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1091 SMILES Strings for Macrophage colony-stimulating factor 1 receptor

Compound NameSMILES String
BDBM21 COc1cc2c(Nc3ccc(Br)cc3F)ncnc2cc1OCC1CCN(C)CC1
BDBM2579 CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r|
BDBM3260 CN(c1ccccc1)c1ncnc2ccccc12
BDBM3530 COc1cc2ncnc(Nc3ccccc3)c2cc1OC
BDBM4552 COc1cc(Nc2c(cnc3cc(OCCCN4CCN(C)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
BDBM4363 NC(=S)C(=C\c1ccc(O)c(O)c1)\C#N
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
BDBM4810 Cc1cc(C)c(\C=C2/C(=O)Nc3ccccc23)[nH]1
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
BDBM6309 CC(=O)c1c(C)c2cnc(Nc3ccc(cn3)N3CCNCC3)nc2n(C2CCCC2)c1=O
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,)|
BDBM6497 COc1cc2ncnc(Nc3cc(OC)c(OC)c(OC)c3)c2cc1OC
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|
BDBM7393 O=Nc1c([nH]c2ccccc12)C1C(=O)Nc2ccccc12
BDBM9503 FC(F)(F)c1cccc(NC(=O)c2ccccc2NCc2ccncc2)c1
BDBM12621 COc1ccc(F)c(F)c1C(=O)c1cnc(NC2CCN(CC2)S(C)(=O)=O)nc1N
BDBM131921 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CCOCC5)ccn34)c12
BDBM131922 CCc1nn(Cc2cccc(OC3CCNC3)n2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131923 CCc1nn(Cc2cccc(OC3CCNC[C@H]3F)n2)c2cccc(NC(=O)c3cnc4ccccn34)c12 |r|
BDBM131909 CCc1nn(Cc2ccccc2)c2ccc(Cl)c(NC(=O)c3cnc4cc(OCCOC)ccn34)c12
BDBM131910 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131911 CCc1nn(Cc2ccc(C)nc2OC)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131912 CCc1nn(Cc2ccn(CCN3CCNCC3)n2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131913 CCc1nn(Cc2ccnn2CC(O)CO)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131914 CCc1nn(Cc2cccc(OCCN)n2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131918 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)C(=O)N3CCN(C)CC3)c12
BDBM131919 CCc1nn(Cc2cccc(CN3CCNCC3)n2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131920 CCc1nn(Cc2cccc(OC)n2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131906 COCCOc1ccn2c(cnc2c1)C(=O)Nc1cccc2n(Cc3ccccc3)nc(I)c12
BDBM131907 CCc1nn(Cc2ccccc2)c2cccc(NC(=O)c3cnc4cc(OCCOC)ccn34)c12
BDBM131908 COCCOc1ccn2c(cnc2c1)C(=O)Nc1cccc2n(Cc3ccccc3)nc(C3CC3)c12
BDBM131915 CCc1nn(Cc2cccc(OCCCN)n2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131916 CCc1nn(Cc2cccc(OCCCN(C)C)n2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131917 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)C(=O)N3CCNCC3)c12
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
BDBM17015 O=C1Nc2ccccc2\C1=C\c1ccc[nH]1
BDBM17055 CN(C)C[C@@H]1CCn2cc(C3=C(C(=O)NC3=O)c3cn(CCO1)c1ccccc31)c1ccccc21 |r,t:10|
BDBM17750 CC1CCN(CC1)c1ccc(CO)cc1NC(=O)c1ccc(o1)C#N
BDBM17751 Cc1cc(on1)-c1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O
BDBM17697 CNC(=O)c1cc(Oc2ccc3oc(Nc4ccc(Cl)c(OC[C@@H]5CCCN5C)c4)nc3c2)ccn1 |r|
BDBM17747 CN(C)c1ccc(\C=C2/C(=O)Nc3ccccc23)cc1
BDBM17748 Cc1cc2ncc(nc2cc1C)-c1ccc(O)c(O)c1
BDBM21079 Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cccc3[nH]nc(N)c23)c1
BDBM21103 COc1ccc(-c2ccc(NC(=O)Nc3cc(C)ccc3F)cc2)c2c(N)noc12
BDBM21104 COc1ccc(-c2ccc(NC(=O)Nc3cccc(c3)C(F)(F)F)cc2)c2c(N)noc12
BDBM21105 COc1ccc(-c2ccc(NC(=O)Nc3cccc(Cl)c3)cc2)c2c(N)noc12
BDBM25617 CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(Cl)cc23)c1F
BDBM25628 OCCn1cc(c(n1)-c1ccncc1)-c1ccc2C(CCc2c1)N=O
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
BDBM27901 CONC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(CCN4CCOCC4)cc3)ncc2c1=O
BDBM27902 CONC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(CCN4CCC(F)(F)CC4)cc3)ncc2c1=O
BDBM27903 CONC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(CCN4CCNC(=O)C4)cc3)ncc2c1=O
BDBM27904 CONC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(CCN4CCN(C)C(=O)C4)cc3)ncc2c1=O
BDBM27905 CONC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(CCS(=O)(=O)NC(C)=O)cc3)ncc2c1=O
BDBM27906 CONC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(cc3)C3CCNCC3)ncc2c1=O
BDBM27907 CONC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(cc3)C3CCN(CCO)CC3)ncc2c1=O
BDBM27908 CONC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(cc3)C3CCN(CC(O)=O)CC3)ncc2c1=O
BDBM27909 CONC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(cc3)C3CCN(C)CC3)ncc2c1=O
BDBM27910 CONC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(cc3)C3CCN(C)CC3(F)F)ncc2c1=O
BDBM27911 CCN1CCCC(O)(C1)c1cccc(Nc2ncc3c(n2)n(cc(C(=O)NOC)c3=O)-c2ccc3CCCc3c2)c1
BDBM27912 CCc1ccc(cc1)-n1cc(C(=O)NOC)c(=O)c2cnc(Nc3ccc(cc3)C3CCN(C)CC3)nc12
BDBM27913 CCc1cccc(c1)-n1cc(C(=O)NOC)c(=O)c2cnc(Nc3ccc(cc3)C3CCN(C)CC3)nc12
BDBM27914 CONC(=O)c1cn(-c2cnc3CCCc3c2)c2nc(Nc3ccc(cc3)C3CCN(C)CC3)ncc2c1=O
BDBM27915 CONC(=O)c1cn(C2CCC(C)(C)CC2)c2nc(Nc3ccc(cc3)C3CCN(C)CC3)ncc2c1=O
BDBM27916 CONC(=O)c1cn(C2CCCCC2)c2nc(Nc3ccc(cc3)C3CCN(C)CC3)ncc2c1=O
BDBM27917 CC1CCN(CC1)c1cc(ccc1NC(=O)c1cc(c[nH]1)C#N)N1CCN(C)CC1
BDBM27817 CNC(=O)c1c(F)cccc1Nc1nc(Nc2cc3N(CCc3cc2OC)C(=O)CN(C)C)nc2[nH]ccc12
BDBM27896 CCONC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(CCN4CCN(C)CC4)cc3)ncc2c1=O
BDBM27897 CC(C)ONC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(CCN4CCN(C)CC4)cc3)ncc2c1=O
BDBM27898 CONC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(NCc3ccccc3)ncc2c1=O
BDBM27899 CCCCNc1ncc2c(n1)n(cc(C(=O)NOC)c2=O)-c1ccc2CCCc2c1
BDBM27621 C[C@H](Nc1cncc(Cl)n1)c1cccc(N)c1 |r|
BDBM27622 C[C@H](Nc1cncc(Cl)n1)c1cccc(c1)N(C)C(=O)c1cccnc1 |r|
BDBM27623 C[C@H](Nc1cncc(Cl)n1)c1cccc(NCc2cccnc2)c1 |r|
BDBM27624 C[C@H](Nc1cncc(Cl)n1)c1cccc(NS(=O)(=O)c2cccnc2)c1 |r|
BDBM27625 C[C@H](Nc1cncc(Cl)n1)c1cccc(NC(=O)c2ccc(C)nc2)c1 |r|
BDBM27626 C[C@H](Nc1cncc(Cl)n1)c1cccc(NC(=O)c2ccnc(C)c2)c1 |r|
BDBM27627 C[C@H](Nc1cncc(Cl)n1)c1cccc(NC(=O)c2cncc(C)c2)c1 |r|
BDBM27628 C[C@H](Nc1cncc(Cl)n1)c1cccc(NC(=O)c2cncc(Br)c2)c1 |r|
BDBM27629 C[C@H](Nc1cncc(Cl)n1)c1cccc(NC(=O)c2ccccc2)c1 |r|
BDBM27630 C[C@H](Nc1cncc(Cl)n1)c1cccc(NC(=O)c2cccc(c2)C(F)(F)F)c1 |r|
BDBM27631 C[C@H](Nc1cncc(Cl)n1)c1cccc(NC(=O)c2ccc(F)c(Cl)c2)c1 |r|
BDBM27632 C[C@H](Nc1cncc(Cl)n1)c1cccc(NC(=O)c2ccc(C)cc2)c1 |r|
BDBM27633 C[C@H](Nc1cncc(Cl)n1)c1cccc(NC(=O)c2cccc(C)c2)c1 |r|
BDBM27634 C[C@H](Nc1cncc(Cl)n1)c1cccc(NC(=O)c2cc(C)ccc2F)c1 |r|
BDBM27635 C[C@H](Nc1cncc(Cl)n1)c1cccc(NC(=O)c2cncs2)c1 |r|
BDBM27636 C[C@H](Nc1cncc(Cl)n1)c1cccc(NC(=O)C2CCCN(C)C2)c1 |r|
BDBM27637 C[C@H](Nc1cncc(Br)c1)c1cccc(NC(=O)c2cncc(C)c2)c1 |r|
BDBM27638 C[C@H](Nc1cccc(Br)n1)c1cccc(NC(=O)c2cncc(C)c2)c1 |r|
BDBM27639 COc1cc(ccc1O)-c1cncc(N[C@@H](C)c2cccc(NC(=O)c3cccnc3)c2)n1 |r|
BDBM27640 COc1cc(ccc1O)-c1cncc(N[C@H](C)c2cccc(NC(=O)c3cccnc3)c2)n1 |r|
BDBM27889 CN1CCN(CC1)c1ccc(Nc2ncc3c(n2)n(cc(C(N)=O)c3=O)-c2ccc3CCCc3c2)cc1
BDBM27890 CN1CCN(CCc2ccc(Nc3ncc4c(n3)n(cc(C(N)=O)c4=O)-c3ccc4CCCc4c3)cc2)CC1
BDBM27891 CNC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(CCN4CCN(C)CC4)cc3)ncc2c1=O
BDBM27892 CNC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(CCN4CCOCC4)cc3)ncc2c1=O
BDBM27893 CCNC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(CCN4CCN(C)CC4)cc3)ncc2c1=O
BDBM27894 CN1CCN(CCc2ccc(Nc3ncc4c(n3)n(cc(C(=O)NCCO)c4=O)-c3ccc4CCCc4c3)cc2)CC1
BDBM27895 CONC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(CCN4CCN(C)CC4)cc3)ncc2c1=O
BDBM27900 CONC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(OC)nc3)ncc2c1=O
BDBM27619 COc1cc(ccc1O)-c1cncc(NC(C)c2cccc(NC(=O)c3cccnc3)c2)n1
BDBM27620 C[C@H](Nc1cncc(Cl)n1)c1cccc(NC(=O)c2cccnc2)c1 |r|
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
BDBM31340 COCC(=O)NC\C=C\c1ccc2ncnc(Nc3ccc(Oc4ccc(C)nc4)c(C)c3)c2c1
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
BDBM31093 OC(=O)c1ccc(Nc2ncc3CN=C(c4cc(Cl)ccc4-c3n2)c2c(F)cccc2F)cc1 |c:13|
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
BDBM31099 CN1CCC([C@H](O)C1)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl
BDBM32362 COc1ccc(COc2ccc(Cc3cnc(N)nc3N)cc2OC)cc1
BDBM36409 CC(C)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
BDBM131924 CCc1nn(Cc2cccc(OC3CCNCC3)n2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM86638 O=C(Nc1sc2CCCCc2c1C#N)c1cccc2ccccc12
BDBM103727 O=C(Nc1nc2cccc(-c3ccc(CN4CCS(=O)(=O)CC4)cc3)n2n1)C1CC1
BDBM25121 CC[C@H]1N(C2CCCC2)c2nc(Nc3ccc(cc3OC)C(=O)NC3CCN(C)CC3)ncc2N(C)C1=O |r|
BDBM119039 CN(C)CCOC(C)(C)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:27|
BDBM119041 CC1(C)CCC(=CC1)c1cc(CC(=O)NCCCO)ccc1NC(=O)c1ncc([nH]1)C#N |c:5|
BDBM119043 CC1(C)CCC(=CC1)c1cc(CCN2CCOCC2)ccc1NC(=O)c1ncc([nH]1)C#N |c:5|
BDBM119044 CC(C)(N1CCN(CCO)CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:31|
BDBM119049 COCCNC(C)(C)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:26|
BDBM120076 CC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:28|
BDBM120079 O=C(Nc1ccc(cc1C1=CCS(=O)(=O)CC1)C1CCNCC1)c1ncc([nH]1)C#N |t:10|
BDBM121388 C[C@H](O)Cn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2cccc(C)c2)cc1
BDBM121389 COc1ccc(NC(=O)Nc2ccc(cc2)-c2csc3c(cnc(N)c23)-c2cnn(CC(C)(C)O)c2)cc1
BDBM121390 COc1ccc(NC(=O)Nc2ccc(cc2)-c2csc3c(cnc(N)c23)-c2cnn(C[C@H](O)CO)c2)cc1
BDBM50110208 NC(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc2OCOc2c1)-c1ccccn1
BDBM164903 COc1ccc(COc2ccc(Cn3cnc4cc(cnc34)N3CCN(C)CC3)cc2OC)cn1
BDBM50115295 COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)[N+]([O-])=O)c2cc1OC
BDBM50115297 COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)C#N)c2cc1OC
BDBM50115298 COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Br)cc3)c2cc1OC
BDBM50118826 COc1cc2ncnc(N3CCN(CC3)C(=S)NCc3ccc4OCOc4c3)c2cc1OC
BDBM50118831 COc1cc2ncnc(N3CCN(CC3)C(=S)NCc3ccccc3)c2cc1OC
BDBM50117343 COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(OC(C)C)cc3)c2cc1OC
BDBM50117368 COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
BDBM50117319 COc1cc2c(ncnc2cc1OCCCN1CCOCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
BDBM50121980 O=C(Nc1cccc(c1)-c1cncc2ccccc12)c1ccccc1NCc1ccncc1
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
