC(=O)c2ccc(OC(F)(F)F)cn2)cs1 |r,c:7|
BDBM223400 C[C@H]1C[C@H]2CSC(N)=N[C@]2(CO1)c1nc(NC(=O)c2ncc(OC(F)F)cc2C)cs1 |r,c:7|
BDBM50145773 COC(=O)CCc1ccc(cc1)-c1ccc2c(c1)nc(N)n(C[C@@H]1CC[C@@H](O1)c1ccccc1)c2=O |r|
BDBM50092469 Cl.NC1=NC23COCC2(CS1)CC(CC3)NC(=O)c1cccc(Cl)c1 |t:1|
BDBM50099237 OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(C)=O)[C@@H](O)CC(=O)NC1CCCCC1 |r|
BDBM50139143 Nc1nc2cc(ccc2c(=O)n1C[C@@H]1CCCO1)-c1ccccc1 |r|
BDBM50145774 CCCCc1cccc(c1)-c1ccc2c(c1)nc(N)n(C[C@@H]1CC[C@@H](O1)c1ccccc1)c2=O |r|
BDBM232269 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(C)C)C(=O)Nc1ccn(C)n1 |r|
BDBM232270 COC(=O)[C@@H](NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(C)C)C(C)C |r|
BDBM232271 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(C)C)C(=O)NCc1ccccc1 |r|
BDBM232272 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(C)C)C(=O)NCC1CC1 |r|
BDBM233138 CCCC(=O)NN
BDBM233139 NNC(=O)c1ccccc1[N+]([O-])=O
BDBM233140 NNC(=O)C(c1ccccc1)c1ccccc1
BDBM233141 N(Nc1ccccc1)c1ccccc1
BDBM233142 N(Nc1ccncc1)c1ccncc1
BDBM232273 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(C)(C)C)C(=O)N[C@@H](C(C)C)C(=O)OC |r|
BDBM232274 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)Cc1cccc(OC(F)(F)F)c1)C(C)C)C(=O)N[C@@H](C(C)C)C(O)=O |r|
BDBM232275 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC(C)C)C(C)C)C(=O)N[C@@H](C(C)C)C(O)=O |r|
BDBM232276 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(C)C)C(=O)N[C@H](CO)C(C)C |r|
BDBM232277 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)Cc1cccc(OC(F)(F)F)c1)C(C)C |r|
BDBM234501 COc1cccc(c1)C1(NC(=N)N(C2CCCCC2)C1=O)c1cccc(OC)c1
BDBM232243 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@H](CC)NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)C(=O)N[C@@H](C(C)C)C(=O)OC |r|
BDBM232244 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@H](CC)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)OC |r|
BDBM232245 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)OC |r|
BDBM232278 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)Cc1cccc(OC(F)(F)F)c1)C(C)C)C(=O)NCCC(C)C |r|
BDBM232279 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)Cc1cccc(OC(F)(F)F)c1)[C@@H](C)CC)C(=O)N[C@@H](C(C)C)C(O)=O |r|
BDBM232280 CCc1cccc(CC)c1NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(C)C |r|
BDBM232281 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(C)C)C(=O)NC(CC)CC |r|
BDBM232282 CCc1cccc(CC)c1NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CCCc1ccccc1)C(C)C |r|
BDBM232246 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@H](CC)NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)OC |r|
BDBM232247 CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](N)CC(=O)NCCc1ccc2OCOc2c1 |r|
BDBM232248 CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](N)CC(=O)NCCc1ccc(Cl)c(Cl)c1 |r|
BDBM232249 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)Cc1cccc(OC(F)(F)F)c1)C(C)C)C(=O)N[C@@H](C(C)C)C(=O)OC |r|
BDBM232250 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)COc1cccc2ccccc12)C(C)C)C(=O)N[C@@H](C(C)C)C(=O)OC |r|
BDBM232283 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)Cc1cccc(OC(F)(F)F)c1)[C@@H](C)CC)C(=O)N[C@H](CO)C(C)C |r|
BDBM232284 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC(C)C)C(C)C)C(=O)N[C@H](CO)C(C)C |r|
BDBM232285 CC(C)C[C@H](NC(=O)CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](N)CC(=O)N[C@H](COc1cccnc1)C(C)C |r|
BDBM232286 CC(C)C[C@H](NC(=O)CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](N)CC(=O)N[C@H](COc1ccc(F)cc1F)C(C)C |r|
BDBM232287 CC(C)C[C@H](NC(=O)CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](N)CC(=O)N[C@@H](COc1cccnc1)C(C)C |r|
BDBM234576 CCC(CN1C(=N)NC(C1=O)(c1ccccc1)c1ccccc1)c1ccccc1 |w:2.1|
BDBM234517 COc1ccc(cc1)C1(NC(=N)N(C2CCCCC2)C1=O)c1cccc(c1)-c1cccnc1
BDBM234541 COc1ccc(cc1)C1(NC(=N)N(CC2CCOCC2)C1=O)c1ccc(OC)cc1
BDBM234520 COc1ccc(cc1)C1(NC(=N)N(C2CCOCC2)C1=O)c1ccc(OC)cc1
BDBM232251 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)Cc1cccc(NS(C)(=O)=O)c1)C(C)C)C(=O)N[C@@H](C(C)C)C(=O)OC |r|
BDBM232252 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(C)C)C(=O)N[C@@H](C(C)C)C(=O)OC |r|
BDBM232253 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)OC |r|
BDBM232254 CCOC(=O)C1(CC1)NC(=O)[C@@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(C)C)[C@@H](C)CC |r|
BDBM232255 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)OC |r|
BDBM234527 COc1ccc(cc1)C1(NC(=N)N(C2CCN(CC2)C(=O)OC(C)(C)C)C1=O)c1ccc(OC)cc1
BDBM232256 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)OC |r|
BDBM232257 COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(C)C)C(C)C |r|
BDBM232258 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)C(C)C)C(=O)N[C@@H](C(C)C)C(=O)OC |r|
BDBM232261 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC(C)C)C(C)C)C(=O)N[C@@H](C(C)C)C(=O)OC |r|
BDBM232262 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C)C(=O)N[C@@H](C(C)C)C(=O)OC |r|
BDBM232263 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](C(C)C)C(=O)OC |r|
BDBM234497 COc1ccc(cc1)C1(NC(=N)N(C2CCCCC2)C1=O)c1ccc(OC)cc1
BDBM232264 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)COc1ccc(Cl)cc1Cl)C(C)C)C(=O)N[C@@H](C(C)C)C(=O)OC |r|
BDBM232265 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(C)C)C(=O)N[C@@H](C(C)C)C(O)=O |r|
BDBM232266 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(C)C)C(=O)NCCc1ccccc1 |r|
BDBM232267 CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(C)C)C(=O)Nc1cccnc1 |r|
BDBM234503 N=C1NC(C(=O)N1C1CCCCC1)(c1ccccc1)c1cccc(c1)-c1cccnc1
BDBM220805 COc1cnc(cn1)C(=O)Nc1ccc2Oc3cnc(cc3C3(CCOC(N)=N3)c2c1)C1=CCCOC1 |c:29,t:36|
BDBM220806 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(Cl)cn3)ccc1Oc1cnc(cc21)C1=CCCOC1 |t:1,35|
BDBM220807 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(Cl)cn3)ccc1Oc1ncc(cc21)C1CC1 |t:1|
BDBM220808 COc1cc(F)c2Oc3ccc(NC(=O)c4ccc(cn4)C#N)cc3C3(CCOC(N)=N3)c2c1 |c:32|
BDBM220809 COc1cc(F)c2Oc3ccc(NC(=O)c4cnc(OC)cn4)cc3C3(CCOC(N)=N3)c2c1 |c:32|
BDBM220810 COc1cc(F)c2Oc3ccc(NC(=O)c4ccc(Cl)cc4F)cc3C3(CCOC(N)=N3)c2c1 |c:32|
BDBM220811 COc1ccc(C(=O)Nc2ccc3Oc4c(F)cc(OC)cc4C4(CCOC(N)=N4)c3c2)c(F)c1 |c:29|
BDBM220812 COc1ccc(nc1)C(=O)Nc1ccc2Oc3c(F)nc(cc3[C@]3(CCOC(N)=N3)c2c1)C1=CCOCC1 |c:30,t:37|
BDBM220813 NC1=NC2(CCO1)c1cc(Cl)ncc1Oc1ccc(NC(=O)c3ccc(Cl)cn3)cc21 |t:1|
BDBM220814 COc1cnc(cn1)C(=O)Nc1ccc2Oc3cnc(cc3C3(CCOC(N)=N3)c2c1)C1CC1 |c:29|
BDBM220815 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(Cl)cn3)ccc1Oc1cnc(cc21)C1CC1 |t:1|
BDBM220816 CC(C)(C)C#Cc1cc2c(Oc3ccc(NC(=O)c4ccc(Cl)cn4)cc3C22CCOC(N)=N2)cn1 |c:35|
BDBM220817 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(F)cn3)ccc1Oc1c(F)nc(cc21)C1=CCCOC1 |t:1,36|
BDBM220818 COc1ccc(nc1)C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCOC(N)=N3)c2c1)C1=CCCOC1 |c:30,t:37|
BDBM220819 Cc1nc(cs1)C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCOC(N)=N3)c2c1)C1=CCCOC1 |c:28,t:35|
BDBM220820 COc1cnc(cn1)C(=O)Nc1ccc2Oc3cnc(cc3C3(CCOC(N)=N3)c2c1)C#CC(C)(C)C |c:29|
BDBM220821 COc1ccc(nc1)C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCOC(N)=N3)c2c1)-c1cncc(F)c1 |c:30|
BDBM220822 Cc1nc(cs1)C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCOC(N)=N3)c2c1)-c1cncc(F)c1 |c:28|
BDBM220823 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(F)cn3)ccc1Oc1c(F)nc(cc21)-c1cncc(F)c1 |t:1|
BDBM220824 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(Cl)cn3)ccc1Oc1ncc(cc21)-c1ccnc(F)c1 |t:1|
BDBM220825 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(Cl)cn3)ccc1Oc1c(F)nc(cc21)-c1ccnc(F)c1 |t:1|
BDBM220826 COc1cnc(cn1)C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCOC(N)=N3)c2c1)-c1ccnc(F)c1 |c:30|
BDBM220827 COc1cnc(cn1)C(=O)Nc1ccc2Oc3cnc(cc3C3(CCOC(N)=N3)c2c1)-c1ccnc(F)c1 |c:29|
BDBM220828 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(Cl)cn3)ccc1Oc1cnc(cc21)-c1ccnc(F)c1 |t:1|
BDBM220829 COc1cnc(cn1)C(=O)Nc1ccc2Oc3c(F)cc(cc3C3(CCOC(N)=N3)c2c1)-c1ccnc(F)c1 |c:30|
BDBM50145680 Nc1nc2cc(ccc2c(=O)n1C[C@@H]1CC[C@@H](O1)c1ccccc1)-c1ccc(cc1)C1CCCCC1 |r|
BDBM50145775 CCCCCc1ccc(cc1)-c1ccc2c(c1)nc(N)n(C[C@@H]1CC[C@@H](O1)c1ccccc1)c2=O |r|
BDBM50145777 CC(C)[C@H]1CC[C@@H](Cn2c(N)nc3cc(ccc3c2=O)-c2ccccc2)O1 |r|
BDBM50145778 CCCCc1ccc(cc1)-c1ccc2c(c1)nc(N)n(C[C@@H]1CC[C@@H](O1)c1ccccc1)c2=O |r|
BDBM220830 COc1nc(cc2c1Oc1ccc(NC(=O)c3ccc(Cl)cn3)cc1C21CCOC(N)=N1)C1=CCOCC1 |c:34,t:37|
BDBM220831 COc1nc(cc2c1Oc1ccc(NC(=O)c3ccc(F)cn3)cc1C21CCOC(N)=N1)C1=CCOCC1 |c:34,t:37|
BDBM220832 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(F)cn3)ccc1Oc1c(F)nc(cc21)-c1ccnc(F)c1 |t:1|
BDBM220833 COc1ccc(nc1)C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCOC(N)=N3)c2c1)-c1ccnc(F)c1 |c:30|
BDBM220834 Cc1nc(cs1)C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCOC(N)=N3)c2c1)-c1ccnc(F)c1 |c:28|
BDBM50145779 Nc1nc2cc(ccc2c(=O)n1CC1CC(CO1)c1ccccc1)-c1ccccc1
BDBM50145780 Nc1nc2cc(ccc2c(=O)n1CC1CCC2(CCCCC2)O1)-c1ccccc1
BDBM50145783 CC(C)CCc1ccc(cc1)-c1ccc2c(c1)nc(N)n(C[C@@H]1CC[C@@H](O1)c1ccccc1)c2=O |r|
BDBM50145784 Nc1nc2cc(ccc2c(=O)n1C[C@@H]1CC[C@@H](O1)c1ccccc1)-c1ccc(CCC2CC2)cc1 |r|
BDBM50145785 Nc1nc2cc(ccc2c(=O)n1C[C@@H]1CC[C@@H](O1)c1ccccc1)-c1ccc(CCC2CCCCC2)cc1 |r|
BDBM50145786 Nc1nc2cc(ccc2c(=O)n1C[C@@H]1CC[C@@H](O1)c1ccccc1)-c1ccc(CCCc2ccccc2)cc1 |r|
BDBM220835 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(cn3)C#N)ccc1Oc1c(F)nc(cc21)-c1ccnc(F)c1 |t:1|
BDBM220836 COc1ccc(nc1)C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCSC(N)=N3)c2c1)C1=CCOCC1 |c:30,t:37|
BDBM220837 COc1cnc(cn1)C(=O)Nc1ccc2Oc3c(F)cc(cc3C3(CCOC(N)=N3)c2c1)C1CCOCC1 |c:30|
BDBM220838 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(F)cn3)ccc1Oc1c(F)cc(cc21)-c1ccnc(F)c1 |t:1|
BDBM220839 COc1cnc(cn1)C(=O)Nc1ccc2Oc3cnc(cc3C3(CCSC(N)=N3)c2c1)C1=CCOCC1 |c:29,t:36|
BDBM50145787 Nc1nc2cc(ccc2c(=O)n1C[C@@H]1CC[C@@H](O1)c1ccccc1)-c1ccc(CCc2ccccc2)cc1 |r|
BDBM220840 COc1cnc(cn1)C(=O)Nc1ccc2Oc3cnc(cc3C3(CCSC(N)=N3)c2c1)C1=CCCOC1 |c:29,t:36|
BDBM220841 COc1ccc(nc1)C(=O)Nc1ccc2Oc3c(F)cc(O)cc3C3(CCSC(N)=N3)c2c1 |c:31|
BDBM220842 COc1cnc(cn1)C(=O)Nc1ccc2Oc3c(F)cc(cc3C3(CCOC(N)=N3)c2c1)C1=CCCOC1 |c:30,t:37|
BDBM220843 COc1ccc(nc1)C(=O)Nc1ccc2Oc3c(F)cc(cc3C3(CCSC(N)=N3)c2c1)N1CCOCC1 |c:30|
BDBM220844 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(cn3)C#N)ccc1Oc1c(F)cc(cc21)-c1ccnc(F)c1 |t:1|
BDBM220845 COc1cnc(cn1)C(=O)Nc1ccc2Oc3c(F)cc(O)cc3C3(CCSC(N)=N3)c2c1 |c:31|
BDBM220846 COc1cnc(cn1)C(=O)Nc1ccc2Oc3c(F)cc(cc3C3(CCSC(N)=N3)c2c1)N1CCOCC1 |c:30|
BDBM220847 COc1cnc(cn1)C(=O)Nc1ccc2Oc3c(F)cc(cc3C3(CCSC(N)=N3)c2c1)C1=CCOCC1 |c:30,t:37|
BDBM220848 COc1ccc(nc1)C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCSC(N)=N3)c2c1)C1=CCCOC1 |c:30,t:37|
BDBM220849 COc1cnc(cn1)C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCSC(N)=N3)c2c1)-c1cncc(F)c1 |c:30|
BDBM220766 COc1cnc(cn1)C(=O)Nc1ccc2Oc3cnc(cc3[C@]3(CCOC(N)=N3)c2c1)C1=CCCOC1 |r,c:29,t:36|
BDBM220767 Cc1ccc(nc1)C(=O)Nc1ccc2Oc3cnc(cc3[C@]3(CCOC(N)=N3)c2c1)C1=CCCOC1 |r,c:28,t:35|
BDBM220768 NC1=N[C@@]2(CCO1)c1cc(NC(=O)c3ccc(Cl)cn3)ccc1Oc1c(F)nc(cc21)C1=CCOCC1 |r,t:1,36|
BDBM220769 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(Cl)cn3)ccc1Oc1ncc(Br)cc21 |t:1|
BDBM220770 NC1=NC2(CCO1)c1cc(NC(=O)c3cnc(O)cn3)ccc1Oc1ncc(Br)cc21 |t:1|
BDBM220771 COc1cnc(cn1)C(=O)Nc1ccc2Oc3ncc(Br)cc3C3(CCOC(N)=N3)c2c1 |c:30|
BDBM220850 COc1ccc(nc1)C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCSC(N)=N3)c2c1)-c1cncc(F)c1 |c:30|
BDBM220851 COc1cnc(cn1)C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCSC(N)=N3)c2c1)-c1ccnc(F)c1 |c:30|
BDBM220852 COc1ccc(nc1)C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCSC(N)=N3)c2c1)-c1ccnc(F)c1 |c:30|
BDBM220853 NC1=NC2(CCS1)c1cc(NC(=O)c3ccc(F)cn3)ccc1Oc1c(F)nc(cc21)C1=CCOCC1 |t:1,36|
BDBM220854 NC1=NC2(CCS1)c1cc(NC(=O)c3ccc(Cl)cn3)ccc1Oc1c(F)nc(cc21)C1=CCOCC1 |t:1,36|
BDBM220772 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(Cl)cn3)ccc1Oc1c(F)nc(Cl)cc21 |t:1|
BDBM220773 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(cn3)C#N)ccc1Oc1c(F)nc(Cl)cc21 |t:1|
BDBM220774 COc1cnc(cn1)C(=O)Nc1ccc2Oc3c(F)nc(Cl)cc3C3(CCOC(N)=N3)c2c1 |c:31|
BDBM220775 CC#CCOc1cnc(cn1)C(=O)Nc1ccc2Oc3c(F)nc(Cl)cc3C3(CCOC(N)=N3)c2c1 |c:34|
BDBM220776 NC1=NC2(CCO1)c1cc(NC(=O)c3cnc(Cl)cn3)ccc1Oc1c(F)nc(Cl)cc21 |t:1|
BDBM220777 COc1cc(F)c2Oc3ccc(NC(=O)c4ccc(Cl)cn4)cc3C3(CCSC(N)=N3)c2c1 |c:31|
BDBM220855 NC1=NC2(CCS1)c1cc(NC(=O)c3ccc(F)cn3)ccc1Oc1c(F)nc(cc21)-c1ccnc(F)c1 |t:1|
BDBM220856 NC1=NC2(CCS1)c1cc(NC(=O)c3ncc(Cl)cc3F)ccc1Oc1c(F)nc(cc21)C1=CCOCC1 |t:1,37|
BDBM220857 Cc1cc(Br)cnc1C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCSC(N)=N3)c2c1)C1=CCOCC1 |c:30,t:37|
BDBM220858 COc1cnc(C(=O)Nc2ccc3Oc4c(F)nc(cc4C4(CCSC(N)=N4)c3c2)C2=CCOCC2)c(C)c1 |c:27,t:34|
BDBM220859 Cc1cc(Cl)cnc1C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCSC(N)=N3)c2c1)C1=CCOCC1 |c:30,t:37|
BDBM220778 COc1cc(F)c2Oc3ccc(NC(=O)c4cnc(OC)cn4)cc3C3(CCSC(N)=N3)c2c1 |c:32|
BDBM220779 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(Cl)cn3)ccc1Oc1ncc(cc21)C1=CCOCC1 |t:1,35|
BDBM220780 COc1cc(F)c2Oc3ccc(NC(=O)c4ccc(Cl)cn4)cc3C3(CCOC(N)=N3)c2c1 |c:31|
BDBM220781 NC1=NC2(CCO1)c1cccnc1Oc1ccc(NC(=O)c3ccc(Cl)cn3)cc21 |t:1|
BDBM220782 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(Cl)cc3F)ccc1Oc1ncc(Br)cc21 |t:1|
BDBM220783 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(Cl)cn3)ccc1Oc1c(F)nc(cc21)C1=CCCOC1 |t:1,36|
BDBM220784 COc1cnc(cn1)C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCOC(N)=N3)c2c1)C1=CCCOC1 |c:30,t:37|
BDBM220785 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(cn3)C#N)ccc1Oc1c(F)nc(cc21)C1=CCCOC1 |t:1,37|
BDBM220786 COc1nc(cc2c1Oc1ccc(NC(=O)c3ccc(Cl)cn3)cc1C21CCOC(N)=N1)C1CC1 |c:34|
BDBM220787 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(Cl)cn3)ccc1Oc1c(F)nc(cc21)C1CC1 |t:1|
BDBM220788 COc1cnc(cn1)C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCOC(N)=N3)c2c1)C1CC1 |c:30|
BDBM220790 COc1cnc(cn1)C(=O)Nc1ccc2Oc3c(F)nc(Cl)cc3C3(CCSC(N)=N3)c2c1 |c:31|
BDBM220789 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(Cl)cn3)ccc1Oc1ncc(cc21)C1=CCCOC1 |t:1,35|
BDBM220792 Cc1cccnc1Nc1ccc2Oc3c(F)nc(Cl)cc3[C@]3(CCOC(N)=N3)c2c1 |c:28|
BDBM220793 CCOc1cccnc1Nc1ccc2Oc3c(F)cc(OC)cc3C3(CCSC(N)=N3)c2c1 |c:31|
BDBM220794 COc1cc(F)c2Oc3ccc(Nc4ncccc4OCc4ccccc4)cc3C3(CCOC(N)=N3)c2c1 |c:37|
BDBM220795 CCOc1cccnc1Nc1ccc2Oc3c(F)cc(OC)cc3C3(CCOC(N)=N3)c2c1 |c:31|
BDBM220796 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(cn3)C#N)ccc1Oc1c(F)nc(cc21)C1=CCOCC1 |t:1,37|
BDBM220797 COc1cnc(cn1)C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCOC(N)=N3)c2c1)C1=CCOCC1 |c:30,t:37|
BDBM220798 COc1cnc(cn1)C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCSC(N)=N3)c2c1)C1=CCCOC1 |c:30,t:37|
BDBM220799 COc1cnc(cn1)C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCSC(N)=N3)c2c1)C1=CCOCC1 |c:30,t:37|
BDBM220800 NC1=NC2(CCS1)c1cc(NC(=O)c3ccc(Cl)cn3)ccc1Oc1c(F)nc(cc21)C1=CCCOC1 |t:1,36|
BDBM220801 NC1=NC2(CCO1)c1cc(NC(=O)c3ccc(cn3)C#N)ccc1Oc1c(F)nc(cc21)-c1cncc(F)c1 |t:1|
BDBM220802 COc1cnc(cn1)C(=O)Nc1ccc2Oc3c(F)nc(cc3C3(CCOC(N)=N3)c2c1)-c1cncc(F)c1 |c:30|
BDBM220803 NC1=NC2(CCO1)c1cc(NC(=O)c3cnc(Cl)cn3)ccc1Oc1c(F)nc(cc21)-c1cncc(F)c1 |t:1|
BDBM220804 NC1=NC2(CCO1)c1cc(NC(=O)c3cnc(F)cn3)ccc1Oc1c(F)nc(cc21)-c1cccnc1 |t:1|
BDBM258329 COc1cccnc1Nc1ccc(F)c(c1)[C@]1(C)CC2(CCOCC2)SC(N)=N1 |r,c:30|
BDBM50172100 CC(C)(C)CCNC(=O)CCc1cc2cc(ccc2nc1N)-c1ccccc1CCc1ccc(NC(=O)c2ccc(F)cc2)cn1
BDBM50172101 C[C@@H](Cc1cc2cc(ccc2nc1N)-c1ncccc1C)C(=O)NCCC(C)(C)C |r|
BDBM258266 CC#Cc1cncc(c1)-c1csc(c1)C1(C)CC2(CCOCC2)OC(N)=N1 |c:28|
BDBM258267 CC#Cc1cncc(c1)-c1csc(c1)C1(C)CC2(CCC2)OC(N)=N1 |c:26|
BDBM258268 CC#Cc1cncc(c1)-c1csc(c1)[C@]1(C)CC2(CCOCC2)OC(N)=N1 |r,c:28|
BDBM258269 CC#Cc1cncc(c1)-c1csc(c1)[C@@]1(C)CC2(CCOCC2)OC(N)=N1 |r,c:28|
BDBM258270 CC1(CC2(CCOCC2)OC(N)=N1)c1cc(ccc1F)-c1cncnc1 |c:12|
BDBM258271 CCCn1cc(cn1)-c1ccc(F)c(c1)C1(C)CC2(CCOCC2)OC(N)=N1 |c:29|
BDBM258272 CC#Cc1cncc(c1)-c1cc(sc1C)[C@]1(C)CC2(CCOCC2)OC(N)=N1 |r,c:29|
BDBM258273 CC#Cc1cncc(c1)-c1csc(c1)C1(C)CC2(CCC(F)(F)CC2)OC(N)=N1 |c:30|
BDBM258274 CC#Cc1cncc(c1)-c1csc(c1)[C@]1(C)CC2(CCC(F)(F)CC2)OC(N)=N1 |r,c:30|
BDBM258275 CC#Cc1cncc(c1)-c1ccc(F)c(c1)[C@]1(C)CC2(CCC2)OC(N)=N1 |r,c:28|
BDBM258277 CC#Cc1cncc(c1)-c1csc(c1)C1(C)CC2(CCOCC2)SC(N)=N1 |c:28|
BDBM258278 CC#Cc1cncc(c1)-c1csc(c1)C1(C)N=C(N)OC2(CCOCC2)C1(F)F |t:18|
BDBM258279 CC1(CC2(CCOCC2)OC(N)=N1)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |c:12|
BDBM258280 CC1(CC2(CCOCC2)OC(N)=N1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |c:12|
BDBM258281 C[C@]1(CC2(CCOCC2)OC(N)=N1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,c:12|
BDBM258282 C[C@]1(CC2(CCC(F)(F)CC2)OC(N)=N1)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |r,c:14|
BDBM258283 C[C@]1(CC2(CCC(F)(F)CC2)OC(N)=N1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,c:14|
BDBM258284 CC1(CC2(CCC2)OC(N)=N1)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |c:10|
BDBM258285 C[C@]1(CC2(CCC2)OC(N)=N1)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |r,c:10|
BDBM258286 C[C@@]1(CC2(CCC2)OC(N)=N1)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |r,c:10|
BDBM258287 C[C@]1(CC2(CCOCC2)OC(N)=N1)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |r,c:12|
BDBM258288 C[C@]1(CC2(CCC2)OC(N)=N1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,c:10|
BDBM258289 C[C@]1(CC2(CCC2)OC(N)=N1)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1F |r,c:10|
BDBM258290 C[C@]1(CC2(CCC2)OC(N)=N1)c1cc(NC(=O)c2ncc(Cl)cc2F)ccc1F |r,c:10|
BDBM258292 C[C@]1(CC2(CCC(F)(F)CC2)OC(N)=N1)c1cc(NC(=O)c2ncc(Cl)cc2F)ccc1F |r,c:14|
BDBM258294 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)CC2(CCC2)OC(N)=N1 |r,c:30|
BDBM258295 C[C@]1(CC2(CCC(F)(F)CC2)OC(N)=N1)c1cc(NC(=O)c2ccc(Br)cn2)ccc1F |r,c:14|
BDBM258297 Cc1nc(co1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)CC2(CCC2)OC(N)=N1 |r,c:28|
BDBM258298 CC1(CC2(CCOCC2)OC(N)=N1)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1F |c:12|
BDBM258300 C[C@]1(CC2(CCC2)OC(N)=N1)c1cc(NC(=O)c2ccc(Cl)cc2)ccc1F |r,c:10|
BDBM258302 C[C@@]1(CC2(CCC2)SC(N)=N1)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |r,c:10|
BDBM258303 C[C@]1(CC2(CCC2)SC(N)=N1)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |r,c:10|
BDBM258304 C[C@]1(CC2(CCC2)SC(N)=N1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,c:10|
BDBM258305 C[C@]1(CC2(COC2)SC(N)=N1)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |r,c:10|
BDBM258306 CC1(CC2(CCOCC2)SC(N)=N1)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |c:12|
BDBM258307 C[C@]1(CC2(CCOCC2)SC(N)=N1)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |r,c:12|
BDBM258308 C[C@@]1(CC2(CCOCC2)SC(N)=N1)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |r,c:12|
BDBM258309 CC1(CC2(CCOCC2)SC(N)=N1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |c:12|
BDBM258310 C[C@]1(CC2(CCOCC2)SC(N)=N1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,c:12|
BDBM258311 C[C@@]1(CC2(CCOCC2)SC(N)=N1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,c:12|
BDBM258312 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)CC2(CCOCC2)SC(N)=N1 |r,c:32|
BDBM258313 C[C@]1(CC2(CC2)OC(N)=N1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,c:9|
BDBM258314 CC1(N=C(N)OC2(CCOCC2)C1(F)F)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |t:2|
BDBM258316 C[C@@]1(N=C(N)OC2(CCOCC2)C1(F)F)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |r,t:2|
BDBM258317 CC1(N=C(N)OC2(CCOCC2)C1(F)F)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |t:2|
BDBM258318 CC1(N=C(N)OC2(CCC2)C1(F)F)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |t:2|
BDBM258319 CC1(N=C(N)OC2(CCC2)C1(F)F)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |t:2|
BDBM258320 CC1(N=C(N)OC2(CCC2)C1(F)F)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM258321 C[C@@]1(N=C(N)OC2(CCC2)C1(F)F)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1F |r,t:2|
BDBM258323 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)C1(C)N=C(N)OC2(CCC2)C1(F)F |t:22|
BDBM258324 Cc1nc(co1)C(=O)Nc1ccc(F)c(c1)C1(C)N=C(N)OC2(CCC2)C1(F)F |t:20|
