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668 SMILES Strings for Protein-tyrosine kinase 2-beta

Compound NameSMILES String
BDBM2579 CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r|
BDBM3993 CCOC(=O)c1cccc2C(N=O)c3ccccc3-c12
BDBM4552 COc1cc(Nc2c(cnc3cc(OCCCN4CCN(C)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
BDBM4339 [#8]-c1ccc(\[#6]=[#6](/C#N)C#N)cc1-[#8]
BDBM4779 Fc1ccc(Nc2ncnc3cc(OCCCN4CCOCC4)c(NC(=O)C=C)cc23)cc1Cl
BDBM4814 CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C
BDBM4851 Clc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1
BDBM5544 NS(=O)(=O)c1ccc(Nc2nc(OCC3CCCCC3)c3[nH]cnc3n2)cc1
BDBM5445 CS(=O)(=O)CCNCc1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
BDBM5446 COCCOc1cc2ncnc(Nc3cccc(c3)C#C)c2cc1OCCOC
BDBM5447 COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
BDBM5655 CN1CC[C@@H]([C@H](O)C1)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl |r|
BDBM5931 CC(C)(C)c1cnc(CSc2cnc(NC(=O)C3CCNCC3)s2)o1
BDBM6568 CSc1cccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)c1 |(-12.18,1.86,;-10.84,1.09,;-9.51,1.86,;-9.51,3.4,;-8.18,4.17,;-6.84,3.4,;-6.84,1.86,;-5.51,1.08,;-4.18,1.85,;-4.18,3.39,;-2.84,4.16,;-1.51,3.4,;-.18,4.17,;1.16,3.4,;2.49,4.17,;2.49,5.71,;1.16,6.48,;3.83,6.48,;5.16,5.71,;5.16,4.17,;3.83,3.39,;3.83,1.85,;1.16,1.86,;2.49,1.09,;-.18,1.09,;-.18,-.45,;-1.51,1.86,;-2.84,1.08,;-8.18,1.08,)|
BDBM6866 Nc1nc(Nc2ccc(cc2)S(N)(=O)=O)nn1C(=O)c1c(F)cccc1F
BDBM7533 CC[C@H](CO)Nc1nc(NCc2ccccc2)c2ncn(C(C)C)c2n1 |r|
BDBM7364 CCCCc1c([nH]c2nccnc12)-c1ccc(OC)cc1
BDBM7680 NS(=O)(=O)c1ccc(NN=C2C(=O)Nc3ccc(Br)cc23)cc1 |w:9.8|
BDBM12621 COc1ccc(F)c(F)c1C(=O)c1cnc(NC2CCN(CC2)S(C)(=O)=O)nc1N
BDBM13336 CS(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
BDBM13216 Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)cccc2Cl)cc(n1)N1CCN(CCO)CC1
BDBM13530 CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
BDBM13531 Oc1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
BDBM13533 Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(OCCN2CCOCC2)c2ccccc12)C(C)(C)C
BDBM13534 CN1CCN(CC1)c1cc(Nc2cc(C)n[nH]2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1
BDBM13535 COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
BDBM15138 Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccccc2)c1 |r|
BDBM15244 Fc1ccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)c(F)c1 |(-1.69,6.87,;-1.69,5.33,;-.36,4.56,;-.36,3.02,;-1.69,2.25,;-1.69,.71,;-3.03,-.06,;-3.03,-1.6,;-4.36,-2.37,;-5.75,-1.54,;-7.08,-2.31,;-7.08,-3.85,;-5.75,-4.62,;-4.42,-3.85,;-5.75,-6.16,;-7.08,-6.93,;-8.42,-6.16,;-8.42,-4.62,;-9.75,-3.85,;-8.42,-1.54,;-9.75,-2.31,;-8.42,,;-7.08,.77,;-5.75,,;-4.36,.71,;-3.03,3.02,;-4.36,2.25,;-3.03,4.56,)|
BDBM16673 CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)cc2)ccn1
BDBM17055 CN(C)C[C@@H]1CCn2cc(C3=C(C(=O)NC3=O)c3cn(CCO1)c1ccccc31)c1ccccc21 |r,t:10|
BDBM21079 Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cccc3[nH]nc(N)c23)c1
BDBM22857 O=C1C(=O)c2ccccc2-c2ccccc12
BDBM25617 CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(Cl)cc23)c1F
BDBM25628 OCCn1cc(c(n1)-c1ccncc1)-c1ccc2C(CCc2c1)N=O
BDBM24713 C1Cc2c([nH]c3ccccc23)-c2n[nH]cc12
BDBM24654 Clc1cccc(Cl)c1C(=O)Nc1cn[nH]c1C(=O)NC1CCNCC1
BDBM24773 CC1(C)CNc2cc(NC(=O)c3cccnc3NCc3ccncc3)ccc12
BDBM25084 Nc1nc(N)c2nc(-c3cccc(O)c3)c(nc2n1)-c1cccc(O)c1
BDBM25117 CNC(=O)c1ccccc1Sc1ccc2c(\C=C\c3ccccn3)n[nH]c2c1
BDBM25118 CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O
BDBM25013 CCn1c(nc2c(ncc(OC[C@H]3CCCNC3)c12)C#CC(C)(C)O)-c1nonc1N |r|
BDBM25028 CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1
BDBM25045 Oc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
BDBM27817 CNC(=O)c1c(F)cccc1Nc1nc(Nc2cc3N(CCc3cc2OC)C(=O)CN(C)C)nc2[nH]ccc12
BDBM26474 CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(C)c(c2)S(N)(=O)=O)n1
BDBM26300 CCN(CCO)CCCOc1ccc2c(Nc3cc(CC(=O)Nc4cccc(F)c4)n[nH]3)ncnc2c1
BDBM25919 Cc1cnc2c(NCCN)nc3ccc(C)cc3n12
BDBM31765 Cc1cc(NC(=O)Cc2cccs2)no1
BDBM31698 CC1(C)CCCN(C1)C(=O)c1coc(=O)c(Br)c1
BDBM31699 COc1ccc(cc1)-c1nnc(Nc2nc3c(OC)cccc3s2)o1
BDBM31754 O=C(CSc1nnc2scc(-c3ccccc3)n12)Nc1nsc(n1)-c1ccccc1
BDBM31717 Oc1ccccc1C(=O)\N=N\c1ccc(NOC(=O)c2ccccc2)cc1
BDBM31045 CCn1c2ccccc2c(O)c(C(=O)Nc2nc3ccccc3[nH]2)c1=O
BDBM31340 COCC(=O)NC\C=C\c1ccc2ncnc(Nc3ccc(Oc4ccc(C)nc4)c(C)c3)c2c1
BDBM30809 CCOC(=O)c1sc2N=C3CCCC(=O)C3C(c3cccs3)c2c1C |t:8|
BDBM31085 CCN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4cc(NC)ncn4)cc3)cc2C(F)(F)F)CC1
BDBM31088 Cn1c(Nc2ccc(cc2)C(F)(F)F)nc2cc(Oc3ccnc(c3)-c3ncc([nH]3)C(F)(F)F)ccc12
BDBM31090 CCOc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
BDBM31094 [H][C@@]12C[C@@H]([C@H](OC)[C@@](C)(O1)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)c1ccccc1 |TLB:11:10:9:4.3.2,17:33:9:4.3.2,THB:24:32:9:4.3.2,5:4:9:10.31.33.32,30:31:9:4.3.2|
BDBM31095 Cc1[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
BDBM33089 Cc1cc(N)ccc1N1CCCC1
BDBM34176 COc1ccc2[nH]c(=O)c(cc2c1)-c1noc(n1)-c1ccccc1
BDBM34182 O=c1[nH]c(Nc2ccccc2)cc2ccccc12
BDBM32280 CC(=O)c1ccc(NC(=O)c2ccc3nc(-c4ccco4)c(nc3c2)-c2ccco2)cc1
BDBM32362 COc1ccc(COc2ccc(Cc3cnc(N)nc3N)cc2OC)cc1
BDBM32069 C[C@H]1CCCC(=O)CCCC=Cc2cc(O)cc(O)c2C(=O)O1
BDBM32340 CCc1n[nH]c2cccc3c(OC)ccc1c23
BDBM32271 NC(=O)c1sc2nc3CCCc3c(-c3ccco3)c2c1N
BDBM36409 CC(C)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
BDBM34546 CCCCn1c(CN2C(=O)c3ccccc3C2=O)nc2ccccc2c1=O
BDBM34683 O=C(c1coc-2c1C(=O)C(=O)c1ccccc-21)c1ccccc1
BDBM34691 Cc1oc-2c(c1C(=O)c1ccccc1)C(=O)C(=O)c1ccccc-21
BDBM34474 COc1ccc(cc1NC(=O)c1ccc(Br)o1)-c1cc2ccccc2oc1=O
BDBM35417 O=C(Nc1cccc(c1)C(=O)Nc1cccc(c1)-c1nc2ccccc2[nH]1)c1ccco1
BDBM37601 CCN(CC)c1ccc2cc(-c3nc4ccccc4[nH]3)c(=O)oc2c1
BDBM40551 O=C1C(C(=O)c2ccccc12)c1ccnc2ccccc12
BDBM40555 Brc1ccc(o1)C(=O)Oc1ccc(cc1)-c1cnc2ccccc2n1
BDBM38837 O=C1Cc2ccccc2C(=O)N1CCc1ccccc1
BDBM38173 O=c1oc2ccccc2n1CCn1c2ccccc2c2nc3ccccc3nc12
BDBM286303 C.C[C@H]1CNC(CCO)CN1C(=O)N1Cc2c(Nc3nc(C)ncc3F)n[nH]c2C1(C)C |r|
BDBM36926 Cc1ccc2[nH]c3c(NCc4ccco4)ncnc3c2c1
BDBM41004 Brc1ccc(o1)-c1nc2ccccc2c(=O)o1
BDBM41005 O=C1Cc2ccccc2C(=O)N1Cc1ccccc1
BDBM41006 Cc1oc(cc1C(=O)Nc1cccc2ccccc12)-c1ccccc1
BDBM41007 CCOC(=O)C1=C(OC(=N)C(C#N)C1C1CCCCC1)c1ccccc1 |t:5|
BDBM41008 CCOc1ccc(cc1)-n1c(SCc2nc(no2)-c2ccc(C)cc2)nnc1-c1ccncc1
BDBM41041 NNC(=O)C(=NNc1c(Cl)cccc1Cl)C#N |w:5.5|
BDBM41042 Cc1ccc(cc1)-c1cc(nc2ncnc(N)c12)-c1ccc(F)cc1
BDBM40969 O=C1Nc2ccccc2C1C=Nc1ccc2OCCOc2c1 |w:11.13|
BDBM40970 CSc1nc2ccc3nc(NC(=O)c4cccs4)sc3c2s1
