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2118 SMILES Strings for Cytochrome P450 11B2, mitochondrial

Compound NameSMILES String
BDBM151585 CC(=O)N1CCN(CC1)c1ccc(OCC2COC(Cn3ccnc3)(O2)c2ccc(Cl)cc2Cl)cc1
BDBM2579 CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r|
BDBM3787 C(c1ccccc1)n1cnc2ccccc12
BDBM7887 C(c1ccccc1)n1ccnc1
BDBM8588 Clc1ccc2\C(CCc2c1)=C\c1cccnc1
BDBM8589 Clc1ccc2\C(CCc2c1)=C/c1cccnc1
BDBM8590 Brc1ccc2\C(CCc2c1)=C\c1cccnc1
BDBM8591 Brc1ccc2\C(CCc2c1)=C/c1cccnc1
BDBM8639 Fc1ccc2\C(CCc2c1)=C\c1cccc2cnccc12
BDBM8640 Fc1ccc2\C(CCc2c1)=C/c1cccc2cnccc12
BDBM8607 Fc1cccc2\C(CCc12)=C\c1cccnc1
BDBM8608 Clc1cccc2\C(CCc12)=C\c1cccnc1
BDBM8609 Clc1cccc2\C(CCc12)=C/c1cccnc1
BDBM8610 [H][C@]1(COc2ccc(cc2)N2CCN(CC2)C(C)=O)CO[C@@](Cn2ccnc2)(O1)c1ccc(Cl)cc1Cl |r|
BDBM8611 N#Cc1ccc(cc1)C1CCCc2cncn12
BDBM8612 C1Cc2ccccc2\C1=C/c1ccncc1
BDBM8613 C1C\C(=C/c2ccncc2)c2ccccc2C1
BDBM8614 Fc1ccc2\C(CCc2c1)=C\c1ccncc1
BDBM8615 Fc1ccc2\C(CCc2c1)=C/c1ccncc1
BDBM8618 Clc1ccc2\C(CCc2c1)=C\c1ccncc1
BDBM8619 Clc1ccc2\C(CCc2c1)=C/c1ccncc1
BDBM8620 Brc1ccc2\C(CCc2c1)=C\c1ccncc1
BDBM8621 Brc1ccc2\C(CCc2c1)=C/c1ccncc1
BDBM8581 C1Cc2ccccc2\C1=C\c1cccnc1
BDBM8583 C1Cc2ccccc2\C1=C/c1cccnc1
BDBM8584 C1C\C(=C/c2cccnc2)c2ccccc2C1
BDBM8585 C1C\C(=C\c2cccnc2)c2ccccc2C1
BDBM8586 Fc1ccc2\C(CCc2c1)=C\c1cccnc1
BDBM8587 Fc1ccc2\C(CCc2c1)=C/c1cccnc1
BDBM8631 Fc1ccc2\C(CCc2c1)=C\c1cncnc1
BDBM8593 COc1ccc2\C(CCc2c1)=C\c1cccnc1
BDBM8594 COc1ccc2\C(CCc2c1)=C/c1cccnc1
BDBM8595 COc1ccc2\C(CCCc2c1)=C\c1cccnc1
BDBM8596 COc1ccc2\C(CCCc2c1)=C/c1cccnc1
BDBM8597 CCOc1ccc2\C(CCc2c1)=C\c1cccnc1
BDBM8598 CCOc1ccc2\C(CCc2c1)=C/c1cccnc1
BDBM8599 Cc1cccc2\C(CCc12)=C\c1cccnc1
BDBM8600 COc1cccc2CC\C(=C/c3cccnc3)c12
BDBM8871 C1CC(=Cc2cnc[nH]2)c2ccccc2C1 |w:3.3|
BDBM8873 C1Cc2ccccc2C1=Cc1cnc[nH]1 |w:9.11|
BDBM8875 N#Cc1ccc2C(CCCc2c1)=Cc1cnc[nH]1 |w:12.14|
BDBM8916 c1cn(cn1)-c1ccc2ccccc2c1
BDBM8876 N#Cc1ccc2C(CCc2c1)=Cc1cnc[nH]1 |w:11.13|
BDBM8878 Clc1ccc2CCCC(=Cc3cnc[nH]3)c2c1 |w:9.9|
BDBM8879 Fc1ccc2C(CCc2c1)=Cc1cnc[nH]1 |w:10.12|
BDBM8917 COc1cc2ccccc2cc1-n1ccnc1
BDBM8918 COc1ccc2cc(ccc2c1)-n1ccnc1
BDBM8919 c1cn(cn1)-c1cnc2ccccc2c1
BDBM8920 C(Oc1ccc2cc(ccc2c1)-c1cccnc1)c1ccccc1
BDBM8921 COc1ccc2cc(ccc2c1-c1cccnc1)-c1cccnc1
BDBM8881 Clc1ccc2C(CCc2c1)=Cc1cnc[nH]1 |w:10.12|
BDBM8883 Brc1ccc2C(CCc2c1)=Cc1cnc[nH]1 |w:10.12|
BDBM8888 C1C(=Cc2ccccc12)c1cccnc1 |c:1|
BDBM8889 C1Cc2ccccc2C=C1c1cccnc1 |c:9|
BDBM8922 COc1cc2ccccc2cc1-c1cccnc1
BDBM8923 NC(=O)c1ccc2cc(ccc2c1)-c1cccnc1
BDBM8924 CNC(=O)c1ccc2cc(ccc2c1)-c1cccnc1
BDBM8890 COc1ccc2CC(=Cc2c1)c1cccnc1 |c:7|
BDBM8891 COc1ccc2C=C(CCc2c1)c1cccnc1 |c:6|
BDBM8892 CC1=C(CCc2ccccc12)c1cccnc1 |t:1|
BDBM8925 c1ccc2ncc(cc2c1)-c1cccnc1
BDBM8926 c1ccc2nc(ccc2c1)-c1cccnc1
BDBM8927 c1ccc2nc(cnc2c1)-c1cccnc1
BDBM8893 CCC1=C(CCc2ccccc12)c1cccnc1 |t:2|
BDBM8894 CC1Cc2ccccc2C=C1c1cccnc1 |c:10|
BDBM8895 CC1CC(=Cc2ccccc12)c1cccnc1 |c:3|
BDBM8928 c1ncc(o1)-c1ccc2ccccc2c1
BDBM8929 COc1ccc2cc(ccc2c1)-c1cncnc1
BDBM8930 COc1ccc2cc(ccc2c1)-c1ccncc1
BDBM8896 CCC1CC(=Cc2ccccc12)c1cccnc1 |c:4|
BDBM8897 COc1ccc2C=C(CCc2c1)c1ccncc1 |c:6|
BDBM8898 C1Cc2ccccc2C=C1n1ccnc1 |c:9|
BDBM8931 c1nc(c[nH]1)-c1ccc2ccccc2c1
BDBM8932 Cn1cncc1-c1ccc2ccccc2c1
BDBM8899 COc1ccc2C=C(CCc2c1)n1ccnc1 |c:6|
BDBM8900 C(=C\c1cccnc1)\c1ccccc1
BDBM8901 COc1ccc2CCC(=Cc2c1)c1cccnc1 |c:8|
BDBM8902 C1C(=Cc2ccccc12)n1ccnc1 |c:1|
BDBM8904 c1ccc2cc(ccc2c1)-c1cccnc1
BDBM8905 COc1ccc2cc(ccc2c1)-c1cccnc1
BDBM8906 Oc1ccc2cc(ccc2c1)-c1cccnc1
BDBM8907 Brc1ccc2cc(ccc2c1)-c1cccnc1
BDBM8908 CCOc1ccc2cc(ccc2c1)-c1cccnc1
BDBM8909 N#Cc1ccc2cc(ccc2c1)-c1cccnc1
BDBM8910 COc1ccc2cc(ccc2c1Cl)-c1cccnc1
BDBM8911 COc1ccc2cc(ccc2c1Br)-c1cccnc1
BDBM8912 COc1ccc2c(Cl)c(ccc2c1Cl)-c1cccnc1
BDBM8913 COc1ccc2ccc(-c3cccnc3)c(Cl)c2c1
BDBM8914 COC(=O)c1ccc2cc(ccc2c1)-c1cccnc1
BDBM9460 CCC1(CCC(=O)NC1=O)c1ccc(N)cc1
BDBM9475 O=c1cc(Cn2ccnc2)c2ccc(Oc3ccccc3)cc2o1
BDBM9485 O=c1cc(Cn2ccnc2)c2ccc(OCc3ccccc3)cc2o1
BDBM9920 N#Cc1ccc(cc1)[C@@H]1CCCc2cncn12 |r|
BDBM9921 C1Cc2c(ccc3cccc1c23)-c1cccnc1
BDBM9922 C1Cc2ccc(-c3cccnc3)c3cccc1c23
BDBM13061 N#Cc1ccc(cc1)C(c1ccc(cc1)C#N)n1cncn1
BDBM25817 OC(Cn1cncn1)(Cn1cncn1)c1ccc(F)cc1F
BDBM25439 OC1(CCc2cc(ccc12)-c1ccc(F)cc1)c1ccncc1
BDBM25441 COc1ccc(cc1F)-c1ccc2c(CCC2(O)c2ccncc2)c1
BDBM25442 OC1(CCCc2cc(ccc12)-c1ccc(F)cc1)c1ccncc1
BDBM25443 OC1(CCCc2cc(ccc12)-c1ccc(F)c(F)c1)c1ccncc1
BDBM25444 COc1ccc(cc1F)-c1ccc2c(CCCC2(O)c2ccncc2)c1
BDBM25448 Fc1ccc(cc1)-c1ccc2C(=CCCc2c1)c1ccncc1 |c:12|
BDBM25449 Fc1ccc(cc1F)-c1ccc2C(=CCCc2c1)c1ccncc1 |c:13|
BDBM25450 Oc1ccc(cc1O)-c1ccc2C(=CCCc2c1)c1ccncc1 |c:13|
BDBM25451 Oc1ccc(cc1F)-c1ccc2C(=CCCc2c1)c1ccncc1 |c:13|
BDBM25453 Fc1ccc(cc1)-c1ccc2C(CCc2c1)c1ccncc1
BDBM25454 Fc1ccc(cc1)-c1ccc2C(CCCc2c1)c1ccncc1
BDBM25455 Fc1ccc(cc1F)-c1ccc2C(CCCc2c1)c1ccncc1
BDBM25456 Oc1ccc(cc1O)-c1ccc2C(CCCc2c1)c1ccncc1
BDBM25457 Oc1ccc(cc1F)-c1ccc2C(CCCc2c1)c1ccncc1
BDBM25458 [H][C@@]12CC=C(c3cccnc3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@@H](O)CC[C@]12C |t:3,23|
BDBM24655 C(c1ccccc1)n1cncc1-c1ccccc1
BDBM31768 CC(=O)N1CCN(CC1)c1ccc(OC[C@@H]2CO[C@](Cn3ccnc3)(O2)c2ccc(Cl)cc2Cl)cc1 |r|
BDBM45884 C(c1ccncc1)n1ccnc1
BDBM45885 C(c1cccnc1)n1ccnc1
BDBM50000306 O=C1CCc2cc(ccc2N1)-c1cccnc1
BDBM50008729 Cc1cncn1Cc1ccc(cc1)C#N
BDBM50008733 N#Cc1ccc(Cn2ccnc2)cc1
BDBM50009605 O=C1\C(CCc2ccccc12)=C\c1ccncc1
BDBM50011756 Nc1ccc(cc1)C12CC(C1)C(=O)N(C1CCCCC1)C2=O |(8.24,.27,;6.91,-.5,;6.9,-2.04,;5.55,-2.81,;4.22,-2.02,;4.21,-.47,;5.55,.28,;2.88,-2.79,;1.55,-2.02,;.23,-2.79,;1.57,-3.56,;.23,-4.33,;-1.11,-5.11,;1.55,-5.11,;1.55,-6.65,;2.88,-7.4,;2.88,-8.96,;1.55,-9.71,;.22,-8.94,;.22,-7.4,;2.88,-4.33,;4.22,-5.11,)|
BDBM50011762 Nc1ccc(cc1)C12CC1C(=O)N(CC1CCCCC1)C2=O
BDBM50028166 CC(C)(C(=O)c1cccnc1)c1cccnc1
BDBM50035204 COc1ccc2CCC3C(C3c2c1)c1ccncc1
BDBM50035208 Oc1ccc2CCC3C(C3c2c1)c1ccncc1
BDBM50035209 C1Cc2ccccc2C2C1C2c1ccncc1
BDBM50041335 Oc1ccc2CC(Cc3ccncc3)Cc2c1
BDBM50047262 N#Cc1ccc(cc1)[C@H]1CCCc2cncn12
BDBM50049762 C1Cc2ccccc2C2C1C2c1ccn[nH]1
BDBM50049763 O=C1C(CCc2ccccc12)=Cc1cnc[nH]1 |w:11.13|
BDBM50049764 O=C1\C(CCc2ccccc12)=C\c1cccnn1
BDBM50049766 C1Cc2ccccc2C2C1C2c1ccccc1
BDBM50049768 O=C1\C(CCc2ccccc12)=C\c1cnccn1
BDBM50049774 C1Cc2ccccc2C2C1C2c1cnc[nH]1
BDBM50049776 C1Cc2ccccc2C2C1C2c1cccnc1
BDBM50049778 O=C1C(CCc2ccccc12)=Cc1ccn[nH]1 |w:11.13|
BDBM287639 CCn1c(nc2ccc(cc12)C#N)-c1cnnc(Cl)c1
BDBM50097363 [O-][N+](=O)c1ccc(Cn2ccnc2)c2c1oc1ccccc1c2=O
BDBM50097364 O=c1c2ccccc2oc2cc(Cn3ccnc3)ccc12
BDBM50097365 O=c1c2ccccc2oc2c(ccc(Cn3ccnc3)c12)C#N
BDBM50097370 Brc1ccc(Cn2ccnc2)c2c1oc1ccccc1c2=O
BDBM50097372 COc1ccc2c(c1)oc(-c1ccccc1)c(Cn1ccnc1)c2=O
BDBM50125935 CCOC(=O)c1cncn1[C@H](C)c1ccccc1 |r|
BDBM212442 Cc1nnc2CCc3cc(cc(F)c3-n12)-c1cncc(F)c1C1CC1
BDBM50181473 CC[C@@H]([C@H](C)O)n1ncn(-c2ccc(cc2)N2CCN(CC2)c2ccc(OC[C@@H]3CO[C@](Cn4cncn4)(C3)c3ccc(F)cc3F)cc2)c1=O |r|
BDBM50188085 Fc1ccc(Cn2ccnc2)cc1
BDBM50188087 Cc1ccc(Cn2ccnc2)cc1
BDBM50188088 Brc1ccc(Cn2ccnc2)cc1
BDBM50188097 Clc1ccc(Cn2ccnc2)cc1
BDBM50191597 Brc1ccc(cc1)-c1oc2ccccc2c(=O)c1Cn1ccnc1
BDBM50191598 [O-][N+](=O)c1ccc(cc1)-c1oc2ccccc2c(=O)c1Cn1ccnc1
BDBM50191599 O=c1c(Cn2ccnc2)c(oc2ccccc12)-c1ccccc1
BDBM50191600 COc1ccc(cc1)-c1oc2ccccc2c(=O)c1Cn1ccnc1
BDBM50253370 C(c1ccccc1)c1cc2ccccc2cc1-c1cccnc1
BDBM50253497 COc1ccc2cc(c(Cc3ccccc3)cc2c1)-c1cccnc1
BDBM50253498 COc1ccc(Cc2cc3ccccc3cc2-c2cccnc2)cc1
BDBM50253499 N#Cc1ccc(Cc2cc3ccccc3cc2-c2cccnc2)cc1
BDBM50253545 FC(F)(F)Oc1ccc(Cc2cc3ccccc3cc2-c2cccnc2)cc1
BDBM50253546 COc1ccc(Cc2cc3cc(OC)ccc3cc2-c2cccnc2)cc1
BDBM50253547 COc1ccc(Cc2cc3ccccc3cc2-c2cncc(OC)c2)cc1
BDBM50253548 COc1ccc(Cc2cc3cc(OC)ccc3cc2-c2cncc(OC)c2)cc1
BDBM50253573 COc1cncc(c1)-c1cc2ccc(OC)cc2cc1Cc1ccccc1
BDBM50253574 COc1ccc(Cc2cc3ccccc3cc2-c2cncc3ccccc23)cc1
BDBM50253575 COc1ccc(Cc2cc3cc(OC)ccc3cc2-c2cncc3ccccc23)cc1
BDBM50253576 COc1ccc(cc1)C(=O)c1cc2ccccc2cc1-c1cccnc1
BDBM50253577 COc1ccc(cc1F)C(=O)c1cc2ccccc2cc1-c1cccnc1
BDBM50253609 O=C(c1ccc(cc1)C#N)c1cc2ccccc2cc1-c1cccnc1
BDBM50253610 FC(F)(F)Oc1ccc(cc1)C(=O)c1cc2ccccc2cc1-c1cccnc1
BDBM50253941 [O-][N+](=O)c1ccc(cc1)C(c1coc2ccccc2c1=O)n1ccnc1
BDBM50272251 COc1ccc2cc(c(C)cc2c1)-c1cncc(OC)c1
BDBM50272323 COCc1ccncc1-c1ccc2cc(OC)ccc2c1
BDBM50272365 COc1ccc2cc(ccc2c1)-c1cncc(c1)C(C)O
BDBM50272366 COC(C)c1cncc(c1)-c1ccc2cc(OC)ccc2c1
BDBM50272367 COc1ccc2cc(ccc2c1)-c1cncc(c1)-c1ccccc1
BDBM50272368 COc1ccc2cc(ccc2c1)-c1cncc2ccccc12
BDBM50272369 COc1ccc2cc(c(C)cc2c1)-c1cncc2ccccc12
BDBM50272370 COc1ccc2C=C(C(C)Cc2c1)c1cncc2ccccc12 |c:6|
BDBM50273813 O=C1CCc2cc(ccc2N1)-c1cncc2ccccc12
BDBM50273814 CN1C(=O)CCc2cc(ccc12)-c1cncc2ccccc12
BDBM50272287 COc1ccc2C=C(C(C)Cc2c1)c1cncc(OC)c1 |c:6|
BDBM50272288 CCOc1cncc(c1)-c1ccc2cc(OC)ccc2c1
BDBM50272289 COC(=O)c1cncc(c1)-c1ccc2cc(OC)ccc2c1
BDBM50272290 COc1ccc2cc(ccc2c1)-c1cncc(c1)C(N)=O
BDBM50272291 COc1ccc2cc(ccc2c1)-c1cncc(c1)C(C)=O
BDBM50273675 C1CCc2cc(ccc2C1)-c1cccnc1
BDBM50273676 OC1CCc2cc(ccc2C1)-c1cccnc1
BDBM50273677 COC1CCc2cc(ccc2C1)-c1cccnc1
BDBM50273678 CCOC1CCc2cc(ccc2C1)-c1cccnc1
BDBM50273815 S=C1CCc2cc(ccc2N1)-c1cccnc1
BDBM50273816 Clc1cc(cc2CCC(=S)Nc12)-c1cccnc1
BDBM50273679 N#CC1CCc2cc(ccc2C1)-c1cccnc1
BDBM50273817 O=C1CSc2cc(ccc2N1)-c1cccnc1
BDBM50272318 COc1ccc2cc(ccc2c1)-c1cncc(CC(O)=O)c1
BDBM50272319 COC(=O)Cc1cncc(c1)-c1ccc2cc(OC)ccc2c1
BDBM50272321 COCc1cncc(c1)-c1ccc2cc(OC)ccc2c1
BDBM50272250 COc1ccc2cc(ccc2c1)-c1cncc(OC)c1
BDBM50272320 COc1ccc2cc(ccc2c1)-c1cncc(CO)c1
BDBM50272322 COc1ccc2cc(ccc2c1)-c1cnccc1CO
BDBM50273700 N#CC1=Cc2ccc(cc2CC1)-c1cccnc1 |t:2|
BDBM50273701 CN1CCOc2cc(ccc12)-c1cccnc1
BDBM50273702 C1COc2cc(ccc2O1)-c1cccnc1
BDBM50273703 O=C1CCc2cc(ccc2C1)-c1cccnc1
BDBM50273704 O=C1CCc2cc(ccc12)-c1cccnc1
BDBM50273705 COc1cncc(c1)-c1ccc2CC(=O)CCc2c1
BDBM50273706 O=C1Cc2cc(ccc2N1)-c1cccnc1
BDBM50273776 CN1C(=O)CCc2cc(ccc12)-c1cccnc1
BDBM50273777 CCN1C(=O)CCc2cc(ccc12)-c1cccnc1
BDBM50273778 Clc1cc(cc2CCC(=O)Nc12)-c1cccnc1
BDBM50273779 [O-][N+](=O)c1cc(cc2CCC(=O)Nc12)-c1cccnc1
BDBM50273780 COc1cncc(c1)-c1ccc2NC(=O)CCc2c1
BDBM50273781 COc1cncc(c1)-c1ccc2N(C)C(=O)CCc2c1
BDBM50272194 COc1ccc2cc(c(C)cc2c1)-c1cccnc1
BDBM50272195 COc1ccc2C=C(C(C)Cc2c1)c1cccnc1 |c:6|
BDBM50272245 N#Cc1ccc2C=C(CCc2c1)c1cccnc1 |c:6|
BDBM50272246 COc1ccc2cc(ccc2c1)-c1cnccc1C
BDBM50272247 Cc1ccncc1-c1ccc2cc(ccc2c1)C#N
BDBM50272248 COc1ccc2cc(ccc2c1)-c1cnccc1N
BDBM50272249 COc1ccc2cc(ccc2c1)-c1cncc(O)c1
BDBM50307211 OCc1ccc(Cn2ccnc2)cc1
BDBM50307212 Nc1ccc(Cn2ccnc2)cc1
BDBM50307213 N#Cc1cccc(Cn2ccnc2)c1
BDBM50307214 Fc1cccc(Cn2ccnc2)c1
BDBM50307215 Clc1cccc(Cn2ccnc2)c1
BDBM50307216 Brc1cccc(Cn2ccnc2)c1
BDBM50307217 OCc1cccc(Cn2ccnc2)c1
BDBM50307218 Nc1cccc(Cn2ccnc2)c1
BDBM50307219 COC(=O)CCc1cncn1Cc1ccccc1
BDBM50307220 COC(=O)CCc1cncn1Cc1ccc(cc1)C#N
BDBM50307221 COC(=O)CCc1cncn1Cc1ccc(F)cc1
BDBM50307222 COC(=O)CCc1cncn1Cc1ccc(Cl)cc1
BDBM50307223 COC(=O)CCc1cncn1Cc1ccc(Br)cc1
BDBM50307224 COC(=O)CCc1cncn1Cc1ccc(OC)cc1
BDBM50307225 OCCCc1cncn1Cc1ccccc1
BDBM50307226 OCCCc1cncn1Cc1ccc(cc1)C#N
BDBM50307227 OCCCc1cncn1Cc1ccc(F)cc1
BDBM50307228 OCCCc1cncn1Cc1ccc(Cl)cc1
BDBM50307229 OCCCc1cncn1Cc1ccc(Br)cc1
BDBM50307230 COc1ccc(Cn2cncc2CCCO)cc1
BDBM50307231 N#Cc1ccc(Cn2cncc2-c2ccccc2)cc1
BDBM50307232 Fc1ccc(Cn2cncc2-c2ccccc2)cc1
BDBM50307233 Clc1ccc(Cn2cncc2-c2ccccc2)cc1
BDBM50307234 Brc1ccc(Cn2cncc2-c2ccccc2)cc1
BDBM50307235 COc1ccc(Cn2cncc2-c2ccccc2)cc1
BDBM50307236 COC(=O)OCc1cncn1Cc1ccc(cc1)C#N
BDBM50307237 COC(=O)c1cncn1Cc1ccc(cc1)C#N
BDBM50307238 Brc1cncn1Cc1ccc(cc1)C#N
BDBM50307239 O=Cc1cncn1Cc1ccc(cc1)C#N
BDBM50307240 OCc1cncn1Cc1ccc(cc1)C#N
BDBM50307241 N#Cc1ccc(Cn2cncc2-c2ccncc2)cc1
BDBM50307242 Fc1ccccc1-c1cncn1Cc1ccc(cc1)C#N
BDBM50307243 Cc1ccccc1-c1cncn1Cc1ccc(cc1)C#N
BDBM50307244 Fc1cccc(c1)-c1cncn1Cc1ccc(cc1)C#N
BDBM50307245 Cc1cccc(c1)-c1cncn1Cc1ccc(cc1)C#N
BDBM50307246 Fc1ccc(cc1)-c1cncn1Cc1ccc(cc1)C#N
BDBM50307247 Cc1ccc(cc1)-c1cncn1Cc1ccc(cc1)C#N
BDBM50318616 O=c1c2ccccc2oc2c(Cn3ccnc3)cccc12
BDBM50318619 O=c1c2ccccc2oc2cccc(Cn3ccnc3)c12
BDBM50318622 O=c1c2ccccc2oc2ccc(Cn3ccnc3)cc12
BDBM50322783 Nc1cccc(c1)-c1ccc(Cc2ccncc2)cc1
BDBM50322784 [#6]\[#6](-[#6])=[#6](/c1ccncc1)-c1ccc(cc1)-c1cccc(-[#7])c1
BDBM50322785 Nc1ccc(cc1N)-c1ccc(Cc2ccncc2)cc1
BDBM50322786 [#6]\[#6](-[#6])=[#6](/c1ccncc1)-c1ccc(cc1)-c1ccc(-[#7])c(-[#7])c1
BDBM50322787 [#6]\[#6](-[#6])=[#6](/c1ccncc1)-c1ccc(cc1)-c1ccc2cc(-[#8])ccc2c1
BDBM50323347 CC(C)CC1n2cncc2CN(C2CC2)S1(=O)=O
BDBM50323348 CC(C)CC1n2cncc2CN(CC2CC2)S1(=O)=O
BDBM50322789 Oc1cccc(c1)-c1ccc(Cc2ccncc2)cc1
BDBM50322790 [#6]\[#6](-[#6])=[#6](/c1ccncc1)-c1ccc(cc1)-c1cccc(-[#8])c1
BDBM50322791 Oc1ccc(cc1F)-c1ccc(Cc2ccncc2)cc1
BDBM50322792 [#6]\[#6](-[#6])=[#6](/c1ccncc1)-c1ccc(cc1)-c1ccc(-[#8])c(F)c1
BDBM50322793 Oc1ccc(cc1O)-c1ccc(Cc2ccncc2)cc1
BDBM50322794 [#6]\[#6](-[#6])=[#6](/c1ccncc1)-c1ccc(cc1)-c1ccc(-[#8])c(-[#8])c1
BDBM50324611 OC(c1ccncc1)c1ccc(cc1)-c1ccc(O)cc1
BDBM50324614 CC(=O)Nc1cccc(c1)-c1ccc(Cc2ccncc2)cc1
BDBM50324617 Fc1ccc(cc1F)-c1ccc(Cc2ccncc2)cc1
BDBM50324612 Nc1ccc(cc1)-c1ccc(Cc2ccncc2)cc1
BDBM50324616 Fc1cccc(c1)-c1ccc(Cc2ccncc2)cc1
BDBM50324623 C(c1ccncc1)c1ccc(cc1)-c1ccsc1
BDBM50324624 C(c1ccncc1)c1ccc(cc1)-c1cccs1
BDBM50324625 C(c1ccncc1)c1ccc(cc1)-c1ccc2[nH]ccc2c1
BDBM50324627 Oc1ccc2cc(ccc2c1)-c1ccc(Cc2ccncc2)cc1
BDBM50323342 CC(C)CC1n2cncc2CN(Cc2ccc(F)cc2)S1(=O)=O
BDBM50323343 CC(C)CC1n2cncc2CN(Cc2ccc(Cl)cc2)S1(=O)=O
BDBM50323344 CC(C)CC1n2cncc2CN(Cc2ccccc2)S1(=O)=O
BDBM50323345 CC(C)CC1n2cncc2CN(Cc2ccc(OC(F)(F)F)cc2)S1(=O)=O
BDBM50323346 CC(C)CC1n2cncc2CN(Cc2ccc(cc2)C(F)(F)F)S1(=O)=O
BDBM50323349 CC(C)CC1n2cncc2CN(Cc2cccs2)S1(=O)=O
BDBM50323350 CC(C)CC1n2cncc2CN(C2(CC2)c2ccc(Cl)cc2)S1(=O)=O
BDBM50323351 CC(C)CC1n2cncc2CN([C@@H](C)c2ccc(Cl)cc2)S1(=O)=O |r|
BDBM50323352 CC(C)CC1n2cncc2CN([C@H](C)c2ccc(Cl)cc2)S1(=O)=O |r|
BDBM50323353 C[C@H](N1Cc2cncn2C(CC(C)(C)O)S1(=O)=O)c1ccc(Cl)cc1 |r|
BDBM50323354 C[C@H](N1Cc2cncn2C(CC2(C)COC2)S1(=O)=O)c1ccc(Cl)cc1 |r|
BDBM50323355 COC(C)(C)CC1n2cncc2CN([C@@H](C)c2ccc(Cl)cc2)S1(=O)=O |r|
BDBM50323356 CC(C)OCC1n2cncc2CN([C@@H](C)c2ccc(Cl)cc2)S1(=O)=O |r|
BDBM50323357 C[C@H](N1Cc2cncn2C(CC2CC2)S1(=O)=O)c1ccc(Cl)cc1 |r|
BDBM50323358 C[C@H](N1Cc2cncn2C(C[C@@H](O)c2ccccc2)S1(=O)=O)c1ccc(Cl)cc1 |r|
BDBM50323359 C[C@H](N1Cc2cncn2C(C[C@H](O)c2ccccc2)S1(=O)=O)c1ccc(Cl)cc1 |r|
BDBM50323360 O=C1C(c2ccc(cc2)C#N)n2cncc2CN1Cc1ccccc1
BDBM50339641 Clc1ccc(COc2ccc3c(Cn4ccnc4)cc(=O)oc3c2)cc1
BDBM50339642 COc1ccc(COc2ccc3c(Cn4ccnc4)cc(=O)oc3c2)cc1
BDBM50339643 FC(F)(F)Oc1ccc(COc2ccc3c(Cn4ccnc4)cc(=O)oc3c2)cc1
BDBM50339644 Fc1cc(F)cc(COc2ccc3c(Cn4ccnc4)cc(=O)oc3c2)c1
BDBM50339645 Fc1ccc(COc2ccc3c(Cn4ccnc4)cc(=O)oc3c2)cc1F
BDBM50339655 Fc1ccc(Oc2ccc3c(Cn4ccnc4)cc(=O)oc3c2)cc1F
BDBM50339664 Cc1cccc(COc2ccc3c(Cn4ccnc4)cc(=O)oc3c2)c1
BDBM50339665 Fc1cccc(COc2ccc3c(Cn4ccnc4)cc(=O)oc3c2)c1
BDBM50339666 Clc1cccc(COc2ccc3c(Cn4ccnc4)cc(=O)oc3c2)c1
BDBM50339667 FC(F)(F)c1cccc(COc2ccc3c(Cn4ccnc4)cc(=O)oc3c2)c1
BDBM50339668 FC(F)(F)Oc1cccc(COc2ccc3c(Cn4ccnc4)cc(=O)oc3c2)c1
BDBM50339669 [O-][N+](=O)c1cccc(COc2ccc3c(Cn4ccnc4)cc(=O)oc3c2)c1
BDBM50335360 C(c1ccc(nc1)-c1ccccc1)n1ccnc1
BDBM50335361 Cc1cc(C)cc(Cn2cnc3ccccc23)c1
BDBM50335362 Cc1cccc(Cn2cnc3ccccc23)c1
BDBM50341486 S=C1CCc2cc(cc3CCN1c23)-c1cccnc1
BDBM50341473 O=C1CCc2cc(cc3CCN1c23)-c1cncc(c1)-c1ccccc1
BDBM50341474 Fc1ccccc1-c1cncc(c1)-c1cc2CCN3c2c(CCC3=O)c1
BDBM50341475 Fc1cccc(c1)-c1cncc(c1)-c1cc2CCN3c2c(CCC3=O)c1
BDBM50341476 Fc1ccc(cc1)-c1cncc(c1)-c1cc2CCN3c2c(CCC3=O)c1
BDBM50341477 Fc1ccc(F)c(c1)-c1cncc(c1)-c1cc2CCN3c2c(CCC3=O)c1
BDBM50341478 Fc1ccc(cc1F)-c1cncc(c1)-c1cc2CCN3c2c(CCC3=O)c1
BDBM50341479 Fc1cc(F)cc(c1)-c1cncc(c1)-c1cc2CCN3c2c(CCC3=O)c1
BDBM50341480 COc1ccccc1-c1cncc(c1)-c1cc2CCN3c2c(CCC3=O)c1
BDBM50341481 COc1cccc(c1)-c1cncc(c1)-c1cc2CCN3c2c(CCC3=O)c1
BDBM50341482 COc1ccc(cc1)-c1cncc(c1)-c1cc2CCN3c2c(CCC3=O)c1
BDBM50341483 Oc1cccc(c1)-c1cncc(c1)-c1cc2CCN3c2c(CCC3=O)c1
BDBM50341484 FC(F)(F)Oc1cccc(c1)-c1cncc(c1)-c1cc2CCN3c2c(CCC3=O)c1
BDBM50341485 FC(F)(F)c1cccc(c1)-c1cncc(c1)-c1cc2CCN3c2c(CCC3=O)c1
BDBM50341460 O=C1CCc2cc(cc3CCN1c23)-c1cccnc1
BDBM50341461 O=C1CCc2cc(cc3CCCN1c23)-c1cccnc1
BDBM50341466 Oc1cncc(c1)-c1cc2CCN3c2c(CCC3=O)c1
BDBM50341467 Fc1cncc(c1)-c1cc2CCN3c2c(CCC3=O)c1
BDBM50341471 O=C1CCc2cc(cc3CCN1c23)-c1cncnc1
BDBM50341472 O=C1CCc2cc(cc3CCN1c23)-n1ccnc1
