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883 SMILES Strings for Mitogen-activated protein kinase kinase kinase kinase 4

Compound NameSMILES String
BDBM2579 CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r|
BDBM4552 COc1cc(Nc2c(cnc3cc(OCCCN4CCN(C)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
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
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|
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
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
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
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
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
BDBM32362 COc1ccc(COc2ccc(Cc3cnc(N)nc3N)cc2OC)cc1
BDBM36409 CC(C)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
BDBM25121 CC[C@H]1N(C2CCCC2)c2nc(Nc3ccc(cc3OC)C(=O)NC3CCN(C)CC3)ncc2N(C)C1=O |r|
BDBM110706 Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1N1CC[C@@H](N)[C@H](F)CC1 |r|
BDBM299345 CC(=O)N1CCN(CC1)c1ccc2ncnc(N)c2n1
BDBM103302 O=C(CN1CC[C@@H](C1)C(=O)Nc1ccc2[nH]nc(-c3ccncc3)c2c1)N1CCN(CC1)c1ccc(cc1)-c1ncccn1 |r|
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
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|
BDBM50302943 OCCC#Cc1nc(c(-c2ccncc2)n1C#C)-c1ccc(F)cc1
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
BDBM50309910 COc1c(Cl)cc2c3ccncc3[nH]c2c1NC(=O)c1cccnc1C
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
BDBM50332294 Cc1cnc(Nc2ccc(OCCN3CCCC3)cc2)nc1Nc1cccc(c1)S(=O)(=O)NC(C)(C)C
BDBM50354357 Nc1ncnc2sc3CCCCc3c12
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|
BDBM613825 Fc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)cc1
BDBM613787 COc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(F)cc2)cc1OC
BDBM608272 COc1ccc(OC)c(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)c1
BDBM613806 COc1cccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)c1
BDBM613737 COc1cccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(C)cc2)c1
BDBM613795 COc1ccccc1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCC1)-c1ccc(F)cc1
BDBM613782 COc1ccccc1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCCC1)-c1ccc(F)cc1
BDBM613884 O[C@@H]1CCC[C@H]1n1cnc(c1-c1ccc(o1)C(=O)Nc1ccncc1F)-c1ccc(F)cc1 |r|
BDBM31093 OC(=O)c1ccc(Nc2ncc3CN=C(c4cc(Cl)ccc4-c3n2)c2c(F)cccc2F)cc1 |c:13|
BDBM613779 COc1cc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)cc(OC)c1
BDBM613765 COc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)c(OC)c1
BDBM613767 COc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)cc1Cl
BDBM613821 Cc1ccccc1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCC1)-c1ccc(F)cc1
BDBM613783 CCOc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)cc1
BDBM613799 COc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)cc1OC
BDBM613804 COc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(F)cc2)cc1
BDBM608258 COc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(C)cc2)cc1
BDBM608242 COc1ccc(C)cc1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCCC1)-c1ccc(F)cc1
BDBM613769 CCOc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(F)cc2)cc1
BDBM613810 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ccc(o1)C(=O)Nc1ccc(Cl)cc1
BDBM613818 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ccc(o1)C(=O)Nc1ccc(F)c(F)c1
BDBM50425862 CN(C)C1CCC(CC1)Nc1nc(Nc2cc(Cl)cc(Cl)c2)ncc1-c1cc(C)no1 |(9.04,-43.08,;10.39,-42.35,;11.7,-43.16,;10.44,-40.81,;9.13,-40,;9.18,-38.46,;10.53,-37.74,;11.85,-38.53,;11.8,-40.08,;10.57,-36.2,;9.81,-34.87,;8.27,-34.86,;7.51,-33.53,;5.96,-33.52,;5.2,-32.19,;5.97,-30.85,;5.21,-29.52,;5.98,-28.19,;3.67,-29.52,;2.89,-30.86,;1.35,-30.86,;3.66,-32.19,;8.27,-32.2,;9.8,-32.19,;10.58,-33.53,;12.11,-33.53,;12.6,-34.99,;14.14,-34.99,;15.06,-36.23,;14.61,-33.52,;13.35,-32.62,)|
BDBM50425863 CN1CCC(CC1)NC(=O)c1cnc(Nc2cc(Cl)cc(Cl)c2)nc1N[C@@H]1COC[C@H]1O |r|
BDBM50425864 CN(C)C1CCC(CC1)Nc1nc(Nc2cc(Cl)cc(Cl)c2)ncc1C(=O)NC1CCN(C)CC1 |(47.36,-51.36,;48.9,-51.37,;49.67,-52.7,;49.68,-50.04,;48.92,-48.7,;49.7,-47.37,;51.23,-47.39,;52.01,-48.71,;51.22,-50.05,;52,-46.06,;51.24,-44.72,;49.7,-44.72,;48.94,-43.38,;47.4,-43.38,;46.63,-42.04,;47.41,-40.71,;46.64,-39.37,;47.41,-38.04,;45.1,-39.37,;44.33,-40.71,;42.79,-40.71,;45.1,-42.04,;49.7,-42.05,;51.24,-42.05,;52.01,-43.39,;53.55,-43.39,;54.32,-44.72,;54.32,-42.06,;55.86,-42.06,;56.62,-43.39,;58.16,-43.4,;58.94,-42.07,;60.48,-42.08,;58.17,-40.73,;56.62,-40.72,)|
BDBM50430289 CCc1ccc(cc1)-c1ccc2N(C)S(=O)(=O)c3c[nH]nc3-c2c1
BDBM50430297 CCc1ccc(cc1)-c1ccc2N(C)S(=O)(=O)c3cnn(CC)c3-c2c1
BDBM50436477 C[C@@H](CC(F)(F)F)C(=O)Nc1nc(C)c(s1)-c1ccc(N)nc1 |r|
BDBM50011534 Nc1ncnc2ncc(cc12)-c1cccc(Cl)c1
BDBM50011536 Nc1ncnc2ccc(nc12)-c1cccc(F)c1
BDBM50011539 Cc1onc(N)c1-c1cccc(N)c1
BDBM50011546 CNc1ncc(cn1)-c1cccc(N)c1
BDBM50011547 Nc1cccc(c1)-c1cnc(N)nc1
BDBM50011550 Nc1cccc(c1)-c1ccc2ncnc(N)c2c1
BDBM50015640 Cc1cccc(n1)-c1nn2CCCc2c1-c1ccnc2ccc(cc12)C(N)=O |(13.61,.14,;12.84,-1.19,;13.61,-2.53,;12.84,-3.86,;11.3,-3.86,;10.53,-2.53,;11.3,-1.19,;8.99,-2.53,;8.08,-1.28,;6.62,-1.76,;5.15,-1.28,;4.25,-2.53,;5.15,-3.77,;6.62,-3.3,;8.08,-3.77,;8.56,-5.24,;10.06,-5.56,;10.54,-7.02,;9.51,-8.17,;8,-7.85,;6.97,-8.99,;5.47,-8.67,;4.99,-7.21,;6.02,-6.06,;7.53,-6.38,;3.48,-6.89,;3.01,-5.42,;2.45,-8.03,)|
BDBM50011551 Nc1ncnc2ccc(cc12)-c1ccccc1
BDBM50011552 COc1ccccc1-c1ccc2ncnc(N)c2c1
BDBM50011554 COc1ccc(cc1)-c1ccc2ncnc(N)c2c1
BDBM50011556 Nc1ncnc2ccc(cc12)-c1cccc(c1)C#N
BDBM50011558 Nc1cc(ccc1F)-c1ccc2ncnc(N)c2c1
BDBM50011560 Nc1cc(F)cc(c1)-c1ccc2ncnc(N)c2c1
BDBM50011561 Nc1ncnc2ccc(cc12)-c1cccc(F)c1
BDBM50011564 Nc1ncnc2ccc(cc12)-c1cccc(Cl)c1
BDBM50011535 Nc1ncnc2cnc(cc12)-c1cccc(F)c1
BDBM50011537 Nc1cccc(c1)-c1cnco1
BDBM50011540 Nc1cccc(c1)-c1cccnc1N
BDBM50011548 Cc1cc(cnc1N)-c1cccc(N)c1
BDBM50011549 Nc1cccc(c1)-c1ccc(N)nc1
BDBM50011553 COc1cccc(c1)-c1ccc2ncnc(N)c2c1
BDBM50011555 Cc1cccc(c1)-c1ccc2ncnc(N)c2c1
BDBM50011557 Nc1ncnc2ccc(cc12)-c1ccc(cc1)C#N
BDBM50011559 Nc1ccc(F)c(c1)-c1ccc2ncnc(N)c2c1
BDBM50011562 Nc1ncnc2ccc(cc12)-c1ccccc1F
BDBM50011563 Nc1ncnc2ccc(cc12)-c1ccc(F)cc1
BDBM50011568 Nc1ncnc2ccc(cc12)-c1cc(F)cc(F)c1
BDBM50043416 CN(Cc1ccccc1)C(=O)c1ccc(cc1)S(=O)(=O)Nc1ccccc1
BDBM60665 COc1cc(Nc2ncc(F)c(Nc3ccc4OC(C)(C)C(=O)Nc4n3)n2)cc(OC)c1OC
BDBM50058516 O(c1cccnc1)c1ncnn2cccc12
BDBM50058666 CCS(=O)(=O)c1ccc(cc1)-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058669 OCc1ccc(cc1)-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058680 O=C(c1ccoc1)c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058690 Nc1ncnn2cccc12
BDBM50026612 COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)N(C)C(=O)CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
BDBM50058525 CNC(=O)C(C)(C)n1cc(cn1)-c1ccc(cc1)-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058677 Fc1ccccc1-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058512 N(c1cn[nH]c1)c1ncnn2cccc12
BDBM50058513 N(c1cccnc1)c1ncnn2cccc12
BDBM50058514 N(c1ccncc1)c1ncnn2cccc12
BDBM50058515 C1CN(CCO1)c1ncnn2cccc12
BDBM50058524 Brc1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058586 CNC(=O)Cn1cc(cn1)-c1ccc(cc1)-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058653 CC(C)(O)Cn1cc(cn1)-c1ccc(cc1)-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058654 OCCn1cc(cn1)-c1ccc(cc1)-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058656 C(Cn1cc(cn1)-c1ccc(cc1)-c1cc2c(Nc3ccncc3)ncnn2c1)N1CCOCC1