BDBM40971 Cn1c2ccccc2c(=O)n2c1cc1ccccc1c2=O
BDBM41012 c1nc2ccccc2n1-c1ccc(cc1)-c1ccnc(n1)-c1ccccc1
BDBM41013 COc1ccc(cc1)C(=O)Nc1nc2ccc3nc(C)sc3c2s1
BDBM41043 Cc1ccc(cc1C)C(=O)COC(=O)c1ccc2C(=O)N(C(=O)c2c1)c1cccc2ncccc12
BDBM41044 Clc1ccc2nc(N=NCc3ccccc3C#N)nc(-c3ccccc3)c2c1 |w:7.6|
BDBM41045 Clc1ccc(CSc2nc(ccc2C#N)-c2cccnc2)c(Cl)c1
BDBM41046 COc1ccc(cc1OC)C(=O)c1sc2nc(ccc2c1N)-c1ccccc1
BDBM41047 Nc1ncnc2nc(cc(-c3ccc(F)cc3)c12)-c1ccccc1
BDBM41048 COc1cccc(Cn2cc(O)c(c2N)-c2nc(cs2)-c2ccc(Cl)cc2)c1
BDBM41049 O=C(NN=Cc1ccc2ccccc2c1)c1ccc(COc2ccc3CCCc3c2)o1 |w:3.2|
BDBM41050 CCOc1ccc(NC2=NC(=O)SC2=Cc2ccc(Cl)cc2)cc1 |w:14.15,t:8|
BDBM41051 Nc1c(sc2nc(ccc12)-c1cccs1)C(=O)Nc1nc2ccccc2s1
BDBM41052 COc1ccc(cc1Cl)-n1nc(C(=O)NCC(=O)Nc2ccccn2)c2ccccc2c1=O
BDBM41053 N#Cc1cnn2c1nc(N1CCCCC1)c1ccccc21
BDBM41054 N#Cc1cnn2c1nc(N1CCOCC1)c1ccccc21
BDBM41055 Clc1ccc2[nH]cc(-c3nnnn3-c3ccccc3)c2c1
BDBM41056 Clc1cc(C=NNC(=O)c2cc3ccccc3o2)ccc1OCC(=O)Nc1ccccc1 |w:5.5|
BDBM41057 [O-][N+](=O)c1ccc(N2CCCCCC2)c([CH+][N-]NC(=O)Cn2c3ccccc3c(=O)c3ccccc23)c1
BDBM40972 O=C(NCCc1c[nH]c2ccccc12)C1CCN(CC1)c1nnc(s1)N1CCCC1=O
BDBM40973 OP(O)(=O)c1ccccc1OCCCCCOc1ccccc1P(O)(O)=O
BDBM40974 COc1ccc(cc1OC)N=CC1C(=O)Nc2ccccc12 |w:10.10|
BDBM40975 CN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)NCc1ccco1
BDBM40976 COc1cc(cc(OC)c1O)C1Nc2ccc3ncccc3c2C2=C1C(=O)CCC2 |c:26|
BDBM41009 Fc1ccc(cc1)-c1onc2ccc(C=O)cc12
BDBM41010 Cc1ccc(cc1)-c1onc2ccc(C=O)cc12
BDBM41011 O=Cc1ccc2noc(-c3ccccc3)c2c1
BDBM41077 Cc1cc2cc3c(N)[nH]nc3nc2cc1C
BDBM41078 CCc1ccc2nc3n[nH]c(N)c3cc2c1
BDBM41079 O=C1Nc2ccccc2C1=Cc1cnc[nH]1 |w:10.12|
BDBM41080 CN(C)c1cc(N(C)C)c2C(=O)c3ccccc3C(=O)c2c1
BDBM41081 Clc1ccc(cc1S(=O)(=O)Nc1ccccc1)C(=O)Nc1ccccc1C(=O)NCC=C
BDBM40977 CCN1CCc2c(C1)sc(N)c2C#N
BDBM40978 OC(=O)c1cccc(c1)S(=O)(=O)Nc1ccccc1Cl
BDBM41014 NC(=O)C(C#N)C1=Nc2ccccc2CC1 |t:6|
BDBM41015 CCc1c(C)nc(SCC(=O)c2cccs2)c(C#N)c1C
BDBM41016 COc1ccc(cc1OC)-c1nc(-c2cccs2)c([nH]1)-c1cccs1
BDBM41017 Oc1ccc2ccccc2c1C=Nc1ccc(cc1)N1CCOCC1 |w:12.14|
BDBM41018 CCOC(=O)CNC(=O)c1sc2ncnc(N3CCc4ccccc4C3)c2c1C
BDBM41019 C(N1CCOCC1)c1ccc2ccc3cccc4ccc1c2c34
BDBM41082 COc1ccc(cc1COc1cc(C)cc2oc(=O)cc(-c3ccccc3)c12)[N+]([O-])=O
BDBM41083 COC(=O)c1cc(Cl)c(NC(=O)\C=C\c2ccc(Cl)cc2)cc1OC
BDBM41084 O=C(Nc1cccc(c1)-c1cn2ccccc2n1)c1cc2ccccc2oc1=O
BDBM41085 CCOC(=O)c1cnc2ccc(C)cc2c1Nc1ccc(cc1)N1CCOCC1
BDBM41086 Clc1cc(NC(=O)c2cccnc2)ccc1-c1cc2ccccc2oc1=O
BDBM41087 CC(=O)Nc1ccc(Nc2ncc(c(Nc3ccc(NC(C)=O)cc3)n2)[N+]([O-])=O)cc1
BDBM41088 COc1ccc(cc1NC(=S)NC(=O)c1ccc2OCCOc2c1)-c1cc2ccccc2oc1=O
BDBM41089 CCOC(=O)C1=C(OC(=N)C(C#N)C1c1cccs1)c1ccccc1 |t:5|
BDBM41090 Cc1cc(OCC(=O)Nc2ccc(cc2)N2CCN(CC2)C(=O)c2ccco2)cc(C)c1Cl
BDBM41091 [O-][N+](=O)c1ccc(\C=C\C=N\NC(=O)c2cccs2)cc1
BDBM41092 COc1ccc(cc1F)-c1coc2cc3oc(=O)cc(C)c3cc12
BDBM41093 Clc1c(sc2cc(Cl)ccc12)C(=O)Nc1cccc(c1)-c1nc2ncccc2o1
BDBM41094 Cn1c(SCC(=O)c2ccc-3c(Cc4ccccc-34)c2)nnc1-c1ccccc1
BDBM41095 COC(=O)c1ccc(COc2ccc(\C=C(/C#N)c3nc4ccccc4[nH]3)cc2OC)o1
BDBM40979 COc1cc2nc(oc(=O)c2cc1OC)-c1ccc(Br)o1
BDBM40980 OC(=O)c1ccc(F)c(c1)S(=O)(=O)Nc1ccccc1Cl
BDBM40981 COc1ccc(OC)c(NS(=O)(=O)Cc2ccccc2)c1
BDBM40982 Cc1ccc(OCC(=O)Nc2ccc(cc2)-c2nc3ncccc3o2)c(C)c1
BDBM40983 OC(=O)c1ccccc1OCCOCCOc1ccccc1C(O)=O
BDBM40984 COC(=O)C1C(NC(=O)N=C1CSCc1ccco1)c1cc(C)ccc1C |c:9|
BDBM40985 Cc1nnc2sc(nn12)-c1ccc(C)c(NC(=O)COc2ccc(Cl)c(C)c2)c1
BDBM41020 Cc1ccc(OC(=O)c2ccccc2P(O)(O)=O)cc1
BDBM41021 COc1ccc(cc1)N=CC1C(=O)Nc2ccccc12 |w:8.8|
BDBM40987 CCc1ccc(OCC(=O)Nc2ccc(-c3nc4ccccc4o3)c(O)c2)cc1
BDBM40988 CCOCCOC(=O)C1C(c2ccsc2)C2=C(CC(CC2=O)c2cccs2)N=C1C |c:30,t:16|
BDBM40989 COC(=O)C1C(c2ccsc2)C2=C(CC(CC2=O)c2cccs2)N=C1C |c:26,t:12|
BDBM40990 Cc1cc(C)cc(OCC(=O)Nc2ccc(cc2)N2CCCC2)c1
BDBM41022 CN1C(=O)\C(=C\c2cn(CC(=O)N3CCCCC3)c3ccccc23)c2ccccc12
BDBM41023 COC(=O)c1ccccc1NC(=O)c1c(Br)cnn1C
BDBM40986 OC(=O)c1ccc(F)c(c1)S(=O)(=O)Nc1ccccc1
BDBM41024 OP(O)(=O)c1ccccc1C(=O)Oc1ccccc1Cl
BDBM41025 CC(C)(C)C(=O)Nc1nc-2c(COc3ccccc-23)s1
BDBM41026 CC1CCN(CC1)c1ncnc2nc[nH]c12
BDBM41027 CCN(CC)C(=O)CSc1nc(N)c2c3CCC(C)Cc3sc2n1
BDBM41058 Cc1n[nH]c(C)c1N=Nc1cc(Cl)ccc1Cl |w:8.9|
BDBM41059 CCOc1cc(\C=C2\NC(=S)NC2=O)ccc1OCc1ccc(cc1)[N+]([O-])=O
BDBM41060 O=C1CCCC2=C1C(Nc1ccc3ncccc3c21)c1cccs1 |c:5|
BDBM41061 O=C(CSc1nc(nc2ccccc12)C1CC1)NCc1ccc2OCOc2c1
BDBM41062 CC(C)c1nc(SCC(=O)Nc2nnc(C)s2)c2ccccc2n1
BDBM41063 O=C(CSc1nc(nc2ccccc12)C1CC1)Nc1ccc2OCCOc2c1
BDBM41064 CCc1nc(SCC(=O)NNC(=O)C2CCCCC2)c2ccccc2n1
BDBM41065 O=C(CSc1nc(nc2ccccc12)C1CC1)N1CCc2ccccc2C1
BDBM41066 Cc1ccsc1C1Nc2ccc3ncccc3c2C2=C1C(=O)CCC2 |c:21|
BDBM41067 CCOc1ccc2nc(NC3=NC(CC(=O)N3)c3ccc(OC)cc3)nc(C)c2c1 |t:10|
BDBM41068 COc1ccc2nc(C)cc(SCC(=O)NN=Cc3cccc4ccccc34)c2c1 |w:16.15|
BDBM41069 Clc1c(sc2ccccc12)C(=O)Nc1cccc(c1)-c1nc2ncccc2o1
BDBM41070 O=C(COc1ccccc1)Nc1sc2CCCCc2c1C(=O)NCc1cccnc1
BDBM41071 Brc1cc(C=NNC(=O)c2cc3ccccc3o2)ccc1OCC(=O)Nc1ccccc1 |w:5.5|
BDBM41072 [O-][N+](=O)c1cccc(C=Cc2nc3ccc(cc3[nH]2)[N+]([O-])=O)c1 |w:9.9|
BDBM41073 Fc1cccc(C=NNC(=O)c2cc(nc3ccccc23)-c2ccco2)c1 |w:7.7|
BDBM41074 Cc1ccsc1C1Nc2ccc3ncccc3c2C2=C1C(=O)CC(C)(C)C2 |c:21|
BDBM41075 CCOc1ccc(cc1)S(=O)(=O)N(CC(=O)N\N=C\c1ccc(o1)-c1ccc(cc1)[N+]([O-])=O)c1ccccc1
BDBM41076 Cc1ccc(cc1)C(=O)NNC(=O)CSc1nnc2c(n1)[nH]c1ccc(F)cc21
BDBM40993 O=C(Nc1ccc2oc(nc2c1)-c1cccnc1)c1cc2ccccc2o1
BDBM40994 CCOC(=O)c1cnn(c1N)-c1ncnc2sc(CC)cc12
BDBM40995 Cc1c(C(N)=O)c(N)c(C(=O)c2ccccc2)n1-c1ccccc1
BDBM40996 O=NCc1c(Nc2ccccc2)nc2ccccn2c1=O
BDBM41028 CC(N1C(=S)S\C(=C/C=C/c2ccco2)C1=O)C(O)=O
BDBM41029 [H]C12CC3([H])CC([H])(C1)CC(C2)(C3)C(=O)c1sc2nc3CCN(C)Cc3cc2c1N |TLB:8:1:12:6.9.5,8:6:12:1.11.2,THB:5:6:11:3.12.2|
BDBM41030 COc1nnc(-c2ccc(N3CCCCC3)c(NC(C)=O)c2)c2ccccc12
BDBM40991 Nc1ncnc2oc(-c3ccco3)c(-c3ccco3)c12
BDBM40992 COC(=O)Cc1ccc2c(c1)n(C)c1ccccc21
BDBM41031 Cc1nn2C(C3C(=O)CCCC3=Nc2c1-c1ccccc1)c1ccccc1 |c:12|
BDBM41032 C=CCn1c(SCC(=O)N2CCCC2)nc2scc(-c3cccs3)c2c1=O
BDBM41033 CCN(CC)S(=O)(=O)c1cc(ccc1NNC(=O)Nc1ccccc1)[N+]([O-])=O
BDBM41034 Clc1ccc(c(Cl)c1Cl)-c1cc(C(=O)OCC(=O)N2CCN(CC2)C(=O)c2ccco2)c2ccccc2n1
BDBM41035 OP(=O)(c1nc2ccccc2n1CC=C)c1ccccc1
BDBM41036 Cc1ccc(Cl)cc1NC1=CC(=NS(=O)(=O)c2cccs2)c2ccccc2C1=O |w:12.13,t:10|
BDBM41037 O=C(CSc1ccc2-c3ccccc3C(=O)c3cccc1c23)Nc1cccc(c1)C#N
BDBM41038 Cc1ccccc1NC1=CC(=NS(=O)(=O)c2cccs2)c2ccccc2C1=O |w:11.12,t:9|
BDBM41039 COc1ccc(cc1)-c1ccc2c(N)c(sc2n1)C(=O)c1ccc(OC)c(OC)c1
BDBM41040 COc1cccc(c1)\N=c1/oc2ccc(OC)cc2cc1-c1nc2ccccc2[nH]1
BDBM40997 CN(C)C=NC(=O)C(C#N)C1=Nc2ccccc2CC1 |w:4.4,t:10|
BDBM40998 Cc1c(N2C(=O)c3ccc4CCc5ccc(C2=O)c3c45)c(=O)n(-c2ccccc2)n1C