BDBM50341462 COc1cncc(c1)-c1cc2CCN3c2c(CCC3=O)c1
BDBM50341463 COc1cncc(c1)-c1cc2CCCN3C(=O)CCc(c1)c23
BDBM50341464 CCOc1cncc(c1)-c1cc2CCN3c2c(CCC3=O)c1
BDBM50341465 CC(C)Oc1cncc(c1)-c1cc2CCN3c2c(CCC3=O)c1
BDBM50341468 FC(F)(F)c1cncc(c1)-c1cc2CCN3c2c(CCC3=O)c1
BDBM50341469 O=C1CCc2cc(cc3CCN1c23)-c1cncc2ccccc12
BDBM50341470 O=C1CCc2cc(cc3CCCN1c23)-c1cncc2ccccc12
BDBM50334186 Fc1cc(F)c(cc1F)C(=O)Nc1cccnc1
BDBM50334187 Fc1ccc(cc1F)C(=O)Nc1cccnc1
BDBM50334188 [O-][N+](=O)c1ccc(cc1)C(=O)Nc1cccnc1
BDBM50334189 O=C(Nc1cccnc1)c1ccc(cc1)C#N
BDBM50334190 Brc1ccc(cc1)C(=O)Nc1cccnc1
BDBM50334191 Clc1ccc(cc1)C(=O)Nc1cccnc1
BDBM50334192 Fc1ccc(cc1)C(=O)Nc1cccnc1
BDBM50335346 C(c1ccccc1-c1ccccc1)n1ccnc1
BDBM50335347 C(c1cc(cs1)-c1ccccc1)n1ccnc1
BDBM50335348 Cc1cc(C)c(Cn2ccnc2)c(C)c1
BDBM50335349 Cc1cc(C)cc(Cn2ccnc2)c1
BDBM50335350 C(c1ccc(cc1)-c1ccccc1)n1ccnc1
BDBM50335351 C(c1ccc(s1)-c1ccccc1)n1ccnc1
BDBM50335352 C(c1cccc(c1)-c1ccccc1)n1ccnc1
BDBM50335353 C(c1ccc(o1)-c1ccccc1)n1ccnc1
BDBM50335354 Cc1cccc(Cn2ccnc2)c1
BDBM50335355 Cc1ccccc1Cn1ccnc1
BDBM50335356 C(n1cnc2ccccc12)C12CC3CC(CC(C3)C1)C2 |THB:15:14:11:17.16.18,15:16:13.14.19:11,18:16:13:19.10.11,18:10:13:17.15.16,0:10:13:17.15.16|
BDBM50335357 C(CC(c1ccccc1)(c1ccccc1)c1ccccc1)n1ccnc1
BDBM50335358 Clc1ccc(Cn2cnc3ccccc23)cc1
BDBM50335359 C(c1cc(cc(c1)-c1ccccc1)-c1ccccc1)n1ccnc1
BDBM50335363 C(c1ccc(cc1)-c1ccccc1)n1cnc2ccccc12
BDBM50335364 Cc1ccccc1Cn1cnc2ccccc12
BDBM50335365 C(c1cccc(c1)-c1ccccc1)n1cnc2ccccc12
BDBM50335366 Cc1ccc(Cn2cnc3ccccc23)cc1
BDBM50335367 Cc1cc(C)c(Cn2cnc3ccccc23)c(C)c1
BDBM50335368 Cc1c(C)c(C)c(Cn2cnc3ccccc23)c(C)c1C
BDBM50335369 C(c1ccccc1-c1ccccc1)n1cnc2ccccc12
BDBM50335370 C(c1cc(cc(c1)-c1ccccc1)-c1ccccc1)n1cnc2ccccc12
BDBM50335371 c1nc2ccccc2n1C(c1ccccc1)(c1ccccc1)c1ccccc1
BDBM50335372 C(n1cnc2ccccc12)C(c1ccccc1)(c1ccccc1)c1ccccc1
BDBM50335373 C(CC(c1ccccc1)(c1ccccc1)c1ccccc1)n1cnc2ccccc12
BDBM50335342 c1cn(cn1)C(c1ccccc1)(c1ccccc1)c1ccccc1
BDBM50335343 C(n1ccnc1)C(c1ccccc1)(c1ccccc1)c1ccccc1
BDBM50335344 Cc1c(C)c(C)c(Cn2ccnc2)c(C)c1C
BDBM50335345 C(n1ccnc1)C12CC3CC(CC(C3)C1)C2 |THB:11:10:7:13.12.14,11:12:9.10.15:7,14:12:9:15.6.7,14:6:9:13.11.12,0:6:9:13.11.12|
BDBM50376262 Cc1ccc(cc1)C(=O)Nc1cccnc1
BDBM50378940 C(c1ccc(nc1)-c1cccnc1)n1ccnc1
BDBM50378941 C(c1ccc(nc1)-c1ccncc1)n1ccnc1
BDBM50378937 C(c1ccc(nc1)-c1cccc2ccccc12)n1ccnc1
BDBM50378938 C(c1ccc(nc1)-c1ccc2ccccc2c1)n1ccnc1
BDBM50378939 C(c1cnc(-c2ccccc2)c(c1)-c1ccccc1)n1ccnc1
BDBM50378942 C(c1ccc(nc1)-c1cncc2ccccc12)n1ccnc1
BDBM50378780 Cn1nnc2ccc(cc12)[C@H](c1ccc(Cl)cc1)n1cncn1 |r|
BDBM50378943 C(c1ccc(nc1)-c1cccs1)n1ccnc1
BDBM50378944 C(c1ccc(nc1)-c1ccsc1)n1ccnc1
BDBM50378945 Clc1ccc(s1)-c1ccc(Cn2ccnc2)cn1
BDBM50378946 O=Cc1ccc(s1)-c1ccc(Cn2ccnc2)cn1
BDBM50378947 Clc1ncc(Cn2ccnc2)cc1-c1cccs1
BDBM50378948 C(c1cccnc1-c1cccs1)n1ccnc1
BDBM50378949 C(c1ccc(nc1)-c1cc2ccccc2s1)n1ccnc1
BDBM50378950 C(c1ccc(nc1)-c1csc2ccccc12)n1ccnc1
BDBM50378951 C(c1ccc(nc1)-c1ccco1)n1ccnc1
BDBM50378952 C(c1ccc(nc1)-c1ccoc1)n1ccnc1
BDBM50378953 C(c1ccc(nc1)-c1cc2ccccc2o1)n1ccnc1
BDBM50378954 C(c1cnc(-c2ccco2)c(c1)-c1ccco1)n1ccnc1
BDBM50378955 N#Cc1cccc(c1)-c1ccc(Cn2ccnc2)cn1
BDBM50378956 Oc1ccc(cc1F)-c1ccc(Cn2ccnc2)cn1
BDBM50378957 COc1ccc(cn1)-c1ccc(Cn2ccnc2)cn1
BDBM50378958 N#Cc1ncccc1Cn1ccnc1
BDBM50378959 Brc1ccc(Cn2ccnc2)cn1
BDBM50378960 Brc1ncccc1Cn1ccnc1
BDBM50378961 Clc1ncc(Cn2ccnc2)cc1Br
BDBM50378962 Fc1ccccc1-c1ccc(Cn2ccnc2)cn1
BDBM50378963 Fc1cccc(c1)-c1ccc(Cn2ccnc2)cn1
BDBM50378964 Fc1ccc(cc1)-c1ccc(Cn2ccnc2)cn1
BDBM50378965 Fc1ccc(cc1F)-c1ccc(Cn2ccnc2)cn1
BDBM50378966 COc1ccccc1-c1ccc(Cn2ccnc2)cn1
BDBM50378967 COc1ccc(cc1)-c1ccc(Cn2ccnc2)cn1
BDBM50378968 COc1ccc(cc1OC)-c1ccc(Cn2ccnc2)cn1
BDBM50378969 Nc1ccccc1-c1ccc(Cn2ccnc2)cn1
BDBM50378970 Nc1cccc(c1)-c1ccc(Cn2ccnc2)cn1
BDBM50378971 Nc1ccc(cc1)-c1ccc(Cn2ccnc2)cn1
BDBM50378972 Cc1ccc(cc1N)-c1ccc(Cn2ccnc2)cn1
BDBM50378973 N#Cc1ccc(cc1)-c1ccc(Cn2ccnc2)cn1
BDBM50378974 O=Cc1ccc(cc1)-c1ccc(Cn2ccnc2)cn1
BDBM50395448 COc1cccc(c1)C(c1cc2CCN3c2c(CCC3=O)c1)n1ccnc1
BDBM50395449 O=C1CCc2cc(cc3CCN1c23)C(c1ccc(cc1)C#N)n1ccnc1
BDBM50395450 O=C1CCc2cc(cc3CCN1c23)C(c1ccccc1)n1ccnc1
BDBM50395451 O=C1CCc2cc(cc3CCN1c23)C(c1ccco1)n1ccnc1
BDBM50395452 Fc1ccccc1C(c1cc2CCN3c2c(CCC3=O)c1)n1ccnc1
BDBM50395453 Fc1ccc(cc1)C(c1cc2CCN3c2c(CCC3=O)c1)n1ccnc1
BDBM50395454 Fc1cccc(c1)C(c1cc2CCN3c2c(CCC3=O)c1)n1ccnc1
BDBM50395455 O=C1CCc2cc(cc3CCN1c23)C(C1CC1)n1ccnc1
BDBM50395456 O=C1CCc2cc(cc3CCN1c23)C(c1cccs1)n1ccnc1
BDBM50395458 CCC(c1cc2CCN3c2c(CCC3=O)c1)n1ccnc1
BDBM50395459 O=C1CCc2cc(cc3CCN1c23)C(C1CCC1)n1ccnc1
BDBM50395460 CC(C)C(c1cc2CCN3c2c(CCC3=O)c1)n1ccnc1
BDBM50395461 CC(c1cc2CCN3c2c(CCC3=O)c1)(n1ccnc1)n1ccnc1
BDBM50395462 O=C1CCc2cc(cc3CCN1c23)C(c1cccc(c1)C#N)n1ccnc1
BDBM50395447 C=C(c1cc2CCN3c2c(CCC3=O)c1)n1ccnc1
BDBM50395604 O=C1CCc2cc(cc(-c3ccsc3)c2N1)-c1cccnc1
BDBM50395605 O=C1CCc2cc(cc(c2N1)-c1cccnc1)-c1cccnc1
BDBM50395606 O=C1CCc2cc(cc(c2N1)-c1ccccc1)-c1cccnc1
BDBM50395608 CN1C(=O)CCc2cc(c(OCc3ccccc3)cc12)-c1cccnc1
BDBM50395609 O=C1CCc2cc(c(OCc3ccccc3)cc2N1)-c1cccnc1
BDBM50395610 CN1C(=O)CCc2cc(c(OC3CCCC3)cc12)-c1cccnc1
BDBM50395611 O=C1CCc2cc(c(OC3CCCC3)cc2N1)-c1cccnc1
BDBM50395612 CCOc1cc2N(C)C(=O)CCc2cc1-c1cccnc1
BDBM50395446 COc1ccc(cc1)C(c1cc2CCN3c2c(CCC3=O)c1)n1ccnc1
BDBM50395457 CC(c1cc2CCN3c2c(CCC3=O)c1)n1ccnc1
BDBM50395607 Brc1cc(cc2CCC(=O)Nc12)-c1cccnc1
BDBM50395613 CCOc1cc2NC(=O)CCc2cc1-c1cccnc1
BDBM50395614 COc1cc2N(C)C(=O)CCc2cc1-c1cccnc1
BDBM50395615 COc1cc2NC(=O)CCc2cc1-c1cccnc1
BDBM50395616 Oc1cc2NC(=O)CCc2cc1-c1cccnc1
BDBM50425445 O=C1CCc2cc(Cc3ccncc3)cc3CCN1c23
BDBM50425454 O=C1CCc2cc(Cc3cccnc3)cc3CCN1c23
BDBM50426554 CC1(C)CC(c2cn[nH]c12)c1ccc(cc1F)C#N
BDBM50426555 CC1(C)C[C@@H](c2cn[nH]c12)c1ccc(cc1)C#N |r|
BDBM50425444 C=C(c1ccncc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425446 OC(c1ccncc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425447 Fc1ccc(cc1)C(c1cccnc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425448 Clc1cccc(c1)C(c1cccnc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425449 Cc1cccc(c1)C(c1cccnc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425450 COc1ccccc1C(c1cccnc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425451 O=C1CCc2cc(cc3CCN1c23)C(c1ccccc1)c1cccnc1
BDBM50425452 CC(c1cccnc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425453 C=C(c1cccnc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425455 OC(c1cccnc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425456 COc1ccc(cc1)C(c1ccncc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425457 COc1cccc(c1)C(c1ccncc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425458 COc1ccccc1C(c1ccncc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425459 O=C1CCc2cc(cc3CCN1c23)C(c1ccccc1)c1ccncc1
BDBM50425460 OC(c1ccccc1)(c1ccncc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425461 O=C1CCc2cc(cc3CCN1c23)C(C1CCCCC1)c1ccncc1
BDBM50425462 CC(C)C(c1ccncc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425463 CC(c1ccncc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425464 FC(F)(F)c1cc(cc(c1)C(F)(F)F)C(c1ccncc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425465 Cc1cccc(c1)C(c1ccncc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425466 Clc1ccc(cc1)C(c1ccncc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425467 Clc1cccc(c1)C(c1ccncc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425468 Fc1ccc(cc1)C(c1ccncc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50425469 Fc1cccc(c1)C(c1ccncc1)c1cc2CCN3c2c(CCC3=O)c1
BDBM50428338 Fc1ccc(Cn2ccnc2)cn1
BDBM50428330 CCc1c(F)cncc1-c1cc2CCc3nnc(C)n3-c2c(F)c1F
BDBM50428331 Cc1nnc2CCc3cc(cc(F)c3-n12)-c1cncc(F)c1
BDBM50428332 COc1c(C)cncc1-c1cc2CCc3nnc(C)n3-c2cc1F
BDBM50428333 Cc1nnc2CCc3cc(c(Cl)cc3-n12)-c1cncc2ccccc12
BDBM50428334 Cc1nnc2CCc3cc(cc(Cl)c3-n12)-c1cnccc1C1CC1
BDBM50428335 Cc1nnc2CCc3cc(cc(Cl)c3-n12)-c1cnccc1C(F)(F)F
BDBM50428336 COC(C)(C)c1cncc(c1)-c1ccc-2c(CCc3nnc(C)n-23)c1
BDBM50428337 Cc1nnc2CCc3cc(ccc3-n12)-c1cncc2ccccc12
BDBM50429513 Nc1ccc(Cn2ccnc2)c2c1oc1ccccc1c2=O
BDBM50429514 Oc1ccc(Cn2ccnc2)c2c1oc1ccccc1c2=O
BDBM50429515 O=c1c2ccccc2oc2c(OC3CCCC3)ccc(Cn3ccnc3)c12
BDBM50429516 O=c1c2ccccc2oc2c(OCC3CC3)ccc(Cn3ccnc3)c12
BDBM50429517 CCC(C)Oc1ccc(Cn2ccnc2)c2c1oc1ccccc1c2=O
BDBM50429518 CC(C)CCOc1ccc(Cn2ccnc2)c2c1oc1ccccc1c2=O
BDBM50429519 CC(C)Oc1ccc(Cn2ccnc2)c2c1oc1ccccc1c2=O
BDBM50429520 CCOc1ccc(Cn2ccnc2)c2c1oc1ccccc1c2=O
BDBM50429521 COc1ccc(Cn2ccnc2)c2c1oc1ccccc1c2=O
BDBM50429522 O=c1c2ccccc2oc2c(ccc(Cn3ccnc3)c12)-c1ccccc1
BDBM50429523 Ic1ccc(Cn2ccnc2)c2c1oc1ccccc1c2=O
BDBM50429524 Clc1ccc(Cn2ccnc2)c2c1oc1ccccc1c2=O
BDBM50444548 Cc1cc(ccc1[C@H]1CCc2cncn12)C#N |r|
BDBM50444549 Fc1cc(ccc1[C@H]1CCc2cncn12)C#N |r|
BDBM50444550 Fc1ccc(cc1)-c1cc(ccc1[C@H]1CCCCc2cncn12)C#N |r|
BDBM50444552 Fc1ccc(COC(=O)[C@@]2(CCc3cncn23)c2ccc(cc2Cl)C#N)cc1 |r|
BDBM50444553 COC(=O)[C@@]1(CCc2cncn12)c1ccc(cc1Cl)C#N |r|
BDBM50444554 Brc1cc(ccc1[C@H]1CCc2cncn12)C#N |r|
BDBM50444555 COc1cc(ccc1[C@H]1CCc2cncn12)C#N |r|
BDBM50444566 COc1cc(ccc1C1CCCc2cncn12)C#N
BDBM50444551 Fc1cc(ccc1[C@H]1CCCCc2cncn12)C#N |r|
BDBM50444556 Clc1cc(ccc1[C@H]1CCc2cncn12)C#N |r|
BDBM50444557 Fc1ccc(cc1)-c1ccccc1[C@H]1CCc2cncn12 |r|
BDBM50444558 C1Cc2cncn2[C@H]1c1ccccc1-c1ccccc1 |r|
BDBM50444559 COc1cc(ccc1[C@]1(CCc2cncn12)C(=O)N(C)Cc1ccc(F)cc1)C#N |r|
BDBM50444560 COC(=O)[C@@]1(CCc2cncn12)c1ccc(cc1F)C#N |r|
BDBM50444561 COC(=O)[C@@]1(CCc2cncn12)c1ccc(cc1OC)C#N |r|
BDBM50444562 COc1cc(ccc1[C@H]1CCCCc2cncn12)C#N |r|
BDBM50444563 Clc1cc(ccc1[C@H]1CCCCc2cncn12)C#N |r|
BDBM50444564 C1CCc2cncn2[C@H](C1)c1ccccc1-c1ccccc1 |r|
BDBM50444565 Fc1ccc(cc1)-c1ccccc1[C@H]1CCCCc2cncn12 |r|
BDBM50439078 CC(c1ccc(nc1)-c1ccsc1)n1ccnc1
BDBM50439083 CCC(c1ccc(nc1)-c1ccccc1)n1ccnc1
BDBM50439084 CC(c1ccc(nc1)-c1ccccc1)n1ccnc1
BDBM50438991 Oc1ccc2ccc(-c3cncnc3)c(Cl)c2c1
BDBM50438992 COc1ccc2ccc(-c3cncnc3)c(Cl)c2c1
BDBM50438993 Oc1ccc2ccc(-c3cncc(O)c3)c(Cl)c2c1
BDBM50438994 COc1ccc2ccc(-c3cncc(O)c3)c(Cl)c2c1
BDBM50438995 COc1cncc(c1)-c1ccc2ccc(O)cc2c1Cl
BDBM50438997 Oc1ccc2ccc(-c3cncc(F)c3)c(Cl)c2c1
BDBM50438998 COc1ccc2ccc(-c3cncc(F)c3)c(Cl)c2c1
BDBM50438999 Oc1ccc2ccc(-c3cccnc3)c(Cl)c2c1F
BDBM50439000 COc1ccc2ccc(-c3cccnc3)c(Cl)c2c1F
BDBM50439001 Oc1ccc2ccc(-c3cccnc3)c(F)c2c1
BDBM50439002 COc1ccc2ccc(-c3cccnc3)c(F)c2c1
BDBM50439003 Oc1ccc2ccc(-c3cccnc3)c(Cl)c2c1
BDBM50439004 COc1ccc2ccc(cc2c1)-c1cccnc1
BDBM50439057 Cc1cncc(Cc2ccc(nc2)-c2ccccc2)c1
BDBM50439058 N(c1cccnc1)c1ccc(nc1)-c1ccccc1
BDBM50439059 O(c1cccnc1)c1ccc(nc1)-c1ccccc1
BDBM50439061 Oc1cncc(Cc2ccc(nc2)-c2ccccc2)c1
BDBM50439064 Fc1cncc(Cc2ccc(nc2)-c2ccccc2)c1
BDBM50439066 Cc1ccncc1Cc1ccc(nc1)-c1ccccc1
BDBM50439067 C(c1ccc(nc1)-c1ccccc1)c1cncnc1
BDBM50439069 C(c1ccncc1)c1ccc(nc1)-c1ccccc1
BDBM50439070 C(c1cccnc1)c1ccc(nc1)-c1ccccc1
BDBM50439072 C(c1cnc(nc1)-c1ccccc1)n1ccnc1
BDBM50439073 C(c1cnc(cn1)-c1ccccc1)n1ccnc1
BDBM50439074 C(c1ccc(nn1)-c1ccccc1)n1ccnc1
BDBM50439077 C1CC1C(c1ccc(nc1)-c1ccsc1)n1ccnc1
BDBM50444567 Cc1cc(ccc1C1CCCc2cncn12)C#N
BDBM50444568 Clc1cc(ccc1C1CCCc2cncn12)C#N
BDBM50444569 Fc1cc(ccc1[C@H]1CCCc2cncn12)C#N |r|
BDBM50444570 C1C[C@H](c2ccccc2-c2ccccc2)n2cncc2C1 |r|
BDBM50444571 N#Cc1ccc([C@H]2CCCc3cncn23)c(c1)-c1ccccc1 |r|
BDBM50438989 Oc1ccc2ccc(c(Cl)c2c1)-c1cncc2ccccc12
BDBM50438990 COc1ccc2ccc(c(Cl)c2c1)-c1cncc2ccccc12
BDBM50439060 C(c1ccc(nc1)-c1ccccc1)c1cncc(c1)-c1ccccc1
BDBM50439062 COc1cncc(Cc2ccc(nc2)-c2ccccc2)c1
BDBM50439063 FC(F)(F)c1cncc(Cc2ccc(nc2)-c2ccccc2)c1
BDBM50439065 NC(=O)c1cncc(Cc2ccc(nc2)-c2ccccc2)c1
BDBM50439068 C(c1ccc(nc1)-c1ccccc1)c1cncc2ccccc12
BDBM50439071 C(c1cnc(-c2ccccc2)c2ccccc12)n1ccnc1
BDBM50439075 C1CC1C(c1ccc(nc1)-c1cccc2ccccc12)n1ccnc1
BDBM50438996 COc1ccc2ccc(-c3cncc(OC)c3)c(Cl)c2c1
BDBM50439076 CC(c1ccc(nc1)-c1cccc2ccccc12)n1ccnc1
BDBM50439079 c1cn(cn1)C(c1ccccc1)c1ccc(nc1)-c1ccccc1
BDBM50439080 c1coc(c1)C(c1ccc(nc1)-c1ccccc1)n1ccnc1
BDBM50439081 CC(C)C(c1ccc(nc1)-c1ccccc1)n1ccnc1
BDBM50439082 C1CC1C(c1ccc(nc1)-c1ccccc1)n1ccnc1
BDBM50019867 CC(=O)N1CCc2cc(ccc12)-c1cnccc1C
BDBM50019868 CCC(=O)N1CCc2cc(ccc12)-c1cnccc1C
BDBM50019869 CC(=O)n1ccc2cc(ccc12)-c1cccnc1
BDBM50019870 CCC(=O)n1ccc2cc(ccc12)-c1cccnc1
BDBM50019871 CC(=O)n1ccc2cc(ccc12)-c1cncc2ccccc12
BDBM50019872 CC(=O)n1ccc2cc(ccc12)-c1cnccc1C
BDBM50019873 CCC(=O)n1ccc2cc(ccc12)-c1cnccc1C
BDBM50019874 CC(=O)N1CCc2cc(ccc12)-c1cccnc1
BDBM50019875 CCC(=O)N1CCc2cc(ccc12)-c1cccnc1
BDBM50019876 O=C(C1CC1)N1CCc2cc(ccc12)-c1cccnc1
BDBM50019877 CC(C)C(=O)N1CCc2cc(ccc12)-c1cccnc1
BDBM50019880 ClCCC(=O)N1CCc2cc(ccc12)-c1cccnc1
BDBM50019881 Fc1ccc(cc1)C(=O)N1CCc2cc(ccc12)-c1cccnc1
BDBM50019882 COc1ccc(cc1)C(=O)N1CCc2cc(ccc12)-c1cccnc1
BDBM50019883 COc1cccc(c1)C(=O)N1CCc2cc(ccc12)-c1cccnc1
BDBM50019884 O=C(N1CCc2cc(ccc12)-c1cccnc1)c1cccs1
BDBM50019885 O=C(Cc1ccccc1)N1CCc2cc(ccc12)-c1cccnc1
BDBM50019886 CC(=O)N1CCc2cc(ccc12)-c1cncc2ccccc12
BDBM50019887 CCC(=O)N1CCc2cc(ccc12)-c1cncc2ccccc12
BDBM50019888 O=C(C1CC1)N1CCc2cc(ccc12)-c1cncc2ccccc12
BDBM50019889 CC(C)C(=O)N1CCc2cc(ccc12)-c1cncc2ccccc12
BDBM50019890 CC(=O)N1CCc2cc(ccc12)-c1cncc(c1)C#N
BDBM50019891 CC(=O)N1CCc2cc(ccc12)-c1cncc(F)c1
BDBM50019892 CC(=O)N1CCc2cc(ccc12)-c1cncc(c1)C(C)=O
BDBM50019893 COc1cncc(c1)-c1ccc2N(CCc2c1)C(C)=O
BDBM50019894 CC(O)c1cncc(c1)-c1ccc2N(CCc2c1)C(C)=O
BDBM50019895 CC(=O)N1CCc2cc(ccc12)-c1cncc(c1)-c1ccccc1
BDBM50062547 O=C1Nc2ccc(cc2CO1)-c1cncc2ccccc12
BDBM50062548 O=C1NCc2cc(ccc2N1)-c1cccnc1
BDBM50062545 O=C1CNc2cc(ccc2N1)-c1cncc2ccccc12
BDBM50062550 CN1c2ccc(cc2OCS1(=O)=O)-c1cccnc1
BDBM50082289 CN(C)C(=O)c1ccc(c(OCCc2ccccc2)c1)-c1cccnc1
BDBM50044130 c1ncn2c(cccc12)-c1cccc2ccccc12
BDBM50044134 Cn1c2ccc(cc2oc1=O)-c1cncc(c1)C(O)C(F)(F)F
BDBM50062537 O=C1COc2cc(ccc2N1)-c1cccnc1
BDBM50062542 O=C1CNc2cc(ccc2N1)-c1cccnc1
BDBM50062544 CN1CC(=O)Nc2ccc(cc12)-c1cccnc1
BDBM50038208 FC(F)(F)Oc1ccc(COc2ccc(cc2)C(=O)Cn2ccnc2)cc1
BDBM50044141 CCOC(=O)c1cncn1C1c2ccccc2C(=O)OC1(C)C
BDBM50038209 O=C(Cn1ccnc1)c1ccc(OCc2cccc(c2)C#N)cc1
BDBM50038285 [O-][N+](=O)c1cccc(COc2ccc(cc2)C(=O)Cn2ccnc2)c1
BDBM191959 OC1CCCc2c1cncc2-c1ccc(cc1)C(F)(F)F
BDBM191962 CC1(C)Cc2c(cncc2-c2ccc(c(F)c2)C(F)(F)F)C1O
BDBM191943 CC1(C)Cc2c(cncc2-c2ccc(cc2)C#N)C1O
BDBM191942 CC1(C)Cc2c(cncc2-c2ccc(cc2)C(F)(F)F)C1O
BDBM191903 CCC(=O)NC1CCCc2c1cncc2-c1ccc(Cl)c(F)c1
BDBM191895 CCC(=O)NC1CCCc2c1cncc2-c1ccc(Cl)cc1
BDBM191905 CCC(=O)NC1CCCc2c1cncc2-c1ccc(c(F)c1)C(F)(F)F
BDBM191899 CCC(=O)NC1CCCc2c1cncc2-c1ccc(Cl)cc1F
BDBM191897 CCC(=O)NC1CCCc2c1cncc2-c1ccc(F)c(C)c1
BDBM191880 CCC(=O)NC1CCCc2c1cncc2-c1ccc(cc1)C#N
BDBM191893 CCC(=O)NC1CCCc2c1cncc2-c1ccc(cc1)C(F)(F)F
BDBM191901 CCC(=O)NC1CCCc2c1cncc2-c1ccc(cc1F)C(F)(F)F
BDBM191917 CCC(=O)NC1CCc2c1cncc2-c1ccc(Cl)c(F)c1
BDBM191919 CCC(=O)NC1CCc2c1cncc2-c1ccc(F)c(C)c1
BDBM191890 CCC(=O)NC1CCc2c1cncc2-c1ccc(cc1)C#N
BDBM50038286 FC(F)(F)Oc1cccc(COc2ccc(cc2)C(=O)Cn2ccnc2)c1
BDBM50038288 O=C(Cn1ccnc1)c1ccc(OCc2ccccc2)cc1
BDBM50038289 O=C(Cn1ccnc1)c1cccc(OCc2ccccc2)c1
BDBM191913 CCC(=O)NC1CCc2c1cncc2-c1ccc(cc1)C(F)(F)F
BDBM191921 CCC(=O)NC1CCc2c1cncc2-c1ccc(cc1F)C(F)(F)F
BDBM191929 CCS(=O)(=O)NC1CCc2c1cncc2-c1ccc(c(F)c1)C(F)(F)F
BDBM191923 CCS(=O)(=O)NC1CCc2c1cncc2-c1ccc(cc1)C(F)(F)F
BDBM50038290 COc1cc(COc2ccc3c(Cn4ccnc4)cc(=O)oc3c2)cc(OC)c1OC
BDBM50038291 COc1ccc(COc2ccc3c(Cn4ccnc4)cc(=O)oc3c2)cc1OC
BDBM50038292 O=c1cc(Cn2ccnc2)c2ccc(OCCc3ccccc3)cc2o1
BDBM50038295 CCCOc1ccc(COc2ccc3c(Cn4ccnc4)cc(=O)oc3c2)cc1
BDBM50038296 [O-][N+](=O)c1ccc(COc2ccc3c(Cn4ccnc4)cc(=O)oc3c2)cc1
BDBM50038297 COc1cccc(COc2ccc3c(Cn4ccnc4)cc(=O)oc3c2)c1
BDBM191911 C[C@@H](O)C(=O)NC1CCCc2c1cncc2-c1ccc(cc1)C(F)(F)F |r|
BDBM191915 C[C@@H](O)C(=O)NC1CCc2c1cncc2-c1ccc(cc1)C(F)(F)F |r|
BDBM191888 Cc1ccc(cc1C)C1(O)CCCc2c(cncc12)-c1ccc(cc1)C#N
BDBM50038609 Oc1c(cc2ccccc2c1[S+]([O-])c1ccc(Cl)c(Cl)c1)-c1cccnc1
BDBM50038618 Oc1c(cc2ccccc2c1[S+]([O-])c1cccs1)-c1cccnc1
BDBM50038639 Oc1c(cc2ccccc2c1[S+]([O-])c1ccc(F)cc1)-c1cccnc1
BDBM50038693 Oc1c(cc2ccccc2c1[S+]([O-])c1ccccc1OC(F)(F)F)-c1cccnc1
BDBM50023770 O=S(=O)(C1CCCCC1)N1CCCc2cc(ccc12)-c1cccnc1
BDBM50023771 COc1cccc(c1)S(=O)(=O)N1CCCc2cc(Cc3cccnc3)ccc12
BDBM50023772 Cc1ccc(cc1)S(=O)(=O)N1CCCc2cc(ccc12)-c1cccnc1
BDBM50023773 Cc1cccc(c1)S(=O)(=O)N1CCCc2cc(ccc12)-c1cccnc1
