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501 SMILES Strings for Antrax lethal toxin

Compound NameSMILES String
BDBM1712 CSc1nnc2n(nc(C)c2n1)-c1cccc(C)c1
BDBM1715 O=C(NC1CC1)Nc1ccc2nc(-c3cccs3)c(nc2c1)-c1cccs1
BDBM1718 COc1ccc(OC)c(c1)-c1nc2cc3ccccc3cc2nc1-c1ccccc1
BDBM1775 CCOCCSc1nc2\C(CCc2c(-c2cccs2)c1C#N)=C/c1cccs1
BDBM1735 Cn1c2ccccc2nc(\C=C\c2ccccc2)c1=O
BDBM1795 CCS(=O)(=O)N1N=C(CC1c1ccccc1)c1cccc(NS(C)(=O)=O)c1 |c:6|
BDBM2683 CN(C)CCCn1cc(C2=C(C(=O)NC2=O)c2c[nH]c3ccccc23)c2ccccc12 |t:9|
BDBM3588 Clc1c2oc3ccccc3nc2c2ccccc2c1=O
BDBM3645 [O-][N+](=O)c1cc(cc(c1)[N+]([O-])=O)C(=O)Nc1c[nH]c(=O)[nH]c1=O
BDBM8494 C[C@@H](NS(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM8503 Cc1cc(ccc1F)S(=O)(=O)N[C@H](C1CCOCC1)C(=O)NO |r|
BDBM18957 CCCCc1oc2ccccc2c1C(=O)c1cc(I)c(OCCN(CC)CC)c(I)c1
BDBM31372 [O-][N+](=O)c1ccc(cc1)C1=NN(C(C1)c1ccco1)c1ccccc1 |t:10|
BDBM38452 O=C(Nc1ccc2nc(-c3cccs3)c(nc2c1)-c1cccs1)N1CCOCC1
BDBM42055 N#C\C(=C/c1cccs1)c1nc2ccccc2[nH]1
BDBM44497 CCSc1nnc(o1)-c1sc2nnc(-c3ccccc3)c(-c3ccccc3)c2c1N
BDBM44521 c1c(nc2nc(-c3ccccc3)c(nn12)-c1ccccc1)-c1ccccc1
BDBM47193 Cc1cc2ccccc2n1CCNC(=O)c1ccc(cc1)S(=O)(=O)N1CCCCC1
BDBM47506 Clc1ccc(cc1)C1=NN(C(C1)c1ccco1)c1ccccc1 |t:8|
BDBM51235 Cc1ccc(cc1)-c1cn2nc(-c3ccccc3)c(nc2n1)-c1ccccc1
BDBM51248 [O-][N+](=O)c1cccc(c1)-c1cn2nc(-c3ccccc3)c(nc2n1)-c1ccccc1
BDBM50999 CS(=O)(=O)N1N=C(CC1c1ccc2OCOc2c1)c1ccccc1 |c:5|
BDBM50282 O=C(Nc1ccc2nc3ccccc3nc2c1)c1ccccc1
BDBM50876 O=C(Cc1nc2ccccc2n(-c2ccccc2)c1=O)c1ccccc1
BDBM49541 Cc1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)s1
BDBM53136 CCOc1ccc2nc3cc(NCc4ccc(OC)cc4)ccc3c(N)c2c1
BDBM54587 [O-][N+](=O)c1ccc(cc1)[N+]1=N[C-](CC1c1ccccc1)c1ccccc1 |t:10|
BDBM54591 COc1ccccc1C1CC(=NN1c1ccccc1)c1ccccc1 |c:11|
BDBM54597 Cc1cccc(c1)N1N=C(CC1c1ccccc1)c1ccccc1 |c:9|
BDBM54598 Clc1cccc(c1)N1N=C(CC1c1ccccc1)c1ccccc1 |c:9|
BDBM54599 Clc1ccc(cc1)N1N=C(CC1c1ccccc1)c1ccccc1 |c:9|
BDBM54607 CN(C)c1ccc(cc1)C1CC(=NN1c1ccccc1)c1ccccc1 |c:12|
BDBM54616 COc1ccccc1N1N=C(CC1c1ccccc1)c1ccccc1 |c:10|
BDBM54618 [O-][N+](=O)c1cccc(c1)C1C[C-](N=[N+]1c1ccccc1)c1ccccc1 |c:13|
BDBM60985 On1ccccc1=S
BDBM62820 CC(C)C(=O)NCCn1c(C)cc2ccccc12
BDBM61118 COc1ccccc1[N+]1=N[C-](CC1c1ccccc1)c1ccc(cc1)[N+]([O-])=O |t:9|
BDBM67478 c1ccc(cc1)-c1nc(c(o1)-c1ccccc1)-c1ccccc1
BDBM72525 COc1ccc(cc1OC)C1CC(=NN1c1nc(C)c(s1)C(C)=O)c1cccs1 |c:13|
BDBM72686 O=C1N=C(Nc2nc3ccccc3[nH]2)c2ccccc12 |t:2|
BDBM74437 [H]C12CC3([H])CC([H])(C1)CC(C2)(C3)NC(=O)COC(=O)c1cncc(Br)c1 |TLB:5:3:11:6.9.8,THB:5:6:11:3.12.2,2:3:9:1.11.8|
BDBM78577 CC(C)COCC(CN(Cc1ccccc1)c1ccccc1)N1CCCC1
BDBM76483 CCc1cccc2c(c[nH]c12)C(=O)COC(=O)c1ccccc1
BDBM81261 COc1cc(ccc1C=c1c2cc(-c3ccccc3)[n+](C)n2c2ccccc12)N(C)C
BDBM80824 CC(N=Nc1nc2ccccc2o1)c1cc2ccccc2cn1 |w:3.3|
BDBM87745 CN(C)S(=O)(=O)c1ccc(cc1)C(=O)NCc1ccc2n(C)c(C)cc2c1
BDBM87865 Cc1cc2cc(CNC(=O)c3cccc(c3)[N+]([O-])=O)ccc2[nH]1
BDBM88709 O=C(Cc1ccccc1)c1ccccn1
BDBM88710 [H]C12CCC([H])(C1)c1c2cc(-c2ccc(F)nc2)c2ccn(C)c12 |TLB:23:7:6:3.2,THB:9:8:6:3.2|
BDBM88711 CCCCCCCCC(c1nc2cc(C)c(C)cc2[nH]1)n1c2ccccc2nc(-c2ccccc2Br)c1=O
BDBM88712 Cc1ccc(cc1)-c1nc2cc(C)c(Br)c(C)n2c1Cc1cccc(Cl)c1
BDBM88713 Cc1cc2nc(c(Cc3cccc(Cl)c3)n2c(C)c1Br)-c1cccc(Br)c1
BDBM88714 COc1ccccc1Cc1c(nc2cc(C)c(Br)c(C)n12)-c1ccc(C)cc1
BDBM88715 COc1ccccc1Cc1c(nc2cc(C)c(Br)c(C)n12)-c1ccc(F)cc1
BDBM88692 Cc1cc2cc(CNC(=O)c3c(C)onc3-c3ccccc3Cl)ccc2n1C
BDBM88693 Cc1cc2ccccc2n1CCNC(=O)COc1ccccc1
BDBM88694 CCC(=O)NCCn1c(C)cc2ccccc12
BDBM88695 Cc1cc2cc(CNC(=O)c3ccc(cc3)S(=O)(=O)N3CCCCC3)ccc2[nH]1
BDBM88696 Cc1cc2ccccc2n1CCNC(=O)Cc1ccccc1
BDBM88697 CCc1cccc2c(c[nH]c12)C(=O)COC(=O)c1ccc(O)cc1
BDBM88698 COc1cccc(C(=O)OCC(=O)c2c[nH]c3ccccc23)c1O
BDBM88699 CC1CC2(CCCC2)Nc2c(C)cccc12
BDBM88700 OC(=O)CN1CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC1
BDBM88701 COc1ccc(cc1)C(CNC(=O)c1ccc(OC)c(c1)S(=O)(=O)N1CCCC1)N1CCCC1
BDBM88702 CC(C)[C@H](NC(=O)c1c(F)cccc1F)C(=O)Nc1ccc2nc(C)sc2c1
BDBM88703 COc1ccc(cc1)C(CNC(=O)c1cc(ccc1C)S(=O)(=O)N1CCCCC1)N1CCCC1
BDBM88704 CN(CC(=O)NC1CCN(Cc2ccccc2)CC1)S(=O)(=O)c1ccc(Cl)cc1
BDBM88705 COc1ccc(cc1OC)C(=O)OCC(=O)c1c[nH]c2ccccc12
BDBM88706 COc1ccccc1C(CNC(=O)c1ccc(C)c(c1)S(=O)(=O)N1CCCCC1)N1CCCC1
BDBM88707 Cc1[nH]c2ccccc2c1C(=O)COC(=O)c1ccccc1O
BDBM88708 CN(C)c1ccc(\C=C2\C[N+](C)(C)C\C(=C\c3ccc(cc3)N(C)C)C2=O)cc1
BDBM91540 Cc1csc(n1)N1N=C(CC1c1ccccc1)c1ccccc1 |c:8|