BDBM40999 COc1cc(cc(OC)c1O)C1Nc2ccc3ncccc3c2C2=C1C(=O)CC(C)(C)C2 |c:26|
BDBM41000 CCOC(=O)CSc1nc(nc2ccccc12)C(C)C
BDBM41001 CC(C)c1nc(SCC(=O)Nc2cc(C)on2)c2ccccc2n1
BDBM41003 Cc1ccc2nc(oc(=O)c2c1)-c1ccc(Br)o1
BDBM40966 [#6]C([#6])([#6])[#6](=O)-[#7]\[#6](=[#6](/Cl)Cl)P([#8])([#8])=O
BDBM40967 N#CCSc1nc(Nc2ccc3OCOc3c2)c2ccccc2n1
BDBM40968 Cc1ccc2cc3cc(oc3nc2c1)C(=O)NCc1ccc2OCOc2c1
BDBM40727 Fc1ccc(C=NNC(=O)c2cc(nc3ccccc23)-c2ccco2)cc1 |w:6.6|
BDBM40936 CCOC(=O)CSc1nc(nc2ccccc12)C1CC1
BDBM40937 COCCOC(=O)C1C(c2ccsc2)C2=C(CC(CC2=O)c2cccs2)N=C1C |c:29,t:15|
BDBM40939 CN1CCN(CC1)c1ccc(N)c(c1)N1CCN(C)CC1
BDBM40940 CC(C)c1nc(SCC(=O)N2CCCC2)c2ccccc2n1
BDBM40941 Cc1ccccc1-c1ccc(Nc2ccc(cc2)N2CCOCC2)nn1
BDBM40942 Oc1c(C(=O)Nc2cccnc2)c(=O)c2cccc3CCn1c23
BDBM40943 COC(=O)CSc1nc(nc2ccccc12)C(C)C
BDBM40944 O=C(OCCN=C1NS(=O)(=O)c2ccccc12)c1cccnc1 |w:5.4|
BDBM40945 CCc1nc(SCC(=O)N2CCCC2)c2ccccc2n1
BDBM40946 Cc1ccc2nsnc2c1S(=O)(=O)Nc1cccc2nsnc12
BDBM40947 CCN(CC)C(=O)CSc1nc2ccc(CC)cc2cc1C#N
BDBM40948 OP(O)(=O)C(=C)c1cccc2ccccc12
BDBM40712 Clc1ccc(cc1)C(=O)NN=c1c2cccc3cccc(c23)c1=O |w:10.10|
BDBM40949 CC(C)c1nc2n[nH]c(N)c2c2CCCCc12
BDBM40950 COC(=O)c1[nH]c2ccc(C)cc2c1NC(=O)CN1CCCc2ccccc12
BDBM40951 COCCN(Cc1ccccc1)P(O)(=O)c1ccccc1OCC(O)=O
BDBM40556 O=c1cc(oc2c3ccccc3ccc12)-c1ccco1
BDBM40952 CN1CCc2c(C1)sc1N=CN3N\C(N=C3c21)=C1/C=CC=CC1=O |c:10,15,22,24|
BDBM40953 OP(O)(=O)c1cccc(Cl)c1C(=O)Oc1ccccc1
BDBM40954 CC(C)c1nc2n[nH]c(N)c2c2CCCc12
BDBM40955 Oc1ccccc1-c1nc(NCCN2CCOCC2)c2ccccc2n1
BDBM40956 NC(=O)C1CCN(CC1)c1oc(nc1C#N)-c1ccc(OCc2ccc(Cl)cc2)cc1
BDBM40714 COc1ccccc1CNC(=O)COC(=O)c1cc(nc2ccccc12)-c1ccco1
BDBM40717 Cn1c(SCC(=O)Nc2ccc3nc(SCC(=O)N4CCCC4)sc3c2)nnc1-c1ccc(N)cc1
BDBM40957 Clc1ccc(Cl)c2c3CCNC(=O)c3[nH]c12
BDBM40958 COc1ccc(cc1)-c1cnc(N)nc1-c1ccc(OC)cc1O
BDBM40959 Cc1n[nH]c(NC=C2C(=O)CC(C)(C)CC2=O)c1-c1ccccc1 |(8.76,5.94,;7.85,4.69,;6.31,4.69,;5.84,3.23,;7.08,2.32,;7.08,.78,;5.75,.01,;5.75,-1.53,;4.41,-2.3,;3.08,-1.53,;4.41,-3.84,;5.75,-4.61,;4.98,-5.94,;6.52,-5.94,;7.08,-3.84,;7.08,-2.3,;8.41,-1.53,;8.33,3.23,;9.79,2.75,;10.11,1.25,;11.58,.77,;12.72,1.8,;12.4,3.31,;10.94,3.78,)|
BDBM40960 Cc1n[nH]c(NC=C2C(=O)CC(C)(C)CC2=O)c1-c1ccc(Cl)cc1 |(8.76,5.94,;7.85,4.69,;6.31,4.69,;5.84,3.23,;7.08,2.32,;7.08,.78,;5.75,.01,;5.75,-1.53,;7.08,-2.3,;8.41,-1.53,;7.08,-3.84,;5.75,-4.61,;4.98,-5.94,;6.52,-5.94,;4.41,-3.84,;4.41,-2.3,;3.08,-1.53,;8.33,3.23,;9.79,2.75,;10.11,1.25,;11.58,.77,;12.72,1.8,;14.19,1.33,;12.4,3.31,;10.94,3.78,)|
BDBM40961 O=C1Nc2ccc(NS(=O)(=O)c3cccs3)c3cccc1c23
BDBM40962 FC(F)(F)c1cnc2Sc3ccccc3Nc2c1
BDBM40963 CC(C)(C)c1cc(NC(=O)COC(=O)c2ccc3c(c2)nc2CCCn2c3=O)n(n1)-c1ccccc1
BDBM40964 CCCn1c(NC(=O)c2ccc(Cl)c(c2)S(=O)(=O)N2CCCC2)nc2ccccc12
BDBM40965 Cc1ccc2c(Cl)cc(Cl)c(OCc3nnc(o3)-c3ccccc3)c2n1
BDBM40209 COc1ccc(cc1)-n1nc(C(=O)Nc2ccc(OC)c(OC)c2)c2c3ccccc3n(C)c2c1=O
BDBM40031 O=C(Nc1ccc(cc1)-n1nncc1-c1ccco1)c1cc2ccccc2oc1=O
BDBM40178 O=C(Nc1ccc(cc1)N1CCCC1)C(c1ccccc1)c1ccccc1
BDBM40238 CC(=O)c1ccc(NCC(=O)N2CCN(CC2)c2ccccc2)cc1
BDBM40309 Fc1ccccc1CS(=O)(=O)Cc1ccc(o1)C(=O)NCCCN1CCCCCC1
BDBM40315 O=C(Nc1ccc(cc1)-c1nc2ccc(NC(=O)c3cccs3)cc2[nH]1)c1cccs1
BDBM39937 Brc1ccc(o1)-c1nc2ccc(cc2[nH]1)N1C(=O)c2ccccc2C1=O
BDBM40319 CCOC(=O)c1ccc(NC2=CC(=O)C(=O)c3ccccc23)cc1 |t:10|
BDBM40196 Clc1cccc(c1)N1CCN(CC1)C(=O)CCCn1c(=S)[nH]c2ccccc2c1=O
BDBM40324 [O-][N+](=O)c1c[c-](C[NH+]=Nc2nccs2)ccc1=O |w:7.6|
BDBM40256 [O-][N+](=O)c1ccccc1NC(=O)[C-]1c2[nH]c3ccccc3[n+]2CCC1=O
BDBM39195 COC(=O)c1cccc2C(N=O)c3ccccc3-c12
BDBM39242 O=c1n(CN2CCOCC2)nc2-c3ccccc3-c3cccc1c23
BDBM39316 COc1cc(cc(OC)c1OC)N=CC1C(=O)Nc2ccccc12 |w:12.12|
BDBM39597 OP(O)(=O)c1ccccc1OCc1ccccc1
BDBM92422 CN(C)c1ncnc2nc[nH]c12
BDBM25121 CC[C@H]1N(C2CCCC2)c2nc(Nc3ccc(cc3OC)C(=O)NC3CCN(C)CC3)ncc2N(C)C1=O |r|
BDBM50099737 Nc1ccc-2c(c1)C(=O)C(=O)c1ccccc-21
BDBM50106345 CN1CCN(CC1)c1ccc(N)cc1
BDBM50110208 NC(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc2OCOc2c1)-c1ccccn1
BDBM50128285 Cn1cc(C2=C(C(=O)NC2=O)c2cn(C3CCN(Cc4ccccn4)CC3)c3ccccc23)c2ccccc12 |t:4|
BDBM50132260 Fc1ccc(C(=O)NOCC2CC2)c(Nc2ccc(I)cc2Cl)c1F
BDBM50150979 CN(C)CCN1CCc2ccccc12
BDBM50161957 CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
BDBM50184807 C[C@@H](O)COc1cn2ncnc(Oc3ccc4[nH]c(C)cc4c3F)c2c1C
BDBM50193995 C[C@@H]1CCN(C[C@@H]1N(C)c1ncnc2[nH]ccc12)C(=O)CC#N |r|
BDBM50237710 Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)cc(c1)C(F)(F)F
BDBM50242737 Cc1[nH]c(\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)Cc2c(Cl)cccc2Cl)c(C)c1C(=O)N1CCC[C@@H]1CN1CCCC1 |r|
BDBM50246187 CS(=O)(=O)c1cccc(CNc2nc(Nc3ccc4NC(=O)Cc4c3)ncc2C(F)(F)F)c1
BDBM50246188 CS(=O)(=O)c1ccccc1CNc1nc(Nc2ccc3NC(=O)Cc3c2)ncc1C(F)(F)F
BDBM50246189 FC(F)(F)c1cnc(Nc2ccc3NC(=O)Cc3c2)nc1NCc1ccccc1S(=O)(=O)N1CCCC1
BDBM50246190 FC(F)(F)c1cnc(Nc2ccc3NC(=O)Cc3c2)nc1N[C@@H]1CCCCNC1=O |r|
BDBM50246327 CNS(=O)(=O)c1ccc(Nc2ncc(c(N[C@@H]3CCC[C@H]3N(C)C)n2)C(F)(F)F)cc1 |r|
BDBM50246330 CN(C)[C@@H]1CCC[C@H]1Nc1nc(Nc2ccc3C4CCC(N4C(C)=O)c3c2)ncc1C(F)(F)F |r,TLB:26:25:19.18:21,THB:15:16:19.18:21,22:21:19.18:16.25|
BDBM50246236 CN(C)[C@@H]1CCC[C@H]1Nc1nc(Nc2ccc3NC(=O)Cc3c2)ncc1C(F)(F)F |r|
BDBM50246237 FC(F)(F)c1cnc(Nc2ccc3NC(=O)CCc3c2)nc1NCc1ccccn1
BDBM50246238 FC(F)(F)c1cnc(Nc2ccc3NC(=O)CCCc3c2)nc1NC1CCC1
BDBM50246239 CN(c1ccccc1CNc1nc(Nc2ccc3C(=O)NCc3c2)ncc1C(F)(F)F)S(C)(=O)=O
BDBM50246283 CN(C)[C@@H]1CCC[C@H]1Nc1nc(Nc2ccc3c(CCCNC3=O)c2)ncc1C(F)(F)F |r|
BDBM50246284 CN(C)[C@@H]1CCC[C@H]1Nc1nc(Nc2ccc3c(CN(C)S3(=O)=O)c2)ncc1C(F)(F)F |r|
BDBM50246285 CN(C)[C@@H]1CCC[C@H]1Nc1nc(Nc2ccc(cc2)S(C)(=O)=O)ncc1C(F)(F)F |r|
BDBM50246286 CN(c1ccccc1CNc1nc(Nc2ccc(cc2)S(C)(=O)=O)ncc1C(F)(F)F)S(C)(=O)=O
BDBM50246378 CN(c1ccccc1CNc1nc(Nc2ccc3NS(=O)(=O)Cc3c2)ncc1C(F)(F)F)S(C)(=O)=O
BDBM50246379 CN(C)[C@@H]1CCC[C@H]1Nc1nc(Nc2ccc3NS(=O)(=O)Cc3c2)ncc1C(F)(F)F |r|
BDBM50246137 Brc1cnc(Nc2ccc3NC(=O)Cc3c2)nc1NCc1ccccn1
BDBM50246138 O=C1Cc2cc(Nc3ncc(C#N)c(NCc4ccccn4)n3)ccc2N1
BDBM50246139 FC(F)(F)c1cnc(Nc2ccc3NC(=O)Cc3c2)nc1NCc1ccccn1
BDBM50246140 CN(c1cccc(CNc2nc(Nc3ccc4NC(=O)Cc4c3)ncc2C(F)(F)F)c1)S(C)(=O)=O
BDBM50246058 FC(F)(F)c1cnc(Nc2ccc3NC(=O)Cc3c2)nc1NCc1ccccc1
BDBM50246059 CN(C)[C@@H]1CCC[C@H]1Nc1nc(Nc2ccc3c(CCS3(=O)=O)c2)ncc1C(F)(F)F |r|
BDBM50246060 CN(c1ccccc1CNc1nc(Nc2ccc3NC(=O)Cc3c2)ncc1C(F)(F)F)S(C)(=O)=O
BDBM50246095 Cn1ccc2cc(Nc3ncc(c(NCc4ccccn4)n3)C(F)(F)F)ccc12
BDBM50246096 FC(F)(F)c1cnc(Nc2ccc3[nH]ncc3c2)nc1NCc1ccccn1
BDBM50246097 O=C1Cc2cc(Nc3nccc(NCc4ccccn4)n3)ccc2N1
BDBM50246098 Cc1cnc(Nc2ccc3NC(=O)Cc3c2)nc1NCc1ccccn1