BDBM50058661 CNS(=O)(=O)c1ccc(cc1)-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058662 CN1CCN(CC1)c1ccc(cc1)-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058663 C1CN(CCO1)c1ccc(cc1)-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058664 CN1CCN(CC1)c1ccc(cn1)-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058665 C1CN(CCO1)c1ccc(cn1)-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058667 CS(=O)(=O)c1ccc(cc1)-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058668 CN(C)Cc1ccc(cc1)-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058670 Fc1ccc(cc1)-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058671 OCc1cccc(c1)-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058673 Clc1cccc(c1)-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058674 Cc1cccc(c1)-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058675 Clc1ccccc1-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058676 Cc1ccccc1-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058678 O=C(c1cn[nH]c1)c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058679 O=C(c1cc2c(Nc3ccncc3)ncnn2c1)c1nnn[nH]1
BDBM50058681 O=C(N1CCOCC1)c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058682 O=C(N1CCC1)c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058684 NC(=O)c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058685 CC(C)(O)c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058686 OCc1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058687 N(c1ccncc1)c1ncnn2cc(cc12)-c1ccccc1
BDBM50058688 N#Cc1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058689 CCOC(=O)c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50058691 CNc1ncnn2cccc12
BDBM50058692 CC(C)Nc1ncnn2cccc12
BDBM60589 Cn1cc(cn1)-c1ccc2nnc(Sc3ccc4ncccc4c3)n2n1
BDBM50058683 CCNC(=O)c1cc2c(Nc3ccncc3)ncnn2c1
BDBM50138137 NC(=O)c1ccc(cc1)-c1nccc(n1)-c1ccc(Cl)cc1
BDBM50138158 COc1ccc(cc1)-c1cncc(c1)-c1ccc(cc1)C(N)=O
BDBM50138159 NC(=O)c1ccc(cc1)-c1cc(ccn1)-c1ccc(Cl)cc1
BDBM50138160 NC(=O)c1ccc(cc1)-c1cnc(N)c(c1)-c1ccc(Cl)cc1
BDBM50138162 NC(=O)c1ccc(cc1)-c1cncc(c1)-c1ccc(OC2CC2)cc1
BDBM50134771 Nc1ccc(cn1)-c1cnc(N)c(c1)-c1ccc(Cl)cc1
BDBM50134773 NC(=O)c1ccc(cc1)-c1ncc(o1)-c1ccc(Cl)cc1
BDBM50134774 NC(=O)c1ccc(cc1)-c1cncc(c1)-c1ccc(Cl)cc1
BDBM50122685 NC(=O)c1cnc(N)c2cc(ccc12)-c1cccc(F)c1
BDBM50122725 Nc1ncc(C(=O)NC2CC(O)C2)c2ccc(cc12)-c1cccc(F)c1 |(-1.33,2.77,;-1.33,1.54,;-2.68,.77,;-2.68,-.77,;-1.33,-1.54,;-1.33,-3.08,;-.26,-3.69,;-2.66,-3.85,;-2.65,-5.4,;-3.73,-6.44,;-2.64,-7.52,;-2.63,-8.75,;-1.55,-6.43,;,-.77,;1.33,-1.54,;2.66,-.77,;2.66,.77,;1.33,1.54,;,.77,;4,1.54,;5.33,.77,;6.66,1.53,;6.67,3.07,;5.33,3.85,;5.34,5.08,;4,3.08,)|
BDBM50122727 Nc1ncc(C(=O)NC2CNC2)c2ccc(cc12)-c1cccc(F)c1
BDBM50122728 CC(=O)N1CC(C1)NC(=O)c1cnc(N)c2cc(ccc12)-c1cccc(F)c1
BDBM50122729 CNC(=O)N1CC(C1)NC(=O)c1cnc(N)c2cc(ccc12)-c1cccc(F)c1
BDBM50122739 Nc1ncc(C(=O)N[C@@H]2C[C@H](O)C2)c2ccc(nc12)-c1cccc(F)c1 |r,wD:8.7,10.10,(1.33,2.77,;1.33,1.54,;2.66,.77,;2.66,-.77,;1.33,-1.54,;1.33,-3.08,;.27,-3.7,;2.67,-3.85,;2.67,-5.39,;3.76,-6.42,;2.67,-7.51,;2.67,-8.74,;1.58,-6.42,;,-.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,;-7.75,.92,;-5.35,.77,)|
BDBM50122741 Nc1ncc(C(=O)NC2CN(C2)C(=O)C2CC2)c2ccc(nc12)-c1cccc(F)c1
BDBM50122742 CNC(=O)N1CC(C1)NC(=O)c1cnc(N)c2nc(ccc12)-c1cccc(F)c1
BDBM50122743 Nc1ncc(C(=O)NC2CC2)c2ccc(cc12)-c1cccc(F)c1
BDBM50135286 Cn1c2nc(Nc3ccc4[nH]ccc4c3)ncc2cc(c1=O)S(=O)(=O)c1ccc(F)cc1F
BDBM225230 CS(=O)(=O)c1ccc(cc1)-c1cnc(NCc2ccco2)n2cnnc12
BDBM50122688 Nc1ncc(C(=O)NCC#N)c2ccc(cc12)-c1cccc(F)c1
BDBM50122730 Nc1ncc(C(=O)NC2CC2)c2ccc(nc12)-c1cccc(F)c1
BDBM50122740 CCC(=O)N1CC(C1)NC(=O)c1cnc(N)c2nc(ccc12)-c1cccc(F)c1
BDBM50134772 Nc1ncc(cn1)-c1cnc(N)c(c1)-c1ccc(Cl)cc1
BDBM50138135 Nc1ncc(cc1-c1ccc(Cl)cc1)-c1ccc(=O)[nH]c1
BDBM225896 Cc1c[nH]nc1C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM225884 COc1cc(ccc1O)-c1cnc(Nc2ccc(cc2)N2CCN(C)CC2)c2nccn12
BDBM225885 CN1CCN(CC1)c1ccc(cc1)-c1cnc2[nH]c3c(C)nc(nc3c2c1)-c1cnn(C)c1
BDBM225886 Cc1cc(C)c2c(N)c(sc2n1)C#N
BDBM225887 NC(=O)c1ccccc1NC(=O)c1ccc(o1)-c1cccc(Cl)c1
BDBM225888 CC(=O)NCC1Cc2cc(Cl)cc(c2O1)-c1ccncc1
BDBM225889 Clc1ccccc1-c1cc2cc(NC(=O)C3CC3)ncc2[nH]1
BDBM225890 Cn1c(cc2cnc(NC(=O)C3CC3)cc12)-c1ccccc1Cl
BDBM225891 FC(F)(F)Cn1c(cc2cc(NC(=O)C3CC3)ncc12)-c1ccccc1Cl
BDBM225892 N#Cc1cccc(c1)-c1cc2c(Nc3ccncc3)ncnn2c1
BDBM225893 CNC(=O)c1ccc2-c3sc(cc3CCOc2c1)-c1ccnn1-c1ccc(F)cc1F
BDBM225894 CNC(=O)c1ccc2-c3cc(nn3CCOc2c1)-c1ncnn1-c1ccc(F)cc1F
BDBM225895 CN(C)CCC(=O)Nc1cc(F)cc(c1)-c1ccc2ncnc(N)c2c1
BDBM225898 Nc1ncnc2ccc(nc12)N1CCC(Cc2ccccn2)C1
BDBM225899 CNC(=O)c1ccc2-c3c(C)c(nn3CCOc2c1)-c1ncnn1-c1ccc(F)cc1F
BDBM225900 Nc1ncc(C(=O)N[C@H]2CCC[C@@H](O)C2)c2ccc(cc12)-c1cccc(F)c1
BDBM225901 Cc1c[nH]nc1-c1cccc(c1)-c1ccc2ncnc(N)c2n1
BDBM50138127 NC(=O)c1ccc(cc1)-c1cn(cn1)-c1ccc(Cl)cc1
BDBM50138128 Nc1ncc(cc1-c1ccc(Cl)cc1)-c1cc[nH]c(=O)c1
BDBM50138134 NC(=O)c1ccc(cc1)-n1cc(cn1)-c1ccc(Cl)cc1
BDBM50138143 Cn1c(cnc1-c1ccc(cc1)C(N)=O)-c1ccc(Cl)cc1
BDBM50138151 Nc1ncc(cc1-c1ccc(Cl)cc1)-c1ccccc1
BDBM50138153 CS(=O)(=O)c1ccc(cc1)-c1cc(cnc1N)-c1ccc(O)cc1
BDBM50138155 CS(=O)(=O)c1ccc(cc1)-c1cc(cnc1N)-c1ccc(cc1)C(N)=O
BDBM50185442 O=C(NCc1ccccn1)c1ccc(cc1)-n1cc(cn1)-c1ccncc1
BDBM50162967 O=C(Nc1ccc(CN2CCN(CC2)c2ccccc2)cc1)c1n[nH]c2ccccc12
BDBM50210946 C[C@@H]1NC(=Nc2nc3ccccn3c2C1=O)c1ccc(cc1)-c1ccccc1 |r,c:3|
BDBM50210947 C[C@H]1NC(=Nc2nc3ccccn3c2C1=O)c1ccc(Br)cc1 |r,c:3|
BDBM50210949 CC(C)(C)OC[C@@H]1NC(=Nc2nc3ccccn3c2C1=O)c1ccc(Br)cc1 |r,c:8|
BDBM50210950 C[C@@H]1NC(=Nc2nc3ccccn3c2C1=O)c1ccc(Cl)cc1Cl |r,c:3|
BDBM31096 CN[C@H]1C[C@@H]2O[C@](C)([C@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
BDBM50210945 CC(C)[C@@H]1NC(=Nc2nc3ccccn3c2C1=O)c1ccc(Br)cc1 |r,c:5|
BDBM50210948 C[C@@H]1NC(=Nc2nc3ccccn3c2C1=O)c1ccc(NC(C)=O)cc1 |r,c:3|
BDBM608257 CCc1cccc(C)c1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCC1)-c1ccc(F)cc1
BDBM299256 Nc1ncnc2ccc(nc12)-c1ccnc(F)c1
BDBM299274 Nc1ncnc2ccc(nc12)-c1cc(F)cc(c1)C(=O)NCCO
BDBM299323 Nc1ncnc2ccc(nc12)-c1cc(F)cc(c1)C(=O)NC1CC(O)C1 |(-6.94,14.06,;-6.94,12.52,;-8.28,11.75,;-8.28,10.21,;-6.94,9.44,;-5.61,10.21,;-4.28,9.44,;-2.94,10.21,;-2.94,11.75,;-4.28,12.52,;-5.61,11.75,;-1.61,12.52,;-1.61,14.06,;-.28,14.83,;-.28,16.37,;1.06,14.06,;1.06,12.52,;-.28,11.75,;2.39,11.75,;2.39,10.21,;3.72,12.52,;5.06,11.75,;5.46,10.26,;6.94,10.66,;8.28,9.89,;6.55,12.15,)|
BDBM299324 Nc1ncnc2ccc(nc12)-c1cc(F)cc(c1)C(=O)NCCN1CCOCC1
BDBM299325 Nc1ncnc2ccc(nc12)-c1cccc(c1)C(=O)NC1CC(O)C1 |(-6.94,14.83,;-6.94,13.29,;-8.28,12.52,;-8.28,10.98,;-6.94,10.21,;-5.61,10.98,;-4.28,10.21,;-2.94,10.98,;-2.94,12.52,;-4.28,13.29,;-5.61,12.52,;-1.61,13.29,;-1.61,14.83,;-.28,15.6,;1.06,14.83,;1.06,13.29,;-.28,12.52,;2.39,12.52,;2.39,10.98,;3.72,13.29,;5.06,12.52,;5.46,11.03,;6.94,11.43,;8.28,10.66,;6.55,12.92,)|
BDBM299326 Nc1ncnc2ccc(nc12)-c1cccc(c1)C(=O)NCCO
BDBM299329 Nc1ncnc2ccc(nc12)-c1cccc(c1)C(=O)NCCN1CCOCC1
BDBM299331 Fc1cccc(c1)-c1ccc2ncnc(NC3CCC3)c2n1
BDBM299332 CC(C)(C)OC(=O)N[C@H]1CCCN(C1)c1ccc2ncnc(N)c2n1 |r|
BDBM299337 COCCC(=O)N[C@H]1CCCN(C1)c1ccc2ncnc(N)c2n1 |r|
BDBM299338 CC(=O)Nc1cc(F)cc(c1)-c1ccc2ncnc(N)c2c1
BDBM299339 Nc1ncnc2ccc(cc12)-c1cc(F)cc(NC(=O)CN2CCOCC2)c1
BDBM299343 Nc1ncnc2c(cc(cc12)-c1cccc(F)c1)C#N
BDBM299344 CC(=O)NCCNC(=O)c1cc(cc2c(N)ncnc12)-c1cccc(F)c1
BDBM299350 CC(=O)Nc1cccc(c1)-c1ccc2ncnc(N)c2c1