BDBM91541 COc1cccc(c1)C1CC(=NN1c1ccccc1)c1ccccc1 |c:11|
BDBM91542 Clc1ccc(cc1)C1=NN(C(C1)c1ccccc1)c1ccccc1 |t:8|
BDBM91543 C1C(N(N=C1c1ccccc1)c1ccccc1)c1ccccc1 |c:3|
BDBM91544 COc1cc(cc(OC)c1OC)C1CC(=NN1c1ccccc1)c1ccccc1 |c:15|
BDBM91545 COc1ccc(cc1OC)C1CC(=NN1c1ccccc1)c1ccccc1 |c:13|
BDBM91546 COc1ccc(cc1)C1=NN(C(C1)c1ccco1)c1ccccc1 |t:9|
BDBM91547 O=C(Nc1ccc2nc(-c3cccs3)c(nc2c1)-c1cccs1)N1CCCCC1
BDBM91548 C1Oc2ccc(cc2O1)C1CC(=NN1c1ccccc1)c1ccccc1 |c:13|
BDBM91549 Clc1cccc(c1)C1CC(=NN1c1ccccc1)c1ccccc1 |c:10|
BDBM91550 Cc1ccc(cc1)C1CC(=NN1c1ccccc1)c1ccccc1 |c:10|
BDBM91551 Clc1ccc(cc1)C1CC(=NN1c1ccccc1)c1ccccc1 |c:10|
BDBM91552 Cc1csc(n1)N1N=C(CC1c1ccc(F)cc1)c1cccs1 |c:8|
BDBM91553 COc1ccc(cc1OC)C1=NN(C(C1)c1ccccc1)c1nc(C)cs1 |t:11|
BDBM91554 Cc1csc(n1)N1N=C(CC1c1ccc(C)cc1)c1cccs1 |c:8|
BDBM91555 Cc1csc(n1)N1N=C(CC1c1cccc(C)c1)c1cccs1 |c:8|
BDBM91556 Cc1ccc(cc1)C1=NN(C(C1)c1ccccc1)c1ccccc1 |t:8|
BDBM91557 c1c(nn(c1-c1ccccc1)-c1ccccc1)-c1ccccc1
BDBM91558 O=C(N1CCOCC1)c1ccc2nc(-c3cccs3)c(nc2c1)-c1cccs1
BDBM91559 COc1ccc(cc1)C1=NN(C(C1)c1ccccc1)c1ccccc1 |t:9|
BDBM91560 Fc1ccccc1C1CC(=NN1c1ccccc1)c1ccccc1 |c:10|
BDBM91561 Cc1ccc(cc1)N1N=C(CC1c1ccccc1)c1ccccc1 |c:9|
BDBM91562 COc1ccc(cc1)C1CC(=NN1c1ccccc1)c1ccccc1 |c:11|
BDBM91563 C1C(N(N=C1c1ccccc1)c1ccccc1)c1ccco1 |c:3|
BDBM91564 Clc1ccc(cc1)-c1cn2nc(-c3ccccc3)c(nc2n1)-c1ccccc1
BDBM91565 O=C(NCc1ccccc1)c1ccc2nc(-c3cccs3)c(nc2c1)-c1cccs1
BDBM91566 O=C(NC1CCCCC1)c1ccc2nc(-c3cccs3)c(nc2c1)-c1cccs1
BDBM91567 CN(C)c1ccc(cc1)C1=NN(C(C1)c1ccccc1)c1ccccc1 |t:10|
BDBM91568 O=C(NC1CC1)c1ccc2nc(-c3cccs3)c(nc2c1)-c1cccs1
BDBM91569 COc1ccc(cc1)-c1cn2nc(-c3ccccc3)c(nc2n1)-c1ccccc1
BDBM91570 COc1ccc(cc1)C1=NN(C(C1)c1ccccc1)c1nc(C)cs1 |t:9|
BDBM91571 Cc1csc(n1)N1N=C(CC1c1ccccc1)c1ccccc1C |c:8|
BDBM91572 Cc1csc(n1)N1N=C(CC1c1ccccc1)c1ccc(C)cc1 |c:8|
BDBM50064899 COc1ccc(cc1OC)-c1oc2c(OC)c(OC)c(OC)c(O)c2c(=O)c1OC
BDBM50099857 CC(=O)NO
BDBM50100895 NC(=N)c1ccc(Oc2ccc(cc2)-c2cc3ccc(cc3[nH]2)C(N)=N)cc1
BDBM50215899 CCCCCCCC\C=C/CCCCCCCC(=O)NCCc1ccc(O)c(O)c1
BDBM50215900 CCCCCCCC\C=C/CCCCCCCC(=O)NCCc1cc(O)c(O)c(O)c1
BDBM50215901 CCCCCCCC\C=C/CCCCCCCC(=O)NCCc1ccc(cc1)C(=O)NO
BDBM50215902 CCCCCCCC\C=C/CCCCCCCC(=O)NCCc1cc(O)c(O)cc1O
BDBM50240721 CCCCCCCCCCCCC\C=C\[C@@H](O)[C@H](CO)N(C)C |r|
BDBM50261975 CC(C)(C)c1ccc(cc1)-c1noc(n1)C(=O)NNC(=S)Nc1ccc(cc1)C(F)(F)F
BDBM50294384 Cc1ccc(cc1Cl)S(=O)(=O)Nc1cccs1
BDBM50294385 COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)Nc1cccs1
BDBM50294288 Clc1ccc2cc(ccc2c1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294289 Cc1cc(C)n(n1)-c1ccc(cc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294386 Clc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)Nc1cccs1
BDBM50294387 Cc1ccc(cc1Cl)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294388 Clc1ccc(cc1Cl)-c1ccc(cc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294389 O=S(=O)(Nc1sccc1-c1nc2ccccc2s1)c1ccc2ccccc2c1
BDBM50294390 Brc1ccc(cc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294391 FC(F)(F)c1ccc(cc1)-c1ccc(cc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294392 O=S(=O)(Nc1sccc1-c1nc2ccccc2s1)c1ccc(cc1)-n1cccn1
BDBM50294393 Cc1csc(NS(=O)(=O)c2ccc(C)c(Cl)c2)c1-c1nc2ccccc2s1
BDBM50294394 Clc1ccc(cc1Cl)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294395 COc1ccc(cc1OC)-c1ccc(cc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294396 Clc1ccccc1Oc1ccc(cc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294397 FC(F)(F)c1ccccc1S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294398 Cc1csc(NS(=O)(=O)c2cccc(c2)C(F)(F)F)c1-c1nc2ccccc2s1
BDBM50294399 FC(F)(F)Oc1ccc(cc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294400 Cc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294401 FC(F)(F)c1cc(ccc1Cl)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294402 O=S(=O)(Nc1sccc1-c1nc2ccccc2s1)c1ccc2ncsc2c1
BDBM50294403 Cc1c(sc2ccccc12)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294404 Cc1csc(NS(=O)(=O)c2ccc(cc2)[N+]([O-])=O)c1-c1nc2ccccc2s1
BDBM50294405 Cc1csc(NS(=O)(=O)c2ccc(Cl)c(c2)C(F)(F)F)c1-c1nc2ccccc2s1
BDBM50294406 Cc1csc(NS(=O)(=O)c2cccc(OC(F)(F)F)c2)c1-c1nc2ccccc2s1
BDBM50294407 COc1cccc(c1)S(=O)(=O)Nc1scc(C)c1-c1nc2ccccc2s1
BDBM50294408 FC(F)(F)c1ccc(cc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294409 Cc1ccc(cc1F)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294290 CC(C)(C)C(=O)CSC1NN=C(S1)c1ccccc1 |c:10|