BDBM50023775 COc1cccc(c1)S(=O)(=O)N1CCc2cc(ccc12)-c1cccnc1
BDBM50023776 COc1cccc(c1)S(=O)(=O)N(Cc1ccccc1)c1ccc(cc1)-c1cccnc1
BDBM50023777 CC(C)S(=O)(=O)N1CCc2cc(ccc12)-c1cccnc1
BDBM50023778 CS(=O)(=O)N1CCc2cc(ccc12)-c1cccnc1
BDBM50023779 FC(F)(F)c1ccc(cc1)S(=O)(=O)N1CCCc2cc(ccc12)-c1cccnc1
BDBM50023780 COc1cccc(c1)S(=O)(=O)N1CCCc2cc(ccc12)-c1ccncc1
BDBM50023781 O=S(=O)(N1CCCc2cc(ccc12)-c1cccnc1)c1ccccc1
BDBM50023782 COc1ccc(cc1)S(=O)(=O)N1CCCc2cc(ccc12)-c1cccnc1
BDBM50023783 FC(F)(F)c1cccc(c1)S(=O)(=O)N1CCCc2cc(ccc12)-c1cccnc1
BDBM50023784 O=S(=O)(N1CCCc2cc(ccc12)-c1cccnc1)c1ccc2ccccc2c1
BDBM50023785 O=S(=O)(N1CCCc2cc(ccc12)-c1cccnc1)c1cccs1
BDBM50023786 FC(F)(F)Oc1cccc(c1)S(=O)(=O)N1CCCc2cc(ccc12)-c1cccnc1
BDBM50023787 O=S(=O)(N1CCCc2cc(ccc12)-c1cccnc1)c1ccc(cc1)C#N
BDBM50023789 Fc1ccc(cc1)S(=O)(=O)N1CCCc2cc(ccc12)-c1cccnc1
BDBM50023761 Fc1cccc(c1)S(=O)(=O)N1CCc2cc(ccc12)-c1cccnc1
BDBM50023765 COc1cccc(c1)S(=O)(=O)N(C)c1ccc(cc1)-c1cccnc1
BDBM50023774 COc1cccc(c1)S(=O)(=O)N1CCc2cc(cnc12)-c1cccnc1
BDBM50023788 CC(C)CS(=O)(=O)N1CCc2cc(ccc12)-c1cccnc1
BDBM50023758 Clc1cccc(c1)S(=O)(=O)N1CCCc2cc(ccc12)-c1cccnc1
BDBM50023759 COc1cccc(c1)S(=O)(=O)Nc1ccc(cc1)-c1cccnc1
BDBM50023760 CCS(=O)(=O)N1CCc2cc(ccc12)-c1cccnc1
BDBM50023762 FC(F)(F)Oc1ccc(cc1)S(=O)(=O)N1CCCc2cc(ccc12)-c1cccnc1
BDBM50023763 COc1cccc(c1)S(=O)(=O)N1CCCc2cc(Cc3ccncc3)ccc12
BDBM50023764 Clc1ccc(cc1)S(=O)(=O)N1CCCc2cc(ccc12)-c1cccnc1
BDBM50023766 Fc1cccc(c1)S(=O)(=O)N1CCCc2cc(ccc12)-c1cccnc1
BDBM50023767 COc1cccc(c1)S(=O)(=O)N1CCc2cc(cnc12)-c1ccncc1
BDBM50023768 O=S(=O)(N1CCCc2cc(ccc12)-c1cccnc1)c1cccc(c1)C#N
BDBM50023769 COc1cccc(c1)S(=O)(=O)N1CCCc2cc(ccc12)-c1cccnc1
BDBM50044131 CC1(C)N(C(=O)c2ccc(Cl)cc12)c1cncc(n1)C1CCCN(C1)S(C)(=O)=O
BDBM50044132 CCS(=O)(=O)N(Cc1cncc(c1)-c1cccc(Cl)c1Cl)C1CC1
BDBM50038610 Oc1c(cc2ccccc2c1[S+]([O-])c1cc(cc(c1)C(F)(F)F)C(F)(F)F)-c1cccnc1
BDBM50038611 Oc1c(cc2ccccc2c1[S+]([O-])c1cc(Cl)cc(Cl)c1)-c1cccnc1
BDBM50038612 Oc1c(cc2ccccc2c1[S+]([O-])c1ccc(F)c(Cl)c1)-c1cccnc1
BDBM50038629 Oc1c(cc2ccccc2c1[S+]([O-])c1ccccc1)-c1cccnc1
BDBM50044133 CC(O)c1c(F)cncc1-c1cc2cc(Cl)c(F)cc2o1
BDBM50044135 C1CCCC(CCC1)c1cccnc1
BDBM50044136 Cn1c(nc2ccc(F)c(F)c12)-c1cncc2ccccc12
BDBM50044137 Cc1cncc(c1)-c1cc2NC(=O)CCn2n1
BDBM50044139 CCS(=O)(=O)NCc1cncc(c1)-c1c(C)c2ccccc2n1C
BDBM50044142 CC1CCCC(c2ccc(cc2-c2ccc(F)cc2)C#N)n2cncc12
BDBM50044143 Cc1nnc2CCc3cc(cc(F)c3-n12)-c1cnccc1C
BDBM50044144 COc1cccc2C3C(CCc12)C3c1cnc[nH]1
BDBM50038632 COc1ccc(cc1)[S+]([O-])c1c(O)c(cc2ccccc12)-c1cccnc1
BDBM50038634 COc1ccccc1[S+]([O-])c1c(O)c(cc2ccccc12)-c1cccnc1
BDBM50038635 Oc1c(cc2ccccc2c1[S+]([O-])c1ccc(Cl)cc1)-c1cccnc1
BDBM50038636 Oc1c(cc2ccccc2c1[S+]([O-])c1cccc(Cl)c1)-c1cccnc1
BDBM50038640 Oc1c(cc2ccccc2c1[S+]([O-])c1cccc(F)c1)-c1cccnc1
BDBM50038643 Oc1c(cc2ccccc2c1[S+]([O-])c1ccc(OC(F)(F)F)cc1)-c1cccnc1
BDBM50038692 Oc1c(cc2ccccc2c1[S+]([O-])c1cccc(OC(F)(F)F)c1)-c1cccnc1
BDBM50038695 Oc1c(cc2ccccc2c1[S+]([O-])c1cccc(c1)C(F)(F)F)-c1cccnc1
BDBM50038696 Oc1c(cc2ccccc2c1[S+]([O-])c1ccccc1C(F)(F)F)-c1cccnc1
BDBM50078606 Cc1nnc2CCc3cc(c(F)cc3-n12)-c1cccnc1
BDBM50078608 Fc1cc-2c(CCc3nncn-23)cc1-c1cccnc1
BDBM50078610 Fc1cc(cc2CCc3nnc(-c4ccncc4)n3-c12)-c1cccnc1
BDBM50078611 COc1cncc(c1)-c1cc(F)c-2c(CCc3nnc(C)n-23)c1
BDBM50078612 CC(O)c1cncc(c1)-c1cc(F)c-2c(CCc3nnc(C)n-23)c1
BDBM50078613 CC(=O)c1cncc(c1)-c1cc(F)c-2c(CCc3nnc(C)n-23)c1
BDBM50078614 Cc1nnc2CCc3cc(cc(F)c3-n12)-c1cncc(c1)C(F)(F)F
BDBM50078615 Cc1nnc2CCc3cc(cc(F)c3-n12)-c1cncc(c1)C#N
BDBM50078625 CC(C)c1nnc2CCc3cc(cc(F)c3-n12)-c1cccnc1
BDBM50078627 CCc1nnc2CCc3cc(cc(F)c3-n12)-c1cccnc1
BDBM50078629 Cc1nnc2CCc3cc(cc(F)c3-n12)-c1cccnc1
BDBM50078616 Cc1nnc2CCc3cc(cc(F)c3-n12)-c1cncc(c1)-c1ccccc1
BDBM50078618 Cc1nnc2CCc3cc(cc(F)c3-n12)-c1cncc(F)c1C
BDBM50078619 Fc1cncc(c1)-c1cc(F)c-2c(CCc3nncn-23)c1
BDBM50078620 Cc1c(F)cncc1-c1cc(F)c-2c(CCc3nncn-23)c1
BDBM50078621 Fc1cc(cc2CCc3nnc(C(=O)c4ccccc4)n3-c12)-c1cccnc1
BDBM50078622 Fc1cc-2c(CCc3nnc(Cc4ccccc4)n-23)cc1-c1cccnc1
BDBM50078623 Fc1cc(cc2CCc3nnc(-c4ccccc4)n3-c12)-c1cccnc1
BDBM50078624 Fc1cc-2c(CCc3nnc(-c4ccccc4)n-23)cc1-c1cccnc1
BDBM50078607 Fc1cc(cc2CCc3nncn3-c12)-c1cccnc1
BDBM50062540 CN1C(=O)COc2cc(ccc12)-c1cccnc1
BDBM50062541 O=C1COc2cc(ccc2N1)-c1cncc2ccccc12
BDBM50062546 O=C1Nc2ccc(cc2CO1)-c1cccnc1
BDBM50062549 O=C1NCc2cc(ccc2N1)-c1cncc2ccccc12
BDBM50082271 COc1ccc(c(OCCc2ccccc2)c1)-c1cccnc1
BDBM50082272 Fc1ccc(c(OCCc2ccccc2)c1)-c1ccncc1
BDBM50082273 Fc1ccc(c(OCCc2ccccc2)c1)-c1cccnc1
BDBM50082275 [O-][N+](=O)c1ccc(cc1OCCc1ccccc1)-c1cccnc1
BDBM50082277 [O-][N+](=O)c1ccc(c(OCCc2ccccc2)c1)-c1ccncc1
BDBM50082278 [O-][N+](=O)c1ccc(c(OCc2ccccc2)c1)-c1ccncc1
BDBM50078609 Fc1cc-2c(CCc3nnc(-c4ccncc4)n-23)cc1-c1cccnc1
BDBM50078617 Cc1nnc2CCc3cc(cc(F)c3-n12)-c1cncc2ccccc12
BDBM50078626 CC(C)c1nnc2CCc3cc(c(F)cc3-n12)-c1cccnc1
BDBM50078628 CCc1nnc2CCc3cc(c(F)cc3-n12)-c1cccnc1
BDBM50082279 [O-][N+](=O)c1ccc(c(OCCCc2ccccc2)c1)-c1cccnc1
BDBM50082280 [O-][N+](=O)c1ccc(c(OCCc2ccccc2)c1)-c1cccnc1
BDBM50082281 [O-][N+](=O)c1ccc(c(OCc2ccccc2)c1)-c1cccnc1
BDBM50082282 Nc1ccc(c(OCc2ccccc2)c1)-c1cccnc1
BDBM50082283 Fc1ccc(cc1)C(=O)Nc1ccc(c(OCc2ccccc2)c1)-c1cccnc1
BDBM50082284 CC(=O)Nc1ccc(c(OCc2ccccc2)c1)-c1cccnc1
BDBM50082285 FC(F)(F)c1ccc(c(OCCc2ccccc2)c1)-c1cccnc1
BDBM50082286 FC(F)(F)c1ccc(c(OCCc2ccccc2)c1)-c1ccncc1
BDBM50082288 N#Cc1ccc(c(OCCc2ccccc2)c1)-c1ccncc1
BDBM50082290 CN(C)C(=O)c1ccc(c(OCCc2ccccc2)c1)-c1ccncc1
BDBM50082291 C(Cc1ccccc1)Oc1cccnc1-c1cccnc1
BDBM50082293 [O-][N+](=O)c1ccc(Cc2cccnc2)c(OCCc2ccccc2)c1
BDBM50082294 [O-][N+](=O)c1ccc(Cc2ccncc2)c(OCCc2ccccc2)c1
BDBM50082292 C(Cc1ccccc1)Oc1cccnc1-c1ccncc1
BDBM50082270 COc1ccc(c(OCCc2ccccc2)c1)-c1ccncc1
BDBM50082274 [O-][N+](=O)c1ccc(cc1OCCc1ccccc1)-c1ccncc1
BDBM50082276 [O-][N+](=O)c1ccc(c(OCCCc2ccccc2)c1)-c1ccncc1
BDBM50082287 N#Cc1ccc(c(OCCc2ccccc2)c1)-c1cccnc1
BDBM191927 CCC(=O)N[C@@H]1[C@@H](C)CCc2c1cncc2-c1ccc(cc1)C(F)(F)F |r|
BDBM191928 CCC(=O)N[C@@H]1[C@H](C)CCc2c1cncc2-c1ccc(cc1)C(F)(F)F |r|
BDBM191876 NC1CCCc2c1cncc2-c1ccc(cc1)C#N
BDBM191877 CCS(=O)(=O)NC1CCCc2c1cncc2-c1ccc(cc1)C#N
BDBM191878 CCCNS(=O)(=O)NC1CCCc2c1cncc2-c1ccc(cc1)C#N
BDBM191879 CCNC(=O)NC1CCCc2c1cncc2-c1ccc(cc1)C#N
BDBM191882 CC(=O)NC1CCCc2c1cncc2-c1ccc(cc1)C#N
BDBM191883 CC(C)C(=O)NC1CCCc2c1cncc2-c1ccc(cc1)C#N
BDBM191884 CCOC(=O)NC1CCCc2c1cncc2-c1ccc(cc1)C#N
BDBM191885 OC1CCCc2c1cncc2-c1ccc(cc1)C#N
BDBM191886 CCNC(=O)OC1CCCc2c1cncc2-c1ccc(cc1)C#N
BDBM191887 COC1CCCc2c1cncc2-c1ccc(cc1)C#N
BDBM191892 CCC(=O)NC1CCCc2c1cncc2-c1ccc(F)c(Cl)c1
BDBM191931 N[C@@H]1CCCc2c1cncc2-c1ccc(cc1F)C(F)(F)F |r|
BDBM191932 CC(=O)N[C@@H]1CCCc2c1cncc2-c1ccc(cc1F)C(F)(F)F |r|
BDBM191933 CS(=O)(=O)N[C@@H]1CCCc2c1cncc2-c1ccc(cc1F)C(F)(F)F |r|
BDBM191934 CC(=O)N[C@@H]1CCCc2c1cncc2-c1ccc(cc1)C(F)(F)F |r|
BDBM191935 CC(=O)N[C@@H]1CCCc2c1cncc2-c1ccc(cc1)C#N |r|
BDBM191936 CC(=O)N[C@@H]1CCCc2c1cncc2-c1ccc(c(F)c1)C(F)(F)F |r|
BDBM191937 OC1CCc2c1cncc2-c1ccc(cc1F)C(F)(F)F
BDBM191938 OC1CCc2c1cncc2-c1ccc(cc1)C#N
BDBM191939 OC1CCc2c1cncc2-c1ccc(c(F)c1)C(F)(F)F
BDBM191940 OC1CCc2c1cncc2-c1ccc(cc1)C(F)(F)F
BDBM191941 CC1(O)CCc2c1cncc2-c1ccc(cc1)C(F)(F)F
BDBM191944 NC1CCc2c1cncc2-c1ccc(c(F)c1)C(F)(F)F
BDBM191945 CCC(=O)NC1CCc2c1cncc2-c1ccc(c(F)c1)C(F)(F)F
BDBM191907 CCC(=O)NC1CCCc2c1cncc2-c1ccc(F)cc1F
BDBM191908 CCC(=O)NC1CCCc2c1cncc2-c1cc(F)c(F)cc1F
BDBM191909 CCC(=O)NC1CCCc2c1cncc2-c1ccc(F)c(F)c1
BDBM191910 CCC(=O)NC1CCCc2c1cncc2-c1ccc(Cl)c(Cl)c1
BDBM191946 Fc1cc(ccc1C(F)(F)F)-c1cncc2C(CCc12)NS(=O)(=O)C1CC1
BDBM191947 CCC(=O)OC1CCc2c1cncc2-c1ccc(c(F)c1)C(F)(F)F
BDBM191948 NC1CCc2c1cncc2-c1ccc(cc1)C(F)(F)F
BDBM191949 FC(F)(F)c1ccc(cc1)-c1cncc2C(CCc12)NS(=O)(=O)C1CC1
BDBM191950 CS(=O)(=O)NC1CCc2c1cncc2-c1ccc(cc1)C(F)(F)F
BDBM191951 CCCS(=O)(=O)NC1CCc2c1cncc2-c1ccc(cc1)C(F)(F)F
BDBM191952 CC(C)(C)OC(=O)COC1CCc2c1cncc2-c1ccc(cc1)C(F)(F)F
BDBM191953 COC(=O)COC1CCc2c1cncc2-c1ccc(cc1)C(F)(F)F
BDBM191954 OC(=O)COC1CCc2c1cncc2-c1ccc(cc1)C(F)(F)F
BDBM191955 CNC(=O)COC1CCc2c1cncc2-c1ccc(cc1)C(F)(F)F
BDBM191956 CN(C)C(=O)COC1CCc2c1cncc2-c1ccc(cc1)C(F)(F)F
BDBM191957 NC(=O)COC1CCc2c1cncc2-c1ccc(cc1)C(F)(F)F
BDBM191958 CC1(COC2CCc3c2cncc3-c2ccc(cc2)C(F)(F)F)COC1
BDBM191961 CCC(=O)N[C@@H]1CCCc2c1cncc2-c1ccc(cc1C1CC1)C(F)(F)F |r|
BDBM191925 CCC(=O)N[C@H]1[C@H](C)CCc2c1cncc2-c1ccc(cc1)C(F)(F)F |r|
BDBM191926 CCC(=O)N[C@H]1[C@@H](C)CCc2c1cncc2-c1ccc(cc1)C(F)(F)F |r|
BDBM50038294 CC(C)Oc1ccc(COc2ccc3c(Cn4ccnc4)cc(=O)oc3c2)cc1
BDBM50038298 O=C(Cn1ccnc1)c1ccc(OCc2cccnc2)cc1
BDBM50038608 Oc1c(cc2ccccc2c1[S+]([O-])c1cccc(c1)C#N)-c1cccnc1
BDBM50038637 Oc1c(cc2ccccc2c1[S+]([O-])c1ccccc1Cl)-c1cccnc1
BDBM50038633 COc1cccc(c1)[S+]([O-])c1c(O)c(cc2ccccc12)-c1cccnc1
BDBM50038694 Oc1c(cc2ccccc2c1[S+]([O-])c1ccc(cc1)C(F)(F)F)-c1cccnc1
BDBM50125051 N#Cc1ccc(cc1)-c1cccnc1
BDBM50092185 COc1cncc(c1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM50125050 CCC(=O)N[C@H]1CCCc2c1cncc2-c1ccc(cc1)C#N |r|
BDBM50122328 CNC(=O)c1cncc(c1)-c1ccc-2c(CCc3nnc(C)n-23)c1
BDBM50122329 C[C@@](O)(c1cncc(c1)-c1ccc-2c(CCc3nnc(n-23)C(F)(F)F)c1)C(F)(F)F |r|
BDBM50122330 Cc1nnc2CCc3cc(ccc3-n12)-c1cncc(c1)[C@@](C)(O)C(F)(F)F |r|
BDBM50122331 Cc1nnc2CCc3cc(ccc3-n12)-c1cncc(F)c1
BDBM50122332 Cc1nnc2CCc3cc(ccc3-n12)-c1cncc(c1)[C@](C)(O)C(F)(F)F |r|
BDBM50122353 C1Cc2cc(ccc2-n2c1nnc2-c1ccccc1)-c1cccnc1
BDBM50122354 C1CCC(CC1)c1nnc2CCc3cc(ccc3-n12)-c1cccnc1
BDBM50122355 CC(C)(O)c1cncc(c1)-c1ccc-2c(CCc3nnc(n-23)C(F)(F)F)c1
BDBM50122356 FC(F)(F)c1nnc2CCc3cc(ccc3-n12)-c1cccnc1
BDBM50122357 COC(=O)C(C)(C)c1cncc(c1)-c1ccc-2c(CCc3nnc(C)n-23)c1
BDBM50122358 C1CC1c1nnc2CCc3cc(ccc3-n12)-c1cccnc1
BDBM50122359 Cc1nnc2CCc3cc(ccc3-n12)-c1cncc(c1)C(C)(C)O
BDBM50122360 Cc1nnc2CCc3cc(ccc3-n12)-c1cccnc1
BDBM50122361 Cc1nnc2CCc3cc(ccc3-n12)-c1cncc(c1)S(=O)(=O)c1ccccc1
BDBM50122366 C[C@](O)(c1cncc(c1)-c1ccc-2c(CCc3nnc(n-23)C(F)(F)F)c1)C(F)(F)F |r|
BDBM50122367 Cc1nnc2CCc3cc(ccc3-n12)-c1cncc(c1)C(F)(F)F
BDBM50125049 CCC(=O)N[C@@H]1CCCc2c1cncc2-c1ccc(cc1)C#N |r|
BDBM233830 CCS(=O)(=O)NC1CCCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
BDBM233807 CCS(=O)(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
BDBM233838 CCC(=O)N[C@H]1[C@H](C)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
BDBM233839 CCC(=O)N[C@@H]1[C@H](C)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
BDBM233840 CCC(=O)N[C@@H]1[C@@H](C)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
BDBM233841 CCC(=O)N[C@H]1[C@H](C)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
BDBM233842 CCC(=O)N[C@@H]1[C@H](C)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
BDBM233843 CCC(=O)N[C@@H]1[C@@H](C)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
BDBM233844 CCC(=O)N[C@H]1[C@@H](C)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
BDBM233845 CCC(=O)N[C@H]1[C@@H](C)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
BDBM233846 CCC(=O)N[C@@H]1[C@@H](F)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
BDBM233847 CCC(=O)N[C@@H]1[C@H](F)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
BDBM233848 CCC(=O)N[C@H]1[C@H](F)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
BDBM233849 CCC(=O)N[C@H]1[C@@H](F)CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
BDBM233850 CCC(=O)N[C@H]1[C@H](F)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
BDBM233851 CCC(=O)N[C@H]1[C@@H](F)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
BDBM233852 CCC(=O)N[C@@H]1[C@@H](F)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
BDBM233853 CCC(=O)N[C@@H]1[C@H](F)CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F |r|
BDBM233858 CN1C(=O)CCc2cc(ccc12)-c1cncc2C(=O)CCCc12
BDBM233818 C[C@@H](O)C(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
BDBM233867 CN1C(=O)CCc2cc(ccc12)-c1cncc2[C@H](N)CCCc12 |r|
BDBM233868 CN1C(=O)CCc2cc(ccc12)-c1cncc2[C@@H](CCCc12)NC(=O)c1ncccc1Cl |r|
BDBM233869 CN1C(=O)CCc2cc(ccc12)-c1cncc2[C@@H](CCCc12)NC(C)=O |r|
BDBM233870 CN1C(=O)CCc2cc(ccc12)-c1cncc2[C@@H](CCCc12)NC(=O)C1CC1 |r|
BDBM233871 CN1C(=O)CCc2cc(ccc12)-c1cncc2[C@@H](CCCc12)NS(C)(=O)=O |r|
BDBM233872 CN1C(=O)CCc2cc(ccc12)-c1cncc2[C@@H](CCCc12)NS(=O)(=O)C1CC1 |r|
BDBM233854 CCC(=O)NC1CCc2c1cncc2-c1cc(Cl)c2N(C)C(=O)CCc2c1
BDBM233824 CCC(=O)NC1CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
BDBM233810 CCC(=O)NC1CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
BDBM233806 CCC(=O)N[C@@H]1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
BDBM233826 CCS(=O)(=O)NC1CCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
BDBM233856 CN1C(=O)CCc2cc(ccc12)-c1cncc2C(O)CCCc12
BDBM233812 CCS(=O)(=O)NC1CCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
BDBM233813 CN1C(=O)CCc2cc(ccc12)-c1cncc2N(CCNC(=O)OC(C)(C)C)CCCc12
BDBM233814 CN1C(=O)CCc2cc(ccc12)-c1cncc2N(CCN)CCCc12
BDBM233815 CCC(=O)NCCN1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
BDBM233816 CCS(=O)(=O)NCCN1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
BDBM233817 CC(O)C(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
BDBM233819 C[C@H](O)C(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1 |r|
BDBM233828 CCC(=O)NC1CCCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1F
BDBM233831 CCC(=O)NC1CCCc2c1cncc2-c1cc(Cl)c2N(C)C(=O)CCc2c1
BDBM233803 CCC(=O)NC1CCCc2c1cncc2-c1ccc2N(C)C(=O)CCc2c1
BDBM233835 CCS(=O)(=O)NC1CCCc2c1cncc2-c1cc(Cl)c2N(C)C(=O)CCc2c1
BDBM233832 CCS(=O)(=O)NC1CCCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1Cl
BDBM233833 CCC(=O)NC1CCCc2c1cncc2-c1cc2CCC(=O)N(C)c2cc1Cl
BDBM233834 CCS(=O)(=O)NC1CCCc2c1cncc2-c1cc(F)c2N(C)C(=O)CCc2c1
BDBM50122362 Cc1nnc2CCc3cc(ccc3-n12)-c1cncc(c1)S(C)(=O)=O
BDBM50122363 CN(C)C(=O)c1cncc(c1)-c1ccc-2c(CCc3nnc(C)n-23)c1
BDBM50122364 C1Cc2cc(ccc2-n2cnnc12)-c1cccnc1
BDBM50122365 COC(=O)c1cncc(c1)-c1ccc-2c(CCc3nnc(C)n-23)c1
BDBM50092175 CS(=O)(=O)c1ccc2n(C3CC3)c(nc2c1)-c1cccnc1
BDBM50092177 Clc1ccc2nc(-c3cccnc3)n(C3CC3)c2c1
BDBM50092179 N#Cc1ccc2nc(-c3cccnc3)n(C3CC3)c2c1
BDBM50092180 COc1ccc2nc(-c3cccnc3)n(C3CC3)c2c1
BDBM50092181 Fc1cc2nc(-c3cccnc3)n(C3CC3)c2cc1F
BDBM50092182 Fc1cc2nc(-c3cccnc3)n(C3CC3)c2cc1Cl
BDBM50092183 Fc1cc2nc(-c3cccnc3)n(C3CC3)c2cc1C#N
BDBM50092184 Fc1cc2nc(-c3cncc(c3)C#N)n(C3CC3)c2cc1F
BDBM50092186 Fc1cncc(c1)-c1nc2cc(F)c(Cl)cc2n1C1CC1
BDBM50092187 Fc1cncc(c1)-c1nc2cc(F)c(cc2n1C1CC1)C#N
BDBM50092188 Cc1ccncc1-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM50092189 Fc1cc2nc(-c3cnccc3C(F)(F)F)n(C3CC3)c2cc1F
BDBM50092191 COc1c(C)cncc1-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM50092192 Fc1ccc2nc(-c3cccnc3)n(C3CC3)c2c1
BDBM50092193 CC(C)n1c(nc2ccc(F)cc12)-c1cccnc1
BDBM50092195 Fc1ccc2nc([nH]c2c1)-c1cccnc1
BDBM50092196 Cn1c(nc2ccc(F)cc12)-c1cccnc1
BDBM50092142 CC(C)(O)c1cncc(c1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM50092139 Fc1cncc(c1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM50092153 CC(C)(O)c1cncc(c1)-c1nc2ccc(F)cc2n1C1CC1
BDBM50092156 CC1(CC1)n1c(nc2ccc(F)cc12)-c1cccnc1
BDBM50092159 CC(C)(C)n1c(nc2ccc(F)cc12)-c1cccnc1
BDBM50092160 Fc1ccc2nc(-c3cccnc3)n(C3CCC3)c2c1
BDBM50092161 Fc1ccc2nc(-c3cccnc3)n(CC(F)(F)F)c2c1
BDBM50092162 Fc1ccc2nc(-c3cccnc3)n(Cc3ccccc3)c2c1
BDBM50092163 C1CC1n1c(nc2ccccc12)-c1cccnc1
BDBM50092164 Fc1cccc2n(C3CC3)c(nc12)-c1cccnc1
BDBM50092168 COc1ccc2n(C3CC3)c(nc2c1)-c1cccnc1
BDBM50092174 N#Cc1ccc2n(C3CC3)c(nc2c1)-c1cccnc1
BDBM50092166 Fc1cccc2nc(-c3cccnc3)n(C3CC3)c12
BDBM60877 CCC(=O)N[C@H]1CCc2c1cncc2-c1ccc(Cl)c(F)c1 |r|
BDBM60878 CCC(=O)N[C@@H]1CCc2c1cncc2-c1ccc(F)c(C)c1 |r|
BDBM212443 CC(C)c1c(F)cncc1-c1cc(F)c-2c(CCc3nnc(C)n-23)c1
BDBM212444 Cc1nnc2CCc3cc(cc(F)c3-n12)-c1cncc(F)c1Cl
BDBM60879 CCC(=O)N[C@H]1CCc2c1cncc2-c1ccc(F)c(C)c1 |r|
BDBM232943 CCc1c2NC(=O)CCn2nc1-c1cncc(F)c1
BDBM232944 Cc1c2NC(=O)CCn2nc1-c1cncc(F)c1
BDBM232945 Fc1cncc(c1)-c1nn2CCC(=O)Nc2c1C1CC1
BDBM232946 Clc1cncc(c1)-c1nn2CCC(=O)Nc2c1C#N
BDBM50092137 Cc1c(F)cncc1-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM50092165 Fc1ccc2n(C3CC3)c(nc2c1)-c1cccnc1
BDBM50092167 FC(F)(F)c1ccc2n(C3CC3)c(nc2c1)-c1cccnc1
BDBM50092178 FC(F)(F)c1ccc2nc(-c3cccnc3)n(C3CC3)c2c1
BDBM50092190 Cc1cncc(-c2nc3cc(F)c(F)cc3n2C2CC2)c1C
BDBM50092194 CCn1c(nc2ccc(F)cc12)-c1cccnc1
BDBM232938 Cc1c(nn2CCC(=O)Nc12)-c1cncc(C)c1
BDBM232939 CN1c2c(C)c(nn2CCC1=O)-c1cncc(C)c1
BDBM232940 CCc1c(nn2CCC(=O)N(C)c12)-c1cncc(C)c1
