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590 SMILES Strings for Arachidonate 15-lipoxygenase

Compound NameSMILES String
BDBM7462 Oc1ccc(cc1)-c1oc2cc(O)cc(O)c2c(=O)c1O
BDBM7460 Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O
BDBM7457 Oc1ccc2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O
BDBM23420 Oc1ccc(cc1)-c1coc2cc(O)ccc2c1=O
BDBM22233 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(cc1)C(F)(F)F)-c1ccccc1
BDBM22234 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(F)cc1)-c1ccccc1
BDBM22235 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1[nH]c(nc1-c1cccc(OC)c1)-c1ccccc1
BDBM22236 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1ccc(OC)cc1
BDBM22237 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1ccc(C)cc1
BDBM22238 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1ccc(Cl)cc1
BDBM22239 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1cccc(c1)[N+]([O-])=O
BDBM22240 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1[nH]cnc1-c1ccc(OC)cc1
BDBM22241 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1[nH]c(C)nc1-c1ccc(OC)cc1
BDBM22242 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)C1CC1
BDBM22232 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1[nH]c(nc1-c1ccccc1)-c1ccccc1
BDBM22243 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)C(C)(C)C
BDBM22372 C[C@@H](Cc1ccc(O)c(O)c1)[C@H](C)Cc1ccc(O)c(O)c1
BDBM22244 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1ccncc1
BDBM22245 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1ccccn1
BDBM22246 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1cccnc1
BDBM22247 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1cnccn1
BDBM22248 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1csc(C)n1
BDBM22249 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1cccs1
BDBM22250 CCCCCc1ccc(cc1)S(=O)(=O)NCCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1ccccc1
BDBM22251 CCCCCc1ccc(cc1)S(=O)(=O)NCCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1cccs1
BDBM22252 COc1ccc(cc1)-c1nc([nH]c1CCNS(=O)(=O)c1ccc(C)cc1)-c1ccccc1
BDBM22253 CCCCN1CCN(CC1)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1cccs1
BDBM22254 CCCCCN1CCN(CC1)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1cccs1
BDBM22255 COc1ccc(cc1)-c1nc([nH]c1CCNS(=O)(=O)N1CCN(CC1)c1ccccc1Cl)-c1cccs1
BDBM22256 COc1ccc(cc1)-c1nc([nH]c1CCNS(=O)(=O)N1CCN(CC1)c1ccc(Cl)c(Cl)c1)-c1cccs1
BDBM22257 COc1ccc(cc1)-c1nc([nH]c1CCNS(=O)(=O)N1CCN(CC1)c1ccc(Cl)c(Cl)c1)-c1ccccc1
BDBM22258 COc1ccc(cc1)-c1nc([nH]c1CCNS(=O)(=O)N1CCN(CC1)c1ccccc1)-c1ccccc1
BDBM22259 [H][C@]1(CCN(Cc2ccccc2)C1)NS(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1ccccc1 |r|
BDBM22260 [H][C@@]1(CCN(Cc2ccccc2)C1)NS(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1ccccc1 |r|
BDBM22261 [H][C@]1(CCN(Cc2ccccc2)C1)N(C)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1ccccc1 |r|
BDBM22262 [H][C@@]1(CCN(Cc2ccccc2)C1)N(C)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1ccccc1 |r|
BDBM22263 [H][C@]1(CCN(Cc2ccccc2)C1)N(C)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1cccs1 |r|
BDBM22264 [H][C@]1(CCN(C1)c1ccc(Cl)c(Cl)c1)N(C)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1cccs1 |r|
BDBM22265 [H][C@]1(CCN(C1)C(C)(C)c1ccccc1)N(CC)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1cccs1 |r|
BDBM22266 [H][C@]1(CCN(C1)C(C)c1ccc(F)cc1)N(CC)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1cccs1 |r|
BDBM22267 CN(C)c1cccc2c(cccc12)S(=O)(=O)NCCc1c[nH]c2ccccc12
BDBM22268 Cc1ccc(cc1)S(=O)(=O)NCCc1c[nH]c2ccccc12