BDBM50294291 Cc1csc(NS(=O)(=O)c2ccc3ccccc3c2)c1-c1nc2ccccc2s1
BDBM50294292 Cc1csc(NS(=O)(=O)c2ccc(cc2)-c2ccc(Cl)cc2)c1-c1nc2ccccc2s1
BDBM50294293 Cc1cc(ccc1F)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294294 O=S(=O)(Nc1sccc1-c1nc2ccccc2s1)c1ccc(cc1)-c1cncs1
BDBM50294295 Cc1nccc(n1)-c1cccc(c1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294296 Cc1ccc(cc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294297 Fc1ccc(cc1Cl)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294298 CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294299 O=S(=O)(Nc1sccc1-c1nc2ccccc2s1)c1cccc(c1)-c1ccccc1
BDBM50294300 O=S(=O)(Nc1sccc1-c1nc2ccccc2s1)c1ccc(cc1)-c1cnco1
BDBM50294301 CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1scc(C)c1-c1nc2ccccc2s1
BDBM50294302 COc1ccc(cc1)-c1cccc(c1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294303 Clc1ccc(cc1)C(=O)NCc1ccc(s1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294304 Cc1csc(NS(=O)(=O)c2ccc(Cl)cc2)c1-c1nc2ccccc2s1
BDBM50294305 Cc1csc(NS(=O)(=O)c2cc(Cl)c(Cl)cc2Cl)c1-c1nc2ccccc2s1
BDBM50294306 Clc1ccc(cc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294307 COc1ccc(cc1)-c1cccc(c1)S(=O)(=O)Nc1scc(C)c1-c1nc2ccccc2s1
BDBM50294308 FC(F)(F)c1cccc(c1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294309 Fc1ccc(cc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294310 Cc1csc(NS(=O)(=O)c2ccc(F)c(C)c2)c1-c1nc2ccccc2s1
BDBM50294311 Cc1csc(NS(=O)(=O)c2ccc(cc2)-c2ccccc2)c1-c1nc2ccccc2s1
BDBM50294312 Cc1csc(NS(=O)(=O)c2ccc(cc2)-c2cc(cc(c2)C(F)(F)F)C(F)(F)F)c1-c1nc2ccccc2s1
BDBM50294313 O=S(=O)(Nc1sccc1-c1nc2ccccc2s1)c1ccc(cc1)S(=O)(=O)N1CCOCC1
BDBM50294314 Cc1csc(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)c1-c1nc2ccccc2s1
BDBM50294315 COc1ccc(cc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294316 Fc1cc(Cl)ccc1S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294317 Clc1ccc(cc1)-c1cccc(c1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294318 CSc1nccc(n1)S(=O)(=O)c1ccc(s1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294319 [O-][N+](=O)c1ccc(\C=C(/C#N)C(=O)c2ccco2)s1
BDBM50294320 Cc1csc(NS(=O)(=O)c2ccc(Cl)cc2F)c1-c1nc2ccccc2s1
BDBM50294321 Cc1csc(NS(=O)(=O)c2cccc(c2)-c2ccccc2)c1-c1nc2ccccc2s1
BDBM50294322 COc1ccc(cc1OC)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294323 O=S(=O)(Nc1sccc1-c1nc2ccccc2s1)c1ccc(s1)-c1ccno1
BDBM50294324 CS(=O)(=O)CS(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294325 COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)Nc1scc(C)c1-c1nc2ccccc2s1
BDBM50294326 Cc1csc(NS(=O)(=O)c2cccc(c2)-c2ccc(Cl)cc2)c1-c1nc2ccccc2s1
BDBM50294327 O=S(=O)(Nc1sccc1-c1nc2ccccc2s1)c1ccc2OCCc2c1
BDBM50294328 CN1CCOc2cc(ccc12)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294329 CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294330 Cc1nnc(o1)-c1cccc(c1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294331 O=S(=O)(Nc1sccc1-c1nc2ccccc2s1)c1ccc2OCCOc2c1
BDBM50294332 CN1CCOc2cc(cnc12)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294333 Cc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294334 Cc1ccc(cc1Cl)S(=O)(=O)Nc1nc2ccccc2s1
BDBM50294335 Fc1c(Cl)cccc1S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294337 Clc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294338 COc1ccc(cc1)-c1ccc(cc1Cl)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294339 COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294340 FC(F)(F)Oc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294341 CCOC(=O)CCc1c(CC(=O)OCC)c[nH]c1CN=O
BDBM50294342 Clc1cc(ccc1Br)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294343 O=S(=O)(Nc1sccc1-c1nc2ccccc2s1)c1ccc2nonc2c1
BDBM50294344 COc1ccc(cc1OC)S(=O)(=O)Nc1scc(C)c1-c1nc2ccccc2s1
BDBM50294345 Cc1csc(NS(=O)(=O)c2ccc(C)c(F)c2)c1-c1nc2ccccc2s1
BDBM50294346 O=S(=O)(Nc1sccc1-c1nc2ccccc2s1)c1ccccc1
BDBM50294347 FC(F)(F)CCOc1ccc(OCCC(F)(F)F)c(c1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294348 O=S(=O)(Nc1sccc1-c1nc2ccccc2s1)c1ccc(Oc2ccccc2)nc1
BDBM50294349 COc1ccc(cc1)S(=O)(=O)Nc1scc(C)c1-c1nc2ccccc2s1
BDBM50294350 Cc1csc(NS(=O)(=O)c2ccc(C)c(c2)[N+]([O-])=O)c1-c1nc2ccccc2s1
BDBM50294351 Cc1csc(NS(=O)(=O)c2cccc(Cl)c2F)c1-c1nc2ccccc2s1
BDBM50294352 Cc1csc(NS(=O)(=O)c2cccc(Cl)c2C)c1-c1nc2ccccc2s1