BDBM232941 Cc1cncc(c1)-c1nn2CCC(=O)Nc2c1C1CC1
BDBM232942 CN1c2c(C)c(nn2CCC1=O)-c1cncc(F)c1
BDBM60876 CCC(=O)N[C@@H]1CCc2c1cncc2-c1ccc(Cl)c(F)c1 |r|
BDBM220126 COc1ccc2C=C(Cc2c1)c1cccnc1 |c:6|
BDBM50162276 O=c1c(Cc2ccncc2)coc2ccccc12
BDBM50162277 Fc1ccc2c(c1)oc(Cc1cccnc1)cc2=O
BDBM50162278 COc1ccc2c(c1)oc(Cc1cccnc1)cc2=O
BDBM50162272 COc1ccc2c(c1)oc(Cc1ccncc1)cc2=O
BDBM50162279 O=c1cc(Cc2cccnc2)oc2ccccc12
BDBM50162282 O=c1c(Cc2cccnc2)coc2ccccc12
BDBM101360 CC(C)S(=O)(=O)N1CCCC(C1)Nc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM249213 CN1C(=O)CCc2cc(ccc12)-c1cncc(COc2cccc(Cl)n2)c1
BDBM249214 CN1C(=O)CCc2cc(ccc12)-c1cncc(COc2ccc(F)cn2)c1
BDBM249215 CN1C(=O)CCc2cc(ccc12)-c1cncc(COc2cccc(C)n2)c1
BDBM249216 CN1C(=O)CCc2cc(ccc12)-c1cncc(COc2cc(C)cc(n2)C(F)(F)F)c1
BDBM249217 CN1C(=O)CCc2cc(ccc12)-c1cncc(COc2cc(C)ccn2)c1
BDBM249218 CN1C(=O)CCc2cc(ccc12)-c1cncc(COc2ccc(Cl)cn2)c1
BDBM249219 CN1C(=O)CCc2cc(ccc12)-c1cncc(COc2ccccn2)c1
BDBM249220 CN1C(=O)CCc2cc(ccc12)-c1cncc(COc2ncccc2C(F)(F)F)c1
BDBM249221 CN1C(=O)CCc2cc(ccc12)-c1cncc(COc2ccnc(C)n2)c1
BDBM249222 CN1C(=O)CCc2cc(ccc12)-c1cncc(COc2ccnc(n2)C(F)(F)F)c1
BDBM249223 CN1C(=O)CCc2cc(ccc12)-c1cncc(COc2cnc(Cl)nc2)c1
BDBM249224 CN1C(=O)CCc2cc(ccc12)-c1cncc(COc2ncccn2)c1
BDBM249225 CN1C(=O)CCc2cc(ccc12)-c1cncc(CSc2nc3ccccc3o2)c1
BDBM249226 CN1C(=O)CCc2cc(ccc12)-c1cncc(CSc2cccc(C)n2)c1
BDBM50162274 Fc1ccc2c(c1)occ(Cc1ccncc1)c2=O
BDBM50162275 COc1ccc2c(c1)occ(Cc1ccncc1)c2=O
BDBM249227 CN1C(=O)CCc2cc(ccc12)-c1cncc(CSc2ncccc2C(F)(F)F)c1
BDBM249228 CN1C(=O)CCc2cc(ccc12)-c1cncc(CSc2ncccc2Cl)c1
BDBM249229 CN1C(=O)CCc2cc(ccc12)-c1cncc(COc2cc(ccn2)C#N)c1
BDBM249230 CN1C(=O)CCc2cc(ccc12)-c1cncc(COc2cccc(F)n2)c1
BDBM249231 CN1C(=O)CCc2cc(c(F)cc12)-c1cncc(COc2ncccc2F)c1
BDBM249232 CN1C(=O)CCc2cc(c(F)cc12)-c1cncc(COc2ccc(Cl)cn2)c1
BDBM249233 CN1C(=O)CCc2cc(c(F)cc12)-c1cncc(COc2cccc(Cl)n2)c1
BDBM249234 CN1C(=O)CCc2cc(c(F)cc12)-c1cncc(COc2cccc(C)n2)c1
BDBM249235 CN1C(=O)CCc2cc(c(F)cc12)-c1cncc(COc2cc(C)ccn2)c1
BDBM249236 CN1C(=O)CCc2cc(c(F)cc12)-c1cncc(COc2cccc(C)n2)c1C
BDBM249237 CN1C(=O)CCc2cc(c(F)cc12)-c1cncc(COc2cccc(Cl)n2)c1C
BDBM249238 CN1C(=O)CCc2cc(c(F)cc12)-c1cncc(COc2ncccc2F)c1C
BDBM249239 CN1C(=O)CCc2cc(c(F)cc12)-c1cncc(COc2cccc(F)n2)c1C
BDBM249240 CN1C(=O)CCc2cc(ccc12)-c1cncc(CC(=O)Nc2cccc(C)n2)c1
BDBM249241 CN1C(=O)CCc2cc(ccc12)-c1cncc(CC(=O)Nc2cccc(Cl)c2)c1
BDBM249242 CN1C(=O)CCc2cc(ccc12)-c1cncc(CC(=O)Nc2cccc(Cl)n2)c1
BDBM101381 Cn1ccnc1C(=O)N1CC(C1)Nc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101403 Cn1cc(cn1)C(=O)N1CC(C1)Nc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101406 C[C@H]1N(C(=O)c2ccc(Cl)cc12)c1cncc(NC2CN(C2)C(=O)c2ncccc2Cl)c1 |r|
BDBM101407 C[C@@H]1N(C(=O)c2ccc(Cl)cc12)c1cncc(NC2CN(C2)C(=O)c2ncccc2Cl)c1 |r|
BDBM101410 CC1(C)N(C(=O)c2ccc(cc12)C#N)c1cncc(NC2CN(C2)S(=O)(=O)C2CC2)c1
BDBM101411 Cc1ccncc1C(=O)N1CC(C1)Nc1cncc(c1)N1C(=O)c2ccc(cc2C1(C)C)C#N
BDBM101412 Cn1cc(cn1)C(=O)N1CC(C1)Nc1cncc(c1)N1C(=O)c2ccc(cc2C1(C)C)C#N
BDBM101413 Cn1ccnc1C(=O)N1CC(C1)Nc1cncc(c1)N1C(=O)c2ccc(cc2C1(C)C)C#N
BDBM101414 CC1(C)N(C(=O)c2ccc(cc12)C#N)c1cncc(NC2CCN(CC2)S(=O)(=O)C2CC2)c1
BDBM101415 CC1(C)N(C(=O)c2ccc(cc12)C#N)c1cncc(NC2CCN(CC2)C(=O)c2ncccc2Cl)c1
BDBM101416 Cc1ccncc1C(=O)N1CCC(CC1)Nc1cncc(c1)N1C(=O)c2ccc(cc2C1(C)C)C#N
BDBM101420 CC1(C)N(C(=O)c2ccc(cc12)C#N)c1cncc(NC2CN(C2)C(=O)c2ncccc2Cl)c1
BDBM101421 Cn1cncc1C(=O)N1CC(C1)Nc1cncc(c1)N1C(=O)c2ccc(cc2C1(C)C)C#N
BDBM101382 CN(C1CN(C1)S(=O)(=O)C1CC1)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101422 Cn1cc(cn1)C(=O)N1CCC(CC1)Nc1cncc(c1)N1C(=O)c2ccc(cc2C1(C)C)C#N
BDBM101423 Cn1ccnc1C(=O)N1CCC(CC1)Nc1cncc(c1)N1C(=O)c2ccc(cc2C1(C)C)C#N
BDBM101472 Cn1cncc1C(=O)N1CCC(CC1)Nc1cncc(c1)N1C(=O)c2ccc(cc2C1(C)C)C#N
BDBM101385 CN(C1CCN(CC1)S(=O)(=O)C1CC1)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101388 CC1(C)N(C(=O)c2ccc(Cl)cc12)c1cncc(NC2CN(C2)C(=O)c2ncccc2Cl)c1
BDBM101307 CC(=O)N1CC(C1)Nc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101308 CN(C1CN(C1)C(C)=O)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101389 Cc1ccncc1C(=O)N1CC(C1)Nc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101390 Cc1cncc(c1)C(=O)N1CC(C1)Nc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101311 CC(=O)N1CCC(CC1)Nc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101315 CCS(=O)(=O)N1CCC(CC1)Nc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101340 CCS(=O)(=O)N1CC(C1)Nc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101341 CC1(C)N(C(=O)c2ccc(Cl)cc12)c1cncc(NC2CN(C2)S(C)(=O)=O)c1
BDBM101342 CCC(=O)N1CC(C1)Nc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101343 CCS(=O)(=O)N1CC(C1)N(C)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101345 CN(C1CN(C1)S(C)(=O)=O)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101346 CCC(=O)N1CC(C1)N(C)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101347 CC(C)S(=O)(=O)N1CC(C1)N(C)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101348 CCCS(=O)(=O)N1CC(C1)N(C)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101350 CC(C)S(=O)(=O)N1CCC(C1)N(C)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C |@@:11|
BDBM101351 CCCS(=O)(=O)N1CCC(C1)N(C)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C |@:11|
BDBM101352 CCCS(=O)(=O)N1CCC(C1)N(C)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C |@@:11|
BDBM101353 CCC(=O)N1CCC(CC1)N(C)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101354 CCS(=O)(=O)N1CCC(CC1)N(C)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101355 CN(C1CCN(CC1)S(C)(=O)=O)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101391 CC1N(C(=O)c2ccc(Cl)cc12)c1cncc(NC2CN(C2)C(=O)c2ncccc2Cl)c1
BDBM101392 CC1N(C(=O)c2ccc(Cl)cc12)c1cncc(NC2CN(C2)C(=O)c2cnccc2C)c1
BDBM101396 Clc1ccc2C(=O)N(CCc2c1)c1cncc(NC2CN(C2)C(=O)c2ncccc2Cl)c1
BDBM101397 Cc1cncc(c1)C(=O)N1CC(C1)Nc1cncc(c1)N1CCc2cc(Cl)ccc2C1=O
BDBM101349 CC(C)S(=O)(=O)N1CCC(C1)N(C)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101362 CCC(=O)N1CC(C1)Nc1cncc(c1)N1Cc2cc(Cl)ccc2C1=O
BDBM101363 CCC(=O)N1CC(C1)Nc1cncc(c1)N1CCc2cc(Cl)ccc2C1=O
BDBM101364 CCS(=O)(=O)N1CC(C1)Nc1cncc(c1)N1CCc2cc(Cl)ccc2C1=O
BDBM101365 CC(C)S(=O)(=O)N1CC(C1)Nc1cncc(c1)N1CCc2cc(Cl)ccc2C1=O
BDBM101366 CC(=O)N1CC(C1)Nc1cncc(c1)N1CCc2cc(Cl)ccc2C1=O
BDBM101398 Cc1ccncc1C(=O)N1CC2(CC(C2)Nc2cncc(c2)N2C(=O)c3ccc(Cl)cc3C2(C)C)C1
BDBM101399 Cc1noc(C)c1C(=O)N1CC(C1)Nc1cncc(c1)N1CCc2cc(Cl)ccc2C1=O
BDBM101400 Cn1cc(cn1)C(=O)N1CC(C1)Nc1cncc(c1)N1CCc2cc(Cl)ccc2C1=O
BDBM101401 Cn1ccnc1C(=O)N1CC(C1)Nc1cncc(c1)N1CCc2cc(Cl)ccc2C1=O
BDBM101402 Cc1noc(C)c1C(=O)N1CC(C1)Nc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101367 CCC(=O)N1CC(C1)Nc1cncc(c1)N1C(C)c2cc(Cl)ccc2C1=O
BDBM101368 CCS(=O)(=O)N1CC(C1)Nc1cncc(c1)N1C(C)c2cc(Cl)ccc2C1=O
BDBM101369 CC(=O)N1CC2(CC(C2)Nc2cncc(c2)N2C(=O)c3ccc(Cl)cc3C2(C)C)C1
BDBM101370 CCC(=O)N1CC2(CC(C2)Nc2cncc(c2)N2C(=O)c3ccc(Cl)cc3C2(C)C)C1
BDBM101371 CCS(=O)(=O)N1CC2(CC(C2)Nc2cncc(c2)N2C(=O)c3ccc(Cl)cc3C2(C)C)C1
BDBM101372 CC(C)S(=O)(=O)N1CC2(CC(C2)Nc2cncc(c2)N2C(=O)c3ccc(Cl)cc3C2(C)C)C1
BDBM101373 CCC(=O)N1CC(C1)Nc1cncc(c1)N1[C@H](C)c2cc(Cl)ccc2C1=O |r|
BDBM101393 CC1N(C(=O)c2ccc(Cl)cc12)c1cncc(NC2CN(C2)S(=O)(=O)C2CC2)c1
BDBM101394 Clc1ccc2C(=O)N(CCc2c1)c1cncc(NC2CN(C2)S(=O)(=O)C2CC2)c1
BDBM101395 Cc1ccncc1C(=O)N1CC(C1)Nc1cncc(c1)N1CCc2cc(Cl)ccc2C1=O
BDBM101374 CCC(=O)N1CC(C1)Nc1cncc(c1)N1[C@@H](C)c2cc(Cl)ccc2C1=O |r|
BDBM101375 CCS(=O)(=O)N1CC(C1)Nc1cncc(c1)N1[C@H](C)c2cc(Cl)ccc2C1=O |r|
BDBM101376 CCS(=O)(=O)N1CC(C1)Nc1cncc(c1)N1[C@@H](C)c2cc(Cl)ccc2C1=O |r|
BDBM101377 CCS(=O)(=O)N1CCC(CC1)Nc1cncc(c1)N1C(=O)c2ccc(cc2C1(C)C)C#N
BDBM101378 CCC(=O)N1CCC(CC1)Nc1cncc(c1)N1C(=O)c2ccc(cc2C1(C)C)C#N
BDBM101379 CCC(=O)N1CC(C1)Nc1cncc(c1)N1C(=O)c2ccc(cc2C1(C)C)C#N
BDBM50162286 Fc1ccc2c(c1)oc(Cn1ccnc1)cc2=O
BDBM50162288 COc1ccc2c(c1)oc(Cn1ccnc1)cc2=O
BDBM101380 CC1(C)N(C(=O)c2ccc(Cl)cc12)c1cncc(NC2CN(C2)S(=O)(=O)C2CC2)c1
BDBM50162273 O=c1cc(Cc2ccncc2)oc2ccccc12
BDBM50162285 O=c1c(Cc2c[nH]cn2)coc2ccccc12
BDBM50162280 Fc1ccc2c(c1)occ(Cc1cccnc1)c2=O
BDBM50162281 COc1ccc2c(c1)occ(Cc1cccnc1)c2=O
BDBM50162283 Fc1ccc2c(c1)occ(Cc1c[nH]cn1)c2=O
BDBM50162284 COc1ccc2c(c1)occ(Cc1c[nH]cn1)c2=O
BDBM50162289 O=c1cc(Cn2ccnc2)oc2ccccc12
BDBM50162290 Fc1ccc2c(c1)occ(Cn1ccnc1)c2=O
BDBM50162291 COc1ccc2c(c1)occ(Cn1ccnc1)c2=O
BDBM238149 CCOC(=O)c1cncn1C(C)c1ccccc1
BDBM238150 Clc1ncc(Cn2ccnc2)cc1-c1ccsc1
BDBM101383 CN(C1CCN(C1)S(=O)(=O)C1CC1)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM101404 C[C@H]1N(C(=O)c2ccc(Cl)cc12)c1cncc(NC2CN(C2)C(=O)c2cnccc2C)c1 |r|
BDBM101408 C[C@H]1N(C(=O)c2ccc(Cl)cc12)c1cncc(NC2CN(C2)S(=O)(=O)C2CC2)c1 |r|
BDBM101386 CC1(C)N(C(=O)c2ccc(Cl)cc12)c1cncc(NC2CCCN(C2)S(=O)(=O)C2CC2)c1
BDBM101356 CC1(C)N(C(=O)c2ccc(Cl)cc12)c1cncc(NC2CCCN(C2)S(C)(=O)=O)c1
BDBM101309 CCS(=O)(=O)N1CCC(C1)N(C)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C.CCS(=O)(=O)N1CCC(C1)N(C)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C |@:10,@@:41|
BDBM101358 CCS(=O)(=O)N1CCCC(C1)Nc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM50162292 O=c1c(Cn2ccnc2)coc2ccccc12
BDBM50162293 Fc1ccc2c(c1)oc(Cc1ccncc1)cc2=O
BDBM50206965 Fc1ccc2nc(c(C3CC3)n2c1)-c1cncc(c1)C#N
BDBM50206974 COC(=O)c1cncc(c1)-c1nc2ccc(F)cn2c1C1CC1
BDBM50206095 C1CCC2(CC1)CCN(CC2)c1cncc2ccccc12
BDBM50206955 C[C@](O)(c1cncc(c1)-c1nc2ccc(F)cn2c1C1CC1)C(F)(F)F |r|
BDBM50206956 CC(C)(O)c1cncc(c1)-c1nc2ccc(F)cn2c1C#N
BDBM50206957 Fc1ccc2nc(c(C3CC3)n2c1)-c1cncc(c1)C(F)(F)F
BDBM50206211 CC(C)(C)OC(=O)N1CCC2(C1)CCN(CC2)c1cncc2ccccc12
BDBM50206212 CC1(C)CN(C1)c1cncc(n1)N1CCC2(CNC(=O)C2)CC1
BDBM50206238 C1COC2(C1)CCN(CC2)c1cncc2ccccc12
BDBM50206958 Fc1cncc(c1)-c1nc2ccc(Cl)cn2c1C1CC1
BDBM50206961 Fc1ccc2nc(c(C3CC3)n2c1)-c1cncc(F)c1
BDBM50206962 Fc1ccn2c(C3CC3)c(nc2c1)-c1cncc(F)c1
BDBM50206963 Fc1ccc2nc(c(C3CC3)n2c1)-c1cncc2ccccc12
BDBM50206964 CCS(=O)(=O)NCc1cncc(c1)-c1nc2ccc(F)cn2c1C1CC1
BDBM50206968 CC(C)(O)c1cncc(c1)-c1cn2cc(F)ccc2n1
BDBM50206969 COc1cncc(c1)-c1nc2ccc(F)cn2c1C1CC1
BDBM50206970 Cc1c(nc2ccc(F)cn12)-c1cncc(c1)C(C)(C)O
BDBM50206971 C[C@@](O)(c1cncc(c1)-c1nc2ccc(F)cn2c1C1CC1)C(F)(F)F |r|
BDBM50206972 Cc1cncc(c1)-c1nc2ccc(F)cn2c1C1CC1
BDBM50206975 CCc1c(F)cncc1-c1nc2ccc(F)cn2c1C1CC1
BDBM50206976 CC(C)(O)c1cncc(c1)-c1nc2ccc(F)cn2c1C1CC1
BDBM50206977 C[C@](O)(c1cncc(c1)-c1nc2cc(F)ccn2c1C1CC1)C(F)(F)F |r|
BDBM50206978 CC(C)(O)c1cncc(c1)-c1nc2ccc(F)cn2c1Cl
BDBM50206979 Fc1cncc(c1)-c1nc2cc(F)c(Cl)cn2c1C1CC1
BDBM50206210 CN1CC2(CC1=O)CCN(CC2)c1cncc2ccccc12
BDBM50206216 C1CC2(CN1)CCN(CC2)c1cncc2ccccc12
BDBM50206239 CN1CC2(CC1=O)CCN(CC2)c1cncc(n1)N1CC(C)(C)C1
BDBM50206203 CN1CCC2(CCN(CC2)c2cncc3ccccc23)C1=O
BDBM50206204 CC1(C)CN(C1)c1cncc(n1)N1CCC2(CCC(=O)N2)CC1
BDBM50206205 CC(=O)N1CCC2(C1)CCN(CC2)c1cncc2ccccc12
BDBM50206206 CN1CC2(CC1=O)CCN(CC2)c1cncc(c1)[C@](C)(O)C(F)(F)F |r|
BDBM50206207 C1CCC2(C1)CCN(CC2)c1cncc2ccccc12
BDBM50206208 C1CC2(CO1)CCN(CC2)c1cncc2ccccc12
BDBM50206209 C1OCC11CCN(CC1)c1cncc2ccccc12
BDBM50206213 CN1CC2(CC1=O)CCN(CC2)c1cncc(c1)[C@@](C)(O)C(F)(F)F |r|
BDBM50206214 C[C@](O)(c1cncc(c1)N1CCC2(CCOC2)CC1)C(F)(F)F |r|
BDBM50206959 Cc1c(F)cncc1-c1nc2ccc(F)cn2c1C1CC1
BDBM50206967 C[C@](O)(c1cncc(c1)-c1nc2ccc(cn2c1C1CC1)C#N)C(F)(F)F |r|
BDBM50206973 Fc1ccc2nc(c(C3CC3)n2c1)-c1cncc(c1)-c1ccccc1
BDBM336884 NC(=O)c1cccc2OC(COc12)c1cncc(CC(=O)N2CCC(F)(F)CC2)c1
BDBM279749 Cc1ccncc1C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C11CC1
BDBM279750 Cn1nccc1C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C11CC1
BDBM279751 C[C@H]1N(C(=O)c2ccc(Cl)cc12)c1cncc(c1)N1CC2(CN(C2)C(=O)c2cnn(C)c2)C1 |r|
BDBM279752 C[C@@H]1N(C(=O)c2ccc(Cl)cc12)c1cncc(c1)N1CC2(CN(C2)C(=O)c2cnn(C)c2)C1 |r|
BDBM279753 COc1ccncc1C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279754 Cc1cnc(C)c(n1)C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279755 Cc1c(cnn1C)C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279756 Cc1nocc1C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279757 Cc1cncc(n1)C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279758 Cc1ncncc1C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279759 Cc1cnc(cn1)C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279760 Cc1cc(C(=O)N2CC3(C2)CN(C3)c2cncc(c2)N2C(=O)c3ccc(Cl)cc3C2(C)C)n(C)n1
BDBM279731 CCn1cc(cn1)C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279728 Cn1cc(cn1)C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279732 CC(C)n1cc(cn1)C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279733 Cn1ccnc1C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279761 Cc1ocnc1C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279762 CC1(C)N(C(=O)c2ccc(Cl)cc12)c1cncc(c1)N1CC2(CN(C2)C(=O)c2ncccn2)C1
BDBM279763 Cc1cnc(nc1)C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279764 Cn1cc(C(=O)N2CC3(C2)CN(C3)c2cncc(c2)N2C(=O)c3ccc(Cl)cc3C2(C)C)c(n1)C(F)F
BDBM279765 CC1(C)N(C(=O)c2ccc(Cl)cc12)c1cncc(c1)N1CC2(CN(C2)C(=O)c2cncc(c2)C#N)C1
BDBM279766 COc1nccnc1C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279734 Cn1nccc1C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279767 CC1(C)N(C(=O)c2ccc(Cl)cc12)c1cncc(c1)N1CC2(CN(C2)C(=O)c2cnccn2)C1
BDBM279768 Cc1oncc1C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279769 CC1(C)N(C(=O)c2ccc(Cl)cc12)c1cncc(c1)N1CC2(CN(C2)C(=O)c2cncnc2)C1
BDBM279770 Cc1ncoc1C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279771 CC1(C)N(C(=O)c2ccc(Cl)cc12)c1cncc(c1)N1CC2(CN(C2)C(=O)c2cocn2)C1
BDBM279772 Cc1ncc(o1)C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279773 Cc1nc(C)c(o1)C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279774 Cc1nc(co1)C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279775 CC1(C)N(C(=O)c2ccc(Cl)cc12)c1cncc(c1)N1CC2(CN(C2)C(=O)c2ncccc2C#N)C1
BDBM279776 Cc1ncc(Cl)c(n1)C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279777 Cc1ncnc(C)c1C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279778 Cc1ccnc(C)c1C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279779 CC1(C)N(C(=O)c2ccc(Cl)cc12)c1cncc(c1)N1CC2(CN(C2)C(=O)c2cnccc2C#N)C1
BDBM279780 CCn1cc(cn1)C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1[C@@H](C)c2cc(Cl)ccc2C1=O |r|
BDBM279781 CCn1cc(cn1)C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1[C@H](C)c2cc(Cl)ccc2C1=O |r|
BDBM279782 Cn1cc(cn1)C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1CCc2cc(Cl)ccc2C1=O
BDBM279783 C[C@H]1N(C(=O)c2ccc(Cl)cc12)c1cncc(N2CC3(CN(C3)C(=O)c3cnn(C)c3)C2)c1C |r|
BDBM279784 C[C@@H]1N(C(=O)c2ccc(Cl)cc12)c1cncc(N2CC3(CN(C3)C(=O)c3cnn(C)c3)C2)c1C |r|
BDBM279785 Cn1cc(cn1)C(=O)N1CCC2(CN(C2)c2cncc(c2)N2C(=O)c3ccc(Cl)cc3C2(C)C)CC1
BDBM279786 Cc1ccncc1C(=O)N1CCC2(CN(C2)c2cncc(c2)N2C(=O)c3ccc(Cl)cc3C2(C)C)CC1
BDBM279787 CCn1cc(cn1)C(=O)N1CCC2(CN(C2)c2cncc(c2)N2C(=O)c3ccc(Cl)cc3C2(C)C)CC1
BDBM279788 Cn1cc(cn1)C(=O)N1CC2(C1)CCN(CC2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279789 CCn1cc(cn1)C(=O)N1CC2(C1)CCN(CC2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279790 Cc1ccncc1C(=O)N1CC2(C1)CCN(CC2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279736 Cc1ccncc1C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279735 Cn1cncc1C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM279737 Cn1cc(cn1)C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(cc2C1(C)C)C#N
BDBM279738 CCn1cc(cn1)C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(cc2C1(C)C)C#N
BDBM279739 CC(C)n1cc(cn1)C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(cc2C1(C)C)C#N
BDBM279740 Cn1ccnc1C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(cc2C1(C)C)C#N
BDBM279741 Cn1nccc1C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(cc2C1(C)C)C#N
BDBM279742 Cn1cncc1C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(cc2C1(C)C)C#N
BDBM279743 Cc1ccncc1C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(cc2C1(C)C)C#N
BDBM279744 COc1ccc2C(=O)N(c3cncc(c3)N3CC4(CN(C4)C(=O)c4cnn(C)c4)C3)C(C)(C)c2n1
BDBM279745 COc1ccc2C(=O)N(c3cncc(c3)N3CC4(CN(C4)C(=O)c4cnccc4C)C3)C(C)(C)c2n1
BDBM279746 COc1ccc2C(=O)N(c3cncc(c3)N3CC4(CN(C4)C(=O)c4ccnn4C)C3)C(C)(C)c2n1
BDBM279747 CC1N(C(=O)c2ccc(Cl)cc12)c1cncc(c1)N1CC2(CN(C2)C(=O)c2cnn(C)c2)C1
BDBM279748 Cn1cc(cn1)C(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C11CC1