BDBM299406 COC1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299407 Nc1ncnc2ccc(nc12)N1CCC(C1)C(F)(F)F
BDBM299408 Nc1ncnc2ccc(nc12)N1CCCC(C1)C(F)(F)F
BDBM299409 COCC1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299410 Nc1ncnc2ccc(nc12)N1CCCC(CO)C1
BDBM299411 Nc1ncnc2ccc(cc12)-c1ccncc1
BDBM299412 Cc1cc(ccn1)-c1ccc2ncnc(N)c2c1
BDBM299413 Nc1ncnc2ccc(cc12)-c1cccc(NC(=O)CC2CC2)c1
BDBM299414 Nc1ncnc2ccc(cc12)-c1cccc(NC(=O)C2CCC2)c1
BDBM299351 CC(C)(C)OC(=O)Nc1ccc(cc1)-c1ccc2ncnc(N)c2c1
BDBM299363 Nc1nc(N)c2ccc(cc2n1)-c1cccc(Cl)c1
BDBM299364 Nc1nccc2cc(ccc12)-c1cccc(Cl)c1
BDBM299365 Nc1ncnc2ccc(cc12)-c1cc(F)cc(Cl)c1
BDBM299367 Nc1nc(N)c2nc(ccc2n1)-c1cccc(Cl)c1
BDBM299368 Clc1cccc(c1)-c1ccc2ncnc(NC3CC3)c2c1
BDBM299370 NC(=O)c1cc(Cl)cc(c1)-c1ccc2ncnc(N)c2c1
BDBM299373 CC(C)CNc1ncnc2ccc(cc12)-c1cccc(Cl)c1
BDBM299376 Clc1cccc(c1)-c1ccc2ncnc(NC3CCC3)c2c1
BDBM299415 CCC(=O)Nc1cccc(c1)-c1ccc2ncnc(N)c2c1
BDBM299416 Nc1ncnc2ccc(cc12)-c1cccc(NC(=O)C(F)F)c1
BDBM299417 Nc1ncnc2ccc(cc12)-c1cccc(NC(=O)CC(F)(F)F)c1
BDBM299418 Nc1ncnc2ccc(cc12)-c1cccc(NC(=O)C2CCOCC2)c1
BDBM299419 CN1CCOC(C1)C(=O)Nc1cccc(c1)-c1ccc2ncnc(N)c2c1
BDBM299420 Nc1ncnc2ccc(cc12)-c1cccc(NC(=O)C2CC2(F)F)c1
BDBM299421 Nc1ncnc2ccc(cc12)-c1cccc(NC(=O)C2CCCO2)c1
BDBM299422 Nc1ncnc2ccc(cc12)-c1cccc(NC(=O)C2CCOC2)c1
BDBM299446 CNC(=O)CC1CCN(CC1)c1ccc2ncnc(N)c2n1
BDBM299448 Nc1ncnc2ccc(nc12)N1CCC(CC1)c1ccn[nH]1
BDBM299449 Cc1cccc(n1)C1CCN(CC1)c1ccc2ncnc(N)c2n1
BDBM299450 Nc1ncnc2ccc(nc12)N1CCCC(C1)N1CCOCC1
BDBM299456 Cc1ccc(nc1)C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299457 Cn1ccnc1CC1CCN(C1)c1ccc2ncnc(N)c2n1
BDBM299459 Cc1nc(no1)C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299461 Cn1cncc1C1CCN(CC1)c1ccc2ncnc(N)c2n1
BDBM299462 Nc1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM299377 FC(F)CNc1ncnc2ccc(cc12)-c1cccc(Cl)c1
BDBM299378 CCNc1ncnc2ccc(cc12)-c1cccc(Cl)c1
BDBM299381 CNc1ncnc2ccc(cc12)-c1cccc(Cl)c1
BDBM299383 Nc1ncnc2ccc(nc12)-c1cccc(Cl)c1
BDBM299384 Cc1ccc(Cl)cc1-c1ccc2ncnc(N)c2c1
BDBM299385 Nc1ncnc2ccc(cc12)-c1cc(Cl)cc(Cl)c1
BDBM299391 Nc1ncnc2ccc(cc12)-c1cc(F)cc(c1)C#N
BDBM299395 Nc1ncnc2ccc(cc12)-c1cc(F)cc(NC(=O)CC2CCCO2)c1
BDBM299396 Nc1ncnc2ccc(cc12)-c1cc(F)cc(NC(=O)C2CCOCC2)c1
BDBM299423 Nc1ncnc2ccc(cc12)-c1cccc(NC(=O)CN2CCCC2)c1
BDBM299424 Nc1ncnc2ccc(cc12)-c1cccc(NC(=O)CC2CCCO2)c1
BDBM299425 CC(C)(C)C(=O)Nc1cccc(c1)-c1ccc2ncnc(N)c2c1
BDBM299426 COCCC(=O)Nc1cccc(c1)-c1ccc2ncnc(N)c2c1
BDBM299427 Nc1ncnc2ccc(cc12)-c1cccc(NC(=O)CN2CCOCC2)c1
BDBM299432 Nc1ncnc2ccc(cc12)-c1cccc(CC(=O)NC2CCCC2)c1
BDBM299433 CC(N1CCCC1)C(=O)Nc1cccc(c1)-c1ccc2ncnc(N)c2c1
BDBM299434 CN(C1CCCC1)C(=O)Cc1cccc(c1)-c1ccc2ncnc(N)c2c1
BDBM299463 Nc1ncnc2ccc(nc12)N1CCC(Cc2ccncc2)C1
BDBM299464 Cc1noc(n1)C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299465 CNC(=O)C1CCN(C1)c1ccc2ncnc(N)c2n1
BDBM299469 Cc1noc(n1)C1CCN(C1)c1ccc2ncnc(N)c2n1
BDBM299474 Nc1ncnc2ccc(nc12)N1CCC(Cc2cccnc2)C1
BDBM299475 CN1CCN(CC1)c1ccc2ncnc(N)c2n1
BDBM299476 COC1CCN(CC1)c1ccc2ncnc(N)c2n1
BDBM299477 CN(C)C1CCN(C1)c1ccc2ncnc(N)c2n1
BDBM299478 CCOC(=O)N1CCC(CC1)Nc1ccc2ncnc(N)c2n1
BDBM299397 CC(=O)N1CC(C1)C(=O)Nc1cc(F)cc(c1)-c1ccc2ncnc(N)c2c1
BDBM299398 Nc1ncnc2ccc(cc12)-c1cc(F)cc(NC(=O)CN2CCCC2)c1
BDBM299400 Nc1ncnc2ccc(cc12)-c1cc(F)cc(NC(=O)C2CCC2)c1
BDBM299401 Nc1ncnc2ccc(cc12)-c1cc(F)cc(NC(=O)CC2CC2)c1
BDBM299402 Nc1ncnc2ccc(cc12)-c1cc(F)cc(NC(=O)C2CCCO2)c1
BDBM299403 COCCC(=O)Nc1cc(F)cc(c1)-c1ccc2ncnc(N)c2c1
BDBM299404 CN1CCOC(C1)C(=O)Nc1cc(F)cc(c1)-c1ccc2ncnc(N)c2c1
BDBM299405 CC1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299435 CN(C)CC(=O)Nc1cccc(c1)-c1ccc2ncnc(N)c2c1
BDBM299436 Nc1ncnc2ccc(NCCc3ccc(F)cc3)nc12
BDBM299437 Nc1ncnc2ccc(cc12)N1CCCCC1
BDBM299438 Nc1ncnc2ccc(nc12)N1CCC(CC1)C(=O)N1CCCC1
BDBM299439 Nc1ncnc2ccc(nc12)N1CCC(C1)N1CCOCC1
BDBM299440 COCCN1CCN(CC1)c1ccc2ncnc(N)c2n1
BDBM299442 CN(C1CCN(C1)c1ccc2ncnc(N)c2n1)C(C)=O
BDBM299444 CC(C)C(=O)N1CCN(CC1)c1ccc2ncnc(N)c2n1
BDBM299480 Nc1ncnc2ccc(nc12)N1CCN2CCCC2C1
BDBM299482 Nc1ncnc2ccc(NC3CCCC3)nc12
BDBM299483 Nc1ncnc2ccc(nc12)N1CCOC(C1)C(=O)NC1CCCC1
BDBM299485 Cc1cccc(n1)C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299486 CC(C)(C)OC(=O)N1CCN(CC1)c1ccc2ncnc(N)c2n1
BDBM299487 Cc1nc(no1)C1CCN(CC1)c1ccc2ncnc(N)c2n1
BDBM299488 Nc1ncnc2ccc(cc12)-c1cccc(NC(=O)NC2CCCC2)c1
BDBM613788 CCc1cccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)c1
BDBM299511 Nc1ncnc2ccc(nc12)N1CCC(C1)c1cc[nH]n1
BDBM299512 CN(C)c1cc(CC2CCN(C2)c2ccc3ncnc(N)c3n2)ncn1
BDBM299513 CN(C)c1nccc(n1)C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299514 NC(=O)c1cccc(n1)C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299515 CN(C)c1nccnc1C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299516 Cc1nccc(n1)C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299517 Nc1ncnc2ccc(nc12)N1CCCC(C1)c1ccncn1
BDBM299518 Nc1ncnc2ccc(nc12)N1CCCC(C1)c1cc([nH]n1)C(F)(F)F
BDBM299519 Nc1ncnc2ccc(nc12)N1CCCC(C1)c1cnccn1
BDBM299520 Nc1ncnc2ccc(nc12)N1CCCC(Cc2cnccn2)C1
BDBM299521 CN(C)c1ccc(nc1)C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299522 Cc1ccnc(n1)C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299523 Nc1ncnc2ccc(nc12)N1CCCC(C1)c1ccccn1
BDBM299525 Cn1cnnc1C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299526 COCc1nc(no1)C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299528 CNC(=O)c1cccc(n1)C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299531 CS(=O)(=O)c1cncnc1C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299532 Nc1ncnc2ccc(nc12)N1CCC(C1)c1ccncc1
BDBM299533 CN(C1CCN(C)C1)C(=O)c1cc(cc2c(N)ncnc12)-c1cccc(F)c1
BDBM299534 COCCN(C)C(=O)c1cc(cc2c(N)ncnc12)-c1cccc(F)c1
BDBM299535 Nc1ncnc2c(cc(cc12)-c1cccc(F)c1)C(=O)NCCN1CCCC1
BDBM299536 CCc1cc(ccn1)-c1ccc2ncnc(N)c2n1
BDBM299537 Cc1cc(ccn1)-c1ccc2ncnc(N)c2n1
BDBM299538 CN(C)C1CCN(C1)C(=O)c1cc(cc2c(N)ncnc12)-c1cccc(F)c1
BDBM299539 CN(C)C1CCN(CC1)C(=O)c1cc(cc2c(N)ncnc12)-c1cccc(F)c1
BDBM299540 Nc1ncnc2c(cc(cc12)-c1cccc(F)c1)C(=O)N1CC(O)C1
BDBM299541 Nc1ncnc2c(cc(cc12)-c1cccc(F)c1)C(=O)NC1COC1
BDBM299542 CN1CCN(CC1)C(=O)c1cc(cc2c(N)ncnc12)-c1cccc(F)c1
BDBM299543 Cn1ccnc1CC1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299544 Nc1ncnc2ccc(nc12)-c1cc(F)cc(NC(=O)CN2CCCC2)c1
BDBM299545 Nc1cc(F)cc(c1)-c1ccc2ncnc(NC(=O)CN3CCCC3)c2n1
BDBM299546 Nc1ncnc2ccc(nc12)-c1cccc(O)c1
BDBM299547 CN1CCCC(C1)c1ccc(cn1)-c1ccc2ncnc(N)c2c1
BDBM299548 Cn1nc(cc1O)C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299549 Nc1ncnc2ccc(cc12)-c1ccnc(NCCN2CCCC2)c1
BDBM299550 Nc1ncnc2ccc(nc12)-c1cccc(OCCN2CCCC2)c1
BDBM299551 Nc1ncnc2ccc(nc12)N1CCCC(C1)c1cc[nH]n1
BDBM299552 Nc1ncnc2ccc(nc12)N1CCOC(C1)c1cc[nH]n1
BDBM299553 Nc1ncnc2ccc(nc12)N1CCCC(C1)c1ncc[nH]1
BDBM299554 CN(C)CCNc1cc(ccn1)-c1ccc2ncnc(N)c2c1
BDBM299555 CC(C)(C)OC(=O)N[C@@H]1CCCN(C1)c1ccc2ncnc(N)c2n1 |r|
BDBM299556 N[C@H]1CCCN(C1)c1ccc2ncnc(N)c2n1 |r|
BDBM299557 N[C@@H]1CCCN(C1)c1ccc2ncnc(N)c2n1 |r|
BDBM299558 Nc1ncnc2ccc(nc12)N1CCC[C@@H](C1)NC(=O)CCN1CCCC1 |r|
BDBM299559 CN1CCN(CC(=O)N[C@H]2CCCN(C2)c2ccc3ncnc(N)c3n2)CC1 |r|
BDBM299560 COCCC(=O)N[C@@H]1CCCN(C1)c1ccc2ncnc(N)c2n1 |r|
BDBM299561 Nc1ncnc2ccc(nc12)N1CCC[C@H](C1)NC(=O)CCN1CCCC1 |r|
BDBM299562 CN1CCN(CC(=O)N[C@@H]2CCCN(C2)c2ccc3ncnc(N)c3n2)CC1 |r|
BDBM299563 Nc1ncnc2ccc(NCc3ccccc3F)nc12
BDBM299564 CC(Nc1ccc2ncnc(N)c2n1)c1ccccc1
BDBM299565 Nc1ncnc2ccc(nc12)-c1ccnc(c1)C(F)(F)F
BDBM299566 Cc1ccccc1Oc1ccc2ncnc(N)c2n1
BDBM299568 Cc1cccc(Oc2ccc3ncnc(N)c3n2)c1
BDBM299569 Nc1ncnc2ccc(Oc3ccncc3)nc12