BDBM50294353 Clc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)Nc1ccccc1-c1nc2ccccc2s1
BDBM50294354 Cc1csc(NS(=O)=O)c1-c1nc2ccccc2s1
BDBM50294355 Cc1csc(NS(=O)(=O)c2ccccc2)c1-c1nc2ccccc2s1
BDBM50294356 Cc1csc(NS(=O)(=O)c2ccccc2C(F)(F)F)c1-c1nc2ccccc2s1
BDBM50294357 Cc1csc(NS(=O)(=O)c2ccc(C)cc2)c1-c1nc2ccccc2s1
BDBM50294358 Cc1csc(NS(=O)(=O)c2ccc(F)cc2)c1-c1nc2ccccc2s1
BDBM50294359 Cc1csc(NS(=O)(=O)c2ccc(F)c(Cl)c2)c1-c1nc2ccccc2s1
BDBM50294360 Cc1csc(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)c1-c1nc2ccccc2s1
BDBM50294361 Cc1csc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1-c1nc2ccccc2s1
BDBM50294362 Cc1csc(NS(=O)(=O)c2cccc(Cl)c2)c1-c1nc2ccccc2s1
BDBM50294364 COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)Nc1oncc1-c1nc2ccccc2s1
BDBM50294365 Clc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)Nc1oncc1-c1nc2ccccc2s1
BDBM50294366 COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)Nc1ccccc1-c1nc2ccccc2s1
BDBM50294363 O=S(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294336 Nc1ccc(Nc2ccc(N)cc2S(O)(=O)=O)cc1
BDBM50294367 Cc1ccc(NS(=O)(=O)c2cccs2)cc1Cl
BDBM50294368 Cc1ccc(NS(=O)(=O)c2cccs2)cc1C(F)(F)F
BDBM50294369 FC(F)(F)c1cccc(NS(=O)(=O)c2cccs2)c1
BDBM50294370 O=S(=O)(Nc1ccccc1)c1cccs1
BDBM50294371 Cc1csc(N(S(=O)(=O)c2cccc(c2)C(F)(F)F)S(=O)(=O)c2cccc(c2)C(F)(F)F)c1-c1nc2ccccc2s1
BDBM50294372 Cc1csc(N(S(=O)(=O)c2ccc(OC(F)(F)F)cc2)S(=O)(=O)c2ccc(OC(F)(F)F)cc2)c1-c1nc2ccccc2s1
BDBM50294373 Cc1csc(N(S(=O)(=O)c2ccc(F)cc2)S(=O)(=O)c2ccc(F)cc2)c1-c1nc2ccccc2s1
BDBM50294374 Cc1c(Cl)cccc1S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294375 COc1ccccc1Oc1ccc(cc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294376 Cc1c(cnn1-c1ccccc1)S(=O)(=O)Nc1sccc1-c1nc2ccccc2s1
BDBM50294377 O=S(=O)(Nc1sccc1-c1nc2ccccc2s1)c1ccco1
BDBM50294378 COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2s1
BDBM50294379 Clc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2s1
BDBM50294380 COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NC1=C(C2CCCCC2S1)c1nc2ccccc2s1 |t:20|
BDBM50294381 Clc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NC1=C(C2CCCCC2S1)c1nc2ccccc2s1 |t:19|
BDBM50294382 COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NCCc1nc2ccccc2s1
BDBM50294383 Clc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NCCc1nc2ccccc2s1
BDBM50310142 CCCNc1nnc(Sc2ncc(s2)[N+]([O-])=O)s1
BDBM50310146 COc1ccc(CCNc2nnc(Sc3ncc(s3)[N+]([O-])=O)s2)cc1OC
BDBM50310147 CCC(C)Nc1nnc(Sc2ncc(s2)[N+]([O-])=O)s1
BDBM50310148 COCCNc1nnc(Sc2ncc(s2)[N+]([O-])=O)s1
BDBM50308032 Clc1ccc(Oc2ccc(cc2)-c2cc3ccc(cc3[nH]2)C2=NCCN2)c(Cl)c1 |t:24|
BDBM50308033 C1CN=C(N1)c1ccc(Oc2ccc(cc2)-c2cc3ccc(cc3s2)C2=NCCN2)cc1 |c:2,t:29|
BDBM50308035 CN(C)CCNC(=N)c1ccc2cc([nH]c2c1)-c1ccc(Oc2ccc(cc2)C(N)=NCCN(C)C)cc1 |w:30.33|
BDBM50308036 Clc1cc(ccc1Oc1ccc(cc1)-c1cc2ccc(cc2[nH]1)C1=NCCN1)C#N |t:27|
BDBM50308038 Fc1ccc(Oc2ccc(cc2)-c2cc3ccc(cc3[nH]2)C2=NCCN2)cc1 |t:24|
BDBM50308039 C1CNC(=NC1)c1ccc(Oc2ccc(cc2)-c2cc3ccc(cc3[nH]2)C2=NCCCN2)cc1 |c:3,t:30|
BDBM50308040 C1CN=C(N1)c1ccc(Oc2ccc(cc2)-c2cc3ccc(cc3[nH]2)C2=NCCN2)cc1 |c:2,t:29|
BDBM50308041 COc1ccc(Oc2ccc(cc2)-c2cc3ccc(cc3[nH]2)C2=NCCN2)cc1 |t:25|
BDBM50308042 NC(=N)c1ccc2cc([nH]c2c1)-c1ccc(Oc2ccc(F)cc2)cc1
BDBM50308043 Clc1ccc2cc([nH]c2c1)-c1ccc(Oc2ccc(cc2)C2=NCCN2)cc1 |t:24|
BDBM50308044 C1CNC(=NC1)c1ccc(Oc2ccc(cc2)-c2cc3ccc(cc3s2)C2=NCCCN2)cc1 |c:3,t:30|
BDBM50308045 C1CN=C(N1)c1ccc(Oc2ccc(nc2)-c2cc3ccc(cc3[nH]2)C2=NCCN2)cc1 |c:2,t:29|
BDBM50308046 NCCNc1ccc(Oc2ccc(cc2)-c2nc3ccc(cc3s2)C2=NCCN2)cc1 |t:27|
BDBM50308047 C1CNC(=NC1)c1ccc(Oc2ccc(nc2)-c2cc3ccc(cc3[nH]2)C2=NCCCN2)cc1 |c:3,t:30|
BDBM50308049 NC(=O)c1ccc(Oc2ccc(cc2)-c2cc3ccc(cc3[nH]2)C(N)=O)cc1
BDBM50308050 N#Cc1ccc(Oc2ccc(nc2)-c2cc3ccc(cc3[nH]2)C#N)cc1
BDBM50308052 Fc1ccc(Oc2ccc(cc2)-c2cc3ccc(cc3[nH]2)C#N)cc1
BDBM50308053 NC(=O)c1ccc2cc([nH]c2c1)-c1ccc(Oc2ccc(F)cc2)cc1
BDBM50308054 COc1ccc(Oc2ccc(cc2)-c2cc3ccc(cc3[nH]2)C(N)=O)cc1
BDBM50308055 COc1ccc(Oc2ccc(cc2)-c2cc3ccc(cc3[nH]2)C(N)=N)cc1
BDBM50308056 NC(=O)c1ccc2nc(sc2c1)-c1ccc(Oc2ccc(F)cc2)cc1
BDBM50308057 NC(=N)c1ccc2cc([nH]c2c1)-c1ccc(Oc2ccc(cc2)C#N)cc1
BDBM50308058 OC1CNC(=NC1)c1ccc(Oc2ccc(cc2)-c2cc3ccc(cc3[nH]2)C2=NCC(O)CN2)cc1 |c:4,t:31|