BDBM22269 CCc1ccc(cc1)S(=O)(=O)NCCc1c[nH]c2ccccc12
BDBM22270 CCCc1ccc(cc1)S(=O)(=O)NCCc1c[nH]c2ccccc12
BDBM22271 CCCCc1ccc(cc1)S(=O)(=O)NCCc1c[nH]c2ccccc12
BDBM22272 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c[nH]c2ccccc12
BDBM22273 O=S(=O)(NCCc1c[nH]c2ccccc12)c1ccc(cc1)-c1ccccc1
BDBM22274 Cc1ccccc1-c1ccc(cc1)S(=O)(=O)NCCc1c[nH]c2ccccc12
BDBM22275 Cc1cccc(c1)-c1ccc(cc1)S(=O)(=O)NCCc1c[nH]c2ccccc12
BDBM22276 CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NCCc1c[nH]c2ccccc12
BDBM22277 CC(C)c1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NCCc1c[nH]c2ccccc12
BDBM22278 CCCCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NCCc1c[nH]c2ccccc12
BDBM22279 CC(C)Cc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NCCc1c[nH]c2ccccc12
BDBM22280 CC(C)(C)c1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NCCc1c[nH]c2ccccc12
BDBM22281 COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NCCc1c[nH]c2ccccc12
BDBM22282 CCCCCc1ccc(cc1)S(=O)(=O)N(C)CCc1c[nH]c2ccccc12
BDBM22283 CCCCCc1ccc(cc1)S(=O)(=O)NC(=O)Cc1c[nH]c2ccccc12
BDBM22284 CCCCCc1ccc(cc1)S(=O)(=O)N1CCC(C1)c1c[nH]c2ccccc12
BDBM22285 CCCCCc1ccc(cc1)S(=O)(=O)NC(C)Cc1c[nH]c2ccccc12
BDBM22286 CCCCCc1ccc(cc1)S(=O)(=O)NCCCc1c[nH]c2ccccc12
BDBM22287 CCCCCc1ccc(cc1)S(=O)(=O)NCCCCc1c[nH]c2ccccc12
BDBM22288 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c[nH]c2cc(ccc12)C(=O)OC
BDBM22289 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c[nH]c2cc(ccc12)C(O)=O
BDBM22290 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c[nH]c2ccc(cc12)-c1ccc[nH]1
BDBM22291 COc1ccc(cc1)-c1[nH]c2ccccc2c1CCNS(=O)(=O)c1ccc(C)cc1
BDBM22292 CCCCc1ccc(cc1)S(=O)(=O)NCCc1c([nH]c2ccccc12)-c1ccc(OC)cc1
BDBM22293 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c([nH]c2ccccc12)-c1ccc(OC)cc1
BDBM22294 COc1ccc(cc1)-c1[nH]c2ccccc2c1CCNS(=O)(=O)c1ccc(cc1)C(O)=O
BDBM22295 COc1ccc(cc1)-c1[nH]c2ccccc2c1CCNS(=O)(=O)c1ccc(cc1)-c1ccccc1
BDBM22296 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c([nH]c2ccccc12)-c1ccccc1
BDBM22297 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c([nH]c2ccccc12)-c1cccc(C)c1
BDBM22298 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c([nH]c2ccccc12)-c1ccc(Cl)cc1
BDBM22299 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c([nH]c2ccccc12)-c1ccc(cc1)C(=O)CC
BDBM22300 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c([nH]c2ccccc12)-c1ccc(cc1)C(F)(F)F
BDBM22301 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c([nH]c2ccccc12)-c1cc(OC)ccc1OC
BDBM22302 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c([nH]c2ccccc12)-c1cc2ccccc2o1
BDBM22303 CCCCCc1ccc(cc1)S(=O)(=O)NCCCc1c([nH]c2ccccc12)-c1cc2ccccc2o1
BDBM22304 O=S(=O)(NCCCc1c([nH]c2ccccc12)-c1cc2ccccc2o1)c1ccc(cc1)-c1ccccc1
BDBM22305 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c([nH]c2ccccc12)-c1ccc2oc3ccccc3c2c1
BDBM22306 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c([nH]c2ccccc12)-c1cnc2ccccc2c1
BDBM22307 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c(-c2cc3ccccc3o2)n(C)c2ccccc12
BDBM22308 Cc1ccc(cc1)S(=O)(=O)NCCc1c([nH]c2ccccc12)-c1cc2ccccc2o1
BDBM22309 Brc1ccc(cc1)S(=O)(=O)NCCc1c([nH]c2ccccc12)-c1cc2ccccc2o1
BDBM22310 O=S(=O)(NCCc1c([nH]c2ccccc12)-c1cc2ccccc2o1)c1ccc(cc1)-c1ccncc1
BDBM22311 O=C(Nc1ccccc1)c1ccc(cc1)S(=O)(=O)NCCc1c([nH]c2ccccc12)-c1cc2ccccc2o1
BDBM22312 COc1ccc(NC(=O)c2ccc(cc2)S(=O)(=O)NCCc2c([nH]c3ccccc23)-c2cc3ccccc3o2)cc1
BDBM22313 CCCCNC(=O)c1ccc(cc1)S(=O)(=O)NCCc1c([nH]c2ccccc12)-c1cc2ccccc2o1
BDBM22314 O=C(NC1CCCCC1)c1ccc(cc1)S(=O)(=O)NCCc1c([nH]c2ccccc12)-c1cc2ccccc2o1