BDBM242302 CN1C(=N)N[C@@](C)(CS1(=O)=O)c1sc2c(nccc2c1Cl)-c1ccc(nc1)-n1cccn1 |r|
BDBM50172104 CC(C)(C)CCNC(=O)CCc1cc2cc(ccc2nc1N)-c1ccccc1C#CCC1(CC1)NC(=O)c1ccc(F)cc1
BDBM50172102 NC1=NC2(CO1)c1cc(NC(=O)c3ccc(Cl)cn3)ccc1Oc1ccc(cc21)C1=CCCOC1 |t:1,34|
BDBM50172105 CC(C)(C)CCNC(=O)CCc1cc2cc(ccc2nc1N)-c1ccccc1C#CC1CC(C1)NC(=O)c1ccc(F)cc1 |(-8,-9.72,;-8,-8.48,;-9.07,-9.1,;-9.07,-7.87,;-6.67,-7.71,;-6.67,-6.17,;-5.34,-5.4,;-5.34,-3.86,;-6.41,-3.24,;-4.01,-3.08,;-4.01,-1.54,;-2.68,-.77,;-1.33,-1.54,;,-.77,;1.33,-1.54,;2.66,-.77,;2.66,.77,;1.33,1.54,;,.77,;-1.33,1.54,;-2.68,.77,;-3.75,1.39,;4,-1.54,;3.99,-3.08,;5.33,-3.85,;6.66,-3.08,;6.66,-1.54,;5.33,-.77,;5.33,.77,;5.34,2.31,;5.34,3.85,;6.43,4.89,;5.34,5.98,;4.25,4.89,;5.34,7.51,;4.01,8.28,;2.94,7.67,;4.01,9.82,;2.67,10.59,;2.68,12.13,;4.01,12.9,;4.01,14.13,;5.34,12.13,;5.34,10.59,)|
BDBM50172106 CC(C)(C)CCNC(=O)CCc1cc2cc(ccc2nc1N)-c1ccccc1C#Cc1ccc(NC(=O)c2ccc(F)cc2)cn1
BDBM50178261 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(=O)[C@H](C)O)[C@@H](C)CC)C(=O)NCC(=O)N(C)[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)OC |r|
BDBM50172103 Cc1ccccc1-c1ccc2nc(N)c(CCC(=O)NCCC(C)(C)C)cc2c1
BDBM50195224 Cl.Cl.CC(C)CN([C@H]1CCCNC1)C(=O)c1cnc(nc1NCc1ccco1)C(C)(C)C |r|
BDBM50195235 Cn1c2cc(ccc2oc1=O)-c1ccc(C[C@H](NC(=O)[C@@H]2CNCCCO2)C#N)cc1 |r|
BDBM50195780 Cl.COCCCCn1c(nc2ccccc12)C(=O)N(CC(C)C)[C@@H]1CNC[C@@H](C1)C(=O)N1CCOCC1 |r|
BDBM229451 Cc1cc(cnc1C(=O)Nc1ccc(F)c(c1)[C@@]1(C)N=C(N)C2(CCC2)S(=O)(=O)[C@@H]1F)C(F)F |r,t:21|
BDBM229472 COc1cnc(C(=O)Nc2ccc(F)c(c2)[C@@]2(C)N=C(N)C3(CCC3)S(=O)(=O)[C@@H]2F)c(C)c1 |r,t:19|
BDBM229499 COc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@@]1(C)N=C(N)C2(CCC2)S(=O)(=O)[C@@H]1F |r,t:23|
BDBM229500 C[C@@]1(N=C(N)C2(CCC2)S(=O)(=O)[C@@H]1F)c1cc(NC(=O)c2cnc(cn2)C(F)F)ccc1F |r,t:2|
BDBM229504 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Nc2c(Cl)sc3cc(cnc23)C#N)ccc1F |r,c:4|
BDBM229505 CC1(C)C(N)=N[C@@](C)([C@@H](F)S1(=O)=O)c1cc(N)ccc1F |r,c:4|
BDBM229508 CC1(C)C(N)=N[C@@](C)([C@@H](F)S1(=O)=O)c1cc(Nc2nccc3cc(Cl)cnc23)ccc1F |r,c:4|
BDBM228391 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)CC(N)=N1 |r,wD:18.20,c:28,(-8.77,1.54,;-7.44,2.31,;-6.1,1.54,;-4.77,2.31,;-3.44,1.54,;-3.44,,;-4.77,-.77,;-6.1,,;-2.1,-.77,;-2.1,-2.31,;-.77,,;.56,-.77,;.56,-2.31,;1.9,-3.08,;3.23,-2.31,;4.56,-3.08,;2.92,-.46,;2.36,.46,;4.56,,;5.9,-.77,;3.25,-.91,;1.87,-.02,;1.28,-1.67,;.27,.7,;1.78,1.62,;3.23,2.31,;1.9,3.08,;3.23,.77,)|
BDBM228393 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)CC(N)=N3)nccc2c1 |r,wD:15.16,c:24,(-8.77,1.54,;-7.44,2.31,;-6.1,1.54,;-4.77,2.31,;-3.44,1.54,;-3.44,,;-2.1,-.77,;-.77,,;.56,-.77,;.56,-2.31,;1.9,-3.08,;3.23,-2.31,;4.56,-3.08,;2.92,-.46,;2.36,.46,;4.56,,;5.9,-.77,;3.25,-.91,;1.87,-.02,;.28,.77,;1.49,-1.78,;1.78,1.62,;3.23,2.31,;1.9,3.08,;3.23,.77,;-2.1,-2.31,;-3.44,-3.08,;-4.77,-2.31,;-4.77,-.77,;-6.1,,)|
BDBM228394 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)CSCC(N)=N1 |r,c:26|
BDBM228395 C[C@]1(CS(=O)(=O)CC(N)=N1)c1cc(Nc2nccc3cc(Cl)cnc23)ccc1F |r,wD:1.0,c:8,(5.9,-.77,;4.56,,;3.25,-.91,;1.87,-.02,;.28,.77,;1.49,-1.78,;1.78,1.62,;3.23,2.31,;1.9,3.08,;3.23,.77,;2.92,-.46,;2.36,.46,;.56,-.77,;-.77,,;-2.1,-.77,;-2.1,-2.31,;-3.44,-3.08,;-4.77,-2.31,;-4.77,-.77,;-6.1,,;-6.1,1.54,;-7.44,2.31,;-4.77,2.31,;-3.44,1.54,;-3.44,,;.56,-2.31,;1.9,-3.08,;3.23,-2.31,;4.56,-3.08,)|
BDBM228397 Cc1nc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)CC(N)=N3)nccc2s1 |r,wD:13.14,c:22,(-6.75,3,;-5.98,1.67,;-4.45,1.51,;-4.13,,;-2.79,-.77,;-1.46,,;-.13,-.77,;-.13,-2.31,;1.21,-3.08,;2.54,-2.31,;3.88,-3.08,;2.23,-.46,;1.67,.46,;3.88,,;5.21,-.77,;2.56,-.92,;1.17,-.02,;.62,-1.46,;-.35,.22,;1.1,1.62,;2.54,2.31,;1.21,3.08,;2.54,.77,;-2.79,-2.31,;-4.13,-3.08,;-5.46,-2.31,;-5.46,-.77,;-6.61,.26,)|
BDBM229509 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(NCc2nn(cc2Cl)C(F)F)ccc1F |r,c:4|
BDBM229510 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(NCc2nn(CC(F)(F)F)cc2Cl)ccc1F |r,c:4|
BDBM229511 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(NCc2c(Cl)cnn2CC(F)(F)F)ccc1F |r,c:4|
BDBM229512 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(ccc1F)C(=O)Nc1ccc(cc1O)C#N |r,c:4|
BDBM229513 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Nc2nccc3cc(OCC(F)F)cnc23)ccc1F |r,c:4|
BDBM229566 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Nc2nncc3cc(Br)cnc23)ccc1F |r,c:4|
BDBM228399 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Nc2nccc3cc(Cl)cnc23)ccc1F |r,c:4|
BDBM228400 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)C(C)(C)C(N)=N3)nccc2c1 |r,c:26|
BDBM228401 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |r,c:4|
BDBM228403 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)C(C)(C)C(N)=N3)nccc2n1 |r,c:26|
BDBM228404 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Nc2nccc3cc(cnc23)C#N)ccc1F |r,c:4|
BDBM228405 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)C(N)=N1 |r,c:29|
BDBM228406 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(CS(=O)(=O)C(C)(C)C(N)=N1)C(F)(F)F |r,c:29|
BDBM229582 C[C@]1(CS(=O)(=O)[C@@](C)(F)C(N)=N1)c1cc(Nc2nccc3cc(Cl)cnc23)ccc1F |r,c:10|
BDBM229980 C[C@]1(CS(=O)(=O)[C@@](C)(F)C(N)=N1)c1cc(Nc2ncnc3cc(Cl)cnc23)ccc1F |r,c:10|
BDBM229981 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)[C@@](C)(F)C(N)=N3)ncnc2c1 |r,c:26|
BDBM229982 C[C@]1(CS(=O)(=O)[C@@](C)(F)C(N)=N1)c1cc(Nc2ncnc3cc(cnc23)C#N)ccc1F |r,c:10|
BDBM229984 CC1(C)C(N)=N[C@]2(C[C@H]2S1(=O)=O)c1cc(Nc2nccc3cc(Cl)cnc23)ccc1F |r,c:4|
BDBM228407 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(CS(=O)(=O)C(C)(C)C(N)=N3)C(F)(F)F)nccc2c1 |r,c:25|
BDBM228408 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)C1(CS(=O)(=O)C(C)(C)C(N)=N1)C(F)F |c:29|
BDBM228409 COc1cnc2c(Nc3ccc(F)c(c3)C3(CS(=O)(=O)C(C)(C)C(N)=N3)C(F)F)nccc2c1 |c:25|
BDBM228410 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)C4(CCCC4)C(N)=N3)nccc2c1 |r,c:29|
BDBM228411 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)C4(CC4)C(N)=N3)nccc2c1 |r,c:27|
BDBM228412 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)[C@@](C)(F)C(N)=N3)nccc2c1 |r,c:26|
BDBM229985 Cc1c(CNc2ccc(F)c(c2)[C@]2(C)CS(=O)(=O)C(C)(C)C(N)=N2)nc2ccc(Cl)cn12 |r,c:23|
BDBM229986 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(ccc1F)C(=O)Nc1ccc(Cl)cc1 |r,c:4|
BDBM229987 C[C@]1(CS(=O)(=O)C2(CCC2)C(N)=N1)c1cccc(Br)c1 |r,c:12|
BDBM229988 COc1cnc(C(=O)Nc2ccc(F)c(c2)[C@]2(CF)CS(=O)(=O)C(C)(C)C(N)=N2)c(OC)n1 |r,c:28|
BDBM229989 CC1(C)C(N)=N[C@@](CF)(CS1(=O)=O)c1cc(NC(=O)c2cnc(OCC3CC3)cn2)ccc1F |r,c:4|
BDBM229990 CC1(C)C(N)=N[C@@](CF)(CS1(=O)=O)c1cc(Nc2ncc(F)c3cc(cnc23)[N+]#[C-])ccc1F |r,c:4|
BDBM229991 Cc1c(nc2ccc(Cl)cn12)C(=O)Nc1ccc(F)c(c1)[C@]1(CF)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:35|
BDBM228413 CC1(C)C(N)=N[C@](C)(CS1(=O)=O)c1cc(Nc2noc3cc(Cl)cnc23)ccc1F |r,c:4|
BDBM228414 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Nc2ncc(F)c3cc(Cl)cnc23)ccc1F |r,c:4|
BDBM228416 CC1(C)C(N)=NC(C)(CS1(=O)=O)c1cc(NC(=O)c2ccc(Cl)cn2)cc(F)c1F |c:4|
BDBM228417 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@@]1(CS(=O)(=O)C(C)(C)C(N)=N1)C(F)F |r,c:29|
BDBM228418 COc1cnc2c(Nc3ccc(F)c(c3)[C@@]3(CS(=O)(=O)C(C)(C)C(N)=N3)C(F)F)nccc2c1 |r,c:25|
BDBM229992 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(CF)CS(=O)(=O)C(C)(C)C(N)=N3)ncc(F)c2c1 |r,c:27|
BDBM229993 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Sc2ccccn2)ccc1F |r,c:4|
BDBM229994 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Nc2ncnc3cc(OCC4CC4)cnc23)ccc1F |r,c:4|
BDBM229996 Cc1cc(OCCF)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(CF)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:34|
BDBM229997 Cc1cc(OC2COC2)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(CF)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:36|
BDBM229998 Cc1nc(F)c(cc1Br)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:20|
BDBM228419 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Nc2ncc(F)c3cc(cnc23)[N+]#[C-])ccc1F |r,c:4|
BDBM228420 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)[C@@](C)(F)C(N)=N1 |r,c:30|
BDBM228421 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Sc2cccc3ccccc23)ccc1F |r,c:4|
BDBM228422 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)[C@@](C)(F)C(N)=N3)nccc2n1 |r,c:26|
BDBM228423 C[C@]1(CS(=O)(=O)[C@@](C)(F)C(N)=N1)c1cc(Nc2nccc3cc(cnc23)C#N)ccc1F |r,c:10|
BDBM228424 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(NC(=O)c2ccc(cn2)C(F)F)ccc1F |r,c:4|
BDBM228425 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)C(C)(C)C(N)=N3)ncc(F)c2c1 |r,c:26|
BDBM229999 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Nc2ncc(C#C[Si](C)(C)C)c3cc(Cl)cnc23)ccc1F |r,c:4|
BDBM230000 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Nc2ncc(Br)c3cc(Cl)cnc23)ccc1F |r,c:4|
BDBM230001 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Nc2ncc(Cl)c3cc(Cl)cnc23)ccc1F |r,c:4|
BDBM230002 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Nc2ncc(C#C)c3cc(Cl)cnc23)ccc1F |r,c:4|
BDBM230003 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Nc2ncc(CO)c3cc(Cl)cnc23)ccc1F |r,c:4|
BDBM230004 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(NC(=O)c2ccc(Cl)cc2)ccc1F |r,c:4|
BDBM228426 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)C(C)(C)C(N)=N3)ncnc2c1 |r,c:26|
BDBM228427 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Nc2ncnc3cc(Cl)cnc23)ccc1F |r,c:4|
BDBM228428 COc1cc(F)c2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)C(C)(C)C(N)=N3)ncnc2c1 |r,c:27|
BDBM228429 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(NC(=O)c2cnc(cn2)C(F)(F)F)ccc1F |r,c:4|
BDBM228430 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Nc2csc3cc(cnc23)C#N)ccc1F |r,c:4|
BDBM228431 COc1cnc2c(Nc3cnc(F)c(c3)C3(C)CS(=O)(=O)C(C)(C)C(N)=N3)nccc2c1 |c:26|
BDBM228432 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)C(C)(C)C(N)=N3)cccc2n1 |r,c:26|
BDBM230005 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(NC(=O)c2ccc(Cl)cc2F)ccc1F |r,c:4|
BDBM230006 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(NC(=O)N2CCC=CC2)ccc1F |r,c:4,22|
BDBM230007 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Br)c[nH]c1=O |r,c:4|
BDBM230008 COc1ncc(NC(=O)c2ccc(Cl)cn2)cc1[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:30|
BDBM230009 Cc1cc(OC(F)F)cnc1C(=O)Nc1cc(c(=O)n(C)c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:34|
BDBM230011 C[C@]1(CS(=O)(=O)[C@@](C)(F)C(N)=N1)c1cc(Nc2ncc(F)c3cc(Cl)cnc23)ccc1F |r,c:10|
BDBM228433 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)C1(CF)CS(=O)(=O)C(C)(C)C(N)=N1 |c:31|
BDBM228434 COc1cnc2c(Nc3ccc(F)c(c3)[C@@]3(C)N=C(N)C(C)(C)S(=O)(=O)[C@@H]3F)nccc2c1 |r,t:18|
BDBM228435 COc1cnc2c(Nc3ccc(F)c(c3)C3(CF)CS(=O)(=O)C(C)(C)C(N)=N3)nccc2c1 |c:27|
BDBM228436 Cc1nc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)C(C)(C)C(N)=N3)nccc2s1 |r,c:24|
BDBM228437 COc1ccc(nc1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:30|
BDBM228439 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(NC(=O)c2ncc(Cl)cc2F)ccc1F |r,c:4|
BDBM228440 Cc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:30|
BDBM230012 C[C@]1(CS(=O)(=O)[C@@](C)(F)C(N)=N1)c1cc(Nc2ncc(F)c3cc(cnc23)C#N)ccc1F |r,c:10|
BDBM230013 C[C@]1(CS(=O)(=O)C2(CC2)C(N)=N1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,c:11|
BDBM230014 CC(C)(C)S(=O)N[C@@](C)(CS(=O)(=O)C1(CC1)C#N)c1cc(Br)cnc1F |r|
BDBM230015 C[C@]1(CS(=O)(=O)C2(CCOC2)C(N)=N1)c1cc(Br)ccc1F |r,c:13|
BDBM230016 C[C@]1(CS(=O)(=O)C2(CCOC2)C(N)=N1)c1cc(Nc2nccc3cc(Cl)cnc23)ccc1F |r,c:13|
BDBM230017 C[C@@]1(N=C(N)C2(CC2)S(=O)(=O)[C@@H]1F)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,t:2|
BDBM230018 C[C@@]1(N=C(N)C2(CC2)S(=O)(=O)[C@H]1F)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,t:2|
BDBM228441 CC#CCOc1ccc(nc1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:33|
BDBM228442 Cc1nc(cs1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:28|
BDBM228443 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(NC(=O)c2ccc(Cl)cn2)cc(F)c1F |r,c:4|
BDBM228444 CC1(C)C(N)=N[C@](C)(CS1(=O)=O)c1cc(NC(=O)c2ccc(Cl)cn2)cc(F)c1F |r,c:4|
BDBM228446 COc1cnc(cn1)C(=O)Nc1cc(c(F)cn1)C1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |c:30|
BDBM228447 COc1cnc(cn1)C(=O)Nc1ccc(F)c(n1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:30|
BDBM230019 Cc1cc(OC(F)F)cnc1C(=O)Nc1ccc(F)c(c1)[C@@]1(C)N=C(N)C2(CC2)S(=O)(=O)[C@@H]1F |r,t:25|
BDBM230020 Cc1cc(OC(F)F)cnc1C(=O)Nc1ccc(F)c(c1)[C@@]1(C)N=C(N)C2(CC2)S(=O)(=O)[C@H]1F |r,t:25|
BDBM230021 Cc1cc(cnc1C(=O)Nc1ccc(F)c(c1)[C@@]1(C)N=C(N)C2(CC2)S(=O)(=O)[C@@H]1F)C(F)F |r,t:21|
BDBM230022 Cc1cc(cnc1C(=O)Nc1ccc(F)c(c1)[C@@]1(C)N=C(N)C2(CC2)S(=O)(=O)[C@H]1F)C(F)F |r,t:21|
BDBM230023 COc1cnc2c(Nc3ccc(F)c(c3)[C@@]3(C)N=C(N)C4(CC4)S(=O)(=O)[C@@H]3F)nccc2n1 |r,t:18|
BDBM230024 COc1cnc2c(Nc3ccc(F)c(c3)[C@@]3(C)N=C(N)C4(CC4)S(=O)(=O)[C@H]3F)nccc2n1 |r,t:18|
BDBM228448 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Nc2nccc3nc(cnc23)C(F)(F)F)ccc1F |r,c:4|
BDBM228449 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Nc2nccc3nc(O)cnc23)cc(F)c1F |r,c:4|
BDBM228450 CC1(C)C(N)=N[C@](C)(CS1(=O)=O)c1cc(Nc2nccc3nc(O)cnc23)cc(F)c1F |r,c:4|
BDBM228451 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Oc2ccc(cc2)C#N)ccc1F |r,c:4|
BDBM228452 COc1cc(C)ccc1Oc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:29|
BDBM228453 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Oc2cc(F)cc(c2)C(F)(F)F)ccc1F |r,c:4|
BDBM228454 CCc1cccc(Oc2ccc(F)c(c2)[C@]2(C)CS(=O)(=O)C(C)(C)C(N)=N2)c1 |r,c:26|
BDBM230025 CC1(C)C(N)=N[C@@](CF)(CS1(=O)=O)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,c:4|
BDBM230026 NC1=N[C@](CF)(CS(=O)(=O)C11CC1)c1cc(Br)ccc1F |r,t:1|
BDBM230027 Cc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@@]1(CF)CS(=O)(=O)C2(CC2)C(N)=N1 |r,c:32|
BDBM230028 Cc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(CF)CS(=O)(=O)C2(CC2)C(N)=N1 |r,c:32|
BDBM230029 Cc1cc(OC(F)F)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(CF)CS(=O)(=O)C2(CC2)C(N)=N1 |r,c:35|
BDBM230030 Cc1cc(OC(F)F)cnc1C(=O)Nc1ccc(F)c(c1)[C@@]1(CF)CS(=O)(=O)C2(CC2)C(N)=N1 |r,c:35|
BDBM230031 NC1=N[C@@](CF)(CS(=O)(=O)C11CCC1)c1cc(Br)ccc1F |r,t:1|
BDBM228455 CCc1cc(Oc2ccc(F)c(c2)[C@]2(C)CS(=O)(=O)C(C)(C)C(N)=N2)ccc1Cl |r,c:24|
BDBM228456 COc1ccc(C)cc1Oc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:29|
BDBM228457 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Oc2ccc3ccccc3c2)ccc1F |r,c:4|
BDBM228458 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(Oc2ccccn2)ccc1F |r,c:4|
BDBM228459 C[C@@]1(CS(=O)(=O)C2(CCC2)C(N)=N1)c1cc(Br)ncc1F |r,c:12|
BDBM228460 C[C@]1(CS(=O)(=O)C2(CCC2)C(N)=N1)c1cc(Br)ncc1F |r,c:12|
BDBM228463 C[C@]1(CS(=O)(=O)C2(CCC2)C(N)=N1)c1cc(Nc2nccc3cc(Cl)cnc23)ccc1F |r,c:12|
BDBM230032 CC1(C)C(N)=N[C@](C)(c2cc(Br)ccc2F)C2(CC2)S1(=O)=O |r,c:4|
BDBM230033 CO[C@H]1C[C@]2(C1)C(N)=N[C@@](C)(CS2(=O)=O)c1cc(NC(=O)c2ncc(Cl)cc2C)ccc1F |r,wU:9.10,wD:4.3,2.1,c:8,(-6.27,-5.48,;-5.5,-4.15,;-3.96,-4.15,;-2.87,-5.24,;-1.78,-4.15,;-2.87,-3.06,;-1.01,-2.82,;-1.78,-1.48,;.53,-2.82,;1.3,-4.15,;2.48,-5.14,;.53,-5.48,;-1.01,-5.48,;-.74,-7,;-2.45,-6.01,;2.48,-3.16,;2.21,-1.64,;3.39,-.65,;3.13,.86,;4.31,1.85,;5.75,1.32,;4.04,3.37,;5.22,4.36,;4.95,5.87,;3.5,6.4,;3.24,7.92,;2.32,5.41,;2.59,3.89,;1.41,2.91,;4.84,-1.18,;5.11,-2.7,;3.93,-3.69,;4.2,-5.2,)|
BDBM230034 CO[C@H]1C[C@]2(C1)C(N)=N[C@@](C)(CS2(=O)=O)c1cc(NC(=O)c2ncc(OC)cc2C)ccc1F |r,wU:9.10,wD:4.3,2.1,c:8,(-5.99,-5.77,;-5.22,-4.43,;-3.68,-4.43,;-2.59,-5.52,;-1.5,-4.43,;-2.59,-3.35,;-.73,-3.1,;-1.5,-1.77,;.81,-3.1,;1.58,-4.43,;2.76,-5.42,;.81,-5.77,;-.73,-5.77,;-.46,-7.28,;-2.18,-6.29,;2.76,-3.44,;2.49,-1.93,;3.67,-.94,;3.41,.58,;4.59,1.57,;6.03,1.04,;4.32,3.09,;5.5,4.08,;5.23,5.59,;3.78,6.12,;3.52,7.64,;4.7,8.63,;2.6,5.13,;2.87,3.61,;1.69,2.62,;5.12,-1.46,;5.39,-2.98,;4.21,-3.97,;4.48,-5.49,)|
BDBM230035 COc1cnc(C(=O)Nc2ccc(F)c(c2)[C@]2(C)CS(=O)(=O)[C@@]3(C[C@H](F)C3)C(N)=N2)c(C)c1 |r,wU:24.25,16.17,wD:22.27,c:30,(.1,7.93,;1.54,7.4,;1.81,5.89,;3.26,5.36,;3.53,3.84,;2.35,2.85,;2.61,1.34,;1.43,.35,;4.06,.81,;4.33,-.71,;5.78,-1.23,;6.04,-2.75,;4.86,-3.74,;5.13,-5.26,;3.42,-3.21,;3.15,-1.7,;2.24,-4.2,;3.42,-5.19,;1.47,-5.54,;-.07,-5.54,;.19,-7.05,;-1.52,-6.06,;-.84,-4.2,;-1.93,-3.11,;-3.02,-4.2,;-4.56,-4.2,;-1.93,-5.29,;-.07,-2.87,;-.84,-1.54,;1.47,-2.87,;.9,3.38,;-.28,2.39,;.63,4.9,)|
BDBM230036 Cc1c(nc2ccc(Cl)cn12)C(=O)Nc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)[C@@]2(C[C@H](F)C2)C(N)=N1 |r,wU:29.32,21.24,wD:27.34,c:37,(4.88,-6.35,;5.35,-4.88,;4.45,-3.64,;5.35,-2.39,;6.82,-2.87,;8.15,-2.1,;9.48,-2.87,;9.48,-4.41,;10.82,-5.18,;8.15,-5.18,;6.82,-4.41,;2.91,-3.64,;2.14,-4.97,;2.14,-2.3,;.6,-2.3,;-.17,-3.64,;-1.71,-3.64,;-2.48,-2.3,;-4.02,-2.3,;-1.71,-.97,;-.17,-.97,;-2.48,.37,;-3.66,-.62,;-3.66,1.36,;-3.4,2.87,;-4.94,2.87,;-3.66,4.39,;-1.95,3.4,;-.69,4.28,;-1.57,5.54,;-1.3,7.06,;-2.83,4.66,;-.77,2.41,;.68,2.94,;-1.04,.89,)|
BDBM228465 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)C4(CC(F)(F)C4)C(N)=N3)nccc2n1 |r,c:30|
BDBM228466 C[C@]1(CS(=O)(=O)C2(CCC2)C(N)=N1)c1cc(Nc2nccc3cc(cnc23)[N+]#[C-])ccc1F |r,c:12|
BDBM228467 C[C@]1(CS(=O)(=O)C2(CC(O)C2)C(N)=N1)c1cc(Br)ccc1F |r,wU:1.0,c:13,(2.34,1,;1.16,.01,;.39,-1.32,;-1.15,-1.32,;-.88,-2.84,;-2.6,-1.85,;-1.92,.01,;-3.01,-1.08,;-4.1,.01,;-5.64,.01,;-3.01,1.1,;-1.15,1.34,;-1.92,2.68,;.39,1.34,;2.34,-.98,;3.79,-.45,;4.97,-1.44,;6.41,-.92,;4.7,-2.96,;3.25,-3.49,;2.07,-2.5,;.63,-3.02,)|
BDBM228468 C[C@]1(CS(=O)(=O)C2(CCC2)C(N)=N1)c1cc(Br)ccc1F |r,c:12|
BDBM228469 C[C@]1(CS(=O)(=O)[C@@]2(C[C@H](F)C2)C(N)=N1)c1cc(Br)ccc1F |r,wU:1.0,6.6,wD:8.8,c:13,(2.34,1,;1.16,.01,;.39,-1.32,;-1.15,-1.32,;-.88,-2.84,;-2.6,-1.85,;-1.92,.01,;-3.01,-1.08,;-4.1,.01,;-5.64,.01,;-3.01,1.1,;-1.15,1.34,;-1.92,2.68,;.39,1.34,;2.34,-.98,;3.79,-.45,;4.97,-1.44,;6.41,-.92,;4.7,-2.96,;3.25,-3.49,;2.07,-2.5,;.63,-3.02,)|
BDBM228470 COc1cnc(cn1)C(=O)Nc1cc(c(F)cn1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:30|
BDBM228471 Cc1c(CNc2cc(c(F)cn2)[C@]2(C)CS(=O)(=O)C(C)(C)C(N)=N2)nc2ccc(Cl)cn12 |r,c:23|
BDBM228472 CC(=C)c1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:32|
BDBM228473 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(NC(=O)c2ncc(Cl)cc2C=C)ccc1F |r,c:4|
BDBM228474 CCc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:31|
BDBM228476 CCc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(CF)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:32|
BDBM228477 CC(C)c1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(CF)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:33|
BDBM228478 Cc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@@]1(C)N=C(N)C2(CC2)S(=O)(=O)[C@@H]1F |r,t:22|
BDBM228479 Cc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@@]1(C)N=C(N)C2(CC2)S(=O)(=O)[C@H]1F |r,t:22|
BDBM228867 COc1cnc(cn1)C(=O)Nc1cc(c(F)cn1)[C@@]1(C)CS(=O)(=O)C2(CCC2)C(N)=N1 |r,c:32|
BDBM228868 Cc1cc(OC(F)F)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:33|
BDBM228869 C[C@]1(CS(=O)(=O)C2(CC(F)(F)C2)C(N)=N1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,c:14|
BDBM228963 C[C@]1(CS(=O)(=O)[C@@]2(C[C@H](F)C2)C(N)=N1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,wU:6.10,wD:1.0,8.8,c:13,(6,-2.63,;4.67,-1.86,;6,-1.09,;6,.45,;7.34,1.22,;7.34,-.32,;4.67,1.22,;3.58,2.31,;4.67,3.4,;4.67,4.94,;5.76,2.31,;3.33,.45,;2,1.22,;3.33,-1.09,;3.33,-2.63,;2,-1.86,;.67,-2.63,;-.67,-1.86,;-2,-2.63,;-2,-4.17,;-3.33,-1.86,;-4.67,-2.63,;-6,-1.86,;-6,-.32,;-7.34,.45,;-4.67,.45,;-3.33,-.32,;.67,-4.17,;2,-4.94,;3.33,-4.17,;4.67,-4.94,)|
BDBM228965 Cc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C2(CC(F)(F)C2)C(N)=N1 |r,c:34|
BDBM229017 Cc1cc(OC(F)F)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C2(CC(F)(F)C2)C(N)=N1 |r,c:37|
BDBM229049 Cc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C2(CCC2)C(N)=N1 |r,c:32|
BDBM229050 Cc1cc(OC(F)F)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(CF)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:34|
BDBM229051 Cc1cc(OCC2CCC2)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(CF)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:37|