BDBM50162972 CC(C)N(Cc1ccccc1)c1nc(Nc2ccc3ncsc3c2)[nH]c(=O)n1
BDBM50162973 CC(C)(Nc1nc(NO)nc(Nc2ccc3ncsc3c2)n1)c1ccccc1
BDBM50162976 CC(C)(Nc1nc(Nc2ccc3ncsc3c2)[nH]c(=O)n1)c1ccccc1
BDBM50162978 CCN(Cc1ccccc1)c1nc(Nc2ccc3ncsc3c2)[nH]c(=O)n1
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|
BDBM50209144 COCCOCC(=O)Nc1cccc-2c1Cc1c-2n[nH]c1-c1csc(c1)C#CCOc1ccccc1
BDBM50209148 COC(=O)C(=O)Nc1cccc-2c1Cc1c-2n[nH]c1-c1csc(c1)C#CCOc1ccccc1
BDBM50209150 COCC(=O)Nc1cccc-2c1Cc1c-2n[nH]c1-c1csc(c1)C#CCOc1ccccc1
BDBM50209156 CCOC(=O)CC(=O)Nc1cccc-2c1Cc1c-2n[nH]c1-c1csc(c1)C#CCOc1ccccc1
BDBM50209158 CN1CCN(CC(=O)Nc2cccc-3c2Cc2c-3n[nH]c2-c2csc(c2)C#CCOc2ccccc2)CC1
BDBM50210271 COCCOCC#Cc1cc(cs1)-c1[nH]nc-2c1Cc1ccc(Cn3cncn3)cc-21
BDBM50210272 CN1CCN(Cc2ccc-3c(Cc4c-3n[nH]c4-c3csc(c3)C#CCOc3ccccc3)c2)CC1
BDBM50218709 COc1cc(ccc1N)-c1ccc2c(Nc3ccc(cc3NC2=O)C(C)(C)C(=O)Nc2ccc(cc2)N2CCOCC2)c1
BDBM50221346 COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1
BDBM50223697 NCc1ccc(N2CCCCC2)c(NC(=O)c2ccc(o2)C#N)c1
BDBM50223698 Oc1ccc(N2CCCCC2)c(NC(=O)c2ccc(o2)C#N)c1
BDBM50223699 O=C(Nc1ccccc1N1CCCCC1)c1ccc(o1)C#N
BDBM50223700 OCc1ccc(N2CCCCC2)c(NC(=O)c2ccc(o2)C#N)c1
BDBM50223701 [O-][N+](=O)c1c[nH]c(c1)C(=O)Nc1ccccc1N1CCCCC1
BDBM50223702 CCCN(CCC)c1ccccc1NC(=O)c1ccc(o1)[N+]([O-])=O
BDBM50223703 Nc1ccc(o1)C(=O)Nc1ccccc1N1CCCCC1
BDBM50223704 [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccccc1N1CCC1
BDBM50223705 OC1CCN(C1)c1ccccc1NC(=O)c1ccc(o1)[N+]([O-])=O |w:1.0|
BDBM50223706 OCCC1CCN(CC1)c1ccccc1NC(=O)c1ccc(o1)[N+]([O-])=O
BDBM50223707 [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccccc1N1CCN(CC1)c1ccccc1
BDBM50223708 CC1CCCCN1c1ccccc1NC(=O)c1ccc(o1)[N+]([O-])=O |w:1.0|
BDBM50223664 FC(F)(F)c1ccc(o1)C(=O)Nc1ccccc1N1CCCCC1
BDBM50223665 O=C(Nc1ccccc1N1CCCCC1)c1cc(c[nH]1)C#N
BDBM50223666 CC1CC(C)CN(C1)c1ccccc1NC(=O)c1ccc(o1)[N+]([O-])=O |w:1.0,3.3|
BDBM50223667 O=Cc1ccc(o1)C(=O)Nc1ccccc1N1CCCCC1
BDBM50223668 CC1CCN(CC1)c1ccccc1NC(=O)c1ccc(o1)[N+]([O-])=O
BDBM50223669 CN1CCN(CC1)c1ccccc1NC(=O)c1ccc(o1)[N+]([O-])=O
BDBM50223670 OCC(O)COCc1ccc(N2CCCCC2)c(NC(=O)c2ccc(o2)C#N)c1 |w:2.2|
BDBM50223671 [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccccc1N1CCNCC1
BDBM50223672 [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccccc1N1C=CC=CC=C1 |c:20,22,24|
BDBM50223673 [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccccc1N1CCCC1
BDBM50223674 O=Cc1ccc(N2CCCCC2)c(NC(=O)c2ccc(o2)C#N)c1
BDBM50223675 [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccccc1N1CCOCC1
BDBM50223676 OCC1CCN(CC1)c1ccccc1NC(=O)c1ccc(o1)[N+]([O-])=O
BDBM50223677 CC1CCCN(C1)c1ccccc1NC(=O)c1ccc(o1)[N+]([O-])=O |w:1.0|
BDBM50223678 O=C(Nc1ccccc1N1CCCCC1)c1ccc(Nc2ccccc2)o1
BDBM50223679 O=C(Nc1ccccc1N1CCCCC1)c1ccc(o1)-c1ccccc1
BDBM50223680 [#7]\[#6](-[#7])=[#7]\[#6]-c1ccc(-[#7]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)c(-[#7]-[#6](=O)-c2ccc(o2)C#N)c1
BDBM50223681 CS(=O)(=O)NCc1ccc(N2CCCCC2)c(NC(=O)c2ccc(o2)C#N)c1
BDBM50223682 CN1CCN(Cc2ccc(N3CCCCC3)c(NC(=O)c3ccc(o3)C#N)c2)CC1
BDBM50223683 [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccccc1N1CCCCC1
BDBM50223684 CCCN(CC)c1ccccc1NC(=O)c1ccc(o1)[N+]([O-])=O
BDBM50223685 O=C(Nc1cc(ccc1N1CCCCC1)C#N)c1ccc(o1)C#N
BDBM50223686 COc1ccc(N2CCCCC2)c(NC(=O)c2ccc(o2)C#N)c1
BDBM50223687 OC(=O)c1ccc(o1)C(=O)Nc1ccccc1N1CCCCC1
BDBM50223688 OC1CCN(CC1)c1ccccc1NC(=O)c1ccc(o1)[N+]([O-])=O
BDBM50223689 OCC1CCN(C1)c1ccccc1NC(=O)c1ccc(o1)[N+]([O-])=O |w:2.1|
BDBM50223690 Brc1ccc(o1)C(=O)Nc1ccccc1N1CCCCC1
BDBM50223691 [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccccc1Nc1ccccc1
BDBM50223692 OC(=O)c1ccc(N2CCCCC2)c(NC(=O)c2ccc(o2)C#N)c1
BDBM50223693 O=C(Nc1cc(ccc1N1CCCCC1)N1CCCCC1)c1ccc(o1)C#N
BDBM50223694 Clc1ccc(o1)C(=O)Nc1ccccc1N1CCCCC1
BDBM50223695 NC(=O)c1ccc(o1)C(=O)Nc1ccccc1N1CCCCC1
BDBM50223696 O=C(Nc1ccccc1N1CCCCC1)c1ccco1
BDBM50222553 Cc1cc(Nc2c(cnc3cc(ccc23)-c2ccncc2)C(N)=O)ccc1Cl
BDBM50222554 CS(=O)(=O)c1ccc(cc1)-c1ccc2c(Nc3ccc(F)c(F)c3)c(cnc2c1)C(N)=O
BDBM50222555 Cc1ccc(Nc2c(cnc3cc(ccc23)-c2ccncc2)C(N)=O)cc1C
BDBM50222556 Cc1cc(Nc2c(cnc3cc(ccc23)-c2ccncc2)C(N)=O)ccc1F
BDBM50222557 CS(=O)(=O)Cc1cccc(c1)-c1ccc2c(Nc3ccccc3)c(cnc2c1)C(N)=O
BDBM50222558 NC(=O)c1cnc2cc(ccc2c1Nc1ccccc1)-c1cccc(c1)C#N
BDBM50222559 Cc1ccc(Nc2c(cnc3cc(ccc23)-c2ccc(cc2)S(C)(=O)=O)C(N)=O)cc1F
BDBM50222560 NC(=O)c1cnc2cc(ccc2c1Nc1ccc(OC(F)(F)F)c(Cl)c1)-c1ccncc1
BDBM50222561 NC(=O)c1cnc2cc(ccc2c1Nc1ccccc1)-c1ccc(F)cc1
BDBM50222562 COc1ccc(Nc2c(cnc3cc(ccc23)-c2ccncc2)C(N)=O)cc1
BDBM50222563 CC(C)Oc1ccc(Nc2c(cnc3cc(ccc23)-c2ccncc2)C(N)=O)cc1F
BDBM50222564 NC(=O)c1cnc2cc(ccc2c1Nc1ccccc1)-c1ccc(N)cc1
BDBM50222565 CS(=O)(=O)Cc1ccc(cc1)-c1ccc2c(Nc3ccccc3)c(cnc2c1)C(N)=O
BDBM50222566 NC(=O)c1cnc2cc(ccc2c1Nc1ccccc1)-c1ccc(cc1)C(=O)N1CCOCC1
BDBM50222567 CCS(=O)(=O)c1ccc(cc1)-c1ccc2c(Nc3ccccc3)c(cnc2c1)C(N)=O
BDBM50222568 NC(=O)c1cnc2cc(ccc2c1Nc1n[nH]c2ccccc12)-c1ccncc1
BDBM50222569 NC(=O)c1cnc2cc(ccc2c1Nc1ccccc1)-c1ccc(cc1)S(N)(=O)=O
BDBM50222570 NC(=O)c1cnc2cc(ccc2c1Nc1ccon1)-c1ccncc1
BDBM50222571 NC(=O)c1cnc2cc(ccc2c1Nc1ccc(F)cc1)-c1ccncc1
BDBM50222572 CS(=O)(=O)c1ccc(cc1)-c1ccc2c(Nc3ccccc3)c(cnc2c1)C(N)=O
BDBM50222573 COc1ccc(Nc2c(cnc3cc(ccc23)-c2ccncc2)C(N)=O)cc1Cl
BDBM50222574 NC(=O)c1cnc2cc(ccc2c1Nc1cccc2[nH]ncc12)-c1ccncc1
BDBM50222575 NC(=O)c1cnc2cc(ccc2c1Nc1ccccc1)-c1ccncc1
BDBM50222576 CN(C)c1ccc(Nc2c(cnc3cc(ccc23)-c2ccncc2)C(N)=O)cc1
BDBM50222577 CSc1ccc(Nc2c(cnc3cc(ccc23)-c2ccncc2)C(N)=O)cc1
BDBM50222578 NC(=O)c1cnc2cc(ccc2c1Nc1ccccc1)-c1ccc(cc1)C(=O)C1CCCC1
BDBM50222579 NC(=O)c1cnc2cc(ccc2c1Nc1ccc(F)c(F)c1)-c1ccncc1
BDBM50222580 CS(=O)(=O)Nc1ccc(cc1)-c1ccc2c(Nc3ccccc3)c(cnc2c1)C(N)=O
BDBM50222581 CCOc1ccc(Nc2c(cnc3cc(ccc23)-c2ccncc2)C(N)=O)cc1F
BDBM50222582 Cc1ccc(Nc2c(cnc3cc(ccc23)-c2ccc(cc2)S(C)(=O)=O)C(N)=O)cc1C
BDBM50222583 Cc1ccc(Nc2c(cnc3cc(ccc23)-c2ccncc2)C(N)=O)cc1F
BDBM50222584 CC(=O)Nc1ccc(cc1)-c1ccc2c(Nc3ccccc3)c(cnc2c1)C(N)=O
BDBM50222585 CN(C)c1ccc(cc1)-c1ccc2c(Nc3ccccc3)c(cnc2c1)C(N)=O
BDBM50222586 COc1ccc(Nc2c(cnc3cc(ccc23)-c2ccncc2)C(N)=O)cc1F
BDBM50222587 COc1ccc(cc1)-c1ccc2c(Nc3ccccc3)c(cnc2c1)C(N)=O
BDBM50222588 NC(=O)c1cnc2cc(ccc2c1Nc1ccccc1)-c1ccc(cc1)C(=O)N1CCCCC1
BDBM50222589 NC(=O)c1cnc2cc(ccc2c1Nc1ccccc1)-c1ccccc1
BDBM50222590 CC(C)Oc1ccc(Nc2c(cnc3cc(ccc23)-c2ccncc2)C(N)=O)cc1
BDBM50222591 Cc1ccc(Nc2c(cnc3cc(ccc23)-c2ccncc2)C(N)=O)cc1Cl
BDBM50222592 NC(=O)c1cnc2cc(ccc2c1Nc1ccccc1)-c1ccc(cc1)C(=O)C1CC1
BDBM50222593 Cc1ccc(cc1)-c1ccc2c(Nc3ccccc3)c(cnc2c1)C(N)=O
BDBM50222594 NC(=O)c1cnc2cc(ccc2c1Nc1ccccc1)-c1ccc(Br)cc1
BDBM50222595 COc1ccc(Nc2c(cnc3cc(ccc23)-c2ccc(cc2)S(C)(=O)=O)C(N)=O)cc1F
BDBM50222596 CS(=O)(=O)c1ccc(cc1)-c1ccc2c(Nc3ccc(F)cc3)c(cnc2c1)C(N)=O
BDBM50222597 NC(=O)c1cnc2cc(ccc2c1Nc1ccccc1)-c1ccc(cc1)C(F)(F)F
BDBM50222598 NC(=O)c1cnc2cc(ccc2c1Nc1ccccc1)-c1ccc(cc1)C#N
BDBM50236362 COc1cc2nccc(Oc3ccc4c(cccc4c3)C(=O)Nc3ccc(Cl)cc3)c2cc1OC
BDBM50233697 CN1CCN(CC1)c1ccc(NC(=O)c2cc(c[nH]2)C#N)c(c1)N1CCCCC1
BDBM50233698 CN(C(=O)N1CCN(C)CC1)c1ccc(NC(=O)c2ccc(o2)C#N)c(c1)N1CCCCC1
BDBM50233699 CN1CCN(CC1)c1ccc(NC(=O)c2ccc(o2)C#N)c(c1)N1CCCCC1=O
BDBM50233700 CC1CCN(CC1)c1nc(ccc1NC(=O)c1ccc(o1)C#N)N1CCN(C)CC1
BDBM50233701 O=C(Nc1ccc(cc1N1CCCCC1)N1CCS(=O)(=O)CC1)c1ccc(o1)C#N
BDBM50233702 CCN(C)CCCc1ccc(NC(=O)c2ccc(o2)C#N)c(c1)N1CCCCC1
BDBM50233703 CC1CCN(CC1)c1cc(cnc1NC(=O)c1ccc(o1)C#N)N1CCN(C)CC1
BDBM50233704 Cc1cnn(c1)-c1ccc(NC(=O)c2ccc(o2)C#N)c(c1)N1CCCCC1
BDBM50233705 CC1CCN(CC1)c1cc(ccc1NC(=O)c1cc(c[nH]1)C#N)N1CCNCC1
BDBM50233706 CN(c1ccc(NC(=O)c2ccc(o2)C#N)c(c1)N1CCCCC1)S(C)(=O)=O
BDBM50233707 CC1CCN(CC1)c1cc(ccc1NC(=O)c1ccc(o1)C#N)N1CCN(C)CC1
BDBM50233709 O=C(Nc1ccc(cc1N1CCCCC1)-n1ccnc1)c1ccc(o1)C#N
BDBM50233710 CN1CCN(CC1)c1ccc(NC(=O)c2ccc(o2)C#N)c(c1)N1CCOCC1
BDBM50233711 Fc1ccc(NC(=O)c2ccc(o2)C#N)c(c1)N1CCCCC1
BDBM50233712 CS(=O)(=O)Nc1ccc(NC(=O)c2ccc(o2)C#N)c(c1)N1CCCCC1
BDBM50233713 CC1CCN(CC1)c1cc(ccc1NC(=O)c1ccc(o1)C#N)N1CCN(CC1)S(C)(=O)=O
BDBM50233714 O=C(Nc1ccc(cc1N1CCCCC1)N1CCCCC1)c1ccc(o1)C#N
BDBM50233715 CN1CCN(CC1)c1ccc(NC(=O)c2ccc(o2)C#N)c(c1)N1CCCCC1
BDBM50233716 CC1CCN(CC1)c1cc(ccc1NC(=O)c1ccc(o1)C#N)N1CCN(CCO)CC1
BDBM50233717 CCOc1ccc(NC(=O)c2ccc(o2)C#N)c(c1)N1CCCCC1
BDBM50233718 CN1CCN(CC1)c1ccc(NC(=O)c2ccc(o2)C#N)c(c1)N1CCCC(F)C1 |w:27.30|
BDBM50233719 CC1CCN(CC1)c1cc(ccc1NC(=O)c1ccc(o1)C#N)N1CCOCC1
BDBM50233720 CC1CCN(CC1)c1cc(ccc1NC(=O)c1cc(c[nH]1)C#N)N1CCN(CC1)C(C)=O
BDBM50233708 O=C(Nc1ccccc1N1CCCCC1)c1ccno1
BDBM50240907 COc1cc2ncc(C(N)=O)c(Nc3ccc(Cl)cc3Cl)c2cc1OC
BDBM50237710 Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)cc(c1)C(F)(F)F
BDBM50265370 CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(c2)-c2ccc3c(N)noc3c2)CC1
BDBM50265371 Cc1ccc(cc1-c1ccc2c(noc2c1)C1CCNCC1)C(=O)NC1CC1
BDBM50265033 Cc1nnc(o1)-c1ccc(c(C)c1)-c1cc(ccc1C)C(=O)NC1CC1
BDBM50265034 Cc1nnc(o1)-c1ccc(c(C)c1)-c1cc(ccc1C)C(=O)Nc1cccc(c1)N1CCOCC1
BDBM50265035 Cc1nnc(o1)-c1ccc(c(C)c1)-c1cc(NC(=O)c2ccnc(c2)N2CCCC2)ccc1C
BDBM50265154 Cc1ccc(cc1-c1ccc2c(c1)nnn(CC1CC1)c2=O)C(=O)NC1CC1
BDBM50264389 FC(F)(F)c1cccc(Nc2noc3c(C(=O)Nc4cncnc4)c(Cl)ccc23)c1
BDBM50265069 CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(c2)-c2ccc(cc2C)-c2nnc(C)o2)CC1
BDBM50265259 Cc1ccc(cc1-c1ccc2ccncc2c1)C(=O)NC1CC1
BDBM50265287 CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(c2)-c2ccc3ccncc3c2)CC1
BDBM50264990 CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(c2)-c2ccc(cc2)-c2csc(N)n2)CC1
BDBM50264755 Cc1ccc(cc1-c1ccc2c(noc2c1)C1CCNCC1)C(=O)Nc1cccc(c1)N1CCOCC1
BDBM50264756 Cc1ccc(NC(=O)c2ccnc(c2)N2CCCC2)cc1-c1ccc2c(noc2c1)C1CCNCC1
BDBM50256750 Nc1ncc(NC(=O)c2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2Cl)cc1Cl
BDBM50244430 Cc1cccc(C)c1\C=C\n1cnc2c(Nc3ccc(cc3)P(C)(C)=O)ncnc12
BDBM50244723 Cc1cc(C)cc(c1)C(=O)Nc1ccc(Cl)c(c1)C(=O)Nc1cccnc1
BDBM50244724 Cc1ccc(cc1C)C(=O)Nc1ccc(Cl)c(c1)C(=O)Nc1cccnc1
BDBM50244725 Clc1cc(Cl)cc(c1)C(=O)Nc1ccc(Cl)c(c1)C(=O)Nc1cccnc1
BDBM50244726 Clc1ccc(cc1Cl)C(=O)Nc1ccc(Cl)c(c1)C(=O)Nc1cccnc1