BDBM50328675 NCCCCCCCCSC[C@H]1O[C@H]2O[C@@H]3[C@@H](CSCCCCCCCCN)O[C@@H](O[C@@H]4[C@@H](CSCCCCCCCCN)O[C@@H](O[C@@H]5[C@@H](CSCCCCCCCCN)O[C@@H](O[C@@H]6[C@@H](CSCCCCCCCCN)O[C@@H](O[C@@H]7[C@@H](CSCCCCCCCCN)O[C@@H](O[C@@H]8[C@@H](CSCCCCCCCCN)O[C@@H](O[C@H]1[C@H](O)[C@H]2O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O |r|
BDBM50328677 NCc1ccc(CSC[C@H]2O[C@H]3O[C@@H]4[C@@H](CSCc5ccc(CN)cc5)O[C@@H](O[C@@H]5[C@@H](CSCc6ccc(CN)cc6)O[C@@H](O[C@@H]6[C@@H](CSCc7ccc(CN)cc7)O[C@@H](O[C@@H]7[C@@H](CSCc8ccc(CN)cc8)O[C@@H](O[C@@H]8[C@@H](CSCc9ccc(CN)cc9)O[C@@H](O[C@@H]9[C@@H](CSCc%10ccc(CN)cc%10)O[C@@H](O[C@H]2[C@H](O)[C@H]3O)[C@H](O)[C@H]9O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)cc1 |r|
BDBM50328676 NCc1cccc(CSC[C@H]2O[C@H]3O[C@@H]4[C@@H](CSCc5cccc(CN)c5)O[C@@H](O[C@@H]5[C@@H](CSCc6cccc(CN)c6)O[C@@H](O[C@@H]6[C@@H](CSCc7cccc(CN)c7)O[C@@H](O[C@@H]7[C@@H](CSCc8cccc(CN)c8)O[C@@H](O[C@@H]8[C@@H](CSCc9cccc(CN)c9)O[C@@H](O[C@@H]9[C@@H](CSCc%10cccc(CN)c%10)O[C@@H](O[C@H]2[C@H](O)[C@H]3O)[C@H](O)[C@H]9O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)c1 |r|
BDBM50328674 NCCCSC[C@H]1O[C@H]2O[C@@H]3[C@@H](CSCCCN)O[C@@H](O[C@@H]4[C@@H](CSCCCN)O[C@@H](O[C@@H]5[C@@H](CSCCCN)O[C@@H](O[C@@H]6[C@@H](CSCCCN)O[C@@H](O[C@@H]7[C@@H](CSCCCN)O[C@@H](O[C@@H]8[C@@H](CSCCCN)O[C@@H](O[C@H]1[C@H](O)[C@H]2O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O |r|
BDBM50329259 Cc1cc(N[C@H](CCCCN)C(=O)NO)cc(C)c1F |r|
BDBM50340754 Cc1cc(C[C@H](CCCCNCc2ccc(F)cc2)C(=O)NO)cc(C)c1F |r|
BDBM50340755 Cc1cc(C[C@H](CCCCNCc2ccc(F)cc2)C(=O)NO)ccc1F |r|
BDBM50340756 Cc1cc(C[C@H](CCCCNCc2ccc(Cl)cc2)C(=O)NO)ccc1F |r|
BDBM50340757 Cc1cc(CNCCCC[C@@H](Cc2cc(C)c(F)c(C)c2)C(=O)NO)ccc1F |r|
BDBM50340758 CO[C@H](C[C@H](CCCCNCc1ccc(F)cc1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50340759 Cc1cc(CNCCCC[C@@H](Nc2ccc(F)c(C)c2)C(=O)NO)ccc1F |r|
BDBM50340760 Cc1cc(N[C@H](CCCCNCc2ccc(Cl)cc2)C(=O)NO)ccc1F |r|
BDBM50340761 Cc1cc(C[C@H](CCCCNCc2ccc(Cl)cc2)C(=O)NO)cc(C)c1F |r|
BDBM50340762 Cc1cc(O[C@H](CCCCNCc2ccc(Cl)cc2)C(=O)NO)ccc1F |r|
BDBM50340763 Cc1cc(N[C@H](CCCCNCc2ccc(F)cc2)C(=O)NO)ccc1F |r|
BDBM50340764 CO[C@H](C[C@H](CCCCNCc1ccc(F)cc1)C(=O)NO)c1ccc(F)c(C)c1 |r|
BDBM50340765 CO[C@H](C[C@H](CCCCNCCc1ccc(F)cc1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50340766 Cc1cc(O[C@H](CCCCNCc2ccc(F)cc2)C(=O)NO)ccc1F |r|
BDBM50340767 CO[C@H](C[C@H](CCCCNCc1ccc(Cl)cc1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50340768 Cc1cc(O[C@H](CCCCNCc2ccc(F)cc2)C(=O)NO)cc(C)c1F |r|
BDBM50340769 Cc1cc(CNCCCC[C@@H](Cc2ccc(F)c(C)c2)C(=O)NO)ccc1F |r|
BDBM50340770 CO[C@H](C[C@H](CCCCNCc1ccc(F)c(C)c1)C(=O)NO)c1ccc(F)c(C)c1 |r|
BDBM50340771 CO[C@H](C[C@H](CCCCNCc1ccc(Cl)cc1)C(=O)NO)c1ccc(F)c(C)c1 |r|
BDBM50340772 CO[C@H](C[C@H](CCCCNCc1ccc(F)c(C)c1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50340773 Cc1cc(CNCCCC[C@@H](Oc2cc(C)c(F)c(C)c2)C(=O)NO)ccc1F |r|
BDBM50340774 Cc1cc(CNCCCC[C@@H](Oc2ccc(F)c(C)c2)C(=O)NO)ccc1F |r|
BDBM50340775 Cc1cc(O[C@H](CCCCNCCc2ccc(F)cc2)C(=O)NO)cc(C)c1F |r|
BDBM50340776 Cc1cc(C[C@H](CCCCNCCc2ccc(F)cc2)C(=O)NO)cc(C)c1F |r|
BDBM50340777 Cc1cc(COCCCC[C@@H](Cc2cc(C)c(F)c(C)c2)C(=O)NO)ccc1F |r|
BDBM50340778 Cc1cc(COCCCC[C@@H](Nc2cc(C)c(F)c(C)c2)C(=O)NO)ccc1F |r|
BDBM50340779 Cc1cc(CCCCCC[C@@H](Nc2cc(C)c(F)c(C)c2)C(=O)NO)ccc1F |r|
BDBM50340780 Cc1cc(CCCCCC[C@@H](Cc2cc(C)c(F)c(C)c2)C(=O)NO)ccc1F |r|
BDBM50340781 Cc1cc(O[C@H](CCCCCNCCc2ccc(F)cc2)C(=O)NO)cc(C)c1F |r|
BDBM50340782 Cc1cc(O[C@H](CCCCCNCc2ccc(F)cc2)C(=O)NO)cc(C)c1F |r|
BDBM50340783 CO[C@H](C[C@H](CCCCCNCCc1ccc(F)cc1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50340784 CO[C@H](C[C@H](CCCCCNCc1ccc(F)cc1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50340785 Cc1cc(O[C@H](CCCCNCc2ccc(Cl)cc2)C(=O)NO)cc(C)c1F |r|
BDBM50340786 ONC(=O)[C@@H](CCCCNCc1ccc(F)cc1)Nc1ccc(F)c(Cl)c1 |r|
BDBM50329258 Cc1cc(ccc1F)C(=O)NCCCC[C@@H](Nc1cc(C)c(F)c(C)c1)C(=O)NO |r|
BDBM50329260 Cc1cc(ccc1F)S(=O)(=O)NCCCC[C@@H](Nc1cc(C)c(F)c(C)c1)C(=O)NO |r|
BDBM50329261 Cc1cc(CNCCCC[C@@H](Nc2cc(C)c(F)c(C)c2)C(=O)NO)ccc1F |r|
BDBM50329262 Cc1cc(NC(=O)NCCCC[C@@H](Nc2cc(C)c(F)c(C)c2)C(=O)NO)ccc1F |r|
BDBM50329263 Cc1cc(N[C@H](CCCCNCc2ccccc2F)C(=O)NO)cc(C)c1F |r|
BDBM50329264 Cc1cc(N[C@H](CCCCNCc2cccc(F)c2)C(=O)NO)cc(C)c1F |r|
BDBM50329265 Cc1cc(N[C@H](CCCCNCc2ccc(F)cc2)C(=O)NO)cc(C)c1F |r|
BDBM50329266 Cc1cc(N[C@H](CCCCNCc2ccc(Cl)cc2)C(=O)NO)cc(C)c1F |r|
BDBM50329267 Cc1ccc(CNCCCC[C@@H](Nc2cc(C)c(F)c(C)c2)C(=O)NO)cc1 |r|