BDBM229052 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(NC(=O)c2nn(cc2Cl)C(F)F)ccc1F |r,c:4|
BDBM229053 Cc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:29|
BDBM229054 Cc1cnc(C(=O)Nc2ccc(F)c(c2)[C@]2(C)CS(=O)(=O)C(C)(C)C(N)=N2)c(C)n1 |r,c:26|
BDBM229055 Cc1cc(OC(F)F)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C2(CCC2)C(N)=N1 |r,c:35|
BDBM229056 Cc1cc(cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C2(CCC2)C(N)=N1)C#N |r,c:31|
BDBM229057 Cc1cc(cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C2(CCC2)C(N)=N1)C(F)F |r,c:31|
BDBM229389 C[C@@]1(N=C(N)C2(CCC2)S(=O)(=O)[C@@H]1F)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,t:2|
BDBM229390 Cc1cc(OC(F)F)cnc1C(=O)Nc1ccc(F)c(c1)[C@@]1(C)N=C(N)C2(CCC2)S(=O)(=O)[C@@H]1F |r,t:25|
BDBM275522 COc1cc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCC(C)C)cc(OC)c1 |r|
BDBM275523 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCC2CC2)cc1OC |r|
BDBM275524 COc1cccc(c1)[C@H](C)NC(=O)[C@@H](Cc1ccccc1)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275525 COc1cccc(c1)[C@@H](C)NC(=O)[C@@H](Cc1ccccc1)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275526 COc1ccc(CC(=O)NC(=N)N[C@@H](CC2CCCCC2)C(=O)NCC2CC2)cc1OC |r|
BDBM275527 COc1cccc(c1)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275528 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCC2CCOCC2)cc1OC |r|
BDBM275628 COC(=O)[C@H](CC(=O)NC(=N)N[C@H](CC1CCCCC1)C(=O)NCc1ccc(F)c(OC)c1)Cc1ccccc1 |r|
BDBM275629 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccccc2Br)ccc1F |r|
BDBM275630 CC(C)CNC(=O)[C@@H](CC1CCCCC1)NC(=N)NC(=O)Cc1ccccc1Br |r|
BDBM275631 COc1cc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccccc2Br)ccc1F |r|
BDBM275632 COc1ccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2OC)cc1OC |r|
BDBM275633 COc1cc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2OC)ccc1F |r|
BDBM275529 COCCCNC(=O)[C@@H](Cc1ccccc1)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275530 COc1ccc(CC(=O)NC(=N)N[C@@H](CC2CCCCC2)C(=O)NCC2CCCCC2)cc1OC |r|
BDBM275531 COc1ccc(CC(=O)NC(=N)N[C@@H](CC2CCCCC2)C(=O)NCC2CCOCC2)cc1OC |r|
BDBM275532 COCCCNC(=O)[C@H](CC1CCCCC1)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275533 COc1ccc(CCC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(F)c(OC)c2)cc1OC |r|
BDBM275534 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc3OCOc3c2)ccc1F |r|
BDBM275535 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)CCC(C)C)ccc1F |r|
BDBM275634 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCC(C)C)c(OC)c1OC |r|
BDBM275635 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2OC)ccc1F |r|
BDBM275636 COc1ccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(F)c(F)c2)cc1OC |r|
BDBM275637 COc1cc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(F)c(F)c2)ccc1F |r|
BDBM275638 CC(C)CNC(=O)[C@@H](CC1CCCCC1)NC(=N)NC(=O)Cc1ccc(F)c(F)c1 |r|
BDBM275639 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(F)c(F)c2)ccc1F |r|
BDBM275640 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NC2CCC2)cc1OC |r|
BDBM275536 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)C2Cc3ccccc3C2)ccc1F |r|
BDBM275537 COc1cccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2ccc(OC)c(OC)c2)c1 |r|
BDBM275538 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)CC2CCCCC2)ccc1F |r|
BDBM275540 CC[C@H](C)CNC(=O)[C@@H](CC1CCCCC1)NC(=N)NC(=O)CCc1ccccc1 |r|
BDBM275541 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)CCc2ccccc2)ccc1F |r|
BDBM275542 CC[C@H](C)CNC(=O)[C@@H](CC1CCCCC1)NC(=N)NC(=O)Cc1ccccc1 |r|
BDBM275543 CC(C)CNC(=O)[C@@H](CC1CCCCC1)NC(=N)NC(=O)Cc1ccc2OCOc2c1 |r|
BDBM275641 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NC2CCC2)cc1OC |r|
BDBM275642 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2cccc(c2)C(F)(F)F)cc1OC |r|
BDBM275643 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2cccc(c2)C(F)(F)F)cc1OC |r|
BDBM275644 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(F)c(c2)C(F)(F)F)cc1OC |r|
BDBM275645 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2ccc(F)c(c2)C(F)(F)F)cc1OC |r|
BDBM275646 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2cccc(OC(F)(F)F)c2)cc1OC |r|
BDBM275544 COc1ccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc3OCOc3c2)cc1OC |r|
BDBM275545 COc1ccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)CCc2ccccc2)cc1OC |r|
BDBM275546 CC(C)CNC(=O)[C@@H](CC1CCCCC1)NC(=N)NC(=O)C1Cc2ccccc2C1 |r|
BDBM275547 COc1ccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)C2Cc3ccccc3C2)cc1OC |r|
BDBM275548 COc1ccc(CCC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(OC)c(OC)c2)cc1OC |r|
BDBM275549 COc1cc(Br)c(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCC(C)C)cc1OC |r|
BDBM275647 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2cccc(OC(F)(F)F)c2)cc1OC |r|
BDBM275648 Fc1ccc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(F)c(c2)C(F)(F)F)cc1OC(F)(F)F |r|
BDBM275649 Fc1ccc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(F)c(c2)C(F)(F)F)cc1C(F)(F)F |r|
BDBM275650 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2c(F)cc(F)cc2F)ccc1F |r|
BDBM275651 Fc1cc(F)c(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(F)c(OC(F)(F)F)c2)c(F)c1 |r|
BDBM275652 Fc1cc(F)c(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(F)c(c2)C(F)(F)F)c(F)c1 |r|
BDBM275550 COc1ccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2cc(OC)c(OC)cc2Br)cc1OC |r|
BDBM275551 COc1cccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCC(C)C)c1 |r|
BDBM275552 COc1cccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2ccc(F)c(OC)c2)c1 |r|
BDBM275553 CC[C@H](C)CNC(=O)[C@@H](CC1CCCCC1)NC(=N)NC(=O)Cc1cccc(OC)c1 |r|
BDBM275554 COc1cccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(F)c(OC)c2)c1 |r|
BDBM275555 COc1ccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccccc2)cc1OC |r|
BDBM275556 CC(C)CCC(=O)NC(=N)N[C@H](CC1CCCCC1)C(=O)NCC(C)C |r|
BDBM275653 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(F)c(c2)C(F)(F)F)ccc1F |r|
BDBM275654 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(F)c(OC(F)(F)F)c2)cc1OC |r|
BDBM275655 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2ccc(F)c(OC(F)(F)F)c2)cc1OC |r|
BDBM275656 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)N[C@H]2CCN(C2=O)c2cccc(Cl)c2)cc1OC |r|
BDBM275657 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)N[C@@H]2CCN(C2=O)c2cccc(Cl)c2)cc1OC |r|
BDBM275660 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(OC(F)(F)F)c(F)c2)ccc1F |r|
BDBM275452 COc1ccc(CCNC(=O)[C@@H](Cc2ccc(Cl)cc2Cl)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)cc1OC |r|
BDBM275453 COc1ccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)cc1 |r|
BDBM275454 CCC(CC)NC(=O)[C@@H](CC1CCCCC1)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275455 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccc(Cl)cc2Cl)C(=O)NCCN2C(=O)c3ccccc3C2=O)cc1OC |r|
BDBM275557 COc1cccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCC(C)C)c1 |r|
BDBM275558 CC(C)CNC(=O)[C@@H](CC1CCCCC1)NC(=N)NC(=O)CC1CCCCC1 |r|
BDBM275559 COc1ccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)CC2CCCCC2)cc1OC |r|
BDBM275560 COc1cccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(OC)c(OC)c2)c1 |r|
BDBM275561 COc1cccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2cccc(OC)c2)c1 |r|
BDBM275562 COc1cccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(F)c(OC)c2)c1 |r|
BDBM275563 COc1cc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)CC2CCCCC2)ccc1F |r|
BDBM275663 CC(C)CNC(=O)[C@@H](CC1CCCCC1)NC(=N)NC(=O)Cc1ccc(Cl)cc1 |r|
BDBM275664 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(Cl)cc2)ccc1F |r|
BDBM275667 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(cc2Br)C(F)(F)F)ccc1F |r|
BDBM275668 COc1ccc(CC(=O)NC(=N)NC(CC2CCCCC2)C(=O)NCc2cccc(c2)S(N)(=O)=O)cc1OC
BDBM275456 COc1ccc(C[C@H](NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)C(=O)NCCN2C(=O)c3ccccc3C2=O)cc1 |r|
BDBM275457 COc1ccc(CC(=O)NC(=N)N[C@@H](Cc2ccc(Cl)cc2)C(=O)NCCN2C(=O)c3ccccc3C2=O)cc1OC |r|
BDBM275458 COc1ccc(CC(=O)NC(=N)N[C@@H](Cc2ccc(Cl)cc2Cl)C(=O)NCCN2C(=O)c3ccccc3C2=O)cc1OC |r|
BDBM275459 COc1ccc(CCNC(=O)C(Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)cc1OC
BDBM275460 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCCc2ccccc2)cc1OC |r|
BDBM275461 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCCc2ccc(Cl)cc2)cc1OC |r|
BDBM275564 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCC(C)C)cc1 |r|
BDBM275565 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(OC)c(OC)c2)cc1 |r|
BDBM275566 COc1ccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(cc2)C(F)(F)F)cc1OC |r|
BDBM275567 COc1ccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(OC(F)(F)F)cc2)cc1OC |r|
BDBM275568 COc1ccc(CNC(=O)[C@@H](CC(C)C)NC(=N)NC(=O)CC(C)C)cc1OC |r|
BDBM275569 CNS(=O)(=O)c1ccccc1CNC(=O)[C@@H](Cc1ccccc1)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275462 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCCc2ccc(Cl)cc2Cl)cc1OC |r|
BDBM275464 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCCc2cc(OC)c(OC)cc2Br)cc1OC |r|
BDBM275465 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(cc2)S(N)(=O)=O)cc1OC |r|
BDBM275466 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(C#N)c(F)c2)cc1OC |r|
BDBM275467 COc1ccc(C[C@@H](NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)C(=O)NCc2ccc(OC)c(OC)c2)cc1 |r|
BDBM275468 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCC2CCCCC2)cc1OC |r|
BDBM275571 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc3OCOc3c2)cc1OC |r|
BDBM275572 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2cccc(OC)c2OC)cc1OC |r|
BDBM275573 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2cccc(Br)c2)cc1OC |r|
BDBM275574 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2cccc(Cl)c2)cc1OC |r|
BDBM275575 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccccc2)cc1OC |r|
BDBM275576 COc1ccc(CCNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(Cl)cc2)cc1OC |r|
BDBM275469 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(F)cc2)cc1OC |r|
BDBM275470 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(F)c(F)c2)cc1OC |r|
BDBM275471 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(F)c(OC)c2)cc1OC |r|
BDBM275472 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2cc(OC)c(OC)cc2Br)cc1OC |r|
BDBM275474 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)N(C)Cc2ccccc2)cc1OC |r|
BDBM275475 COc1ccc(CN(C)C(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)cc1OC |r|
BDBM275577 Clc1ccc(C[C@H](NC(=N)NC(=O)Cc2cccc(Oc3ccccc3)c2)C(=O)NCCN2C(=O)c3ccccc3C2=O)cc1 |r|
BDBM275578 Clc1ccc(C[C@@H](NC(=N)NC(=O)Cc2cccc(Oc3ccccc3)c2)C(=O)NCCN2C(=O)c3ccccc3C2=O)c(Cl)c1 |r|
BDBM275579 N=C(N[C@H](Cc1ccccc1)C(=O)NCCN1C(=O)c2ccccc2C1=O)NC(=O)Cc1cccc(Oc2ccccc2)c1 |r|
BDBM275580 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(OC)c(OC)c2)c(OC)c1 |r|
BDBM275581 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(F)c(OC)c2)c(OC)c1 |r|
BDBM275582 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCC(C)C)c(OC)c1 |r|
BDBM275476 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(Cl)c(Cl)c2)cc1OC |r|
BDBM275477 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccncc2)cc1OC |r|
BDBM275478 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2cccc(c2)-c2nnn[nH]2)cc1OC |r|
BDBM275479 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCC(C)C)cc1OC |r|
BDBM275480 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCC(C)(C)C)cc1OC |r|
BDBM275481 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCCC(C)C)cc1OC |r|
BDBM275583 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(F)c(OC)c2)c(OC)c1 |r|
BDBM275584 CC(C)CNC(=O)[C@@H](CC1CCCCC1)NC(=N)NC(=O)C[C@]12C[C@H]3C[C@H](C[C@H](C3)C1)C2 |r,TLB:21:22:27:24.25.29,21:22:27.26.25:29,THB:23:24:27:30.22.31,23:22:27:24.25.29,31:22:27.26.25:29|
BDBM275585 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)C[C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)ccc1F |r,TLB:23:24:29:26.27.31,23:24:29.28.27:31,THB:33:24:29.28.27:31,25:26:29:32.24.33,25:24:29:26.27.31|
BDBM275586 COc1cc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)C[C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)ccc1F |r,TLB:23:24:29:26.27.31,23:24:29.28.27:31,THB:33:24:29.28.27:31,25:26:29:32.24.33,25:24:29:26.27.31|
BDBM275587 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(cc2)S(N)(=O)=O)cc1OC |r|
BDBM275588 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCC2CC2)cc1OC |r|
BDBM275482 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NC2CCC(CC2)C(C)(C)C)cc1OC |r,wD:13.12,(-11.34,1.62,;-10,2.39,;-8.67,1.62,;-7.34,2.39,;-6,1.62,;-6,.08,;-4.67,-.69,;-3.33,.08,;-3.33,1.62,;-2,-.69,;-.67,.08,;-.67,1.62,;.67,-.69,;2,.08,;2,1.62,;3.33,2.39,;4.67,1.62,;6,2.39,;6,3.93,;4.67,4.7,;3.33,3.93,;3.33,-.69,;3.33,-2.23,;4.67,.08,;6,-.69,;6,-2.23,;7.34,-3,;8.67,-2.23,;8.67,-.69,;7.34,.08,;10,-3,;11.34,-2.23,;10,-4.54,;8.67,-3.77,;-7.34,-.69,;-8.67,.08,;-10,-.69,;-11.34,.08,)|
BDBM275483 COCCOc1cccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)c1 |r|
BDBM275484 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2cccc(OCCO)c2)cc1OC |r|
BDBM275485 CCC(CC)NC(=O)[C@@H](Cc1ccccc1)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275486 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NC(C)C)cc1OC |r|
BDBM275487 CC[C@H](C)CNC(=O)[C@@H](Cc1ccccc1)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275589 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2ccc(cc2)S(N)(=O)=O)cc1OC |r|
BDBM275590 CC[C@H](C)NC(=O)[C@@H](CC(C)C)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275591 CCC(C)NC(=O)[C@@H](CC(C)C)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275592 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)N[C@H]2CC[C@H](O)CC2)cc1OC |r,wU:24.24,wD:13.12,21.20,(-9.34,5.38,;-9.34,3.84,;-8,3.07,;-6.67,3.84,;-5.33,3.07,;-5.33,1.53,;-4,.76,;-2.67,1.53,;-2.67,3.07,;-1.33,.76,;,1.53,;,3.07,;1.33,.76,;2.67,1.53,;2.67,3.07,;4,3.84,;4,5.38,;5.33,3.07,;4,.76,;4,-.78,;5.33,1.53,;6.67,.76,;6.67,-.78,;8,-1.55,;9.34,-.78,;10.67,-1.55,;9.34,.76,;8,1.53,;-6.67,.76,;-8,1.53,;-9.34,.76,;-10.67,1.53,)|
BDBM275593 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)N[C@H]2CC[C@H](O)CC2)cc1OC |r,wU:21.20,wD:13.12,24.24,(-9.34,5.38,;-9.34,3.84,;-8,3.07,;-6.67,3.84,;-5.33,3.07,;-5.33,1.53,;-4,.76,;-2.67,1.53,;-2.67,3.07,;-1.33,.76,;,1.53,;,3.07,;1.33,.76,;2.67,1.53,;2.67,3.07,;4,3.84,;4,5.38,;5.33,3.07,;4,.76,;4,-.78,;5.33,1.53,;6.67,.76,;8,1.53,;9.34,.76,;9.34,-.78,;10.67,-1.55,;8,-1.55,;6.67,-.78,;-6.67,.76,;-8,1.53,;-9.34,.76,;-10.67,1.53,)|
BDBM275594 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)N[C@H]2CCc3ccccc23)cc1OC |r|
BDBM275488 CC[C@H](C)CNC(=O)[C@@H](CC1CCCCC1)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275490 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCC(C)C)cc1OC |r|
BDBM275491 CC[C@@H](C)[C@@H](NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1)C(=O)NCc1ccc(F)c(OC)c1 |r|
BDBM275492 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCCc2ccc3OCOc3c2)cc1OC |r|
BDBM275493 COc1ccc(CNC(=O)[C@@H](CO)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)cc1OC |r|
BDBM275494 COc1ccc(CNC(=O)[C@@H](COC(C)(C)C)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)cc1OC |r|
BDBM275496 COc1ccc(CC(=O)NC(=N)NC(Cc2ccccc2)C(=O)NC2CCCCC2)cc1OC
BDBM275595 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)N[C@@H]2CCc3ccccc23)cc1OC |r|
BDBM275596 COc1cccc2CC(Cc12)NC(=O)[C@@H](CC(C)C)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275597 COc1ccc2CC(Cc2c1)NC(=O)[C@@H](CC(C)C)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275599 CCOc1cc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(F)c(OC)c2)ccc1OC |r|
BDBM275600 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)N[C@@H]2CC[C@H](O)CC2)cc1OC |r,wU:24.24,27.28,wD:13.12,(-9.34,4.67,;-9.34,3.13,;-8,2.36,;-6.67,3.13,;-5.33,2.36,;-5.33,.82,;-4,.05,;-2.67,.82,;-2.67,2.36,;-1.33,.05,;,.82,;,2.36,;1.33,.05,;2.67,.82,;2.67,2.36,;4,3.13,;5.33,2.36,;6.67,3.13,;6.67,4.67,;5.33,5.44,;4,4.67,;4,.05,;4,-1.49,;5.33,.82,;6.67,.05,;6.67,-1.49,;8,-2.26,;9.34,-1.49,;10.67,-2.26,;9.34,.05,;8,.82,;-6.67,.05,;-8,.82,;-9.34,.05,;-10.67,.82,)|
BDBM275601 CC[C@@H](C)NC(=O)[C@@H](CC1CCCCC1)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275497 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCC(C)C)cc1OC |r|
BDBM275498 COc1cccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)c1 |r|
BDBM275499 COc1ccc(CCNC(=O)[C@@H](Cc2ccccc2Cl)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)cc1OC |r|
BDBM275500 COc1ccc(CCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)cc1OC |r|
BDBM275501 COC(=O)c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)o1 |r|
BDBM275502 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2cccs2)cc1OC |r|
BDBM275602 COc1ccc(OC)c(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(OC)c(OC)c2)c1 |r|
BDBM275603 COc1ccc(OC)c(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(F)c(OC)c2)c1 |r|
BDBM275604 COc1ccc(OC)c(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(F)c(OC)c2)c1 |r|
BDBM275605 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)N[C@H]2CCc3ccccc23)cc1OC |r|
BDBM275606 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)N[C@@H]2CCc3ccccc23)cc1OC |r|
BDBM275607 COc1cccc2CC(Cc12)NC(=O)[C@@H](CC1CCCCC1)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275504 COc1cc(CNC(=O)[C@@H](CCc2ccccc2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)ccc1F |r|
BDBM275505 COC(=O)[C@H]1CC[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)[C@@H](O)C1 |r|
BDBM275506 COc1cc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)cc(OC)c1 |r|
BDBM275507 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)N[C@@H](CO)CC(C)C)cc1OC |r|
BDBM275508 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)N[C@H](CO)CC(C)C)cc1OC |r|
BDBM275509 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NC2CCC(C)CC2)cc1OC |r,wD:13.12,(-10.67,2.26,;-9.34,3.03,;-8,2.26,;-6.67,3.03,;-5.33,2.26,;-5.33,.72,;-4,-.05,;-2.67,.72,;-2.67,2.26,;-1.33,-.05,;,.72,;,2.26,;1.33,-.05,;2.67,.72,;2.67,2.26,;4,3.03,;5.33,2.26,;6.67,3.03,;6.67,4.57,;5.33,5.34,;4,4.57,;4,-.05,;4,-1.59,;5.33,.72,;6.67,-.05,;6.67,-1.59,;8,-2.36,;9.34,-1.59,;10.67,-2.36,;9.34,-.05,;8,.72,;-6.67,-.05,;-8,.72,;-9.34,-.05,;-10.67,.72,)|
BDBM275608 COc1ccc2CC(Cc2c1)NC(=O)[C@@H](CC1CCCCC1)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275610 COc1cc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(F)c(OC)c2)ccc1F |r|
BDBM275611 COc1cc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCC(C)C)ccc1F |r|
BDBM275612 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(F)c(OC)c2)ccc1F |r|
BDBM275613 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(F)c(OC)c2)cc1F |r|
BDBM275614 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCC(C)C)cc1F |r|
BDBM275510 CC[C@@H](C)[C@@H](NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1)C(=O)NCC(C)C |r|
BDBM275511 CC[C@H](C)CNC(=O)[C@@H](CC(C)C)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275512 COc1cc(ccc1F)C1(CC1)NC(=O)[C@@H](CC1CCCCC1)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275513 COc1cc(ccc1F)C1(CC1)NC(=O)[C@@H](CC(C)C)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275514 COc1cc(ccc1F)C1(CC1)NC(=O)[C@@H](Cc1ccccc1)NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1 |r|
BDBM275515 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NC2CCCCC2)cc1OC |r|
BDBM275615 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(F)c(OC)c2)cc1F |r|
BDBM275616 COc1cc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)CC2CCOCC2)ccc1F |r|
BDBM275617 CC(C)CNC(=O)[C@@H](CC1CCCCC1)NC(=N)NC(=O)CC1CCOCC1 |r|
BDBM275618 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)CC2CCOCC2)ccc1F |r|
BDBM275619 COc1cc(F)c(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(F)c(OC)c2)c(F)c1 |r|
BDBM275620 COc1cc(F)c(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCC(C)C)c(F)c1 |r|
BDBM275621 CCOc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCC(C)C)cc1OCC |r|