BDBM299570 Cc1ccc(Oc2ccc3ncnc(N)c3n2)cc1
BDBM299571 Nc1ncnc2ccc(Oc3cccc(F)c3)nc12
BDBM299572 Nc1ncnc2ccc(Oc3ccccc3C#N)nc12
BDBM299573 Cc1ccc(Oc2ccc3ncnc(N)c3n2)cn1
BDBM299574 Cc1ncccc1Oc1ccc2ncnc(N)c2n1
BDBM299575 Nc1ncnc2ccc(Oc3ccccc3)nc12
BDBM299576 Nc1ncnc2ccc(Oc3cccnc3)nc12
BDBM299577 NC(=O)c1ccc(Oc2ccc3ncnc(N)c3n2)cc1
BDBM299578 Nc1ncnc2ccc(Oc3ccc(cc3)C#N)nc12
BDBM299579 Nc1ncnc2ccc(Oc3cccc(c3)C#N)nc12
BDBM299580 Nc1ncnc2ccc(Oc3ccccc3Cl)nc12
BDBM299581 COc1ccc(Oc2ccc3ncnc(N)c3n2)cc1
BDBM299582 Nc1ncnc2ccc(Oc3cccc(Cl)c3)nc12
BDBM299583 Nc1ncnc2ccc(Oc3ccc(F)cc3F)nc12
BDBM299584 Nc1ncnc2ccc(Oc3ccc(F)c(F)c3)nc12
BDBM299585 Nc1ncnc2ccc(NCc3ccccc3Cl)nc12
BDBM299591 Nc1ncnc2ccc(Oc3ccccc3F)nc12
BDBM299592 Nc1ncnc2ccc(NCc3cccc(Cl)c3)nc12
BDBM299613 Nc1ncnc2ccc(NCc3ccc(Cl)cc3)nc12
BDBM299614 Cc1ccccc1CNc1ccc2ncnc(N)c2n1
BDBM299615 Nc1ncnc2ccc(NCc3cccc(c3)N3CCCC3)nc12
BDBM299616 Nc1ncnc2ccc(NCc3cnccn3)nc12
BDBM299617 Nc1ncnc2ccc(nc12)-c1cccc(OC(F)F)c1
BDBM299618 CC(C)Oc1cccc(c1)-c1ccc2ncnc(N)c2n1
BDBM299619 COc1cccc(c1)-c1ccc2ncnc(N)c2n1
BDBM299489 Nc1ncnc2ccc(cc12)-c1cccc(NC(=O)CN2CCCC2=O)c1
BDBM299490 Nc1ncnc2ccc(nc12)-c1cc(F)cc(NC(=O)CC2CCCC2)c1
BDBM299491 Nc1ncnc2ccc(cc12)-c1cccc(CCO)c1
BDBM299492 Nc1ncnc2ccc(cc12)-c1cccc(O)c1
BDBM299494 CCOc1cccc(c1)-c1ccc2ncnc(N)c2c1
BDBM299497 Nc1ncnc2ccc(NCc3ccccc3)nc12
BDBM299500 Cc1cc(C)nc(n1)C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299501 CN(C)C(=O)c1ccnc(n1)C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299502 Cc1ccc(CC2CCN(C2)c2ccc3ncnc(N)c3n2)nc1
BDBM299503 Nc1ncnc2ccc(nc12)N1CCC(Cc2ncccn2)C1
BDBM299504 CN(C)c1cccc(n1)C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299505 Nc1ncnc2ccc(nc12)N1CCCC(Cc2ncccn2)C1
BDBM299506 CS(=O)(=O)c1cn[nH]c1C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299507 CN(C)c1cncc(n1)C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM299508 Cc1nccc(n1)C1CCN(C1)c1ccc2ncnc(N)c2n1
BDBM299509 CN(C)c1cc(nc(C)n1)C1CCN(C1)c1ccc2ncnc(N)c2n1
BDBM299510 CN(C)c1cc(CC2CCCN(C2)c2ccc3ncnc(N)c3n2)ncn1
BDBM50235816 CC1(C)OCC(=O)Nc2cc(Nc3nc(NCC(F)(F)F)c4occc4n3)ccc12
BDBM50235820 FC(F)(F)CNc1nc(Nc2ccc3cn[nH]c3c2)nc2ccoc12
BDBM50235830 CCCNC(=O)c1ccc(Nc2nc(NCC(F)(F)F)c3cc[nH]c3n2)cc1
BDBM50235833 Cc1n[nH]c2cc(Nc3nc(NC4CC4)c4occc4n3)ccc12
BDBM50235817 FC(F)(F)CNc1nc(Nc2ccc(N3CCOCC3)c(Cl)c2)nc2ccoc12
BDBM364051 CC(C)CNCc1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM364052 CN(C1CCC(O)CC1)c1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1 |(-2.67,-2.7,;-2.67,-1.16,;-4,-.38,;-4,1.16,;-5.33,1.93,;-6.67,1.16,;-8,1.93,;-6.67,-.38,;-5.33,-1.16,;-1.33,-.38,;-1.33,1.16,;,1.93,;,3.46,;1.33,1.16,;1.33,-.38,;,-1.16,;2.67,-1.16,;2.67,-2.7,;4,-3.46,;5.33,-2.7,;6.67,-3.46,;8,-2.7,;8,-1.16,;6.67,-.38,;6.67,1.16,;5.33,-1.16,;4,-.38,)|
BDBM364053 Nc1ncnc2ccc(nc12)-c1cccc(Oc2ccccn2)c1
BDBM364054 Nc1ncnc2ccc(nc12)-c1cccc(c1)C1CC1CN1CCCC1
BDBM364055 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CNCC2CC2)c1
BDBM364056 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CNC2CCC2)c1
BDBM364057 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CNC2COC2)c1
BDBM364058 CC(CO)N(C)c1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM364059 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CNC2CCCC2)c1
BDBM364060 CC(C)NCc1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM364061 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CNC2CCOCC2)c1
BDBM364062 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CNCC2CCOC2)c1
BDBM364063 CN1CCC(CC1)NCc1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM364064 CN(c1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1)C1(CO)CC1
BDBM363972 CN(Cc1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1)C1CCN(C)CC1
BDBM364065 CCOC(=O)N1CCC(CC1)N(C)c1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM364066 CN(CCO)c1cccc(c1)-c1ccc2ncnc(N)c2n1
BDBM364067 Nc1ncnc2ccc(nc12)-c1cccc(CNCC2CC2)c1
BDBM364068 Nc1ncnc2ccc(nc12)-c1cccc(CNC2CCC2)c1
BDBM364069 CC(C)CNCc1cccc(c1)-c1ccc2ncnc(N)c2n1
BDBM363929 Cc1cn(C)nc1C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM363930 Cc1cnn(C)c1C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM363761 Nc1ncnc2ccc(cc12)-c1cncc(c1)C#N
BDBM363769 Clc1cccc(c1)-c1ccc2ncnc(Nc3ccncc3)c2c1
BDBM363830 Nc1ncnc2ccc(nc12)N1CCCCC1
BDBM363838 CC1CN(CCN1C(=O)OC(C)(C)C)c1ccc2ncnc(N)c2n1
BDBM363849 Cn1cncc1C1CCN(C1)c1ccc2ncnc(N)c2n1
BDBM363878 CN(C)C(=O)c1cccc(n1)C1CCCN(C1)c1ccc2ncnc(N)c2n1
BDBM363885 CNc1cc(CC2CCN(C2)c2ccc3ncnc(N)c3n2)ncn1
BDBM364070 CN(c1cccc(c1)-c1ccc2ncnc(N)c2n1)C1(CO)CC1
BDBM364071 CN(C)CCNCc1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM364072 CN(C)C(=O)CN(C)c1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM364073 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CNCCN2CCCC2)c1
BDBM364074 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CNCC2CCOCC2)c1
BDBM364075 CN(Cc1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1)C1CCCCN1C
BDBM363935 CC(=O)N1CCCN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)CC1
BDBM363936 CC(=O)N1CCN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)CC1
BDBM363937 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CN2CCC(O)CC2)c1
BDBM363938 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CN2CCC(CO)CC2)c1
BDBM364077 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CNCCN2CCOCC2)c1
BDBM364078 CN(C1CCN(CC1)C(C)=O)c1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM364079 CN1CC(C1)NCc1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM364080 Nc1ncnc2ccc(nc12)-c1cccc(CNC2CC2)c1
BDBM364081 CC(CO)N(C)c1cccc(c1)-c1ccc2ncnc(N)c2n1
BDBM364082 Nc1ncnc2ccc(nc12)-c1cccc(CNC2CCCC2)c1
BDBM364083 CN(C)CCNCc1cccc(c1)-c1ccc2ncnc(N)c2n1
BDBM364084 CC(C)NCc1cccc(c1)-c1ccc2ncnc(N)c2n1
BDBM363939 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CN2CCN(CCO)CC2)c1
BDBM363940 COCCN1CCN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)CC1
BDBM363941 CN(C)C(=O)N1CCN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)CC1
BDBM363942 NC(=O)C1CCN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)CC1
BDBM363943 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CN2CC(F)(F)C2)c1
BDBM363944 CN(C)S(=O)(=O)N1CCN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)CC1
BDBM363945 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CN2CCCOCC2)c1
BDBM364085 Nc1ncnc2ccc(nc12)-c1cccc(CNC2CCOCC2)c1
BDBM364086 Nc1ncnc2ccc(nc12)-c1cccc(CNCC2CCOC2)c1
BDBM364087 CN(C)C(=O)CN(C)c1cccc(c1)-c1ccc2ncnc(N)c2n1
BDBM364088 Nc1ncnc2ccc(nc12)-c1cccc(CNCCN2CCCC2)c1
BDBM364089 CN1CCC(CC1)NCc1cccc(c1)-c1ccc2ncnc(N)c2n1
BDBM364090 Nc1ncnc2ccc(nc12)-c1cccc(CNCC2CCOCC2)c1
BDBM364091 CN(Cc1cccc(c1)-c1ccc2ncnc(N)c2n1)C1CCCCN1C
BDBM364092 CN(Cc1cccc(c1)-c1ccc2ncnc(N)c2n1)C1CCN(C)CC1
BDBM363946 CN(C)C(=O)CN1CCN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)CC1
BDBM363947 CC(C)C(=O)N1CCN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)CC1
BDBM363948 CS(=O)(=O)N1CCN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)CC1
BDBM363949 CN(Cc1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1)C1CCS(=O)(=O)C1
BDBM363950 CN(CC(=O)N1CCOCC1)Cc1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM363951 CN(C1CCN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)C1)C(C)=O
BDBM363952 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CN2C[CH]C2)c1 |^1:20|
BDBM364093 Nc1ncnc2ccc(nc12)-c1cccc(CNCCN2CCOCC2)c1