BDBM50246099 Clc1cnc(Nc2ccc3NC(=O)Cc3c2)nc1NCc1ccccn1
BDBM50269948 CS(=O)(=O)c1cccc(CNc2nc(Nc3ccc4NC(=O)CCc4c3)ncc2C(F)(F)F)c1
BDBM50273571 CCS(=O)(=O)Nc1ccc2NC(=O)C(C(=Nc3ccc(CN4CCCCC4)cc3)c3ccccc3)c2c1 |w:15.15|
BDBM50306682 C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl |r|
BDBM50308060 C[C@]12O[C@H](C[C@]1(O)CO)n1c3ccccc3c3c4C(=O)NCc4c4c5ccccc5n2c4c13 |r|
BDBM50300690 CC(C)(C)c1cc(NC(=O)Nc2ccc(cc2)-c2cn3c(n2)sc2cc(OCCN4CCOCC4)ccc32)no1
BDBM50301356 CNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1
BDBM50301357 COc1cc2nccc(Oc3ccc(NC(=O)c4c(ccn(-c5ccccc5)c4=O)N(C)C)nc3)c2cc1OC
BDBM50301358 COCCNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1
BDBM50301361 COc1cc2nccc(Oc3ccc(NC(=O)c4c(Nc5ccccc5)ccn(-c5ccccc5)c4=O)nc3)c2cc1OC
BDBM50301362 COCCNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)ccc23)cn1
BDBM50301363 CNc1ccn(Cc2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1
BDBM50301364 COc1cc2nccc(Oc3ccc(NC(=O)c4cc(cn(-c5ccccc5)c4=O)-c4cccs4)nc3)c2cc1OC
BDBM50301365 COc1cc2nccc(Oc3ccc(NC(=O)c4cc(cn(-c5ccccc5)c4=O)-c4cccnc4)nc3)c2cc1OC
BDBM50301366 COc1cc2nccc(Oc3ccc(NC(=O)c4cc(Cc5ccccc5)cn(-c5ccccc5)c4=O)nc3)c2cc1OC
BDBM50301367 COc1ccc2c(Oc3ccc(NC(=O)c4cc(cn(-c5ccccc5)c4=O)-c4cccnc4)nc3)ccnc2c1
BDBM50301368 COc1ccc2c(Oc3ccc(NC(=O)c4cc(cn(-c5ccccc5)c4=O)-c4cnccn4)nc3)ccnc2c1
BDBM50301359 COc1cc2nccc(Oc3ccc(NC(=O)c4c(NC5CCOCC5)ccn(-c5ccccc5)c4=O)nc3)c2cc1OC
BDBM50301360 COc1cc2nccc(Oc3ccc(NC(=O)c4c(ccn(-c5ccccc5)c4=O)N4CCN(C)CC4)nc3)c2cc1OC
BDBM50309910 COc1c(Cl)cc2c3ccncc3[nH]c2c1NC(=O)c1cccnc1C
BDBM50318872 Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1cc(COc2cccnc2)n[nH]1)C(C)(C)C
BDBM50318884 CN(c1ncccc1CNc1nc(Nc2ccc3NC(=O)Cc3c2)ncc1C(F)(F)F)S(C)(=O)=O
BDBM50322823 CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1O[C@H]1CCOC1 |r|
BDBM50326053 CO[C@@H]1[C@@H](C[C@H]2O[C@]1(C)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)c1ccccc1 |r|
BDBM50326054 CO[C@@H]1[C@@H](C[C@H]2O[C@]1(C)n1c3ccccc3c3c4[C@H](O)NC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)c1ccccc1 |r|
BDBM50331096 COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCCCN1CCCC1
BDBM50341636 CN(c1cccc(Cl)c1)S(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c(C)c(C(=O)N4CCN(C)CC4)c3C)c2c1
BDBM50332294 Cc1cnc(Nc2ccc(OCCN3CCCC3)cc2)nc1Nc1cccc(c1)S(=O)(=O)NC(C)(C)C
BDBM50343726 C[C@H](Nc1nc(Nc2cc(C)n[nH]2)c(F)cc1C#N)c1ccc(F)cn1 |r|
BDBM50345900 CN(C)[C@@H]1CCC[C@H]1Nc1nc(Nc2ccc(cc2)S(=O)(=O)NC2CC2)ncc1C(F)(F)F |r|
BDBM50359359 CN(C)CCN1CCN(CCC1=O)C(=O)c1cc(sc1NC(=O)Nc1cccc(Cl)c1Cl)C(C)(C)C
BDBM50355494 COc1cc(Oc2ccnc3cc(OC)c(OC)cc23)ccc1NC(=O)NC(C)c1nccs1
BDBM50355495 CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nc(cs3)-c3cccnc3)c2)CC1
BDBM50355496 O=C(N1CCNCC1)c1ccc(\C=C\c2n[nH]c3ccccc23)cc1
BDBM50355497 Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(cc12)C(=O)NOCCO
BDBM50355499 CN(C)CC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:31|
BDBM50355500 C[C@@H](Oc1cc(sc1C(N)=O)-n1cnc2ccc(CN3CCN(C)CC3)cc12)c1ccccc1C(F)(F)F |r|
BDBM50355501 N#CC[C@H](C1CCCC1)n1cc(cn1)-c1ncnc2[nH]ccc12 |r|
BDBM50355504 COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)NC4=CCC(F)C=C4)cc3F)ccnc2cc1OCCCN1CCOCC1 |c:26,t:21|
BDBM50383081 Oc1ccc(\C=C2/C3Nc4ccccc4C3=C(C2=O)C2=C3C(=Nc4ccccc34)\C(=C/c3ccc(O)cc3)C2=O)cc1 |c:17,24,t:22|
BDBM31093 OC(=O)c1ccc(Nc2ncc3CN=C(c4cc(Cl)ccc4-c3n2)c2c(F)cccc2F)cc1 |c:13|
BDBM50401152 CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccn2nc(N)nc2c1
BDBM286368 CCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2CC(CCO)N(C)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286370 COc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2CC(CCO)N(C)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286385 COCc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2CC(CCO)N(C)C[C@@H]2C)C3(C)C)n1 |r|
BDBM50402990 CC(C)NC(=O)c1cc2cccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c2[nH]1
BDBM50402991 Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1cccc2cc([nH]c12)C(=O)N1CCC2(CCNC2)C1)C(C)(C)C
BDBM50402992 COc1ccc(-c2cc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)[nH]n2)c(C)c1
BDBM50402993 COc1ccc(nc1)-c1cc(NC(=O)Nc2cc(nn2-c2ccc(C)cc2)C(C)(C)C)[nH]n1
BDBM50402994 CNC(=O)c1cc2cccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c2[nH]1
BDBM50402995 Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1cc(n[nH]1)-c1ccc(=O)[nH]n1)C(C)(C)C
BDBM50402996 Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1cc(n[nH]1)-c1ccc2ncccc2c1)C(C)(C)C
BDBM50402997 CN(CCc1ccccn1)C(=O)c1cc2cccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c2[nH]1
BDBM50402998 COc1ccc(cn1)-c1cc(NC(=O)Nc2cc(nn2-c2ccc(C)cc2)C(C)(C)C)[nH]n1
BDBM50402999 Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1cc(n[nH]1)-c1ccc2nccnc2c1)C(C)(C)C
BDBM50403000 Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1cc(n[nH]1)-c1ccc(=O)n(C)c1)C(C)(C)C
BDBM50403001 Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1cc(n[nH]1)-c1ccc2OCCOc2c1)C(C)(C)C
BDBM50403002 CCOCCCNC(=O)c1cc2cccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c2[nH]1
BDBM50403003 Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1cccc2cc([nH]c12)C(=O)N1CCCC1)C(C)(C)C
BDBM50403004 Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1cc(n[nH]1)-c1ccc2nccn2c1)C(C)(C)C
BDBM50403005 COc1ccc(cc1)-c1cc(NC(=O)Nc2cc(nn2-c2ccc(C)cc2)C(C)(C)C)[nH]n1
BDBM50403006 Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1cccc2cc([nH]c12)C(=O)Nc1cccc(Cl)c1)C(C)(C)C
BDBM50403007 Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1cc(n[nH]1)-c1ccc(=O)[nH]c1)C(C)(C)C
BDBM50403008 COc1cnc(cn1)-c1cc(NC(=O)Nc2cc(nn2-c2ccc(C)cc2)C(C)(C)C)[nH]n1
BDBM50403009 Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1cc(CO)n[nH]1)C(C)(C)C
BDBM50418578 CNS(=C)(=O)c1ccc(Nc2ncc(c(N[C@@H]3CCC[C@H]3N(C)C)n2)C(F)(F)F)cc1 |r|
BDBM50418579 CCNS(=C)(=O)c1ccc(Nc2ncc(c(N[C@@H]3CCC[C@H]3N(C)C)n2)C(F)(F)F)cc1 |r|
BDBM50418580 CC(C)NS(=C)(=O)c1ccc(Nc2ncc(c(N[C@@H]3CCC[C@H]3N(C)C)n2)C(F)(F)F)cc1 |r|
BDBM50418581 CN(C)[C@@H]1CCC[C@H]1Nc1nc(Nc2ccc(cc2)S(N)(=C)=O)ncc1C(F)(F)F |r|
BDBM50418584 CNS(=O)(=CC)c1ccc(Nc2ncc(c(N[C@@H]3CCC[C@H]3N(C)C)n2)C(F)(F)F)cc1 |r|
BDBM50429867 Cc1c(F)c(ccc1C(=O)N1CCOc2ccc(cc2C1)-c1ccc(N)nc1)S(C)(=O)=O
BDBM50430287 CN1c2ccc(NCc3ccc(cc3)C(C)(C)C)cc2-c2c(cnn2C)S1(=O)=O
BDBM50430288 CCc1ccc(cc1)-c1ccc2N(C)S(=O)(=O)c3cnn(C)c3-c2c1
BDBM50430289 CCc1ccc(cc1)-c1ccc2N(C)S(=O)(=O)c3c[nH]nc3-c2c1