BDBM50226134 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@@H](O)[C@@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(C)C
BDBM50226135 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C
BDBM50226136 [H][C@](O)(CC(=O)N[C@@H](C)C(=O)NCCC(C)C)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C
BDBM275516 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NC2CCCCC2)cc1OC |r|
BDBM275517 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NC2CCOCC2)cc1OC |r|
BDBM275518 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NC2CCOCC2)cc1OC |r|
BDBM275519 COc1cc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(OC)c(OC)c2)cc(OC)c1 |r|
BDBM275520 COc1cc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(F)c(OC)c2)cc(OC)c1 |r|
BDBM275521 COc1cc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(F)c(OC)c2)cc(OC)c1 |r|
BDBM275622 CCOc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(F)c(OC)c2)cc1OCC |r|
BDBM275623 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(F)c(OC)c2)c(Br)c1 |r|
BDBM275624 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCC(C)C)c(Br)c1 |r|
BDBM275625 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(F)c(OC)c2)c(Br)c1 |r|
BDBM275626 COC(=O)[C@H](CC(=O)NC(=N)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(F)c(OC)c1)Cc1ccccc1 |r|
BDBM275627 COC(=O)[C@H](CC(=O)NC(=N)N[C@H](CC1CCCCC1)C(=O)NCC(C)C)Cc1ccccc1 |r|
BDBM275669 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)CN2CCOCC2)ccc1F |r|
BDBM275670 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(cc2)S(N)(=O)=O)ccc1F |r|
BDBM275671 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(F)c(OC)c2)c(F)c1 |r|
BDBM275672 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCC(C)C)c(F)c1 |r|
BDBM275673 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(cc2)-c2noc(C)n2)ccc1F |r|
BDBM275674 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2cccc(c2)C#N)ccc1F |r|
BDBM275675 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2cccc(NS(C)(=O)=O)c2)ccc1F |r|
BDBM275676 COC(=O)c1ccc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)cc1 |r|
BDBM275677 COC(=O)c1ccc(CNC(=O)[C@@H](CC(C)C)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)cc1 |r|
BDBM275678 COC(=O)c1ccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)cc1 |r|
BDBM275679 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2cccc(c2)-c2noc(C)n2)cc1OC |r|
BDBM275680 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2cccc(c2)-c2noc(C)n2)cc1OC |r|
BDBM275681 CCOC(=O)c1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(F)c(OC)c2)cc1OCC |r|
BDBM275682 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccccn2)ccc1F |r|
BDBM275683 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)COCC(C)C)ccc1F |r|
BDBM275684 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2ccc(cc2)-c2csnn2)cc1OC |r|
BDBM275685 NS(=O)(=O)c1cccc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(Cl)cc2)c1 |r|
BDBM275686 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(cc2)-c2csnn2)cc1OC |r|
BDBM275687 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2cccc(c2)-c2noc(C)n2)cc1OC |r|
BDBM275688 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(cc2)-n2cnnn2)ccc1F |r|
BDBM275689 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2cccc(c2)-n2ccnc2C)cc1OC |r|
BDBM275690 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2cccc(c2)-n2ccnc2C)cc1OC |r|
BDBM275691 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2cccc(c2)-n2ccnc2C)cc1OC |r|
BDBM275692 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2cccc(c2)-n2cncn2)cc1OC |r|
BDBM275693 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2cccc(c2)-n2cncn2)cc1OC |r|
BDBM275694 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2cccc(c2)-n2cncn2)cc1OC |r|
BDBM275695 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(cc2)-c2nnc(O)o2)cc1OC |r|
BDBM275696 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(cc2)-c2nnc(O)o2)cc1OC |r|
BDBM275697 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2cccc(c2)-c2nnc(O)o2)cc1OC |r|
BDBM275698 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2cccc(c2)-c2nnc(O)o2)cc1OC |r|
BDBM275699 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2cccc(c2)-c2nnc(O)o2)cc1OC |r|
BDBM275700 Clc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(cc2)-c2nnn[nH]2)cc1 |r|
BDBM275701 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(cc2)-c2csnn2)cc1OC |r|
BDBM275702 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2cccc(c2)-c2ccnn2C)cc1OC |r|
BDBM275703 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2cccc(c2)-c2ccnn2C)cc1OC |r|
BDBM275704 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2cccc(c2)-c2ccnn2C)cc1OC |r|
BDBM275705 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2cccc(c2)-c2ccn(C)n2)cc1OC |r|
BDBM275706 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2cccc(c2)-c2ccn(C)n2)cc1OC |r|
BDBM275707 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2cccc(c2)-c2ccn(C)n2)cc1OC |r|
BDBM275708 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(Cl)cc2F)ccc1F |r|
BDBM275709 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2cccc(c2)-c2nccs2)cc1OC |r|
BDBM275710 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2cccc(c2)-c2nccs2)cc1OC |r|
BDBM50012951 CC(C)OC(=O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](CC(=O)N1CCOCC1)Cc1cccc2ccccc12
BDBM275711 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2cccc(c2)-c2nccs2)cc1OC |r|
BDBM275712 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)CC2C[C@@H]3CC[C@H]2C3)ccc1F |r,THB:23:24:27.28:30|
BDBM275713 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(C)c(C)c2)ccc1F |r|
BDBM275714 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(F)c(c2)-c2nnc(O)o2)cc1OC |r|
BDBM275715 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2ccc(F)c(c2)-c2nnc(O)o2)cc1OC |r|
BDBM275716 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(F)c(c2)-c2nnc(O)o2)cc1OC |r|
BDBM275717 N=C(N[C@H](CC1CCCCC1)C(=O)NCc1cccc(c1)-c1nnn[nH]1)NC(=O)CC1C[C@@H]2CC[C@H]1C2 |r,THB:29:30:33.34:36|
BDBM275718 Cc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2cccc(c2)-c2nnn[nH]2)cc1C |r|
BDBM275719 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(cc2)-c2nn[nH]n2)ccc1F |r|
BDBM275720 CCCC1CCC(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(F)c(OC)c2)CC1 |r,wD:14.13,(11.34,1.47,;10,.7,;8.67,1.47,;7.34,.7,;7.34,-.84,;6,-1.61,;4.67,-.84,;3.33,-1.61,;2,-.84,;2,.7,;.67,-1.61,;-.67,-.84,;-.67,.7,;-2,-1.61,;-3.33,-.84,;-4.67,-1.61,;-6,-.84,;-6,.7,;-7.34,1.47,;-8.67,.7,;-8.67,-.84,;-7.34,-1.61,;-3.33,.7,;-2,1.47,;-4.67,1.47,;-4.67,3.01,;-6,3.78,;-6,5.32,;-7.34,6.09,;-8.67,5.32,;-10,6.09,;-8.67,3.78,;-10,3.01,;-11.34,3.78,;-7.34,3.01,;4.67,.7,;6,1.47,)|
BDBM275721 CCCC1CCC(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2cccc(c2)-c2nnn[nH]2)CC1 |r,wD:14.13,(11.85,1.45,;10.52,.68,;9.19,1.45,;7.85,.68,;7.85,-.86,;6.52,-1.63,;5.19,-.86,;3.85,-1.63,;2.52,-.86,;2.52,.68,;1.18,-1.63,;-.15,-.86,;-.15,.68,;-1.48,-1.63,;-2.82,-.86,;-4.15,-1.63,;-5.48,-.86,;-5.48,.68,;-6.82,1.45,;-8.15,.68,;-8.15,-.86,;-6.82,-1.63,;-2.82,.68,;-1.48,1.45,;-4.15,1.45,;-4.15,2.99,;-5.48,3.76,;-5.48,5.3,;-6.82,6.07,;-8.15,5.3,;-8.15,3.76,;-6.82,2.99,;-9.48,2.99,;-9.48,1.45,;-10.95,.97,;-11.85,2.22,;-10.95,3.47,;5.19,.68,;6.52,1.45,)|
BDBM275722 COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)NCc2ccc(F)c(c2)-c2nn[nH]n2)cc1OC |r|
BDBM275723 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(F)c(c2)-c2nn[nH]n2)cc1OC |r|
BDBM275724 COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)NCc2ccc(F)c(c2)-c2nn[nH]n2)cc1OC |r|
BDBM275725 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)N[C@@H](C)c2cccc(c2)-c2nnn[nH]2)cc1OC |r|
BDBM275726 C[C@H](NC(=O)[C@@H](CC1CCCCC1)NC(=N)NC(=O)Cc1ccc(C)c(C)c1)c1cccc(c1)-c1nnn[nH]1 |r|
BDBM275727 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)N[C@@H](C)c2ccc(F)c(c2)-c2nnn[nH]2)cc1OC |r|
BDBM275728 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(cc2)N(C(F)(F)F)C(F)(F)F)cc1OC |r|
BDBM50022517 COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)CC(O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)COC(=O)C(C)(C)C
BDBM50022515 COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)CC(O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)COC(=O)C(C)(C)C
BDBM50367299 [Cl-].CC(C)CCNC(=O)[C@H](C)NC(=O)C([S+](C)C)C(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C |r|
BDBM50025537 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](C)[C@@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C
BDBM50025512 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](C)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(C)C
BDBM50025523 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(C)C
BDBM50025536 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](C)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C
BDBM50025535 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](C)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(C)C
BDBM50025528 COC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C |r|
BDBM50025514 COC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C |r|
BDBM50025533 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C
BDBM50025513 COC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C |r|
BDBM50025510 COC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C |r|
BDBM50025529 [H][C@](O)(CC(=O)N[C@@H](C)C(=O)NCCC(C)C)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C
BDBM50045286 CC[C@@H](O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1
BDBM50024145 CC[C@H](C)[C@H](NC(=O)C(F)(F)C(=O)C(CC(C)C)NC(=O)[C@H](CC1N=CC=N1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1ccccn1 |c:24,26|
BDBM50024156 CC[C@H](C)[C@H](NC(=O)[C@@H](C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)C(C)C)C(=O)NCc1ccccn1
BDBM312938 C[C@H]1C[C@H]2CSC(N)=N[C@]2(CO1)c1nc(NC(=O)c2ccn(n2)C(F)F)cs1 |c:7|
BDBM314860 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(N[C@@H]2CCc3cc(Br)cnc23)ccc1F |r,t:1|
BDBM314821 NC1=N[C@](CF)([C@@H]2C[C@@H]2O1)c1cc(Nc2nccc3cc(Cl)cnc23)cc(F)c1F |r,t:1|
BDBM314840 COc1cnc2c(Nc3ccc(Cl)c(c3)[C@@]3(CF)N=C(N)O[C@@H]4C[C@H]34)nccc2c1 |r,t:19|
BDBM314863 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(N[C@H]2CCOc3cc(ccc23)C#N)ccc1F |r,t:1|
BDBM314864 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(N[C@H]2CCc3cc(Br)ccc23)ccc1F |r,t:1|
BDBM314865 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(Nc2coc3cc(Cl)cnc23)ccc1F |r,t:1|
BDBM314379 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)N=C(NC(=O)c2ccccc2)OC2C[C@H]12 |r,t:22|
BDBM314799 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)N=C(NC(=O)c2ccccc2)O[C@H]2C[C@@H]12 |r,t:22|
BDBM314880 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC2CCc3cc(cnc23)C#N)ccc1F |r,t:1|
BDBM314881 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(N[C@H]2CCCc3cc(cnc23)C#N)ccc1F |r,t:1|
BDBM314888 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(CCC#CC3CC3)cn2)ccc1F |r,t:1|
BDBM314896 OCc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(N=[C-]O[C@@H]2C[C@H]12)C(F)F |r,c:22|
BDBM314900 FC[C@@]1(N=C(NC(=O)c2ccccc2)O[C@@H]2C[C@H]12)c1cc(Br)ccc1Cl |r,t:3|
BDBM314902 FC(F)[C@]1(N=C(NC(=O)c2ccccc2)O[C@H]2C[C@@H]12)c1cc(Br)ccc1F |r,t:4|
BDBM314903 FC(F)[C@@]1(N=C(NC(=O)c2ccccc2)O[C@@H]2C[C@H]12)c1cc(Br)ccc1F |r,t:4|
BDBM312934 C[C@H]1C[C@H]2CSC(N)=N[C@]2(CO1)c1nc(NC(=O)c2cnc(OC(F)F)cn2)cs1 |c:7|
BDBM312940 C[C@H]1C[C@H]2CSC(N)=N[C@]2(CO1)c1nc(NC(=O)c2ccc(cn2)C#N)cs1 |c:7|
BDBM314908 CC#Cc1cncc(c1)-c1ccc(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:21|
BDBM314909 COc1ccc(COCc2cc(F)c(cc2-c2cncc(c2)C#CC)[C@@]2(CF)N=C(N)OC3C[C@H]23)cc1 |r,t:30|
BDBM314910 CC(C)(C)OC(=O)N=C1OC2C[C@@H]2[C@](CF)(N1C(=O)OC(C)(C)C)c1cc(c(CO)cc1F)-c1cncc(F)c1 |r|
BDBM314916 CN(C(=O)OC(C)(C)C)c1cnc(nc1)C(=O)Nc1ccc(F)c(c1)[C@]1(N=C(N)O[C@@H]2C[C@H]12)C(F)F |r,t:28|
BDBM314412 Cc1c(F)cccc1[C@]1(N=C(NC(=O)c2ccccc2)O[C@@H]2C[C@H]12)C(F)F |r,t:10|
BDBM314413 Cc1cc(OCC#CC(C)(C)O)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(C)N=C(N)O[C@H]2C[C@@H]12 |r,t:29|
BDBM314621 CSc1c(F)cc(NC(=O)c2ccc(Cl)cn2)cc1[C@@]1(CF)N=C(N)OC2C[C@H]12 |r,t:24|
BDBM314622 NC1=N[C@@](CF)([C@H]2CC2O1)c1cc(NC(=O)c2ccc(Cl)cn2)cc(F)c1F |r,t:1|
BDBM314640 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(NC(=O)c2cnc(OCC(F)(F)F)cn2)ccc1F |r,t:1|
BDBM314742 NC1=N[C@@](C(F)F)([C@H]2CC2O1)c1cc(NC(=O)c2cnc(Cl)cn2)ccc1F |r,t:1|
BDBM314756 NC1=N[C@](CF)([C@@H]2C[C@H]2O1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1Cl |r,t:1|
BDBM314777 COc1cc(Cl)cnc1C(=O)Nc1ccc(F)c(c1)[C@@]1(CF)N=C(N)O[C@@H]2C[C@H]12 |r,t:24|
BDBM314801 NC1=N[C@](C(F)F)([C@H]2C[C@H]2O1)c1nc(NC(=O)c2ccc(Cl)cn2)ccc1F |r,t:1|
BDBM314810 NC1=N[C@@](C(F)F)([C@H]2CC2O1)c1nc(NC(=O)c2ccc(cn2)[N+]#[C-])ccc1F |r,t:1|
BDBM314811 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1nc(NC(=O)c2ccc(cn2)C#N)ccc1F |r,t:1|
BDBM327813 CCN(CC)C(=O)c1ccc2CN(C3Cc4ccccc4C3)C(N)=Nc2c1 |c:25|
BDBM347300 CC(C)[C@H](NC(=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CCC(=O)NCCc1ccccc1 |r|
BDBM327789 COc1cc2CC(Cc2cc1OC)N1Cc2ccc(Cl)cc2N=C1N |c:25|
BDBM347308 CC[C@H](C)[C@H](NC(=O)CC[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(C)C)C(=O)N[C@@H](C(C)C)C(O)=O |r|
BDBM347309 CC[C@H](C)[C@H](NC(=O)CC[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)Cc1cccc(OC(F)(F)F)c1)C(C)C)C(=O)N[C@@H](C(C)C)C(O)=O |r|
BDBM347304 COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(C)C)C(C)C |r|
BDBM347289 CC[C@H](C)[C@H](NC(=O)CC[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)C(C)C)C(=O)NCc1cnc(C)nc1N |r|
BDBM347290 CC[C@H](C)[C@H](NC(=O)CC[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)C(C)C)C(=O)N[C@@H](C(C)C)C(=O)OC |r|
BDBM347292 COc1ccc(OC(F)(F)F)cc1CC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CCC(=O)NCCc1ccccc1 |r|
BDBM347294 CC(C)[C@H](NC(=O)Cc1cccc(Oc2ccccc2)c1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CCC(=O)NCCc1ccccc1 |r|
BDBM335459 C[C@]1(CS(=O)(=O)[C@@](C)(C2CC2)C(N)=N1)c1cc(Nc2nccc3cc(cnc23)C#N)ccc1F |r,c:13|
BDBM335460 COc1cnc2c(Nc3cc(c(F)cn3)[C@]3(C)CS(=O)(=O)[C@@](C)(C4CC4)C(N)=N3)ncnc2c1 |r,c:29|
BDBM335461 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)[C@@](C)(C4CC4)C(N)=N3)ncnc2c1 |r,c:29|
BDBM335463 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)[C@@](C)(C4CC4)C(N)=N3)ncnc2n1 |r,c:29|
BDBM335464 COc1cnc2c(Nc3cc(c(F)cn3)[C@]3(C)CS(=O)(=O)[C@@](C)(C4CC4)C(N)=N3)ncnc2n1 |r,c:29|
BDBM335465 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)[C@@](C)(C4CC4)C(N)=N3)nccc2n1 |r,c:29|
BDBM335466 C[C@]1(CS(=O)(=O)[C@@](C)(C2CC2)C(N)=N1)c1cc(Nc2nccc3cc(O)cnc23)ncc1F |r,c:13|
BDBM335467 C[C@]1(CS(=O)(=O)[C@@](C)(C2CC2)C(N)=N1)c1cc(Nc2nccc3cc(F)cnc23)ncc1F |r,c:13|
BDBM335468 C[C@]1(CS(=O)(=O)[C@@](C)(C2CC2)C(N)=N1)c1cc(Nc2nccc3cc(Cl)cnc23)ncc1F |r,c:13|
BDBM335469 CC#CCOc1cnc2c(Nc3cc(c(F)cn3)[C@]3(C)CS(=O)(=O)[C@@](C)(C4CC4)C(N)=N3)nccc2n1 |r,c:32|
BDBM335470 CC#CCOc1cnc2c(Nc3cnc(F)c(c3)[C@]3(C)CS(=O)(=O)[C@@](C)(C4CC4)C(N)=N3)nccc2n1 |r,c:32|
BDBM327784 NC1=Nc2cc(Cl)ccc2CN1C1Cc2ccccc2C1 |t:1|
BDBM327785 NC1=Nc2cccc(Cl)c2CN1C1Cc2ccccc2C1 |t:1|
BDBM327786 NC1=Nc2cc(ccc2CN1C1Cc2ccccc2C1)-c1ccccc1 |t:1|
BDBM327787 NC1=Nc2cc(Cl)ccc2CN1C1CCCc2ccccc12 |t:1|
BDBM327788 CCCc1ccc2CN(C3Cc4ccccc4C3)C(N)=Nc2c1 |c:21|
BDBM335471 CC#CCOc1cnc2c(Nc3cnc(F)c(c3)[C@]3(C)CS(=O)(=O)[C@@](C)(C4CC4)C(N)=N3)nccc2c1 |r,c:32|
BDBM335472 C[C@]1(CS(=O)(=O)[C@@](C)(C2CC2)C(N)=N1)c1cc(Nc2ccnc3cccnc23)ncc1F |r,c:13|
BDBM335473 COc1cnc2c(Nc3cnc(F)c(c3)[C@]3(C)CS(=O)(=O)[C@@](C)(C4CC4)C(N)=N3)nccc2c1 |r,c:29|
BDBM335474 C[C@]1(CS(=O)(=O)[C@@](C)(C2CC2)C(N)=N1)c1cc(Nc2ccnc3cc(Cl)cnc23)ncc1F |r,c:13|
BDBM335475 C[C@]1(CS(=O)(=O)[C@@](C)(C2CC2)C(N)=N1)c1cc(Nc2ccnc3cc(F)cnc23)ncc1F |r,c:13|
BDBM327792 NC1=Nc2cc(ccc2CN1C1Cc2ccccc2C1)C(F)(F)F |t:1|
BDBM327793 COc1ccc2CC(Cc2c1OC)N1Cc2ccc(Cl)cc2N=C1N |c:25|
BDBM327794 COc1cccc2CC(Cc12)N1Cc2ccc(Cl)cc2N=C1N |c:23|
BDBM327796 NC1=Nc2cc(ccc2CN1C1CCc2ccccc12)C(F)(F)F |t:1|
BDBM327798 COc1ccc2CC(Cc2c1)N1Cc2ccc(Cl)cc2N=C1N |c:23|
BDBM327799 NC1=Nc2cc(ccc2CN1C1c2ccccc2-c2ccccc12)C(F)(F)F |t:1|
BDBM335476 COc1cnc2c(Nc3cc(c(F)cn3)[C@]3(C)CS(=O)(=O)[C@@](C)(C4CC4)C(N)=N3)ccnc2n1 |r,c:29|
BDBM335477 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)[C@@](C)(C4CC4)C(N)=N3)ccnc2c1 |r,c:29|
BDBM335478 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)[C@@](C)(C4CC4)C(N)=N3)ccnc2n1 |r,c:29|
BDBM335479 C[C@]1(CS(=O)(=O)[C@@](C)(C2CC2)C(N)=N1)c1cc(Nc2ncnc3cc(Br)cnc23)ncc1F |r,c:13|
BDBM335480 C[C@]1(CS(=O)(=O)[C@@](C)(C2CC2)C(N)=N1)c1cc(Nc2ncnc3cc(cnc23)C#N)ncc1F |r,c:13|
BDBM327800 COc1ccc2CC(Cc2c1)N1Cc2ccc(cc2N=C1N)C(F)(F)F |c:22|
BDBM327802 CCc1ccc2CN(C3Cc4ccc(OC)cc4C3)C(N)=Nc2c1 |c:22|
BDBM327803 COc1ccc2C[C@@H](Cc2c1)N1Cc2ccc(cc2N=C1N)C(F)(F)F |r,c:22|
BDBM327807 COc1ccc2C[C@H](Cc2c1)N1Cc2ccc(cc2N=C1N)C(F)(F)F |r,c:22|
BDBM327809 NC1=Nc2cc(ccc2CN1C1CCc2ccccc2C1)C(F)(F)F |t:1|
BDBM327811 NC1=Nc2cc(ccc2CN1C1Cc2ccccc2C1)C(=O)N1CCc2ccccc12 |t:1|
BDBM327812 COc1ccc2CN(Cc2c1)C(=O)c1ccc2CN(C3Cc4ccccc4C3)C(N)=Nc2c1 |c:33|
BDBM335433 C[C@]1(CS(=O)(=O)[C@@](C)(C2CC2)C(N)=N1)c1nc(Nc2nccc3cc(cnc23)C#N)ncc1F |r,c:13|
BDBM335434 COc1cnc2c(Nc3cc(c(F)cn3)[C@]3(C)CS(=O)(=O)[C@@](C)(C4CC4)C(N)=N3)nccc2c1 |r,c:29|
BDBM327816 NC1=Nc2cc(ccc2CN1C1Cc2ccccc2C1)C(=O)N1CCOCC1 |t:1|
BDBM327817 NC1=Nc2cc(ccc2CN1C1Cc2ccccc2C1)C(=O)N1CCCCC1 |t:1|
BDBM327819 Nc1nc2cc(ccc2c(=O)n1C1Cc2ccccc2C1)C(F)(F)F
BDBM327821 NNc1nc2cc(ccc2c(=O)n1C1Cc2ccccc2C1)C(F)(F)F
BDBM327822 NC1=Nc2cc(ccc2CN1C1Cc2ccccc2C1)C(=O)N1CCCC1Cc1ccccc1 |t:1|
BDBM327823 NC1=Nc2cc(ccc2CN1C1Cc2ccccc2C1)C(=O)N1CCOc2ccccc12 |t:1|
BDBM327825 CO[C@H]1[C@H](Cc2ccccc12)N1Cc2ccc(cc2NC1=N)C(F)(F)F |r|
BDBM335424 C[C@]1(CS(=O)(=O)[C@@](CF)(C2CC2)C(N)=N1)c1cc(Nc2nccc3cc(cnc23)C#N)ccc1F |r,c:14|
BDBM335427 C[C@]1(CS(=O)(=O)[C@@](CF)(C2CC2)C(N)=N1)c1nc(Nc2nccc3cc(cnc23)C#N)ccc1F |r,c:14|
BDBM335430 C[C@]1(CS(=O)(=O)[C@@](C)(C2CC2)C(N)=N1)c1cc(Nc2nccc3cc(Br)cnc23)ncc1F |r,c:13|
BDBM335431 C[C@]1(CS(=O)(=O)[C@@](C)(C2CC2)C(N)=N1)c1cc(Nc2nccc3cc(cnc23)C#N)ncc1F |r,c:13|
BDBM335437 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)[C@@](CF)(C4CC4)C(N)=N3)nccc2c1 |r,c:30|
BDBM335438 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)[C@@](CF)(C4CC4)C(N)=N3)nccc2n1 |r,c:30|
BDBM335444 COc1cnc2c(Nc3cc(c(F)cn3)[C@]3(C)CS(=O)(=O)[C@@](C)(C4CC4)C(N)=N3)nccc2n1 |r,c:29|
BDBM335447 CC#CCOc1cnc2c(Nc3cc(c(F)cn3)[C@]3(C)CS(=O)(=O)[C@@](C)(C4CC4)C(N)=N3)nccc2c1 |r,c:32|
BDBM335448 CC#CCOc1cnc2c(Nc3cnc(F)c(c3)[C@]3(C)CS(=O)(=O)[C@@](CF)(C4CC4)C(N)=N3)nccc2c1 |r,c:33|
BDBM335453 COc1cnc2c(Nc3cnc(F)c(c3)[C@]3(C)CS(=O)(=O)[C@@](CF)(C4CC4)C(N)=N3)nccc2c1 |r,c:30|
BDBM335454 CC#CCOc1cnc2c(Nc3cnc(F)c(c3)[C@]3(C)CS(=O)(=O)[C@@](CF)(C4CC4)C(N)=N3)nccc2n1 |r,c:33|
BDBM335455 COc1cnc2c(Nc3ccc(F)c(c3)[C@]3(C)CS(=O)(=O)[C@@](C)(C4CC4)C(N)=N3)nccc2c1 |r,c:29|
BDBM335456 C[C@]1(CS(=O)(=O)[C@@](C)(C2CC2)C(N)=N1)c1cc(Nc2ncnc3cc(Br)cnc23)ccc1F |r,c:13|
BDBM335457 C[C@]1(CS(=O)(=O)[C@@](C)(C2CC2)C(N)=N1)c1cc(Nc2ncnc3cc(cnc23)C#N)ccc1F |r,c:13|
BDBM335458 C[C@]1(CS(=O)(=O)[C@@](C)(C2CC2)C(N)=N1)c1cc(Nc2nccc3cc(Br)cnc23)ccc1F |r,c:13|
BDBM50240554 [H][C@]1(NCCN(Cc2ccccc2)C1=O)[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O |r|
BDBM50259950 C[C@]1(CCSC(N)=N1)c1cc(CNCC(F)F)c(F)cc1F |r,c:6|
BDBM50259954 CC(C)(NCc1cc(c(F)cc1F)[C@]1(C)CCSC(N)=N1)C(F)(F)F |r,c:20|
BDBM50259957 C[C@]1(CCSC(N)=N1)c1cc(CNC2CC2)c(F)cc1F |r,c:6|
BDBM50259959 C[C@]1(CCSC(N)=N1)c1cc(CNC2(CC2)C(F)F)c(F)cc1F |r,c:6|
BDBM50259961 C[C@]1(CCSC(N)=N1)c1cc(CNC2(COC2)C(F)(F)F)c(F)cc1F |r,c:6|
BDBM50259962 C[C@@H]1C[C@](C)(N=C(N)S1)c1cc(CNC2(CC2)C(F)(F)F)c(F)cc1F |r,t:5|
BDBM50259963 CCNCc1cc(c(F)cc1F)[C@]1(C)CCSC(N)=N1 |r,c:19|
BDBM50259964 CC(C)NCc1cc(c(F)cc1F)[C@]1(C)CCSC(N)=N1 |r,c:20|
BDBM50259965 CN(C)Cc1cc(c(F)cc1F)[C@]1(C)CCSC(N)=N1 |r,c:19|
BDBM372903 C[C@]1(O)CCN(C1)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,t:16|
BDBM50259968 COC[C@@H](C)NCc1cc(c(F)cc1F)[C@]1(C)CCSC(N)=N1 |r,c:22|
BDBM50259967 COCCCNCc1cc(c(F)cc1F)[C@]1(C)CCSC(N)=N1 |r,c:22|
BDBM50259969 CN(Cc1cc(c(F)cc1F)[C@]1(C)CCSC(N)=N1)CC(F)(F)F |r,c:18|