BDBM364094 CN1CC(C1)NCc1cccc(c1)-c1ccc2ncnc(N)c2n1
BDBM364095 CCOC(=O)N1CCC(CC1)N(C)c1cccc(c1)-c1ccc2ncnc(N)c2n1
BDBM364096 Nc1ncnc2ccc(nc12)-c1cccc(CNC2COC2)c1
BDBM364097 CC(C)(CN1CCOCC1)NCc1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM364098 Cc1c[nH]nc1-c1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM364100 CC(C)(CN1CCOCC1)NCc1cccc(c1)-c1ccc2ncnc(N)c2n1
BDBM363953 CN(C)C1CCN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)CC1
BDBM363954 COC1CCN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)CC1
BDBM363955 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CN2CCCC2)c1
BDBM363956 CC1CCCN1Cc1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM363957 CN(Cc1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1)C1CCN(C)C1
BDBM363958 CN(C)C(=O)CN(C)Cc1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM363959 COCCN(C)Cc1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM363960 CNC(=O)C1CN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)CCN1C
BDBM363961 NC(=O)C1CN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)C1
BDBM363962 CNC(=O)C1CCN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)C1
BDBM363963 CN(C)C(=O)C1CN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)C1
BDBM363964 CN1CCN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)CC1C(N)=O
BDBM363965 CNC(=O)C1CN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)C1
BDBM363966 CN(C)C(=O)CC1CCN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)CC1
BDBM363967 CNC(=O)C1CN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)CCO1
BDBM363968 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CN2CCCC(CO)C2)c1
BDBM363969 CN1CCN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)CC1
BDBM363970 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CN2CCCC(O)C2)c1
BDBM363971 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CN2CCC[C@@H](O)C2)c1
BDBM363973 CN(C)[C@H]1CCN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)C1
BDBM363974 CN(C)C1CCN(Cc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)C1
BDBM363975 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CN2CCC(C2)N2CCOCC2)c1
BDBM363986 Nc1ncnc2ccc(nc12)-c1cc[nH]c(=O)c1
BDBM364013 CC(Nc1ccc2ncnc(N)c2n1)c1cccc(C)n1
BDBM364016 CC(C)(CO)NC(=O)c1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM364017 CNC(=O)c1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM364022 CC(CO)NC(=O)c1cccc(c1)-c1ccc2ncnc(N)c2n1
BDBM364023 CC(CO)NC(=O)c1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM364024 CC(C)(CO)NC(=O)c1cccc(c1)-c1ccc2ncnc(N)c2n1
BDBM364025 Nc1ncnc2ccc(nc12)-c1cccc(c1)C(=O)NC1CCC1
BDBM364026 CN1CCC(CNC(=O)c2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)CC1
BDBM364028 Nc1ncnc2ccc(nc12)-c1cc(F)cc(NCCN2CCCC2)c1
BDBM364029 CNC(=O)c1cccc(c1)-c1ccc2ncnc(N)c2n1
BDBM364031 Nc1ncnc2ccc(nc12)-c1cc(F)cc(c1)C(=O)NCCN1CCCC1
BDBM364032 Nc1ncnc2ccc(nc12)-c1cccc(c1)C(=O)NCCN1CCCC1
BDBM364033 CN(C)CCNC(=O)c1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM364034 CN(C)CCNC(=O)c1cccc(c1)-c1ccc2ncnc(N)c2n1
BDBM364035 CN1CCC(CNC(=O)c2cccc(c2)-c2ccc3ncnc(N)c3n2)CC1
BDBM364036 Nc1ncnc2ccc(nc12)-c1cc(F)cc(NS(=O)(=O)CCN2CCCCC2)c1
BDBM364037 CN1CCN(CCS(=O)(=O)Nc2cc(F)cc(c2)-c2ccc3ncnc(N)c3n2)CC1
BDBM364038 Nc1ncnc2ccc(nc12)-c1cc(F)cc(NS(=O)(=O)CCN2CCOCC2)c1
BDBM364039 Nc1ncnc2ccc(nc12)-c1cc(F)cc(NC2(CN3CCCC3)COC2)c1
BDBM364040 CC(C)Nc1ncnc2ccc(nc12)-c1cccc(F)c1
BDBM364041 CNc1ncnc2ccc(nc12)-c1cccc(F)c1
BDBM364043 Fc1cccc(c1)-c1ccc2ncnc(NCC3CC3)c2n1
BDBM364044 CCNc1ncnc2ccc(nc12)-c1cccc(F)c1
BDBM364045 CC(C)CNc1ncnc2ccc(nc12)-c1cccc(F)c1
BDBM364046 CN(C)CCCNc1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM364048 Nc1ncnc2ccc(nc12)-c1cc(F)cc(NS(=O)(=O)N2CCCC2)c1
BDBM364049 Nc1ncnc2ccc(nc12)-c1cc(F)cc(CNC2CC2)c1
BDBM364050 CN(CCO)c1cc(F)cc(c1)-c1ccc2ncnc(N)c2n1
BDBM50463479 CS(=O)(=O)Nc1cccc(CC(=O)Nc2nc(cs2)-c2c[nH]c3ncccc23)c1
BDBM50463483 O=C(Cc1cccc(OCCCC2CCNCC2)c1)Nc1nc(cs1)-c1c[nH]c2ncccc12
BDBM50462709 O=C(Cc1cccc(OCCCN2CCNCC2)c1)Nc1nc(cs1)-c1ccncc1
BDBM50469353 CCC[C@H](C)Nc1ncc2c(cn([C@H]3CC[C@H](O)CC3)c2n1)-c1ccc(CN2CCCN(C)CC2)cc1 |r,wU:13.12,wD:16.16,3.3,(17.07,-10.92,;18.4,-10.15,;19.74,-10.92,;21.07,-10.15,;21.07,-8.61,;22.4,-10.92,;23.74,-10.15,;23.74,-8.61,;25.07,-7.84,;26.4,-8.6,;27.88,-8.12,;28.79,-9.38,;27.88,-10.63,;28.63,-11.97,;30.16,-12,;30.91,-13.35,;30.11,-14.67,;30.85,-16.02,;28.57,-14.64,;27.83,-13.29,;26.4,-10.15,;25.07,-10.92,;28.59,-6.76,;30.13,-6.7,;30.84,-5.34,;30.02,-4.03,;30.73,-2.67,;32.27,-2.6,;33,-3.97,;34.51,-4.24,;35.67,-3.22,;35.61,-1.69,;36.96,-.95,;34.36,-.79,;32.87,-1.2,;28.47,-4.1,;27.77,-5.47,)|
BDBM50499634 OC(=O)C1CN(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)C1
BDBM50535489 Nc1ncc(Br)c2ccc(nc12)-c1ccnc(F)c1
BDBM50535490 CN(C)c1ncc(cc1-c1ccc(cc1)S(C)(=O)=O)-c1ccc(O)cc1
BDBM50535494 CC(C)(O)c1cnc(N)c2nc(ccc12)-c1ccnc(F)c1
BDBM50535491 CC(C)NC(=O)c1ccc(cc1)-c1cnc(N)c(c1)-c1ccc(cc1)C#N
BDBM50535492 Fc1cc(ccn1)-c1ccc2ccncc2n1
BDBM50535493 CC(C)NC(=O)c1ccc(cc1)-c1cnc(N(C)C)c(c1)-c1ccc(cc1)C#N
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|
BDBM50541592 CC(O)(C#Cc1ccc2CCN(c2c1)c1nc(N)ncc1Cl)c1nccs1
BDBM482158 COc1cc(ccc1Nc1ncc(Cl)c(Nc2ccccc2S(=O)(=O)C(C)C)n1)N1CCC(CC1)N1CCN(C)CC1
BDBM497267 CCC[C@H](C)Nc1ncc2c(cn([C@H]3CC[C@H](O)CC3)c2n1)C1CCN(CC1)C(=O)c1cc(C)nc(C)c1 |r,wU:13.12,wD:3.3,16.16,(-8.93,-2.23,;-7.59,-1.46,;-6.26,-2.23,;-4.93,-1.46,;-4.93,.08,;-3.59,-2.23,;-2.26,-1.46,;-2.26,.08,;-.93,.85,;.41,.08,;1.87,.56,;2.78,-.69,;1.87,-1.94,;2.35,-3.4,;3.85,-3.72,;4.33,-5.19,;3.3,-6.33,;3.78,-7.79,;1.79,-6.01,;1.32,-4.55,;.41,-1.46,;-.93,-2.23,;2.35,2.02,;3.85,2.34,;4.33,3.81,;3.3,4.95,;1.79,4.63,;1.32,3.16,;3.78,6.41,;3.04,7.77,;5.26,6.02,;6.35,7.1,;7.84,6.71,;8.93,7.79,;8.24,5.22,;7.15,4.13,;7.55,2.64,;5.66,4.53,)|
BDBM613811 Cc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(F)cc2)cc1C
BDBM613778 Cc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(F)cc2)cc1Cl
BDBM613819 Cc1ccc(cc1)-c1ncn(C2CCCCC2)c1-c1ccc(o1)C(=O)Nc1ccc(F)cc1
BDBM613780 Cc1ccc(cc1)-c1ncn(C2CCCCC2)c1-c1ccc(o1)C(=O)Nc1ccccc1F
BDBM613764 Cc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(F)cc2)c(Cl)c1
BDBM50550593 CC(C)(Oc1ccc(cc1)-c1cnc(N)c(c1)-c1ccc(Cl)cc1)C(O)=O
BDBM50550594 Nc1ncc(cc1-c1ccc(Cl)cc1)-c1ccc(cc1)C1(CCCC1)c1nn[nH]n1
BDBM50550595 Nc1ncc(cc1-c1ccc(Cl)cc1)-c1ccc2[C@H](CCc2c1)C(O)=O |r|
BDBM50550596 Nc1ncc(cc1-c1ccc(Cl)cc1)-c1ccc(nc1)C(O)=O
BDBM50550597 Nc1ncc(cc1-c1ccc(Cl)cc1)-c1ccc(cc1)C(O)=O
BDBM50550598 Nc1ncc(cc1-c1ccc(Cl)cc1)-c1ccc(NCC(O)=O)nc1
BDBM50550608 Nc1ncc(cc1-c1ccc(cc1)C#N)-c1ccc(cc1)C(O)=O
BDBM50550609 Cc1ccc(cc1)-c1cc(cnc1N)-c1ccc(cc1)C(O)=O
BDBM50550610 COc1ccc(cc1)-c1cc(cnc1N)-c1ccc(cc1)C(O)=O
BDBM50550611 COc1ncc(cn1)-c1cc(cnc1N)-c1ccc(cc1)C(O)=O
BDBM50550612 Cn1cc(cn1)-c1cc(cnc1N)-c1ccc(cc1)C(O)=O
BDBM50550613 Nc1ncc(cc1COc1ccccc1)-c1ccc(cc1)C(O)=O
BDBM50550614 Nc1ncc(cc1OCc1ccccc1)-c1ccc(cc1)C(O)=O
BDBM50550615 Nc1ncc(cc1OCC1CCC1)-c1ccc(cc1)C(O)=O
BDBM50550616 CC(C)(C(O)=O)c1ccc(cc1)-c1cnc(N)c(c1)-c1ccc(Cl)cc1
BDBM50550625 C[C@@H](Oc1ccc(cc1)-c1cnc(N)c(c1)-c1ccc(Cl)cc1)C(O)=O |r|
BDBM50550626 CC(C)Oc1ccc(cc1)-c1cnc(N)c(c1)-c1ccc(Cl)cc1
BDBM50550627 Nc1ncc(cc1-c1ccc(Cl)cc1)-c1ccc(OC2(CCCC2)C(O)=O)cc1
BDBM50550628 CC(C)(Oc1cccc(c1)-c1cnc(N)c(c1)-c1ccc(Cl)cc1)C(O)=O
BDBM50550629 CC(C)(Oc1ccc(cn1)-c1cnc(N)c(c1)-c1ccc(Cl)cc1)C(O)=O
BDBM50550630 CC(C)(COc1ccc(cc1)-c1cnc(N)c(c1)-c1ccc(Cl)cc1)C(O)=O