BDBM50244727 Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1C(=O)Nc1ccccc1
BDBM50244895 Cc1ncc(NC(=O)c2cc(NC(=O)c3cc(F)cc(Cl)c3)ccc2Cl)s1
BDBM50244896 CC(C)c1ncc(NC(=O)c2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2Cl)s1
BDBM50244897 CC(C)c1ncc(NC(=O)c2cc(NC(=O)c3cc(C)cc(C)c3)ccc2Cl)s1
BDBM50244898 FC(F)(F)c1cccc(c1)C(=O)Nc1ccc(Cl)c(c1)C(=O)Nc1cnc(s1)C1CC1
BDBM50244780 Cc1ncc(NC(=O)c2cc(NC(=O)c3cccc(Cl)c3)ccc2C)s1
BDBM50244781 FC(F)(F)c1cccc(c1)C(=O)Nc1ccc(Cl)c(c1)C(=O)Nc1cncs1
BDBM50244782 Clc1cccc(c1)C(=O)Nc1ccc(Cl)c(c1)C(=O)Nc1cncs1
BDBM50244783 Cc1cc(C)cc(c1)C(=O)Nc1ccc(Cl)c(c1)C(=O)Nc1cncs1
BDBM50244784 Cc1ncc(NC(=O)c2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2C)s1
BDBM50244842 Cc1ncc(NC(=O)c2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2Cl)s1
BDBM50244843 Cc1ncc(NC(=O)c2cc(NC(=O)c3cccc(Cl)c3)ccc2Cl)s1
BDBM50244844 Cc1ncc(NC(=O)c2cc(NC(=O)c3cc(C)cc(C)c3)ccc2C)s1
BDBM50244845 Cc1ncc(NC(=O)c2cc(NC(=O)c3cc(C)cc(C)c3)ccc2Cl)s1
BDBM50244846 Cc1ncc(NC(=O)c2cc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)ccc2Cl)s1
BDBM50244581 CN(c1cccc(c1)C(=O)Nc1ccc(C)c(NC(=O)c2ccc3ncccc3c2)c1)S(C)(=O)=O
BDBM50244582 Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1NC(=O)c1cccnc1
BDBM50244629 Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1C(=O)Nc1cccnc1
BDBM50244630 Cc1ccc(cc1NC(=O)c1cccnc1)C(=O)Nc1cccc(c1)C(F)(F)F
BDBM50244631 FC(F)(F)c1cccc(c1)C(=O)Nc1ccc(Cl)c(c1)C(=O)Nc1cccnc1
BDBM50244632 Cc1cccc(c1)C(=O)Nc1ccc(Cl)c(c1)C(=O)Nc1cccnc1
BDBM50244671 Fc1cccc(c1)C(=O)Nc1ccc(Cl)c(c1)C(=O)Nc1cccnc1
BDBM50244672 Clc1cccc(c1)C(=O)Nc1ccc(Cl)c(c1)C(=O)Nc1cccnc1
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|
BDBM50242742 COc1cc(ccc1Nc1ncc(Cl)c(Nc2ccccc2S(=O)(=O)C(C)C)n1)N1CCC(CC1)N1CCN(C)CC1
BDBM50243075 Cc1ccc(cc1C(=O)Nc1cccnc1)C(=O)Nc1cccc(c1)C(F)(F)F
BDBM50244673 Clc1ccc(NC(=O)c2cccc(Br)c2)cc1C(=O)Nc1cccnc1
BDBM50244674 COc1cccc(c1)C(=O)Nc1ccc(Cl)c(c1)C(=O)Nc1cccnc1
BDBM50244675 CN(C)c1cccc(c1)C(=O)Nc1ccc(Cl)c(c1)C(=O)Nc1cccnc1
BDBM50243417 Cc1cccc(NC(=O)Nc2ccc(cc2)-c2cnc3c(ccn3c2N)-c2cnn(C)c2)c1
BDBM50263093 Cc1ccc(cc1-c1ccc(cc1)C(=O)NCC1CC1)C(=O)NC1CC1
BDBM50255811 CCOc1cc2ncc(C(N)=O)c(Nc3ccc(F)cc3F)c2cc1N1CCN(C)CC1
BDBM50255145 COc1cc2ncc(C(N)=O)c(Nc3ccccc3F)c2cc1OC
BDBM50255371 COc1cc2ncc(C(N)=O)c(Nc3cccc(F)c3F)c2cc1OC
BDBM50255372 COc1cc2ncc(C(N)=O)c(Nc3cccc(Cl)c3F)c2cc1OC
BDBM50255373 COc1cc2ncc(C(N)=O)c(Nc3cccc(C)c3C)c2cc1OC
BDBM50255374 COc1cc2ncc(C(N)=O)c(Nc3cccc(Cl)c3C)c2cc1OC
BDBM50255375 COc1cc2ncc(C(N)=O)c(Nc3cccc(Cl)c3Cl)c2cc1OC
BDBM50255098 COc1cc2ncc(C(N)=O)c(Nc3ccc(F)cc3Cl)c2cc1OC
BDBM50255418 COc1cc2ncc(C(N)=O)c(Nc3ccc(F)cc3F)c2cc1OC
BDBM50255419 COc1cc2ncc(C(N)=O)c(Nc3ccc(C)cc3F)c2cc1OC
BDBM50255420 COc1cc2ncc(C(N)=O)c(Nc3ccc(Cl)cc3F)c2cc1OC
BDBM50255421 COc1cc2ncc(C(N)=O)c(Nc3ccc(F)c(F)c3)c2cc1OC
BDBM50255463 COc1cc2ncc(C(N)=O)c(Nc3ccc(F)c(Cl)c3)c2cc1OC
BDBM50255464 COc1cc2ncc(C(N)=O)c(Nc3ccc(Cl)c(Cl)c3)c2cc1OC
BDBM50255465 COc1cc2ncc(C(N)=O)c(Nc3cc(F)ccc3F)c2cc1OC
BDBM50255466 COc1cc2ncc(C(N)=O)c(Nc3cc(C)ccc3F)c2cc1OC
BDBM50255467 COc1cc2ncc(C(N)=O)c(Nc3cc(F)cc(F)c3)c2cc1OC
BDBM50255513 COc1cc2ncc(C(N)=O)c(Nc3cc(Cl)cc(Cl)c3)c2cc1OC
BDBM50255514 COc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cc1OCCN(C)C)C(N)=O
BDBM50255515 COc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cc1OCCNC1CC1)C(N)=O
BDBM50255516 COCCN(C)CCOc1cc2ncc(C(N)=O)c(Nc3ccc(F)c(Cl)c3)c2cc1OC
BDBM50255517 COc1cc2ncc(C(N)=O)c(Nc3ccc(Cl)cc3Cl)c2cc1N1CCN(C)CC1
BDBM50255518 COc1cc2ncc(C(N)=O)c(Nc3ccc(Cl)c(Cl)c3)c2cc1N1CCN(C)CC1
BDBM50255520 COc1cc2ncc(C(N)=O)c(Nc3ccc(F)cc3F)c2cc1N1CCN(C)CC1
BDBM50255255 COc1cc2ncc(C(N)=O)c(Nc3ccccc3Cl)c2cc1OC
BDBM50255256 COc1cc2ncc(C(N)=O)c(Nc3ccccc3Br)c2cc1OC
BDBM50255257 COc1cc2ncc(C(N)=O)c(Nc3ccccc3C)c2cc1OC
BDBM50255258 COc1cc2ncc(C(N)=O)c(Nc3cccc(F)c3)c2cc1OC
BDBM50255259 COc1cc2ncc(C(N)=O)c(Nc3cccc(Cl)c3)c2cc1OC
BDBM50255316 COc1cc2ncc(C(N)=O)c(Nc3cccc(C)c3)c2cc1OC
BDBM50255317 COc1cc2ncc(C(N)=O)c(Nc3ccc(F)cc3)c2cc1OC
BDBM50255318 COc1cc2ncc(C(N)=O)c(Nc3ccc(Cl)cc3)c2cc1OC
BDBM50255319 COc1ccc(Nc2c(cnc3cc(OC)c(OC)cc23)C(N)=O)cc1
BDBM50255320 COc1cc2ncc(C(N)=O)c(Nc3ccc(cc3)N(C)C)c2cc1OC
BDBM50255586 COc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cc1OCCN(C)CCO)C(N)=O
BDBM50255587 COc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cc1OCCN1CCCC1)C(N)=O
BDBM50255588 COc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cc1OCCCN1CCN(C)CC1)C(N)=O
BDBM50255589 COc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cc1OCCN1CCC(O)CC1)C(N)=O
BDBM50255590 CN1CCN(CC1)c1ccc2ncc(C(N)=O)c(Nc3ccc(Cl)cc3Cl)c2c1
BDBM50255591 CN1CCN(CC1)c1ccc2ncc(C(N)=O)c(Nc3ccc(Cl)c(Cl)c3)c2c1
BDBM50255592 CN1CCN(CC1)c1ccc2ncc(C(N)=O)c(Nc3cccc(Cl)c3Cl)c2c1
BDBM50255593 CN1CCN(CC1)c1ccc2ncc(C(N)=O)c(Nc3ccc(F)cc3F)c2c1
BDBM50255594 CN1CCN(CC1)c1cc2c(Nc3cccc(Cl)c3Cl)c(cnc2cc1F)C(N)=O
BDBM50255642 COc1cc2ncc(C(N)=O)c(Nc3ccc(F)c(Cl)c3)c2cc1OCCN1CCCC1
BDBM50255643 COc1cc2ncc(C(N)=O)c(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCN(C)CC1
BDBM50255645 COc1cc2ncc(C(N)=O)c(Nc3cccc(Cl)c3Cl)c2cc1NCCN1CCCCC1
BDBM50255646 CN1CCN(CC1)c1cc2c(Nc3ccc(F)cc3F)c(cnc2cc1F)C(N)=O
BDBM50255647 COc1cc2c(Nc3ccc(Cl)c(Cl)c3)c(cnc2cc1N1CCN(C)CC1)C(N)=O
BDBM50255648 COc1cc2c(Nc3cccc(Cl)c3Cl)c(cnc2cc1N1CCN(C)CC1)C(N)=O
BDBM50255649 COc1cc2c(Nc3ccc(F)cc3F)c(cnc2cc1N1CCN(C)CC1)C(N)=O
BDBM50255695 COc1cc2c(Nc3cccc(Cl)c3Cl)c(cnc2cc1NCCN(C)C)C(N)=O
BDBM50255696 COc1cc2c(Nc3cccc(Cl)c3Cl)c(cnc2cc1NCCN1CCCCC1)C(N)=O
BDBM50255697 CCOc1cc2ncc(C(N)=O)c(Nc3cccc(Cl)c3Cl)c2cc1NCCN(C)C
BDBM50255698 CCOc1cc2ncc(C(N)=O)c(Nc3cccc(Cl)c3Cl)c2cc1NCCN1CCCCC1
BDBM50255744 COc1cc2ncc(C(N)=O)c(Nc3ccc(F)cc3F)c2cc1NCCN(C)C
BDBM50255745 COc1cc2ncc(C(N)=O)c(Nc3ccc(F)cc3F)c2cc1NCCN1CCCCC1
BDBM50255746 COc1cc2ncc(C(N)=O)c(Nc3ccc(F)cc3F)c2cc1NCCN1CCOCC1
BDBM50255747 COc1cc2c(Nc3ccc(F)cc3F)c(cnc2cc1NCCN(C)C)C(N)=O
BDBM50273281 COc1cc2ncnc(N(C)c3ccccc3)c2cc1OC
BDBM50291104 COc1ccc2ncnc(N(C)c3ccccc3)c2c1
BDBM50291105 CN(c1ccccc1)c1ncnc2c(C)cc(C)cc12
BDBM50291106 CN(c1ccccc1)c1ncnc2ccc(Cl)cc12
BDBM50291110 CN(c1cccc(C)c1)c1ncnc2n[nH]cc12
BDBM50291101 COc1cc2c(ncnc2c(OC)c1OC)N(C)c1ccccc1
BDBM50291102 CCN(c1ccccc1)c1ncnc2cc(OC)c(OC)cc12
BDBM50291103 COc1cc2ncnc(N(C)c3cccc(c3)C(F)(F)F)c2cc1OC
BDBM50291112 CN(c1ccccc1)c1ncnc2n[nH]cc12
BDBM50291114 COc1cc2ncnc(N(C)c3ccc(Cl)cc3)c2cc1OC
BDBM50291115 CN(c1ccccc1)c1ncnc2nc[nH]c12
BDBM50291116 COc1cc2ncnc(N(C)c3ccc(C)cc3)c2cc1OC
BDBM50291117 COc1cc2nc(OC)nc(N(C)c3ccccc3)c2cc1OC
BDBM50291107 COc1cc2ncnc(N(C)c3cccc(Cl)c3)c2cc1OC
BDBM50291108 COc1cc2nc(Cl)nc(N(C)c3ccccc3)c2cc1OC
BDBM50291109 CN(c1cccc(C)c1)c1ncnc2cc(C)c(C)cc12
BDBM50290633 COc1cc2ncnc(N3CCc4ccccc34)c2cc1OC
BDBM50291111 COc1cc2ncnc(N(C)c3cccc(C)c3)c2cc1OC
BDBM50275499 Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1
BDBM50305006 NCCn1cc(-c2cc(-c3cc4ccccc4s3)c3[nH]ncc3c2)c2nc(N)ncc12
BDBM50310637 CC(C)(C)c1cc(NC(=O)Nc2ccc(NC(=O)c3ncccc3O)cc2)no1
BDBM50310628 CC(C)(C)c1cc(NC(=O)Nc2ccc(NC(=O)c3cc4ccccc4cn3)cc2)no1
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
BDBM50300691 CC(C)(C)c1cc(NC(=O)Nc2ccc(NC(=O)c3cn4c(n3)sc3ccccc43)cc2)no1
BDBM50309910 COc1c(Cl)cc2c3ccncc3[nH]c2c1NC(=O)c1cccnc1C
BDBM50315888 O=C(Cc1ccccc1)Nc1cccc(c1)-c1nc2sccn2c1-c1ccnc(Nc2cccc(c2)N2CCOCC2)n1
BDBM50321352 [O-][n+]1ccc(cc1)-c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:26|
BDBM50321353 O=C(Nc1ccc(cc1C1=CCCCC1)-c1ccncc1)c1ncc([nH]1)C#N |t:10|
BDBM50321354 [O-][n+]1cccc(c1)-c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:26|
BDBM50321355 O=C(Nc1ccc(cc1C1=CCCCC1)-c1cccnc1)c1ncc([nH]1)C#N |t:10|
BDBM50321356 [O-][n+]1ccccc1-c1ccc(NC(=O)c2nc(c[nH]2)C#N)c(c1)C1=CCCCC1 |t:26|
BDBM50321357 O=C(Nc1ccc(cc1C1=CCCCC1)-c1ccccn1)c1ncc([nH]1)C#N |t:10|
BDBM50321358 Nc1ccc(cn1)-c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:26|
BDBM50321359 COc1ccc(cn1)-c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:27|
BDBM50321360 CN(C)S(=O)(=O)c1ccc(cc1)-c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:31|
BDBM50321361 Nc1ccc(cc1)-c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:26|
BDBM50321362 O=C(Nc1ccc(cc1C1=CCCCC1)-c1ccccc1)c1ncc([nH]1)C#N |t:10|
BDBM50321363 O=C(Nc1ccc(cc1C1=CCCCC1)C1CC(=O)NC(=O)C1)c1ncc([nH]1)C#N |t:10|
BDBM50321364 CC1(C)CCC(=CC1)c1cc(ccc1NC(=O)c1ncc([nH]1)C#N)C1CC(=O)NC(=O)C1 |c:5|
BDBM50321365 CN1C(=O)CC(CC1=O)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:28|
BDBM50321366 O=C(Nc1ccc(cc1C1=CCCCC1)C1CNC(=O)NC1)c1ncc([nH]1)C#N |t:10|
BDBM50321367 CN1CC(CN(C)C1=O)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:28|
BDBM50321368 CN1CC(CN(C)C1=O)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:28|
BDBM50321369 CN1CC(CN(C)C1=O)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCCC1 |t:28|
BDBM50321370 O=C(Nc1ccc(cc1C1=CCCCC1)C1CNS(=O)(=O)NC1)c1ncc([nH]1)C#N |t:10|
BDBM50321371 CN1CC(CN(C)S1(=O)=O)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:29|
BDBM50321372 CC1(C)CCC(=CC1)c1cc(ccc1NC(=O)c1ncc([nH]1)C#N)C1CNC(NC1)=NC#N |c:5,(11.18,-14.71,;11.96,-16.05,;12.71,-14.71,;10.62,-16.82,;10.63,-18.36,;11.95,-19.12,;13.29,-18.35,;13.29,-16.82,;11.95,-20.65,;10.63,-21.42,;10.62,-22.96,;11.96,-23.73,;13.29,-22.96,;13.29,-21.42,;14.6,-20.61,;15.94,-21.38,;15.94,-22.91,;17.26,-20.6,;18.67,-21.23,;19.7,-20.08,;18.92,-18.75,;17.42,-19.08,;19.53,-17.35,;20.15,-15.93,;9.3,-23.73,;7.97,-22.95,;6.62,-23.7,;6.63,-25.24,;7.96,-26.02,;9.3,-25.26,;5.3,-26.01,;3.96,-25.24,;2.63,-24.47,)|
BDBM50321373 CN1CC(CN(C)C1=NC#N)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:30|
BDBM50321374 CN1CC(CN(C)C1=NS(C)(=O)=O)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:32,(-4.16,-42.5,;-4.16,-40.96,;-2.81,-40.2,;-2.82,-38.66,;-4.15,-37.88,;-5.48,-38.65,;-6.81,-37.87,;-5.49,-40.19,;-6.82,-40.95,;-8.15,-40.17,;-8.15,-38.63,;-9.65,-39.76,;-8.93,-41.5,;-1.49,-37.89,;-.16,-38.66,;1.18,-37.89,;1.18,-36.34,;2.51,-35.57,;3.84,-36.33,;3.85,-37.87,;5.17,-35.56,;6.58,-36.19,;7.61,-35.04,;6.83,-33.71,;5.32,-34.04,;7.44,-32.3,;8.06,-30.89,;-.16,-35.58,;-1.49,-36.35,;-.16,-34.05,;1.17,-33.28,;1.17,-31.74,;-.16,-30.97,;-.94,-29.63,;.6,-29.63,;-1.49,-31.74,;-1.49,-33.29,)|