BDBM50259970 C[C@@H](NCc1cc(c(F)cc1F)[C@]1(C)CCSC(N)=N1)C(F)(F)F |r,c:19|
BDBM372783 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(ccc1F)C(\F)=C\c1ccc(cc1)C#N |t:11|
BDBM372929 CC[C@H]1COCCN1C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:17|
BDBM372776 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(\F)c2ccc(Cl)cn2)cnc1F |t:11|
BDBM372777 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)cnc1F |t:11|
BDBM372778 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CC[C@@H](F)C1)c1cc(\C=C(/F)c2ccc(cn2)C#N)cnc1F |t:2|
BDBM372779 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CC[C@H](F)C1)c1cc(\C=C(/F)c2ccc(cn2)C#N)cnc1F |t:2|
BDBM372780 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOCC1)c1cc(\C=C(/F)c2ccc(cn2)C#N)cnc1F |t:2|
BDBM372781 COc1ncc(\C=C(/F)c2ccc(cn2)C#N)cc1[C@@]1(C)N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CC[C@@H](F)C1 |t:23|
BDBM372878 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(O)=O)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)cnc1F |t:2|
BDBM372879 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:9|
BDBM372881 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)cnc1F |t:11|
BDBM372882 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC(C)=O)cn2)cnc1F |t:11|
BDBM372883 CC#CCOc1cnc(cn1)C(\F)=C\c1cnc(F)c(c1)[C@@]1(C)N=C(N)S[C@]2(C[C@@H]12)C(=O)N(C)C |t:25|
BDBM372884 C[C@@H]1COCCN1C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)cnc1F |t:16|
BDBM372696 COC[C@]12C[C@H]1[C@](CF)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:10|
BDBM372782 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(ccc1F)C(\F)=C\c1ccc(Cl)cn1 |t:11|
BDBM372784 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOCC1)c1cc(\C=C(/F)c2cnc(cn2)C#N)ccc1F |t:2|
BDBM372785 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCCCC1)c1cc(\C=C(/F)c2cnc(cn2)C#N)ccc1F |t:2|
BDBM372786 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CC[C@H](F)C1)c1cc(\C=C(/F)c2cnc(cn2)C#N)ccc1F |t:2|
BDBM372787 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CC[C@@H](F)C1)c1cc(\C=C(/F)c2cnc(cn2)C#N)ccc1F |t:2|
BDBM372885 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC(F)(F)C(F)F)cn2)cnc1F |t:11|
BDBM372886 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOCC1)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |t:2|
BDBM372887 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:9|
BDBM372888 COC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)cnc1F |t:10|
BDBM372889 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CC[C@@H](F)C1)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)cnc1F |t:2|
BDBM372890 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(cn2)C#N)cnc1F |t:11|
BDBM372697 COC[C@]12C[C@H]1[C@](CF)(N=C(N)S2)c1cc(\C=C(\F)c2ccc(Cl)cn2)ccc1F |t:10|
BDBM372698 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:11|
BDBM372699 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCCC1)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:2|
BDBM372700 COc1ccc(nc1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCCC1 |t:22|
BDBM372701 COC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(Br)cn2)ccc1F |t:10|
BDBM372702 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:11|
BDBM372788 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCCC1)c1cc(\C=C(/F)c2cnc(cn2)C#N)ccc1F |t:2|
BDBM372789 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(cn2)C#C)ccc1F |t:11|
BDBM372790 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)I)ccc1F |t:11|
BDBM372791 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)C#Cc2ccccc2)ccc1F |t:11|
BDBM372792 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C/F)ccc1F |t:11|
BDBM372793 CC#C\C(F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)S[C@]2(C[C@@H]12)C(=O)N(C)C |t:16|
BDBM372891 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CC[C@@H](F)C1)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |t:2|
BDBM372892 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1[C@H]2COC[C@@H]1COC2)c1cc(\C=C(/F)c2ccc(cn2)C#N)cnc1F |t:2,THB:9:11:17.18.19:13.14.15|
BDBM372893 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(cn2)C#N)ccc1F |t:9|
BDBM372894 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)NCC(F)F)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)cnc1F |t:2|
BDBM372895 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOCC1)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)cnc1F |t:2|
BDBM372703 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCCC1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372704 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(Br)cn2)ccc1F |r,t:11|
BDBM372705 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#CC2CC2)ccc1F |t:11|
BDBM372706 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#C)ccc1F |t:11|
BDBM372707 COC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:10|
BDBM372708 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCC1)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:2|
BDBM372794 COCCOc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)S[C@]2(C[C@@H]12)C(=O)N(C)C |t:25|
BDBM372795 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC3CC3)cn2)ccc1F |t:11|
BDBM372796 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC3COC3)cn2)ccc1F |t:11|
BDBM372797 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC(F)F)cn2)ccc1F |t:11|
BDBM372798 COC[C@H](C)Oc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)S[C@]2(C[C@@H]12)C(=O)N(C)C |t:26|
BDBM372896 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)NCC(F)F)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |t:2|
BDBM372897 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CC[C@H](F)C1)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |t:2|
BDBM372898 C[C@@H]1COCCN1C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |t:16|
BDBM372899 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cc3OCCOc3cn2)ccc1F |t:9|
BDBM372900 C[C@H]1[C@@H](F)CCN1C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:16|
BDBM372709 C[C@@]1(N=C(N)S[C@@]2(CO)C[C@@H]12)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:2|
BDBM372710 C[C@@]1(N=C(N)S[C@@]2(CC#N)C[C@@H]12)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:2|
BDBM372711 CC(O)CCNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:14|
BDBM372712 CC1CCN1C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:14|
BDBM372713 COC[C@@H]1CCCN1C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:17|
BDBM372714 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)Nc1ccccc1)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:2|
BDBM372799 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC3CC3(F)F)cn2)ccc1F |t:11|
BDBM372800 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCc3nnc(C)o3)cn2)ccc1F |t:11|
BDBM372801 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCc3nc(C)no3)cn2)ccc1F |t:11|
BDBM372802 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCc3cc(C)no3)cn2)ccc1F |t:11|
BDBM372803 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ncc(s2)C#N)ccc1F |t:11|
BDBM372901 C[C@@H]1[C@H](F)CCN1C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:16|
BDBM372902 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOC2(COC2)C1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372715 C[C@H]1CCN1C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:14|
BDBM372716 C[C@@H]1CCN1C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:14|
BDBM372717 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)NC1CC1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372718 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCC(F)(F)C1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372719 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCC1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372720 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOCC1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372804 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(s2)C#N)ccc1F |t:11|
BDBM372806 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:10|
BDBM372807 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(cn2)C#N)ccc1F |t:10|
BDBM372808 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C(F)(F)F)ccc1F |t:10|
BDBM372907 C[C@H]1COC[C@@H](C)N1C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:17|
BDBM372908 C[C@@H]1COC[C@@H](C)N1C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:17|
BDBM372909 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1C2CCC1COC2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2,THB:9:11:16.17.18:13.14|
BDBM372911 CC(C)[C@H]1CN(CCO1)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:18|
BDBM372912 CC(C)[C@@H]1CN(CCO1)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:18|
BDBM372721 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CC[C@H](O)C1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372722 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CC[C@@H](F)C1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372723 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CC[C@H](F)C1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372724 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)NC1CCOCC1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372725 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1Cc2ccccc2C1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372809 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ncc(cc2C)C#N)ccc1F |t:10|
BDBM372810 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCc3cnco3)cn2)ccc1F |t:10|
BDBM372811 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)S(C)(=O)=O)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |t:2|
BDBM372812 Cc1nnc(COc2cnc(cn2)C(\F)=C\c2ccc(F)c(c2)[C@@]2(C)N=C(N)S[C@]3(C[C@@H]23)S(C)(=O)=O)o1 |t:27|
BDBM372813 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)S(C)(=O)=O)c1cc(\C=C(/F)c2cnc(OCC(F)(F)F)cn2)ccc1F |t:2|
BDBM372814 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)S(C)(=O)=O)c1cc(\C=C(/F)c2cnc(Cl)cn2)ccc1F |t:2|
BDBM372913 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOC2(CC2)C1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372914 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CC2(C1)CCOCC2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,t:2|
BDBM372915 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CC2(C1)CCOCC2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372916 C[C@H]1CN(CCO1)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:16|
BDBM372917 CC(C)[C@@H]1COCCN1C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:18|
BDBM372726 COC(=O)[C@H]1CCCN1C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:18|
BDBM372727 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCN(CC1)c1ccccc1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372728 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CC2CC1CO2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372729 C[C@@H]1CC[C@@H](C)N1C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:16|
BDBM372730 CN(C)[C@@H]1CCN(C1)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:17|
BDBM372815 CC#CCOc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)S[C@]2(C[C@@H]12)S(C)(=O)=O |t:25|
BDBM372816 C[C@H](Oc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)S[C@]2(C[C@@H]12)S(C)(=O)=O)C#C |t:23|
BDBM372817 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)S(C)(=O)=O)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372818 CC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |t:9|
BDBM372819 CC#CCOc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)S[C@]2(C[C@@H]12)C(C)=O |t:25|
BDBM372820 CC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC(F)(F)F)cn2)ccc1F |t:9|
BDBM372918 C[C@H]1CN(C[C@H](C)O1)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:17|
BDBM372919 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCCC(F)(F)C1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372920 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCC(F)(F)CC1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372921 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCC(F)CC1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372922 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCC2(CCO2)C1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372731 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CC[C@@H]2CCCC[C@H]2C1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372732 CC12CC(CC(C)(C)C1)N(C2)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:21|
BDBM372733 CC1CC(C)CN(C1)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:17|
BDBM372734 CC1CCCN1C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:15|
BDBM372735 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCC(CC1)C(F)(F)F)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372821 C[C@H](Oc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)S[C@]2(C[C@@H]12)C(C)=O)C#C |t:23|
BDBM372822 CC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:9|
BDBM372823 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(N)=O)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |t:2|
BDBM372829 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C#N)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |t:2|
BDBM372830 CC#CCOc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)S[C@]2(C[C@@H]12)C(N)=O |t:25|
BDBM372831 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(N)=O)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:2|
BDBM372923 COC[C@H]1COCCN1C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:18|
BDBM372924 C[C@H]1CN([C@@H](C)CO1)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:17|
BDBM372925 C[C@@H]1CN([C@H](C)CO1)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:17|
BDBM372926 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOCC11CCC1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372927 CC1(C)COCCN1C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:17|
BDBM372736 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCCC(C1)c1ccccc1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372737 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCN(CC2CC2)CC1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372738 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCNC(=O)CC1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372739 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCCC(C1)C#N)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372740 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCNC(=O)C1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372832 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(N)=O)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372833 CC#CCOc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)S[C@]2(C[C@@H]12)C#N |t:25|
BDBM372834 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C#N)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372835 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cn3cc(ccc3n2)C#N)ccc1F |t:11|
BDBM372836 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cc3nccnc3cn2)ccc1F |t:11|
BDBM372837 COC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(Cl)cn2)cc(F)c1F |t:10|
BDBM372928 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CC[C@@H](O)C1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM50259949 C[C@]1(CCSC(N)=N1)c1cc(CNCC(F)(F)F)c(F)cc1F |r,c:6|
BDBM50259955 C[C@]1(CCSC(N)=N1)c1cc(CNCCC(F)(F)F)c(F)cc1F |r,c:6|
BDBM372931 C[C@H]1[C@H](O)CCN1C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:16|
BDBM372932 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCCC1c1ccccc1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372741 CC1CCCN(C1)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:16|
BDBM372742 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCCCC1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372743 CC1CCN(CC1)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:16|
BDBM372744 COC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(Br)cn2)ccc1F |t:10|
BDBM372745 COC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(Cl)cn2)ccc1F |t:10|
BDBM372746 COC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCc3ncco3)cn2)ccc1F |t:10|
BDBM372838 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cc3OCCOc3cn2)ccc1F |t:10|
BDBM372839 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ncc3OCCOc3n2)ccc1F |t:11|
BDBM372840 COc1ccc(CNC2=N[C@@](C)([C@@H]3C(F)(F)[C@]3(CO)S2)c2cc(\C=C(/F)c3ccc(cn3)C#N)ccc2F)cc1 |r,t:8|
BDBM372841 C[C@@]1(N=C(N)S[C@]2(CO)[C@H]1C2(F)F)c1cc(\C=C(/F)c2cnc(Cl)cn2)ccc1F |t:2|
BDBM372842 C[C@@]1(N=C(N)S[C@]2(CO)[C@H]1C2(F)F)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |t:2|
BDBM372844 C[C@@]1(N=C(N)S[C@]2(CO)[C@H]1C2(F)F)c1cc(\C=C(/F)c2cnc(cn2)C#N)ccc1F |t:2|
BDBM372933 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOCC1)c1cc(\C=C(/F)c2ccc(Br)cn2)ccc1F |t:2|
BDBM372934 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOCC1)c1cc(\C=C(/F)c2ccccn2)ccc1F |t:2|
BDBM372935 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOCC1)c1cc(\C=C(/F)c2ccc(cn2)C2COC2)ccc1F |t:2|
BDBM372936 COC(CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F)OC |t:13|
BDBM372937 CC1COC(=N1)[C@]12C[C@H]1[C@](C)(N=C(NC(=O)OC(C)(C)C)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,c:4,t:13|
BDBM372938 C[C@@H]1CN=C(O1)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |c:3,t:13|
BDBM372747 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |t:10|
BDBM372748 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC(C)=O)cn2)ccc1F |t:10|
BDBM372749 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |t:11|
BDBM372750 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCc3ncco3)cn2)ccc1F |t:11|
BDBM372751 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC(F)(F)F)cn2)ccc1F |t:11|
BDBM372845 C[C@@]1(N=C(N)S[C@]2(CO)[C@H]1C2(F)F)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:2|
BDBM372846 COC(=O)[C@@]12SC(N)=N[C@@](C)([C@@H]1C2(F)F)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |c:7|
BDBM372847 CC(C)(O)[C@@]12SC(N)=N[C@@](C)([C@@H]1C2(F)F)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |c:7|
BDBM372848 COC[C@@]12SC(N)=N[C@@](C)([C@@H]1C2(F)F)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |c:6|
BDBM372849 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCC(F)(F)C1)c1cc(\C=C(/F)c2ccc(cn2)C#N)cnc1F |t:2|
BDBM372850 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCC(F)(F)CC1)c1cc(\C=C(/F)c2ccc(cn2)C#N)cnc1F |t:2|
BDBM372939 Cc1cnc(o1)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,t:13|
BDBM372940 Cc1cnc(o1)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |r,t:13|
BDBM372941 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOCC1)c1cc(\C=C(/F)c2cnc(cn2)N2CCOC2=O)ccc1F |r,t:2|
BDBM372942 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOCC1)c1cc(\C=C(\F)c2ccc(cn2)C#N)ccc1F |t:2|
BDBM372943 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOCC1)c1cc(\C=C(/F)c2ccc(cn2)C#C)ccc1F |t:2|
BDBM372944 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOCC1)c1cc(\C=C(/F)c2cnc(cn2)C#C[Si](C)(C)C)ccc1F |t:2|
BDBM372752 CC(Oc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)S[C@]2(C[C@@H]12)C(=O)N(C)C)c1ncco1 |t:23|
BDBM372753 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(Br)cn2)ccc1F |t:11|
BDBM372754 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC#N)cn2)ccc1F |t:11|
BDBM372755 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(cn2)C#CC2CC2)ccc1F |t:11|
BDBM372756 Cc1cc(cnc1\C(F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOCC1)C#N |t:21|
BDBM372851 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(Cl)cn2)ccc1F |t:9|
BDBM372852 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |t:9|
BDBM372853 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC#CC)cn2)ccc1F |r,t:9|
BDBM372854 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(O[C@@H](C)C#C)cn2)ccc1F |r,t:9|
BDBM372855 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OC[C@H](C)OC)cn2)ccc1F |r,t:9|