BDBM50329268 COc1ccc(CNCCCC[C@@H](Nc2cc(C)c(F)c(C)c2)C(=O)NO)cc1 |r|
BDBM50329269 Cc1cc(N[C@H](CCCCNCc2ccc(cc2)C(F)(F)F)C(=O)NO)cc(C)c1F |r|
BDBM50329270 Cc1cc(N[C@H](CCCCNCc2ccc(cc2)[N+]([O-])=O)C(=O)NO)cc(C)c1F |r|
BDBM50329271 Cc1cc(N[C@H](CCCCNCc2ccc(cc2)C(C)(C)C)C(=O)NO)cc(C)c1F |r|
BDBM50329272 Cc1cc(N[C@H](CCCCNCCc2ccc(F)cc2)C(=O)NO)cc(C)c1F |r|
BDBM50329273 Cc1cc(N[C@H](CCCCNCCCc2ccc(F)cc2)C(=O)NO)cc(C)c1F |r|
BDBM50329274 CO[C@H](C[C@H](CCN(C)C)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50329275 CO[C@H](C[C@H](CCN1CCCC1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50329276 CO[C@H](C[C@H](CCN1CCCCC1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50329277 CO[C@H](C[C@H](CCN1CCOCC1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50329278 CO[C@H](C[C@H](CCN1CCCC(CO)C1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50329279 CO[C@H](C[C@H](CCN1CCCC(Cc2ccc(F)cc2)C1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50329280 CO[C@H](C[C@H](CCN1CCNCC1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50329281 CO[C@H](C[C@H](CCN1CCN(CC1)c1ccccc1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50329282 CO[C@H](C[C@H](CCN1CCN(Cc2ccccc2)CC1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50329283 CO[C@H](C[C@H](CCN1CCN(CCc2ccccc2)CC1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50329284 CO[C@H](C[C@H](CCN(C)CCCc1ccccc1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50329285 CO[C@H](C[C@H](CCN(C)CCCc1ccc(F)c(C)c1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50329286 CO[C@H](C[C@H](CCN(C)Cc1ccc(cc1)-c1ccc(F)c(C)c1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50335806 Oc1coccc1=S
BDBM50360386 Cc1cc(\C=C(/C#N)c2nc3ccccc3[nH]2)sc1C
BDBM50360387 N#C\C(=C/c1ccc(s1)-c1ccco1)c1nc2ccccc2[nH]1
BDBM50360388 N#C\C(=C/c1ccc(o1)-c1cccs1)c1nc2ccccc2[nH]1
BDBM50360389 N#C\C(=C/c1ccc(s1)-c1cccs1)c1cc2ccccc2[nH]1
BDBM50360390 N#C\C(=C/c1ccc(s1)-c1cccs1)c1nc2ccccc2s1
BDBM50360391 N#C\C(=C/c1ccc(s1)-c1cccs1)c1ccc2ccccc2n1
BDBM50360392 COc1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)cc1I
BDBM50360393 N#C\C(=C/c1ccc(s1)-c1cccs1)c1nc2ccccc2[nH]1
BDBM50360394 COc1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)cc1
BDBM50360396 COc1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)cc1Br
BDBM50360397 COc1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)cc1Cl
BDBM50360398 COc1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)cc1F
BDBM50360399 COc1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)cc1OC
BDBM50360400 COc1cc(\C=C(/C#N)c2nc3ccccc3[nH]2)cc(Cl)c1O
BDBM50360401 COc1cc(cc(Br)c1O)-c1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)cc1
BDBM50360402 N#C\C(=C/c1ccc(cc1)-c1ccccc1)c1nc2ccccc2[nH]1
BDBM50360403 N#C\C(=C/c1ccc(cc1)-c1ncc[nH]1)c1nc2ccccc2[nH]1
BDBM50360404 COc1cc(\C=C(/C#N)c2nc3ccccc3[nH]2)cc(OC)c1OC
BDBM50360405 Clc1ncc(cc1\C=C(/C#N)c1nc2ccccc2[nH]1)-c1ccccc1
BDBM50360406 Clc1ncnc(Cl)c1\C=C(/C#N)c1nc2ccccc2[nH]1
BDBM50360407 Cc1c(\C=C(/C#N)c2nc3ccccc3[nH]2)sc2ccccc12
BDBM50360409 [O-][N+](=O)c1cccc2[nH]cc(\C=C(/C#N)c3nc4ccccc4[nH]3)c12
BDBM50360410 N#C\C(=C/c1c[nH]c2c1ccc1ccccc21)c1nc2ccccc2[nH]1
BDBM50360395 Ic1cccc(\C=C(/C#N)c2nc3ccccc3[nH]2)c1
BDBM50375786 CCCCCCCC\C=C/CCCCCCCC(=O)NCc1ccc(cc1)C(=O)NO
BDBM50375787 CCCCCCCC\C=C/CCCCCCCC(=O)NCc1ccc(O)c(O)c1
BDBM50378658 C1CN=C(N1)c1ccc(cc1)-c1cc2ccc(cc2[nH]1)C1=NCCN1 |c:2,t:24|
BDBM50378659 C1CN=C(N1)c1ccc(cc1)-c1cc2ccc(cc2s1)C1=NCCN1 |c:2,t:24|
BDBM50378660 C1CNC(=NC1)c1ccc(cc1)-c1cc2ccc(cc2[nH]1)C1=NCCCN1 |c:3,t:25|
BDBM50379533 CCC(NCCCC[C@@H](C[C@@H](OC)c1ccc(F)cc1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50379534 CCC(NCCCC[C@@H](Oc1cc(C)c(F)c(C)c1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50379535 CCC(NCCCC[C@@H](Cc1cc(C)c(F)c(C)c1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50379536 CCC(NCCCC[C@@H](Nc1cc(C)c(F)c(C)c1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50379537 Cc1cc(C[C@H](CCCCN[C@@H](Cc2ccccc2)c2ccc(F)cc2)C(=O)NO)cc(C)c1F |r|
BDBM50379538 CC(C)C[C@H](NCCCC[C@@H](Cc1cc(C)c(F)c(C)c1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50379539 Cc1cc(C[C@H](CCCCN[C@H](Cc2ccccc2)c2ccc(F)cc2)C(=O)NO)cc(C)c1F |r|