BDBM50548191 CCN1CCC(CC1)c1ncc(s1)-c1cnc(N)c(OCc2ccncc2)c1
BDBM50550599 Nc1ncc(cc1-c1ccc(Cl)cc1)-c1cccc(c1)C(O)=O
BDBM50550600 CS(=O)(=O)NC(=O)c1ccc(cc1)-c1cnc(N)c(c1)-c1ccc(Cl)cc1
BDBM50550601 CC(=O)NS(=O)(=O)c1ccc(cc1)-c1cnc(N)c(c1)-c1ccc(Cl)cc1
BDBM50550602 Nc1ncc(cc1-c1ccc(Cl)cc1)-c1ccc(cc1)-c1nn[nH]n1
BDBM50550603 Nc1ncc(cc1-c1ccccc1)-c1ccc(cc1)C(O)=O
BDBM50550604 Nc1ncc(cc1-c1cccc(Cl)c1)-c1ccc(cc1)C(O)=O
BDBM50550605 Nc1ncc(cc1-c1ccccc1Cl)-c1ccc(cc1)C(O)=O
BDBM50550606 Nc1ncc(cc1-c1ccc(F)cc1)-c1ccc(cc1)C(O)=O
BDBM50550607 Nc1ncc(cc1-c1ccc(cc1)C(F)(F)F)-c1ccc(cc1)C(O)=O
BDBM50550617 CC(C)(C(O)=O)c1cccc(c1)-c1cnc(N)c(c1)-c1ccc(Cl)cc1
BDBM50550618 Nc1ncc(cc1-c1ccc(Cl)cc1)-c1ccc(cc1)C1(CCCC1)C(O)=O
BDBM50550619 Nc1ncc(cc1-c1ccc(Cl)cc1)-c1ccc(cc1)C1(CCOCC1)C(O)=O
BDBM50550620 Nc1ncc(cc1-c1ccc(Cl)cc1)-c1ccc2[C@@H](CCc2c1)C(O)=O |r|
BDBM50550621 Nc1ncc(cc1-c1ccc(Cl)cc1)-c1ccc(cc1)C1(CCCC1)C#N
BDBM50550622 Nc1ncc(cc1-c1ccc(Cl)cc1)-c1ccc(CCC(O)=O)cc1
BDBM50550623 Nc1ncc(cc1-c1ccc(Cl)cc1)-c1ccc(OCC(O)=O)cc1
BDBM50550624 C[C@H](Oc1ccc(cc1)-c1cnc(N)c(c1)-c1ccc(Cl)cc1)C(O)=O |r|
BDBM50551644 CC(C)(C)c1cc(NC(=O)Nc2ccc3oc(cc3c2)C(=O)c2cc3cc(O)ccc3[nH]2)no1
BDBM50565637 CC(C)(C)c1cc(NC(=O)Cc2ccc(Nc3ncnc4[nH]c(cc34)-c3ccc(cc3)S(C)(=O)=O)cc2)no1
BDBM50579197 CN(C)CCn1cc(cn1)-c1ccc2c(Nc3ccnc(c3)-c3ccccc3F)ccnc2c1
BDBM50579171 CS(=O)(=O)c1ccc(cc1)-c1ccc2c(Nc3ccnc(c3)-c3cc(F)ccc3F)ccnc2c1
BDBM50579175 CN(C)CCn1cc(cn1)-c1ccc2c(Nc3ccnc(c3)-c3cc(F)ccc3F)ccnc2c1
BDBM50579184 CS(=O)(=O)c1ccc(cc1)-c1ccc2c(Nc3ccnc(c3)-c3ccccc3)ccnc2c1
BDBM50579185 CS(=O)(=O)c1ccc(cc1)-c1ccc2c(Nc3ccnc(c3)-c3ccccc3F)ccnc2c1
BDBM50579186 CS(=O)(=O)c1ccc(cc1)-c1ccc2c(Nc3ccnc(c3)-c3cccc(F)c3)ccnc2c1
BDBM50579187 CS(=O)(=O)c1ccc(cc1)-c1ccc2c(Nc3ccnc(c3)-c3ccc(F)cc3)ccnc2c1
BDBM50579188 Cc1ccccc1-c1cc(Nc2ccnc3cc(ccc23)-c2ccc(cc2)S(C)(=O)=O)ccn1
BDBM50579189 Cc1cccc(c1)-c1cc(Nc2ccnc3cc(ccc23)-c2ccc(cc2)S(C)(=O)=O)ccn1
BDBM50579194 CS(=O)(=O)c1ccc(cc1)-c1ccc2c(Nc3ccnc(c3)-c3ccoc3)ccnc2c1
BDBM50579196 CN(C)CCn1cc(cn1)-c1ccc2c(Nc3ccnc(c3)-c3ccccc3)ccnc2c1
BDBM50579200 CN(C)CCn1cc(cn1)-c1ccc2c(Nc3ccnc(c3)-c3ccccc3C)ccnc2c1
BDBM50579201 CN(C)CCn1cc(cn1)-c1ccc2c(Nc3ccnc(c3)-c3cccc(C)c3)ccnc2c1
BDBM50579202 CN(C)CCn1cc(cn1)-c1ccc2c(Nc3ccnc(c3)-c3ccc(C)cc3)ccnc2c1
BDBM50579206 CN(C)CCn1cc(cn1)-c1ccc2c(Nc3ccnc(c3)-c3ccoc3)ccnc2c1
BDBM50579207 CN(C)CCn1cc(cn1)-c1ccc2c(Nc3ccnc(c3)-c3ccsc3)ccnc2c1
BDBM50579198 CN(C)CCn1cc(cn1)-c1ccc2c(Nc3ccnc(c3)-c3cccc(F)c3)ccnc2c1
BDBM50568968 Cn1cc(cn1)-c1cc2ncnc(Nc3ccc(CC(=O)Nc4cc(nn4C)C(C)(C)C)cc3)c2s1
BDBM585279 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(CCC(O)=O)cc1)-c1ccc(Cl)cc1
BDBM585280 CN1CCN(CC1)c1ccc(NC(=O)c2c[nH]c(n2)-c2c(ncn2C(F)F)-c2ccc(F)cc2)cc1
BDBM585281 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CCN(C)CC1)-c1ccc(cc1)C(F)(F)F
BDBM585282 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CCN(CCO)CC1)-c1ccc(cc1)C(F)(F)F
BDBM585283 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CCN(CCC(O)=O)CC1)-c1ccc(cc1)C(F)(F)F
BDBM585240 CC(C)n1cnc(c1-c1cccc(n1)C(=O)Nc1ccc(cc1)N1CCN(CCO)CC1)-c1ccc(F)cc1
BDBM585241 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CC2CCC(C1)N2C)-c1ccc(F)cc1 |TLB:19:22:29:25.26,30:29:25.26:22.28.23|
BDBM585242 CC(C)n1cnc(c1-c1cccc(n1)C(=O)Nc1ccc(CCC(O)=O)cc1)-c1ccc(F)cc1
BDBM585243 CC(C)n1cnc(c1-c1cccc(n1)C(=O)Nc1ccc(cc1)N1CCN(C)CC1)-c1ccc(F)cc1
BDBM585244 CC(C)n1cnc(c1-c1cccc(n1)C(=O)Nc1ccc(CCO)cc1)-c1ccc(F)cc1
BDBM585245 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CCN(CC1)C(C)=O)-c1ccc(F)cc1
BDBM585246 CN1CCN(CC1)c1ccc(NC(=O)c2c[nH]c(n2)-c2c(ncn2[C@H]2CC[C@H](O)CC2)-c2ccc(F)cc2)cc1 |r,wU:27.30,wD:24.26,(-10.31,-.25,;-8.77,-.25,;-8,-1.58,;-6.46,-1.58,;-5.69,-.25,;-6.46,1.09,;-8,1.09,;-4.15,-.25,;-3.38,-1.58,;-1.84,-1.58,;-1.07,-.25,;.47,-.25,;1.24,1.09,;.47,2.42,;2.78,1.09,;3.68,2.33,;5.15,1.86,;5.15,.32,;3.68,-.16,;6.39,-.59,;7.86,-.11,;8.76,-1.36,;7.86,-2.6,;6.39,-2.13,;5.15,-3.03,;3.74,-2.41,;2.49,-3.31,;2.65,-4.84,;1.41,-5.75,;4.06,-5.47,;5.31,-4.56,;8.33,1.35,;9.84,1.67,;10.31,3.14,;9.28,4.28,;9.76,5.75,;7.78,3.96,;7.3,2.5,;-1.84,1.09,;-3.38,1.09,)|
BDBM585247 OCCN1CCN(CC1)c1ccc(NC(=O)c2c[nH]c(n2)-c2c(ncn2C2CC[C@H](O)CC2)-c2ccc(F)cc2)cc1 |r,wD:29.32,(-11.47,1.09,;-9.93,1.09,;-9.16,-.25,;-7.62,-.25,;-6.85,-1.58,;-5.31,-1.58,;-4.54,-.25,;-5.31,1.09,;-6.85,1.09,;-3,-.25,;-2.23,-1.58,;-.69,-1.58,;.08,-.25,;1.62,-.25,;2.39,1.09,;1.62,2.42,;3.93,1.09,;4.84,2.33,;6.3,1.86,;6.3,.32,;4.84,-.16,;7.55,-.59,;9.01,-.11,;9.92,-1.36,;9.01,-2.6,;7.55,-2.13,;6.3,-3.03,;6.46,-4.56,;5.22,-5.47,;3.81,-4.84,;2.56,-5.75,;3.65,-3.31,;4.89,-2.41,;9.49,1.35,;10.99,1.67,;11.47,3.14,;10.44,4.28,;10.91,5.75,;8.93,3.96,;8.46,2.5,;-.69,1.09,;-2.23,1.09,)|
BDBM585248 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CCN(CC1)S(N)(=O)=O)-c1ccc(F)cc1
BDBM585249 CC(C)n1cnc(c1-c1ccc(o1)C(=O)Nc1ccc(cc1)N1CCN(C)CC1)-c1ccc(F)cc1
BDBM585251 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CC(C)N(C)C(C)C1)-c1ccc(F)cc1
BDBM585252 CN1C2CCC1CN(C2)c1ccc(NC(=O)c2c[nH]c(n2)-c2c(ncn2CC(F)(F)F)-c2ccc(F)cc2)cc1 |TLB:0:1:3.4:7.6.8,THB:9:7:1:3.4|
BDBM585253 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CCN(C)CC1)-c1ccc(F)cc1
BDBM585254 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CCNCC1)-c1ccc(F)cc1
BDBM585255 CC(C)n1cnc(c1-c1ccc(o1)C(=O)Nc1ccc(CCO)cc1)-c1ccc(F)cc1
BDBM585256 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CCN(CCO)CC1)-c1ccc(F)cc1
BDBM585257 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(CCCCC(O)=O)cc1)-c1ccc(F)cc1
BDBM585258 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CCN(CC(F)(F)F)CC1)-c1ccc(F)cc1
BDBM585259 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N(CCO)CCO)-c1ccc(F)cc1
BDBM585260 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CC[N+](C)([O-])CC1)-c1ccc(F)cc1
BDBM585261 CC1CN(CC(C)N1C)c1ccc(NC(=O)c2c[nH]c(n2)-c2c(ncn2CC(F)(F)F)-c2ccc(F)cc2)cc1
BDBM585262 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CCN(C)C(=O)C1)-c1ccc(F)cc1
BDBM585263 CC(=O)N1CCN(CC1)c1ccc(NC(=O)c2c[nH]c(n2)-c2c(ncn2CC(F)(F)F)-c2ccc(F)cc2)cc1
BDBM585264 Fc1ccc(cc1)-c1ncn(CC(F)(F)F)c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CCNCC1
BDBM585265 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(CCO)cc1)-c1ccc(F)cc1
BDBM585266 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CCN(C)CC1)-c1ccc(F)c(F)c1
BDBM585267 CN1CCN(CC1=O)c1ccc(NC(=O)c2c[nH]c(n2)-c2c(ncn2CC(F)(F)F)-c2ccc(F)cc2)cc1
BDBM585268 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CCN(CCO)CC1)-c1ccc(F)c(F)c1
BDBM585269 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(CCC(O)=O)cc1)-c1ccc(F)cc1
BDBM585270 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CCN(C)CC1)-c1ccc(Cl)cc1
BDBM585271 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CCN(CC1)C(N)=O)-c1ccc(F)cc1
BDBM585272 C[N+]1([O-])CCN(CC1)c1ccc(NC(=O)c2c[nH]c(n2)-c2c(ncn2CC(F)(F)F)-c2ccc(F)cc2)cc1
BDBM585273 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CCN(CCO)CC1)-c1ccc(Cl)cc1
BDBM585274 CN1CCN(CC1)c1ccc(NC(=O)c2c[nH]c(n2)-c2c(ncn2CC(F)(F)F)-c2ccc(F)cc2)cc1
BDBM585275 CC(C)n1cnc(c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)C(O)=O)-c1ccc(F)cc1
BDBM585276 Fc1ccc(cc1)-c1ncn(CC(F)(F)F)c1-c1nc(c[nH]1)C(=O)Nc1ccc(cc1)N1CCN(CC(F)(F)F)CC1
BDBM585277 CN1CCN(CC1)c1ccc(NC(=O)c2c[nH]c(n2)-c2c(ncn2CC(C)(C)C)-c2ccc(F)cc2)cc1
BDBM585278 CN1CCN(CC1)c1ccc(NC(=O)c2c[nH]c(n2)-c2c(ncn2C)-c2ccc(F)cc2)cc1