BDBM372856 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC(F)F)cn2)ccc1F |r,t:9|
BDBM372945 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOCC1)c1cc(\C=C(/F)c2cnc(cn2)C#C)ccc1F |t:2|
BDBM372946 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOCC1)c1cc(\C=C(/F)c2cnc(cn2)N2CCC2)ccc1F |t:2|
BDBM372947 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(Cl)cn2)ccc1F |t:10|
BDBM372948 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOCC1)c1cc(\C=C(/F)c2ccc(cn2)C#C[Si](C)(C)C)ccc1F |t:2|
BDBM372949 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOCC1)c1cc(\C=C(/F)c2cnc(cn2)C#CC2CC2)ccc1F |t:2|
BDBM372757 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC(F)(F)C(F)F)cn2)ccc1F |t:10|
BDBM372759 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCc3ncco3)cn2)ccc1F |t:10|
BDBM372760 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(Br)cn2)ccc1F |t:10|
BDBM372761 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(cn2)C#CC)ccc1F |t:10|
BDBM372762 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(cn2)C#CC2CC2)ccc1F |t:10|
BDBM372763 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(cn2)C#C[Si](C)(C)C)ccc1F |t:10|
BDBM372857 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC(F)(F)F)cn2)ccc1F |r,t:9|
BDBM372859 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCCC(F)(F)F)cn2)ccc1F |r,t:9|
BDBM372862 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCCF)cn2)ccc1F |r,t:9|
BDBM372863 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC3CC3)cn2)ccc1F |r,t:9|
BDBM372864 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC3CCC3)cn2)ccc1F |r,t:9|
BDBM372865 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC3COC3)cn2)ccc1F |r,t:9|
BDBM372866 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC3CCO3)cn2)ccc1F |r,t:9|
BDBM372950 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(Br)cn2)ccc1F |t:10|
BDBM372951 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(\F)c2ccc(Br)cn2)ccc1F |t:10|
BDBM372952 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCOCC1)c1cc(\C=C(/F)c2ccc(cn2)C#CC2CC2)ccc1F |t:2|
BDBM372953 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#CC2CC2)ccc1F |t:10|
BDBM372954 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#CC(C)(C)C)ccc1F |t:10|
BDBM372955 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cn2)C#CC2(C)COC2)ccc1F |t:10|
BDBM372764 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(cn2)C#C)ccc1F |t:10|
BDBM372765 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cc2)C#N)ccc1F |t:11|
BDBM372766 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(cn2)C#N)ccc1F |t:11|
BDBM372767 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ncc(cn2)C#N)ccc1F |t:11|
BDBM372768 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(nc2)C#N)ccc1F |t:11|
BDBM372769 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(cc2F)C#N)ccc1F |t:11|
BDBM372867 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC(C)C)cn2)ccc1F |r,t:9|
BDBM372868 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCc3cc(C)on3)cn2)ccc1F |r,t:9|
BDBM372869 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCc3cc(C)no3)cn2)ccc1F |r,t:9|
BDBM372870 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OC(C)C(F)(F)F)cn2)ccc1F |r,t:9|
BDBM372871 COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC3CC(F)(F)C3)cn2)ccc1F |r,t:9|
BDBM372872 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1[C@H]2COC[C@@H]1COC2)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |t:2,THB:9:11:17.18.19:13.14.15|
BDBM372956 CCCC#Cc1ccc(nc1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)S[C@]2(C[C@@H]12)C(=O)NC |t:25|
BDBM372957 CNC(=O)[C@@]12C[C@@H]1[C@@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ncc(cn2)C#CCO)ccc1F |t:10|
BDBM372958 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(cn2)C#CCF)ccc1F |t:10|
BDBM372959 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(OC(F)(F)F)cn2)ccc1F |t:10|
BDBM50259973 C[C@]1(CCSC(N)=N1)c1cc(CNC2(CC2)C(F)(F)F)c(F)cc1F |r,c:6|
BDBM50259974 C[C@]1(CCSC(N)=N1)c1cc(CNC23CC(C2)C3)c(F)cc1F |r,c:6|
BDBM372770 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(nc2)C#N)ccc1F |t:11|
BDBM372771 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(nn2)C#N)ccc1F |t:11|
BDBM372772 CNC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:10|
BDBM372773 COC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(Cl)cn2)cnc1F |t:10|
BDBM372774 COC(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(\F)c2ccc(Cl)cn2)cnc1F |t:10|
BDBM372775 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2ccc(Cl)cn2)cnc1F |t:11|
BDBM372873 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CC[C@H](F)C1)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)cnc1F |t:2|
BDBM372874 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)NCC(F)F)c1cc(\C=C(/F)c2ccc(cn2)C#N)cnc1F |t:2|
BDBM372875 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC(F)(F)F)cn2)cnc1F |t:11|
BDBM372876 C[C@@H]1COCCN1C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)cnc1F |t:16|
BDBM372877 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1[C@H]2COC[C@@H]1COC2)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)cnc1F |t:2,THB:9:11:17.18.19:13.14.15|
BDBM372905 C[C@@]1(N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCO[C@H]2C[C@@H]12)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,t:2|
BDBM50259971 C[C@]1(CCSC(N)=N1)c1cc(CNCC2CC2)c(F)cc1F |r,c:6|
BDBM50259975 CO[C@@H]1CCN(Cc2cc(c(F)cc2F)[C@]2(C)CCSC(N)=N2)C1 |r,c:22|
BDBM50259976 Cc1ccc(NCc2cc(c(F)cc2F)[C@]2(C)CCSC(N)=N2)nc1 |r,c:22|
BDBM50259960 C[C@]1(CCSC(N)=N1)c1cc(CNC2(CC2)C#N)c(F)cc1F |r,c:6|
BDBM50259966 COCCNCc1cc(c(F)cc1F)[C@]1(C)CCSC(N)=N1 |r,c:21|
BDBM379557 Cc1ccc(Cl)cc1N1CCN(CC1)C(=O)CCC1(NC(=O)NC1=O)C1CC1
BDBM50273443 C[C@]1(CO[C@@](C)(C(N)=N1)C(F)(F)F)c1cccc(NC(=O)c2ccc(Br)cn2)c1 |r,c:7|
BDBM400979 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]12CN(C[C@H]1CSC(N)=N2)c1ncc(F)cn1 |r,c:29|
BDBM408717 COCc1nn(Cc2ccc(Cn3ccccc3=O)cc2)cc1C(=O)NCc1nccc(OC)c1F
BDBM50283681 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](C)OC(=O)[C@H](Cc1ccccc1)N(C)C)C(=O)N[C@@H](C)C(=O)N(C)[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)OC |r|
BDBM50283682 CC[C@H](C)[C@@H](O)C(=O)N[C@@H](CC(C)C)C(=O)N(C)[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N(C)[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)OC |r|
BDBM50283683 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](C)O)C(=O)N[C@@H](C)C(=O)N(C)[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)OC |r|
BDBM50283685 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(=O)[C@H](C)O)[C@@H](C)CC)C(=O)NCC(=O)N(C)[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|
BDBM50283686 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](C)O)C(=O)NCC(=O)N(C)[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)OC |r|
BDBM50283684 CC(C)C[C@H](NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(=O)[C@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N(C)[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|
BDBM50461470 Nc1nc2cc(ccc2c(=O)n1CC1CCCO1)-c1ccc(CCCc2ccccc2)cc1
BDBM50461471 Nc1nc2cc(cc(CC(O)=O)c2c(=O)n1CC1CCCO1)-c1ccccc1
BDBM50461472 CCCCCc1ccc(cc1)-c1cc(-c2ccc(cc2)C(O)=O)c2c(c1)nc(N)n(CC1CCCO1)c2=O
BDBM50461473 CCCCCc1ccc(cc1)-c1cc(CCC(O)=O)c2c(c1)nc(N)n(CC1CCCO1)c2=O
BDBM50461474 CCCCCCCCc1ccc(cc1)-c1ccc2c(c1)nc(N)n(CC1CCCO1)c2=O
BDBM50461475 Nc1nc2cc(cc(CC(O)=O)c2c(=O)n1C[C@@H]1CC[C@@H](O1)c1ccccc1)-c1ccccc1 |r|
BDBM50461476 Nc1nc2cc(cc(-c3ccncc3)c2c(=O)n1CC1CCCO1)-c1ccccc1
BDBM50461477 Nc1cccc(c1)-c1cc(cc2nc(N)n(CC3CCCO3)c(=O)c12)-c1ccccc1
BDBM50461478 NC(=O)c1ccc(cc1)-c1cc(cc2nc(N)n(CC3CCCO3)c(=O)c12)-c1ccccc1
BDBM50461479 Nc1nc2cc(cc(-c3cccc(c3)C(O)=O)c2c(=O)n1CC1CCCO1)-c1ccccc1
BDBM50461480 Nc1nc2cc(cc(-c3ccc(cc3)C(O)=O)c2c(=O)n1CC1CCCO1)-c1ccccc1
BDBM50461481 CCCCCCCCc1cc(CCC(O)=O)c2c(c1)nc(N)n(CC1CCCO1)c2=O
BDBM50461482 CCCCCCCCc1ccc(cc1)-c1ccc2c(c1)nc(N)n(C[C@@H]1CC[C@@H](O1)c1ccccc1)c2=O |r|
BDBM50461483 Nc1nc2cc(cc(-c3ccc(cc3)C(O)=O)c2c(=O)n1C[C@@H]1CC[C@@H](O1)c1ccccc1)-c1ccccc1 |r|
BDBM50461484 Nc1nc2cc(ccc2c(=O)n1CC1CCCO1)-c1ccc(CCCc2ccccc2)cc1-c1ccc(cc1)C(O)=O
BDBM50461485 Nc1nc2cc(cc(CCC(O)=O)c2c(=O)n1CC1CCCO1)-c1ccc(CCCc2ccccc2)cc1
BDBM50461487 CCCCCc1ccc(cc1)-c1ccc2c(c1)nc(N)n(CC1CCCO1)c2=O
BDBM50452882 [H][C@]12CSC(N)=N[C@]1(CO[C@@H](C)C2)c1ccccc1 |r,c:5|
BDBM50452883 [H][C@]12CSC(N)=N[C@]1(CO[C@@H](C)C2)c1ncc(s1)C(=O)Nc1cccc(OC)c1 |r,c:5|
BDBM50462002 CC(F)(F)[C@H]1OC(N)=N[C@@](C)([C@H]1F)c1cc(NC(=O)c2cnc(OCF)cn2)ccc1F |r,c:7|
BDBM50462004 [H][C@@]1(OC(N)=N[C@@](C)([C@H]1F)c1cc(NC(=O)c2cnc(OCF)cn2)ccc1F)[C@@H](C)F |r,c:4|
BDBM50462008 C[C@@]1(N=C(N)O[C@@H]([C@@H]1F)C1(F)CC1)c1cc(NC(=O)c2cnc(OCF)cn2)ccc1F |r,t:2|
BDBM50461486 Nc1nc2cc(cc(-c3cccnc3)c2c(=O)n1CC1CCCO1)-c1ccccc1
BDBM50452873 [H][C@]12CSC(N)=N[C@]1(CO[C@@H](C)C2)c1ccccc1C(F)(F)F |r,c:5|
BDBM50452874 CO[C@H]1CC[C@]2(Cc3ccc(cc3[C@@]22N=C(C)C(N)=N2)-c2cncc(c2)C#CC)CC1 |r,wU:13.15,5.4,wD:2.1,c:20,t:16,(42.8,-16.77,;41.71,-15.68,;40.22,-16.08,;39.13,-14.99,;37.64,-15.39,;37.25,-16.87,;37.1,-18.41,;35.59,-18.75,;34.81,-20.09,;33.28,-20.09,;32.51,-18.75,;33.27,-17.42,;34.81,-17.41,;35.84,-16.25,;34.46,-15.55,;34.7,-14.03,;33.6,-12.94,;36.22,-13.78,;36.92,-12.4,;36.93,-15.15,;30.97,-18.75,;30.21,-17.42,;28.66,-17.43,;27.9,-18.76,;28.67,-20.08,;30.21,-20.08,;27.9,-21.41,;27.12,-22.74,;26.34,-24.06,;38.34,-17.96,;39.82,-17.56,)|
BDBM50452875 [H][C@]12CSC(N)=N[C@]1(CO[C@@H](C)C2)c1ncc(s1)C(=O)Nc1cccc(OC)n1 |r,c:5|
BDBM50452876 [H][C@]12CSC(N)=N[C@]1(CO[C@@H](C)C2)c1ccsc1 |r,c:5|
BDBM50452877 [H][C@@]12CCC[C@@]1(N=C(N)SC2)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |r,t:7|
BDBM50452878 [H][C@]12CSC(N)=N[C@]1(CO[C@@H](C)C2)c1nccs1 |r,c:5|
BDBM50452880 [H][C@]12CSC(N)=N[C@]1(CO[C@@H](C)C2)c1cccs1 |r,c:5|
BDBM50452881 [H][C@]12CSC(N)=N[C@]1(CO[C@@H](C)C2)c1ccccc1OC |r,c:5|
BDBM50452884 [H][C@]12CSC(N)=N[C@]1(CO[C@@H](C)C2)c1nc(NC(=O)c2ccc(OC)cc2)cs1 |r,c:5|
BDBM50452885 [H][C@]12CSC(N)=N[C@]1(CO[C@@H](C)C2)c1ncccc1F |r,c:5|
BDBM50457586 C[C@]1(C=C(CF)OC(N)=N1)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1F |r,c:8,t:2|
BDBM50361186 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](OC(=O)[C@@H](O)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N(C)[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)OC |r|
BDBM50361187 CC[C@H](C)[C@H](NC(=O)[C@H](OC(=O)[C@@H](O)C(C)C)[C@@H](C)CC)C(=O)NCC(=O)N(C)[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)OC |r|
BDBM50361188 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](OC(=O)[C@@H](O)C(C)C)C(C)C)C(=O)N[C@@H](C)C(=O)N(C)[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)OC |r|
BDBM50488934 [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4CC(=O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CC[C@@H](CC)C(C)C |t:9|
BDBM420298 COc1cccc2[nH]c(cc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C[C@@H]1CCNC1=O)C(=O)CO
BDBM50536834 FCC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1 |r|
BDBM50536838 FCC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccc2ccccc12 |r|
BDBM50536839 C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF |r|
BDBM50507791 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)C(=O)NCCC(F)(F)F |r|
BDBM50507792 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)NCCCO)N1CCCCC1 |r|
BDBM50507796 CCCN(CCC)C(=O)c1cccc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccc(OC)c1 |r|
BDBM50507797 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N(CCC)CCC)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccc(OC)c1 |r|
BDBM50507798 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)N(CCO)CCO)N1CCCCC1 |r|
BDBM50507799 COCCN(CCOC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccc(OC)c1)N1CCCCC1 |r|
BDBM50507800 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)NCCC(F)(F)F)N1CCCCC1 |r|
BDBM50507801 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)NCC(C)(C)O)N1CCCCC1 |r|
BDBM50507805 CCCN(CCC)C(=O)c1cc(Cl)cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccc(OC)c1 |r|
BDBM50507808 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)N(CCC(F)(F)F)CCC(F)(F)F)N1CCCCC1 |r|
BDBM50507809 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)N(CC(C)C)CC(C)C)N1CCCCC1 |r|
BDBM50507811 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)NCCO)N1CCCCC1 |r|
BDBM50507813 CCCN(CCC)C(=O)c1cc(cc(c1)C(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccc(OC)c1 |r|
BDBM50507815 CCCN(CCC)C(=O)c1cc(F)cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccc(OC)c1 |r|
BDBM50506509 CC(C)[C@@H]1NC(=O)C[C@H](O)[C@H](CS)NC(=O)CCCCCCCCCCCNC1=O |r|
BDBM50506515 CC(C)[C@@H]1NC(=O)C[C@H](O)[C@H](Cc2ccccc2)NC(=O)CCCCCCCCCCNC1=O |r|
BDBM50506519 CC(C)[C@@H]1NC(=O)C[C@H](O)[C@H](CSCc2ccccc2)NC(=O)CCCCCCCCCCCNC1=O |r|
BDBM50506520 CC(C)[C@@H]1NC(=O)C[C@H](O)[C@H](Cc2ccc(O)cc2)NC(=O)CCCCCCCCCCCNC1=O |r|
BDBM50506521 O[C@H]1CC(=O)N[C@@H](Cc2cccnc2)C(=O)NCCCCCCCCCCCC(=O)N[C@H]1Cc1ccccc1 |r|
BDBM50506523 CC(=O)NCCCC[C@@H]1NC(=O)C[C@H](O)[C@H](Cc2ccccc2)NC(=O)CCCCCCCCCCCNC1=O |r|
BDBM50506524 O[C@H]1CC(=O)N[C@@H](c2ccccc2)C(=O)NCCCCCCCCCCCC(=O)N[C@H]1Cc1ccccc1 |r|
BDBM50506525 [H][C@]1(NC(=O)C[C@H](O)[C@H](Cc2ccccc2)NC(=O)CCCCCCCCCCCNC1=O)[C@@H](C)O |r|
BDBM50506527 CC(C)[C@@H]1NC(=O)C[C@H](O)[C@H](Cc2ccccc2)NC(=O)CCOCCOCCOCCNC1=O |r|
BDBM50506528 CC(C)[C@@H]1NC(=O)C[C@H](O)[C@H](Cc2cscn2)NC(=O)CCCCCCCCCCCNC1=O |r|
BDBM50506529 O[C@H]1CC(=O)N[C@@H](Cc2ccccc2)C(=O)NCCCCCCCCCCCC(=O)N[C@H]1Cc1ccccc1 |r|
BDBM50506531 CC(C)[C@@H]1NC(=O)CC[C@H](Cc2ccccc2)NC(=O)CCCCCCCCCCCNC1=O |r|
BDBM50510765 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |r,c:3|
BDBM50513857 CCCCCCc1ccc(cc1)S(=O)(=O)C1C2CCC(N2)C1NCc1ccc2ccccc2c1 |TLB:22:21:20:18.17,THB:12:15:20:18.17|
BDBM50506540 CC(C)[C@@H]1NC(=O)C[C@H](O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CCCCCCCCCCCNC1=O |r|
BDBM50506541 CC(C)[C@@H]1NC(=O)C[C@H](O)[C@H](Cc2ccc3ccccc3c2)NC(=O)CCCCCCCCCCCNC1=O |r|
BDBM50510780 [H][C@@]12CC[C@@](C)(C(N)=N[C@]1(C)c1cc(NC(=O)c3ncc(Cl)cc3C)ccc1F)S2(=O)=O |r,c:7|
BDBM50510974 [H][C@@]12C[C@]1(COC)SC(N)=N[C@]2(C)c1cc(NC(=O)c2ccc(Cl)cn2)cc(F)c1F |r,c:10|
BDBM50510982 [H][C@@]12C[C@@]1(SC(N)=N[C@]2(C)c1cc(NC(=O)c2ccc(Cl)cn2)cc(F)c1F)C(=O)N(C)C |r,c:7|
BDBM50514485 CCCCCc1ccc(cc1)C(=O)N(Cc1ccc(cc1)-c1ccc(OC)cc1)C1CCN(CCC(C)C)CC1
BDBM50514491 CCCCCc1ccc(cc1)S(=O)(=O)C1C(NCc2ccc3ccccc3c2)C2CC(CNC3CCCC3)C1N2
BDBM50514497 O=C(Cc1ccccc1)N(Cc1ccccc1)C1CNCC1N(Cc1ccccc1)C(=O)Cc1ccccc1
BDBM50514502 CCCCCc1ccc(cc1)C(=O)N(Cc1ccc(cc1)-c1ccc(CC(=O)OC)cc1)C1CCN(Cc2ncc[nH]2)CC1
BDBM50506510 [H][C@]1(NC(=O)C[C@H](O)[C@H](Cc2ccccc2)NC(=O)CCCCCCCCCCCNC1=O)[C@@H](C)OCc1ccccc1 |r|
BDBM50506511 CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C)[C@@H](O)CC(=O)N[C@@H](C)C(O)=O |r|
BDBM50506513 C[C@@H]1NC(=O)C[C@H](O)[C@H](Cc2ccccc2)NC(=O)CCCCCCCCCCCNC1=O |r|
BDBM50506514 CC(C)[C@@H]1NC(=O)C[C@H](O)[C@H](Cc2ccccc2)NC(=O)CCCCCCCCCCCNC1=O |r|
BDBM50506516 CC(C)[C@@H]1NC(=O)C[C@H](O)[C@H](Cc2ccc(F)c(F)c2)NC(=O)CCCCCCCCCCCNC1=O |r|
BDBM50506517 CC(C)[C@@H]1NC(=O)C[C@H](O)[C@H](Cc2ccc(Cl)c(Cl)c2)NC(=O)CCCCCCCCCCCNC1=O |r|
BDBM50506518 CC(C)[C@@H]1NC(=O)C[C@H](O)[C@H](Cc2ccc(F)cc2)NC(=O)CCCCCCCCCCCNC1=O |r|
BDBM50506522 [H][C@]1(NC(=O)C[C@H](O)[C@H](Cc2ccccc2)NC(=O)CCCCCCCCCCCNC1=O)[C@H](C)CC |r|
BDBM50506526 CC(C)[C@@H]1NC(=O)NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)CCCCCCCCCCCNC1=O |r|
BDBM50506530 CC(C)[C@@H]1NC(=O)C[C@H](O)[C@H](Cc2ccccc2)NC(=O)OCCCCCCCCCCCNC1=O |r|
BDBM50506532 O[C@H]1CC(=O)N[C@@H](C2CCCCC2)C(=O)NCCCCCCCCCCCC(=O)N[C@H]1Cc1ccccc1 |r|
BDBM50506533 CC(C)C[C@@H]1NC(=O)CCCCCCCCCCCNC(=O)[C@H](C)NC(=O)C[C@@H]1O |r|
BDBM50506534 CC(C)[C@@H]1NC(=O)C[C@H](O)[C@H](Cc2ccc(OCc3ccccc3)cc2)NC(=O)CCCCCCCCCCCNC1=O |r|
BDBM50506535 CC(C)[C@@H]1NC(=O)C[C@H](O)[C@H](Cc2ccccc2)NC(=O)CCCCCCCCCCCCNC1=O |r|
BDBM50506536 CC(C)C[C@H](NC(=O)CC(C)C)[C@@H](O)CC(=O)N[C@@H](C)C(O)=O |r|
BDBM50506537 CC(C)C[C@@H]1NC(=O)CCCCCCCCCCCNC(=O)[C@@H](NC(=O)C[C@@H]1O)C(C)C |r|
BDBM50506538 CC(C)[C@@H]1NC(=O)C[C@H](O)[C@H](Cc2ccccc2)NC(=O)CCCCCCCCCCCCCCNC1=O |r|
BDBM50506539 CC(C)[C@@H]1NC(=O)C[C@H](O)[C@H](CC2CCCCC2)NC(=O)CCCCCCCCCCCNC1=O |r|
BDBM50514484 C(CSc1nc2ccccc2s1)Oc1ccc(OC2C3CCC(N3)C2OCc2ccc3ccccc3c2)cc1
BDBM50514490 NC(=N)c1ccc(NC(=O)Nc2ccc(Oc3ccccc3)cc2)cc1
BDBM50514495 CCCCCc1ccc(cc1)C(=O)N(Cc1ccc(cc1)-c1ccc(OC)c(OC)c1)C1CCN(CCC(C)C)CC1
BDBM50514496 Clc1ccc2sc(SCCCc3ccc(OC4C5CCC(N5)C4OCc4ccc5ccccc5c4)cc3)nc2c1
BDBM50514498 Nc1ccc(cc1)C(=O)CCC1CNCC=C(COC(=O)c2ccc3ccccc3c2)C1 |t:16|
BDBM50514501 CCCCCc1ccc(cc1)N(C[C@@H]1CCC(=O)C(F)(F)C1)C(=O)Cc1ccc2ccccc2c1 |r|
BDBM50507788 CCN(CC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccc(OC)c1)N1CCCCC1 |r|
BDBM50507790 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)NCCOC(C)(C)C)N1CCCCC1 |r|
BDBM50507793 CCCN(CCC)C(=O)c1cc(C)cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccc(OC)c1 |r|
BDBM50507795 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)NCC1CC1)N1CCCCC1 |r|
BDBM50507806 CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccc(OC)c1)C#N |r|
BDBM50507807 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)N(C)C)N1CCCCC1 |r|
BDBM50507810 COCCNC(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC(C)(C)c1cccc(OC)c1)N1CCCCC1 |r|
BDBM50510978 [H][C@@]12C[C@]1(CF)SC(N)=N[C@]2(C)c1cc(NC(=O)c2ccc(Cl)cn2)cc(F)c1F |r,c:9|
BDBM50507812 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)NCc1ccccc1)N1CCCCC1 |r|
BDBM50507814 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)C(=O)NCC(C)(C)C |r|
BDBM50510772 [H][C@@]12CCOc3ccc(NC(=O)c4ncc(Cl)cc4C)cc3[C@@]1(C)N=C(N)C(C)(C)S2(=O)=O |r,t:27|
BDBM50510783 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |r,c:4|
BDBM50510976 [H][C@@]12C[C@]1(COC)SC(N)=N[C@]2(C)c1cc(NC(=O)c2cnc(OCC#C)cn2)cc(F)c1F |r,c:10|
BDBM50510983 [H][C@@]12C[C@@]1(SC(N)=N[C@]2(C)c1cc(NC(=O)c2ccc(Cl)cn2)cc(F)c1F)C(=O)NC |r,c:7|
BDBM50507789 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)NCC(C)(C)OC)N1CCCCC1 |r|
BDBM50507794 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)NCC(C)(C)C)N1CCCCC1 |r|
BDBM50507802 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)NCCN(C)C)N1CCCCC1 |r|
BDBM50507803 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)NC(C)(C)CO)N1CCCCC1 |r|
BDBM50507804 COc1cccc(c1)C(C)(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)NCC1CCCCC1)N1CCCCC1 |r|
BDBM50506512 CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C)[C@@H](O)CC(O)=O |r|
BDBM50510977 [H][C@@]12C[C@@]1(SC(N)=N[C@]2(C)c1cc(NC(=O)c2cnc(OCC#C)cn2)cc(F)c1F)C(F)F |r,c:7|
BDBM50510981 [H][C@@]12C[C@@]1(SC(N)=N[C@]2(C)c1cc(NC(=O)c2ccc(Cl)cn2)cc(F)c1F)C(N)=O |r,c:7|
BDBM50510991 NC1=N[C@@]2(CO1)c1cc(ccc1Oc1c(F)nc(cc21)C1=CCCOC1)-c1cccnc1F |r,t:1,24|
BDBM50510992 [H][C@@]12C[C@@]1(SC(N)=N[C@]2(C)c1cc(NC(=O)c2ccc(Cl)cn2)cc(F)c1F)C#N |r,c:7|
BDBM50510979 [H][C@@]12C[C@]1(CO)SC(N)=N[C@]2(C)c1cc(NC(=O)c2ccc(Cl)cn2)cc(F)c1F |r,c:9|
BDBM50506507 CC(C)C[C@H](NC(=O)CC(C)C)[C@@H](O)CC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(O)=O |r|
BDBM50506508 CC(C)[C@@H]1NC(=O)C[C@H](O)[C@H](Cc2ccccc2)NC(=O)CCCCCCCCCCCCCNC1=O |r|
BDBM50510980 [H][C@@]12C[C@@]1(SC(N)=N[C@]2(C)c1cc(NC(=O)c2ccc(Cl)cn2)cc(F)c1F)C(F)F |r,c:7|
BDBM477911 C[C@@]1(N=C(N)S[C@@]2(CF)C[C@@H]12)c1cc(cnc1F)C#Cc1ccc(cn1)C#N |r,t:2|
BDBM477898 NC1=N[C@@](CF)([C@@H]2C[C@]2(CF)S1)c1cc(ccc1F)C#Cc1ccc(cn1)C#N |r,t:1|
BDBM477908 NC1=N[C@@](CF)([C@@H]2C[C@@]2(S1)\C=C\C(=O)N1CCOCC1)c1cc(ccc1F)C#Cc1ccc(cn1)C#N |r,t:1|
BDBM477925 Cc1cc(cnc1C#Cc1ccc(F)c(c1)[C@@]1(C)N=C(N)S[C@]2(C[C@@H]12)C(=O)N1CCCC1)C#N |r,t:20|
BDBM477929 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(ccc1F)C#CC1CC1 |r,t:11|
BDBM477904 NC1=N[C@@](CF)([C@@H]2C[C@@]2(S1)\C=C\C#N)c1cc(ccc1F)C#Cc1ccc(cn1)C#N |r,t:1|
BDBM477920 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(ccc1F)C#Cc1ncc(cc1C)C#N |r,t:11|
BDBM477923 Cc1cc(cnc1C#Cc1ccc(F)c(c1)[C@@]1(C)N=C(N)S[C@]2(C[C@@H]12)C#N)C#N |r,t:20|
BDBM477926 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(ccc1F)C#Cc1ccc(cc1)C#N |r,t:11|