BDBM287716 OCc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287717 FC(F)(F)c1cc(cnn1)-c1nc2ccc(Cl)nc2n1C1CC1
BDBM287718 CCS(=O)(=O)NC(C)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287719 CCCCc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287720 Cc1ccc2nc(-c3cnnc(C)c3)n(C3CC3)c2c1
BDBM287721 Cc1nnccc1-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287722 Cc1cc(-c2nc3cc(F)c(F)cc3n2C2CC2)c(C)nn1
BDBM287723 FC(F)c1cc(cnn1)-c1nc2ccc(F)c(F)c2n1C1CC1
BDBM287623 Fc1ccc2nc(-c3ccnnc3)n(C3CC3)c2c1
BDBM287624 Fc1ccc2nc(-c3cnnc(c3)C#N)n(C3CC3)c2c1
BDBM287625 Fc1ccc2nc(-c3cnnc(Cl)c3)n(C3CC3)c2c1
BDBM287626 Fc1ccc2nc(-c3cnnc(C=C)c3)n(C3CC3)c2c1
BDBM287627 COC(=O)c1cc(cnn1)-c1nc2ccc(F)cc2n1C1CC1
BDBM287628 CCc1cc(cnn1)-c1nc2ccc(F)cc2n1C1CC1
BDBM287629 OC(c1cc(cnn1)-c1nc2ccc(F)cc2n1C1CC1)C(F)(F)F
BDBM287630 CCC(=O)NCc1cc(cnn1)-c1nc2ccc(F)cc2n1C1CC1
BDBM287631 CCOC(=O)NCc1cc(cnn1)-c1nc2ccc(F)cc2n1C1CC1
BDBM287632 Fc1ccc2nc(-c3cnnc(c3)N3CCOCC3)n(C3CC3)c2c1
BDBM287633 Fc1ccc(cc1)N1CCN(CC1)c1cc(cnn1)-c1nc2ccc(F)cc2n1C1CC1
BDBM287634 CC(C)(O)c1cc(cnn1)-c1nc2ccc(F)cc2n1C1CC1
BDBM287635 Fc1ccc2nc(-c3cnnc(NC4CCOCC4)c3)n(C3CC3)c2c1
BDBM287636 Fc1ccc2nc(-c3cnnc4ccccc34)n(C3CC3)c2c1
BDBM287637 Cc1cc(cnn1)-c1nc2ccc(F)cc2n1C1CC1
BDBM287638 CCS(=O)(=O)Nc1cc(cnn1)-c1nc2ccc(F)cc2n1C1CC1
BDBM287640 CC(C)NC(=O)CN1CCN(CC1)c1cc(cnn1)-c1nc2ccc(F)cc2n1C1CC1
BDBM287641 Cc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287642 Fc1ccc2nc(-c3cnnc(c3)N3CCN(CC(=O)N4CCCC4)CC3)n(C3CC3)c2c1
BDBM287643 CNc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287644 Fc1cc2nc(-c3cnnc(Cl)c3)n(C3CC3)c2cc1F
BDBM287645 COc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287646 CC(C)Oc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287647 CN(C)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287648 CCn1c(nc2ccc(F)cc12)-c1cnnc(C)c1
BDBM287649 Fc1cc2nc(-c3cnnc(OCC(F)(F)F)c3)n(C3CC3)c2cc1F
BDBM287650 COCCNc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287651 COc1cc(cnn1)-c1nc2ccc(cc2n1C1CC1)C#N
BDBM287652 Cc1cc(cnn1)-c1cc2ccc(F)cc2n1C1CC1
BDBM287653 CCS(=O)(=O)NCc1cc(cnn1)-c1nc2ccc(F)cc2n1C1CC1
BDBM287654 Fc1cc2nc(-c3cnnc(NCC(F)(F)F)c3)n(C3CC3)c2cc1F
BDBM287655 CCc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287656 Clc1cc(cnn1)-c1nc2ccc(cc2n1C1CC1)C#N
BDBM287657 Cc1cc(cnn1)-c1nc2ccc(cc2n1C1CC1)C#N
BDBM287658 CN1CCN(CC1)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287659 CC(=O)N1CCN(CC1)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287660 CS(=O)(=O)N1CCN(CC1)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287661 CC(C)(C)OC(=O)N1CCN(CC1)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287662 CCn1c(nc2ccc(cc12)C#N)-c1cnnc(OC)c1
BDBM287663 CCc1cc(cnn1)-c1nc2ccc(cc2n1CC)C#N
BDBM287664 FC(F)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287665 Fc1cc2nc(-c3cnnc(OC4CCC4)c3)n(C3CC3)c2cc1F
BDBM287666 Fc1cc2nc(-c3cnnc(c3)N3CCC(F)(F)CC3)n(C3CC3)c2cc1F
BDBM287667 Cc1cc(cnn1)-c1nc2ccc(Cl)nc2n1C1CC1
BDBM287668 Fc1cc2nc(-c3cnnc(c3)N3CCC(F)(F)C3)n(C3CC3)c2cc1F
BDBM287669 OC(c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1)C(F)(F)F
BDBM287670 CN(C)C1CCN(C1)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287671 Fc1ccc(cc1)-c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287672 Fc1ccc(cc1)C#Cc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287673 CC(C)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287674 CCS(=O)(=O)NCc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287675 CC(Oc1cc(ccn1)-c1nc2cc(F)c(F)cc2n1C1CC1)C(F)(F)F
BDBM287676 CNc1ccc2nc(-c3cnnc(C)c3)n(C3CC3)c2n1
BDBM287677 Fc1cc2nc(-c3ccnnc3)n(C3CC3)c2cc1F
BDBM287678 Fc1cc2n(C3CC3)c(nc2c(c1F)C(F)(F)F)-c1ccnnc1
BDBM287679 CC(F)(F)COc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287680 CC(C)c1cnncc1-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287681 Fc1cc2nc(-c3cnnc(c3)C3CC3)n(C3CC3)c2cc1F
BDBM287682 COc1ccc2nc(-c3cnnc(Cl)c3)n(C3CC3)c2n1
BDBM287683 Cc1cc(F)ccc1-c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287684 Fc1ccc(c(F)c1)-c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287685 Fc1ccc(cc1F)-c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287686 CC(=O)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287687 CCn1c(nc2cc(F)c(F)cc12)-c1cnnc(Cl)c1
BDBM287688 FC(F)c1cc(cnn1)-c1nc2ccc(cc2n1C1CC1)C#N
BDBM287689 CCn1c(nc2cc(F)c(F)cc12)-c1cnnc(c1)C(F)F
BDBM287691 CCn1c(nc2ccc(cc12)C#N)-c1cnnc(c1)C(F)F
BDBM287692 CC(F)(F)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287693 Fc1cc2nc(-c3cnnc(CC(F)(F)F)c3)n(C3CC3)c2cc1F
BDBM287694 CCn1c(nc2cc(F)c(F)cc12)-c1cnnc(c1)C1CC1
BDBM287695 FC(F)c1cc(cnn1)-c1nc2ccc(Cl)nc2n1C1CC1
BDBM287696 Cc1cnncc1-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287697 N#Cc1ccc2nc(-c3cnnc(c3)C3CC3)n(C3CC3)c2c1
BDBM287698 FC(F)c1cc(cnn1)-c1nc2ccc(nc2n1C1CC1)C#N
BDBM287699 CS(=O)(=O)NCc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287700 CN(Cc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1)S(C)(=O)=O
BDBM287701 CC(C)S(=O)(=O)NCc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287702 CS(=O)(=O)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287703 CCS(=O)(=O)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287704 CS(=O)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287705 CCS(=O)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287706 Clc1ccc2nc(-c3cnnc(c3)C3CC3)n(C3CC3)c2c1
BDBM287707 Fc1cc2nc(-c3cnnc(c3)C(F)(F)F)n(C3CC3)c2cc1F
BDBM287708 FC(F)(F)c1cc(cnn1)-c1nc2ccc(cc2n1C1CC1)C#N
BDBM287709 N#Cc1ccc2nc(-c3cnnc(c3)C3CC3)n(C3CC3)c2n1
BDBM287710 Fc1cc2nc(-c3cnnc(CN4CCCS4(=O)=O)c3)n(C3CC3)c2cc1F
BDBM287711 FC(F)(F)c1cc(cnn1)-c1nc2ccc(nc2n1C1CC1)C#N
BDBM287712 Cc1cc(cnn1)-c1nc2ccc(cc2n1C1CC1)C(F)(F)F
BDBM287713 CC(NS(C)(=O)=O)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287714 FCc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287715 Cc1nncc(-c2nc3cc(F)c(F)cc3n2C2CC2)c1C
BDBM280298 Fc1ccc(cc1)-c1cnnc(n1)N1CCN(CC(=O)NN2CCCC2)CC1
BDBM280299 C[C@H]1CC[C@@H](CC1)c1cnnc(n1)N1CCN(CC(=O)N[C@H]2CC[C@@H](CC2)N(C)C)CC1 |r,wU:4.7,24.29,wD:1.0,21.22,(-2.58,-27.86,;-1.06,-27.09,;.27,-27.86,;1.6,-27.09,;1.6,-25.55,;.27,-24.78,;-1.06,-25.55,;3.12,-24.78,;3.12,-23.24,;4.45,-22.47,;5.78,-23.24,;5.78,-24.78,;4.45,-25.55,;7.3,-25.55,;7.3,-27.09,;8.63,-27.86,;9.97,-27.09,;11.3,-27.86,;12.63,-27.09,;12.63,-25.55,;13.97,-27.86,;15.3,-27.09,;16.63,-27.86,;17.97,-27.09,;17.97,-25.55,;16.63,-24.78,;15.3,-25.55,;19.3,-24.78,;19.3,-23.24,;20.63,-25.55,;9.97,-25.55,;8.63,-24.78,)|
BDBM280300 CC[C@@H](O)C(=O)N1CCC(CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1 |r|
BDBM280301 OC1(CC1)C(=O)N1CC(C1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1
BDBM280302 Cc1ncc(CN2CCC(CC2)NC(=O)CN2CCN(CC2)c2nncc(n2)-c2ccc(F)cc2)[nH]1
BDBM280303 Fc1ccc(cc1)-c1cnnc(n1)N1CCN(CC(=O)NC2CCN(CC3=NCCN3)CC2)CC1 |t:28|
BDBM280304 Cc1nc[nH]c1CN1CCC(CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1
BDBM280305 Cc1nc[nH]c1CN1CCC(CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(Cl)cc1
BDBM280306 OC1C2COCC1CC(C2)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(cc1)C(F)(F)F |TLB:0:1:8.7.9:4.3.5,10:8:1:4.3.5,(11.24,-7.1,;9.75,-7.5,;8.96,-6.18,;8.96,-4.64,;7.47,-4.24,;8.26,-5.56,;8.26,-7.1,;6.77,-7.5,;6,-6.16,;7.49,-6.55,;4.67,-6.93,;3.34,-6.16,;3.34,-4.62,;2,-6.93,;.67,-6.16,;-.66,-6.93,;-2,-6.16,;-2,-4.62,;-.66,-3.85,;.67,-4.62,;-3.33,-3.85,;-3.33,-2.31,;-4.66,-1.54,;-6,-2.31,;-6,-3.85,;-4.66,-4.62,;-7.33,-4.62,;-7.33,-6.16,;-8.67,-6.93,;-10,-6.16,;-10,-4.62,;-8.67,-3.85,;-11.33,-6.93,;-12.67,-6.16,;-11.33,-8.47,;-12.67,-7.7,)|
BDBM280307 CN1CCO[C@@H](CNC(=O)CN2CCN(CC2)c2nncc(n2)-c2ccc(F)cc2)C1 |r|
BDBM280308 CN(C)[C@@H]1CCC[C@@H](C1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1 |r|
BDBM280309 C[C@H]1COCCC1NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(Cl)cc1 |r|
BDBM286211 Cc1ccncc1-c1cn2cc(F)ccc2n1
BDBM286214 Cc1cncc(c1)-c1cn2cc(F)ccc2n1
BDBM286216 Cc1c(nc2ccc(C)cn12)-c1cnccc1C
BDBM286218 Cc1c(nc2c(C)cccn12)-c1cnccc1C
BDBM286219 Cc1c(nc2cc(C)ccn12)-c1cnccc1C
BDBM286221 COc1cncc(c1)-c1nc2ccc(F)cn2c1C
BDBM286222 Cc1c(nc2ccc(F)cn12)-c1cncc(C)c1
BDBM286223 Cc1c(nc2ccc(F)cn12)-c1cnccc1C
BDBM286224 Cc1c(nc2ccc(F)cn12)-c1cncc2ccccc12
BDBM287724 Fc1cc2nc(-c3cnnc(S)c3)n(C3CC3)c2cc1F
BDBM287725 FC(F)c1cc(cnn1)-c1nc2cc(F)c(F)cc2[nH]1
BDBM287726 Cn1c(nc2cc(F)c(F)cc12)-c1cnnc(c1)C(F)F
BDBM287727 CCCn1c(nc2cc(F)c(F)cc12)-c1cnnc(c1)C(F)F
BDBM287728 Fc1cc2nc(-c3cnnc4CCCCc34)n(C3CC3)c2cc1F
BDBM287729 Cc1cc(cnn1)-c1nc2cc(ccc2n1C1CC1)C#N
BDBM287730 Cc1cc(ccn1)-c1nc2cc(F)c(F)cc2n1C1CCC1
BDBM287731 Oc1ccc2nc(-c3cnnc(c3)C(F)F)n(C3CC3)c2c1
BDBM287732 OC(=O)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM280310 O[C@H]1COC[C@H]1NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(cc1)C(F)(F)F |r|
BDBM280311 O[C@@H]1COCC[C@@H]1NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(Cl)cc1 |r|
BDBM280312 CC(=O)N[C@@H]1CCC[C@@H](C1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(Cl)cc1 |r|
BDBM280313 Cc1ccccc1-c1cnnc(n1)N1CCN(CC1)c1ccc(F)cc1
BDBM280314 Clc1ccc(cc1)-c1cnnc(n1)N1CCN(CC1)C1CCOCC1
BDBM280315 CC(C)NC(=O)NC1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1
BDBM280316 Cc1ccccc1-c1cnnc(n1)N1CCC(CCCO)CC1
BDBM280317 Cc1ccccc1-c1cnnc(n1)N1CC[C@H](C1)Oc1ccncc1 |r|
BDBM286225 Cc1c(nc2cc(F)ccn12)-c1cncc(F)c1
BDBM286226 Fc1ccc2nc(c(C3CC3)n2c1)-c1cccnc1
BDBM286228 Cc1ccncc1-c1nc2ccc(F)cn2c1C1CC1
BDBM286237 CC(O)(c1cncc(c1)-c1nc2ccc(F)cn2c1C1CC1)C(F)(F)F
BDBM286240 Fc1cccn2c(C3CC3)c(nc12)-c1cncc2ccccc12
BDBM287733 Cc1cc(cnn1)-c1nc2cccc(F)c2n1C1CC1
BDBM287734 Cc1cc(cnn1)-c1nc2cc(Cl)ccc2n1C1CC1
BDBM287735 Cc1cc(cnn1)-c1nc2c(Cl)cccc2n1C1CC1
BDBM287736 COCc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287737 COC(=O)c1cc(cnn1)-c1nc2ccc(cc2n1C1CC1)C#N
BDBM287738 OC(=O)c1cc(cnn1)-c1nc2ccc(cc2n1C1CC1)C#N
BDBM287739 Fc1cc2nc(-c3cnnc(OCC4CC4)c3)n(C3CC3)c2cc1F
BDBM287740 FC(F)(F)COc1cc(cnn1)-c1nc2ccc(cc2n1C1CC1)C#N
BDBM287741 FC(F)c1cc(cnn1)-c1nc2cc(F)c(Cl)cc2n1C1CC1
BDBM280318 CN(CCCS(C)(=O)=O)c1nncc(n1)-c1ccc2ccccc2c1
BDBM280319 CC(=O)N1CCC(CNc2nncc(n2)-c2ccc3ccccc3c2)CC1
BDBM280320 O=C1NCC2(CCN(CC2)c2nncc(n2)-c2ccc3ccccc3c2)O1
BDBM280321 Cn1c(cc2ccccc12)-c1cnnc(n1)N1CCOCC1
BDBM280322 CC(C)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(nc1)C#N
BDBM280323 CC(C)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1cccc2CCOCc12
BDBM280324 CC(C)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc2OCCc2c1
BDBM280325 CC(C)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc2ncsc2c1
BDBM287742 FC(F)c1cc(cnn1)-c1nc2cc(F)c(cc2n1C1CC1)C#N
BDBM287743 Fc1cc2nc(-c3cnnc4CCCc34)n(C3CC3)c2cc1F
BDBM287744 FC(F)c1cc(cnn1)-c1nc2ccc(F)cc2n1C1CC1
BDBM287745 CSc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287746 CC(C)Sc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287747 FC(F)Sc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287748 Oc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287749 FC(F)Oc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287750 CC(O)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM280326 CC(C)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(cc1)C(F)(F)F
BDBM280327 CC(C)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc2N(C)NCc2c1
BDBM280328 C(C1CCCCC1)c1cnnc(n1)N1CCOCC1
BDBM280329 Cc1ccccc1-c1cnnc(n1)N(Cc1ccccn1)S(C)(=O)=O
BDBM280330 Cc1ccccc1-c1cnnc(n1)C1CCCN(C1)c1cnccn1
BDBM280331 CC(C)CC(=O)NN1CCN(CC1)c1nncc(n1)-c1ccc(Cl)cc1
BDBM280332 CN(C)[C@H]1CC[C@@H](CC1)NC(=O)C(O)C1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1 |r,wU:3.2,wD:6.9,(10.03,-3.02,;10.03,-4.56,;11.36,-5.33,;8.69,-5.33,;8.69,-6.87,;7.36,-7.64,;6.03,-6.87,;6.03,-5.33,;7.36,-4.56,;4.69,-7.64,;3.36,-6.87,;3.36,-5.33,;2.02,-7.64,;2.02,-9.18,;.69,-6.87,;-.64,-7.64,;-1.98,-6.87,;-1.98,-5.33,;-.64,-4.56,;.69,-5.33,;-3.31,-4.56,;-3.31,-3.02,;-4.64,-2.25,;-5.98,-3.02,;-5.98,-4.56,;-4.64,-5.33,;-7.31,-5.33,;-8.64,-4.56,;-9.98,-5.33,;-9.98,-6.87,;-11.31,-7.64,;-8.64,-7.64,;-7.31,-6.87,)|
BDBM280333 C(Oc1cnnc(n1)N1CCOCC1)c1ccccc1
BDBM287751 CC(F)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM287752 Fc1cc2nc(-c3cnnc(SC(F)(F)F)c3)n(C3CC3)c2cc1F
BDBM287753 FC(F)c1cc(cnn1)-c1nc2ccccc2n1C1CC1
BDBM287754 CCCn1c(nc2ccccc12)-c1cnnc(c1)C(F)F
BDBM287755 FC(F)Oc1cc(cnn1)-c1nc2ccc(cc2n1C1CC1)[N+]#[C-]
BDBM287756 FC(F)c1cc(cnn1)-c1c(C#N)c2ccccc2n1C1CC1
BDBM287757 Cn1c(c(C#N)c2ccccc12)-c1cnnc(c1)C(F)F
BDBM287758 CC(F)c1cc(cnn1)-c1nc2ccc(cc2n1C1CC1)C#N
BDBM280334 Clc1ccc(CNc2cnnc(n2)N2CCOCC2)cc1
BDBM280267 Cc1ccccc1-c1cnnc(n1)N1CCN(CC(=O)NC2CC[C@@](C)(O)CC2)CC1 |r,wU:24.26,wD:24.27,(-5.63,1.44,;-5.63,-.1,;-6.96,-.87,;-6.96,-2.41,;-5.63,-3.18,;-4.29,-2.41,;-4.29,-.87,;-2.96,-.1,;-2.96,1.44,;-1.63,2.21,;-.29,1.44,;-.29,-.1,;-1.63,-.87,;1.04,-.87,;1.04,-2.41,;2.38,-3.18,;3.71,-2.41,;5.04,-3.18,;6.38,-2.41,;6.38,-.87,;7.71,-3.18,;9.04,-2.41,;10.38,-3.18,;11.71,-2.41,;11.71,-.87,;13.05,-.1,;13.05,-1.64,;10.38,-.1,;9.04,-.87,;3.71,-.87,;2.38,-.1,)|
BDBM280268 CC(C)[C@@H](CO)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(cc1)C(F)(F)F |r|
BDBM280269 CN(C)[C@H]1CC[C@@H](CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(Cl)cc1 |r,wU:3.2,wD:6.9,(13.05,1.44,;13.05,-.1,;14.38,-.87,;11.71,-.87,;11.71,-2.41,;10.38,-3.18,;9.04,-2.41,;9.04,-.87,;10.38,-.1,;7.71,-3.18,;6.38,-2.41,;6.38,-.87,;5.04,-3.18,;3.71,-2.41,;2.38,-3.18,;1.04,-2.41,;1.04,-.87,;2.38,-.1,;3.71,-.87,;-.29,-.1,;-.29,1.44,;-1.62,2.21,;-2.96,1.44,;-2.96,-.1,;-1.62,-.87,;-4.29,-.87,;-5.63,-.1,;-6.96,-.87,;-6.96,-2.41,;-8.29,-3.18,;-5.63,-3.18,;-4.29,-2.41,)|
BDBM280270 CO[C@H]1CC[C@@H](CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc2n(C)ncc2c1 |r,wU:2.1,wD:5.8,(14.38,-.87,;13.05,-.1,;11.71,-.87,;11.71,-2.41,;10.38,-3.18,;9.04,-2.41,;9.04,-.87,;10.38,-.1,;7.71,-3.18,;6.38,-2.41,;6.38,-.87,;5.04,-3.18,;3.71,-2.41,;2.38,-3.18,;1.04,-2.41,;1.04,-.87,;2.38,-.1,;3.71,-.87,;-.29,-.1,;-.29,1.44,;-1.62,2.21,;-2.96,1.44,;-2.96,-.1,;-1.62,-.87,;-4.29,-.87,;-4.29,-2.41,;-5.63,-3.18,;-6.96,-2.41,;-8.42,-2.89,;-8.9,-4.35,;-9.33,-1.64,;-8.42,-.4,;-6.96,-.87,;-5.63,-.1,)|
BDBM280271 CN(C)[C@H]1CC[C@@H](CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1 |r,wU:3.2,wD:6.9,(13.05,1.44,;13.05,-.1,;14.38,-.87,;11.71,-.87,;11.71,-2.41,;10.38,-3.18,;9.05,-2.41,;9.05,-.87,;10.38,-.1,;7.71,-3.18,;6.38,-2.41,;6.38,-.87,;5.04,-3.18,;3.71,-2.41,;2.38,-3.18,;1.04,-2.41,;1.04,-.87,;2.38,-.1,;3.71,-.87,;-.29,-.1,;-.29,1.44,;-1.62,2.21,;-2.96,1.44,;-2.96,-.1,;-1.62,-.87,;-4.29,-.87,;-5.63,-.1,;-6.96,-.87,;-6.96,-2.41,;-8.29,-3.18,;-5.63,-3.18,;-4.29,-2.41,)|
BDBM280272 Fc1ccc(cc1)-c1cnnc(n1)N1CCN(CC(=O)N[C@H]2CC[C@@H](CC2)N2CCNC(=O)C2)CC1 |r,wU:24.29,wD:21.22,(-8.29,-3.18,;-6.96,-2.41,;-6.96,-.87,;-5.63,-.1,;-4.29,-.87,;-4.29,-2.41,;-5.63,-3.18,;-2.96,-.1,;-2.96,1.44,;-1.62,2.21,;-.29,1.44,;-.29,-.1,;-1.62,-.87,;1.04,-.87,;1.04,-2.41,;2.38,-3.18,;3.71,-2.41,;5.04,-3.18,;6.38,-2.41,;6.38,-.87,;7.71,-3.18,;9.05,-2.41,;10.38,-3.18,;11.71,-2.41,;11.71,-.87,;10.38,-.1,;9.05,-.87,;13.05,-.1,;14.38,-.87,;15.71,-.1,;15.71,1.44,;14.38,2.21,;14.38,3.75,;13.05,1.44,;3.71,-.87,;2.38,-.1,)|
BDBM280273 Clc1ccc(cc1)-c1cnnc(n1)N1CCN(CC(=O)NC2CCS(=O)(=O)CC2)CC1
BDBM280274 Fc1ccc(cc1)-c1cnnc(n1)N1CCN(CC(=O)N[C@H]2CC[C@@H](CC2)N2CCOCC2)CC1 |r,wU:24.29,wD:21.22,(-8.29,-3.18,;-6.96,-2.41,;-6.96,-.87,;-5.62,-.1,;-4.29,-.87,;-4.29,-2.41,;-5.63,-3.18,;-2.96,-.1,;-2.96,1.44,;-1.62,2.21,;-.29,1.44,;-.29,-.1,;-1.62,-.87,;1.04,-.87,;1.04,-2.41,;2.38,-3.18,;3.71,-2.41,;5.04,-3.18,;6.38,-2.41,;6.38,-.87,;7.71,-3.18,;9.05,-2.41,;10.38,-3.18,;11.71,-2.41,;11.71,-.87,;10.38,-.1,;9.05,-.87,;13.05,-.1,;14.38,-.87,;15.71,-.1,;15.71,1.44,;14.38,2.21,;13.05,1.44,;3.71,-.87,;2.38,-.1,)|
BDBM280275 CN(C)[C@H]1CC[C@@H](CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccccc1C |r,wU:3.2,wD:6.9,(14.38,-.87,;13.05,-.1,;13.05,1.44,;11.71,-.87,;11.71,-2.41,;10.38,-3.18,;9.05,-2.41,;9.05,-.87,;10.38,-.1,;7.71,-3.18,;6.38,-2.41,;6.38,-.87,;5.04,-3.18,;3.71,-2.41,;2.38,-3.18,;1.04,-2.41,;1.04,-.87,;2.38,-.1,;3.71,-.87,;-.29,-.1,;-.29,1.44,;-1.62,2.21,;-2.96,1.44,;-2.96,-.1,;-1.62,-.87,;-4.29,-.87,;-4.29,-2.41,;-5.63,-3.18,;-6.96,-2.41,;-6.96,-.87,;-5.62,-.1,;-5.62,1.44,)|
BDBM280276 Fc1ccc(cc1)-c1cnnc(n1)N1CCN(CC(=O)NC2CCN(CC(=O)N3CCOCC3)CC2)CC1