BDBM50585632 CN1CCN(CC1)c1cc(Nc2cc(C)n[nH]2)nc(Nc2ccc(CC(=O)Nc3cccc(F)c3)cc2)n1
BDBM613803 Cc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)c(C)c1
BDBM613777 Cc1cc(C)c(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)c(C)c1
BDBM613742 Cc1cc(C)c(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(F)cc2)c(C)c1
BDBM613773 Cc1cc(Cl)ccc1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCC1)-c1ccc(F)cc1
BDBM613817 Fc1ccc(cc1)-c1ncn(C2CCCCC2)c1-c1ccc(o1)C(=O)Nc1cccc(F)c1
BDBM613796 Fc1ccc(cc1)-c1ncn(C2CCCCC2)c1-c1ccc(o1)C(=O)Nc1ccc(F)cc1F
BDBM613738 Cc1ccc(Cl)cc1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCC1)-c1ccc(F)cc1
BDBM613814 Cc1cc(F)ccc1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCC1)-c1ccc(F)cc1
BDBM608267 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ccc(o1)C(=O)Nc1ccccc1Br
BDBM21 COc1cc2c(Nc3ccc(Br)cc3F)ncnc2cc1OCC1CCN(C)CC1
BDBM613839 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1cccc(n1)C(=O)Nc1ccccc1F
BDBM613785 Fc1ccc(cc1)-c1ncn(C2CCCCC2)c1-c1ccc(o1)C(=O)Nc1ccccc1Cl
BDBM613807 Cc1cccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)c1C
BDBM613813 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ccc(o1)C(=O)Nc1ccc(F)cc1F
BDBM613802 CC(=O)Nc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(F)cc2)cc1
BDBM613771 COc1cc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(F)cc2)cc(OC)c1
BDBM613789 Cc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(F)cc2)c(C)c1
BDBM613781 CC(=O)c1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)cc1
BDBM613800 Fc1ccc(cc1)-c1ncn(C2CCCCC2)c1-c1ccc(o1)C(=O)Nc1ccc(Cl)cc1
BDBM613792 COc1cccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(F)cc2)c1
BDBM613776 CCc1cccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(F)cc2)c1
BDBM613766 CCc1ccccc1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCCC1)-c1ccc(F)cc1
BDBM613881 Oc1cncc(F)c1NC(=O)c1ccc(o1)-c1c(ncn1C1COCC1F)-c1ccc(F)cc1
BDBM613840 Fc1ccc(cc1)C1=C(C(CC2CCCC2)C=N1)c1ccc(o1)C(=O)Nc1ccccc1F |c:18,t:8|
BDBM613774 CC(C)c1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(F)cc2)cc1
BDBM613843 Fc1ccc(cc1)-c1ncn(C2CC2)c1-c1ccc(o1)C(=O)Nc1ccccc1F
BDBM613791 Cc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)cc1Cl
BDBM613824 Cc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)cc1
BDBM613735 CCOC(=O)c1cccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)c1
BDBM608237 CCOC(=O)c1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)cc1
BDBM613812 Fc1ccc(cc1)-c1ncn(C2CCCCC2)c1-c1ccc(o1)C(=O)Nc1ccccc1F
BDBM613850 Fc1ccc(cc1)-c1ncn(C2CCNCC2)c1-c1ccc(o1)C(=O)Nc1ccccc1F
BDBM613851 Fc1ccccc1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCC1)-c1ccncc1
BDBM613852 Fc1ccccc1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCC1)-c1cccnc1
BDBM613815 Cc1ccccc1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCCC1)-c1ccc(F)cc1
BDBM613830 Fc1ccc(cc1)-c1ncn(C2CCNC2)c1-c1ccc(o1)C(=O)Nc1ccccc1F
BDBM613831 Fc1ccc(cc1)-c1ncn(C2CCOC2)c1-c1ccc(o1)C(=O)Nc1ccccc1F
BDBM613741 COC(=O)c1ccccc1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCC1)-c1ccc(F)cc1
BDBM613854 Fc1ccccc1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCC1)-c1cncnc1
BDBM613855 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ccc(NC(=O)c2ccccc2F)o1
BDBM613856 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ccc(s1)C(=O)Nc1ccccc1F
BDBM613857 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ccc([nH]1)C(=O)Nc1ccccc1F
BDBM613859 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1cnc(o1)C(=O)Nc1ccccc1F
BDBM613833 Fc1ccc(cc1)-c1ncn(CC2CCCN2)c1-c1ccc(o1)C(=O)Nc1ccccc1F
BDBM613829 CC(C)n1cnc(c1-c1ccc(o1)C(=O)Nc1ccccc1F)-c1ccc(F)cc1
BDBM613786 Cc1ccc(C)c(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)c1
BDBM613860 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ncc(s1)C(=O)Nc1ccccc1F
BDBM613862 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1nnc([nH]1)C(=O)Nc1ccccc1F
BDBM613865 Fc1ccc(cc1)-c1ncn(CC2CCOC2)c1-c1ccc(o1)C(=O)Nc1ccncc1F
BDBM613770 CC(=O)c1cccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)c1
BDBM613866 COc1cnccc1NC(=O)c1ccc(o1)-c1c(ncn1CC1CCOC1)-c1ccc(F)cc1
BDBM613867 COc1cnccc1NC(=O)c1ccc(o1)-c1c(ncn1C1CCOC1)-c1ccc(F)cc1
BDBM613868 COc1cnccc1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCC1)-c1ccc(F)cc1
BDBM613869 Fc1ccc(cc1)-c1ncn(C2COCC2(F)F)c1-c1ccc(o1)C(=O)Nc1ccncn1
BDBM613870 Oc1cncc(F)c1NC(=O)c1ccc(o1)-c1c(ncn1C1COCC1(F)F)-c1ccc(F)cc1
BDBM613871 Fc1ccc(cc1)-c1ncn(C2COCC2(F)F)c1-c1ccc(o1)C(=O)Nc1cc[nH]c(=O)c1
BDBM613805 Cc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)cc1F
BDBM613733 CSc1cccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(F)cc2)c1
BDBM613872 Oc1cncc(F)c1NC(=O)c1ccc(o1)-c1c(ncn1C1COC1)-c1ccc(F)cc1
BDBM613873 Fc1ccc(cc1)-c1ncn(C2COC2)c1-c1ccc(o1)C(=O)Nc1cc[nH]c(=O)c1
BDBM613874 Cc1cc(NC(=O)c2ccc(o2)-c2c(ncn2C2COC2)-c2ccc(F)cc2)c(F)cn1
BDBM613875 Cn1cnc(c1-c1ccc(o1)C(=O)Nc1ccncc1F)-c1ccc(F)cc1
BDBM613876 NS(=O)(=O)c1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)c(F)c1
BDBM613877 C[NH+]1CCN(CC1)c1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)c(F)c1
BDBM608270 Fc1ccc(cc1)-c1ncn(C2CCCCC2)c1-c1ccc(o1)C(=O)Nc1ccc(Cl)cc1F
BDBM608253 CSc1cccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)c1
BDBM613878 FC1COCC1n1cnc(c1-c1ccc(o1)C(=O)Nc1ccncc1F)-c1ccc(F)cc1
BDBM613879 F[C@@H]1COC[C@H]1n1cnc(c1-c1ccc(o1)C(=O)Nc1ccncc1F)-c1ccc(F)cc1 |r|
BDBM613880 FC1COCC1n1cnc(c1-c1ccc(o1)C(=O)Nc1ccncn1)-c1ccc(F)cc1
BDBM613883 Cc1cc(NC(=O)c2ccc(o2)-c2c(ncn2C2COCC2F)-c2ccc(F)cc2)c(F)cn1
BDBM613808 Fc1ccc(cc1)-c1ncn(C2CCCCC2)c1-c1ccc(o1)C(=O)Nc1ccc(F)c(F)c1
BDBM613768 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ccc(o1)C(=O)Nc1ccccc1C(F)(F)F
BDBM613793 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ccc(o1)C(=O)Nc1ccccc1Cl
BDBM613820 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ccc(o1)C(=O)Nc1ccccc1F
BDBM497376 COc1cc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(C)cc2)cc(OC)c1
BDBM613823 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ccc(o1)C(=O)Nc1cccc(F)c1
BDBM613832 Fc1ccc(cc1)-c1ncn(CC2CCCO2)c1-c1ccc(o1)C(=O)Nc1ccccc1F
BDBM613828 Fc1ccc(cc1)-c1ncn(CC2CCNC2)c1-c1ccc(o1)C(=O)Nc1ccccc1F
BDBM613827 Fc1ccc(cc1)-c1ncn(CC2CCOC2)c1-c1ccc(o1)C(=O)Nc1ccccc1F
BDBM613739 CC(=O)c1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(F)cc2)cc1
BDBM613757 CC(=O)c1cccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(F)cc2)c1
BDBM613835 Fc1ccc(cn1)-c1ncn(C2CCCC2)c1-c1ccc(o1)C(=O)Nc1ccccc1F
BDBM613798 Cc1cccc(C)c1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCCC1)-c1ccc(F)cc1
BDBM613822 Cc1cccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)c1
BDBM613809 Cc1cccc(C)c1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCC1)-c1ccc(F)cc1
BDBM613886 O[C@H]1CC[C@H](C1)n1cnc(c1-c1ccc(o1)C(=O)Nc1ccncc1F)-c1ccc(F)cc1 |r|
BDBM613754 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ccc(o1)C(=O)Nc1ccc(OC(F)(F)F)cc1
BDBM613790 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ccc(o1)C(=O)Nc1cc(F)ccc1F
BDBM613775 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ccc(o1)C(=O)Nc1ccc(Br)cc1
BDBM613763 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ccc(o1)C(=O)Nc1ccc(Cl)cc1F
BDBM613837 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ncc([nH]1)C(=O)Nc1ccccc1F
BDBM613794 Cc1cccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCCC2)-c2ccc(F)cc2)c1C