BDBM50324271 CCOC(=O)CCc1c(C=C2C(=O)Nc3ccc(NS(=O)(=O)c4ccccc4)cc23)[nH]c2CCCC(=O)c12 |w:9.8|
BDBM50324277 CN(C)CCCc1c(C=C2C(=O)Nc3ccc(NS(=O)(=O)c4ccccc4)cc23)[nH]c2CCCC(=O)c12 |w:8.7|
BDBM50322823 CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1O[C@H]1CCOC1 |r|
BDBM50326198 CNc1nccc(n1)-c1cccnc1Oc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1C
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|
BDBM50312735 Nc1ncc(nc1NCc1c(Cl)cccc1Cl)-c1ccc(cc1)C(=O)N1CCC[C@H]1CN1CCCC1 |r|
BDBM50312736 Nc1ncc(nc1OCc1c(Cl)cccc1Cl)-c1ccc(cc1)C(=O)N1CCC[C@H]1CN1CCCC1 |r|
BDBM50312737 Cn1cc(cn1)-c1cnc(N)c(NCc2c(Cl)cccc2Cl)n1
BDBM50312738 Cn1cc(cn1)-c1cnc(N)c(OCc2c(Cl)cccc2Cl)n1
BDBM50312739 Cn1cc(cn1)-c1cnc(N)c(OCc2ccccc2Cl)n1
BDBM50312740 COc1ccc(COc2ccc(COc3nc(cnc3N)-c3cnn(C)c3)cc2OC)cc1
BDBM50312741 COc1ccc(COc2cnc(COc3nc(cnc3N)-c3cnn(C)c3)cc2OC)cc1
BDBM50312742 COc1ccc(COc2ncc(COc3nc(cnc3N)-c3cnn(C)c3)cc2OC)cc1
BDBM50312743 COc1ccc(COc2ncc(Oc3nc(cnc3N)-c3cnn(C)c3)cc2OC)cc1
BDBM50331096 COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCCCN1CCCC1
BDBM50338201 CCNC(=O)Nc1ccc(Oc2ncnc(N)c2\C=N\OC)cc1Cl
BDBM50332294 Cc1cnc(Nc2ccc(OCCN3CCCC3)cc2)nc1Nc1cccc(c1)S(=O)(=O)NC(C)(C)C
BDBM50346238 Oc1ccccc1C1CC(=NN1C(=O)c1cccs1)c1cccnc1 |c:10|
BDBM50346239 Oc1ccccc1C1CC(=NN1C(=O)c1ccc[nH]1)c1cccnc1 |c:10|
BDBM50346240 CCOc1cccc2cc(oc12)C(=O)N1N=C(CC1c1ccccc1O)c1cccnc1 |c:17|
BDBM50346241 Oc1ccccc1C1CC(=NN1C(=O)c1ccc(Br)o1)c1cccnc1 |c:10|
BDBM50346242 Oc1ccccc1C1CC(=NN1C(=O)c1cccc(c1)-n1cccn1)c1cccnc1 |c:10|
BDBM50346243 Oc1ccccc1C1CC(=NN1C(=O)c1ccco1)c1cccnc1 |c:10|
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|
BDBM50362058 COc1cc2ncnc(Oc3ccc(CC(=O)Nc4cnn(c4)C(C)C)cc3)c2cc1OC
BDBM50362059 COc1cccc(NC(=O)Cn2cc(Nc3ncnc4cc(OC)c(OC)cc34)cn2)c1
BDBM50362060 COc1cc2ncnc(Nc3cnn(CC(=O)Nc4ccc(cc4)N(C)C)c3)c2cc1OC
BDBM50362061 COc1cc2ncnc(Nc3cnn(CC(=O)Nc4cccc(F)c4)c3)c2cc1OC
BDBM50362062 COc1cc2ncnc(Nc3cnn(CC(=O)Nc4ccc(cn4)N(C)C)c3)c2cc1OC
BDBM50362063 COc1cc2ncnc(Oc3cnn(CC(=O)Nc4ccc(cn4)N(C)C)c3)c2cc1OC
BDBM50362064 COc1cccc(NC(=O)Cn2cc(Oc3ncnc4cc(OC)c(OC)cc34)cn2)c1
BDBM50362065 COCCOc1cc2ncnc(Oc3cnn(CC(=O)Nc4cccc(OC)c4)c3)c2cc1OC
BDBM50362066 COCCOc1cc2c(Oc3cnn(CC(=O)Nc4cccc(OC)c4)c3)ncnc2cc1OC
BDBM50362067 COc1cccc(NC(=O)Cn2cc(Oc3ncnc4cc(OC)c(OCCN5CCCCC5)cc34)cn2)c1
BDBM50362068 COc1cccc(NC(=O)Cn2cc(Oc3ncnc4cc(OCCN5CCCC5)c(OC)cc34)cn2)c1
BDBM50362069 COc1cccc(NC(=O)Cn2cc(Oc3ncnc4cc(OC)cc(OC)c34)cn2)c1
BDBM50362070 COc1cccc(NC(=O)Cn2cc(Oc3ccnc4cc(OC)c(cc34)C#N)cn2)c1
BDBM50362071 COc1cccc(NC(=O)Cn2cc(Oc3ccnc4cc(OC)c(OC)cc34)cn2)c1
BDBM50362072 CCn1cc(NC(=O)Cn2cc(Oc3ncnc4cc(OC)c(OC)cc34)cn2)cn1
BDBM50362073 CCn1cc(NC(=O)Cc2cc(Oc3ccnc4cc(OC)c(OC)cc34)[nH]n2)cn1
BDBM50362074 COc1cc2ncnc(Oc3ccc(CC(=O)Nc4ccc(cn4)N(C)C)cc3)c2cc1OC
BDBM50362075 COc1cccc(NC(=O)Cc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2)c1
BDBM50362076 COc1cccc(NC(=O)Cc2ccc(Nc3ncnc4cc(OC)c(OC)cc34)cc2)c1
BDBM50362077 COc1cccc(NC(=O)Cc2cccc(Oc3ncnc4cc(OC)c(OC)cc34)c2)c1
BDBM50362078 COc1cccc(NC(=O)NCc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2)c1
BDBM50362079 COc1cccc(c1)S(=O)(=O)NCc1ccc(Oc2ncnc3cc(OC)c(OC)cc23)cc1
BDBM50362080 COc1cccc(c1)C(=O)NCc1ccc(Oc2ncnc3cc(OC)c(OC)cc23)cc1
BDBM50362081 COc1cccc(CNC(=O)c2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2)c1
BDBM50362082 COc1cccc(CC(=O)Nc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2)c1
BDBM50362083 COc1cccc(COc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2)c1
BDBM50362084 CCc1cc(NC(=O)Cc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2)[nH]n1
BDBM50362085 CCn1ccc(NC(=O)Cc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2)n1
BDBM50362086 COc1cc2ncnc(Oc3ccc(CC(=O)Nc4cn[nH]c4)cc3)c2cc1OC
BDBM50362087 COc1cc2ncnc(Oc3ccc(CC(=O)Nc4cnn(C)c4)cc3)c2cc1OC
BDBM50362088 CCn1cc(NC(=O)Cc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2)cn1
BDBM50362089 CCn1cc(NC(=O)Cc2ccc(Oc3ccnc4cc(OC)c(OC)cc34)cc2)cn1
BDBM50362090 COc1cc2ncnc(Nc3ccc(CC(=O)Nc4cnn(c4)C(C)C)cc3)c2cc1OC
BDBM50375134 CCOC(=O)c1nc2cnc(Nc3ccccc3)nc2n(-c2ccccc2)c1=O
BDBM50375135 NC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(NCCCn3ccnc3)ncc2c1=O
BDBM50375136 CN1CCN(CCCNc2ncc3c(n2)n(cc(C(N)=O)c3=O)-c2ccc3CCCc3c2)CC1
BDBM50375137 NC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(NCCN3CCOCC3)ncc2c1=O
BDBM50375138 NC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3cccc(c3)C(=O)N3CCCCC3)ncc2c1=O
BDBM50375139 CN(C)CCc1ccc(Nc2ncc3c(n2)n(cc(C(N)=O)c3=O)-c2ccc3CCCc3c2)cc1
BDBM50375140 CN(C)Cc1ccc(Nc2ncc3c(n2)n(cc(C(N)=O)c3=O)-c2ccc3CCCc3c2)cc1
BDBM50375141 NC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(CN4CCOCC4)cc3)ncc2c1=O
BDBM50375142 NC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(cc3)C3CCNCC3)ncc2c1=O
BDBM50375143 CN1CCN(CC1)c1ccc(Nc2ncc3c(n2)n(cc(C(N)=O)c3=O)-c2ccc3CCCc3c2)c(O)c1
BDBM50375144 CN1CCN(CC1)c1cccc(Nc2ncc3c(n2)n(cc(C(N)=O)c3=O)-c2ccc3CCCc3c2)c1
BDBM50375145 NC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(cc3)N3CCNCC3)ncc2c1=O
BDBM50375146 NC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccccc3)ncc2c1=O
BDBM50375147 CNC(=O)c1cn(Cc2ccccc2)c2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2c1=O
BDBM50375148 CN1CCN(CC1)c1ccc(Nc2ncc3c(n2)n(cc(C(N)=O)c3=O)C2CC3CCC2C3)cc1 |w:31.33,28.31,26.28,TEB:18:26:29.30:32|
BDBM50375149 CN1CCN(CC1)c1ccc(Nc2ncc3c(n2)n(cc(C(N)=O)c3=O)C2CCCC2)cc1
BDBM50375150 CN1CCN(CC1)c1ccc(Nc2ncc3c(n2)n(cc(C(N)=O)c3=O)C2CCCCC2)cc1
BDBM50375151 CCNC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2c1=O
BDBM50375152 CNC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2c1=O
BDBM50375153 CN1CCN(CC1)c1ccc(Nc2cc3n(cc(C(N)=O)c(=O)c3cn2)-c2ccc3CCCc3c2)cc1
BDBM50375154 CN1CCN(CC1)c1ccc(Nc2ncc3c(n2)n(cc(C(O)=O)c3=O)-c2ccc3CCCc3c2)cc1
BDBM50375155 CN1CCN(Cc2ccc(Nc3ncc4c(n3)n(cc(C(N)=O)c4=O)-c3ccc4CCCc4c3)cc2)CC1
BDBM50375156 CCOC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2c1=O
BDBM50375157 NC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(C[C@H]4COC(=O)N4)cc3)ncc2c1=O
BDBM50375158 NC(=O)c1cn(-c2ccc3CCCc3c2)c2nc(Nc3ccc(CCN4CCOCC4)cc3)ncc2c1=O
BDBM50375159 CC1CN(CC(C)N1)c1ccc(Nc2ncc3c(n2)n(cc(C(N)=O)c3=O)-c2ccc3CCCc3c2)cc1 |w:1.0,5.5|
BDBM50375160 CN1CCN(CC1)c1ccc(Nc2ncc3c(n2)n(cc(C(N)=O)c3=O)-c2ccccc2)cc1
BDBM50375646 c1ccc(cc1)-c1[nH]nc2c3ccccc3oc12
BDBM50371914 CCc1ccc(cc1)-c1c(-c2c[nH]c(C)n2)c(=O)[nH]c2ccc(Cl)cc12
BDBM50371915 CCc1ccc(cc1)-c1c(-c2c[nH]c(C)n2)c(=O)[nH]c2ccc(cc12)C#N
BDBM50371916 CCOC(=O)c1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O
BDBM50371917 Cc1cc(on1)-c1c(-c2cccc(C)c2)c2cc(Cl)ccc2[nH]c1=O
BDBM50371918 Cc1cc(on1)-c1c(C2CCCCC2)c2cc(Cl)ccc2[nH]c1=O
BDBM50371919 Cc1cc(on1)-c1c(C2=CCCCCC2)c2cc(Cl)ccc2[nH]c1=O |t:9|
BDBM50371920 Cc1cc(on1)-c1c(C2=CCCCC2)c2cc(Cl)ccc2[nH]c1=O |t:9|
BDBM50371921 Cc1cc(on1)-c1c(-c2ccc(O)cc2)c2cc(Cl)ccc2[nH]c1=O
BDBM50371922 CC(C)c1ccc(cc1)-c1c(-c2cc(C)no2)c(=O)[nH]c2ccc(Cl)cc12
BDBM50371923 CCc1ccc(cc1)-c1c(-c2cc(C)no2)c(=O)[nH]c2ccc(Cl)cc12
BDBM50371924 Cc1cc(on1)-c1c(-c2ccccc2)c2ncccc2[nH]c1=O
BDBM50371925 Cc1cc(on1)-c1c(-c2ccccc2)c2cc(Cl)ncc2[nH]c1=O
BDBM50371926 Cn1cnc(c1)-c1c(-c2ccccc2)c2cc(ccc2[nH]c1=O)C#N
BDBM50371927 O=c1[nH]c2ccc(cc2c(-c2ccccc2)c1-c1c[nH]cn1)C#N
BDBM50371928 Clc1ccc2[nH]c(=O)c(-c3c[nH]cn3)c(-c3ccccc3)c2c1
BDBM50371929 Clc1ccc2[nH]c(=O)c(-c3ccc[nH]3)c(-c3ccccc3)c2c1
BDBM50371930 Nc1cc(on1)-c1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O
BDBM50371931 CC(C)c1cc(on1)-c1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O
BDBM50371932 Cc1cc(on1)-c1c(-c2ccccc2)c2cc(N)ccc2[nH]c1=O
BDBM50371933 Cc1cc([o+][n-]1)-c1c(-c2ccccc2)c2cc(ccc2[nH]c1=O)[N+]([O-])=O
BDBM50371934 Cc1cc(on1)-c1c(-c2ccccc2)c2cc(ccc2[nH]c1=O)C#N
BDBM50371935 Cc1cc(on1)-c1c(-c2ccncc2)c2cc(Cl)ccc2[nH]c1=O
BDBM50371936 COc1ccc(cc1)-c1c(-c2cc(C)no2)c(=O)[nH]c2ccc(Cl)cc12
BDBM50371937 Cc1cc(on1)-c1c(-c2ccc(C)cc2)c2cc(Cl)ccc2[nH]c1=O
BDBM50371938 Cc1cc(on1)-c1c(-c2ccccc2)c2cc(Cl)cnc2[nH]c1=O
BDBM50371939 Cc1cc(n[nH]1)-c1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O
BDBM50371940 Cc1cc(on1)-c1c(-c2ccccc2)c2ccccc2[nH]c1=O
BDBM50371941 Cc1cc(on1)-c1c(-c2ccccc2)c2cc(F)ccc2[nH]c1=O
BDBM50372153 Nc1n[nH]c2nccc(-c3ccc(NC(=O)Nc4cccc(c4)C(F)(F)F)cc3)c12
BDBM50372158 Cc1cccc(NC(=O)Nc2ccc(cc2)-c2cncc3n(C)nc(N)c23)c1
BDBM50381698 Cc1cccc(NC(=O)Nc2ccc(cc2)-c2csc3c(cnc(N)c23)-c2cn[nH]c2)c1
BDBM50381703 Cn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2cccc(F)c2)cc1
BDBM50381920 CCn1cc(NC(=O)Cc2ccc(Oc3ccnc4ccc(OC)cc34)cc2OC)cn1
BDBM50381921 COc1cc(Oc2ccnc3cc(F)ccc23)ccc1CC(=O)Nc1noc(C)c1C
BDBM50381922 CCn1cc(NC(=O)Cc2ccc(Oc3ccnc4cc(OC)c(OC)cc34)cn2)cn1
BDBM50381923 CCn1cc(NC(=O)Cc2ccc(Oc3ccnc4cc(OC)c(OC)cc34)cc2OC)cn1
BDBM50381924 CCc1cn[nH]c1NC(=O)Cc1ccc(Oc2ccnc3cc(OC)ccc23)cc1OC
BDBM50381925 COc1cc(Oc2ccnc3ccc(F)cc23)ccc1CC(=O)Nc1noc(C)c1C
BDBM50381926 COc1ccc2c(Oc3ccc(CC(=O)Nc4cn(C)nc4C)c(OC)c3)ccnc2c1
BDBM50381928 CCOc1cc2nccc(Oc3cnc(CC(=O)Nc4[nH]nc(CC)c4C)c(OC)c3)c2cc1OC
BDBM50381929 CCn1cc(NC(=O)Cc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2OC)cn1
BDBM50381930 CCn1cc(NC(=O)Cc2ncc(Oc3ccnc4cc(OC)ccc34)cc2OC)cn1
BDBM50381931 COc1ccc2c(Oc3ccc(CC(=O)Nc4ncc(C)s4)c(OC)c3)ccnc2c1
BDBM50381932 CCn1cc(NC(=O)Cc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)c(OC)c2)cn1
BDBM50381933 COc1cc(Oc2ncnc3cc(OC)c(OC)cc23)ccc1CC(=O)Nc1cn(C)nc1C
BDBM50381934 CCn1cc(NC(=O)Cc2ccc(Oc3ccnc4cc(F)ccc34)cc2OC)cn1
BDBM50381935 CCn1cc(NC(=O)Cc2ccc(Oc3ccnc4ccc(F)cc34)cc2OC)cn1
BDBM50381936 COc1ccc2c(Oc3ccc(CC(=O)Nc4noc(C)c4C)c(OC)c3)ccnc2c1
BDBM50381937 COc1ccc2nccc(Oc3ccc(CC(=O)Nc4noc(C)c4C)c(OC)c3)c2c1
BDBM50381938 COc1ccc2c(Oc3ccc(CC(=O)Nc4[nH]nc(C)c4C)c(OC)c3)ccnc2c1
BDBM50381939 COc1cc(Oc2ccnc3cc(OC)c(OC)cc23)ccc1CC(=O)Nc1cn(C)nc1C