BDBM50430297 CCc1ccc(cc1)-c1ccc2N(C)S(=O)(=O)c3cnn(CC)c3-c2c1
BDBM50448785 C[C@@H](Oc1cc(cnc1N)-c1sc(nc1C)[C@](C)(O)CO)c1cc(F)ccc1-n1nccn1 |r|
BDBM50440370 Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(cc1)-n1cnc2c(N)ncnc12)C(C)(C)C
BDBM50018830 C[C@H]1Oc2cc(cnc2N)-c2c(CN(C)C(=O)c3ccc(F)cc13)nn(C)c2C#N |r|
BDBM50020310 CN1CCN(CCC(=O)Nc2c(C)[nH]c(\C=C3/C(=O)Nc4ccc(F)cc34)c2C)CC1
BDBM60665 COc1cc(Nc2ncc(F)c(Nc3ccc4OC(C)(C)C(=O)Nc4n3)n2)cc(OC)c1OC
BDBM50026612 COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)N(C)C(=O)CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
BDBM60589 Cn1cc(cn1)-c1ccc2nnc(Sc3ccc4ncccc4c3)n2n1
BDBM50031747 COc1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)nn12
BDBM50135286 Cn1c2nc(Nc3ccc4[nH]ccc4c3)ncc2cc(c1=O)S(=O)(=O)c1ccc(F)cc1F
BDBM245585 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCOCC1
BDBM245630 COc1cc(NCCN2CCOCC2)ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1
BDBM245631 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCC(O)CC1
BDBM245632 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCS(=O)(=O)CC1
BDBM245633 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)-n1ncnn1
BDBM245634 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCC(C1)N(C)C
BDBM245635 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)-n1cc(C)nc1C
BDBM245636 CC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2nc(C)cs2)nc2NCCc12
BDBM245637 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCC(CC1)N1CCCCC1
BDBM245638 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCC(CC1)N1CCCC1
BDBM245639 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)-n1cccn1
BDBM245640 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCC(CC1)N1CCOCC1
BDBM245641 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCC(CC1)N1CCN(C)CC1
BDBM245547 CNC(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCCc12
BDBM245548 CNC(=O)c1ccc2OCOc2c1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCCc12
BDBM245549 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2C(=O)N2CCCC2)n1)N1CCOCC1
BDBM245642 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCC(CC1)N1CCNCC1
BDBM245643 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCCCC1=O
BDBM245644 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1C(=O)CCc2ccccc12
BDBM245645 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)C(C)C)n1)N1CCOCC1
BDBM245646 COc1cc(ccc1Nc1nc2NCC(C)c2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCOCC1
BDBM245647 CNC(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NC[C@H](C)c12 |r|
BDBM245550 CNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCCc12
BDBM245551 CCCNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCCc12
BDBM245552 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC2CCC2)n1)N1CCOCC1
BDBM245553 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC2CCCC2)n1)N1CCOCC1
BDBM245554 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC2CCCCC2)n1)N1CCOCC1
BDBM245555 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2NC(C)=O)n1)N1CCOCC1
BDBM245556 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2N(C)S(C)(=O)=O)n1)N1CCOCC1
BDBM245557 COc1cc(ccc1Nc1nc2NCCc2c(NCc2ccccc2N(C)S(C)(=O)=O)n1)N1CCOCC1
BDBM245558 COc1cc(ccc1Nc1nc2NCCc2c(Nc2cccc(C)n2)n1)N1CCOCC1
BDBM245559 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccc(F)c(F)c2)n1)N1CCOCC1
BDBM245560 CNC(=O)c1ccccc1Nc1nc(Nc2ccc(cc2CO)N2CCOCC2)nc2NCCc12
BDBM245561 CNC(=O)c1ccccc1Nc1nc(Nc2cccc3OCCOc23)nc2NCCc12
BDBM245562 CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCOCC3)c3OCCOc23)nc2NCCc12
BDBM245649 COc1cc(ccc1Nc1nc2NCC(C)(C)c2c(Nc2ccccc2S(=O)(=O)NC2CCC2)n1)N1CCOCC1
BDBM245648 CNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCC(C)(C)c12
BDBM245650 COc1cc(ccc1Nc1nc2NCC(C)(C)c2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCOCC1
BDBM245651 CCCNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCC(C)(C)c12
BDBM245563 CCN1c2ccc(Nc3nc4NCCc4c(Nc4ccccc4C(=O)NC)n3)c(OC)c2CCCC1=O
BDBM245564 CNC(=O)c1ccccc1Nc1nc(Nc2cccc3ccoc23)nc2NCCc12
BDBM245565 CNC(=O)c1ccccc1Nc1nc(Nc2cc(C)nn2C)nc2NCCc12
BDBM245566 CNC(=O)c1ccccc1Nc1nc(Nc2cc(OC)c(OC)c(OC)c2)nc2NCCc12
BDBM245567 CNC(=O)c1ccccc1Nc1nc(Nc2cccc3n(CCCN4CCOCC4)ccc23)nc2NCCc12
BDBM245568 CNC(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCC(C)c12
BDBM245569 COc1cc(ccc1Nc1nc2NCC(C)c2c(Nc2ccccc2C(=O)N2CCCC2)n1)N1CCOCC1
BDBM245652 COc1cc(ccc1Nc1nc2NCC(C)(C)c2c(Nc2ccccc2S(=O)(=O)NCC(C)C)n1)N1CCOCC1
BDBM245653 COc1cc(ccc1Nc1nc2NCC(C)(C)c2c(Nc2ccccc2S(=O)(=O)NC2CCCC2)n1)N1CCOCC1
BDBM245654 COc1cc(ccc1Nc1nc2NCC(C)(C)c2c(Nc2ccccc2S(=O)(=O)NC2CCCCC2)n1)N1CCOCC1
BDBM245655 CCCCNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCC(C)(C)c12
BDBM245656 COc1cc(ccc1Nc1nc2NCC(C)(C)c2c(Nc2ccccc2S(=O)(=O)N(C)C)n1)N1CCOCC1
BDBM245657 CCC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCC(C)(C)c12
BDBM245570 CNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCC(C)c12
BDBM245571 CCCNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCC(C)c12
BDBM245572 COc1cc(ccc1Nc1nc2NCC(C)c2c(Nc2ccccc2S(=O)(=O)NC2CCC2)n1)N1CCOCC1
BDBM245573 COc1cc(ccc1Nc1nc2NCC(C)c2c(Nc2ccccc2S(=O)(=O)NC2CCCC2)n1)N1CCOCC1
BDBM245574 COc1cc(ccc1Nc1nc2NCC(C)c2c(Nc2ccccc2S(=O)(=O)NC2CCCCC2)n1)N1CCOCC1
BDBM245575 COc1cc(ccc1Nc1nc2NCC(C)c2c(Nc2ccccc2NC(C)=O)n1)N1CCOCC1
BDBM245658 CCNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCC(C)(C)c12
BDBM245659 COCCCNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCC(C)(C)c12
BDBM245660 COCCNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCC(C)(C)c12
BDBM245661 COc1cc(ccc1Nc1nc2NCC(C)(C)c2c(Nc2ccccc2S(=O)(=O)Nc2ccccc2)n1)N1CCOCC1
BDBM245662 COc1cc(ccc1Nc1nc2NCC(C)(C)c2c(Nc2ccccc2S(=O)(=O)NC(C)(C)C)n1)N1CCOCC1
BDBM245663 COc1cc(ccc1Nc1nc2NCC(C)(C)c2c(Nc2ccccc2S(=O)(=O)NCC2CC2)n1)N1CCOCC1
BDBM245576 COc1cc(ccc1Nc1nc2NCC(C)c2c(Nc2ccccc2N(C)S(C)(=O)=O)n1)N1CCOCC1
BDBM245577 COc1cc(ccc1Nc1nc2NCC(C)c2c(NCc2ccccc2N(C)S(C)(=O)=O)n1)N1CCOCC1
BDBM245578 COc1cc(ccc1Nc1nc2NCC(C)c2c(Nc2cccc(C)n2)n1)N1CCOCC1
BDBM245579 COc1cc(ccc1Nc1nc2NCC(C)c2c(Nc2ccc(F)c(F)c2)n1)N1CCOCC1
BDBM245580 CNC(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NC[C@@H](C)c12 |r|
BDBM245581 COc1cc(ccc1Nc1nc2NC[C@@H](C)c2c(Nc2ccccc2S(=O)(=O)NC2CCC2)n1)N1CCOCC1 |r|
BDBM245664 COc1cc(ccc1Nc1nc2NCC(C)(C)c2c(Nc2ccccc2S(=O)(=O)NCCO)n1)N1CCOCC1
BDBM245665 COc1cc(ccc1Nc1nc2NCC(C)(C)c2c(Nc2ccccc2S(=O)(=O)NCCN(C)C)n1)N1CCOCC1