BDBM22315 NNC(=O)c1ccc(cc1)S(=O)(=O)NCCc1c([nH]c2ccccc12)-c1cc2ccccc2o1
BDBM22316 CN(CCO)C(=O)c1ccc(cc1)S(=O)(=O)NCCc1c([nH]c2ccccc12)-c1cc2ccccc2o1
BDBM22317 CN(C)CCN(C)C(=O)c1ccc(cc1)S(=O)(=O)NCCc1c([nH]c2ccccc12)-c1cc2ccccc2o1
BDBM22230 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1[nH]c(nc1-c1ccc(OC)cc1)-c1ccccc1
BDBM24679 Oc1ccccc1-c1cc[nH]n1
BDBM26660 Oc1ccc2c(c1)oc(-c1ccccc1)c(O)c2=O
BDBM26664 Oc1ccc2c(c1)oc(cc2=O)-c1ccccc1
BDBM30770 CCCNc1oc(nc1C#N)-c1cccc2ccccc12
BDBM32147 Oc1c(Cl)cc(Cl)c2cccnc12
BDBM44681 CCNc1oc(nc1C#N)-c1cccc2ccccc12
BDBM49265 Cc1ccc(-c2cc([nH]n2)-c2cccc(F)c2)c(O)c1
BDBM49247 Oc1ccccc1-c1cc([nH]n1)-c1ccccc1Cl
BDBM49390 Cc1ccc(-c2cc([nH]n2)-c2ccccc2C)c(O)c1
BDBM57040 COc1ccc(O)c(c1)-c1cc([nH]n1)-c1cccc(Br)c1
BDBM56150 Cc1ccc(O)c(c1)-c1cc([nH]n1)-c1ccccc1C
BDBM59267 Cc1ccc(O)c(c1)-c1cc([nH]n1)C(=O)NCc1ccccc1
BDBM65361 CCC(=O)NC(c1cccs1)c1ccc2cccnc2c1O
BDBM64651 CCC(=O)NC(c1cccs1)c1cc(Cl)c2cccnc2c1O
BDBM64674 CCC(=O)NC(c1ccco1)c1cc(Cl)c2cccnc2c1O
BDBM78048 Cc1ccc(O)c(c1)-c1cc([nH]n1)-c1cccc(F)c1
BDBM79800 CNc1oc(nc1C#N)-c1cccc2ccccc12
BDBM79955 O=C(OCC#CCSc1nnc(o1)-c1cccc2ccccc12)c1cccc2[nH]ccc12
BDBM106774 Oc1cc2occ(-c3ccc(Cl)cc3)c(=O)c2cc1O
BDBM106775 Oc1cc2occ(-c3ccc(cc3)[N+]([O-])=O)c(=O)c2cc1O
BDBM106776 Oc1cc2occ(-c3cccc(Cl)c3)c(=O)c2cc1O
BDBM106777 Cc1c(O)ccc2c1occ(-c1ccc(O)cc1)c2=O
BDBM106778 Cc1ccc(cc1)-c1coc2c(C)c(O)ccc2c1=O
BDBM106779 Cc1c(O)ccc2c1occ(-c1ccc(cc1)[N+]([O-])=O)c2=O
BDBM106780 Cc1c(O)ccc2c1occ(-c1ccc(cc1)C(F)(F)F)c2=O
BDBM106781 Oc1ccc2c(c1)occ(-c1ccccc1)c2=O
BDBM106782 Oc1ccc2c(c1)occ(-c1ccc(cc1)[N+]([O-])=O)c2=O
BDBM106783 COc1ccc(cc1)-c1coc2cc(OCc3ccccc3)ccc2c1=O
BDBM106784 Oc1cc(O)c2c(c1)occ(-c1ccc(cc1)[N+]([O-])=O)c2=O
BDBM106785 Oc1cc(OCc2ccccc2)cc2occ(-c3ccc(cc3)[N+]([O-])=O)c(=O)c12
BDBM106786 Cc1c(O)ccc2c1occ(-c1ccc(Cl)cc1)c2=O
BDBM106787 Cc1ccc(cc1)C1COc2c(C1)ccc(O)c2O
BDBM106788 Cc1cccc(c1)C1COc2c(C1)ccc(O)c2O
BDBM114790 Cc1ccc(-c2cc([nH]n2)-c2ccc(F)cc2)c(O)c1
BDBM50000540 NC1=NN(CC1)c1cccc(c1)C(F)(F)F |t:1|
BDBM50007260 CC(C)(Sc1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C)Sc1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C
BDBM50009001 Oc1cc2oc(cc(=O)c2c(O)c1O)-c1ccccc1
BDBM50009004 O=C1CCN(N1)c1ccccc1
BDBM50016986 CCCc1cc(Cl)c2oc(Cc3ccc(OC)cc3)c(C)c2c1O
BDBM50024458 CCCCC\C=C/C\C=C/CC=CC=CC(=O)CCCC(O)=O |w:13.12,11.10|
BDBM50025735 CCCCCC(=O)C=CC=CC\C=C/C\C=C/CCCC(O)=O |w:9.8,7.6|
BDBM50067040 COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(O)c(OC)c2)ccc1O |w:12.11,5.4|
BDBM50065995 COc1ccc(C[C@@H](C)[C@@H](C)Cc2ccc(O)c(O)c2)cc1OC
BDBM50065996 COc1cc(C[C@@H](C)[C@@H](C)Cc2ccc(O)c(O)c2)ccc1O
BDBM50065997 COc1ccc(C[C@H](C)[C@H](C)Cc2ccc(OC)c(O)c2)cc1O |r|
BDBM50081950 Oc1ccc2oc(cc(=O)c2c1)-c1ccccc1
BDBM50085045 Cc1c(C)c2OC(C)(COc3ccc(Cc4sc(=O)[nH]c4O)cc3)CCc2c(C)c1O
BDBM50123670 CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(=O)C[C@H](C)CCCC(C)C |r|
BDBM50123671 CCCCCCCCCCCC(=O)c1c([nH]c2cc(Cl)ccc12)C(=O)OCC
BDBM50123666 CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(C)=O
BDBM50123663 c1cc2ccccn2c1
BDBM50123668 CCCC(=O)c1c([nH]c2cc(Cl)ccc12)C(=O)OCC
BDBM50114092 C[C@@H](Cc1cc(O)c(O)cc1C(C)=O)[C@H](C)Cc1cc(O)c(O)cc1C(C)=O
BDBM50114093 C[C@@H](Cc1cc(O)c(O)cc1Cl)[C@H](C)Cc1cc(O)c(O)cc1Cl
BDBM50114094 C[C@@H](Cc1cc(O)c(O)cc1Br)[C@H](C)Cc1cc(O)c(O)cc1Br
BDBM50114095 C[C@@H](Cc1cc(O)c(O)cc1[N+]([O-])=O)[C@H](C)Cc1cc(O)c(O)cc1[N+]([O-])=O
BDBM50114096 CCc1cc(O)c(O)cc1C[C@H](C)[C@H](C)Cc1cc(O)c(O)cc1CC