BDBM50381940 COc1ccc2c(Oc3ccc(CC(=O)Nc4cnn(C)c4C)c(OC)c3)ccnc2c1
BDBM50381941 COc1ccc2c(Oc3ccc(CC(=O)Nc4cnn(C)c4)c(OC)c3)ccnc2c1
BDBM50381942 COc1ccc2c(Oc3ccc(CC(=O)Nc4cc(C)nn4C)c(OC)c3)ccnc2c1
BDBM50381943 COc1ccc2c(Oc3cnc(CC(=O)Nc4cn(C)nc4C)c(OC)c3)ccnc2c1
BDBM50381944 CCc1n[nH]c(NC(=O)Cc2ncc(Oc3ccnc4cc(OC)c(OC)cc34)cc2OC)c1C
BDBM50381945 COc1cc(Oc2ccnc3cc(OC)c(OC)cc23)ccc1CC(=O)Nc1noc(C)c1C
BDBM50381947 CCc1cc(NC(=O)Cc2ccc(Oc3ccnc4cc(OC)ccc34)cc2OC)no1
BDBM50381948 CCc1cc(NC(=O)Cc2ccc(Oc3ccnc4cc(OC)ccc34)cc2OC)[nH]n1
BDBM50381949 CCn1cc(NC(=O)Cc2ccc(Oc3ccnc4cc(OC)ccc34)cc2OC)cn1
BDBM50381950 COc1ccc2c(Oc3ccc(CC(=O)Nc4cc(C)cc(CN(C)C)c4)c(OC)c3)ccnc2c1
BDBM50381951 COc1cc2nccc(Oc3ccc(CC(=O)Nc4cn(C)nc4C)cc3)c2cc1OC
BDBM50381716 Nc1ncc(-c2cnn(CCO)c2)c2scc(-c3ccc(NC(=O)Nc4cccc(F)c4)cc3)c12
BDBM50382959 COc1cc2ncnc(Oc3cccc(NC(=O)Nc4cc(on4)C(C)(C)C(F)(F)F)c3)c2cc1OC
BDBM50381719 C[C@@H](O)Cn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2cccc(F)c2)cc1 |r|
BDBM50377054 CC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCS(=O)(=O)CC1 |t:28|
BDBM50377057 O=C(Nc1ccc(cc1C1=CCCC1)C1CCNCC1)c1ncc([nH]1)C#N |t:10|
BDBM50377058 O=C(Nc1ccc(cc1C1=CCCCC1)C1CCNCC1)c1ncc([nH]1)C#N |t:10|
BDBM50377059 CC1CCN(CC1)c1cc(ccc1NC(=O)c1ccc(o1)C#N)C1CCN(CC1)C(C)=O
BDBM50377060 CC1CCN(CC1)c1cc(ccc1NC(=O)c1ccc(o1)C#N)C1=CCNCC1 |t:26|
BDBM50377061 CC1CCN(CC1)c1cc(ccc1NC(=O)c1ccc(o1)C#N)C#CCN1CCOCC1
BDBM50377062 CC1CCN(CC1)c1cc(ccc1NC(=O)c1ccc(o1)C#N)C#CCN(C)S(C)(=O)=O
BDBM50377063 CC1CCN(CC1)c1cc(\C=C\C(O)=O)ccc1NC(=O)c1ccc(o1)C#N
BDBM50377064 CC1CCN(CC1)c1cc(\C=C\C(=O)OC(C)(C)C)ccc1NC(=O)c1ccc(o1)C#N
BDBM50377065 CN1CCN(CC1)c1ccc(NC(=O)c2ccc(o2)C#N)c(c1)C1=C(C)CCCC1 |c:26|
BDBM50377066 CN1CCN(CC1)c1ccc(NC(=O)c2ccc(o2)C#N)c(c1)C1=CCCCC1 |t:26|
BDBM50377067 CN1CCN(CC1)c1ccc(NC(=O)c2ccc(o2)C#N)c(c1)C1=CCOCC1 |t:26|
BDBM50377068 CN1CCN(CC1)c1ccc(NC(=O)c2ccc(o2)C#N)c(c1)-c1sccc1C
BDBM50377069 CN1CCN(CC1)c1ccc(NC(=O)c2ccc(o2)C#N)c(c1)-c1ccccc1F
BDBM50377070 CC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1CCCN=C1 |c:32|
BDBM50377071 CC1CCC(=CC1)c1cc(ccc1NC(=O)c1ncc([nH]1)C#N)C1CCNCC1 |c:4|
BDBM50377072 CC1CCN(CC1)c1cc(ccc1NC(=O)c1ccc(o1)C#N)C1CCNCC1
BDBM50377073 CC1CCN(CC1)c1cc(ccc1NC(=O)c1ccc(o1)C#N)C#CCN(C)C
BDBM50377074 CC1CCN(CC1)c1cc(ccc1NC(=O)c1ccc(o1)C#N)-c1ccncc1
BDBM50377075 CN1CCN(CC1)c1ccc(NC(=O)c2ccc(o2)C#N)c(c1)-c1ccsc1C
BDBM50377076 CN1CCN(CC1)c1ccc(NC(=O)c2ccc(o2)C#N)c(c1)-c1ccccc1C
BDBM50379186 CC(C)Cn1c2ccc(Nc3ncccn3)cc2c2c3CNC(=O)c3c3-c4cn(C)nc4CCc3c12
BDBM50399537 Cc1cc(C(=O)Nc2cc(Oc3ccc4nc(NC(=O)C5CC5)cn4n3)ccc2C)n(C)n1
BDBM50384879 C(CN1CCCC1)Oc1ccc2Nc3nccc(n3)-c3ccc(COC\C=C\COCc1c2)o3 |t:28|
BDBM50388873 CNCC#Cc1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2cccc(C)c2)cc1
BDBM50388874 CC(C)(C(N)=O)n1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(NC(=O)Nc2cccc(F)c2)cc1
BDBM50388880 Cc1cccc(NC(=O)Nc2ccc(cc2)-c2csc3c(cnc(N)c23)C#CC(C)(C)N)c1
BDBM50393536 O=C(Nc1ccc(cc1C1=CCCCC1)C1CCN(CC1)c1ccccn1)c1ncc([nH]1)C#N |t:10|
BDBM50393537 O=C(Nc1ccc(cc1C1=CCCCC1)C1CCN(CCC#N)CC1)c1ncc([nH]1)C#N |t:10|
BDBM50393538 O=C(Nc1ccc(cc1C1=CCCCC1)C1CCN(Cc2ccccn2)CC1)c1ncc([nH]1)C#N |t:10|
BDBM50393539 OCCN1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:28|
BDBM50393540 OCC(CO)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:30|
BDBM50393541 CS(=O)(=O)CCN1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:31|
BDBM50393542 NC(=O)CN1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:29|
BDBM50393543 OC(=O)CN1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:29|
BDBM50393544 O=C(Nc1ccc(cc1C1=CCCCC1)C1CCN(CCN2CCOCC2)CC1)c1ncc([nH]1)C#N |t:10|
BDBM50393545 O=C(Nc1ccc(cc1C1=CCCCC1)C1CCN(CC1)C(=O)c1cccnc1)c1ncc([nH]1)C#N |t:10|
BDBM50393547 OC[C@@H](O)C(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |r,t:31|
BDBM50393548 OCCNCC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:32|
BDBM50393549 CN(CCO)CC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:33|
BDBM50393550 CS(=O)(=O)CC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:32|
BDBM50393551 [O-][n+]1cccc(c1)C(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:35|
BDBM50393552 [O-][n+]1ccc(cc1)C(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:35|
BDBM50393553 O=C(Cc1cnc[nH]1)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:34|
BDBM50393554 Cn1cnc(CC(=O)N2CCC(CC2)c2ccc(NC(=O)c3ncc([nH]3)C#N)c(c2)C2=CCCCC2)c1 |t:33|
BDBM50393555 O=C(Cc1ccccn1)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:35|
BDBM50393556 O=C(Cc1cccnc1)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:35|
BDBM50393557 O=C(Cc1ccncc1)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:35|
BDBM50393558 O=C(CCN1CCOCC1)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:36|
BDBM50393559 O=C(CN1CCOCC1)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:35|
BDBM50393560 CC(C)(N)CC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:32|
BDBM50393561 CC(C)(N)C(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:31|
BDBM50393562 OCCNC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:31|
BDBM50393563 NC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:28|
BDBM50386749 Cc1ccc(NC(=O)Nc2nnc(Sc3ncnc4cc(OCCCN5CCOCC5)ccc34)s2)cc1
BDBM50400600 CN1C(C)(C)CC(CC1(C)C)Oc1ccc(nc1)C(=O)Nc1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1
BDBM50400601 CCN1CCC(CC1)Oc1ccc(nc1)C(=O)Nc1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1
BDBM50400602 CCN1C(C)(C)CC(CC1(C)C)Oc1ccc(nc1)C(=O)Nc1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1
BDBM50400603 CN1CCN(Cc2ccc(nc2)C(=O)Nc2ccc(NC(=O)Nc3cc(on3)C(C)(C)C)cc2)CC1
BDBM50400604 CCN1CCC(Cc2ccc(nc2)C(=O)Nc2ccc(NC(=O)Nc3cc(on3)C(C)(C)C)cc2)CC1
BDBM50400605 CC(C)(C)c1cc(NC(=O)Nc2ccc(NC(=O)c3ccc(OC4CCN(CC4)C4CC4)cn3)cc2)no1
BDBM50400606 CC(C)(C)N1CCC(CC1)Oc1ccc(nc1)C(=O)Nc1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1
BDBM50400607 CC(C)(C)c1cc(NC(=O)Nc2ccc(NC(=O)c3ccc(OC4CCN(CC(F)(F)F)CC4)cn3)cc2)no1
BDBM50400608 CC(C)N1CCC(CC1)Oc1ccc(nc1)C(=O)Nc1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1
BDBM50400609 CC(C)(C)c1cc(NC(=O)Nc2ccc(NC(=O)c3ccc(OC4CCNCC4)cn3)cc2)no1
BDBM50400610 CCN1CCC(CC1)Oc1ccnc(c1)C(=O)Nc1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1
BDBM50400611 CC(C)(C)c1cc(NC(=O)Nc2ccc(NC(=O)c3cc(OC4CCNCC4)ccn3)cc2)no1
BDBM50400612 Cc1ccc(nc1)C(=O)Nc1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1
BDBM50400613 Cc1ccnc(c1)C(=O)Nc1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1
BDBM50400614 CCN1CCC(CC1)c1ccc(nc1)C(=O)Nc1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1
BDBM50400615 CC(C)(C)c1cc(NC(=O)Nc2ccc(NC(=O)c3ccc(OC4CC(C)(C)NC(C)(C)C4)cn3)cc2)no1
BDBM50402020 CC(C)(C)Nc1c(Nc2ccnc(Nc3ccc(cc3)-c3ccncc3)n2)c(=O)c1=O
BDBM50415620 COc1cc2CCN=C(c3cccc(Cl)c3)c2cc1Cl |t:7|
BDBM50415616 COc1cc2CCN=C(c3ccc(Cl)c(Cl)c3)c2cc1Cl |t:7|
BDBM50411406 O=C(Nc1sc2N(CCCc2c1C#N)C(=O)C1CC1)c1cccc2ccccc12
BDBM50418163 NC(=O)c1cc(cc2c(c[nH]c12)C1CCCNC1)-c1ccccc1
BDBM50431519 CC(C)(O)c1ccc(cn1)-c1cnc2NC(=O)CN(CC3CCOCC3)c2n1
BDBM50433630 Fc1ccc(C(=O)Nc2ccc(Nc3ccnc4[nH]c(=O)c5ccccc5c34)cc2)c(c1)C(F)(F)F
BDBM50428696 CC(C)Nc1c(nnc2cc(ccc12)N1CCOCC1)C(N)=O
BDBM50428716 C[C@@H](Nc1c(nnc2cc(ccc12)-c1ccc(cc1)S(C)(=O)=O)C(N)=O)C1CC1 |r|
BDBM50428718 CC(C)Nc1c(nnc2cc(ccc12)-c1ccc(cc1)S(C)(=O)=O)C(N)=O
BDBM50423656 CO[C@H]1[C@@H](C[C@H]2O[C@@]1(C)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)c1ccccc1 |r|
BDBM50423773 C[C@]12O[C@@H](C[C@@]1(O)CO)n1c3ccccc3c3c4C(=O)NCc4c4c5ccccc5n2c4c13 |r|
BDBM50443118 CC(C)(OCCN1CCOCC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:31|
BDBM50443119 CC(C)(OCCN1CCCC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:30|
BDBM50443121 CC(C)(O)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:22|
BDBM50443122 CC1(C)CCC(=CC1)c1cc(CCS(=O)(=O)N2CCOCC2)ccc1NC(=O)c1ncc([nH]1)C#N |c:5|
BDBM50443123 O=C(Nc1ccc(CCS(=O)(=O)N2CCOCC2)cc1C1=CCCCC1)c1ncc([nH]1)C#N |t:22|
BDBM50443124 CC1(C)CCC(=CC1)c1cc(CCS(=O)(=O)NN)ccc1NC(=O)c1ncc([nH]1)C#N |c:5|
BDBM50443125 NNS(=O)(=O)CCc1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:25|
BDBM50443126 CC1(C)CCC(=CC1)c1cc(CCS(N)(=O)=O)ccc1NC(=O)c1ncc([nH]1)C#N |c:5|
BDBM50443127 NS(=O)(=O)CCc1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:24|
BDBM50443128 CC1(C)CCC(=CC1)c1cc(CCC(N)=O)ccc1NC(=O)c1ncc([nH]1)C#N |c:5|
BDBM50443129 NC(=O)CCc1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:23|
BDBM50443130 OC(=O)CCc1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:23|
BDBM50443132 O=C(Nc1ccc(CCN2CCOCC2)cc1C1=CCCCC1)c1ncc([nH]1)C#N |t:19|
BDBM50443133 CC1(C)CCC(=CC1)c1cc(CCO)ccc1NC(=O)c1ncc([nH]1)C#N |c:5|
BDBM50443134 OCCc1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:21|
BDBM50443136 CC(C)(O)Cc1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:23|
BDBM50443137 CC1(C)CCC(=CC1)c1cc(Cc2nnn[nH]2)ccc1NC(=O)c1ncc([nH]1)C#N |c:5|
BDBM50443138 O=C(Nc1ccc(Cc2nnn[nH]2)cc1C1=CCCCC1)c1ncc([nH]1)C#N |t:17|
BDBM50443139 O=C(Nc1ccc(CS(=O)(=O)N2CCOCC2)cc1C1=CCCCC1)c1ncc([nH]1)C#N |t:21|
BDBM50443140 CC1(C)CCC(=CC1)c1cc(CN2CCN(CCO)CC2)ccc1NC(=O)c1ncc([nH]1)C#N |c:5|
BDBM50443141 O=C(Nc1ccc(CN2CCOCC2)cc1C1=CCCCC1)c1ncc([nH]1)C#N |t:18|
BDBM50443142 CC1(C)CCC(=CC1)c1cc(ccc1NC(=O)c1ncc([nH]1)C#N)-c1nnn[nH]1 |c:5|
BDBM50443143 O=C(Nc1ccc(cc1C1=CCCCC1)S(=O)(=O)N1CCOCC1)c1ncc([nH]1)C#N |t:10|
BDBM50443144 CC1(C)CCC(=CC1)c1cc(ccc1NC(=O)c1ncc([nH]1)C#N)S(N)(=O)=O |c:5|
BDBM50443145 NS(=O)(=O)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:22|
BDBM50443146 CC1(C)CCC(=CC1)c1cc(ccc1NC(=O)c1ncc([nH]1)C#N)S(C)(=O)=O |c:5|
BDBM50443147 CC(O)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:21|
BDBM50443148 CC1(C)CCC(=CC1)c1cc(ccc1NC(=O)c1ncc([nH]1)C#N)C(O)=O |c:5|
BDBM50443149 CN(C)C(=O)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:23|
BDBM50443150 CC1(C)CCC(=CC1)c1cc(ccc1NC(=O)c1ncc([nH]1)C#N)C(N)=O |c:5|
BDBM50443151 NC(=O)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:21|