BDBM245666 COc1cc(ccc1Nc1nc2NCC(C)(C)c2c(Nc2ccccc2C(=O)N2CCCC2)n1)N1CCOCC1
BDBM245667 COc1cc(ccc1Nc1nc2NCC(C)(C)c2c(Nc2ccccc2N(C)S(C)(=O)=O)n1)N1CCOCC1
BDBM245668 COc1cc(ccc1Nc1nc2NCC(C)(C)c2c(Nc2cccc(C)n2)n1)N1CCOCC1
BDBM245669 COc1cc(ccc1Nc1nc2NCC(C)(C)c2c(Nc2ccccc2NC(C)=O)n1)N1CCOCC1
BDBM245582 CNC(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCC(C)(C)c12
BDBM245583 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)N(C)C)n1)N1CCOCC1
BDBM245584 CCCCNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCCc12
BDBM245586 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(N)(=O)=O)n1)N1CCOCC1
BDBM245587 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC2CC2)n1)N1CCOCC1
BDBM245670 COc1cc(ccc1Nc1nc2NCC(C)(C)c2c(Nc2ccc(F)c(F)c2)n1)N1CCOCC1
BDBM245671 CNC(=O)c1ccc2OCOc2c1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCC(C)(C)c12
BDBM245672 COc1cc(ccc1Nc1nc2NCC(C)(C)c2c(NC2CCCCC2N(C)S(C)(=O)=O)n1)N1CCOCC1
BDBM245673 CNC(=O)c1ccccc1Nc1nc(Nc2cccc3OCCOc23)nc2NCC(C)(C)c12
BDBM245674 CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCOCC3)c3OCCOc23)nc2NCC(C)(C)c12
BDBM245675 CNC(=O)c1ccccc1Nc1nc(Nc2cc(OC)c(OC)c(OC)c2)nc2NCC(C)(C)c12
BDBM245588 CCNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCCc12
BDBM245589 CCC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCCc12
BDBM245590 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NCC(C)C)n1)N1CCOCC1
BDBM245592 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)(C)C)n1)N1CCOCC1
BDBM245593 COCCCNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCCc12
BDBM245676 CNC(=O)c1ccccc1Nc1nc(Nc2cccc3ccoc23)nc2NCC(C)(C)c12
BDBM245677 CNC(=O)c1ccccc1Nc1nc(Nc2cc(C)nn2C)nc2NCC(C)(C)c12
BDBM245678 CCN1c2ccc(Nc3nc4NCC(C)(C)c4c(Nc4ccccc4C(=O)NC)n3)c(OC)c2CCCC1=O
BDBM245679 CNC(=O)c1ccccc1Nc1nc(Nc2ccc3n(CCCN4CCOCC4)ccc3c2)nc2NCC(C)(C)c12
BDBM245680 CNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCC3(CC3)c12
BDBM245681 COc1cc(ccc1Nc1nc2NCC3(CC3)c2c(Nc2ccccc2S(=O)(=O)NC(C)(C)C)n1)N1CCOCC1
BDBM245594 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NCCN(C)C)n1)N1CCOCC1
BDBM245595 COCCNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCCc12
BDBM245596 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)Nc2ccccc2)n1)N1CCOCC1
BDBM245597 CC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2)N2CCOCC2)nc2NCCc12
BDBM245598 CNC(=O)c1ccc(Nc2nc3NCCc3c(Nc3ccccc3S(=O)(=O)NC(C)C)n2)cc1
BDBM245599 CC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(CO)cc2)nc2NCCc12
BDBM245682 COc1cc(ccc1Nc1nc2NCC3(CC3)c2c(Nc2ccccc2S(=O)(=O)NCC(C)C)n1)N1CCOCC1
BDBM245683 COc1cc(ccc1Nc1nc2NCC3(CC3)c2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCOCC1
BDBM245684 CCNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCC3(CC3)c12
BDBM245685 COc1cc(ccc1Nc1nc2NCC3(CC3)c2c(Nc2ccccc2S(=O)(=O)NCC2CC2)n1)N1CCOCC1
BDBM245686 COCCNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCC3(CC3)c12
BDBM245687 COc1cc(ccc1Nc1nc2NCC3(CC3)c2c(Nc2ccccc2S(=O)(=O)NCCO)n1)N1CCOCC1
BDBM245600 CC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2F)N2CCOCC2)nc2NCCc12
BDBM245601 COc1nc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCOCC1
BDBM245602 CC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(nc2)N2CCOCC2)nc2NCCc12
BDBM245603 CC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cn2)N2CCOCC2)nc2NCCc12
BDBM245604 CCOc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCOCC1
BDBM245605 CC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2C(F)(F)F)N2CCOCC2)nc2NCCc12
BDBM245688 COc1cc(ccc1Nc1nc2NCC3(CC3)c2c(Nc2ccccc2S(=O)(=O)Nc2ccccc2)n1)N1CCOCC1
BDBM245689 COc1cc(ccc1Nc1nc2NCC3(CC3)c2c(Nc2ccccc2S(=O)(=O)NCC=C)n1)N1CCOCC1
BDBM245690 COc1cc(ccc1Nc1nc2NCC3(CC3)c2c(Nc2ccccc2S(=O)(=O)NC2CCCC2)n1)N1CCOCC1
BDBM245691 COc1cc(ccc1Nc1nc2NCC3(CC3)c2c(Nc2ccccc2S(=O)(=O)NC2CC2)n1)N1CCOCC1
BDBM245692 CCC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCC3(CC3)c12
BDBM245693 CCCNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCC3(CC3)c12
BDBM245606 CC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2)C(F)(F)F)nc2NCCc12
BDBM245607 CC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2)C(=O)N(C)C)nc2NCCc12
BDBM245608 CC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(NC(C)=O)cc2)nc2NCCc12
BDBM245609 CNS(=O)(=O)c1ccc(Nc2nc3NCCc3c(Nc3ccccc3S(=O)(=O)NC(C)C)n2)cc1
BDBM245610 CC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2)C(=O)N2CCOCC2)nc2NCCc12
BDBM245611 CC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2C)N2CCOCC2)nc2NCCc12
BDBM245694 COc1cc(ccc1Nc1nc2NCC3(CC3)c2c(Nc2ccccc2S(=O)(=O)NC2CCCCC2)n1)N1CCOCC1
BDBM245695 COc1cc(ccc1Nc1nc2NCC3(CC3)c2c(Nc2ccccc2S(=O)(=O)NC2CCC2)n1)N1CCOCC1
BDBM245696 COc1cc(ccc1Nc1nc2NCC3(CC3)c2c(Nc2ccccc2S(=O)(=O)N(C)C)n1)N1CCOCC1
BDBM245697 CNC(=O)c1ccccc1Nc1nc(Nc2ccc(cc2OC)N2CCOCC2)nc2NCC3(CC3)c12
BDBM245698 COc1cc(ccc1Nc1nc2NCC3(CC3)c2c(Nc2ccc(F)c(F)c2)n1)N1CCOCC1
BDBM245699 COc1cc(ccc1Nc1nc2NCC3(CC3)c2c(Nc2cccc(C)n2)n1)N1CCOCC1
BDBM245612 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCCC1
BDBM245613 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCCCC1
BDBM245614 CC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2)C(C)O)nc2NCCc12
BDBM245615 COc1cc(OCCN2CCOCC2)ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1
BDBM245616 CC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(OC(F)(F)F)cc2)nc2NCCc12
BDBM245617 CC(C)NC(C)c1ccc(Nc2nc3NCCc3c(Nc3ccccc3S(=O)(=O)NC(C)C)n2)cc1
BDBM245700 COc1cc(ccc1Nc1nc2NCC3(CC3)c2c(Nc2ccccc2NC(C)=O)n1)N1CCOCC1
BDBM245701 COc1cc(ccc1Nc1nc2NCC3(CC3)c2c(Nc2ccccc2N(C)S(C)(=O)=O)n1)N1CCOCC1
BDBM245702 CNS(=O)(=O)c1ccccc1Nc1nc(Nc2cc(OC)c(OC)c(OC)c2)nc2NCC3(CC3)c12
BDBM245703 CNC(=O)c1ccccc1Nc1nc(Nc2ccc(cc2)N2CCOCC2)nc2NCCc12
BDBM245704 CNC(=O)c1ccccc1Nc1nc(Nc2ccccc2OC)nc2NCCc12
BDBM245705 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2C(O)=O)n1)N1CCOCC1
BDBM245706 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2C=O)n1)N1CCOCC1
BDBM245618 CC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2cccc(NS(C)(=O)=O)c2)nc2NCCc12
BDBM245619 CNC(=O)c1cccc(Nc2nc3NCCc3c(Nc3ccccc3S(=O)(=O)NC(C)C)n2)c1
BDBM245620 CC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2cccc(NC(C)=O)c2)nc2NCCc12
BDBM245621 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCC(CC1)N(C)C
BDBM245622 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)-n1ccnc1
BDBM245623 CC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2)C(=O)N2CCCC2)nc2NCCc12
BDBM245707 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2CCO)n1)N1CCOCC1