BDBM477927 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(ccc1F)C#Cc1ccc(OCC#C)cn1 |r,t:11|
BDBM477928 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(ccc1F)C#Cc1ncc(OCc2ncco2)cc1C |r,t:11|
BDBM477930 COC[C@]12CC1[C@](C)(N=C(N)S2)c1cc(ccc1F)C#Cc1ccc(cn1)C#N |r,t:9|
BDBM477931 COC[C@]12CC1[C@](C)(N=C(N)S2)c1cc(ccc1F)C#Cc1ncc(Cl)cc1C |r,t:9|
BDBM477932 COC[C@]12CC1[C@](C)(N=C(N)S2)c1cc(ccc1F)C#Cc1ncc(cc1C)C#N |r,t:9|
BDBM477933 Cc1cc(cnc1C#Cc1cnc(F)c(c1)[C@@]1(C)N=C(N)S[C@]2(CC12)C(=O)N1CCOCC1)C#N |r,t:20|
BDBM477934 Cc1cc(cnc1C#Cc1cnc(F)c(c1)[C@@]1(C)N=C(N)S[C@]2(CC12)C(=O)N1CCCC1)C#N |r,t:20|
BDBM477912 Cc1cn(C[C@]23C[C@H]2[C@](CF)(N=C(N)S3)c2cc(ccc2F)C#Cc2ccc(cn2)C#N)nn1 |r,t:12|
BDBM477935 NC1=N[C@@](CF)([C@@H]2C[C@]2(CF)S1)c1cc(ccc1F)C#Cc1cc(Cl)ccn1 |r,t:1|
BDBM477936 CN(C)C(=O)[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(ccc1F)C#C |r,t:11|
BDBM50540165 [H][C@]1(C[C@H]1C(=O)NCC)[C@]12COC[C@@]1([H])CSC(N)=N2 |r,c:20|
BDBM50540166 [H][C@]1(C[C@H]1C(=O)NCCC)[C@]12COC[C@@]1([H])CSC(N)=N2 |r,c:21|
BDBM50540167 [H][C@]1(C[C@H]1C(=O)NCCCC)[C@]12COC[C@@]1([H])CSC(N)=N2 |r,c:22|
BDBM50540168 [H][C@]1(C[C@H]1C(=O)NC[C@@H]1C[C@H]1C)[C@]12COC[C@@]1([H])CSC(N)=N2 |r,c:24|
BDBM50540163 [H][C@@]1(C[C@@H]1NC(=O)c1ccc(F)cn1)[C@]12COC[C@@]1([H])CSC(N)=N2 |r,c:26|
BDBM50540164 [H][C@]1(C[C@H]1C(=O)Nc1ccc(F)cn1)[C@]12COC[C@@]1([H])CSC(N)=N2 |r,c:26|
BDBM50540169 [H][C@]1(C[C@H]1NC(=O)CCCC)[C@]12COC[C@@]1([H])CSC(N)=N2 |r,c:22|
BDBM50540170 [H][C@]1(C[C@H]1C(=O)NCCCC)[C@]12CN(C[C@@]1([H])CSC(N)=N2)c1ncccn1 |r,c:22|
BDBM50540171 [H][C@]1(C[C@H]1C(=O)NC[C@@H]1C[C@H]1C)[C@]12CN(C[C@@]1([H])CSC(N)=N2)c1ncccn1 |r,c:24|
BDBM50540172 [H][C@]1(C[C@H]1C(C)(C)OC[C@@H]1C[C@H]1C)[C@]12CN(C[C@@]1([H])CSC(N)=N2)c1ncccn1 |r,c:25|
BDBM477913 Cc1cc(cnc1C#Cc1ccc(F)c(c1)[C@@]1(CF)N=C(N)S[C@]2(C[C@@H]12)\C=C\C(=O)N1CCOCC1)C#N |r,t:21|
BDBM477914 NC1=N[C@@](CF)([C@@H]2C[C@@]2(S1)\C=C\C(=O)N1CCOCC1)c1cc(ccc1F)C#Cc1ncc(Cl)cn1 |r,t:1|
BDBM477915 Cc1cc(sn1)C#Cc1ccc(F)c(c1)[C@@]1(CF)N=C(N)S[C@]2(C[C@@H]12)\C=C\C(=O)N1CCOCC1 |r,t:20|
BDBM477916 NC1=N[C@@](CF)([C@@H]2C[C@]2(CCC(=O)N2CCOCC2)S1)c1cc(ccc1F)C#Cc1ccc(cn1)C#N |r,t:1|
BDBM477917 Cc1cc(cnc1C#Cc1ccc(F)c(c1)[C@@]1(CF)N=C(N)S[C@@]2(CCC(=O)N3CCOCC3)C[C@@H]12)C#N |r,t:21|
BDBM477918 NC1=N[C@@](CF)([C@@H]2C[C@@]2(S1)\C=C\C(=O)N1CCOCC1)c1cc(ccc1F)C#Cc1ncc(cn1)C#N |r,t:1|
BDBM477919 NC1=N[C@@](CF)([C@@H]2C[C@@]2(S1)\C=C\C(=O)N1CCOCC1)c1cc(ccc1F)C#Cc1ccc(cc1)C#N |r,t:1|
BDBM477921 NC1=N[C@@](CF)([C@@H]2C[C@@]2(S1)\C=C\C(=O)N1CCOCC1)c1cc(ccc1F)C#Cc1ncc(cc1F)C#N |r,t:1|
BDBM477924 CN(C)C(=O)[C@]12C[C@H]1[C@](CF)(N=C(N)S2)c1cc(ccc1F)C#Cc1ncc(cc1C)C#N |r,t:12|
BDBM477922 NC1=N[C@@](CF)([C@@H]2C[C@]2(Cn2ccnc2)S1)c1cc(ccc1F)C#Cc1ccc(cn1)C#N |r,t:1|
BDBM476660 CC#Cc1ccc2sc3ccc(cc3c2c1)[C@]1(C)CC(=O)N(C)C(=N)N1 |r|
BDBM477880 C[C@]1(C=CSC(N)=N1)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |c:2,6|
BDBM477881 C[C@]1(C=CSC(N)=N1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |c:2,6|
BDBM477882 C[C@]1(CCSC(N)=N1)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |c:6|
BDBM477883 C[C@]1(CCSC(N)=N1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |c:6|
BDBM477884 COC(=O)[C@H]1C[C@](C)(N=C(N)S1)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:8|
BDBM477885 COC(=O)[C@@H]1C[C@](C)(N=C(N)S1)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:8|
BDBM477886 COC(=O)[C@]1(C)C[C@](C)(N=C(N)S1)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:9|
BDBM477887 COC(=O)[C@@]1(C)C[C@](C)(N=C(N)S1)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |t:9|
BDBM477888 COC(=O)[C@@]1(C)C[C@](C)(N=C(N)S1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:9|
BDBM477889 COC(=O)[C@]1(C)C[C@](C)(N=C(N)S1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:9|
BDBM477890 C[C@]1(C[C@](C)(N=C(N)S1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F)C(=O)N1CCOCC1 |t:5|
BDBM477891 C[C@@]1(C[C@](C)(N=C(N)S1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F)C(=O)N1CCOCC1 |t:5|
BDBM476688 CC#Cc1ccc2sc3ccc(cc3c2c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(=N)N1 |r|
BDBM476692 CC#Cc1ccc2sc3cc(F)c(cc3c2c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(=N)N1 |r|
BDBM477892 CNC(=O)[C@@]1(C)C[C@](C)(N=C(N)S1)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |t:9|
BDBM477893 CNC(=O)[C@]1(C)C[C@](C)(N=C(N)S1)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |t:9|
BDBM477894 C[C@]1(C[C@](C)(N=C(N)S1)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F)C(=O)N1CCOCC1 |t:5|
BDBM477895 C[C@]1(C[C@](C)(N=C(N)S1)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F)C(=O)NCC(F)F |t:5|
BDBM477896 CNC(=O)[C@]1(C)C[C@](C)(N=C(N)S1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |t:9|
BDBM477897 NC1=N[C@@](CF)([C@@H]2C[C@]2(CO)S1)c1cc(ccc1F)C#Cc1ccc(cn1)C#N |r,t:1|
BDBM476694 CC#Cc1ccc2sc3cc(Cl)c(cc3c2c1)[C@]1(C)CC(=O)N(C)C(=N)N1 |r|
BDBM477899 NC1=N[C@@](CF)([C@@H]2C[C@]2(CF)S1)c1cc(ccc1F)C#Cc1ccc(Cl)cn1 |r,t:1|
BDBM477900 NC1=N[C@@](CF)([C@@H]2C[C@]2(CF)S1)c1cc(ccc1F)C#Cc1cnc(cn1)C#N |r,t:1|
BDBM477901 Cc1cc(cnc1C#Cc1ccc(F)c(c1)[C@@]1(CF)N=C(N)S[C@@]2(CF)C[C@@H]12)C#N |r,t:21|
BDBM477902 CC#CCOc1ccc(nc1)C#Cc1ccc(F)c(c1)[C@@]1(CF)N=C(N)S[C@@]2(CF)C[C@@H]12 |r,t:25|
BDBM477903 NC1=N[C@@](CF)([C@@H]2C[C@]2(CC#N)S1)c1cc(ccc1F)C#Cc1ccc(cn1)C#N |r,t:1|
BDBM477905 NC1=N[C@@](CF)([C@@H]2C[C@]2(CF)S1)c1cc(ccc1F)C#Cc1ccc(OCc2ncco2)cn1 |r,t:1|
BDBM477906 NC1=N[C@@](CF)([C@@H]2C[C@]2(CF)S1)c1cc(ccc1F)C#Cc1ncc(s1)C#N |r,t:1|
BDBM477907 C[C@@]1(N=C(N)S[C@]2(CO)[C@H]1C2(F)F)c1cc(ccc1F)C#Cc1ccc(cn1)C#N |r,t:2|
BDBM477909 CN(C)C(=O)\C=C\[C@]12C[C@H]1[C@](CF)(N=C(N)S2)c1cc(ccc1F)C#Cc1ccc(cn1)C#N |r,t:14|
BDBM477910 NC(=O)C[C@]12C[C@H]1[C@](CF)(N=C(N)S2)c1cc(ccc1F)C#Cc1ccc(cn1)C#N |r,t:11|
BDBM486434 FC(F)[C@@]1(N=C(NC(=O)c2ccccc2)O[C@@H]2C[C@H]12)c1cc(\C=C(/F)c2ccc(Br)cn2)ccc1F |r,t:4|
BDBM486435 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |r,t:1|
BDBM486436 NC1=N[C@@](C(F)F)([C@H]2C[C@H]2O1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,t:1|
BDBM486437 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |r,c:7|
BDBM486438 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,c:7|
BDBM486439 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1cc(\C=C(/F)c2cnc(cn2)C#N)ccc1F |r,c:7|
BDBM486441 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1cc(\C=C(/F)c2cnc(OCC(F)(F)C(F)F)cn2)ccc1F |r,c:7|
BDBM486442 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |r,c:7|
BDBM486443 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1cc(\C=C(/F)c2cnc(Cl)cn2)ccc1F |r,c:7|
BDBM486444 C[C@@]1(N=C(N)OC[C@@H]1OCC(F)(F)F)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,t:2|
BDBM486445 C[C@@]1(N=C(N)OC[C@@H]1OCC(F)(F)F)c1cc(\C=C(/F)c2cnc(Cl)cn2)ccc1F |r,t:2|
BDBM486446 C[C@@]1(N=C(N)OC[C@@H]1OCC(F)(F)F)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |r,t:2|
BDBM486448 C[C@@]1(N=C(N)OC[C@@H]1OCC(F)(F)F)c1cc(\C=C(/F)c2cnc(cn2)C#N)ccc1F |r,t:2|
BDBM486449 CC#CCOc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)OC[C@@H]1OCC(F)(F)F |r,t:25|
BDBM486450 C[C@@]1(N=C(N)OCC1(F)F)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,t:2|
BDBM486451 C[C@@]1(N=C(N)OCC1(F)F)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |r,t:2|
BDBM486452 C[C@@]1(N=C(N)COC1(F)F)c1nc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,t:2|
BDBM486453 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1nc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,c:7|
BDBM501284 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(Cl)cn2)cnc1F |r,c:4|
BDBM501285 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)cc(F)c1F |r,c:4|
BDBM501286 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)cnc1F |r,c:4|
BDBM501288 CC#C[C@H](C)Oc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:34|
BDBM501289 CC#C[C@@H](C)Oc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:34|
BDBM501290 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCc3ccccc3)cn2)cnc1F |r,c:4|
BDBM501304 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCc3cc(C)on3)cn2)cc(F)c1F |r,c:3|
BDBM501247 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCc3ncco3)cn2)cc(F)c1F |r,c:3|
BDBM501248 C[C@H](Oc1cnc(cn1)C(\F)=C\c1cc(F)c(F)c(c1)[C@]1(C)CS(=O)(=O)N(C)C(N)=N1)C#C |r,c:31|
BDBM501249 CC#CCOc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)N(C)C(N)=N1 |r,c:32|
BDBM501251 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(cn2)C#N)ccc1F |r,c:4|
BDBM501253 COC(C)COc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:34|
BDBM501241 C[C@H](Oc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1)C#C |r,c:31|
BDBM501291 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCc3ccncc3)cn2)ccc1F |r,c:4|
BDBM501292 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(Oc3ccccc3)cn2)ccc1F |r,c:4|
BDBM501293 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(cc2)C#N)ccc1F |r,c:3|
BDBM501294 CC1(C)C(N)=N[C@@](C)([C@H](F)S1(=O)=O)c1cc(\C=C(/F)c2cc3OCCOc3cn2)ccc1F |r,c:4|
BDBM501295 CC1(C)C(N)=N[C@@](C)([C@@H](F)S1(=O)=O)c1cc(\C=C(/F)c2cc3OCCOc3cn2)ccc1F |r,c:4|
BDBM501296 CC1(C)C(N)=N[C@](C)(c2cc(\C=C(/F)c3cc4OCCOc4cn3)ccc2F)C(F)(F)S1(=O)=O |r,c:4|
BDBM501297 CCC#C[C@H](C)Oc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:35|
BDBM501305 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCc3nc(C)no3)cn2)cc(F)c1F |r,c:3|
BDBM501306 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCc3cocn3)cn2)cc(F)c1F |r,c:3|
BDBM501307 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cc(F)c(cn2)C#N)ccc1F |r,c:3|
BDBM501308 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCC=C)cn2)cc(F)c1F |r,c:3|
BDBM501309 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCc3ncccn3)cn2)cc(F)c1F |r,c:3|
BDBM501310 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCc3noc(C)n3)cn2)cc(F)c1F |r,c:3|
BDBM501311 COc1cc(ncc1Cl)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)N(C)C(N)=N1 |r,c:30|
BDBM501254 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCc3nnc(C)o3)cn2)ccc1F |r,c:3|
BDBM501255 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(CC3CCC3)cn2)ccc1F |r,c:4|
BDBM501256 Cc1noc(COc2cnc(cn2)C(\F)=C\c2ccc(F)c(c2)[C@]2(C)CS(=O)(=O)C(C)(C)C(N)=N2)n1 |r,c:35|
BDBM501257 Cc1nnc(COc2cnc(cn2)C(\F)=C\c2ccc(F)c(c2)[C@]2(C)CS(=O)(=O)C(C)(C)C(N)=N2)o1 |r,c:35|
BDBM501258 CC[C@@H](Oc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1)C#C |r,c:32|
BDBM501259 CC[C@H](Oc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1)C#C |r,c:32|
BDBM501298 CCC#C[C@@H](C)Oc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:35|
BDBM501299 C[C@H](O)COc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:33|
BDBM501300 C[C@@H](O)COc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:33|
BDBM501301 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCc3cscn3)cn2)cc(F)c1F |r,c:3|
BDBM501302 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCc3cc(C)no3)cn2)cc(F)c1F |r,c:3|
BDBM501303 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cc(=O)c(Cl)c[nH]2)ccc1F |r,c:3|
BDBM501312 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cc(C#N)c(Cl)cn2)ccc1F |r,c:3|
BDBM501313 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cc(F)c(Cl)cn2)ccc1F |r,c:3|
BDBM501314 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCc3nnc(C)o3)cn2)cc(F)c1F |r,c:3|
BDBM501315 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ncc3OCCOc3n2)ccc1F |r,c:3|
BDBM501316 C[C@@H]1COc2nc(ncc2O1)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)N(C)C(N)=N1 |r,c:33|
BDBM501317 C[C@H]1COc2cnc(nc2O1)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)N(C)C(N)=N1 |r,c:33|
BDBM501318 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCc3nc(C)cs3)cn2)cc(F)c1F |r,c:3|
BDBM501260 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCC3COC3)cn2)ccc1F |r,c:3|
BDBM501261 CN1C(N)=N[C@](C)(c2cc(\C=C(/F)c3ccc(cn3)C#N)ccc2F)C(C)(C)S1(=O)=O |r,c:3|
BDBM501262 CN1C(N)=N[C@](C)(c2cc(\C=C(/F)c3cnc(cn3)C#N)ccc2F)C(C)(C)S1(=O)=O |r,c:3|
BDBM501263 CN1C(N)=N[C@](C)(c2cc(\C=C(/F)c3cnc(Cl)cn3)ccc2F)C(C)(C)S1(=O)=O |r,c:3|
BDBM501264 CN1C(N)=N[C@](C)(c2cc(\C=C(/F)c3cnc(OCC#C)cn3)ccc2F)C(C)(C)S1(=O)=O |r,c:3|
BDBM501265 CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)C1=N[C@@](C)(CS(=O)(=O)C1(C)C)c1cc(ccc1F)B1OC(C)(C)C(C)(C)O1 |r,t:15|
BDBM501266 CC#CCOc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)N(C)S(=O)(=O)C1(C)C |r,t:25|
BDBM501319 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCc3nc(C)oc3C)cn2)cc(F)c1F |r,c:3|
BDBM501320 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cc3CCCOc3cn2)ccc1F |r,c:3|
BDBM501321 CN1C(=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(F)cn2)ccc1F)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C |r,c:2|
BDBM501322 COc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)N(C)C(N)=N1 |r,c:29|
BDBM501323 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ncc(cc2Cl)C(F)(F)F)ccc1F |r,c:3|
BDBM501324 CCOC(=O)COc1cnc(cn1)C(\F)=C\c1cc(F)c(F)c(c1)[C@]1(C)CS(=O)(=O)N(C)C(N)=N1 |r,c:35|
BDBM501325 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(cn2)C(F)(F)F)ccc1F |r,c:3|
BDBM501181 C[C@]1(CS(=O)(=O)C2(CCC2)C(N)=N1)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |r,c:12|
BDBM501182 C[C@@]1(N=C(N)[C@]2(CF)CC[C@@H]1S2(=O)=O)c1cc(\C=C(/F)c2ccc(Br)cn2)ccc1F |r,t:2|
BDBM501183 C[C@@]1(N=C(N)[C@]2(CF)CC[C@@H]1S2(=O)=O)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,t:2|
BDBM501184 C[C@]1(CS(=O)(=O)C2(CCC2)C(N)=N1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,c:12|
BDBM501185 CN1C(NC(=O)OC(C)(C)C)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |r,c:10|
BDBM501186 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(Br)cn2)cc(F)c1F |r,c:3|
BDBM501187 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,c:3|
BDBM501267 C[C@H](Oc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)N(C)S(=O)(=O)C1(C)C)C#C |r,t:23|
BDBM501268 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cc3OCCOc3cn2)ccc1F |r,c:3|
BDBM501269 CC1(C)C(N)=N[C@@](CF)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,c:4|
BDBM501270 CC1(C)C(N)=N[C@@](CF)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(Cl)cn2)ccc1F |r,c:4|
BDBM501271 CC1(C)C(N)=N[C@@](CF)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |r,c:4|
BDBM501272 CC1(C)C(N)=N[C@](C)(c2cc(\C=C(/F)c3cnc(Cl)cn3)ccc2F)C(F)(F)S1(=O)=O |r,c:4|
BDBM501273 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(cn2)C#N)cc(F)c1F |r,c:4|
BDBM501326 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ncc(cc2C)C#N)ccc1F |r,c:3|
BDBM501327 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCc3ncc(C)o3)cn2)cc(F)c1F |r,c:3|
BDBM501329 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(cn2)C#CC2CC2)ccc1F |r,c:3|
BDBM501330 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCc3nccn3C)cn2)cc(F)c1F |r,c:3|
BDBM501331 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cc3nccnc3cn2)ccc1F |r,c:3|
BDBM501189 C[C@@]1(N=C(N)[C@]2(CF)CC[C@@H]1S2(=O)=O)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |r,t:2|
BDBM501190 C[C@@]1(N=C(N)[C@@]2(CF)CC[C@@H]1S2(=O)=O)c1cc(\C=C(/F)c2cnc(OCC(F)(F)F)cn2)ccc1F |r,wD:1.0,10.9,5.5,t:2,TLB:4:3:8.9:11,THB:14:1:8.9:11,0:1:8.9:11,(-1.04,-1.11,;-.93,-2.65,;-.68,-4.17,;-1.64,-3.37,;-2.16,-4.82,;-3.45,-3.37,;-4.54,-2.28,;-6.03,-2.68,;-4.42,-4.7,;-3.27,-4,;-2.67,-2.68,;-3.71,-1.85,;-5.25,-1.69,;-3.13,-.43,;.59,-2.47,;1.2,-1.05,;2.73,-.87,;3.34,.54,;2.42,1.78,;.89,1.6,;3.03,3.19,;4.56,3.37,;5.17,4.79,;4.25,6.02,;4.86,7.44,;6.39,7.62,;6.99,9.03,;8.52,9.21,;6.07,10.26,;7.6,10.45,;2.72,5.84,;2.11,4.43,;3.65,-2.11,;3.05,-3.52,;1.52,-3.7,;.91,-5.12,)|
BDBM501191 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)C2CCOCC2)cc(F)c1F |r,c:3|
BDBM501194 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,c:4|
BDBM501274 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(Cl)cn2)cc(F)c1F |r,c:4|
BDBM501275 CC#CCOc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]1(CF)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:34|
BDBM501276 C[C@H](Oc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]1(CF)CS(=O)(=O)C(C)(C)C(N)=N1)C#C |r,c:32|
BDBM501277 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc3OCCOc3c2)ccc1F |r,c:3|
BDBM501278 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(cn2)C#N)cnc1F |r,c:4|
BDBM501279 CC[C@H](Oc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1)C#CC |r,c:32|
BDBM501280 CC[C@@H](Oc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1)C#CC |r,c:32|
BDBM501333 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCC#CCO)cn2)ccc1F |r,c:3|
BDBM501334 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ncc(s2)C#N)ccc1F |r,c:3|
BDBM501335 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCC#CCF)cn2)ccc1F |r,c:3|
BDBM501336 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc3OCCOc3n2)ccc1F |r,c:3|
BDBM501337 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(s2)C#N)ccc1F |r,c:3|
BDBM501338 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cc3OCOc3cn2)ccc1F |r,c:3|
BDBM501339 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(OC(F)(F)F)cn2)ccc1F |r,c:3|
BDBM501195 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |r,c:4|
BDBM501196 Cc1noc(COc2cnc(cn2)C(\F)=C\c2ccc(F)c(c2)[C@@]2(C)N=C(N)[C@@]3(CF)CC[C@@H]2S3(=O)=O)n1 |r,t:27,THB:21:23:31.32:34,27:26:31.32:34,24:23:31.32:34|
BDBM501197 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCc3ncco3)cn2)ccc1F |r,c:3|
BDBM501198 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCC(F)(F)F)cn2)ccc1F |r,c:3|
BDBM501199 C[C@@]1(N=C(N)[C@@]2(CF)CC[C@@H]1S2(=O)=O)c1cc(\C=C(/F)c2cnc(OCC3CC3)cn2)ccc1F |r,t:2,THB:14:1:8.9:11,0:1:8.9:11,4:3:8.9:11|
BDBM501200 Cc1nnc(COc2cnc(cn2)C(\F)=C\c2ccc(F)c(c2)[C@@]2(C)N=C(N)[C@@]3(CF)CC[C@@H]2S3(=O)=O)o1 |r,t:27,THB:21:23:31.32:34,24:23:31.32:34,27:26:31.32:34|
BDBM501281 CC1(C)C(N)=N[C@@](C)([C@H](F)S1(=O)=O)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |r,c:4|
BDBM501282 CC1(C)C(N)=N[C@@](C)([C@@H](F)S1(=O)=O)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |r,c:4|
BDBM501283 CC1(C)C(N)=N[C@](C)(c2cc(\C=C(/F)c3cnc(OCC#C)cn3)ccc2F)C(F)(F)S1(=O)=O |r,c:4|
BDBM501340 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cc3ccccc3cn2)ccc1F |r,c:3|
BDBM501341 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cc3cc(Cl)ccc3cn2)ccc1F |r,c:3|
BDBM501342 CC1(C)C(N)=N[C@]2(CO[C@H]2S1(=O)=O)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,c:4|
BDBM501343 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(F)cn2)ccc1F |r,c:4|
BDBM501344 COc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:30|
BDBM501345 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ncc(cc2Cl)C(F)(F)F)ccc1F |r,c:4|
BDBM501346 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(cn2)C(F)(F)F)ccc1F |r,c:4|
BDBM501201 C[C@@]1(N=C(N)[C@@]2(CF)CC[C@@H]1S2(=O)=O)c1cc(\C=C(/F)c2cnc(OCC(F)(F)C(F)F)cn2)ccc1F |r,t:2,THB:14:1:8.9:11,0:1:8.9:11,4:3:8.9:11|
BDBM501202 COc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)[C@@]2(CF)CC[C@@H]1S2(=O)=O |r,t:22,THB:19:18:26.27:29,22:21:26.27:29,16:18:26.27:29|
BDBM501203 CCOc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)[C@@]2(CF)CC[C@@H]1S2(=O)=O |r,t:23,THB:17:19:27.28:30,20:19:27.28:30,23:22:27.28:30|
BDBM501205 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCC(F)(F)F)cn2)ccc1F |r,c:4|
BDBM501206 C[C@@]1(N=C(N)[C@@]2(CF)CC[C@@H]1S2(=O)=O)c1cc(\C=C(/F)c2cnc(OCC=C)cn2)ccc1F |r,t:2,THB:14:1:8.9:11,0:1:8.9:11,4:3:8.9:11|
BDBM501207 C[C@@]1(N=C(N)[C@@]2(CF)CC[C@@H]1S2(=O)=O)c1cc(\C=C(/F)c2cnc(OCC3COC3)cn2)ccc1F |r,t:2,THB:0:1:8.9:11,14:1:8.9:11,4:3:8.9:11|
BDBM501347 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(cn2)C2CC2)ccc1F |r,c:3|
BDBM501348 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2nc(cs2)C#N)ccc1F |r,c:3|
BDBM501349 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ncc(cc2Cl)C#N)ccc1F |r,c:4|
BDBM501350 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ncc(cc2Cl)C#N)ccc1F |r,c:3|
BDBM501351 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(F)cn2)ccc1F |r,c:3|
BDBM501352 COc1cnc(cn1)C(\F)=C\c1cc(F)c(F)c(c1)[C@]1(C)CS(=O)(=O)N(C)C(N)=N1 |r,c:30|