BDBM50443152 CC(C)(CN1CCN(CCO)CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:32|
BDBM50443153 CC(C)(CNCCS(C)(=O)=O)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:29|
BDBM50443154 COCCNCC(C)(C)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:27|
BDBM50443155 CC(C)(CN1CCS(=O)(=O)CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:31|
BDBM50443156 CC(=O)N1CCN(CC(C)(C)c2ccc(NC(=O)c3ncc([nH]3)C#N)c(c2)C2=CCC(C)(C)CC2)CC1 |t:29|
BDBM50443157 CC(C)(CN1CCOCC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:29|
BDBM50443158 CC(C)(CO)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:23|
BDBM50443159 COCCN1CCN(CC1)C(C)(C)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:32|
BDBM50443161 CC(=O)N1CCN(CC1)C(C)(C)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:31|
BDBM50443162 CCN1CCN(CC1)C(C)(C)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:30|
BDBM50443163 CN1CCN(CC1)C(C)(C)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:29|
BDBM50443164 CC(C)(N1CCS(=O)(=O)CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:30|
BDBM50443165 CC(C)(N1CCOCC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:28|
BDBM50443166 CC(C)(Nc1ccccn1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:29|
BDBM50443167 CC(=O)NCCNC(C)(C)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:28|
BDBM50443168 CC(C)(NCCN1CCOCC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:31|
BDBM50443169 CN(CCS(C)(=O)=O)C(C)(C)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:29|
BDBM50443170 CC(C)(NCCS(C)(=O)=O)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:28|
BDBM50443171 COCCN(C)C(C)(C)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCC(C)(C)CC1 |t:27|
BDBM50443173 O=C(Nc1ccc(cc1C1=CCCCC1)-c1nnn[nH]1)c1ncc([nH]1)C#N |t:10|
BDBM50447512 CN1CCN(CC1)c1ccc(Nc2ncc3cc(C#N)c(=O)n(C4CCCC4)c3n2)cc1
BDBM50446303 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@H]3CCNC[C@@H]3F)c2n1 |r|
BDBM50446304 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@@H]3CCNC[C@H]3F)c2n1 |r|
BDBM50446305 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@@H]3CCNC[C@@H]3F)c2n1 |r|
BDBM50446306 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(OC3CCNCC3)c2n1
BDBM50446307 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(OCCN)c2n1
BDBM50446308 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(OCc3cnc[nH]3)c2n1
BDBM50446309 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@@H]3CN[C@@H](C3)C(=O)OC)c2n1 |r|
BDBM50446310 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@H]3CN[C@@H](C3)C(=O)OC)c2n1 |r|
BDBM50446311 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@@H]3CNC[C@H]3OC)c2n1 |r|
BDBM50446312 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(OCC3CCNC3)c2n1
BDBM50446313 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(OCC3CNCCO3)c2n1
BDBM50446314 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@H]3CC[C@H](N)CC3)c2n1 |r,wU:26.28,wD:23.24,(30.19,-22.56,;31.74,-22.58,;32.49,-23.91,;34.04,-23.93,;34.79,-25.28,;36.34,-25.29,;37.28,-26.52,;38.79,-26.32,;39.38,-24.91,;40.83,-24.4,;40.8,-22.86,;39.33,-22.41,;38.46,-23.68,;36.93,-23.88,;42.17,-25.17,;42.17,-26.71,;43.51,-27.49,;44.84,-26.71,;46.18,-27.48,;47.52,-26.7,;47.51,-25.15,;46.17,-24.39,;46.16,-22.84,;47.48,-22.08,;48.8,-22.86,;50.13,-22.1,;50.15,-20.57,;51.48,-19.81,;48.82,-19.79,;47.48,-20.55,;44.84,-25.16,;43.5,-24.4,)|
BDBM50446315 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@@H]3CCNC[C@@H]3O)c2n1 |r|
BDBM50446316 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@@H]3CCNC[C@H]3O)c2n1 |r|
BDBM50446317 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@@H]3CCCNC3)c2n1 |r|
BDBM50446318 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@H]3CCCNC3)c2n1 |r|
BDBM50446319 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(OCC3(F)CCNCC3)c2n1
BDBM50446320 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(OCC3CCNCC3)c2n1
BDBM50446321 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(OC3CCN(C)CC3)c2n1
BDBM50446322 COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(OCC(C)(C)CN)c2n1
BDBM131925 CCc1nn(Cc2cnn(Cc3ccc(OC)cc3)c2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131926 CCc1nn(Cc2cnn(CCO)c2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131927 CCc1nn(Cc2cnn(c2)C2CCNC[C@H]2F)c2cccc(NC(=O)c3cnc4ccccn34)c12 |r|
BDBM131928 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(CC)ccn34)c12
BDBM131929 CCc1nn(Cc2cccc(CC)n2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM132020 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)N3CCNC(=O)C3)c12
BDBM132021 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)N3CCCNCC3)c12
BDBM132022 CCc1nn(Cc2ccn(CC)n2)c2cccc(NC(=O)c3cnc4cc(F)ccn34)c12
BDBM132023 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)-n3cncn3)c12
BDBM132024 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)-n3cnc(C)n3)c12
BDBM132025 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)-n3ncnc3C)c12
BDBM131930 CCc1nn(Cc2cccc(=O)n2C)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131931 CCc1nn(Cc2cccc(=O)n2CC)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131932 CCOc1cccc(Cn2nc(CC)c3c(NC(=O)c4cnc5ccccn45)cccc23)n1
BDBM131933 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)-c3nnco3)c12
BDBM131934 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)-c3nnc(C)o3)c12
BDBM131935 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(CN5CCNCC5)ccn34)c12
BDBM132026 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)-n3cnnc3C)c12
BDBM132027 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCC(O)CO)ccn34)c12
BDBM132028 CCc1nn(Cc2ccn(CC)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)-c3cnn(C)c3)c12
BDBM132029 CCc1nn(Cc2cc(C)n(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)-c3cnn(C)c3)c12
BDBM132030 CCc1nn(Cc2cc(C)n(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)-c3ccc(CN(C)C)o3)c12
BDBM132031 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(CCN5CC[C@@H](F)C5)ccn34)c12 |r|
BDBM131936 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(CN5CCN(C)CC5)ccn34)c12
BDBM131937 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(O[C@H]5CNC[C@@H]5O)ccn34)c12 |r|
BDBM131938 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(O[C@@H]5CNC[C@H]5O)ccn34)c12 |r|
BDBM131939 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(O[C@H]5CN(C)C[C@@H]5O)ccn34)c12 |r|
BDBM131940 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(O[C@@H]5CN(C)C[C@H]5O)ccn34)c12 |r|
BDBM131941 CCc1nn(Cc2cccc(OC[C@H]3NCC[C@@H]3O)n2)c2cccc(NC(=O)c3cnc4ccccn34)c12 |r|
BDBM132032 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(CCN5CCN(C)CC5)ccn34)c12
BDBM132033 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(CCN5CC(F)C5)ccn34)c12
BDBM132034 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(CCN(C)C)ccn34)c12
BDBM132035 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(CCN5CC(C5)OC)ccn34)c12
BDBM132036 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(CN(C)C)ccn34)c12
BDBM132037 CCc1nn(Cc2ccn(CC)n2)c2cccc(NC(=O)c3cnc4cc(CN(C)C)ccn34)c12
BDBM131942 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CC[N+](C)([O-])CC5)ccn34)c12
BDBM131943 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OC[C@H]5NCC[C@@H]5O)ccn34)c12 |r|
BDBM131944 CCc1nn(Cc2ccnn2CC)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131945 CCc1nn(Cc2ccn(CC)n2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131946 CCc1nn(Cc2cccc(OC[C@@H]3[C@@H](O)CCN3C)n2)c2cccc(NC(=O)c3cnc4ccccn34)c12 |r|
BDBM131947 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OC[C@@H]5[C@@H](O)CCN5C)ccn34)c12 |r|
BDBM132038 CN1CCN(CCOc2ccn3c(cnc3c2)C(=O)Nc2cccc3n(Cc4cnc(C)s4)nc(I)c23)CC1
BDBM132039 CN1CCN(CCOc2ccn3c(cnc3c2)C(=O)Nc2cccc3n(Cc4nnc(C)s4)nc(C4CC4)c23)CC1
BDBM132040 CN1CCN(CCOc2ccn3c(cnc3c2)C(=O)Nc2cccc3n(Cc4coc(C)n4)nc(C4CC4)c23)CC1
BDBM132041 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)-c3cncnc3)c12
BDBM132042 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)-c3ccc(C)nc3)c12
BDBM132043 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(CCCN5CCN(C)CC5)ccn34)c12
BDBM131948 CCc1nn(Cc2cccc(OCCN3CCNCC3)n2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131949 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)-c3nncs3)c12
BDBM131950 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CCN(C)CC5)ccn34)c12
BDBM131951 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)C(=O)NC3CCNC3)c12
BDBM131952 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)C(=O)NCCN)c12
BDBM131953 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)C(=O)NC)c12
BDBM132044 COCCOc1ccn2c(cnc2c1)C(=O)Nc1cccc2n(Cc3ccc(C)nc3)nc(OC)c12
BDBM132045 COCCOc1ccn2c(cnc2c1)C(=O)Nc1cccc2n(Cc3ccc(C)nc3)nc(Br)c12
BDBM132046 COc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CCN(C)CC5)ccn34)c12
BDBM132047 CCc1nn(Cc2nccs2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM132048 CCc1nn(Cc2ccc(C)nc2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM132049 CCc1nn(Cc2ccc(C)nc2)c2cccc(NC(=O)c3cnc4cc(OCCN5CCN(C)CC5)ccn34)c12
BDBM131954 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)C(=O)N(C)C)c12
BDBM131955 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)C(=O)NC3CCN(C)C3)c12
BDBM131956 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)C(=O)NCCN(C)C)c12
BDBM131957 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)-c3cnc(C)n3C)c12
BDBM131958 CCc1nn(Cc2ccc(C)n(C)c2=O)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131959 CCc1nn(Cc2cccc(OCCN3CCN(C)CC3)n2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM132050 CCc1nn(Cc2nccs2)c2cccc(NC(=O)c3cnc4cc(OCCN5CCN(C)CC5)ccn34)c12
BDBM132051 CCc1nn(Cc2nc(C)cs2)c2cccc(NC(=O)c3cnc4cc(OCCN5CCN(C)CC5)ccn34)c12
BDBM132052 CN1CCN(CCOc2ccn3c(cnc3c2)C(=O)Nc2cccc3n(Cc4ccc(C)nc4)nc(C4CC4)c23)CC1
BDBM132053 CCc1nn(Cc2csc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CCN(C)CC5)ccn34)c12