BDBM50114097 C[C@@H](Cc1ccc2OC(C)(C)Oc2c1)[C@H](C)Cc1ccc(O)c(O)c1
BDBM50130920 Oc1ccc(NC(=O)\C=C\c2ccc(NC(=O)c3ccccc3O)cc2)cc1O
BDBM50130921 Oc1ccc(NC(=O)c2ccc(NC(=O)c3ccccc3O)cc2)cc1O
BDBM50130923 Oc1ccc(NC(=O)CCc2cccc(NC(=O)c3ccccc3O)c2)cc1O
BDBM50130924 Oc1ccc(NC(=S)Nc2ccc(NC(=O)c3ccccc3O)cc2)cc1O
BDBM50130925 Oc1ccc(NC(=O)CCc2ccc(NC(=O)c3ccccc3O)cc2)cc1O
BDBM50130926 Oc1ccc(NC(=O)c2ccc(NCc3ccccc3O)cc2)cc1O
BDBM50130928 Oc1ccc(NC(=O)Nc2ccc(NC(=O)c3ccccc3O)cc2)cc1O
BDBM50135851 Oc1c(Br)cc(Br)cc1Oc1c(O)c(Br)c(Br)c(Br)c1Br
BDBM50123673 CCCCCCCC(=O)c1c([nH]c2cc(Cl)ccc12)C(=O)OCC
BDBM50123675 CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(=O)Cc1ccccc1
BDBM50123676 CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(=O)Cc1ccc(C)cc1
BDBM50123677 CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(=O)Cc1ccc(Cl)cc1
BDBM50123678 CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(=O)Cc1ccc(F)cc1
BDBM50123680 CCOC(=O)c1cc2ccc(Cl)cc2[nH]1
BDBM50123681 CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C=O
BDBM50139862 Oc1ccc(cc1)C1COc2cc(O)c(O)cc2C1
BDBM50137349 CCOC(=O)c1c2cccccc2c2c(OCC)oc(=O)c(C#N)c12
BDBM50143435 [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#8]-c1ccc2ccc(=O)oc2c1
BDBM50150778 Oc1c(Br)cc2CCNC(=O)C(Cc3ccc(Oc4cc(CC(N=O)C(=O)NC=Cc5ccc(Oc1c2)c(Br)c5)cc(Br)c4O)c(Br)c3)N=O |w:29.29|
BDBM50150779 Oc1ccc(Br)cc1
BDBM50150780 CC(Cc1ccc(O)c(O)c1)[C@H](C)Cc1ccc(O)c(O)c1
BDBM50150781 Oc1ccc(Br)cc1Oc1c(O)ccc(Br)c1Br
BDBM50150782 Oc1c(Br)cc(Br)c(Br)c1Oc1ccc(Br)cc1Br
BDBM50150783 Oc1ccccc1Br
BDBM50150784 Oc1cc(Br)c(Br)c2Oc3c(Br)cc(Br)cc3Oc12
BDBM50150785 Oc1c(Br)c(Br)c(Br)c(Br)c1Oc1ccc(Br)cc1Br
BDBM50150786 CCOc1ccc(Br)cc1
BDBM50150787 OCc1ccc(Br)cc1
BDBM50150788 Oc1c(Br)cc(Br)cc1Oc1c(O)c(Br)c(Br)cc1Br
BDBM50150789 Oc1c(Br)cccc1Br
BDBM50150790 CC(C)(c1ccc(O)c(Br)c1)c1cc(Br)c(O)c(Br)c1
BDBM50150791 Oc1cc(Br)cc2Oc3c(Br)cc(Br)cc3Oc12
BDBM50150792 Oc1ccc(Br)cc1Br
BDBM50150793 CC(C)(c1cc(Br)c(O)c(Br)c1)c1cc(Br)c(O)c(Br)c1
BDBM50150794 Oc1ccc(CCNC(=O)C(Cc2cc(Br)c(Oc3cc(CC(N=O)C(=O)NC=Cc4ccc(O)c(Br)c4)cc(Br)c3O)c(Br)c2)N=O)cc1Br |w:29.29|
BDBM50150795 Oc1cccc(Br)c1
BDBM50150777 COc1cc(Br)cc(Br)c1Oc1cc(Br)cc(Br)c1O
BDBM50156942 CC(C)(C)c1cc(SC(C)(C)Sc2ccc(c(OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CO)c2C(C)(C)C)C(C)(C)C)cc(c1O)C(C)(C)C |r|
BDBM50156934 CC(C)(C)c1cc(SC(C)(C)Sc2ccc(c(OC[C@H]3OC(O)[C@H](O)[C@@H](O)[C@@H]3O)c2C(C)(C)C)C(C)(C)C)cc(c1O)C(C)(C)C |r|
BDBM50156693 COc1cc2ccc(=O)oc2cc1O
BDBM50156938 CC(C)(C)c1ccc(SC(C)(C)Sc2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)c(c1OC[C@H](O)[C@@H](O)CO)C(C)(C)C |r|
BDBM50156940 CC(C)(C)c1ccc(SC(C)(C)Sc2cc(c(OCC(O)=O)c(c2)C(C)(C)C)C(C)(C)C)c(c1OCC(O)=O)C(C)(C)C
BDBM50158387 OC(=O)c1cc(C(=O)C(=O)c2cc(C(O)=O)c(O)c3ccccc23)c2ccccc2c1O
BDBM50182516 Nc1sc2CCCCc2c1C(=O)Nc1cccc(Cl)c1
BDBM50182498 O=C(COc1ccccc1)NC(=S)Nc1ccc(Cc2ccncc2)cc1
BDBM50182499 O=C(NCc1ccccc1)c1cccc(COc2ccc3CCCc3c2)c1
BDBM50182500 CC(C)c1ccc(O)c(NC(=O)COc2ccc(Cl)cc2C)c1
BDBM50182501 CCc1cc(-c2n[nH]cc2Oc2ccccc2)c(O)cc1O
BDBM50182502 CCCC(=O)Nc1ccc(Cl)c(NC(=O)c2cc3ccccc3o2)c1
BDBM50182503 CC(Oc1cccc(Cl)c1)C(=O)NCc1ccc(C)cc1
BDBM50182504 CCOc1ccc(cc1Cl)C(=O)Nc1ccccc1N1CCCC1
BDBM50182505 O=C(CSc1nnc2ccc3ccccc3n12)NCCc1ccccc1
BDBM50182506 COc1ccc(Cl)cc1NC(=O)c1oc2ccccc2c1C
BDBM50182507 Cc1cc(CSc2ccccc2)ccc1NC(=O)c1ccccc1Cl
BDBM50182508 CCOC(=O)c1ccccc1NC(=O)CCCc1ccccc1
BDBM50182509 COc1ccccc1C(=O)Nc1cccc(NC(=O)c2cccs2)c1
BDBM50182510 Cc1ccccc1C(=O)Nc1cccc(NC(=O)c2cccs2)c1
BDBM50182511 COc1ccccc1N1CCN(CC1)C(=O)CCCCC(=O)N1CCN(CC1)c1ccccc1OC