BDBM50379540 C[C@@H](NCCCC[C@@H](Cc1cc(C)c(F)c(C)c1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50379541 CC(C)C[C@@H](NCCCC[C@@H](Cc1cc(C)c(F)c(C)c1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50379542 CC[C@H](NCCCC[C@@H](Cc1cc(C)c(F)c(C)c1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50379543 CC[C@@H](NCCCC[C@@H](Cc1cc(C)c(F)c(C)c1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50379544 C[C@H](NCCCC[C@@H](Cc1cc(C)c(F)c(C)c1)C(=O)NO)c1ccc(F)cc1 |r|
BDBM50420291 COc1ccc(C(=O)N[C@@H]2C[C@@H](N(C2)S(=O)(=O)c2ccc(Cl)c(Cl)c2)C(=O)NO)c(OC)c1 |r|
BDBM50420292 ONC(=O)[C@H]1[C@H](CCN1S(=O)(=O)c1ccc(Cl)c(Cl)c1)OCc1ccccc1 |r|
BDBM50420293 ONC(=O)[C@H]1[C@H](CCN1S(=O)(=O)c1ccc(Cl)cc1)OCc1ccccc1 |r|
BDBM50420294 CCCCCCO[C@H]1CCN([C@H]1C(=O)NO)S(=O)(=O)c1ccc(Cl)cc1 |r|
BDBM50420290 ONC(=O)[C@H]1C[C@H](CN1S(=O)(=O)c1ccc(Cl)c(Cl)c1)OCc1ccccc1 |r|
BDBM50444767 Oc1ccc2c3CCCc3c(=O)oc2c1O
BDBM50444768 CNC(=O)[C@@H](CCc1ccccc1)NC(=O)[C@H](CC(C)C)CC(=O)NO |r|
BDBM50444769 Cc1cc(=S)c(O)c(o1)C(=S)NCc1ccc(cc1)-c1ccccc1
BDBM50444770 Oc1ccc(cc1O)C(=O)N[N-][CH+]c1cc(ccc1O)[N+]([O-])=O
BDBM50444707 COc1ccc(Cl)cc1CCC(=O)Nc1ccc2nc(C)cc(N)c2c1
BDBM50444708 COc1ccc(Br)cc1CCC(=O)Nc1ccc2nc(C)cc(N)c2c1
BDBM50444709 COc1ccccc1\C=C\C(=O)Nc1ccc2nc(C)cc(N)c2c1
BDBM50444710 Cc1cc(N)c2cc(NC(=O)CCc3ccc(F)cc3)ccc2n1
BDBM50444711 Cc1cc(N)c2cc(NC(=O)CCc3ccccc3C(F)(F)F)ccc2n1
BDBM50444712 Cc1cc(N)c2cc(NC(=O)CCc3ccccc3C)ccc2n1
BDBM50444713 Cc1cc(N)c2cc(NC(=O)CCc3ccccc3Cl)ccc2n1
BDBM50444714 Cc1cc(N)c2cc(NC(=O)CCc3ccccc3OC(=O)c3ccccc3)ccc2n1
BDBM50444715 COc1cccc(CCC(=O)Nc2ccc3nc(C)cc(N)c3c2)c1OC
BDBM50444716 COc1ccc(OC)c(CCC(=O)Nc2ccc3nc(C)cc(N)c3c2)c1
BDBM50444717 COc1cccc(CCC(=O)Nc2ccc3nc(C)cc(N)c3c2)c1
BDBM50444718 COc1ccc(CCC(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1
BDBM50444719 Cc1cc(N)c2cc(NC(=O)c3cccc(c3)-c3cccc4cccnc34)ccc2n1
BDBM50444720 Cc1cc(N)c2cc(NC(=O)c3cccc(c3)-c3cccc4ncccc34)ccc2n1
BDBM50444721 Cc1cc(N)c2cc(NC(=O)c3cccc(c3)-c3cncc4ccccc34)ccc2n1
BDBM50444722 Cc1cc(N)c2cc(NC(=O)c3cccc(c3)-c3cnc4ccccc4c3)ccc2n1
BDBM50444723 Cc1cc(N)c2cc(NC(=O)c3cccc(c3)-c3ccc4ncccc4c3)ccc2n1
BDBM50444724 Cc1cc(N)c2cc(NC(=O)c3ccc(cc3)-c3cccc4cccnc34)ccc2n1
BDBM50444725 Cc1cc(N)c2cc(NC(=O)c3ccc(cc3)-c3cccc4ncccc34)ccc2n1
BDBM50444726 Cc1cc(N)c2cc(NC(=O)c3ccc(cc3)-c3cncc4ccccc34)ccc2n1
BDBM50444727 Cc1cc(N)c2cc(NC(=O)c3ccc(cc3)-c3cnc4ccccc4c3)ccc2n1
BDBM50444728 COc1ccccc1CCC(=O)Nc1ccc2nc(C)cc(N)c2c1
BDBM50444729 Cc1cc(N)c2cc(NC(=O)CCc3ccccc3)ccc2n1
BDBM50444730 Cc1cc(N)c2cc(NC(=O)Cc3ccc4OCOc4c3)ccc2n1
BDBM50444731 Cc1cc(N)c2cc(NC(=O)Cc3ccccc3)ccc2n1
BDBM50444732 Cc1cc(N)c2cc(NC(=O)COc3ccc(OCc4ccccc4)cc3)ccc2n1
BDBM50444733 COc1ccc(\C=C\C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1
BDBM50444734 CN(C)c1ccc(cc1)-c1cccc(c1)C(=O)Nc1ccc2nc(C)cc(N)c2c1
BDBM50444735 Cc1cc(N)c2cc(NC(=O)c3ccc(cc3)-c3ccc4ncccc4c3)ccc2n1
BDBM50444736 Cc1cc(N)c2cc(NC(=O)c3ccc(cc3)-c3cccnc3)ccc2n1
BDBM50444737 Cc1cc(N)c2cc(NC(=O)c3ccc(cc3)-c3ccccc3)ccc2n1
BDBM50444738 COc1ccc2[nH]c(cc2c1)C(=O)Nc1ccc2nc(C)cc(N)c2c1
BDBM50444739 Cc1cc(N)c2cc(NC(=O)c3cc4ccccc4o3)ccc2n1
BDBM50444740 Cc1cc(N)c2cc(NC(=O)c3ccc4ccccc4n3)ccc2n1
BDBM50444741 Cc1cc(N)c2cc(NC(=O)c3cc4ccccc4cn3)ccc2n1
BDBM50444742 Cc1cc(N)c2cc(NC(=O)c3ccc(cc3)N3CCOCC3)ccc2n1
BDBM50444743 CN(C)c1cccc(c1)C(=O)Nc1ccc2nc(C)cc(N)c2c1
BDBM50444744 Cc1cc(N)c2cc(NC(=O)c3ccco3)ccc2n1
BDBM50444706 COc1cc(Cl)ccc1CCC(=O)Nc1ccc2nc(C)cc(N)c2c1
BDBM50444745 Cc1cc(N)c2cc(NC(=O)c3cccnc3)ccc2n1
BDBM50444746 Cc1cc(N)c2cc(NC(=O)c3cccc(c3)C(=O)c3ccccc3)ccc2n1
BDBM50444747 Cc1cc(N)c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2n1
BDBM50444748 Cc1cc(N)c2cc(NC(=O)Nc3ccc4nc(C)cc(N)c4c3)ccc2n1
BDBM50444749 COc1ccccc1CNC(=O)Nc1ccc2nc(C)cc(N)c2c1
BDBM50444750 Cc1cc(N)c2cc(NC(=O)NCc3ccccc3Cl)ccc2n1
BDBM50444751 Cc1cc(N)c2cc(NC(=O)Nc3ccc(cc3)C(=O)c3ccccc3)ccc2n1
BDBM50444752 CC(C)c1ccc(NC(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1
BDBM50444753 Cc1cc(N)c2cc(NC(=O)Nc3ccc(F)cc3)ccc2n1
BDBM50444754 CCOC(=O)c1ccc(NC(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1
BDBM50444755 COc1ccc(NC(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1
BDBM50444756 Cc1cc(N)c2cc(NC(=O)Nc3ccc(cc3)-c3ccccc3)ccc2n1
BDBM50444757 Cc1cc(N)c2cc(NC(=O)Nc3ccc4OCOc4c3)ccc2n1
BDBM50444758 COc1ccsc1CCC(=O)Nc1ccc2nc(C)cc(N)c2c1
BDBM50444759 COc1ccncc1CCC(=O)Nc1ccc2nc(C)cc(N)c2c1
BDBM50444760 COc1ncccc1CCC(=O)Nc1ccc2nc(C)cc(N)c2c1
BDBM50444761 COc1ccccc1CCCC(=O)Nc1ccc2nc(C)cc(N)c2c1