BDBM132054 CCc1nn(Cc2ccc(F)cn2)c2cccc(NC(=O)c3cnc4cc(OCCN5CCN(C)CC5)ccn34)c12
BDBM132055 CN1CCN(CCOc2ccn3c(cnc3c2)C(=O)Nc2cccc3n(Cc4ccc(F)cn4)nc(C4CC4)c23)CC1
BDBM131960 CCc1nn(Cc2cc(C)n(C)n2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131961 CCc1nn(Cc2cc(C)n(C)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CCN(C)CC5)ccn34)c12
BDBM131962 CCc1nn(Cc2ccn(C)n2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131963 CCc1nn(Cc2ccn(C)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CCN(C)CC5)ccn34)c12
BDBM131964 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)-c3cnc4CNCCn34)c12
BDBM131965 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)-c3cnc4CN(C)CCn34)c12
BDBM132056 CN1CCN(CCOc2ccn3c(cnc3c2)C(=O)Nc2cccc3n(Cc4csc(C)n4)nc(C4CC4)c23)CC1
BDBM132057 CCc1nn(Cc2csc(n2)C(C)C)c2cccc(NC(=O)c3cnc4cc(OCCN5CCN(C)CC5)ccn34)c12
BDBM132058 CC(C)c1nc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCCN6CCN(C)CC6)ccn45)cccc23)cs1
BDBM132059 CC(C)N1CCN(CCOc2ccn3c(cnc3c2)C(=O)Nc2cccc3n(Cc4ccc(F)cn4)nc(C4CC4)c23)CC1
BDBM132060 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(SCCNC(C)=O)ccn34)c12
BDBM132061 CN1CCN(CCOc2ccn3c(cnc3c2)C(=O)Nc2cccc3n(Cc4ccc(O)c(C)n4)nc(C4CC4)c23)CC1
BDBM131966 CCn1ccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCCN6CCN(C)CC6)ccn45)cccc23)n1
BDBM131967 CCn1ccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCCN6CCN(CC6)C(C)C)ccn45)cccc23)n1
BDBM131968 CC(C)n1ccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCCN6CCN(C)CC6)ccn45)cccc23)n1
BDBM131969 CC(C)N1CCN(CCOc2ccn3c(cnc3c2)C(=O)Nc2cccc3n(Cc4ccn(n4)C(C)C)nc(C4CC4)c23)CC1
BDBM131970 Cc1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(Cl)ccn45)cccc23)n1
BDBM131971 CCc1nn(Cc2cccc(OCC(O)CO)n2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM132062 Cc1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCc6ccccc6)ccn45)cccc23)n1
BDBM132063 Cc1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(O)ccn45)cccc23)n1
BDBM132064 CSc1ccn2c(cnc2c1)C(=O)Nc1cccc2n(Cc3cccc(C)n3)nc(C3CC3)c12
BDBM132065 Cc1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCCOCCOC=C)ccn45)cccc23)n1
BDBM132066 Cc1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCCOCCO)ccn45)cccc23)n1
BDBM132067 Cc1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(Br)ccn45)cccc23)n1
BDBM131972 CCc1nn(Cc2cccc(n2)N2CCNCC2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131973 CCc1nn(Cc2cccc(n2)N2CCC(N)CC2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131974 CCc1nn(Cc2cnn(CC)c2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131975 CCc1nn(Cc2cnn(CC3CC3)c2)c2cccc(NC(=O)c3cnc4ccccn34)c12
BDBM131976 Cc1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCCN6CC[N+](C)([O-])CC6)ccn45)cccc23)n1
BDBM131977 Cc1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCCN6CCNCC6)ccn45)cccc23)n1
BDBM132068 CN1CCN(CCOc2ccn3c(cnc3c2)C(=O)Nc2cccc3n(Cc4cccc(C)n4)nc(C4CC4)c23)CC1
BDBM132069 Cc1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCCN6CCC6)ccn45)cccc23)n1
BDBM132070 CCc1nn(Cc2ccn(CC)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)-n3cncn3)c12
BDBM131978 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4ccc(cn34)C#N)c12
BDBM131979 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CCN(CC5)C(C)C)ccn34)c12
BDBM131980 CC(C)N1CCN(CCOc2ccn3c(cnc3c2)C(=O)Nc2cccc3n(Cc4cccc(C)n4)nc(C4CC4)c23)CC1
BDBM131981 CN1CCN(CCOc2ccn3c(cnc3c2)C(=O)Nc2cccc3n(Cc4cccn(C)c4=O)nc(C4CC4)c23)CC1
BDBM131982 Cc1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(F)ccn45)cccc23)n1
BDBM131983 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCC5CCN(C)CC5)ccn34)c12
BDBM131984 CCN1CCN(CCOc2ccn3c(cnc3c2)C(=O)Nc2cccc3n(Cc4cccc(C)n4)nc(CC)c23)CC1
BDBM131985 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(O[C@@H]5CCN(C)C5)ccn34)c12 |r|
BDBM131986 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OC5CCN(C)CC5)ccn34)c12
BDBM131987 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CCCC5)ccn34)c12
BDBM131988 Cc1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCCN6CCOCC6)ccn45)cccc23)n1
BDBM131989 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(O[C@H]5CCN(C)C5)ccn34)c12 |r|
BDBM50020310 CN1CCN(CCC(=O)Nc2c(C)[nH]c(\C=C3/C(=O)Nc4ccc(F)cc34)c2C)CC1
BDBM131990 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCC5CN(CCO5)C(=O)OC(C)(C)C)ccn34)c12
BDBM131991 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCC(F)(F)CNC(=O)OC(C)(C)C)ccn34)c12
BDBM131992 CCc1nn(Cc2ccn(CC)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CCN(CC5)C(C)C)ccn34)c12
BDBM131993 Cc1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCCN6CCCC6)ccn45)cccc23)n1
BDBM131994 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CC[C@H](C5)OC)ccn34)c12 |r|
BDBM131995 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CC6CCC(C5)N6C)ccn34)c12
BDBM131996 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CC[C@@H](C5)OC)ccn34)c12 |r|
BDBM131997 CCc1nn(Cc2ccn(CC)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CCCC5)ccn34)c12
BDBM131998 CN1CCC(CC1)Oc1ccn2c(cnc2c1)C(=O)Nc1cccc2n(Cc3cccc(C)n3)nc(C3CC3)c12
BDBM131999 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CC[C@H](F)C5)ccn34)c12 |r|
BDBM132000 Cc1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCCN6CCS(=O)(=O)CC6)ccn45)cccc23)n1
BDBM132001 CCc1nn(Cc2ccn(CC)n2)c2cccc(NC(=O)c3cnc4cc(OC5CCN(C)CC5)ccn34)c12
BDBM132002 Cc1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCCN6CC7CCC(C6)O7)ccn45)cccc23)n1
BDBM132003 Cn1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCCN6CCCC6)ccn45)cccc23)c1=O
BDBM132004 CCc1nn(Cc2ccn(CC)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CCOCC5)ccn34)c12
BDBM132005 Cn1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCCN6CCOCC6)ccn45)cccc23)c1=O
BDBM132006 Cn1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCCN6CCC6)ccn45)cccc23)c1=O
BDBM132007 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CCNCC5)ccn34)c12
BDBM132008 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCCO)ccn34)c12
BDBM132009 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCC(F)(F)CN)ccn34)c12
BDBM132010 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OC5CNC5)ccn34)c12
BDBM132011 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCC5CNCCO5)ccn34)c12
BDBM132012 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CC[C@@H](F)C5)ccn34)c12 |r|
BDBM132013 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)N3CCNCC3)c12
BDBM132014 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)N3CCOCC3)c12
BDBM132015 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)N3CC[C@@H](O)C3)c12 |r|
BDBM132016 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)N3CCN(CCO)CC3)c12
BDBM132017 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)N3CCC(O)CC3)c12
BDBM132018 CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(ccn34)N3CC[C@H](O)C3)c12 |r|
BDBM132019 CCN1CCN(CC1)c1ccn2c(cnc2c1)C(=O)Nc1cccc2n(Cc3cccc(C)n3)nc(CC)c12
BDBM50043380 CNc1cc2ccc(cc2cn1)C#CCOc1ccc(CN2CCNCC2)c(c1)C(F)(F)F
BDBM60665 COc1cc(Nc2ncc(F)c(Nc3ccc4OC(C)(C)C(=O)Nc4n3)n2)cc(OC)c1OC
BDBM50086266 COc1cc(cc(OC)c1OC)-c1cnc2c(snc2c1)N1CCOCC1
BDBM50026612 COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)N(C)C(=O)CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
BDBM174907 COc1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)c(OC)n1
BDBM174908 Fc1ccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cc1F
BDBM174909 Fc1cc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cc(c1)C(F)(F)F
BDBM174910 Cc1cccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cn2)c1
BDBM174911 Cc1cnc2[nH]cc(Cc3cnc(NCc4ccc(Cl)nc4)nc3)c2c1
BDBM174912 Cc1cnc2[nH]cc(Cc3cnc(NCc4cccc(C)n4)nc3)c2c1
BDBM174913 Cc1cnc2[nH]cc(Cc3cnc(NCc4cccc(n4)N4CCOCC4)nc3)c2c1
BDBM174914 Cc1cnc2[nH]cc(Cc3cnc(NCc4cccc(n4)N4CCCC4)nc3)c2c1
BDBM174915 COc1ncccc1CNc1ncc(Cc2c[nH]c3ncc(C)cc23)cn1
BDBM174916 Cc1cnc2[nH]cc(Cc3cnc(NCc4cccnc4OC4CCCC4)nc3)c2c1
BDBM174917 COc1ncc(CNc2ccc(Cc3c[nH]c4ncc(cc34)C(F)(F)F)c(F)n2)cc1F
BDBM174918 COc1ncc(F)cc1CNc1ncc(Cc2c[nH]c3ncc(C)cc23)cn1
BDBM174919 COc1ncc(F)cc1CNc1ncc(Cc2c[nH]c3ncc(Cl)cc23)cn1
BDBM174920 Cc1cnc2[nH]cc(Cc3ccc(NCc4ccc(Cl)nc4)nc3F)c2c1
BDBM174921 COc1ccc(CNc2ccc(Cc3c[nH]c4ncc(C)cc34)c(F)n2)c(OC)n1
BDBM174922 Cc1cnc2[nH]cc(Cc3ccc(NCc4cccnc4F)nc3F)c2c1
BDBM174923 Cc1cnc2[nH]cc(Cc3ccc(NCc4ccnc(F)c4)nc3F)c2c1
BDBM174924 Cc1ccc(CNc2ccc(Cc3c[nH]c4ncc(C)cc34)c(F)n2)nc1
BDBM174925 CCS(=O)(=O)Nc1ccccc1CNc1ccc(Cc2c[nH]c3ncc(C)cc23)c(F)n1
BDBM174926 CCS(=O)(=O)Nc1cc(F)cc(CNc2ccc(Cc3c[nH]c4ncc(C)cc34)c(F)n2)c1
BDBM174927 Fc1cncc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)c(F)n2)c1
BDBM174928 COc1cnc2[nH]cc(Cc3ccc(NCc4cncc(F)c4)nc3F)c2c1
BDBM174929 COc1ccc(CNc2ccc(Cc3c[nH]c4ncc(C)cc34)c(F)n2)cn1
BDBM174930 COc1cnc2[nH]cc(Cc3ccc(NCc4ccc(OC)nc4)nc3F)c2c1
BDBM174931 Cc1cnc2[nH]cc(Cc3ccc(NCc4ccc(nc4)C(F)(F)F)nc3F)c2c1
BDBM174932 COc1cnc2[nH]cc(Cc3ccc(NCc4ccc(Cl)cc4)nc3F)c2c1
BDBM174933 Fc1cncc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cn2)c1
BDBM174934 COc1ccc(CNc2ccc(Cc3c[nH]c4ncc(F)cc34)c(F)n2)cn1
BDBM174935 FC(F)(F)c1cnc2[nH]cc(Cc3ccc(NCc4ccc(nc4)C(F)(F)F)nc3)c2c1
BDBM174936 Cc1cnc2[nH]cc(Cc3ccc(NCc4ccc(nc4)C(F)(F)F)nc3)c2c1
BDBM174938 CS(=O)(=O)Nc1cnc2[nH]cc(Cc3ccc(NCc4ccc(Cl)nc4)nc3F)c2c1
BDBM174939 COc1cnc2[nH]cc(Cc3ccc(NCc4ccccc4Cl)nc3F)c2c1
BDBM174940 COc1ccc(CNc2ncc(Cc3c[nH]c4ncc(C)cc34)cc2C)cn1
BDBM174941 COc1ccc(CNc2ncc(Cc3c[nH]c4ncc(C)cc34)cc2F)cn1
BDBM174942 COc1ccnc2[nH]cc(Cc3ccc(NCc4ccc(Cl)cc4)nc3F)c12
BDBM174943 COc1ccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
BDBM174944 COc1cnc2[nH]cc(Cc3ccc(NCc4cccnc4OC)nc3F)c2c1
BDBM174945 Fc1nc(NCc2ccc(Cl)cn2)ccc1Cc1c[nH]c2ncccc12
BDBM174946 COc1ncccc1CNc1ccc(Cc2c[nH]c3ncccc23)c(F)n1
BDBM174947 COc1cnc(CNc2ccc(Cc3c[nH]c4ncc(C)cc34)c(F)n2)cc1F
BDBM174948 COc1ncc(F)cc1CNc1ccc(Cc2c[nH]c3ncc(C)cc23)c(F)n1
BDBM174949 COc1ncccc1CNc1ccc(Cc2c[nH]c3ncc(C)cc23)c(F)n1