BDBM245708 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2P(C)(C)=O)n1)N1CCC(CC1)N1CCNCC1
BDBM245624 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCC(CO)CC1
BDBM245625 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCC(O)C1
BDBM245626 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1CCCC(O)C1
BDBM245627 CC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(cc2)C(C)N2CCCCC2)nc2NCCc12
BDBM245628 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)-n1ccccc1=O
BDBM245629 COc1cc(ccc1Nc1nc2NCCc2c(Nc2ccccc2S(=O)(=O)NC(C)C)n1)N1C(C)COCC1C
BDBM31096 CN[C@H]1C[C@@H]2O[C@](C)([C@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
BDBM50207358 CS(=O)(=O)N1CCCC(=O)N2CCc3cc(Nc4ncc(c(NCc5cccnc15)n4)C(F)(F)F)ccc23
BDBM50207348 FC(F)(F)c1cnc2Nc3ccc4N(CCc4c3)C(=O)CCCNS(=O)(=O)c3ncccc3CNc1n2
BDBM50207349 CS(=O)(=O)N1C\C=C\c2cc(Nc3ncc(c(NCc4cccnc14)n3)C(F)(F)F)ccc2N1CCOCC1 |t:6|
BDBM50207350 CS(=O)(=O)N1CCCCC(=O)N2CCc3cc(Nc4ncc(c(NCc5ccccc15)n4)C(F)(F)F)ccc23
BDBM50207351 CS(=O)(=O)N(CC=C)c1ncccc1CNc1nc(Nc2ccc(N3CCOCC3)c(Br)c2)ncc1C(F)(F)F
BDBM50207352 CCS(=O)(=O)N1CCCCC(=O)N2CCc3cc(Nc4ncc(c(NCc5ccccc15)n4)C(F)(F)F)ccc23
BDBM50207353 CS(=O)(=O)N1CCCc2cccc(Nc3ncc(c(NCc4cccnc14)n3)C(F)(F)F)c2
BDBM50207354 CS(=O)(=O)N1C\C=C\c2cccc(Nc3ncc(c(NCc4cccnc14)n3)C(F)(F)F)c2 |t:6|
BDBM50207355 CS(=O)(=O)N1CCCc2cc(Nc3ncc(c(NCc4cccnc14)n3)C(F)(F)F)ccc2N1CCOCC1
BDBM50207356 CN1Cc2cccnc2N(C\C=C\c2cc(Nc3ncc(c1n3)C(F)(F)F)ccc2N1CCOCC1)S(C)(=O)=O |t:12|
BDBM50207357 CS(=O)(=O)N1Cc2cccc(c2)C(=O)N2CCc3cc(Nc4ncc(c(NCc5cccnc15)n4)C(F)(F)F)ccc23
BDBM50207359 CS(=O)(=O)N(CC=C)c1ncccc1CNc1nc(Nc2cccc(Br)c2)ncc1C(F)(F)F
BDBM50207360 CN(Cc1ccccc1N(CCCCC(O)=O)S(C)(=O)=O)c1nc(Nc2ccc3NCCc3c2)ncc1C(F)(F)F
BDBM50207361 CS(=O)(=O)N1CCCCC(=O)N2CCc3cc(Nc4ncc(c(NCc5cccnc15)n4)C(F)(F)F)ccc23
BDBM50207362 CN1Cc2ccncc2N(C\C=C\c2cc(Nc3ncc(c1n3)C(F)(F)F)ccc2N1CCOCC1)S(C)(=O)=O |t:12|
BDBM50207363 CN(Cc1ccncc1N(CC=C)S(C)(=O)=O)c1nc(Nc2ccc(N3CCOCC3)c(Br)c2)ncc1C(F)(F)F
BDBM50207364 CCS(=O)(=O)N(CCCCC(O)=O)c1ccccc1CNc1nc(Nc2ccc3NCCc3c2)ncc1C(F)(F)F
BDBM50207365 CN1Cc2ccccc2N(CCCCC(=O)N2CCc3cc(Nc4ncc(c1n4)C(F)(F)F)ccc23)S(C)(=O)=O
BDBM286272 CCc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(CCC(F)(F)F)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286273 C.CCc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2CC(CCO)NC[C@@H]2C)C3(C)C)n1 |r|
BDBM286274 CN1CCC(F)(CC1)C(=O)N1Cc2c(Nc3nc(C)ncc3F)n[nH]c2C1(C)C
BDBM286275 CCc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)C2(F)CCN(C)CC2)C3(C)C)n1
BDBM286277 C[C@H]1CN2CCC[C@H]2CN1C(=O)N1Cc2c(Nc3nc(C)ncc3F)n[nH]c2C1(C)C |r|
BDBM286278 C.C[C@@H]1CN([C@@H](C)CN1)C(=O)N1Cc2c(Nc3nc(C)ncc3F)n[nH]c2C1(C)C |r|
BDBM286279 C[C@H]1CN(C)C(C)(C)CN1C(=O)N1Cc2c(Nc3nc(C)ncc3F)n[nH]c2C1(C)C |r|
BDBM286280 CC[C@H]1CN(CCN1C)C(=O)N1Cc2c(Nc3nc(C)ncc3F)n[nH]c2C1(C)C |r|
BDBM286288 CC[C@@H]1CN(CCN1C)C(=O)N1Cc2c(Nc3nc(C)ncc3F)n[nH]c2C1(C)C |r|
BDBM286292 C[C@@H]1CN([C@@H](C)CN1CC1CCOCC1)C(=O)N1Cc2c(Nc3nc(C)ncc3F)n[nH]c2C1(C)C |r|
BDBM286299 C[C@@H]1CN([C@@H](C)CN1C1CCOCC1)C(=O)N1Cc2c(Nc3nc(C)ncc3F)n[nH]c2C1(C)C |r|
BDBM286301 C[C@@H]1CN([C@@H](C)CN1CC1(O)CCOCC1)C(=O)N1Cc2c(Nc3nc(C)ncc3F)n[nH]c2C1(C)C |r|
BDBM286310 C.CCCc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2CC(C)(C)NC[C@@H]2C)C3(C)C)n1 |r|
BDBM286311 CC(C)c1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2CC(C)(C)N(C)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286312 CN1CCC(F)(CC1)C(=O)N1Cc2c(Nc3nc(C)ccc3F)n[nH]c2C1(C)C
BDBM286313 CN1CCC(F)(CC1)C(=O)N1Cc2c(Nc3cccc(C)n3)n[nH]c2C1(C)C
BDBM286316 CC1C[C@H](C)N(C[C@H]1C)C(=O)N1Cc2c(Nc3nc(C)ccc3F)n[nH]c2C1(C)C |r|
BDBM286317 C[C@H]1CN2CCC[C@@]2(C)CN1C(=O)N1Cc2c(Nc3nc(C)ccc3F)n[nH]c2C1(C)C |r|
BDBM286318 C[C@H]1CN2CCC[C@H]2CN1C(=O)N1Cc2c(Nc3nc(C)ccc3F)n[nH]c2C1(C)C |r|
BDBM286320 C[C@H]1CC(C)C(C)(C)CN1C(=O)N1Cc2c(Nc3nc(C)ccc3F)n[nH]c2C1(C)C |r|
BDBM286323 C[C@H]1CN2CCC[C@@]2(C)CN1C(=O)N1Cc2c(Nc3cccc(C)n3)n[nH]c2C1(C)C |r|
BDBM286324 C[C@@H]1CN([C@@H](C)CN1C)C(=O)N1Cc2c(Nc3cccc(C)n3)n[nH]c2C1(C)C |r|
BDBM286327 COCc1ncc(F)c(Nc2c[nH]c3c2CN(C(=O)C2CC(C)(C)N(C)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286330 CCc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(CC4CCOCC4)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286331 COc1ccnc(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(C[C@@H]2C)C2CCOCC2)C3(C)C)n1 |r|
BDBM286332 C[C@@H]1CN([C@@H](C)CN1C1CCOCC1)C(=O)N1Cc2c(Nc3nccc(C)n3)n[nH]c2C1(C)C |r|
BDBM286335 C[C@@H]1CN([C@@H](C)CN1C1CCOCC1)C(=O)N1Cc2c(Nc3nccc(n3)C(F)(F)F)n[nH]c2C1(C)C |r|
BDBM286337 COc1ccnc(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(CC4CCOCC4)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286340 C[C@@H]1CN([C@@H](C)CN1CC1CCOCC1)C(=O)N1Cc2c(Nc3nccc(C)n3)n[nH]c2C1(C)C |r|
BDBM286342 C[C@@H]1CN([C@@H](C)CN1CC1CCOCC1)C(=O)N1Cc2c(Nc3nc(C)cc(C)n3)n[nH]c2C1(C)C |r|
BDBM286343 CCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(C)CC2C)C3(C)C)n1 |r|
BDBM286344 CCOc1ccc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(CC)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286345 CCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2CC(C)(C)N(C)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286346 CCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(CCOC)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286347 CCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(CCCOC)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286348 COCCCN1C[C@H](C)N(C[C@H]1C)C(=O)N1Cc2c(Nc3nc(OCC(F)(F)F)ncc3F)n[nH]c2C1(C)C |r|
BDBM286349 C[C@@H]1CN([C@@H](C)CN1C)C(=O)N1Cc2c(Nc3nc(OCC(F)(F)F)ncc3F)n[nH]c2C1(C)C |r|
BDBM286350 C[C@H]1CN(C)C(C)(C)CN1C(=O)N1Cc2c(Nc3nc(OCC(F)(F)F)ncc3F)n[nH]c2C1(C)C |r|
BDBM286351 C.C[C@H]1CN(C)C(C)(C)CN1C(=O)N1Cc2c(Nc3nc(OCCCO)ncc3F)n[nH]c2C1(C)C |r|
BDBM286352 C.C[C@@H]1CN([C@@H](C)CN1C)C(=O)N1Cc2c(Nc3nc(OCCCO)ncc3F)n[nH]c2C1(C)C |r|
BDBM286353 COCCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2CC(C)(C)N(C)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286354 COCCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(C)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286355 CCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@H](C)N(C)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286356 CCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2CCN4CCC[C@@H]4C2)C3(C)C)n1 |r|
BDBM286357 CCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@]4(C)CCCN4C[C@@H]2C)C3(C)C)n1 |r|