BDBM50444762 Cc1cc(N)c2cc(NC(=O)Cc3ccccc3Cl)ccc2n1
BDBM50444763 COc1ccccc1CC(=O)Nc1ccc2nc(C)cc(N)c2c1
BDBM50444764 CCCOc1ccccc1CCC(=O)Nc1ccc2nc(C)cc(N)c2c1
BDBM50444765 CCOc1ccccc1CCC(=O)Nc1ccc2nc(C)cc(N)c2c1
BDBM50444766 COc1cc(Br)ccc1CCC(=O)Nc1ccc2nc(C)cc(N)c2c1
BDBM50010572 Cc1cc(C)c(NC(=O)N\N=C\c2ccc(Br)cc2)c(C)c1
BDBM50010576 Cc1cccc(C)c1NC(=O)N\N=C\c1ccc(Br)cc1
BDBM50010578 Cc1cccc(C)c1NC(=O)N\N=C\c1ccc(Cl)cc1
BDBM50010581 Cc1ccc(\C=N\NC(=O)Nc2c(C)cccc2C)cc1F
BDBM50010583 Cc1cccc(C)c1NC(=O)N\N=C\c1ccc(F)cc1F
BDBM50010601 Cc1ccc(\C=N\NC(=O)Nc2c(C)cccc2C)cc1
BDBM50010619 CCc1ccc(\C=N\NC(=O)Nc2c(C)cccc2C)cc1
BDBM50010625 COc1ccc(\C=N\NC(=O)Nc2c(C)cccc2C)cc1
BDBM50010630 Cc1cccc(C)c1NC(=O)N\N=C\c1ccc(I)cc1
BDBM50010632 Cc1cccc(C)c1NC(=O)N\N=C\c1ccc(cc1)C#N
BDBM50010633 Cc1cccc(C)c1NC(=O)N\N=C\c1ccc(Br)o1
BDBM50010634 Cc1cccc(C)c1NC(=O)N\N=C\c1cccs1
BDBM50010638 Cc1cccc(C)c1NC(=O)N\N=C\c1ccc(Br)cc1Cl
BDBM50010641 Cc1cccc(C)c1NC(=O)N\N=C\c1ccc(Br)c(Cl)c1
BDBM50010643 CN(\N=C\c1ccc(Br)cc1)C(=O)Nc1c(C)cccc1C
BDBM50010646 Cc1cccc(C)c1NC(=S)N\N=C\c1ccc(Br)cc1
BDBM50010648 Cc1cccc(C)c1NC(=O)N\N=C\c1ccc(cc1)N=[N+]=[N-]
BDBM50010650 Cc1cccc(C)c1NC(=O)N\N=C\c1c(F)c(F)c(N=[N+]=[N-])c(F)c1F
BDBM50010574 CCc1cccc(CC)c1NC(=O)N\N=C\c1ccc(Br)cc1
BDBM50010577 Cc1cccc(C)c1NC(=O)N\N=C\c1ccc(Br)cc1F
BDBM50010579 Cc1cccc(C)c1NC(=O)N\N=C\c1ccccc1F
BDBM50010582 Cc1cccc(C)c1NC(=O)N\N=C\c1ccc(F)cc1
BDBM50010590 Cc1cccc(\C=N\NC(=O)Nc2c(C)cccc2C)c1
BDBM50010623 CC(C)c1ccc(\C=N\NC(=O)Nc2c(C)cccc2C)cc1
BDBM50010627 Cc1cccc(C)c1NC(=O)N\N=C\c1ccc(cc1)C#C
BDBM50010631 Cc1cccc(C)c1NC(=O)N\N=C\c1ccc(cc1)C(F)(F)F
BDBM50010635 Cc1cccc(C)c1NC(=O)N\N=C\c1ccc(Br)s1
BDBM50010636 Cc1cccc(C)c1NC(=O)N\N=C\c1c(F)cc(Br)cc1F
BDBM50010639 Cc1cccc(C)c1NC(=O)N\N=C\c1ccc(Br)c(F)c1
BDBM50010642 C\C(=N/NC(=O)Nc1c(C)cccc1C)c1ccc(Br)cc1
BDBM50010645 Cc1cccc(C)c1NC(=O)N(CC#C)\N=C\c1ccc(Br)cc1
BDBM50010647 Cc1cccc(C)c1NC(=O)N\N=C\c1ccc(cc1F)N=[N+]=[N-]
BDBM50010649 Cc1cccc(C)c1\N=C(/N)N\N=C\c1ccc(Br)cc1
BDBM50057413 On1ccccc1=O
BDBM50133303 C[C@@H](N(CCCNC(C)=O)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133304 C[C@@H](N(CCCCCNC(C)=O)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133306 C[C@@H](N(Cc1ccc(CCNC(C)=O)cc1)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133307 C[C@@H](N(Cc1cccc(CNC(C)=O)c1)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133308 C[C@@H](N(Cc1ccc(CNC(C)=O)cc1)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133309 C[C@@H](N(CCCCCCCC(O)=O)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133311 OC(=O)C(F)(F)F.C[C@@H](N(CCCCN)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133312 OC(=O)C(F)(F)F.C[C@@H](N(CCCCCN)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133314 Cl.C[C@@H](N(Cc1ccc(CCN)cc1)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133315 Cl.C[C@@H](N(Cc1cccc(CN)c1)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133316 C[C@@H](N(Cc1ccc(N)cc1)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133318 C[C@@H](N(CCCCCCCC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133319 C[C@@H](N(Cc1ccc(CCNC(=O)OC(C)(C)C)cc1)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133321 C[C@@H](N(CCOCc1ccccc1)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133322 C[C@@H](N(Cc1c(F)cccc1F)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133323 C[C@@H](N(Cc1ccccc1F)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133324 C[C@@H](N(Cc1ccc(F)cc1)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133325 C[C@@H](N(Cc1cc(F)cc(F)c1)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133326 C[C@@H](N(C)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133327 Cl.C[C@@H](N(Cc1ccc(CN)cc1)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133301 C[C@@H](N(Cc1cccc(NC(C)=O)c1)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133302 CNC(=O)CCCCCCCN([C@H](C)C(=O)NO)S(=O)(=O)c1ccc(F)c(C)c1 |r|
BDBM50133305 C[C@@H](N(CCCCCCNC(C)=O)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133313 Cl.C[C@@H](N(CCCCCCN)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133317 CC(C)N([C@H](C)C(=O)NO)S(=O)(=O)c1ccc(F)c(C)c1 |r|
BDBM50133320 C[C@@H](N(Cc1ccc(CNC(=O)OC(C)(C)C)cc1)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|
BDBM50133310 OC(=O)C(F)(F)F.C[C@@H](N(CCCN)S(=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |r|