BDBM50026673 CCN1CCN(CC(=O)Nc2cc(Oc3ccc4n(C)c(Nc5cc(ccc5F)C(F)(F)F)nc4c3)ccn2)CC1
BDBM174950 COc1ccc(CNc2ncc(Cc3c[nH]c4ncc(C)cc34)cn2)cn1
BDBM174951 Cc1cnc2[nH]cc(Cc3ccc(NCc4cnccc4C(F)(F)F)nc3F)c2c1
BDBM174952 FC(F)(F)c1ccncc1CNc1ccc(Cc2c[nH]c3ncc(Cl)cc23)cn1
BDBM174953 Cc1cnc2[nH]cc(Cc3ccc(NCc4ccnc(C)c4)nc3F)c2c1
BDBM174954 Cc1cnc2[nH]cc(Cc3ccc(NCc4cnccc4C(F)(F)F)nc3)c2c1
BDBM174955 COc1cc(CNc2ccc(Cc3c[nH]c4ncc(C)cc34)c(F)n2)c(F)cn1
BDBM174956 COc1ncc(CNc2ncc(Cc3c[nH]c4ncc(C)cc34)cn2)cc1F
BDBM174957 Cc1cc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)c(F)n2)ccn1
BDBM174958 Cc1cnc2[nH]cc(Cc3cnc(NCc4ccc(nc4)C(F)(F)F)c(F)c3)c2c1
BDBM174959 COc1cnc2[nH]cc(Cc3cnc(NCc4ccc(nc4)C(F)(F)F)c(F)c3)c2c1
BDBM174960 COc1ccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)s2)cn1
BDBM174962 COc1cccc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)s2)n1
BDBM174963 COc1ncc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)c(F)n2)cc1F
BDBM174964 Fc1cc(Cc2c[nH]c3ncc(Cl)cc23)cnc1NCc1ccc(nc1)C(F)(F)F
BDBM174965 Clc1cnc2[nH]cc(Cc3ccc(NCc4ccc(Cl)nc4)nc3)c2c1
BDBM174966 Fc1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1
BDBM174967 COc1ncc(F)cc1CNc1ccc(Cc2c[nH]c3ncc(cc23)C#N)c(F)n1
BDBM164946 COc1ccc(COc2ccc(Cn3c(N)nc4cc(cnc34)C#CC3CCCCC3)cc2OC)cn1
BDBM164947 COc1ccc(COc2ccc(Cn3c(N)nc4cc(cnc34)C#CCCO)cc2OC)cn1
BDBM164948 COc1ccc(cn1)C(Oc1ccc(Cn2c(N)nc3cc(cnc23)-c2cnn(C)c2)cc1OC)C1CC1
BDBM164949 COc1cc2CCCC(Oc3ccc(Cn4c(N)nc5cc(cnc45)-c4cnn(C)c4)cc3OC)c2cn1
BDBM164950 COc1ccc(COc2ccc(cc2OC)C(C)n2c(N)nc3cc(ccc23)-c2cnn(C)c2)cn1
BDBM164951 COc1ccc(COc2ccc(cc2OC)C(C)n2c(N)nc3cc(ccc23)-c2ccc(F)cc2)cn1
BDBM164952 COc1cc(ccc1OCc1ccc(nc1)C(F)(F)F)C(C)n1cnc2cc(ccc12)-c1ccc(F)cc1
BDBM164953 COc1cc(ccc1OCc1ccc(nc1)C(F)(F)F)C(C)n1cnc2cc(ccc12)-c1cnn(C)c1
BDBM164954 COc1cc(ccc1OCc1ccc(nc1)C(F)(F)F)C(C)n1cnc2cc(ccc12)C#CCCO
BDBM164956 COc1cc(ccc1OCc1ccc(cc1)C(F)(F)F)[C@H](C)n1c(N)nc2cc(cnc12)-c1cnn(C)c1 |r|
BDBM164957 COc1cc(ccc1OCc1ccc(cc1)C(F)(F)F)[C@@H](C)n1c(N)nc2cc(cnc12)-c1cnn(C)c1 |r|
BDBM164961 COc1cc(ccc1OCc1ccc(nc1)C(F)(F)F)C(C)n1cnc2cc(cnc12)-c1cnn(C)c1
BDBM164962 COc1cc(ccc1OCc1ccc(nc1)C(F)(F)F)C(C)n1c(N)nc2cc(cnc12)-c1cnn(C)c1
BDBM164964 COc1cc(ccc1OCc1ccc(nc1)C(F)(F)F)C(C)n1c(N)nc2cc(cnc12)C#CCCO
BDBM164965 COc1cc(Cn2cnc3cc(cnc23)C#CCCO)ccc1OCc1ccc(nc1)C(F)F
BDBM164966 COc1ccc(cn1)C(C)Oc1ccc(Cn2cnc3cc(cnc23)-c2cnn(C)c2)cc1OC
BDBM164967 COc1ccc(cn1)C(C)Oc1ccc(Cn2cnc3cc(cnc23)-c2ccnn2C)cc1OC
BDBM164968 COc1ccc(cn1)C(C)Oc1ccc(Cn2cnc3cc(cnc23)-c2ccc(OC)nc2)cc1OC
BDBM164969 COc1ccc(cn1)C(C)Oc1ccc(Cn2cnc3cc(cnc23)-c2ccnc(F)c2)cc1OC
BDBM164885 COc1ccc(COc2ccc(Cn3c(N)nc4cc(ccc34)-c3cnn(C)c3)cc2OC)cc1
BDBM164886 COc1ccc(COc2ccc(Cn3c(N)nc4cc(ccc34)-c3cncnc3)cc2OC)cc1
BDBM164887 COc1ccc(COc2ccc(Cn3c(N)nc4cc(ccc34)-c3ccncc3)cc2OC)cc1
BDBM164888 COc1ccc(COc2ccc(Cn3c(N)nc4cc(ccc34)-c3cnn(CCN4CCOCC4)c3)cc2OC)cc1
BDBM164889 COc1ccc(COc2ccc(Cn3c(N)nc4cc(ccc34)-c3ccc(nc3)P(C)(C)=O)cc2OC)cc1
BDBM164890 COc1ccc(COc2ccc(Cn3cnc4cc(ccc34)-c3ccnnc3)cc2OC)cn1
BDBM164891 COc1ccc(COc2ccc(Cn3cnc4cc(ccc34)-c3cnn(c3)C3CCNCC3)cc2OC)cn1
BDBM164892 COc1ccc(COc2ccc(Cn3cnc4cc(ccc34)-n3cc(nn3)C3CCCNC3)cc2OC)cn1
BDBM164893 COc1ccc(COc2ccc(Cn3cnc4cc(ccc34)-c3nnc(o3)C3CCCNC3)cc2OC)cn1
BDBM164894 COc1ccc(COc2ccc(Cn3cnc4cc(ccc34)C3CCNCC3)cc2OC)cn1
BDBM164895 COc1ccc(COc2ccc(Cn3cnc4cc(ccc34)C3CCOCC3)cc2OC)cn1
BDBM164896 COc1ccc(COc2ccc(Cn3cnc4cc(ccc34)N3CCC(CC3)C(C)(C)N)cc2OC)cn1
BDBM164897 COc1ccc(COc2ccc(Cn3cnc4cc(ccc34)N3CC4(C3)CCNCC4)cc2OC)cn1
BDBM164898 COc1ccc(COc2ccc(Cn3cnc4cc(ccc34)N3CCC(N)CC3)cc2OC)cn1
BDBM164899 COc1ccc(COc2ccc(Cn3cnc4cc(ccc34)N3CCN(C)CC3)cc2OC)cn1
BDBM164900 COc1ccc(COc2ccc(Cn3c(N)nc4cc(ccc34)N3CCN(C)CC3=O)cc2OC)cn1
BDBM164901 COc1ccc(COc2ccc(Cn3c(N)nc4cc(cnc34)-c3cnn(C)c3)cc2OC)cc1
BDBM164902 COc1ccc(COc2ccc(Cn3c(N)nc4cc(cnc34)-c3ccc(nc3)P(C)(C)=O)cc2OC)cc1
BDBM164904 COc1ccc(COc2ccc(Cn3cnc4cc(cnc34)N3CCC(CC3)C(C)(C)N)cc2OC)cn1
BDBM164905 COc1ccc(COc2ccc(Cn3cnc4cc(cnc34)N3CCOCC3)cc2OC)cn1
BDBM164906 COc1ccc(COc2ccc(Cn3cnc4cc(cnc34)N3CCN(CC3)C3CC3)cc2OC)cn1
BDBM164907 COc1ccc(COc2ccc(Cn3cnc4cc(cnc34)N3CCN4CCC3CC4)cc2OC)cn1 |(-1.02,-9.85,;-1.79,-8.52,;-1.02,-7.18,;-1.79,-5.85,;-1.02,-4.52,;.52,-4.52,;1.61,-3.43,;1.21,-1.94,;2.3,-.85,;1.53,.48,;2.3,1.82,;3.84,1.82,;4.61,3.15,;3.84,4.48,;4.75,5.73,;3.84,6.97,;2.38,6.5,;1.04,7.27,;-.29,6.5,;-.29,4.96,;1.04,4.19,;2.38,4.96,;-1.62,7.27,;-2.9,6.4,;-4.37,6.86,;-4.93,8.29,;-4.16,9.62,;-2.64,9.85,;-1.51,8.8,;-2.53,9.45,;-3.25,8.29,;4.61,.48,;3.84,-.85,;4.93,-1.94,;4.53,-3.43,;1.29,-5.85,;.52,-7.18,)|
BDBM164908 COc1ccc(COc2ccc(Cn3cnc4cc(cnc34)N3CC4(C3)CCNCC4)cc2OC)cn1
BDBM60589 Cn1cc(cn1)-c1ccc2nnc(Sc3ccc4ncccc4c3)n2n1
BDBM164909 COc1ccc(COc2ccc(Cn3cnc4cc(cnc34)N3CCC(N)CC3)cc2OC)cn1
BDBM164910 COc1ccc(COc2ccc(Cn3cnc4cc(cnc34)N3CCC[C@H]3C(O)=O)cc2OC)cn1 |r|
BDBM164911 COc1ccc(COc2ccc(Cn3cnc4cc(cnc34)-c3cnn(c3)C3CCNCC3)cc2OC)cn1
BDBM164912 COc1cc(Cn2cnc3cc(cnc23)-c2cnn(c2)C2CCNCC2)ccc1OCc1ccc(C)nc1
BDBM164913 COc1ccc(COc2ccc(Cn3cnc4cc(cnc34)-c3noc(n3)C3CCNCC3)cc2OC)cn1
BDBM164914 COc1ccc(COc2ccc(Cn3cnc4cc(ccc34)-c3noc(n3)C3CCNCC3)cc2OC)cn1
BDBM164915 COc1ccc(COc2ccc(Cn3cnc4cc(cnc34)-c3nnc(o3)C3CCNCC3)cc2OC)cn1
BDBM164916 COc1ccc(COc2ccc(Cn3cnc4cc(cnc34)-n3cc(nn3)C(C)(C)N)cc2OC)cn1
BDBM164917 COc1ccc(COc2ccc(Cn3cnc4cc(cnc34)-n3cc(nn3)C3CCCNC3)cc2OC)cn1
BDBM164918 COc1ccc(COc2ccc(Cn3c(N)nc4cc(ccc34)N3CCN(C)CC3)cc2OC)cn1
BDBM164919 COc1ccc(COc2cc(F)c(Cn3cnc4cc(ccc34)N3CCN(C)CC3)cc2OC)cn1
BDBM164921 COc1ccc(COc2ccc(Cn3cnc4cc(ccc34)N3CCN(C)CC3=O)cc2OC)cn1
BDBM164922 COc1ccc(COc2ccc(Cn3cnc4cc(cnc34)C3=CC4(C)CN3CCC4)cc2OC)cn1 |t:24|
BDBM164923 COc1ccc(COc2ccc(Cn3cnc4cc(ccc34)C3=CC4(C)CN3CCC4)cc2OC)cn1 |t:24|
BDBM164924 COc1ccc(COc2ccc(Cn3cnc4cc(cnc34)C3=CC4(O)CN3CCC4)cc2OC)cn1 |t:24|
BDBM164925 COc1ccc(COc2ccc(Cn3cnc4cc(ccc34)C3=CC4(O)CN3CCC4)cc2OC)cn1 |t:24|
BDBM164926 CCC(Oc1ccc(Cn2c(N)nc3cc(cnc23)-c2cnn(C)c2)cc1OC)c1ccc(OC)nc1
BDBM164927 COc1ccc(COc2ccc(Cn3c(N)nc4cc(cnc34)-c3cnn(C)c3)cc2OC)cn1
BDBM164928 COc1cc(Cn2c(N)nc3cc(cnc23)-c2cnn(C)c2)ccc1OCc1ccc(nc1)C(F)(F)F
BDBM164929 COc1cc(Cn2c(N)nc3cc(cnc23)-c2cnn(C)c2)ccc1OCc1ccc(cc1)C(F)(F)F
BDBM164930 COc1cc(Cn2c(N)nc3cc(cnc23)-c2cnn(C)c2)ccc1OCc1ccc(nc1)C1CC1
BDBM164931 COc1cc(Cn2c(N)nc3cc(cnc23)-c2cnn(C)c2)ccc1OCc1csc(C)n1
BDBM164932 COc1ccc(COc2ccc(Cn3c(N)nc4cc(cnc34)-c3ccccc3)cc2OC)cn1
BDBM164933 COc1ccc(COc2ccc(Cn3c(N)nc4cc(cnc34)-c3ccc(F)cc3)cc2OC)cn1
BDBM164934 COc1ccc(COc2ccc(Cn3c(N)nc4cc(cnc34)-c3ccn(C)n3)cc2OC)cn1
BDBM164935 COc1ccc(COc2ccc(Cn3c(N)nc4cc(cnc34)-c3cncnc3)cc2OC)cn1
BDBM164936 COc1ccc(COc2ccc(Cn3c(N)nc4cc(cnc34)-c3c(C)nn(C)c3C)cc2OC)cn1
BDBM164937 COc1ccc(COc2ccc(Cn3c(N)nc4cc(cnc34)-c3ccncc3)cc2OC)cn1
BDBM164938 COc1ccc(COc2ccc(Cn3c(N)nc4cc(cnc34)-c3cccnc3)cc2OC)cn1
BDBM164939 COc1ccc(COc2ccc(Cn3c(N)nc4cc(cnc34)-c3ccccn3)cc2OC)cn1
BDBM164940 COc1cc(Cn2c(N)nc3cc(cnc23)-c2cnn(C)c2)ccc1OCc1ccc(cc1)C(F)(F)C(F)(F)F
BDBM164941 COc1cc(Cn2c(N)nc3cc(cnc23)-c2cnn(C)c2)ccc1OCc1ccc(OC(F)(F)F)cc1
BDBM164942 COc1cc(Cn2c(N)nc3cc(cnc23)-c2cnn(C)c2)ccc1OCc1ccc(SC(F)(F)F)cc1
BDBM164943 COc1cc(Cn2c(N)nc3cc(cnc23)-c2cnn(C)c2)ccc1OCc1ccc(nc1)C(C)C
BDBM164944 COc1cc(Cn2c(N)nc3cc(cnc23)-c2cnn(C)c2)ccc1OCc1ccc(CC(F)(F)F)cc1
BDBM164945 COc1cc(Cn2c(N)nc3cc(cnc23)-c2cnn(C)c2)ccc1OCc1csc(n1)C(F)(F)F
BDBM174961 Cn1cc(F)cc(CNc2ncc(Cc3c[nH]c4ncc(Cl)cc34)cn2)c1=O
BDBM185584 Cc1ccc2c(Nc3ccc(Cl)cc3)nccc2c1NC(=O)c1csc2c(N)ncnc12
BDBM185586 Cc1ccc2c(Nc3cccc(Cl)c3)nccc2c1NC(=O)c1csc2c(N)ncnc12
BDBM185589 CC(=O)c1ccc(Nc2nccc3c(NC(=O)c4csc5c(N)ncnc45)c(C)ccc23)cc1
BDBM185590 Cc1ccc2c(Nc3ccc(F)c(Cl)c3)nccc2c1NC(=O)c1csc2c(N)ncnc12
BDBM185591 Cc1ccc2c(Nc3cccc(Cl)c3F)nccc2c1NC(=O)c1csc2c(N)ncnc12
BDBM50123803 CN(C)CCCNC(=O)c1csc2nc(cn12)-c1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1
BDBM50135286 Cn1c2nc(Nc3ccc4[nH]ccc4c3)ncc2cc(c1=O)S(=O)(=O)c1ccc(F)cc1F
BDBM50092783 CO[C@H]1CC[C@@H](CC1)N1C(=O)CNc2ncc(nc12)-c1ccc(nc1)C(C)(C)O |r,wU:2.1,wD:5.8,(2.39,-8.32,;1.33,-7.7,;1.33,-6.16,;-.01,-5.39,;-0,-3.85,;1.33,-3.08,;2.66,-3.85,;2.66,-5.39,;1.33,-1.54,;2.66,-.77,;3.73,-1.38,;2.66,.77,;1.33,1.54,;,.77,;-1.33,1.54,;-2.68,.77,;-2.68,-.77,;-1.33,-1.54,;,-.77,;-4.01,-1.54,;-4.01,-3.08,;-5.35,-3.85,;-6.68,-3.08,;-6.68,-1.54,;-5.35,-.77,;-8.02,-3.85,;-9.08,-3.23,;-9.08,-4.47,;-8.02,-5.08,)|
BDBM50092079 Fc1cccc(c1)[C@H]1CCCN1c1ccc2ncc(-c3ccccn3)n2n1 |r|
BDBM50092080 N#Cc1ccc(cc1)-c1cnc2ccc(NCc3ccccc3)nn12
BDBM50092081 OC1CCN(CC1)c1cc(ccn1)-c1cnc2ccc(nn12)N1CCC[C@@H]1c1cccc(F)c1 |r|
BDBM50121690 CN1CCN(CC1)c1cc(cc(c1)C(F)(F)F)C(=O)Nc1ccc(C)c(NC(=O)c2cnoc2C)c1
BDBM50121691 Cc1oncc1NC(=O)c1ccccc1C
BDBM50092082 OC(=O)CN1CCN(CC1)c1cc(ccn1)-c1cnc2ccc(nn12)N1CCC[C@@H]1c1cccc(F)c1 |r|
BDBM50093082 CCN1C(=O)CNc2ncc(nc12)-c1ccc(nc1C)-c1nc[nH]n1
BDBM50128294 N#Cc1ccnc(Nc2cc(C3CCN(CC3)C3COC3)n(n2)C2CCCC2)c1
BDBM205483 CSc1nc(N)cc(Oc2ccc(cc2)-c2nnc(Nc3cccc(c3)C(F)(F)F)[nH]2)n1
BDBM50173334 Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1OC1CCN(CC1)C(=O)c1ccncc1
BDBM50211223 CN1CCN(Cc2ccc(cc2C(F)(F)F)C(=O)Nc2ccc(C)c(OC3CCN(CC3)C(=O)c3ccc(C)nc3)c2)CC1
BDBM31096 CN[C@H]1C[C@@H]2O[C@](C)([C@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
BDBM50208911 CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3ccccc3)ncc12 |r|
BDBM50198027 CCc1ccc(cc1)\N=C1/S\C(=C/c2ccnc(Nc3ccc(cn3)C(O)=O)c2)C(=O)N1C
BDBM276741 CC1(C)CCC(=CC1)c1nc(ccc1NC(=O)c1nc(c[nH]1)C#N)C1CC(C)(C)OC(C)(C1)C(O)=O |c:5|
BDBM276742 CC1(C)CCC(=CC1)c1nc(ccc1NC(=O)c1nc(c[nH]1)C#N)C1CC(C)(C)OC(C)(CO)C1 |c:5|
BDBM276743 CC1(C)CCC(=CC1)c1nc(ccc1NC(=O)c1nc(c[nH]1)C#N)C1CC(C)(C)OC(C)(C)C1 |c:5|
BDBM276744 CC1(C)CCC(=CC1)c1nc(ccc1NC(=O)c1nc(c[nH]1)C#N)[C@@H]1CC(C)(C)O[C@@](C)(C1)C(O)=O |r,c:5|
BDBM276745 CC1(C)CCC(=CC1)c1nc(ccc1NC(=O)c1nc(c[nH]1)C#N)[C@H]1CC(C)(C)O[C@](C)(C1)C(O)=O |r,c:5|
BDBM276746 CC1(C)CCC(=CC1)c1nc(ccc1NC(=O)c1nc(c[nH]1)C#N)[C@@H]1CC(C)(C)O[C@](C)(CO)C1 |r,c:5|
BDBM276747 CC1(C)CCC(=CC1)c1nc(ccc1NC(=O)c1nc(c[nH]1)C#N)[C@H]1CC(C)(C)O[C@](C)(CO)C1 |r,c:5|