BDBM280277 CN([C@H]1CC[C@@H](CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1)C(C)=O |r,wU:2.1,wD:5.8,(13.05,1.44,;13.05,-.1,;11.71,-.87,;11.71,-2.41,;10.38,-3.18,;9.05,-2.41,;9.05,-.87,;10.38,-.1,;7.71,-3.18,;6.38,-2.41,;6.38,-.87,;5.04,-3.18,;3.71,-2.41,;2.38,-3.18,;1.04,-2.41,;1.04,-.87,;2.38,-.1,;3.71,-.87,;-.29,-.1,;-.29,1.44,;-1.62,2.21,;-2.96,1.44,;-2.96,-.1,;-1.62,-.87,;-4.29,-.87,;-5.62,-.1,;-6.96,-.87,;-6.96,-2.41,;-8.29,-3.18,;-5.63,-3.18,;-4.29,-2.41,;14.38,-.87,;15.71,-.1,;14.38,-2.41,)|
BDBM280278 CNC(=O)CN1CCC(CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1
BDBM280279 Fc1ccc(cc1)-c1cnnc(n1)N1CCN(CC(=O)NCCN2CCS(=O)(=O)CC2)CC1
BDBM280280 CC(=O)N[C@H]1CC[C@@H](CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(C)cc1 |r,wU:4.3,wD:7.10,(15.71,-.1,;14.38,-.87,;14.38,-2.41,;13.05,-.1,;11.71,-.87,;11.71,-2.41,;10.38,-3.18,;9.04,-2.41,;9.04,-.87,;10.38,-.1,;7.71,-3.18,;6.38,-2.41,;6.38,-.87,;5.04,-3.18,;3.71,-2.41,;2.38,-3.18,;1.04,-2.41,;1.04,-.87,;2.38,-.1,;3.71,-.87,;-.29,-.1,;-.29,1.44,;-1.62,2.21,;-2.96,1.44,;-2.96,-.1,;-1.62,-.87,;-4.29,-.87,;-5.62,-.1,;-6.96,-.87,;-6.96,-2.41,;-8.29,-3.18,;-5.62,-3.18,;-4.29,-2.41,)|
BDBM280281 Cc1ccc(cc1)-c1cnnc(n1)N1CCN(CC(=O)N[C@H]2CC[C@@H](CC2)S(C)(=O)=O)CC1 |r,wU:24.29,wD:21.22,(-8.29,-3.18,;-6.96,-2.41,;-6.96,-.87,;-5.62,-.1,;-4.29,-.87,;-4.29,-2.41,;-5.62,-3.18,;-2.96,-.1,;-2.96,1.44,;-1.62,2.21,;-.29,1.44,;-.29,-.1,;-1.62,-.87,;1.04,-.87,;1.04,-2.41,;2.38,-3.18,;3.71,-2.41,;5.04,-3.18,;6.38,-2.41,;6.38,-.87,;7.71,-3.18,;9.04,-2.41,;10.38,-3.18,;11.71,-2.41,;11.71,-.87,;10.38,-.1,;9.04,-.87,;13.05,-.1,;14.38,-.87,;13.05,1.44,;13.05,-1.64,;3.71,-.87,;2.38,-.1,)|
BDBM280282 CN1CC[C@@H](CC1=O)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(Cl)cc1 |r|
BDBM280283 CNC(=O)CO[C@H]1CC[C@@H](CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1 |r,wU:6.5,wD:9.12,(18.38,-.1,;17.05,-.87,;15.71,-.1,;15.71,1.44,;14.38,-.87,;13.05,-.1,;11.71,-.87,;11.71,-2.41,;10.38,-3.18,;9.04,-2.41,;9.04,-.87,;10.38,-.1,;7.71,-3.18,;6.38,-2.41,;6.38,-.87,;5.04,-3.18,;3.71,-2.41,;2.38,-3.18,;1.04,-2.41,;1.04,-.87,;2.38,-.1,;3.71,-.87,;-.29,-.1,;-.29,1.44,;-1.62,2.21,;-2.96,1.44,;-2.96,-.1,;-1.62,-.87,;-4.29,-.87,;-5.62,-.1,;-6.96,-.87,;-6.96,-2.41,;-8.29,-3.18,;-5.62,-3.18,;-4.29,-2.41,)|
BDBM280284 NC(=O)N1CCC(O)(CNC(=O)CN2CCN(CC2)c2nncc(n2)-c2ccc(Cl)cc2)CC1
BDBM280285 Cc1ccc(cc1)-c1cnnc(n1)N1CCN(CC(=O)NC2CCN(CCNS(C)(=O)=O)CC2)CC1
BDBM280286 OC1CCN(CC1)[C@H]1CC[C@@H](CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1 |r,wU:7.7,wD:10.14,(17.05,2.21,;15.71,1.44,;15.71,-.1,;14.38,-.87,;13.05,-.1,;13.05,1.44,;14.38,2.21,;11.71,-.87,;11.71,-2.41,;10.38,-3.18,;9.04,-2.41,;9.04,-.87,;10.38,-.1,;7.71,-3.18,;6.38,-2.41,;6.38,-.87,;5.04,-3.18,;3.71,-2.41,;2.38,-3.18,;1.04,-2.41,;1.04,-.87,;2.38,-.1,;3.71,-.87,;-.29,-.1,;-.29,1.44,;-1.62,2.21,;-2.96,1.44,;-2.96,-.1,;-1.62,-.87,;-4.29,-.87,;-5.62,-.1,;-6.96,-.87,;-6.96,-2.41,;-8.29,-3.18,;-5.62,-3.18,;-4.29,-2.41,)|
BDBM280287 CN(C)C(=O)Cn1cc(NC(=O)CN2CCN(CC2)c2nncc(n2)-c2ccc(F)cc2)cn1
BDBM280288 CN(C)C(=O)Cn1cc(NC(=O)CN2CCN(CC2)c2nncc(n2)-c2ccc(C)cc2)cn1
BDBM280289 CN(C)C(=O)Cn1cc(NC(=O)CN2CCN(CC2)c2nncc(n2)-c2ccc(Cl)cc2)cn1
BDBM280290 CNC(=O)Cn1cc(NC(=O)CN2CCN(CC2)c2nncc(n2)-c2ccc(C)cc2)cn1
BDBM280291 CNC(=O)Cn1cc(NC(=O)CN2CCN(CC2)c2nncc(n2)-c2ccc(F)cc2)cn1
BDBM280292 CNC(=O)Cn1cc(NC(=O)CN2CCN(CC2)c2nncc(n2)-c2ccc(Cl)cc2)cn1
BDBM280293 CN1CCNC(=O)[C@@]11CCC(CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1 |r,wU:7.7,(12,1.93,;13.34,1.16,;14.67,1.93,;16,1.16,;16,-.38,;14.67,-1.15,;14.67,-2.69,;13.34,-.38,;13.34,-1.92,;12,-2.69,;10.67,-1.92,;10.67,-.38,;12,.39,;9.34,-2.69,;8,-1.92,;8,-.38,;6.67,-2.69,;5.33,-1.92,;4,-2.69,;2.67,-1.92,;2.67,-.38,;4,.38,;5.33,-.38,;1.33,.38,;1.33,1.92,;,2.69,;-1.33,1.92,;-1.33,.38,;,-.38,;-2.67,-.38,;-4,.38,;-5.33,-.38,;-5.33,-1.92,;-6.67,-2.69,;-4,-2.69,;-2.67,-1.92,)|
BDBM280294 CN(C)[C@H]1CC[C@@H](CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1cc(F)ccc1F |r,wU:6.9,wD:3.2,(14.67,1.93,;14.67,.39,;16,-.38,;13.34,-.38,;12,.39,;10.67,-.38,;10.67,-1.92,;12,-2.69,;13.34,-1.92,;9.34,-2.69,;8,-1.92,;8,-.38,;6.67,-2.69,;5.33,-1.92,;4,-2.69,;2.67,-1.92,;2.67,-.38,;4,.38,;5.33,-.38,;1.33,.38,;1.33,1.92,;,2.69,;-1.33,1.92,;-1.33,.38,;,-.38,;-2.67,-.38,;-2.67,-1.92,;-4,-2.69,;-4,-4.23,;-5.33,-1.92,;-5.33,-.38,;-4,.38,;-4,1.92,)|
BDBM280295 CN1CC[C@@H](CC1=O)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc2COCc2c1 |r|
BDBM280296 CNC(=O)CN1CCC(CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(C)cc1
BDBM280297 Cc1ccccc1-c1cnnc(n1)N1CCN(CC(=O)Nc2cccnc2)CC1
BDBM286329 c1ccn2nc(nc2c1)-c1cncc2ccccc12
BDBM286333 Clc1cccn2nc(nc12)-c1cncc2ccccc12
BDBM286334 CC(C)(O)c1cncc(c1)-c1nc2ccc(F)cn2n1
BDBM286336 Cc1cccc2nc(nn12)-c1cncc(Br)c1
BDBM286339 Fc1cc(F)c2nc(nn2c1)-c1cncc2ccccc12
BDBM286341 Fc1ccn2nc(nc2c1)-c1cncc2ccccc12
BDBM286359 Fc1ccc2nc(nn2c1)-c1cncc2ccccc12
BDBM336949 Cc1c(cncc1C1COc2c(O1)cccc2C(N)=O)C#N
BDBM336317 CC(=O)N1CCc2cc(cc(Cl)c12)-c1cncc(C#N)c1C
BDBM336320 CC(=O)N1CCc2cc(cc(Cl)c12)-c1cncc2ccccc12
BDBM336321 CC(=O)N1CCc2cc(cc(Cl)c12)-c1cncc(c1)C(F)(F)F
BDBM336330 CCc1c(F)cncc1-c1cc2CCN(C(C)=O)c2c(Cl)c1
BDBM336331 CC(=O)N1CCc2cc(cc(Cl)c12)-c1cncc(F)c1C
BDBM336332 CC(=O)N1CCc2cc(cc(F)c12)-c1cccnc1
BDBM336347 CC(=O)N1CCc2cc(cc(F)c12)-c1cncc(F)c1
BDBM50238101 CCCC(O)c1cncnc1Nc1ccc(F)cc1
BDBM50238102 OC(c1ccccc1)c1cncnc1Nc1ccc(F)cc1
BDBM336351 CC(=O)N1CCc2cc(cc(F)c12)-c1cncc(F)c1C
BDBM336515 CCc1c(F)cncc1-c1cc2CCN(C(C)=O)c2c(F)c1
BDBM336518 CC(=O)N1CCc2cc(cc(F)c12)-c1cncc(c1)C#N
BDBM336519 CC(=O)N1CCc2cc(cc(F)c12)-c1cncc(C#N)c1C
BDBM336520 CC(=O)N1CCc2cc(cc(F)c12)-c1cnccc1C
BDBM336521 CC(=O)N1CCc2cc(c(F)cc12)-c1cccnc1
BDBM336522 CC(=O)N1CCc2cc(c(F)cc12)-c1cncc(F)c1
BDBM50238103 CC(O)(C1CCN(CC1)S(C)(=O)=O)c1cncnc1Nc1ccc(F)cc1
BDBM50238104 CCCCC(O)(C1CCN(CC1)S(C)(=O)=O)c1cncnc1Nc1ccc(F)cc1
BDBM50238105 CS(=O)(=O)N1CCC(CC1)C(O)c1cncnc1Nc1ccc(F)cc1
BDBM50238107 COc1ccc(Nc2ncncc2C(O)C2CCN(CC2)S(C)(=O)=O)cc1
BDBM50238108 CS(=O)(=O)N1CCC(CC1)C(O)c1cncnc1Nc1ccc(cc1)C#N
BDBM50238109 CS(=O)(=O)N1CCC(CC1)C(O)c1cncnc1Nc1ccc(cc1)C(F)(F)F
BDBM50238110 CS(=O)(=O)N1CCC(CC1)C(O)c1cncnc1Sc1ccc(F)cc1
BDBM336523 CCc1c(F)cncc1-c1cc2CCN(C(C)=O)c2cc1F
BDBM336524 CC(=O)N1CCc2cc(c(Cl)cc12)-c1cccnc1
BDBM336525 CC(=O)N1CCc2cc(c(Cl)cc12)-c1cncc(F)c1
BDBM336526 CCc1c(F)cncc1-c1cc2CCN(C(C)=O)c2cc1Cl
BDBM336528 O=C(CCC#N)N1CCc2cc(ccc12)-c1cccnc1
BDBM336540 Fc1cncc(c1)-c1cc2CCN(C(=O)C(F)(F)F)c2c(Cl)c1
BDBM336541 Fc1cncc(c1)-c1cc2CCN(C(=O)C(F)(F)F)c2c(F)c1
BDBM336542 CC(=S)N1CCc2cc(ccc12)-c1cccnc1
BDBM50238111 CS(=O)(=O)N1CCC(O)(CC1)c1cncnc1Nc1ccc(F)cc1
BDBM50238112 CS(=O)(=O)N1CCC(CC(O)c2cncnc2Nc2ccc(F)cc2)CC1
BDBM50238113 CS(=O)(=O)N1CCC(CC1)C(=O)c1cncnc1Nc1ccc(F)cc1
BDBM50238120 FC(F)(F)c1cccc(Nc2ccncc2S(=O)(=O)N2CCOCC2)c1
BDBM50238121 OC(C1CCNCC1)c1cncnc1Nc1ccc(F)cc1
BDBM50238122 CS(=O)(=O)N1CCC(CC1)C(O)c1cncnc1Cc1ccccc1
BDBM50238123 CS(=O)(=O)N1CCC(CC1)C(O)c1cncnc1Nc1cccc2ccccc12
BDBM336235 CC(=O)N1CCc2cc(cc(Cl)c12)-c1cccnc1
BDBM336244 CC(=O)N1CCc2cc(cc(Cl)c12)-c1cncc(F)c1
BDBM336267 COc1cncc(c1)-c1cc2CCN(C(C)=O)c2c(Cl)c1
BDBM336313 CC(=O)N1CCc2cc(cc(Cl)c12)-c1cnccc1C(F)(F)F
BDBM50238114 CC(C)C(O)(C1CCN(CC1)S(C)(=O)=O)c1cncnc1Nc1ccc(F)cc1
BDBM50238115 CS(=O)(=O)N1CCC(CC1)C(O)(c1cncnc1Nc1ccc(F)cc1)C(F)(F)F
BDBM336862 CC(=O)N1CC(C1)Oc1cncc(c1)C1COc2c(O1)cccc2C(N)=O
BDBM336900 CC(=O)N1CCC(CC1)Oc1cncc(c1)C1COc2c(O1)cccc2C#N
BDBM336848 CC(=O)N1CCC(CC1)Oc1cncc(c1)C1COc2c(O1)cccc2C(N)=O
BDBM336858 CC(=O)N1CC[C@@H](C1)Oc1cncc(c1)C1COc2c(O1)cccc2C(N)=O |r|
BDBM336866 Cc1c(F)cncc1C1COc2c(O1)cccc2C(N)=O
BDBM336516 CC(=O)N1CCc2cc(cc(F)c12)-c1cncc(c1)C(C)(O)C(F)(F)F
BDBM50238119 CS(=O)(=O)N1CCC(C1)C(O)c1cncnc1Nc1ccc(F)cc1
BDBM325751 CCOC(=O)CC1CCc2c1cncc2-c1ccc(c(F)c1)C(F)(F)F
BDBM325752 CNC(=O)CC1CCc2c1cncc2-c1ccc(c(F)c1)C(F)(F)F
BDBM325753 CCNC(=O)CC1CCc2c1cncc2-c1ccc(c(F)c1)C(F)(F)F
BDBM325754 CCCNC(=O)CC1CCc2c1cncc2-c1ccc(c(F)c1)C(F)(F)F
BDBM325755 Fc1cc(ccc1C(F)(F)F)-c1cncc2C(CC(=O)NC3CC3)CCc12
BDBM325756 Fc1cc(ccc1C(F)(F)F)-c1cncc2C(CC(=O)NCC3CC3)CCc12
BDBM325757 COCCNC(=O)CC1CCc2c1cncc2-c1ccc(c(F)c1)C(F)(F)F
BDBM325758 Fc1cc(ccc1C(F)(F)F)-c1cncc2C(CC(=O)N3CCCCC3)CCc12
BDBM325759 Fc1cc(ccc1C(F)(F)F)-c1cncc2C(CC(=O)N3CCOCC3)CCc12
BDBM325760 Fc1cc(ccc1C(F)(F)F)-c1cncc2C(CC(=O)Nc3ccon3)CCc12
BDBM325761 Fc1cc(ccc1C(F)(F)F)-c1cncc2C(CC(=O)Nc3cc[nH]n3)CCc12
BDBM325762 Cn1cc(NC(=O)CC2CCc3c2cncc3-c2ccc(c(F)c2)C(F)(F)F)cn1
BDBM325763 CN(C)C(=O)CC1CCc2c1cncc2-c1ccc(cc1F)C(F)(F)F
BDBM325764 CCN(C)C(=O)CC1CCc2c1cncc2-c1ccc(cc1F)C(F)(F)F
BDBM325765 CC(C)N(C)C(=O)CC1CCc2c1cncc2-c1ccc(cc1F)C(F)(F)F
BDBM325766 CN(C1CC1)C(=O)CC1CCc2c1cncc2-c1ccc(cc1F)C(F)(F)F
BDBM325767 CCN(C1CC1)C(=O)CC1CCc2c1cncc2-c1ccc(cc1F)C(F)(F)F
BDBM325768 Fc1cc(ccc1-c1cncc2C(CC(=O)N3CCC3)CCc12)C(F)(F)F
BDBM325769 OCC1CN(C1)C(=O)CC1CCc2c1cncc2-c1ccc(cc1F)C(F)(F)F
BDBM325770 COC1CN(C1)C(=O)CC1CCc2c1cncc2-c1ccc(cc1F)C(F)(F)F
BDBM325771 Fc1cc(ccc1-c1cncc2C(CC(=O)N3CCCC3)CCc12)C(F)(F)F
BDBM325772 C[C@H]1CCCN1C(=O)CC1CCc2c1cncc2-c1ccc(cc1F)C(F)(F)F |r|
BDBM325773 CCOC(=O)CC1CCCc2c1cncc2-c1ccc(cc1F)C(F)(F)F
BDBM325774 OCCC1CCCc2c1cncc2-c1ccc(cc1F)C(F)(F)F
BDBM325775 CNC(=O)CC1CCCc2c1cncc2-c1ccc(cc1F)C(F)(F)F
BDBM325776 CN(C)C(=O)CC1CCCc2c1cncc2-c1ccc(cc1F)C(F)(F)F
BDBM325778 CN(C)C(=O)CC1CCCc2c1cncc2-c1ccc(cc1F)C(F)(F)F
BDBM325779 CN(C)C(=O)CC1CCCc2c1cncc2-c1ccc(cc1F)C(F)(F)F
BDBM325780 CCNC(=O)CC1CCCc2c1cncc2-c1ccc(cc1F)C(F)(F)F
BDBM325781 Fc1cc(ccc1-c1cncc2C(CC(=O)NC3CC3)CCCc12)C(F)(F)F
BDBM325782 Fc1cc(ccc1-c1cncc2C(CC(=O)NCC3CC3)CCCc12)C(F)(F)F
BDBM325783 COCCNC(=O)CC1CCCc2c1cncc2-c1ccc(cc1F)C(F)(F)F
BDBM336860 CC(=O)N1CC[C@H](C1)Oc1cncc(c1)C1COc2c(O1)cccc2C(N)=O |r|
BDBM336322 CC(=O)N1CCc2cc(cc(Cl)c12)-c1cncc(c1)C(C)(O)C(F)(F)F
BDBM336908 CN(C)C(=O)COCc1cncc(c1)C1COc2c(O1)cccc2C#N
BDBM336874 CN(C)C(=O)COCc1cncc(c1)C1COc2c(O1)cccc2C(N)=O
BDBM336882 CN(C)C(=O)Cc1cncc(c1)C1COc2c(O1)cccc2C(N)=O
BDBM336872 CN(Cc1cncc(c1)C1COc2c(O1)cccc2C(N)=O)C(=O)C1CC1
BDBM336894 CN1C(CCC1=O)c1cncc(c1)C1COc2c(O1)cccc2C#N
BDBM336834 CN1C(CCC1=O)c1cncc(c1)C1COc2c(O1)cccc2C(N)=O
BDBM336890 CNC(=O)c1cccc2OC(COc12)c1cncc(OC2CCN(CC2)C(C)=O)c1
BDBM336880 CNC(=O)c1cccc2OC(COc12)c1cncc(c1)C(F)(F)F
BDBM336943 Cc1cncc(c1)C1COc2c(O1)cccc2C(N)=O
BDBM336951 CS(=N)(=O)Cc1cncc(c1)C1COc2c(O1)cccc2C#N
BDBM336912 CS(=O)(=O)COc1cncc(c1)C1COc2c(O1)cccc2C#N
BDBM336898 CS(=O)(=O)Cc1cncc(c1)C1COc2c(O1)cccc2C#N
BDBM336840 CS(=O)(=O)Cc1cncc(c1)C1COc2c(O1)cccc2C(N)=O
BDBM336939 C[C@@H](O)c1c(F)cncc1C1COc2c(O1)cccc2C(N)=O |r|
BDBM325739 Fc1cc(ccc1C(F)(F)F)-c1cncc2CCC(CC(=O)NCC3CC3)c12
BDBM336945 CCS(=O)(=O)NC(C1CC1)c1cncc(c1)C1COc2c(O1)cccc2C(N)=O
BDBM347701 CN(C)\C=C(\Oc1ccc(cc1)C(F)(F)F)C(=O)c1ccccc1Cl
BDBM347702 CN(C)\C=C(\Oc1ccc(Cl)cc1F)C(=O)c1ccccc1Cl
BDBM347703 CN(C)C(=C\OC1(CC=CC=C1)C#N)\C(=O)c1ccccc1Cl |c:8,10|
BDBM347704 CN(C)\C=C(\Oc1ccc(cc1)C(F)(F)F)C(=O)c1ccc(Cl)cc1F
BDBM347705 CN(C)\C=C(\Oc1ccc(cc1F)C#N)C(=O)c1ccccc1Cl
BDBM347706 CN(C)C(=C\OC1(CC=CC=C1)C#N)\C(=O)c1cccc(F)c1F |c:8,10|
BDBM347707 CN(C)\C=C(\Oc1ccc(cc1)C#N)C(=O)c1cccc(Cl)c1F
BDBM347708 CN(C)\C=C(\Oc1ccc(Cl)cc1)C(=O)c1cccc(Cl)c1F
BDBM347709 CN(C)\C=C(/Oc1ccc(cc1)C#N)C(=O)c1cccc(Cl)c1
BDBM347679 COc1ccccc1C(=O)C(\Oc1ccc(Cl)cc1)=C/N(C)C
BDBM347710 COC(=O)c1cccc(c1)C(=O)C(\Oc1ccc(cc1)C#N)=C/N(C)C
BDBM347711 CN(C)\C=C(\Oc1ccc(Cl)cc1)C(=O)c1cccc(F)c1Cl
BDBM347712 CN(C)\C=C(/Oc1ccc(cc1)C#N)C(=O)c1cccc(F)c1Cl
BDBM347713 CN(C)\C=C(/Oc1ccc(cc1)C#N)C(=O)c1cccc(OCc2ccccc2)c1
BDBM347714 CN(C)\C=C(/Oc1ccc(cc1)C#N)C(=O)c1ccnc(Cl)c1
BDBM347715 COC(=O)c1cccc(c1)C(=O)C(\Oc1ccc(cc1F)C#N)=C\N(C)C
BDBM347718 CN(C)\C=C(/Oc1ccc(cc1)C#N)C(=O)c1ccccc1OCc1ccccc1
BDBM347719 CS(=O)(=O)c1ccc(-c2[nH]ncc2Oc2ccc(Cl)cc2)c(Cl)c1
BDBM347720 CS(=O)(=O)c1ccc(-c2[nH]ncc2Oc2ccc(cc2)C#N)c(Cl)c1
BDBM347721 CC(=O)N1CCN(CC1)C(=O)c1cccc(c1)-c1[nH]ncc1Oc1ccc(cc1)C#N
BDBM347722 O=C(N1CCOCC1)c1cccc(c1)-c1[nH]ncc1Oc1ccc(cc1)C#N
BDBM347723 CS(=O)(=O)N1CCN(CC1)C(=O)c1cccc(c1)-c1[nH]ncc1Oc1ccc(cc1)C#N
BDBM347724 OCC1CN(C1)C(=O)c1cccc(c1)-c1[nH]ncc1Oc1ccc(cc1)C#N
BDBM347725 Oc1cccc(c1)-c1[nH]ncc1Oc1ccc(cc1)C#N
BDBM347726 OCc1cccc(c1)-c1[nH]ncc1Oc1ccc(cc1)C#N
BDBM347727 N#Cc1ccc(Oc2cn[nH]c2-c2cccc(OCc3ccccn3)c2)cc1
BDBM347728 N#Cc1ccc(Oc2cn[nH]c2-c2cccc(OCc3cccnc3)c2)cc1
BDBM347729 Cc1cc(COc2cccc(c2)-c2[nH]ncc2Oc2ccc(cc2)C#N)on1
BDBM347730 Cn1nncc1COc1cccc(c1)-c1[nH]ncc1Oc1ccc(cc1)C#N
BDBM347731 N#Cc1ccc(Oc2cn[nH]c2-c2cccc(OCc3ccncc3)c2)cc1
BDBM347732 Clc1cc(COc2cccc(c2)-c2[nH]ncc2Oc2ccc(cc2)C#N)ccn1
BDBM347733 Cn1cc(COc2cccc(c2)-c2[nH]ncc2Oc2ccc(cc2)C#N)cn1
BDBM347734 CC(=O)N1CCC(C1)Oc1cccc(c1)-c1[nH]ncc1Oc1ccc(cc1)C#N
BDBM347735 CCCCOc1cccc(c1)-c1[nH]ncc1Oc1ccc(cc1)C#N
BDBM347736 COc1ccccc1CCc1[nH]ncc1Oc1ccc(cc1)C#N
BDBM347737 CC(=O)N1CCCC(C1)c1[nH]ncc1Oc1ccc(cc1)C#N
BDBM347738 Cn1cc(cn1)C(=O)N1CCCC(C1)c1[nH]ncc1Oc1ccc(cc1)C#N
BDBM347739 O=C(N1CCCC(C1)c1[nH]ncc1Oc1ccc(cc1)C#N)c1cccnc1
BDBM347740 O=C(N1CCCC(C1)c1[nH]ncc1Oc1ccc(cc1)C#N)c1ccccn1
BDBM347741 Cc1ncc(s1)-c1[nH]ncc1Oc1ccc(cc1)C#N
BDBM347742 Cn1cc(cn1)-c1[nH]ncc1Oc1ccc(cc1)C#N
BDBM347743 N#Cc1ccc(Oc2cn[nH]c2-c2cnn(Cc3ccccc3)c2)cc1
BDBM347744 Fc1cccc(OCc2cccc(c2)-c2[nH]ncc2Oc2ccc(cc2)C#N)n1
BDBM347745 N#Cc1ccc(Oc2cn[nH]c2-c2cccc(COc3cccnn3)c2)cc1
BDBM347748 [O-]c1ccc[n+](Cc2cccc(c2)-c2[nH]ncc2Oc2ccc(cc2)C#N)c1
BDBM347750 O=c1ccn(Cc2cccc(c2)-c2[nH]ncc2Oc2ccc(cc2)C#N)cc1
BDBM347751 Clc1cccc(OCc2cccc(c2)-c2[nH]ncc2Oc2ccc(cc2)C#N)n1
BDBM347752 OCC1(F)CN(Cc2cccc(c2)-c2[nH]ncc2Oc2ccc(cc2)C#N)C1
BDBM347753 N#Cc1ccc(Oc2cn[nH]c2-c2cccc(CN3CCOCC3)c2)cc1
BDBM347754 N#Cc1ccc(Oc2cn[nH]c2-c2ccccc2OCc2ccncc2)cc1
BDBM347755 N#Cc1ccc(Oc2cn[nH]c2-c2ccccc2OCc2ccnnc2)cc1
BDBM347756 Oc1ccccc1-c1[nH]ncc1Oc1ccc(cc1)C#N
BDBM347757 N#Cc1ccc(Oc2cn[nH]c2-c2ccccc2OCc2ccccn2)cc1
BDBM347758 N#Cc1ccc(Oc2cn[nH]c2-c2ccccc2OCc2cn[nH]c2)cc1
BDBM347759 Cn1nncc1COc1ccccc1-c1[nH]ncc1Oc1ccc(cc1)C#N
BDBM336878 CC(O)c1cncc(C2COc3c(O2)cccc3C(N)=O)c1C
BDBM347760 N#Cc1ccc(Oc2cn[nH]c2-c2ccccc2OCc2cccnc2)cc1
BDBM347761 O=c1ccn(Cc2ccccc2-c2[nH]ncc2Oc2ccc(cc2)C#N)cc1
BDBM347762 Oc1cccc(-c2[nH]ncc2Oc2ccc(cc2)C#N)c1F
BDBM347763 Fc1c(OCc2ccncc2)cccc1-c1[nH]ncc1Oc1ccc(cc1)C#N
BDBM347764 Fc1c(OCc2ccc(Cl)nc2)cccc1-c1[nH]ncc1Oc1ccc(cc1)C#N
BDBM347765 Cn1cc(cn1)C(=O)N1CCN(Cc2[nH]ncc2Oc2ccc(cc2)C#N)CC1
BDBM347766 Cn1cc(cn1)C(=O)N1CCCC(C1)c1[nH]ncc1Oc1ccc(cc1F)C#N
BDBM347767 Cn1nncc1COc1c(Cl)cccc1-c1[nH]ncc1Oc1ccc(cc1)C#N
BDBM347768 Fc1cc(ccc1Oc1cn[nH]c1C1CCCN(C1)C(=O)c1cccnc1)C#N
BDBM336838 CC(=O)N1CCC[C@H](C1)Oc1cncc(c1)C1COc2c(O1)cccc2C(N)=O |r|
BDBM347661 Fc1cccc(-c2[nH]ncc2Oc2ccc(Cl)cc2)c1F
BDBM347677 COc1ccc(O\C(=C\N(C)C)C(=O)c2ccc(Cl)cc2)cc1
BDBM347678 CN(C)\C=C(\Oc1ccc(Cl)cc1)C(=O)c1ccc(Cl)cc1
BDBM347681 CN(C)\C=C(\Oc1ccc(Cl)cc1)C(=O)c1ccccc1Cl
BDBM347684 CN(C)\C=C(\Oc1ccc(Cl)cc1)C(=O)c1ccccc1OC(F)(F)F
BDBM347685 CN(C)\C=C(\Oc1ccc(Cl)cc1)C(=O)c1ccccc1OC(F)F
BDBM347686 CN(C)\C=C(\Oc1ccc(Cl)cc1)C(=O)c1ccccc1F
BDBM347687 COc1ccc(Cl)cc1C(=O)C(\Oc1ccc(Cl)cc1)=C/N(C)C
BDBM347688 CN(C)\C=C(\Oc1ccc(Cl)cc1)C(=O)c1ccc(Cl)cc1F
BDBM347689 CN(C)\C=C(\Oc1ccc(Cl)cc1)C(=O)c1ccc(cc1)S(C)(=O)=O
BDBM347690 CN(C)\C=C(\Oc1ccc(Cl)cc1)C(=O)c1ccc(cc1F)C(F)(F)F
BDBM336914 CCOc1cncc(c1)C1COc2c(O1)cccc2C(N)=O
BDBM347691 CN(C)\C=C(\Oc1ccc(Cl)cc1)C(=O)c1ccc(cc1)C(F)(F)F
BDBM347692 CN(C)\C=C(\Oc1ccc(Cl)cc1)C(=O)c1ccc(F)cc1F
BDBM347693 CN(C)\C=C(\Oc1ccc(cc1)C(F)(F)F)C(=O)c1ccc(cc1)S(C)(=O)=O
BDBM347694 CSc1ccc(C(=O)C(\Oc2ccc(Cl)cc2)=C/N(C)C)c(Cl)c1
BDBM347695 CN(C)\C=C(/Oc1ccc(cc1)C#N)C(=O)c1ccc(cc1)S(C)(=O)=O
BDBM347697 CN(C)\C=C(\Oc1ccc(Cl)nc1)C(=O)c1ccccc1Cl
BDBM347698 CN(C)\C=C(\Oc1ccc(C)nc1)C(=O)c1ccccc1Cl
BDBM347699 CN(C)\C=C(\Oc1cccc(F)n1)C(=O)c1ccc(Cl)cc1Cl
BDBM347700 CN(C)\C=C(\Oc1cccc(C)n1)C(=O)c1ccc(Cl)cc1Cl
BDBM336830 NC(=O)c1cccc2OC(COc12)c1cccnc1
BDBM336850 NC(=O)c1cccc2OC(COc12)c1cncc(CC(=O)N2CCOCC2)c1
BDBM336832 NC(=O)c1cccc2OC(COc12)c1cncc(CN2CCCC2=O)c1
BDBM336828 NC(=O)c1cccc2OC(COc12)c1cncc(CN2CCCCS2(=O)=O)c1
BDBM336886 NC(=O)c1cccc2OC(COc12)c1cncc(CN2CCOC2=O)c1
BDBM336854 NC(=O)c1cccc2OC(COc12)c1cncc(CN2CCOCC2=O)c1
BDBM336852 NC(=O)c1cccc2OC(COc12)c1cncc(CNC(=O)C2CC2)c1
BDBM336925 OC1(CCOCC1)c1cncc(c1)C1COc2c(O1)cccc2C#N
BDBM336864 NC(=O)c1cccc2OC(COc12)c1cncc(CO)c1