BDBM50182512 O=C(NCCc1ccccc1)c1cccc(n1)C(=O)NCCc1ccccc1
BDBM50182513 CCOC(=O)C1CCN(CCC(=O)Nc2cc(C)cc(C)c2)CC1
BDBM50182514 Cc1cccc(c1)C(N)=NOC(=O)c1ccc(C)cc1Cl |w:9.10|
BDBM50182515 COc1ccccc1COc1cc(C)cc2oc(=O)cc(-c3ccccc3)c12
BDBM50182497 Cc1c(Cl)cccc1NC(=O)CSCc1ccccc1
BDBM50187657 Oc1ccc2oc(-c3ccccc3)c(O)c(=O)c2c1
BDBM50187668 Oc1c(oc2ccccc2c1=O)-c1ccccc1
BDBM50187067 COc1ccc(O)c(c1)-c1cc(n[nH]1)-c1ccccc1Cl
BDBM50206008 COc1cc2oc(=O)ccc2cc1O
BDBM50206257 C[C@H](CCC\C(C)=C\Cc1cc(O)ccc1O)[C@@H](C[C@H]1C(C)=CC[C@H]2C(C)(C)CCC[C@]12C)OS([O-])(=O)=O |r,c:22|
BDBM50206259 C[C@H](CCC\C(C)=C\Cc1cc(O)ccc1O)[C@H](O)C[C@H]1C(C)=CC[C@H]2C(C)(C)CCC[C@]12C |r,c:23|
BDBM50208822 Oc1ccc(cc1O)[C@@H]1OC[C@@H]2[C@H]1CO[C@H]2c1ccc(O)c(O)c1
BDBM50208823 C1Sc2ccccc2-c2[nH]c3ccccc3c12
BDBM50208824 OC[C@@H]1[C@H](CO[C@@H]1c1ccc(O)c(O)c1)[C@H](O)c1ccc(O)c(O)c1
BDBM50208825 Oc1ccc(cc1O)[C@H]1OC(=O)[C@H]2[C@@H]1CO[C@@H]2c1ccc(O)c(O)c1
BDBM50212955 Oc1ccc(CCCCc2ccc(O)c(O)c2)cc1
BDBM50212956 Oc1ccc(CCCCc2ccccc2)cc1O
BDBM50212957 Oc1ccc(CCCCc2ccc(Cl)c(Cl)c2)cc1O
BDBM50212958 Oc1ccc(CCCCc2ccc(O)c(O)c2)cc1O
BDBM50212959 Cc1ccc(CCCCc2ccc(O)c(O)c2)cc1
BDBM50212960 Oc1ccc(CCCCc2ccc(Cl)cc2)cc1O
BDBM50212961 Oc1cc2CCCC(c3ccccc3)c2cc1O |w:7.7|
BDBM50212962 COc1ccc(CCCCc2ccc(O)c(O)c2)cc1
BDBM50214969 [#6]-[#8]-c1c(-[#8])cc2oc3cc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c3c(=O)c2c1-[#6]\[#6]=[#6](\[#6])-[#6]
BDBM50221402 Oc1c(Cl)cc(cc1Cl)C(C(c1cc(Cl)c(O)c(Cl)c1)c1cc(Cl)c(O)c(Cl)c1)c1cc(Cl)c(O)c(Cl)c1
BDBM50221403 COc1cc(C)cc2c(cc(c(O)c12)-c1ccc2c(c(C)cc(OC)c2c1O)-c1c(O)cc(O)c2[C@@H](C)N[C@H](C)Cc12)-c1c(O)cc(O)c2[C@@H](C)N[C@H](C)Cc12 |wU:38.42,52.58,wD:49.55,35.39,(-8.29,-38.12,;-6.96,-37.34,;-6.96,-35.81,;-8.29,-35.04,;-8.29,-33.49,;-9.62,-32.73,;-6.96,-32.73,;-5.63,-33.48,;-4.3,-32.71,;-2.97,-33.47,;-2.96,-35.02,;-4.3,-35.8,;-4.29,-37.34,;-5.63,-35.03,;-1.63,-35.78,;-1.62,-37.32,;-.29,-38.08,;1.03,-37.31,;2.38,-38.07,;3.71,-37.29,;5.05,-38.06,;3.7,-35.74,;2.36,-34.99,;2.34,-33.45,;3.67,-32.66,;1.03,-35.76,;-.31,-35,;-.32,-33.47,;2.38,-39.6,;1.05,-40.38,;-.28,-39.61,;1.06,-41.92,;2.39,-42.68,;2.41,-44.22,;3.73,-41.89,;5.04,-42.65,;5.05,-44.19,;6.36,-41.88,;6.36,-40.35,;7.45,-39.24,;5.03,-39.59,;3.72,-40.36,;-4.31,-31.19,;-2.98,-30.4,;-1.64,-31.17,;-2.99,-28.87,;-4.32,-28.11,;-4.33,-26.57,;-5.65,-28.88,;-7,-28.13,;-7,-26.59,;-8.33,-28.9,;-8.31,-30.45,;-9.64,-31.22,;-6.97,-31.22,;-5.65,-30.42,)|
BDBM50221404 C[C@@H](C[C@H](NC(=O)C[C@H](C)C(Cl)(Cl)Cl)C(=O)N(C)[C@H](C)c1nccs1)C(Cl)(Cl)Cl
BDBM50221405 C[C@@H](C[C@H](N(C)C(=O)C[C@H](C)C(Cl)(Cl)Cl)C(=O)N[C@@H](C)c1nccs1)C(Cl)(Cl)Cl
BDBM50222277 Cc1cccc(c1)C1COc2cc(O)c(O)cc2C1 |w:7.7|
BDBM50222278 Oc1ccc2c(occ(-c3ccccc3)c2=O)c1O
BDBM50222279 Oc1cc2occ(-c3ccc(c(O)c3)[N+]([O-])=O)c(=O)c2cc1O
BDBM50222280 CC(C)(C)c1cc(=O)c2cc(O)ccc2o1
BDBM50222281 CC(C)c1oc2ccccc2c(=O)c1O
BDBM50222282 CC(C)(C)c1oc2ccccc2c(=O)c1O
BDBM50222283 CCCc1cc(=O)c2cc(O)ccc2o1
BDBM50222284 Cc1cccc(c1)-c1coc2c(O)c(O)ccc2c1=O
BDBM50222285 Cc1ccc(cc1)C1COc2c(C1)ccc(O)c2O |w:7.7|
BDBM50222286 CCCCCc1cc(=O)c2ccc(O)cc2o1
BDBM50222287 COc1ccc(cc1)-c1coc2cc(O)c(O)cc2c1=O
BDBM50222288 CCCCCc1oc2ccccc2c(=O)c1O
BDBM50222289 CC(C)(C)c1cc(=O)c2cc3OCOc3cc2o1
BDBM50222290 Oc1ccc2c(occ(-c3cccc(Cl)c3)c2=O)c1O
BDBM50222291 Oc1cccc2oc(-c3ccccc3)c(O)c(=O)c12
BDBM50222292 CC(C)Cc1cc(=O)c2cc3OCOc3cc2o1
BDBM50222293 Oc1ccc2c(occ(-c3ccc(Cl)cc3)c2=O)c1O
BDBM50222294 Oc1cc2occ(-c3ccc4OCOc4c3)c(=O)c2cc1O
BDBM50222304 COc1ccc(cc1OC)C1COc2c(C1)ccc(O)c2O |w:10.10|
BDBM50222307 Oc1cc2CC(COc2cc1O)c1ccc2OCOc2c1 |w:5.13|