BDBM613838 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ccc(o1)C(=O)Nc1ccncc1F
BDBM613816 CC(=O)Nc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)cc1
BDBM613797 CC(C)c1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)cc1
BDBM613836 Fc1ccc(cc1)-c1ncn(C2CCCC2)c1-c1ncc(o1)C(=O)Nc1ccccc1F
BDBM613801 CCc1ccc(NC(=O)c2ccc(o2)-c2c(ncn2C2CCCC2)-c2ccc(F)cc2)cc1
BDBM628273 OCCOc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628274 CC(=O)NCc1cccc(c1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628275 NCc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628276 NCc1cccc(c1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628277 NCC(=O)Nc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628278 CNCC(=O)Nc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628279 NCCOc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628280 CNCc1cccc(c1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628281 O=c1[nH]cnc2n(cc(-c3ccc(OCC4CNC4)cc3)c12)-c1ccccc1
BDBM628282 CNCCC(=O)Nc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628283 OC(=O)Cc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628284 NC(=O)Cc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628285 O=c1[nH]cnc2c(cn(-c3ccccc3)c12)-c1ccc(OCCCN2CCOCC2)cc1
BDBM628286 COc1ccc(cc1)-n1cc(-c2ccc(OCCCN(C)C)cc2)c2nc[nH]c(=O)c12
BDBM628287 CN1CCC(CC1)Oc1ccc(cc1)-c1cn(-c2ccccc2)c2c1nc[nH]c2=O
BDBM628288 CC(C)(O)COc1ccc(cc1)-c1cn(-c2ccccc2)c2c1nc[nH]c2=O
BDBM628289 OCC(O)COc1ccc(cc1)-c1cn(-c2ccccc2)c2c1nc[nH]c2=O
BDBM628290 OC(COc1ccc(cc1)-c1cn(-c2ccccc2)c2c1nc[nH]c2=O)CN1CCOCC1
BDBM628292 CN(CC(O)COc1ccc(cc1)-c1cn(-c2ccccc2)c2c1nc[nH]c2=O)C1CC1
BDBM628293 OC(COc1ccc(cc1)-c1cn(-c2ccccc2)c2c1nc[nH]c2=O)CN1CCCC1
BDBM628294 C[C@@H](O)COc1ccc(cc1)-c1cn(-c2ccccc2)c2c1nc[nH]c2=O |r|
BDBM628295 C[C@H](O)COc1ccc(cc1)-c1cn(-c2ccccc2)c2c1nc[nH]c2=O |r|
BDBM628296 ClC1NC=Nc2c(cn(c12)-c1ccccc1)-c1ccc(OCC2CCNC2)cc1 |c:3|
BDBM628297 CN1CCC(COc2ccc(cc2)-c2cn(-c3ccccc3)c3c2nc[nH]c3=O)C1
BDBM628298 CCOC(=O)c1cccc(c1)-c1cn(-c2ccccc2)c2c1nc[nH]c2=O
BDBM628299 O=c1[nH]cnc2c(cn(-c3ccccc3)c12)-c1ccccc1
BDBM628300 CCOC(=O)c1ccc(cc1)-c1cn(-c2ccccc2)c2c1nc[nH]c2=O
BDBM628301 O=c1[nH]cnc2c(cn(-c3ccccc3)c12)-c1ccc(cc1)C#N
BDBM628302 O=c1[nH]cnc2c(cn(-c3ccccc3)c12)-c1cccc(c1)C#N
BDBM628303 OC(=O)c1cccc(c1)-c1cn(-c2ccccc2)c2c1nc[nH]c2=O
BDBM628304 OC(=O)c1ccc(cc1)-c1cn(-c2ccccc2)c2c1nc[nH]c2=O
BDBM628204 OC(=O)c1ccc(cc1)-n1cc(-c2ccccc2)c2c1nc[nH]c2=O
BDBM628205 NC(=O)c1cccc(c1)-n1cc(-c2ccccc2)c2c1nc[nH]c2=O
BDBM628206 CS(=O)(=O)c1ccc(cc1)-n1cc(-c2ccccc2)c2c1nc[nH]c2=O
BDBM628207 O=c1[nH]cnc2n(cc(-c3ccccc3)c12)-c1ccc(Cn2ccnc2)cc1
BDBM628208 CNC(=O)c1ccc(cc1)-n1cc(-c2ccccc2)c2c1nc[nH]c2=O
BDBM628209 NC(=O)c1ccc(cc1)-n1cc(-c2ccccc2)c2c1nc[nH]c2=O
BDBM628256 CN1CCN(CC(O)COc2ccc(cc2)-c2cn(-c3ccccc3)c3nc[nH]c(=O)c23)CC1=O
BDBM628211 CC(C)(O)COc1ccc(cc1C#N)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628212 O=c1[nH]cnc2n(cc(-c3cccc(c3)C#N)c12)-c1ccccc1
BDBM628213 CC(=O)Nc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628214 CCOC(=O)Cc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628215 O=c1[nH]cnc2n(cc(-c3ccc(cc3)C#N)c12)-c1ccccc1
BDBM628216 CC(=O)Nc1cccc(c1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628217 O=c1[nH]cnc2n(cc(-c3ccc(Cn4ccnc4)cc3)c12)-c1ccccc1
BDBM628218 OCC(=O)Nc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628219 CN(C)CCOc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628221 O=C(CN1CCOCC1)Nc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628222 CN1CCN(CC(=O)Nc2ccc(cc2)-c2cn(-c3ccccc3)c3nc[nH]c(=O)c23)CC1
BDBM628224 CN1CCN(CC(=O)Nc2ccc(cc2)-c2cn(-c3cccc(F)c3)c3nc[nH]c(=O)c23)CC1
BDBM628225 O=C1CCCN1c1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628226 O=C1CCCCN1c1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628227 CN(C)CCNC(=O)c1cccc(c1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628228 COc1cccc(c1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628229 COc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628230 CN(C)CC(=O)Nc1cccc(c1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628231 Fc1cccc(c1)-n1cc(-c2ccc(cc2)N2CCCC2=O)c2c1nc[nH]c2=O
BDBM628232 CN(C)CCCOc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628233 O=c1[nH]cnc2n(cc(-c3ccc(OCCCN4CCOCC4)cc3)c12)-c1ccccc1
BDBM628234 COC(COc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12)CN1CCOCC1
BDBM628235 CN1CCN(C1=O)c1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628236 Clc1ccccc1-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628237 CN(C)Cc1cccc(c1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628238 CN(Cc1cccc(c1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12)C(=O)OC(C)(C)C
BDBM628239 CN(C)CCN1CCN(C1=O)c1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628240 Fc1cccc(F)c1-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12 |(-3.42,.87,;-3.02,2.35,;-4.11,3.44,;-3.71,4.93,;-2.22,5.33,;-1.13,4.24,;.35,4.64,;-1.53,2.75,;-.44,1.66,;-.92,.2,;.33,-.71,;.33,-2.25,;-1.01,-3.02,;-1.01,-4.56,;.33,-5.33,;1.66,-4.56,;1.66,-3.02,;1.57,.2,;3.08,-.12,;4.11,1.02,;3.63,2.49,;2.13,2.81,;1.73,4.29,;1.1,1.66,)|
BDBM628241 CN1CCN(CCCOc2ccc(cc2)-c2cn(-c3ccccc3)c3nc[nH]c(=O)c23)CC1
BDBM628242 OCCCOc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628243 CC(C)(O)CN1CCN(C1=O)c1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628244 OC(COc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12)CN1CCOCC1=O
BDBM628245 OC1CCN(C1)C(=O)Nc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628246 CC(C)(O)CCOc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628247 COc1cccc(c1)-n1cc(-c2ccc(OCC(O)CN3CCOCC3)cc2)c2c1nc[nH]c2=O
BDBM628248 OC(COc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12)CN1CCOCC1
BDBM628249 OC(COc1ccc(cc1)-c1cn(-c2cccc(F)c2)c2nc[nH]c(=O)c12)CN1CCOCC1
BDBM628250 OCCNC(=O)c1cccc(c1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628251 OCc1cccc(c1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628252 CN(C)CC(O)COc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628253 OCCOc1cccc(c1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628254 CN1CCN(CC(O)COc2ccc(cc2)-c2cn(-c3ccccc3)c3nc[nH]c(=O)c23)CC1
BDBM628255 OC(COc1ccc(cc1C#N)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12)CN1CCOCC1
BDBM628257 OC(COc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12)CN1CCS(=O)(=O)CC1
BDBM628258 C[C@@H](O)COc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12 |r|
BDBM628259 C[C@H](O)COc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12 |r|
BDBM628260 OCCN1CCN(C1=O)c1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628261 OCCOc1ccc(-c2cn(-c3ccccc3)c3nc[nH]c(=O)c23)c(F)c1
BDBM628262 Cc1cc(OCCO)ccc1-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628263 COCCOc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628264 O=C1NCCN1c1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628265 O=c1[nH]cnc2n(cc(-c3ccc(cc3)N3CCCC3)c12)-c1ccccc1
BDBM628266 CC(C)(C)OC(=O)NCCOc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628267 CC(C)(O)COc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628268 COCCOc1ccc(cc1)-c1cn(-c2cccc(F)c2)c2nc[nH]c(=O)c12
BDBM628269 Fc1ccccc1-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628270 CN1CC(COc2ccc(cc2)-c2cn(-c3ccccc3)c3nc[nH]c(=O)c23)C1
BDBM628271 OCC(O)COc1ccc(cc1)-c1cn(-c2ccccc2)c2nc[nH]c(=O)c12
BDBM628272 OC1(COc2ccc(cc2)-c2cn(-c3ccccc3)c3nc[nH]c(=O)c23)COC1