BDBM501353 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ncc(cc2Cl)C(F)(F)F)cc(F)c1F |r,c:3|
BDBM501208 CN1C(N)=N[C@](C)(c2cc(\C=C(/F)c3ccc(cn3)C#N)ccc2F)C2(CC2)S1(=O)=O |r,c:3|
BDBM501209 C[C@H](Oc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)[C@@]2(CF)CC[C@@H]1S2(=O)=O)C#C |r,t:23,THB:20:19:27.28:30,23:22:27.28:30,17:19:27.28:30|
BDBM501210 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCc3ncco3)cn2)ccc1F |r,c:4|
BDBM501211 COCCOc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)[C@@]2(CF)CC[C@@H]1S2(=O)=O |r,t:25,THB:22:21:29.30:32,25:24:29.30:32,19:21:29.30:32|
BDBM501212 COC[C@H](C)Oc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)[C@@]2(CF)CC[C@@H]1S2(=O)=O |r,t:26,THB:23:22:30.31:33,26:25:30.31:33,20:22:30.31:33|
BDBM501213 C[C@@]1(N=C(N)[C@@]2(CF)CC[C@@H]1S2(=O)=O)c1cc(\C=C(/F)c2cnc(OCC3CCC3)cn2)ccc1F |r,t:2,THB:0:1:8.9:11,14:1:8.9:11,4:3:8.9:11|
BDBM501354 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(cn2)C(F)(F)F)cc(F)c1F |r,c:3|
BDBM501355 Cc1cc(cnc1\C(F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1)C#N |r,c:29|
BDBM501357 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ncc(cc2Cl)C#N)cc(F)c1F |r,c:3|
BDBM501358 C[C@@]1(N=C(N)[C@@]2(CF)CC[C@@H]1S2(=O)=O)c1cc(\C=C(/F)C2CCOC2)ccc1F |r,t:2,THB:14:1:8.9:11,4:3:8.9:11,0:1:8.9:11|
BDBM501359 C[C@@]1(N=C(N)[C@@]2(CF)CC[C@@H]1S2(=O)=O)c1cc(\C=C(\F)C2CCCO2)ccc1F |r,t:2,THB:14:1:8.9:11,4:3:8.9:11,0:1:8.9:11|
BDBM501360 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C\c2ccc(Cl)cc2)ccc1F |r,c:4|
BDBM501214 C[C@@]1(N=C(N)[C@@]2(CF)CC[C@@H]1S2(=O)=O)c1cc(\C=C(/F)c2cnc(OCCF)cn2)ccc1F |r,t:2,THB:0:1:8.9:11,4:3:8.9:11,14:1:8.9:11|
BDBM501215 C[C@@]1(N=C(N)[C@@]2(CF)CC[C@@H]1S2(=O)=O)c1cc(\C=C(/F)c2cnc(OCC(F)F)cn2)ccc1F |r,t:2,THB:0:1:8.9:11,4:3:8.9:11,14:1:8.9:11|
BDBM501216 CCCOc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)[C@@]2(CF)CC[C@@H]1S2(=O)=O |r,t:24,THB:18:20:28.29:31,24:23:28.29:31,21:20:28.29:31|
BDBM501217 COC(C)COc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)[C@@]2(CF)CC[C@@H]1S2(=O)=O |r,t:26,THB:20:22:30.31:33,26:25:30.31:33,23:22:30.31:33|
BDBM501218 CC#CCOc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@@]1(C)N=C(N)[C@@]2(CF)CC[C@@H]1S2(=O)=O |r,t:25,THB:19:21:29.30:32,25:24:29.30:32,22:21:29.30:32|
BDBM501219 CN1C(N)=N[C@](C)(c2cc(\C=C(/F)c3cnc(OCC#C)cn3)ccc2F)C2(CC2)S1(=O)=O |r,c:3|
BDBM501222 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCC(F)(F)C(F)F)cn2)ccc1F |r,c:4|
BDBM501223 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCCC(F)(F)F)cn2)ccc1F |r,c:4|
BDBM501225 CC1(C)C(NC(=O)OCC2CCCC2)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCC3CCCC3)cn2)ccc1F |r,c:14|
BDBM501226 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCC3CCCC3)cn2)ccc1F |r,c:4|
BDBM501229 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCC(F)(F)C(F)F)cn2)ccc1F |r,c:3|
BDBM501230 C[C@]1(CS(=O)(=O)C2(CCC2)C(N)=N1)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |r,c:12|
BDBM501231 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCC3CCCCC3)cn2)ccc1F |r,c:4|
BDBM501234 CC(C)(COc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1)C#N |r,c:33|
BDBM501235 CC#CCOc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]1(C)CS(=O)(=O)C(C)(C)C(N)=N1 |r,c:33|
BDBM501236 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCCn3ccnc3)cn2)ccc1F |r,c:4|
BDBM501239 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(Cl)cn2)cc(F)c1F |r,c:3|
BDBM501240 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(Cl)cn2)ccc1F |r,c:4|
BDBM501246 CC#CCOc1cnc(cn1)C(\F)=C\c1cc(F)c(F)c(c1)[C@]1(C)CS(=O)(=O)N(C)C(N)=N1 |r,c:33|
BDBM501221 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCC3CC3)cn2)ccc1F |r,c:4|
BDBM501237 CC1(C)C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(OCCn3cc(Br)cn3)cn2)ccc1F |r,c:4|
BDBM501328 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(Br)cn2)ccc1F |r,c:3|
BDBM501232 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(Cl)cn2)cc(F)c1F |r,c:3|
BDBM501188 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2ccc(cn2)C#N)cc(F)c1F |r,c:3|
BDBM501192 CN1C(N)=N[C@@](C)(CS1(=O)=O)c1cc(\C=C(/F)c2cnc(Cl)cn2)ccc1F |r,c:3|
BDBM501220 CN1C(N)=N[C@](C)(c2cc(\C=C(/F)c3cnc(Cl)cn3)ccc2F)C2(CC2)S1(=O)=O |r,c:3|
BDBM513874 Cn1cnc(Cn2c(=O)[nH]\c(=N/c3cc4cn(C)nc4cc3Cl)n(Cc3cc(F)c(F)cc3F)c2=O)n1
BDBM50546118 CC(C)CN(C[C@H](O)[C@@H](N)c1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1 |r|
BDBM50555157 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(=O)(=O)N(C)C)cc1OC |r|
BDBM50555158 OC(=O)C(F)(F)F.CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(Cl)c(Cl)c2)c1 |r|
BDBM50555159 OC(=O)C(F)(F)F.CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(F)c(F)c2)c1 |r|
BDBM50555160 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(=O)(=O)N(C)C)cc1F |r|
BDBM50555161 OC(=O)C(F)(F)F.CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2cccc(c2)C#N)c1 |r|
BDBM50555162 OC(=O)C(F)(F)F.CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccccc2C(F)(F)F)c1 |r|
BDBM50555163 OC(=O)C(F)(F)F.CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2cccc(c2)C(F)(F)F)c1 |r|
BDBM50555164 OC(=O)C(F)(F)F.CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(cc2)C(F)(F)F)c1 |r|
BDBM50555165 OC(=O)C(F)(F)F.CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c1 |r|
BDBM50555166 OC(=O)C(F)(F)F.CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)c2ccc3OCCOc3c2)c1 |r|
BDBM50555167 OC(=O)C(F)(F)F.COc1ccc(CCC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(=O)(=O)N(C)C)cc1OC |r|
BDBM50555168 OC(=O)C(F)(F)F.CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc3ccccc3c2)c1 |r|
BDBM50555169 OC(=O)C(F)(F)F.CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)C2CCCc3ccccc23)c1 |r|
BDBM50555170 OC(=O)C(F)(F)F.CCN(CC)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)c1 |r|
BDBM50555171 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(=O)(=O)N(C(C)C)C(C)C)cc1OC |r|
BDBM50555172 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(=O)(=O)NC(C)C)cc1OC |r|
BDBM50555173 OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)c1 |r|
BDBM50555174 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(=O)(=O)NC2CC2)cc1OC |r|
BDBM50555175 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(=O)(=O)NC2CCCCC2)cc1OC |r|
BDBM50555176 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(=O)(=O)N2CCOCC2)cc1OC |r|
BDBM50555177 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(=O)(=O)N2CCN(C)CC2)cc1OC |r|
BDBM50555178 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)N(S(C)(=O)=O)S(C)(=O)=O)cc1OC |r|
BDBM50555179 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
BDBM50555180 OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)c1 |r|
BDBM50555181 OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@H](NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)C2CCCCC2)c1 |r|
BDBM50555182 OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@H](NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)c2ccccc2)c1 |r|
BDBM50555183 OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@H](NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)C(C)C)c1 |r|
BDBM50555184 OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC(C)C)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)c1 |r|
BDBM50555185 OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)c1 |r|
BDBM50555186 OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](C)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)c1 |r|
BDBM50555187 OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(F)c(OC)c2)c1 |r|
BDBM50555188 OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(OC)c(Cl)c2)c1 |r|
BDBM50555189 OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2cc(Cl)cc(OC)c2)c1 |r|
BDBM50555190 OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2cc(Cl)cc(c2)C(F)(F)F)c1 |r|
BDBM50555191 OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(Cl)c(Cl)c2)c1 |r|
BDBM50555192 OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c1 |r|
BDBM50555193 OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(OC)c(c2)C(F)(F)F)c1 |r|
BDBM50555194 OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(cc2)S(C)(=O)=O)c1 |r|
BDBM50555195 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
BDBM50555196 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2F)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
BDBM50555197 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](Cc2cccs2)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
BDBM50555198 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](Cc2cc3ccccc3s2)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
BDBM50555199 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](Cn2cc(nn2)-c2ccccc2)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
BDBM50555200 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CN2CCOCC2)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
BDBM50555201 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](C2CCCCC2)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
BDBM50555202 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@@H](C(=O)Nc2cc(ccc2C)S(N)(=O)=O)C2=CCC=CC2)cc1OC |r,c:38,t:35|
BDBM50555203 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@@H](C2CCCC2)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
BDBM50555204 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CC2)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
BDBM50555205 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](C2CC2)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
BDBM50555206 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
BDBM50555207 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](C(C)C)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
BDBM50555208 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@@H](C(=O)Nc2cc(ccc2C)S(N)(=O)=O)C(C)(C)C)cc1OC |r|
BDBM50555209 OC(=O)C(F)(F)F.CCCC[C@@H](NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1)C(=O)Nc1cc(ccc1C)S(N)(=O)=O |r|
BDBM50555210 OC(=O)C(F)(F)F.CCC[C@@H](NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1)C(=O)Nc1cc(ccc1C)S(N)(=O)=O |r|
BDBM50555211 OC(=O)C(F)(F)F.CC[C@@H](NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1)C(=O)Nc1cc(ccc1C)S(N)(=O)=O |r|
BDBM50555212 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](C)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
BDBM50555213 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)NCC(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC
BDBM50555214 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CSC)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
BDBM50555215 OC(=O)C(F)(F)F.COC[C@@H](NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1)C(=O)Nc1cc(ccc1C)S(N)(=O)=O |r|
BDBM50555216 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CCSC)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
BDBM50555217 OC(=O)C(F)(F)F.COCC[C@@H](NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1)C(=O)Nc1cc(ccc1C)S(N)(=O)=O |r|
BDBM50555218 OC(=O)C(F)(F)F.CCOC[C@@H](NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1)C(=O)Nc1cc(ccc1C)S(N)(=O)=O |r|
BDBM50555219 OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CO)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
BDBM50575718 Clc1cc(Cl)cc(c1)N1CCN(CC1)C(=O)CC[C@H]1NC(=O)NC1=O |r|
BDBM589211 NC1=N[C@]2(CO[C@@H]([C@H]2CS1)C(F)(F)F)c1cc(\C=C(/F)c2ccc(cn2)C(F)(F)F)ccc1F |r,t:1|
BDBM50579806 CCS(=O)(=O)[C@]1(C)CC[C@](CF)(N=C1N)c1cc(NC(=O)c2cc3OC(F)(F)Oc3cn2)ccc1F |r,c:12|
BDBM50587072 Cc1cc(OC(F)F)cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(C)CO[C@](C)(C(N)=N1)C(F)(F)F |r,c:30|
BDBM589176 NC1=N[C@@]2(CN(C[C@@H]2CS1)c1ncc(F)cn1)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |r,t:1|
BDBM589187 [H][C@@]12CN(C[C@@]1(N=C(N)SC2)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F)C(C)=O |r,t:7|
BDBM589190 NC1=N[C@]2(CN(C[C@H]2CS1)c1ncccn1)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |r,t:1|
BDBM589178 Cc1noc(COc2cnc(cn2)C(\F)=C\c2ccc(F)c(c2)[C@@]23CN(C[C@@H]2CSC(N)=N3)c2ncc(F)cn2)n1 |r,c:34|
BDBM589196 NC1=N[C@@]2(CO[C@H]([C@@H]2CS1)C(F)(F)F)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,t:1|
BDBM589204 NC1=N[C@]2(CO[C@@H]([C@H]2CS1)C(F)(F)F)c1cc(\C=C(/F)c2ccc(F)cn2)ccc1F |r,t:1|
BDBM50587070 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ncc(cc2N)C#N)ccc1F |r,c:7|
BDBM589167 NC1=N[C@@]2(CN(C[C@@H]2CS1)c1ncc(F)cn1)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |r,t:1|
BDBM589197 NC1=N[C@]2(CO[C@@H]([C@H]2CS1)C(F)(F)F)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,t:1|
BDBM589173 [H][C@]12COC[C@]1(N=C(N)SC2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,t:7|
BDBM50581135 Cl.[H][C@@]12CN(C[C@@]1(N=C(N)SC2)c1ccc(s1)C#N)c1ncc(F)cn1 |r,t:7|
BDBM50581136 Cl.[H][C@@]12CN(C[C@@]1(N=C(N)SC2)c1ccns1)c1ncc(F)cn1 |r,t:7|
BDBM50581133 Cl.[H][C@@]12CN(C[C@@]1(N=C(N)SC2)c1cccs1)c1ncc(F)cn1 |r,t:7|
BDBM50581134 Cl.[H][C@@]12CN(C[C@@]1(N=C(N)SC2)c1cnccn1)c1ncc(F)cn1 |r,t:7|
BDBM589207 [H][C@@]12CN(C[C@@]1(N=C(N)SC2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F)c1ncccn1 |r,t:7|
BDBM589192 COC(=O)N1C[C@H]2CSC(N)=N[C@]2(C1)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |r,c:10|
BDBM589195 CC(C)OC(=O)N1C[C@H]2CSC(N)=N[C@]2(C1)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |r,c:12|
BDBM589208 COc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]12CO[C@@H]([C@H]1CSC(N)=N2)C(F)(F)F |r,c:29|
BDBM589200 NC1=N[C@]2(CO[C@@H]([C@H]2CS1)C(F)(F)F)c1cc(\C=C(/F)c2cnc(cn2)C#N)ccc1F |r,t:1|
BDBM589180 NC1=N[C@]2(CN(C[C@H]2CS1)c1ncc(F)cn1)c1cc(\C=C(/F)c2cnc(OCC(F)(F)CF)cn2)ccc1F |r,t:1|
BDBM50587073 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ncc(OC(F)F)cc2Cl)ccc1F |r,c:7|
BDBM50587074 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ncc(Cl)cc2Cl)ccc1F |r,c:7|
BDBM50583315 COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)Cn2nc(cc2C(N)=N1)C#N |r,c:30|
BDBM589216 NC1=N[C@]2(CO[C@H](C(F)F)[C@H]2CS1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,t:1|
BDBM589175 NC1=N[C@]2(CN(C[C@H]2CS1)c1ncc(F)cn1)c1cc(\C=C(/F)c2cnc(Cl)cn2)ccc1F |r,t:1|
BDBM589169 NC1=N[C@]2(CN(C[C@H]2CS1)c1ncc(F)cn1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,t:1|
BDBM589205 [H][C@@]12CSC(N)=N[C@@]1(CO[C@H]2CF)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,c:5|
BDBM589198 NC1=N[C@]2(CO[C@@H]([C@H]2CS1)C(F)(F)F)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |r,t:1|
BDBM589217 NC1=N[C@@]2(CO[C@@H](C(F)F)[C@@H]2CS1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,t:1|
BDBM589170 NC1=N[C@@]2(CN(C[C@@H]2CS1)c1ncc(F)cn1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,t:1|
BDBM589171 NC1=N[C@@]2(COC[C@@H]2CS1)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |r,t:1|
BDBM589172 NC1=N[C@]2(COC[C@H]2CS1)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F |r,t:1|
BDBM50587071 COc1cnc(C(=O)Nc2ccc(F)c(c2)[C@]2(C)CO[C@](C)(C(N)=N2)C(F)(F)F)c(C)c1 |r,c:24|
BDBM589185 CC#CCOc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]12CN(C[C@H]1CSC(NC(=O)c1ccccc1)=N2)c1ncc(F)cn1 |r,c:41|
BDBM589188 NC1=N[C@]2(CN(C[C@H]2CS1)C(=O)CC(F)(F)F)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |r,t:1|
BDBM589193 CCC(=O)N1C[C@H]2CSC(N)=N[C@]2(C1)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |r,c:10|
BDBM589179 NC1=N[C@]2(CN(C[C@H]2CS1)c1ncc(F)cn1)c1cc(\C=C(/F)c2cnc(cn2)C#N)ccc1F |r,t:1|
BDBM589202 [H][C@@]12CN(C[C@@]1(N=C(N)SC2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F)c1nc(C)c(F)c(OC)n1 |r,t:7|
BDBM589214 NC1=N[C@]2(CO[C@@H]([C@H]2CO1)C(F)(F)F)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,t:1|
BDBM589215 NC1=N[C@@]2(CO[C@H]([C@@H]2CO1)C(F)(F)F)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,t:1|
BDBM50587068 Cc1nc(cnc1C(=O)Nc1ccc(F)c(c1)[C@]1(C)CO[C@](C)(C(N)=N1)C(F)(F)F)C#N |r,c:26|
BDBM589203 [H][C@]12CSC(N)=N[C@]1(CO[C@@H]2CF)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,c:5|
BDBM589209 NC1=N[C@]2(CO[C@@H]([C@H]2CS1)C(F)(F)F)c1cc(\C=C(/F)c2ncc(cc2Cl)C(F)(F)F)ccc1F |r,t:1|
BDBM589181 NC1=N[C@]2(CN(C[C@H]2CS1)c1ncc(F)cn1)c1cc(\C=C(/F)c2cnc(OCC(F)F)cn2)ccc1F |r,t:1|
BDBM589201 [H][C@]12CSC(N)=N[C@]1(CO[C@@H]2C(F)(F)F)c1cc(\C=C(/F)c2ccc(OC(F)(F)F)cn2)ccc1F |r,c:5|
BDBM589213 [H][C@]12COC(N)=N[C@]1(CO[C@@H]2C(F)(F)F)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,c:5|
BDBM50581791 NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CCC(O)=O)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 |r|
BDBM50586753 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1nc(NC(=O)c2ncc(OCCF)nc2N)ccc1F |r,c:7|
BDBM50586754 COCCOc1cnc(C(=O)Nc2ccc(F)c(n2)[C@]2(C)CO[C@](C)(C(N)=N2)C(F)(F)F)c(N)n1 |r,c:27|
BDBM50586755 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1nc(NC(=O)c2ncc(cc2N)C(F)(F)F)ccc1F |r,c:7|
BDBM589168 [H][C@@]12CN(C[C@@]1(N=C(N)SC2)c1cc(\C=C(/F)c2ccc(Cl)cn2)ccc1F)c1ncc(F)cn1 |r,t:7|
BDBM589210 Cc1cc(cnc1\C(F)=C\c1ccc(F)c(c1)[C@]12CO[C@@H]([C@H]1CSC(N)=N2)C(F)(F)F)C#N |r,c:28|
BDBM589194 CCOC(=O)N1C[C@H]2CSC(N)=N[C@]2(C1)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F |r,c:11|
BDBM589206 COc1nc(ncc1F)N1C[C@H]2CSC(N)=N[C@]2(C1)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,c:16|
BDBM589183 C[C@H](Oc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]12CN(C[C@H]1CSC(N)=N2)c1ncc(F)cn1)C#C |r,c:30|
BDBM50581132 Cl.Cl.[H][C@@]12CN(C[C@@]1(N=C(N)SC2)c1cccs1)c1ncccn1 |r,t:7|
BDBM589184 [H][C@@]12CN(C[C@@]1(N=C(N)SC2)c1cc(\C=C(/F)c2cnc(OCC#C)cn2)ccc1F)C(=O)OC(C)(C)C |r,t:7|
BDBM589182 COC[C@H](C)Oc1cnc(cn1)C(\F)=C\c1ccc(F)c(c1)[C@]12CN(C[C@H]1CSC(N)=N2)c1ncc(F)cn1 |r,c:33|
BDBM589174 [H][C@@]12COC[C@@]1(N=C(N)SC2)c1cc(\C=C(/F)c2ccc(cn2)C#N)ccc1F |r,t:7|
BDBM50587069 C[C@]1(CO[C@](C)(C(N)=N1)C(F)(F)F)c1cc(NC(=O)c2ncc(cc2Cl)C#N)ccc1F |r,c:7|
BDBM589212 NC1=N[C@]2(CO[C@@H]([C@H]2CS1)C(F)(F)F)c1cc(\C=C(/F)c2ncc(cc2Cl)C#N)ccc1F |r,t:1|
BDBM50591315 C[C@]1(CC(=O)N(C2CCOCC2)C(=N)N1)c1cccc(Nc2ccccc2)c1Cl |r|
BDBM50591316 C[C@]1(CC(=O)N(C2CCOCC2)C(=N)N1)c1cccc(Nc2ccc(nc2)C2CC2)c1Cl |r|
BDBM50591317 C[C@H]1C[C@H](CCO1)N1C(=O)C[C@](C)(NC1=N)c1cccc(Nc2ccc(nc2)C2CC2)c1Cl |r|
BDBM50591318 C[C@H]1C[C@H](CCO1)N1C(=O)C[C@](C)(NC1=N)c1cccc(Nc2cnc(nc2)C2CC2)c1Cl |r|
BDBM50591319 C[C@]1(CC(=O)N(C2CCOCC2)C(=N)N1)c1cccc(NC(=O)c2ccccc2)c1Cl |r|
BDBM50591320 C[C@H]1C[C@H](CCO1)N1C(=O)C[C@](C)(NC1=N)c1cccc(NC(=O)c2cccc(c2)C#N)c1Cl |r|
BDBM50596254 Cc1cc(cnc1C(=O)Nc1ccc(F)c(n1)[C@]1(C)CS(=O)(=O)[C@@](C)(C(F)F)C(=N)N1)C#N |r|
BDBM50603520 CCOC[C@@H](NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1)C(=O)Nc1cc(ccc1C)S(N)(=O)=O |r|
BDBM50603521 CC(C)C[C@H](NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C)C(=O)N[C@@H](C)C(=O)N(C)[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|
BDBM50603522 COC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccc(OC(C)(C)C)cc1)N(C)C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C |r|
BDBM50603523 CC(C)C[C@H](NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C)C(=O)N[C@@H](C)C(=O)N(C)[C@H](Cc1ccc(OC(C)(C)C)cc1)C(=O)N1CCC[C@H]1C(O)=O |r|
BDBM50603524 COC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccc(O)cc1)N(C)C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C |r|
BDBM50603525 CC(C)C[C@H](NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C)C(=O)N[C@@H](C)C(=O)N(C)[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NCCOCCOCCn1cc(CNC(=O)[C@H](CCCCNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)CCN2c3ccccc3C(C)(C)[C@@]22Oc3ccc(cc3C=C2)[N+]([O-])=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)C(CCC(N)=O)NC(=O)[C@H](CO)NC(=O)CCN2c3ccccc3C(C)(C)[C@]22CCc3cc(ccc3O2)[N+]([O-])=O)nn1 |r,c:157|
BDBM50603526 CC(C)C[C@H](NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C)C(=O)N[C@@H](C)C(=O)N(C)[C@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)NCCOCCOCCn1cc(CNC(=O)[C@H](CCCCNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)CCN2c3ccccc3C(C)(C)[C@@]22Oc3ccc(cc3C=C2)[N+]([O-])=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)C(CCC(N)=O)NC(=O)[C@H](CO)NC(=O)CCN2c3ccccc3C(C)(C)[C@]22CCc3cc(ccc3O2)[N+]([O-])=O)nn1 |r,c:158|