BDBM50222308 Oc1ccc2c(occ(-c3cccc(c3)C(F)(F)F)c2=O)c1O
BDBM50222309 COc1ccc(cc1)C1COc2cc(O)c(O)cc2C1=O
BDBM50222310 CC(C)c1cc(=O)c2ccc(O)cc2o1
BDBM50222311 CCCc1cc(=O)c2ccc(O)cc2o1
BDBM50222312 CC(C)Cc1cc(=O)c2cc(O)ccc2o1
BDBM50222313 CC(C)Cc1cc(=O)c2ccc(O)cc2o1
BDBM50222314 CC(C)c1cc(=O)c2cc(O)ccc2o1
BDBM50222274 CC(C)Cc1oc2ccccc2c(=O)c1O
BDBM50222275 CCCc1oc2ccccc2c(=O)c1O
BDBM50222276 COc1ccc(cc1)C1COc2cc(O)c(O)cc2C1 |w:8.8|
BDBM50222301 COc1ccc(cc1)C1COc2c(C1)ccc(O)c2O |w:8.8|
BDBM50222302 CC(C)(C)c1cc(=O)c2ccc(O)cc2o1
BDBM50222303 Oc1ccc(cc1)-c1coc2cc(O)c(O)cc2c1=O
BDBM50222305 O=c1cc(oc2cc3OCOc3cc12)-c1ccccc1
BDBM50222306 CCCCCc1cc(=O)c2cc(O)ccc2o1
BDBM50222295 Cc1cccc(c1)C1COc2cc(O)c(O)cc2C1=O
BDBM50222296 Oc1ccc(cc1)C1COc2cc(O)c(O)cc2C1=O
BDBM50222297 Cc1ccc(cc1)-c1coc2c(O)c(O)ccc2c1=O
BDBM50222298 CCc1oc2ccccc2c(=O)c1O
BDBM50222299 CCc1cc(=O)c2cc(O)ccc2o1
BDBM50222300 CC(C)(C)c1cc(=O)c2cc(O)c(O)cc2o1
BDBM50232491 Oc1cc(Br)cc(Br)c1Oc1ccc(Br)cc1Br
BDBM50240865 CC1(C)CCC[C@@]2(C)[C@H]1CC[C@]1(C)OC3=CC(=O)C(=O)CC3=C[C@H]21 |r,c:23,t:15|
BDBM50240936 C\C(CC\C=C(/C)CCC1=C(C)CCCC1(C)C)=C/Cc1cc(O)ccc1O |c:9|
BDBM50240937 [#6]\[#6](-[#6])=[#6]\[#6]-[#6][C@@]1([#6])[#6]-[#6]-[#6][C@]2([#6])[#6@@H](-[#6]-c3cc(ccc3-[#8])-[#6](-[#8])=O)-[#6](-[#6])=[#6]-[#6]-[#6@@H]12 |r,c:27|
BDBM50241360 C\C(CCC1C(C)=CCCC1(C)C)=C/CCC(CO)CCCc1ccoc1 |c:6|
BDBM50242010 COC1=CC2=C[C@H]3[C@](C)(CC[C@H]4C(C)(C)CCC[C@]34C)OC2=CC1=O |r,c:24,t:2,4|
BDBM50242017 CO[C@H]1[C@H]2[C@](C)(CC[C@H]3C(C)(C)CCC[C@]23C)Oc2cc(O)c(OC)cc12 |r|
BDBM50269692 CN1[C@H]2n3c(Br)c(Br)cc3C(=O)N3CCC[C@]23N=C1N |r,c:20|
BDBM50269747 CO[C@H]1C[C@@]2(O)[C@@H](O1)C1=C[C@H]3[C@](C)(CC[C@H]4C(C)(C)CCC[C@]34C)OC1=CC2=O |r,c:29,t:9|
BDBM50269748 CC1(C)CCC[C@@]2(C)[C@H]1CC[C@]1(C)OC3=CC(=O)C(=O)C(Cl)C3=C[C@H]21 |r,c:24,t:15|
BDBM50269763 COc1cc2C=C3[C@H](CC[C@H]4C(C)(C)CCC[C@]34C)Oc2cc1O |r,c:5|
BDBM50269774 CC1(C)CCC[C@]2(C)[C@@H]1CCC1=C2CC\C(C1)=C\Cc1cc(ccc1O)C(O)=O |r,c:12|
BDBM50269775 C[C@@]12CCC(=O)c3coc(c13)C(=O)c1cc3c(O)ccc(OS([O-])(=O)=O)c3cc21 |r|
BDBM50292291 COc1cc(ccc1O)[C@@H]1OC[C@H]2[C@@H]1CO[C@H]2c1ccc(O)c(OC)c1 |r|
BDBM50292636 CCCCCCc1ccc(O)cc1O
BDBM50292443 Oc1cc(Br)c(Br)c(Br)c1Oc1ccc(Br)cc1Br
BDBM50292444 Oc1c(Oc2ccc(Br)cc2Br)cc(Br)c(Br)c1Br
BDBM50286954 Oc1ccc(CCCc2ccc(NC(=O)c3ccccc3O)cc2)cc1O
BDBM50286955 Oc1ccc(CCc2ccc(NC(=O)c3ccc(cc3O)-c3ccccc3)cc2)cc1O
BDBM50286956 Oc1ccc(CCc2ccc(NC(=O)c3ccc4ccccc4c3O)cc2)cc1O
BDBM50286957 Oc1ccc(C(=O)Nc2ccc(CCc3ccc(O)c(O)c3)cc2)c(O)c1
BDBM50286958 Oc1ccc(CCc2ccc(NC(=O)c3cccc(Cl)c3O)cc2)cc1O
BDBM50286959 Oc1ccc(CCc2ccc(NC(=O)c3c(O)ccc4ccccc34)cc2)cc1O
BDBM50286960 Cc1ccc(C(=O)Nc2ccc(CCc3ccc(O)c(O)c3)cc2)c(O)c1
BDBM50286961 COc1cc(CCc2ccc(NC(=O)c3ccc(C)cc3O)cc2)ccc1O
BDBM50286962 OC(=O)c1ccccc1-c1cccc(C(=O)Nc2ccc(CCc3ccc(O)c(O)c3)cc2)c1O
BDBM50286963 Oc1ccc(CCc2ccc(NC(=O)c3ccc(Cl)cc3O)cc2)cc1O
BDBM50286964 Oc1ccc(CCCCc2ccc(NC(=O)c3ccccc3O)cc2)cc1O
BDBM50286965 CN(C(=O)c1ccc(C)cc1O)c1ccc(CCc2ccc(O)c(O)c2)cc1
BDBM50286966 COc1ccc(CCc2ccc(NC(=O)c3ccccc3O)cc2)cc1OC
BDBM50286967 Oc1ccc(CCc2ccc(NC(=O)c3cc(Br)ccc3O)cc2)cc1O
BDBM50286968 OC(=O)c1cccc(C(=O)Nc2ccc(CCc3ccc(O)c(O)c3)cc2)c1O
BDBM50286969 Oc1ccc(CCc2ccc(NC(=O)c3ccccc3O)cc2)cc1O
BDBM50320451 CC1(C)CCC[C@@]2(C)[C@H]1CC[C@]1(C)OC3=CC(=O)C(=O)C=C3C=C21 |r,c:21,t:15,24|
BDBM50320452 CC1(C)CCC[C@@]2(C)[C@H]1CC[C@]1(C)OC3CC(=O)C(=O)C3=C[C@H]21 |r,c:22|
BDBM50320453 CC1(C)CCC[C@@]2(C)[C@H]1CC[C@]1(C)Oc3cccc(C(O)=O)c3C(=O)[C@H]21 |r|