BDBM336926 NC(=O)c1cccc2OC(COc12)c1cncc(F)c1
BDBM336918 NC(=O)c1cccc2OC(COc12)c1cncc(OC2CCOCC2)c1
BDBM336916 NC(=O)c1cccc2OC(COc12)c1cncc(O[C@@H]2CCOC2)c1 |r|
BDBM336922 NC(=O)c1cccc2OC(COc12)c1cncc(c1)C(O)C(F)(F)F
BDBM336826 NC(=O)c1cccc2OC(COc12)c1cncc(c1)C1(CC1)C#N
BDBM336888 NC(=O)c1cccc2OC(COc12)c1cncc(c1)C1(F)CCOCC1
BDBM336876 NC(=O)c1cccc2OC(COc12)c1cncc(c1)C1(O)CCC1
BDBM347716 CCOC(=O)c1ccccc1C(=O)C(\Oc1ccc(cc1)C#N)=C\N(C)C
BDBM336932 FC(F)(F)C(=O)NCc1cncc(c1)C1COc2c(O1)cccc2C#N
BDBM336846 NC(=O)c1cccc2OC(COc12)c1cncc(c1)C1(O)CCCCC1
BDBM336824 NC(=O)c1cccc2OC(COc12)c1cncc(c1)C1(O)CCOCC1
BDBM336844 NC(=O)c1cccc2OC(COc12)c1cncc(c1)C1CCOCC1
BDBM336928 NC(=O)c1cccc2OC(COc12)c1cncc2C(O)CCc12
BDBM336904 NS(=O)(=O)c1ccc(cc1)-c1cncc(c1)C1COc2c(O1)cccc2C#N
BDBM336910 O=C(Cc1cncc(c1)C1COc2c(O1)cccc2C#N)N1CCOCC1
BDBM336902 O=C(NCc1cncc(c1)C1COc2c(O1)cccc2C#N)C1CC1
BDBM336896 O=C1COCCN1Cc1cncc(c1)C1COc2c(O1)cccc2C#N
BDBM336892 O=C1OCCN1Cc1cncc(c1)C1COc2c(O1)cccc2C#N
BDBM336906 O=S1(=O)CCCCN1Cc1cncc(c1)C1COc2c(O1)cccc2C#N
BDBM336935 O[C@@H]1CCN(C1)C(=O)Cc1cncc(c1)C1COc2c(O1)cccc2C#N |r|
BDBM50238106 CS(=O)(=O)N1CCC(CC1)C(O)c1cncnc1Nc1cccc(F)c1
BDBM50238116 CS(=O)(=O)N1CCC(CC1)C(O)c1cncnc1Nc1ccccc1
BDBM50238117 Cc1ccc(Nc2ncncc2C(O)C2CCN(CC2)S(C)(=O)=O)cc1
BDBM336941 CC(C)(O)c1c(F)cncc1C1COc2c(O1)cccc2C(N)=O
BDBM336920 CC(C)C(=O)N1CCC(CC1)Oc1cncc(c1)C1COc2c(O1)cccc2C(N)=O
BDBM325726 NC1CCc2cncc(c12)-c1ccc(c(F)c1)C(F)(F)F
BDBM325728 OC1CCc2cncc(c12)-c1ccc(c(F)c1)C(F)(F)F
BDBM336937 C[C@H](O)c1c(F)cncc1C1COc2c(O1)cccc2C(N)=O |r|
BDBM336856 NC(=O)c1cccc2OC(COc12)c1cncc(c1)-c1ccc(cc1)S(N)(=O)=O
BDBM336842 NC(=O)c1cccc2OC(COc12)c1cncc(c1)C(F)(F)F
BDBM336868 NC(=O)c1cccc2OC(COc12)c1cncc(c1)C(F)F
BDBM325729 CC1(O)CCc2cncc(c12)-c1ccc(c(F)c1)C(F)(F)F
BDBM325730 OC1(CCc2cncc(c12)-c1ccc(c(F)c1)C(F)(F)F)c1ccccc1
BDBM325731 OC1CCc2cncc(c12)-c1ccc(cc1F)C(F)(F)F
BDBM325732 CC1(O)CCc2cncc(c12)-c1ccc(cc1F)C(F)(F)F
BDBM325733 CC(C)C1(O)CCc2cncc(c12)-c1ccc(cc1F)C(F)(F)F
BDBM325734 OC1(CCc2cncc(c12)-c1ccc(cc1F)C(F)(F)F)c1ccccc1
BDBM325735 OC1(CCc2cncc(c12)-c1ccc(cc1F)C(F)(F)F)c1ccccc1
BDBM325736 OC1(CCc2cncc(c12)-c1ccc(cc1F)C(F)(F)F)c1ccccc1
BDBM336870 Cc1ccncc1C1COc2c(O1)cccc2C(N)=O
BDBM325737 CCOC(=O)CC1CCc2cncc(c12)-c1ccc(c(F)c1)C(F)(F)F
BDBM325738 CNC(=O)CC1CCc2cncc(c12)-c1ccc(c(F)c1)C(F)(F)F
BDBM325740 CCCNC(=O)CC1CCc2cncc(c12)-c1ccc(c(F)c1)C(F)(F)F
BDBM325742 Fc1cc(ccc1C(F)(F)F)-c1cncc2CCC(CC(=O)N3CCOCC3)c12
BDBM325743 Fc1cc(ccc1C(F)(F)F)-c1cncc2CCC(CC(=O)Nc3ccon3)c12
BDBM325744 Fc1cc(ccc1C(F)(F)F)-c1cncc2CCC(CC(=O)Nc3cc[nH]n3)c12
BDBM325745 Fc1cc(ccc1-c1cncc2CCC(CC(=O)N3CCCC3)c12)C(F)(F)F
BDBM325746 CCN(C)C(=O)CC1CCc2cncc(c12)-c1ccc(cc1F)C(F)(F)F
BDBM325747 CC(C)N(C)C(=O)CC1CCc2cncc(c12)-c1ccc(cc1F)C(F)(F)F
BDBM325748 CN(C1CC1)C(=O)CC1CCc2cncc(c12)-c1ccc(cc1F)C(F)(F)F
BDBM325749 CCN(C1CC1)C(=O)CC1CCc2cncc(c12)-c1ccc(cc1F)C(F)(F)F
BDBM325750 C[C@H]1CCCN1C(=O)CC1CCc2cncc(c12)-c1ccc(cc1F)C(F)(F)F |r|
BDBM351259 CN1C(=O)CCc2c(F)c(ccc12)-c1n[nH]cc1CC1CCN(CC1)C(=O)c1cnn(C)c1
BDBM351260 CN1C(=O)CCc2c(F)c(ccc12)-c1n[nH]cc1CC1CCN(CC1)C(C)=O
BDBM351263 CN1C(=O)CCc2c(F)c(ccc12)-c1n[nH]cc1CC1CCN(CC1)C(=O)c1ccnn1C
BDBM351018 CN1C(=O)CCc2cc(ccc12)-c1n[nH]cc1CC1CCN(CC1)C(C)=O
BDBM351201 CN1C(=O)CCc2cc(ccc12)-c1n[nH]cc1CC1CCN(CC1)C(=O)c1cnn(C)c1
BDBM351257 CCS(=O)(=O)N1CCC(Cc2c[nH]nc2-c2ccc3N(C)C(=O)CCc3c2)CC1
BDBM351258 CN1C(=O)CCc2cc(-c3n[nH]cc3CC3CCN(CC3)C(C)=O)c(F)cc12
BDBM351261 CCS(=O)(=O)N1CCC(Cc2c[nH]nc2-c2ccc3N(C)C(=O)CCc3c2F)CC1
BDBM351262 CN1C(=O)CCc2c(F)c(ccc12)-c1n[nH]cc1CC1CCN(CC1)S(=O)(=O)c1ccnn1C
BDBM351267 CN1C(=O)CCc2c(Cl)c(ccc12)-c1n[nH]cc1CC1CCN(CC1)C(=O)c1ncccc1Cl
BDBM351268 CN1C(=O)CCc2c(Cl)c(ccc12)-c1n[nH]cc1CC1CCN(CC1)C(=O)c1ccnn1C
BDBM351269 CN1C(=O)CCc2c(Cl)c(ccc12)-c1n[nH]cc1CC1CCN(CC1)C(=O)c1ccncc1Cl
BDBM351270 CN1C(=O)CCc2cc(ccc12)-c1n[nH]cc1CC1CCN(CC1)C(=O)c1cncn1C
BDBM351271 CN1C(=O)CCc2cc(ccc12)-c1n[nH]cc1CC1CCN(CC1)C(=O)c1nccn1C
BDBM351272 CN1C(=O)CCc2cc(ccc12)-c1n[nH]cc1CC1CCN(CC1)C(=O)c1cccnc1
BDBM50239790 Cc1cncc(Cc2cc(no2)-c2ccccc2)c1
BDBM50239792 Cc1cncc(Cc2cc(nn2C)-c2ccccc2)c1
BDBM50239793 Cc1cncc(Cc2cnc(o2)-c2ccccc2)c1
BDBM50239795 Cc1cncc(Cc2ccc(nc2)-c2ccccc2F)c1
BDBM50239796 Cc1cncc(Cc2ccc(nc2)-c2cccc(NS(C)(=O)=O)c2)c1
BDBM50239797 Cc1cncc(Cc2ccc(nc2)-c2cnn(C)c2)c1
BDBM50239798 Cc1cncc(Cc2ccc(nc2)-c2ccnn2C)c1
BDBM50239799 Cc1cncc(Cc2ccc(NC3CC3)nc2)c1
BDBM50239802 Cc1cncc(Cc2ccc(nc2)S(=O)(=O)c2ccccc2F)c1
BDBM50239812 Cc1cncc(Cc2cnc(s2)-c2ccccc2)c1
BDBM50239789 COc1cncc(Cc2cc(no2)-c2ccccc2)c1
BDBM50239794 Cc1cncc(Cc2cc(n[nH]2)-c2ccccc2)c1
BDBM50239800 Cc1cncc(Cc2ccc(Sc3ccccc3)nc2)c1
BDBM50239801 Cc1cncc(Cc2ccc(nc2)S(=O)(=O)c2ccccc2)c1
BDBM50239806 C(c1cc(no1)-c1ccccc1)n1ccnc1
BDBM50239811 Cc1cncc(Cc2ccc(nc2)-c2ccoc2)c1
BDBM50239813 Cc1cncc(Cc2ccc(nc2)N2CCOCC2)c1
BDBM50239816 Cn1nc(cc1Cn1ccnc1)-c1ccccc1
BDBM50239814 Cc1cncc(Cc2ccc(Sc3ccccc3F)nc2)c1
BDBM351273 CN1C(=O)CCc2cc(ccc12)-c1n[nH]cc1CC1CCN(CC1)C(=O)c1ncccc1Cl
BDBM351274 CC(C1CCN(CC1)C(C)=O)c1c[nH]nc1-c1cc2CCC(=O)N(C)c2cc1F
BDBM351275 CC(C1CCN(CC1)C(C)=O)c1c[nH]nc1-c1ccc2N(C)C(=O)CCc2c1F
BDBM351276 C[C@@H](C1CCN(CC1)C(C)=O)c1c[nH]nc1-c1ccc2N(C)C(=O)CCc2c1F
BDBM351277 C[C@H](C1CCN(CC1)C(C)=O)c1c[nH]nc1-c1ccc2N(C)C(=O)CCc2c1F
BDBM351278 CCS(=O)(=O)N1CC2(CC(Cc3c[nH]nc3-c3ccc4N(C)C(=O)CCc4c3Cl)C2)C1
BDBM50239803 C(c1csnc1-c1ccccc1)n1ccnc1
BDBM50239804 C(c1cc(ns1)-c1ccccc1)n1ccnc1
BDBM50239805 C(c1cnc(s1)-c1ccccc1)n1ccnc1
BDBM50239807 C(c1cnc([se]1)-c1ccccc1)n1ccnc1
BDBM50239808 Cn1c(Cn2ccnc2)cnc1-c1ccccc1
BDBM50239809 Cc1cncc(Cc2csnc2-c2ccccc2)c1
BDBM50239810 Cc1cncc(Cc2cc(ns2)-c2ccccc2)c1
BDBM50239815 C(c1cnc(o1)-c1ccccc1)n1ccnc1
BDBM351279 CN1C(=O)CCc2c(Cl)c(ccc12)-c1n[nH]cc1CC1CC2(C1)CN(C2)C(C)=O
BDBM351280 CN1C(=O)CCc2c(Cl)c(ccc12)-c1n[nH]cc1CC1CC2(C1)CN(C2)C(=O)c1cnn(C)c1
BDBM362864 Cc1cncc(c1)-c1nn2CCC(=O)Nc2c1C#N
BDBM50249088 Cc1ccc2n(ncc2c1)-c1cncc(c1)C(C)(C)O
BDBM50249044 CC(C)(O)c1cncc(c1)-n1ncc2c(cccc12)C(F)(F)F
BDBM50249045 Cc1nn(-c2cncc(c2)[C@](C)(O)C(F)(F)F)c2ccccc12 |r|
BDBM50249046 C[C@](O)(c1cncc(c1)-n1nc(c2ccccc12)C(F)(F)F)C(F)(F)F |r|
BDBM50249048 Cc1nn(-c2cncc(c2)[C@@](C)(O)C(F)(F)F)c2ccccc12 |r|
BDBM50249056 Fc1ccc2n(ncc2c1)-c1cncc(c1)C(F)(F)F
BDBM50249057 COC(=O)c1cncc(c1)-n1ncc2cc(F)ccc12
BDBM50249058 COc1cncc(c1)-n1ncc2cc(F)ccc12
BDBM50249059 CC(O)(c1cncc(c1)-n1ncc2cc(F)ccc12)C(F)(F)F
BDBM50249061 Cc1nn(-c2cncc(c2)C(C)(C)O)c2ccccc12
BDBM50249062 CC(C)(O)c1cncc(c1)-n1nc(c2ccccc12)C(F)(F)F
BDBM50249063 CC(C)(O)c1cncc(c1)-n1nc(C2CC2)c2ccccc12
BDBM50249064 CC(C)(O)c1cncc(c1)-n1ncc2cccc(F)c12
BDBM50249065 CC(C)(O)c1cncc(c1)-n1ncc2ccc(Cl)cc12
BDBM50249066 CC(C)(O)c1cncc(c1)-n1ncc2ccc(cc12)C(F)(F)F
BDBM50249068 COc1ccc2n(ncc2c1)-c1cncc(c1)C(C)(C)O
BDBM50249072 CC(C)(O)c1cncc(c1)-n1ncc2cc(ccc12)C(F)(F)F
BDBM50249073 CC(C)(O)c1cncc(c1)-n1ncc2cc(ccc12)C#N
BDBM50249074 Cc1cccc2n(ncc12)-c1cncc(c1)C(C)(C)O
BDBM50249075 CC(C)(O)c1cncc(c1)-n1ncc2c(F)ccc(F)c12
BDBM50249076 CC(C)(O)c1cncc(c1)-n1ncc2c(Cl)ccc(F)c12
BDBM50249084 Fc1ccc2n(ncc2c1)-c1cncc(F)c1
BDBM50249085 CC(C)(O)c1cncc(c1)-n1ncc2cc(F)ccc12
BDBM50249086 COc1nn(-c2cncc(c2)C(C)(C)O)c2ccccc12
BDBM50249087 CC(C)(O)c1cncc(c1)-n1ncc2ccc(F)cc12
BDBM50249103 CC(C)(O)c1cncc(c1)-n1ncc2c(F)cccc12
BDBM50249104 COC(=O)c1cccc2n(ncc12)-c1cncc(c1)C(C)(C)O
BDBM50249047 Cc1nn(-c2cncc(c2)C(C)(C)O)c2cccc(F)c12
BDBM50249055 Fc1ccc2n(ncc2c1)-c1cccnc1
BDBM50249060 CC(C)(O)c1cncc(c1)-n1ncc2ccccc12
BDBM50249067 CC(C)(O)c1cncc(c1)-n1ncc2cc(Cl)ccc12
BDBM380861 CCS(=O)(=O)NC1COCc2c1cncc2-c1ccc2nnn(C)c2c1
BDBM380862 CCS(=O)(=O)NC1COCc2c1cncc2-c1ccc2c(C)n[nH]c2c1
BDBM380863 CCS(=O)(=O)NC1COCc2c1cncc2-c1ccc2ncn(C)c2c1
BDBM380864 CCS(=O)(=O)NC1COCc2c1cncc2-c1ccc2c(F)nn(C)c2c1
BDBM380865 CCS(=O)(=O)NC1COCc2c1cncc2-c1ccc2[nH]nc(C)c2c1
BDBM380866 Cc1cc2cnn(C)c2cc1-c1cncc2C(N)COCc12
BDBM380867 Cn1ncc2ccc(cc12)-c1cncc2C(N)COCc12
BDBM380870 CC(=O)NC1COCc2c1cncc2-c1ccc2cnn(C)c2c1
BDBM380871 Cn1ncc2ccc(cc12)-c1cncc2C(COCc12)NC(=O)C1CC1
BDBM380929 CCS(=O)(=O)NC1COCc2c1cncc2-c1ccc2OCCC(O)c2c1
BDBM380873 CC(C)C(=O)NC1COCc2c1cncc2-c1ccc2cnn(C)c2c1
BDBM380878 CCS(=O)(=O)NC1COCc2c1cncc2-c1ccc2n(C)ncc2c1
BDBM380879 CCS(=O)(=O)NC1COCc2c1cncc2-c1ccc2cnn(C)c2c1
BDBM380888 Cn1ncc2c(F)cc(cc12)-c1cncc2C(O)C3(CC3)OCc12
BDBM380892 Cn1ncc2c(F)cc(cc12)-c1cncc2C(O)COCc12
BDBM380933 CC1(O)CCOc2ccc(cc12)-c1cncc2C(O)COCc12
BDBM380902 Cn1ncc2c(cc(cc12)-c1cncc2C(O)COCc12)C#N
BDBM380821 OC1COCc2c1cncc2-c1ccc2OCCOc2c1
BDBM380827 OC1COCc2c1cncc2-c1ccc2[nH]ccc2c1
BDBM380995 OC1COCc2c1cncc2-c1ccc2c(COCC2(F)F)c1
BDBM380941 OC1COCc2c1cncc2-c1ccc2c(OCCNC2=O)c1
BDBM380905 CC(=O)N1Cc2ccc(cc2C1)-c1cncc2C(O)COCc12
BDBM380906 OC1COCc2c1cncc2-c1ccc2c(c1)occc2=O
BDBM380909 Cn1nc(C#N)c2ccc(cc12)-c1cncc2C(O)COCc12
BDBM380910 Cc1noc2ccc(cc12)-c1cncc2C(O)C3(CC3)OCc12
BDBM380874 CCS(=O)(=O)NC1COCc2c1cncc2-c1cc2n(C)ncc2cc1C
BDBM380915 OC1COCc2c1cncc2-c1ccc2CCNC(=O)c2c1
BDBM380920 CN1CCc2cc(ccc2C1=O)-c1cncc2C(O)COCc12
BDBM380923 OC1COCc2c1cncc2-c1ccc2c(Cl)n[nH]c2c1
BDBM380924 CCC(=O)NC1COCc2c1cncc2-c1ccc2c(Cl)n[nH]c2c1
BDBM380925 CCS(=O)(=O)NC1COCc2c1cncc2-c1ccc2c(Cl)n[nH]c2c1
BDBM380926 OC1COCc2c1cncc2-c1cc(Cl)c2cn[nH]c2c1
BDBM380803 OC1COCc2c1cncc2-c1ccc(C#N)c(Cl)c1
BDBM380804 CC(C)Oc1nc(cs1)-c1cncc2C(O)COCc12
BDBM380805 Cn1ncc2ccc(cc12)-c1cncc2C(COCc12)C#N
BDBM380939 CCC(=O)NC1COCc2c1cncc2-c1ccc2OCCC(F)(F)c2c1
BDBM380940 CCS(=O)(=O)NC1COCc2c1cncc2-c1ccc2OCCC(F)(F)c2c1
BDBM380943 CCC(=O)NC1COCc2c1cncc2-c1ccc2c(OCCNC2=O)c1
BDBM380944 OC1COCc2c1cncc2-c1ccc2c(COCCC2(F)F)c1
BDBM380945 Cn1ncc2c(F)cc(cc12)-c1cncc2C(N)COCc12
BDBM380946 CCC(=O)NC1COCc2c1cncc2-c1cc(F)c2cnn(C)c2c1
BDBM380949 CC(C)(O)CC(=O)NC1COCc2c1cncc2-c1ccc2C(=O)CCc2c1
BDBM380950 CC(=O)NC1COCc2c1cncc2-c1ccc2oc(=O)ccc2c1
BDBM380952 CCC(=O)NC1COCc2c1cncc2-c1ccc2onc(C)c2c1
BDBM380953 CCS(=O)(=O)NC1COCc2c1cncc2-c1ccc2C(=O)CCc2c1
BDBM380954 CCS(=O)(=O)NC1COCc2c1cncc2-c1ccc2oc(=O)ccc2c1
BDBM380955 CCS(=O)(=O)NC1COCc2c1cncc2-c1ccc2onc(C)c2c1
BDBM380828 Cn1cc(cn1)-c1cncc2C(O)COCc12
BDBM380837 Cc1c(cnn1C)-c1cncc2C(O)COCc12
BDBM380838 Cn1nc(cc1-c1cncc2C(O)COCc12)C(F)(F)F
BDBM380842 OC1COCc2c1cncc2-c1cnn(c1)C1CC1
BDBM380843 OC1COCc2c1cncc2-c1ccc2[nH]ncc2c1
BDBM380977 OC1COCc2c1cncc2-c1ccc2C(=O)CCc2n1
BDBM380978 CC1(C)COc2ccc(cc12)-c1cncc2C(O)COCc12
BDBM380947 CC(=O)NC1COCc2c1cncc2-c1ccc2C(=O)CCc2c1
BDBM380846 Cn1cc2ccc(cc2n1)-c1cncc2C(O)COCc12
BDBM380848 OC1COCc2c1cncc2-c1ccc2NC(=O)Cc2c1
BDBM380852 CCC(=O)NC1COCc2c1cncc2-c1ccc2ocnc2c1
BDBM380980 CCS(=O)(=O)NC1COCc2c1cncc2-c1ccc2C(O)CCc2c1
BDBM380981 CN(C)C1COCc2c1cncc2-c1ccc2cnn(C)c2c1
BDBM380853 CCC(=O)NC1COCc2c1cncc2-c1ccc2ncn(C)c2c1
BDBM380854 CCC(=O)NC1COCc2c1cncc2-c1ccc2N(C)C(=O)Cc2c1
BDBM380855 CCC(=O)NC1COCc2c1cncc2-c1ccc2NC(=O)Cc2c1
BDBM380856 CCC(=O)NC1COCc2c1cncc2-c1ccc2nnn(C)c2c1
BDBM380857 CCC(=O)NC1COCc2c1cncc2-c1ccc2[nH]nc(C)c2c1
BDBM380858 CCC(=O)NC1COCc2c1cncc2-c1ccc2c(C)n[nH]c2c1
BDBM380859 CCS(=O)(=O)NC1COCc2c1cncc2-c1ccc2N(C)C(=O)Cc2c1
BDBM380860 CCS(=O)(=O)NC1COCc2c1cncc2-c1ccc2NC(=O)Cc2c1
BDBM380989 CCC(=O)NC1COCc2c1cncc2-c1cc2n(C)ncc2cc1F
BDBM380990 CCC(=O)NC1COCc2c1cncc2-c1ccc2c(COCC2(F)F)c1
BDBM380991 CCS(=O)(=O)NC1COCc2c1cncc2-c1cc2n(C)ncc2cc1F
BDBM380992 CCS(=O)(=O)NC1COCc2c1cncc2-c1ccc2c(COCC2(F)F)c1
BDBM50268690 OC(Cn1cnnn1)(c1ccc(F)cc1F)C(F)(F)c1ccc(cn1)C#Cc1ccc(OCc2ccc(cc2)C#N)cc1
BDBM380928 CCC(=O)NC1COCc2c1cncc2-c1ccc2OCCC(O)c2c1
BDBM380872 CCC(=O)NC1COCc2c1cncc2-c1ccc2cnn(C)c2c1
BDBM380868 CCC(=O)NC1COCc2c1cncc2-c1ccc2n(C)ncc2c1
BDBM380811 Cn1nc(F)c2ccc(cc12)-c1cncc2C(O)COCc12
BDBM380967 Cn1nc(F)c2ccc(cc12)-c1cncc2c1COCC2(C)O
BDBM380993 Cn1nnc2ccc(cc12)-c1cncc2C(O)C3(CC3)OCc12
BDBM380810 Cn1nnc2ccc(cc12)-c1cncc2C(O)COCc12
BDBM380983 Cn1ncc2CCC(=Cc12)c1cncc2C(O)COCc12 |c:7|
BDBM380971 Cn1ncc2c(F)cc(cc12)-c1cncc2c1COCC2(C)O
BDBM380898 NC(=O)N1CCCc2cc(cnc12)-c1cncc2C(O)COCc12
BDBM380956 NC(=O)N1CCCc2cc(cnc12)-c1cncc2COCC(O)c12
BDBM380900 NC(=O)c1cccc2cc(cnc12)-c1cncc2C(O)COCc12
BDBM380969 Cn1ncc2c(cc(cc12)-c1cncc2c1COCC2(C)O)C#N
BDBM380814 Cn1ncc2cc(F)c(cc12)-c1cncc2C(O)COCc12
BDBM380819 Cn1ncc2cc(ccc12)-c1cncc2C(O)COCc12
BDBM380876 Cn1ncc2ccc(cc12)-c1cncc2C(COCc12)NS(C)(=O)=O
BDBM380812 Cn1ncc2ccc(cc12)-c1cncc2C(O)C3(CC3)OCc12
BDBM380825 Cn1ncc2ccc(cc12)-c1cncc2C(O)COCc12
BDBM380975 Cn1ncc2ccc(cc12)-c1cncc2COCC(C)(O)c12
BDBM380961 Cn1ncc2ccc(cc12)-c1cncc2COCC(O)c12
BDBM380965 Cn1ncc2ccc(cc12)-c1cncc2c1COCC2(C)O
BDBM380847 CN1C(=O)Cc2cc(ccc12)-c1cncc2C(O)COCc12
BDBM380927 OC1CCOc2ccc(cc12)-c1cncc2C(O)COCc12
BDBM380800 OC1COCc2c1cncc2-c1ccc(cc1)C#N
BDBM380913 OC1COCc2c1cncc2-c1ccc2C(=O)CCCc2c1
BDBM380918 OC1COCc2c1cncc2-c1ccc2C(=O)CCOc2c1
BDBM380899 OC1COCc2c1cncc2-c1ccc2C(=O)CCc2c1
BDBM380916 OC1COCc2c1cncc2-c1ccc2C(=O)NCCc2c1
BDBM380911 OC1COCc2c1cncc2-c1ccc2CCCC(=O)c2c1
BDBM380796 OC1COCc2c1cncc2-c1ccc2NC(=O)CCc2c1
BDBM380937 OC1COCc2c1cncc2-c1ccc2OCCC(F)(F)c2c1
BDBM380824 OC1COCc2c1cncc2-c1ccc2OCCCOc2c1
BDBM380903 OC1COCc2c1cncc2-c1ccc2OCCOCc2c1
BDBM380817 OC1COCc2c1cncc2-c1ccc2cc[nH]c2c1
BDBM380820 OC1COCc2c1cncc2-c1ccc2cn[nH]c2c1
BDBM380826 OC1COCc2c1cncc2-c1ccc2cnccc2c1
BDBM380818 OC1COCc2c1cncc2-c1ccc2ncccc2c1
BDBM380894 OC1COCc2c1cncc2-c1ccc2nncn2c1
BDBM380921 OC1COCc2c1cncc2-c1ccc2oc(=O)ccc2c1
BDBM380845 OC1COCc2c1cncc2-c1ccc2ocnc2c1
BDBM380816 OC1COCc2c1cncc2-c1ccc2scnc2c1
BDBM380799 OC1COCc2c1cncc2-c1ccccc1
BDBM380895 OC1COCc2c1cncc2-c1ccn2ccnc2c1
BDBM380823 OC1COCc2c1cncc2-c1cnc2[nH]ccc2c1
BDBM380982 OC1COCc2c1cncc2C1=CCC(CC1)C#N |t:13|
BDBM380963 OC1COCc2cncc(-c3ccc4cnccc4c3)c12
BDBM380880 OC1c2cncc(-c3ccc4C(=O)NCCc4c3)c2COC11CC1
BDBM380907 OC1c2cncc(c2COC11CC1)-c1ccc2OCCOCc2c1
BDBM380807 Cc1n[nH]c2cc(ccc12)-c1cncc2C(O)COCc12
BDBM380806 Cc1n[nH]c2ccc(cc12)-c1cncc2C(O)COCc12
BDBM380884 Cc1ncc2ccc(cn12)-c1cncc2C(O)C3(CC3)OCc12
BDBM380882 Cc1ncc2ccc(cn12)-c1cncc2C(O)COCc12
BDBM380822 Cc1nn(C)c(C)c1-c1cncc2C(O)COCc12 |(-1.36,3.29,;-2.13,1.96,;-3.6,1.48,;-3.6,-.06,;-4.93,-.83,;-2.13,-.54,;-1.36,-1.87,;-1.23,.71,;.31,.71,;1.08,2.04,;2.62,2.04,;3.39,.71,;2.62,-.62,;3.39,-1.96,;4.93,-1.96,;2.62,-3.29,;1.08,-3.29,;.31,-1.96,;1.08,-.62,)|
BDBM380887 Cc1nnc2ccc(cn12)-c1cncc2C(O)C3(CC3)OCc12
BDBM380891 Cc1nnc2ccc(cn12)-c1cncc2C(O)COCc12
BDBM380886 Cc1noc2ccc(cc12)-c1cncc2C(O)COCc12
BDBM380986 Cn1ncc2CCC(Cc12)c1cncc2C(O)COCc12
BDBM380973 Cn1nc(C#N)c2ccc(cc12)-c1cncc2c1COCC2(C)O
BDBM50275518 Cn1cc(cn1)-c1ccc(cc1)C#N
BDBM50275519 Cc1c(cnn1C)-c1ccc(cc1)C#N
BDBM50275520 CCc1c(cnn1C)-c1ccc(cc1)C#N
BDBM50275543 Cc1cnc(O[C@@H]2Cc3c(cnn3C2)-c2ccc(cc2C)C#N)nc1 |r|
BDBM50275495 N#Cc1ccc(cc1)-c1cnn2CCCc12
BDBM50275496 Cc1cc(ccc1-c1cnn2C[C@@H](Cc12)OCc1ccccc1)C#N |r|
BDBM50275497 Cc1cc(ccc1-c1cnc2CCCn12)C#N
BDBM50275498 Cc1cc(ccc1-c1cnn2C[C@H](Cc12)Oc1ncc(F)cn1)C#N |r|
BDBM50275508 CCn1ncc(c1C)-c1ccc(cc1)C#N
BDBM50275511 Cc1cc(ccc1-c1cnn2CCCc12)C#N
BDBM50275512 Fc1cc(ccc1C#N)-c1cnn2CCCc12
BDBM50275529 CN(C)Cc1c(cnn1C)-c1ccc(cc1)C#N
BDBM50275533 CO[C@@H]1Cc2c(cnn2C1)-c1ccc(cc1C)C#N |r|
BDBM50275534 Cc1cc(ccc1-c1cnn2C[C@@H](Cc12)OCC(N)=O)C#N |r|
BDBM50275535 Cc1cc(ccc1-c1cnn2C[C@@H](Cc12)Oc1cnccn1)C#N |r|
BDBM50275544 Cc1cc(ccc1-c1cnn2C[C@@H](Cc12)Oc1ncc(cn1)C#N)C#N |r|
BDBM50275489 COc1cc(ccc1-c1cnn2CCCc12)C#N
BDBM50275494 Cc1cc(ccc1-c1cnn2C[C@@H](Cc12)Oc1ncccn1)C#N |r|
BDBM50275514 Cc1cc(ccc1-c1cnn2C[C@@H](Cc12)Oc1ncc(F)cn1)C#N |r|
BDBM50275515 Cc1cc(ccc1-c1cnn2C[C@@H](O)Cc12)C#N |r|
BDBM50275516 Cn1ncc(c1CO)-c1ccc(cc1)C#N
BDBM50275530 Fc1cc(ccc1-c1cnn2CCCc12)C#N
BDBM50275532 Cc1cc(ccc1-c1cnn2C[C@H](O)Cc12)C#N |r|
BDBM50275513 Cc1cc(ccc1-c1cnn2C[C@@H](Cc12)OCC(O)=O)C#N |r|
BDBM50275517 Cc1cc(ccc1C#N)-c1cnn2CCCc12
BDBM50275521 Cn1ncc(c1C(F)(F)F)-c1ccc(cc1)C#N
BDBM50275531 Clc1cc(ccc1-c1cnn2CCCc12)C#N
BDBM50456836 O=c1c2ccc(Cn3ccnc3)cc2oc2cc(OC3CCCC3)ccc12
BDBM50456837 Clc1ccc2c(c1)oc1cc(Cn3ccnc3)ccc1c2=O
BDBM50456829 O=c1c2ccc(Cn3ccnc3)cc2oc2cc(Oc3ccccc3)ccc12
BDBM50456830 Fc1ccc2c(c1)oc1cc(Cn3ccnc3)ccc1c2=O
BDBM50456831 O=c1c2ccc(Cn3ccnc3)cc2oc2cc(OCC3CC3)ccc12
BDBM50456832 CC(C)Oc1ccc2c(c1)oc1cc(Cn3ccnc3)ccc1c2=O
BDBM50456833 Brc1ccc2c(c1)oc1cc(Cn3ccnc3)ccc1c2=O
BDBM50456834 COc1ccc2c(c1)oc1cc(Cn3ccnc3)ccc1c2=O
BDBM50456835 [O-][N+](=O)c1ccc2c(c1)oc1cc(Cn3ccnc3)ccc1c2=O
BDBM50500183 CCS(=O)(=O)NCc1cncc(c1)-c1cc2cnc(Cl)cc2n1C
BDBM50500184 Cn1c(c(C#N)c2ccccc12)-c1cccnc1