BDBM286358 CCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2CCN(C)C(C)C2)C3(C)C)n1
BDBM286360 CCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2CCN(C)[C@H](C)C2)C3(C)C)n1 |r|
BDBM286361 CCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(CCC(F)(F)F)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286362 CCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(CC4CCOCC4)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286363 CCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H]4CCCN4C[C@@H]2C(C)C)C3(C)C)n1 |r|
BDBM286365 CCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(C[C@@H]2C)C2CCOCC2)C3(C)C)n1 |r|
BDBM286366 CCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2CCN(CC4(O)CCOCC4)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286372 CCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)C2(F)CCN(C)CC2)C3(C)C)n1
BDBM286374 COCCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)C2(F)CCN(C)CC2)C3(C)C)n1
BDBM286375 COCCCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)C2(F)CCN(C)CC2)C3(C)C)n1
BDBM286377 CN1CCC(F)(CC1)C(=O)N1Cc2c(Nc3nc(OCC(F)(F)F)ncc3F)n[nH]c2C1(C)C
BDBM286378 CCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)C2CCN(CCC(F)(F)F)CC2)C3(C)C)n1
BDBM286379 CCOc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)C2CCN(CC2)C2CCOCC2)C3(C)C)n1
BDBM286380 CCOc1ccnc(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(C)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286382 CCOc1ccnc(Nc2n[nH]c3c2CN(C(=O)C2C[C@@H](C)N(CCCOC)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286384 COCc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)C2C[C@@H](C)N(CC4CCOCC4)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286227 CCNc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2CC(C)(C)N(C)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286231 C[C@H]1CN(C)C(C)(C)CN1C(=O)N1Cc2c(Nc3nc(ncc3F)N(C)C)n[nH]c2C1(C)C |r|
BDBM286232 C[C@H]1CN(C)C(C)(C)CN1C(=O)N1Cc2c(Nc3nc(NCC4CC4)ncc3F)n[nH]c2C1(C)C |r|
BDBM286234 CC(C)CNc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2CC(C)(C)N(C)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286239 C[C@H]1CN(C)C(C)(C)CN1C(=O)N1Cc2c(Nc3nc(NC4CC4)ncc3F)n[nH]c2C1(C)C |r|
BDBM286241 CNc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2CC(C)(C)N(C)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286242 CC(C)Nc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2CC(C)(C)N(C)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286244 CCNc1nccc(Nc2n[nH]c3c2CN(C(=O)N2CC(C)(C)N(C)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286245 C[C@H]1CN(C)C(C)(C)CN1C(=O)N1Cc2c(Nc3ccnc(n3)N(C)C)n[nH]c2C1(C)C |r|
BDBM286246 C[C@H]1CN(C)C2(CCCC2)CN1C(=O)N1Cc2c(Nc3nc(C)ncc3F)n[nH]c2C1(C)C |r|
BDBM286248 CCNc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(CC4CCOCC4)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286251 CCNc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(C[C@@H]2C)C2CCOCC2)C3(C)C)n1 |r|
BDBM286252 CCN1C[C@H](C)N(C[C@H]1C)C(=O)N1Cc2c(Nc3nc(OC)ncc3F)n[nH]c2C1(C)C |r|
BDBM286253 CCN1C[C@H](C)N(C[C@H]1C)C(=O)N1Cc2c(Nc3nc(C)ncc3F)n[nH]c2C1(C)C |r|
BDBM286254 CCN1C[C@H](C)N(C[C@H]1C)C(=O)N1Cc2c(Nc3nc(C)nc(C)c3F)n[nH]c2C1(C)C |r|
BDBM286255 C[C@H]1CN([C@@H](C)CN1C)C(=O)N1Cc2c(Nc3nc(C)ncc3F)n[nH]c2C1(C)C |r|
BDBM286256 C[C@@H]1CN([C@@H](C)CN1CCCO)C(=O)N1Cc2c(Nc3nc(C)ncc3F)n[nH]c2C1(C)C |r|
BDBM286257 CCNc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(CCCOC)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286258 CCNc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2CC4CCCN4C[C@@H]2C)C3(C)C)n1 |r,@@:25|
BDBM286260 CCNc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(C)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286261 CCNc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(CCOC)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286263 CCNc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(CCC(F)(F)F)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286264 C[C@@H]1CN([C@@H](C)CN1C)C(=O)N1Cc2c(Nc3ccnc(n3)C#N)n[nH]c2C1(C)C |r|
BDBM286265 C[C@@H]1CN([C@@H](C)CN1C)C(=O)N1Cc2c(Nc3nc(ncc3F)N3CCOCC3)n[nH]c2C1(C)C |r|
BDBM286266 CCNc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)C2(F)CCN(C)CC2)C3(C)C)n1
BDBM286267 CCc1ccc(F)c(Nc2n[nH]c3c2CN(C(=O)N2CC(C)(C)N(C)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286269 CCc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(C)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286270 CCc1ncc(F)c(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)N(CCCOC)C[C@@H]2C)C3(C)C)n1 |r|
BDBM286271 CCOc1nccc(Nc2n[nH]c3c2CN(C(=O)N2C[C@@H](C)C(C)C[C@@H]2C)C3(C)C)n1 |r|
BDBM378885 Cc1ccc(NC(=O)c2ccc(C)c(c2)C(F)(F)F)cc1C#Cc1nn([C@H]2CC[C@H](O)CC2)c2ncnc(N)c12 |r,wU:26.27,wD:29.31,(-5.46,5.4,;-3.98,5.8,;-3.58,7.29,;-2.09,7.69,;-1,6.6,;.49,7,;1.57,5.91,;1.18,4.42,;3.06,6.31,;3.46,7.79,;4.95,8.19,;6.04,7.1,;7.53,7.5,;5.64,5.62,;4.15,5.22,;6.73,4.53,;8.22,4.93,;6.33,3.04,;7.82,3.44,;-1.4,5.11,;-2.89,4.71,;-3.29,3.22,;-3.68,1.74,;-4.08,.25,;-3.18,-1,;-4.08,-2.24,;-3.68,-3.73,;-2.2,-4.13,;-1.8,-5.62,;-2.89,-6.7,;-2.49,-8.19,;-4.38,-6.31,;-4.77,-4.82,;-5.55,-1.77,;-6.88,-2.54,;-8.22,-1.77,;-8.22,-.23,;-6.88,.54,;-6.88,2.08,;-5.55,-.23,)|
BDBM50463479 CS(=O)(=O)Nc1cccc(CC(=O)Nc2nc(cs2)-c2c[nH]c3ncccc23)c1
BDBM50463483 O=C(Cc1cccc(OCCCC2CCNCC2)c1)Nc1nc(cs1)-c1c[nH]c2ncccc12
BDBM50462632 CNC(=O)c1ccccc1Nc1nc(Nc2ccc(cc2)N2CCOCC2)ncc1Cl
BDBM50462709 O=C(Cc1cccc(OCCCN2CCNCC2)c1)Nc1nc(cs1)-c1ccncc1
BDBM418609 CNC(=O)c1ccc(Nc2ncc(c(NCc3cccnc3N(C)S(C)(=O)=O)n2)C(F)(F)F)cc1
BDBM418817 CNC(=O)c1ccc(Nc2ncc(c(NCc3nccnc3N(C)S(C)(=O)=O)n2)C(F)(F)F)cc1
BDBM50505541 [H][C@]12C[C@@H](NCCOCCOCCOCCNC(=O)CCC3=[N+]4C(C=C3)=Cc3c(C)cc(C)n3[B-]4(F)F)[C@@H](OC)[C@](C)(O1)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r,c:24,26,t:21|
BDBM50505542 [H][C@]12C[C@H]([C@@H](OC)[C@](C)(O1)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13)N(C)CCOCCOCCOCCNC(=O)CCC1=[N+]2C(C=C1)=Cc1c(C)cc(C)n1[B-]2(F)F |r,c:63,65,t:60|
BDBM50519662 CN(C)c1ccc(cc1)C(=O)Nc1cccc(NC(=O)COc2ccc3c(c2)occc3=O)c1
BDBM50537742 C[C@@H]1C[C@H]1C(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|
BDBM482158 COc1cc(ccc1Nc1ncc(Cl)c(Nc2ccccc2S(=O)(=O)C(C)C)n1)N1CCC(CC1)N1CCN(C)CC1
BDBM50571706 CNC(=O)c1ccc(Nc2ncc(c(NCc3ccccc3Cl)n2)C(F)(F)F)cc1
BDBM50571721 CNC(=O)c1ccc(Nc2ncc(c(Nc3ccccc3OC)n2)C(F)(F)F)cc1
BDBM21 COc1cc2c(Nc3ccc(Br)cc3F)ncnc2cc1OCC1CCN(C)CC1