BDBM50320447 [#6]\[#6](-[#6])=[#6]\[#6]-[#6][C@@]1([#6])[#6]-[#6]-[#6][C@]2([#6])[#6@H](-[#6]-c3cc(ccc3-[#8])-[#6](-[#8])=O)-[#6](-[#6])=[#6]-[#6]-[#6@@H]12 |r,c:27|
BDBM50320448 [#6]\[#6](-[#6])=[#6]/[#6]-[#6]C1([#6])[#6]-[#6]-[#6][C@@]2([#6])[#6@@H](-[#6]-c3cc(ccc3-[#8])-[#6](-[#8])=O)-[#6](-[#6])=[#6]-[#6]-[#6@H]12 |r,c:27|
BDBM50331803 CC[C@](O)(c1cn(Cc2ccc3c(c(sc3c2)C(N)=O)-c2ccc(F)cc2)nn1)C(F)(F)F |r|
BDBM50329320 O=C(OCC#CCSc1nnc(o1)-c1cccc2ccccc12)c1cccs1
BDBM50329321 O=C(OCC#CCSc1nnc(o1)-c1cccc2ccccc12)c1ccsc1
BDBM50329322 O=C(OCC#CCSc1nnc(o1)-c1cccc2ccccc12)c1cc2ccccc2s1
BDBM50329323 O=C(OCC#CCSc1nnc(o1)-c1cccc2ccccc12)c1ccccc1
BDBM50329324 Fc1cccc(c1)C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50329325 Fc1ccc(cc1F)C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50329326 FC(F)(F)Oc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50329327 FC(F)(F)c1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50329328 Fc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1ccc2ccccc2c1
BDBM50329329 Fc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1ccc(Cl)cc1
BDBM50329330 O=C(OCC#CCSc1nnc(o1)-c1cccc2ccccc12)c1cnc[nH]1
BDBM50353672 CC(C)c1ccc(OC(=O)CCc2cc(-c3ccc(C)cc3)n(n2)-c2ccccc2)cc1
BDBM50353673 CCOC(=O)C1CCN(CC1)C(=O)CCc1cc(-c2ccc(C)cc2)n(n1)-c1ccc2ccccc2n1
BDBM50353674 CC(C)c1ccc(OC(=O)CCc2cc(-c3ccc(C)cc3)n(n2)-c2ccc3ccccc3n2)cc1
BDBM50353676 CCOC(=O)C1CCN(CC1)C(=O)CCc1cc(-c2ccc(cc2)C(F)(F)F)n(n1)-c1ccc(Cl)nn1
BDBM50353677 CCOC(=O)C1CCN(CC1)C(=O)CCc1cc(-c2ccc(C)cc2)n(n1)-c1ccccc1
BDBM50353678 CC(C)(C)c1ccc(CN2CCN(CC2)C(=O)CCc2cc(-c3ccc(F)cc3)n(n2)-c2ccc(Cl)nn2)cc1
BDBM50353663 Cc1ccc(cc1)-c1cc(CCC(=O)N2CCN(Cc3ccc(cc3)C(C)(C)C)CC2)nn1-c1ccccc1
BDBM50353666 Cc1ccc(cc1)-c1cc(CCC(=O)N2CCN(Cc3ccc(cc3)C(C)(C)C)CC2)nn1-c1ccc2ccccc2n1
BDBM50347310 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c(C)[nH]nc1-c1ccc(OC)cc1
BDBM50347311 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c(CC(C)C)[nH]nc1-c1ccc(OC)cc1
BDBM50347312 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c(n[nH]c1-c1ccc(OC)cc1)-c1ccccc1
BDBM50347313 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c(n[nH]c1-c1ccccc1)-c1ccccc1OC
BDBM50347314 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c(n[nH]c1-c1cccc(OC)c1)-c1ccccc1
BDBM50347315 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c(n[nH]c1-c1ccccc1)-c1ccccc1
BDBM50347316 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c(Cc2ccccc2)[nH]nc1-c1ccccc1
BDBM50347317 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c(n[nH]c1-c1cccs1)-c1ccccc1
BDBM50347318 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c(n[nH]c1-c1cccs1)-c1cccs1
BDBM50347319 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c(n[nH]c1-c1cccs1)-c1cccc(OC)c1
BDBM50347320 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c(n[nH]c1-c1cccs1)-c1cc(C)on1
BDBM50347321 CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c(n[nH]c1-c1cccs1)-c1cnccn1
BDBM50347322 CN([C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)NCCc1c(n[nH]c1-c1cccs1)-c1ccccc1 |r|
BDBM50347323 COc1cccc(c1)-c1n[nH]c(c1CCNS(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)-c1cccs1 |r|
BDBM50347324 CN([C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)NCCc1c(n[nH]c1-c1cccs1)-c1cccs1 |r|
BDBM50347325 CN([C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)NCCc1c(n[nH]c1-c1cccs1)-c1cnccn1 |r|
BDBM50347326 CCN([C@@H]1CCN(C1)[C@H](C)c1ccccc1)S(=O)(=O)NCCc1c(n[nH]c1-c1cccs1)-c1cnccn1 |r|
BDBM50347327 CCN([C@@H]1CCN(C1)[C@@H](C)c1ccccc1)S(=O)(=O)NCCc1c(n[nH]c1-c1cccs1)-c1cnccn1 |r|