BDBM50500185 Cc1c([nH]c2ccccc12)-c1cccnc1
BDBM50500186 CCS(=O)(=O)Nc1cncc(c1)-c1c(C#N)c2ccc(Cl)cc2n1C
BDBM50500187 Cn1c(c(C#N)c2ccc(Cl)cc12)-c1cccnc1
BDBM50500188 CCS(=O)(=O)NCc1cncc(c1)-c1c(C#N)c2ccc(Cl)cc2n1C
BDBM50500189 CN(C)S(=O)(=O)Oc1cncc(c1)-c1c(C#N)c2ccccc2n1C
BDBM50500190 CCS(=O)(=O)NCc1cncc(c1)-c1cc2ccc(Cl)nc2n1C
BDBM50500191 Cc1c(-c2cccnc2)n(C)c2ccccc12
BDBM50500192 CCS(=O)(=O)Nc1cncc(c1)-c1c(C#N)c2ccccc2n1C
BDBM50502503 Fc1ccc2nc(-n3ccnn3)n(C3CC3)c2c1
BDBM50502508 FC(F)c1ncncc1-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM50502509 FC(F)c1ncncc1-c1nc2ccc(cc2n1C1CC1)C#N
BDBM50502504 Cc1ncncc1-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM50502502 Fc1cc2nc(-c3cncnc3NCCC(F)(F)F)n(C3CC3)c2cc1F
BDBM50502505 Fc1cc2nc(-c3cncnc3C(F)(F)F)n(C3CC3)c2cc1F
BDBM50502506 CC(C)c1ncncc1-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM50502507 CNc1ncncc1-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM50502510 FC(F)(F)c1ncncc1-c1nc2ccc(cc2n1C1CC1)C#N
BDBM50502511 FC(F)c1ncncc1-c1nc2ccc(nc2n1C1CC1)C#N
BDBM50502512 Fc1ccc2nc(-c3cn[nH]c3)n(C3CC3)c2c1
BDBM50502513 Fc1ccc2nc(-c3cncs3)n(C3CC3)c2c1
BDBM50502514 Fc1ccc2nc(-c3cnccn3)n(C3CC3)c2c1
BDBM50502515 Fc1ccc2nc(-c3cccnn3)n(C3CC3)c2c1
BDBM50502516 CCc1ncncc1-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM50502517 Fc1cc2nc(-c3cncnc3C#N)n(C3CC3)c2cc1F
BDBM50502518 CN(C)c1ncncc1-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM50502519 CC(F)(F)c1ncncc1-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM50502520 Fc1ccc2nc(-c3cnco3)n(C3CC3)c2c1
BDBM50502521 Fc1ccc2nc(-c3cncnc3)n(C3CC3)c2c1
BDBM50502522 FC(F)(F)c1ncncc1-c1nc2ccc(nc2n1C1CC1)C#N
BDBM50502523 Fc1cc2nc(-c3cncnc3C3CC3)n(C3CC3)c2cc1F
BDBM50502524 Fc1cc2nc(-c3cncnc3)n(C3CC3)c2cc1F
BDBM473972 CNC(=O)[C@@H]1Cc2ncn(c2C(=O)C1)-c1ccc(C#N)c(Cl)c1 |r|
BDBM473911 CC1(C)Cc2ncn(c2C(=O)C1)-c1ccc(cc1)C#N
BDBM473926 CC1(C)Cc2ncn(C3CCc4cc(Br)ccc4C3)c2C(=O)C1
BDBM473950 CC1(C)Cc2ncn([C@@H]3CC[C@@H](CC3)C#N)c2C(=O)C1 |r,wD:8.7,11.14,(2.94,-5.47,;2.54,-3.98,;3.88,-4.75,;1.21,-4.75,;-.13,-3.98,;-1.59,-4.45,;-2.5,-3.21,;-1.59,-1.96,;-1.99,-.47,;-3.48,-.08,;-3.88,1.41,;-2.79,2.5,;-1.3,2.1,;-.9,.61,;-3.22,3.98,;-3.62,5.47,;-.13,-2.44,;1.21,-1.67,;1.21,-.13,;2.54,-2.44,)|
BDBM473948 O=C1CCCc2ncn(C3CCc4ccccc4C3)c12
BDBM473961 O=C1CCCc2ncn(c12)-c1ccc(cn1)C#N
BDBM473964 NC(=O)N1CCCc2cc(ccc12)-n1cnc2CCCC(=O)c12
BDBM473965 Clc1cc(ccc1C#N)-n1cnc2CCCC(=O)c12
BDBM473966 NC(=O)[C@H]1Cc2ncn(c2C(=O)C1)-c1ccc(C#N)c(Cl)c1 |r|
BDBM473967 NC(=O)[C@@H]1Cc2ncn(c2C(=O)C1)-c1ccc(C#N)c(Cl)c1 |r|
BDBM473968 OCC1Cc2ncn(c2C(=O)C1)-c1ccc(C#N)c(Cl)c1
BDBM473969 CN(C)C(=O)[C@@H]1Cc2ncn(c2C(=O)C1)-c1ccc(C#N)c(Cl)c1 |r|
BDBM473970 Cn1ncc2CCC(Cc12)n1cnc2CCCC(=O)c12
BDBM50541760 CCC(=O)N[C@@H]1CCCc2c1cncc2N1Cc2cc(Cl)ccc2C1=O |r|
BDBM473918 Fc1ccc(cc1F)-n1cnc2CC3(CCC3)CC(=O)c12
BDBM473919 Clc1ccc(cc1)-n1cnc2CC3(CCC3)CC(=O)c12
BDBM473920 Clc1cc(ccc1C#N)-n1cnc2CC3(CCC3)CC(=O)c12
BDBM473921 CN1C(=O)CCc2cc(ccc12)-n1cnc2CC3(CC3)CC(=O)c12
BDBM473922 CC1(C)Cc2ncn(c2C(=O)C1)-c1ccc(cc1)C(F)(F)F
BDBM473923 C[C@@]1(CC[C@@H](CC1)n1cnc2CCCC(=O)c12)C#N |r,wU:1.19,wD:4.7,1.0,(-1.79,2.07,;-2.12,2.14,;-.63,1.74,;-.23,.25,;-1.32,-.84,;-2.81,-.44,;-3.21,1.05,;-.92,-2.33,;-1.83,-3.57,;-.92,-4.82,;.54,-4.34,;1.87,-5.11,;3.21,-4.34,;3.21,-2.8,;1.87,-2.03,;1.87,-.49,;.54,-2.8,;-2.52,3.62,;-2.92,5.11,)|
BDBM473924 CC1CCC(CC1)n1cnc2CC(C)(C)CC(=O)c12 |(-2.46,3.91,;-2.79,3.98,;-1.3,3.58,;-.9,2.1,;-1.99,1.01,;-3.48,1.41,;-3.88,2.89,;-1.59,-.48,;-2.5,-1.73,;-1.59,-2.97,;-.13,-2.5,;1.21,-3.27,;2.54,-2.5,;3.88,-3.27,;2.94,-3.98,;2.54,-.96,;1.21,-.19,;1.21,1.35,;-.13,-.96,)|
BDBM473925 CC1(C)Cc2ncn([C@H]3C[C@H]4CC[C@H]3C4)c2C(=O)C1 |r|
BDBM473928 CC1(C)Cc2ncn(C3CCC4(C)CCCCC4C3)c2C(=O)C1
BDBM473929 CC1(C)Cc2ncn(CC3CCCCC3)c2C(=O)C1
BDBM473930 CC1(C)Cc2ncn(C3CCc4ccccc34)c2C(=O)C1
BDBM473932 CC1CCC(c2ccccc12)n1cnc2CC(C)(C)CC(=O)c12
BDBM473933 CC1(C)Cc2ncn(C3CC4(COC4)C3)c2C(=O)C1
BDBM473934 CC1(C)Cc2ncn(C3CC(C3)c3ccccc3)c2C(=O)C1 |(4.36,-3.88,;3.02,-4.65,;4.36,-5.42,;1.69,-5.42,;.36,-4.65,;-1.11,-5.13,;-2.01,-3.88,;-1.11,-2.63,;-1.51,-1.15,;-.74,.19,;-2.07,.96,;-2.84,-.38,;-2.47,2.44,;-1.38,3.53,;-1.78,5.02,;-3.27,5.42,;-4.36,4.33,;-3.96,2.84,;.36,-3.11,;1.69,-2.34,;1.69,-.8,;3.02,-3.11,)|
BDBM473935 CC1(C)Cc2ncn(C3CCc4ncncc4C3)c2C(=O)C1
BDBM473936 CC1(C)Cc2ncn(C3CCCCc4ccccc34)c2C(=O)C1
BDBM473937 CC1(C)Cc2ncn(CC3CCOC3)c2C(=O)C1
BDBM473938 CC1(C)Cc2ncn(Cc3ccc4[nH]ncc4c3)c2C(=O)C1
BDBM473939 COC(=O)c1ccc(Cn2cnc3CC(C)(C)CC(=O)c23)cc1
BDBM473940 CC1(C)Cc2ncn(CC3CC3)c2C(=O)C1
BDBM473941 CC1(C)Cc2ncn(Cc3ccc(cc3)-n3cncn3)c2C(=O)C1
BDBM473942 Cc1nnsc1Cn1cnc2CC(C)(C)CC(=O)c12
BDBM473901 CC1(C)Cc2ncn(c2C(=O)C1)-c1ccc(Cl)cc1
BDBM50541751 CN(C(=O)c1ccc(cc1)C#N)c1cccnc1
BDBM50541752 CN(C(=O)c1ccc(Cl)cc1C)c1cccnc1
BDBM50541761 CS(=O)(=O)N[C@@H]1CCCc2c1cncc2N1Cc2cc(Cl)ccc2C1=O |r|
BDBM50541762 CCS(=O)(=O)N[C@@H]1CCCc2c1cncc2N1Cc2cc(Cl)ccc2C1=O |r|
BDBM50541763 C[C@H]1N(C(=O)c2ccc(Cl)cc12)c1cncc2[C@@H](CCCc12)NC(C)=O |r|
BDBM473943 CN1CCOc2cc(Cn3cnc4CC(C)(C)CC(=O)c34)cnc12
BDBM473944 CC(=O)Nc1ccc(Cn2cnc3CC(C)(C)CC(=O)c23)cc1
BDBM473945 CC1(C)Cc2ncn(C3Cc4ccccc4C3)c2C(=O)C1
BDBM473946 CC1(C)Cc2ncn(C3CCc4ccccc4C3)c2C(=O)C1
BDBM473947 CC1(C)Cc2ncn(CC3CCOCC3)c2C(=O)C1
BDBM473949 O=C1CCCc2ncn(C3Cc4ccccc4C3)c12
BDBM473951 CCO[C@H]1C[C@H](n2cnc3CC(C)(C)CC(=O)c23)C11CCC1 |r|
BDBM473953 CC1(C)Cc2ncn(Cc3ccc(F)cc3)c2C(=O)C1
BDBM473954 CC1(C)Cc2ncn(Cc3ccc(cc3)S(C)(=O)=O)c2C(=O)C1
BDBM473955 COc1ccc(Cn2cnc3CC(C)(C)CC(=O)c23)cc1
BDBM473956 CC1(C)Cc2ncn(Cc3ccccc3)c2C(=O)C1
BDBM473957 CN(CCO)C(=O)c1ccc(Cn2cnc3CC(C)(C)CC(=O)c23)cc1
BDBM473958 CC1(C)Cc2ncn(Cc3ccc(cc3)C(=O)N3CC[C@@H](O)C3)c2C(=O)C1 |r|
BDBM473959 CC1(C)Cc2ncn(Cc3ccc(cc3)C(=O)NCCS(C)(=O)=O)c2C(=O)C1
BDBM473960 CC(C)(O)c1ccc(Cn2cnc3CC(C)(C)CC(=O)c23)cc1
BDBM473952 CC1(C)Cc2ncn(C3CCc4cc(ccc4C3)C#N)c2C(=O)C1
BDBM473962 CC1(C)CCc2ncn(c2C1=O)-c1ccc(cc1)C#N
BDBM473917 CN1C(=O)CCc2cc(ccc12)-n1cnc2CCCC(=O)c12
BDBM473798 CC(=O)N1CCc2cc(ccc12)-n1cnc2CCCC(=O)c12
BDBM473799 O=C1CCCc2ncn(c12)-c1ccc2COCc2c1
BDBM473800 CN1Cc2cc(ccc2CC1=O)-n1cnc2CCCC(=O)c12
BDBM473801 CN1C(=O)CCc2cc(cnc12)-n1cnc2CCCC(=O)c12
BDBM50541738 CC1CN(C(=O)c2ccc(Cl)cc12)c1cccnc1
BDBM50541739 CC1Cc2cc(Cl)ccc2C(=O)N1c1cccnc1
BDBM50541740 Clc1ccc2C(=O)N(C(Cc3ccccc3)c2c1)c1cccnc1
BDBM50541741 Clc1ccc2C(=O)N(C(C3CC3)c2c1)c1cccnc1
BDBM50541742 Clc1ccc2C(=O)N(c3cccnc3)C3(CC3)c2c1
BDBM50541743 CC1(C)N(C(=O)c2ccc(Cl)cc12)c1cccnc1
BDBM50541744 CCC1N(C(=O)c2ccc(Cl)cc12)c1cccnc1
BDBM50541745 CC1N(C(=O)c2ccc(Cl)cc12)c1cccnc1
BDBM50541746 O=C1N(Cc2cc(ccc12)C#N)c1cccnc1
BDBM50541747 Clc1ccc2C(=O)N(Cc2c1)c1cccnc1
BDBM50541748 O=C1N(Cc2ccccc12)c1cccnc1
BDBM50541749 Fc1cc2C(=O)N(CCc2cc1Cl)c1cccnc1
BDBM50541750 Clc1ccc2C(=O)N(CCc2c1)c1cccnc1
BDBM50541753 CN(C(=O)c1ccc(Cl)cc1F)c1cccnc1
BDBM50541754 Cc1cc(Cl)ccc1C(=O)Nc1cccnc1
BDBM50541755 Fc1cc(Cl)ccc1C(=O)Nc1cccnc1
BDBM50541756 Clc1ccccc1C(=O)Nc1cccnc1
BDBM50541757 CC1(C)CN(C(=O)c2ccc(Cl)cc12)c1cccnc1
BDBM50541758 CC(=O)N[C@H]1CCCc2c1cncc2N1Cc2cc(Cl)ccc2C1=O |r|
BDBM50541759 CC(=O)N[C@@H]1CCCc2c1cncc2N1Cc2cc(Cl)ccc2C1=O |r|
BDBM50541764 C[C@@H]1N(C(=O)c2ccc(Cl)cc12)c1cncc2[C@@H](CCCc12)NC(C)=O |r|
BDBM50541765 CC[C@H]1N(C(=O)c2ccc(Cl)cc12)c1cncc2[C@@H](CCCc12)NC(C)=O |r|
BDBM50541766 CC[C@@H]1N(C(=O)c2ccc(Cl)cc12)c1cncc2[C@@H](CCCc12)NC(C)=O |r|
BDBM50541767 CCC(=O)N[C@@H]1CCCc2c1cncc2N1[C@H](C)c2cc(Cl)ccc2C1=O |r|
BDBM473802 O=C1CCCc2ncn(c12)-c1ccc2OCCc2c1
BDBM473803 CC(=O)N1CCCc2cc(ccc12)-n1cnc2CCCC(=O)c12
BDBM473804 Cn1ncc2cc(ccc12)-n1cnc2CCCC(=O)c12
BDBM473805 Cn1ncc2ccc(cc12)-n1cnc2CCCC(=O)c12
BDBM473806 O=C1CCCc2ncn(c12)-c1ccc2OCCOc2c1
BDBM473807 O=C1CCCc2ncn(c12)-c1ccc2OCCCOc2c1
BDBM473808 O=C1CCCc2ncn(c12)-c1ccc(cc1C1CC1)C#N
BDBM473809 O=C1CCCc2ncn(c12)-c1ccc(cc1)C#N
BDBM473810 Cn1c2ccc(cc2oc1=O)-n1cnc2CCCC(=O)c12
BDBM473811 CN1C(=O)COc2cc(ccc12)-n1cnc2CCCC(=O)c12
BDBM473812 Cc1cc(ccc1C#N)-n1cnc2CC3(CCOCC3)CC(=O)c12
BDBM473813 CN1C(=O)CCc2cc(ccc12)-n1cnc2CC3(CCOCC3)CC(=O)c12
BDBM473814 Clc1cc(ccc1C#N)-n1cnc2CC3(CCOCC3)CC(=O)c12
BDBM473815 Clc1ccc(cc1)-n1cnc2CC3(CCOCC3)CC(=O)c12
BDBM473816 O=C1CC2(CCOCC2)Cc2ncn(c12)-c1ccc(cc1)C#N
BDBM473817 O=C1CC2(CCC2)Cc2ncn(c12)-c1ccc(cc1)C#N
BDBM473818 Cc1cc(ccc1C#N)-n1cnc2CC3(CCC3)CC(=O)c12
BDBM473819 CN1C(=O)CCc2cc(ccc12)-n1cnc2CC3(CCC3)CC(=O)c12
BDBM50541768 CCC(=O)N[C@@H]1CCCc2c1cncc2N1[C@@H](C)c2cc(Cl)ccc2C1=O |r|
BDBM50541769 CC[C@H]1N(C(=O)c2ccc(Cl)cc12)c1cncc2[C@@H](CCCc12)NC(=O)CC |r|
BDBM50541770 CC[C@@H]1N(C(=O)c2ccc(Cl)cc12)c1cncc2[C@@H](CCCc12)NC(=O)CC |r|
BDBM50541771 CC(=O)N[C@@H]1CCCc2c1cncc2N1[C@H](C2CC2)c2cc(Cl)ccc2C1=O |r|
BDBM50541772 CC(=O)N[C@@H]1CCCc2c1cncc2N1[C@@H](C2CC2)c2cc(Cl)ccc2C1=O |r|
BDBM50541773 CC(=O)N[C@@H]1CCCc2c1cncc2N1CCc2cc(Cl)ccc2C1=O |r|
BDBM50541774 CCC(=O)N[C@@H]1CCCc2c1cncc2N1CCc2cc(Cl)ccc2C1=O |r|
BDBM50541775 CS(=O)(=O)N[C@@H]1CCCc2c1cncc2N1CCc2cc(Cl)ccc2C1=O |r|
BDBM50541784 CC(=O)N1CCN(CC1)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM50541785 CC1(C)N(C(=O)c2ccc(Cl)cc12)c1cncc(c1)N1CCN(CC1)S(C)(=O)=O
BDBM50541786 CCS(=O)(=O)N1CC(C1)Oc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM50541787 CC(=O)N1CC[C@H](C1)Oc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C |r|
BDBM50541788 CC(=O)N1CC[C@@H](C1)Oc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C |r|
BDBM50541789 CC(=O)N1CCC(CC1)Oc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM50541790 CC1(C)N(C(=O)c2ccc(Cl)cc12)c1cncc(OC2CN(C2)C(=O)c2ncccc2Cl)c1
BDBM473820 Clc1cc(ccc1C#N)-n1cnc2CC3(CC3)CC(=O)c12
BDBM473821 O=C1CC2(CC2)Cc2ncn(c12)-c1ccc(cc1)C#N
BDBM473822 CCOC(=O)C1Cc2ncn(c2C(=O)C1)-c1ccc(C#N)c(Cl)c1
BDBM473823 C[C@@H]1Cc2cc(ccc2O1)-n1cnc2CCCC(=O)c12 |r|
BDBM473824 C[C@H]1Cc2cc(ccc2O1)-n1cnc2CCCC(=O)c12 |r|
BDBM473825 Clc1cc(ccc1C#N)-n1cnc2C[C@@]3(CCOC3)CC(=O)c12 |r|
BDBM473826 Clc1cc(ccc1C#N)-n1cnc2C[C@]3(CCOC3)CC(=O)c12 |r|
BDBM473827 O=C1CCCc2ncn(c12)-c1ccc2NCCCc2c1
BDBM473828 CC1(C)Cc2ncn(c2C(=O)C1)-c1ccc(F)c(F)c1
BDBM473830 CC1(C)Cc2ncn(c2C(=O)C1)-c1ccc(Cl)c(Cl)c1
BDBM473831 CC1(C)Cc2ncn(c2C(=O)C1)-c1ccc(C#N)c(Cl)c1
BDBM473832 CC1(C)Cc2ncn(c2C(=O)C1)-c1cccc(Cl)c1Cl
BDBM473833 CC1(C)Cc2ncn(c2C(=O)C1)-c1ccc(Cl)cc1Cl
BDBM473834 CC1(C)Cc2ncn(c2C(=O)C1)-c1cc(Cl)cc(Cl)c1
BDBM473839 CC1(C)Cc2ncn(c2C(=O)C1)-c1ccc(F)c(Cl)c1
BDBM473897 CC(C)Oc1ccc(cc1Cl)-n1cnc2CC(C)(C)CC(=O)c12
BDBM473898 CC1(C)Cc2ncn(c2C(=O)C1)-c1cccc(Cl)c1
BDBM473899 CC(=O)c1ccc(cc1)-n1cnc2CC(C)(C)CC(=O)c12
BDBM50541776 CC(=O)NCc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM50541777 CCC(=O)NCc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM50541778 CC1(C)N(C(=O)c2ccc(Cl)cc12)c1cncc(CNS(C)(=O)=O)c1
BDBM50541779 C[C@@H](NS(C)(=O)=O)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C |r|
BDBM50541780 CCS(=O)(=O)NCc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM50541781 Cc1cccnc1C(=O)NCc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM50541782 CC(=O)N1CCC(CC1)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM50541783 CCS(=O)(=O)N1CCC(CC1)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM50541791 Cc1ccncc1C(=O)N1CC(C1)Oc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM50541792 Cn1cc(cn1)C(=O)N1CC(C1)Oc1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM50541793 CC(=O)N1CC2(C1)CN(C2)c1cncc(c1)N1C(=O)c2ccc(Cl)cc2C1(C)C
BDBM50541794 CCS(=O)(=O)N1CC2(CN(C2)c2cncc(c2)N2C(=O)c3ccc(Cl)cc3C2(C)C)C1
BDBM473900 CC1(C)Cc2ncn(c2C(=O)C1)-c1ccc(Cl)c(F)c1
BDBM473931 CN1C[C@H](CCC1=O)n1cnc2CC(C)(C)CC(=O)c12 |r|
BDBM473902 CN(C)c1ccc(cc1)-n1cnc2CC(C)(C)CC(=O)c12
BDBM473903 CC1(C)Cc2ncn(c2C(=O)C1)-c1ccc(F)cc1
BDBM473904 CC(C)Oc1ccc(cc1)-n1cnc2CC(C)(C)CC(=O)c12
BDBM473905 COc1ccc(cc1)-n1cnc2CC(C)(C)CC(=O)c12
BDBM473907 CC1(C)Cc2ncn(c2C(=O)C1)-c1ccc(Cl)nc1
BDBM473908 CC1(C)Cc2ncn(c2C(=O)C1)-c1ccc2OCOc2c1
BDBM473927 COc1ccc2CC(CCc2c1)n1cnc2CC(C)(C)CC(=O)c12
BDBM473910 COC(=O)c1ccc(cc1)-n1cnc2CC(C)(C)CC(=O)c12
BDBM473913 CC1(C)Cc2ncn(c2C(=O)C1)-c1cccc(c1)C(F)(F)F
BDBM473914 CC1(C)Cc2ncn(c2C(=O)C1)-c1ccccc1
BDBM473915 Cc1ccc(cc1)-n1cnc2CC(C)(C)CC(=O)c12
BDBM473909 Cc1cc(ccc1C#N)-n1cnc2CC(C)(C)CC(=O)c12
BDBM473906 Cc1ccc(cc1C#N)-n1cnc2CC(C)(C)CC(=O)c12
BDBM473916 Clc1ccc(cc1Cl)-n1cnc2CCCC(=O)c12
BDBM473963 CC1CCc2ncn(c2C1=O)-c1ccc(cc1)C#N
BDBM473971 CN1C(=O)CCc2cc(cnc12)-n1cnc2CC3(CC3)CC(=O)c12
BDBM504374 CC(Oc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1)C(F)(F)F
BDBM504360 CB(O)N1CCN(CC1)c1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CC1
BDBM504375 Cc1cc(cnn1)-c1nc2ccc(nc2n1C1CC1)C#N
BDBM504406 Clc1ccc2nc(-c3cnnc(c3)C3CC3)n(C3CC3)c2n1
BDBM504431 Cc1cc(cnn1)-c1nc2cc(F)c(F)cc2n1C1CCC1
BDBM504471 FC(F)Oc1cc(cnn1)-c1nc2ccc(cc2n1C1CC1)C#N
BDBM50595551 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1cccc(OC)c1 |r,t:10|
BDBM50595552 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1ccc(OC)cc1 |r,t:10|
BDBM50595553 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1ccccc1F |r,t:10|
BDBM50595554 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1cccc(F)c1 |r,t:10|
BDBM50595555 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1ccc(F)cc1 |r,t:10|
BDBM50595559 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1cccc(c1)[N+]([O-])=O |r,t:10|
BDBM50595560 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1ccc(cc1)[N+]([O-])=O |r,t:10|
BDBM50595561 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1ccccc1N |r,t:10|
BDBM50595562 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1cnccc1C |r,t:10|
BDBM50595563 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1cccc(F)n1 |r,t:10|
BDBM50595564 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1ncccn1 |r,t:10|
BDBM50595565 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1nc2ccccc2[nH]1 |r,t:10|
BDBM50595566 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1ccc2cc[nH]c2c1 |r,t:10|
BDBM50595567 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1ccc2[nH]ccc2c1 |r,t:10|
BDBM50595568 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1cnc2[nH]ccc2c1 |r,t:10|
BDBM50595569 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1ccc2[nH]ncc2c1 |r,t:10|
BDBM50595570 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cncc(Br)c3)[C@@]21[H])C(=O)Nc1ccc2[nH]ncc2c1 |r,t:10|
BDBM50595571 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cncc(c3)-c3ccoc3)[C@@]21[H])C(=O)Nc1ccc2[nH]ncc2c1 |r,t:10|
BDBM50595572 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cncc(c3)-c3ccsc3)[C@@]21[H])C(=O)Nc1ccc2[nH]ncc2c1 |r,t:10|
BDBM50595573 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cncc(c3)-c3cccc(c3)C#N)[C@@]21[H])C(=O)Nc1ccc2[nH]ncc2c1 |r,t:10|
BDBM50595557 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1ccc(Cl)cc1 |r,t:10|
BDBM50595558 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1cccc(Cl)c1Cl |r,t:10|
BDBM50595574 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cncc(c3)-c3ccc(cc3)C#N)[C@@]21[H])C(=O)Nc1ccc2[nH]ncc2c1 |r,t:10|
BDBM50595575 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cncc(c3)-c3cccc(OC)c3)[C@@]21[H])C(=O)Nc1ccc2[nH]ncc2c1 |r,t:10|
BDBM50595576 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cncc(c3)-c3cccc(F)c3)[C@@]21[H])C(=O)Nc1ccc2[nH]ncc2c1 |r,t:10|
BDBM50595577 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cncc(c3)-c3ccc(F)cc3)[C@@]21[H])C(=O)Nc1ccc2[nH]ncc2c1 |r,t:10|
BDBM50595543 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1ccccc1 |r,t:10|
BDBM50595544 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)N(C)c1ccccc1 |r,t:10|
BDBM50595545 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1ccccc1C |r,t:10|
BDBM50595549 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1ccc(cc1)C#N |r,t:10|
BDBM50595546 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1cccc(C)c1 |r,t:10|
BDBM50595547 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1ccc(C)cc1 |r,t:10|
BDBM50595548 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1cccc(c1)C#N |r,t:10|
BDBM50595578 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cncc(c3)-c3cccc(c3)C(F)(F)F)[C@@]21[H])C(=O)Nc1ccc2[nH]ncc2c1 |r,t:10|
BDBM50595550 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1ccccc1OC |r,t:10|
BDBM50595556 [H][C@@]12CC[C@@]([H])(C1)[C@]1(ON=C(c3cccnc3)[C@@]21[H])C(=O)Nc1cccc(Cl)c1 |r,t:10|