BDBM50347328 CCN([C@@H]1CCN(C1)C(C)(C)c1ccccc1)S(=O)(=O)NCCc1c(n[nH]c1-c1cccs1)-c1cnccn1 |r|
BDBM50347329 CCN([C@@H]1CCN(C1)C(C)c1ccc(F)cc1)S(=O)(=O)NCCc1c(n[nH]c1-c1cccs1)-c1cnccn1 |r|
BDBM50347330 CN([C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)NCCc1c(n[nH]c1-c1cccs1)-c1cc(C)on1 |r|
BDBM50357000 N#Cc1ccn2c(c(c(OCOCc3ccccc3)c2c1)-c1ccccc1)-c1ccccc1
BDBM50357001 FC(F)(F)S(=O)(=O)Oc1c(c(-c2ccccc2)n2ccc(cc12)C#N)-c1ccccc1
BDBM50357002 Cc1ccc(cc1)S(=O)(=O)Oc1c(c(-c2ccccc2)n2ccc(cc12)C#N)-c1ccccc1
BDBM50357003 CC(=O)Oc1c(c(-c2ccccc2)n2ccc(cc12)C#N)-c1ccccc1
BDBM50357004 N#Cc1ccn2c(c(c(Cc3ccccc3)c2c1)-c1ccccc1)-c1ccccc1
BDBM50357005 COc1ccc(cc1)-c1c(c(-c2ccccc2)n2ccc(cc12)C#N)-c1ccccc1
BDBM50357006 O=Cc1c(c(-c2ccccc2)n2ccc(cc12)C#N)-c1ccccc1
BDBM50357007 CC(=O)c1c(c(-c2ccccc2)n2ccc(cc12)C#N)-c1ccccc1
BDBM50357008 O=C(c1c(c(-c2ccccc2)n2ccc(cc12)C#N)-c1ccccc1)c1ccccc1
BDBM50357009 OCc1c(c(-c2ccccc2)n2ccc(cc12)C#N)-c1ccccc1
BDBM50357010 OC(c1c(c(-c2ccccc2)n2ccc(cc12)C#N)-c1ccccc1)c1ccccc1
BDBM50357015 COc1c(c(-c2ccccc2)n2ccc(cc12)C#N)-c1ccccc1
BDBM50357016 N#Cc1ccn2c(c(cc2c1)-c1ccccc1)-c1ccccc1
BDBM50350394 CC(=O)NC(c1cccs1)c1cc(Cl)c2cccnc2c1O
BDBM50350396 CC(=O)NC(c1cccs1)c1cc(Br)c2cccnc2c1O
BDBM50361373 [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#8]-c1ccc2ccc(=O)oc2c1
BDBM50391169 [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#8]-c1cc2ccccc2oc1=O
BDBM50391170 [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#8]-c1cc(=O)oc2ccccc12
BDBM50391171 [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#8]-c1cccc2oc(=O)ccc12
BDBM50391172 [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#8]-c1ccc2oc(=O)ccc2c1
BDBM50391173 [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#8]-c1cccc2ccc(=O)oc12
BDBM50391174 [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#8]-c1cc2ccccc2oc1=O
BDBM50391175 [#6]\[#6](-[#6])=[#6]/[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#8]-c1cc(=O)oc2ccccc12
BDBM50391176 [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#8]-c1cccc2oc(=O)ccc12
BDBM50391177 [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#8]-c1ccc2oc(=O)ccc2c1
BDBM50391178 [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#8]-c1cccc2ccc(=O)oc12
BDBM50391179 [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#8]-c1ccccc1
BDBM50417151 O=C(OCC#CCSc1nnc(o1)-c1cccc2ccccc12)c1ccco1
BDBM50417152 O=C(OCC#CCSc1nnc(o1)-c1cccc2ccccc12)C1CCC1
BDBM50417153 O=C(OCC#CCSc1nnc(o1)-c1cccc2ccccc12)c1ccc2ccccc2c1
BDBM50417154 Clc1c(sc2ccccc12)C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50417155 Fc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1ccccc1
BDBM50417156 Fc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1ccccc1F
BDBM50417157 Fc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1ccccc1Cl
BDBM50417158 Fc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1ccco1
BDBM50417159 Fc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1cccs1
BDBM50417160 COc1ccccc1-c1nnc(SCC#CCOC(=O)c2ccc(F)cc2)o1
BDBM50417161 Fc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1cc2ccccc2[nH]1
BDBM50417162 Fc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1cccc2ncccc12
BDBM50417163 O=C(NCC#CCSc1nnc(o1)-c1cccc2ccccc12)c1cccs1
BDBM50417164 O=C(OCC#CCNc1nnc(o1)-c1cccc2ccccc12)c1cccs1
BDBM50417165 Fc1ccc(cc1)C(=O)OCCCCSc1nnc(o1)-c1cccc2ccccc12
BDBM50417166 Fc1ccc(cc1)C(=O)OCc1ccc(CSc2nnc(o2)-c2cccc3ccccc23)cc1
BDBM50417167 Fc1ccc(cc1)C(=O)OC\C=C\CSc1nnc(o1)-c1cccc2ccccc12
BDBM50417168 OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50417169 Fc1ccc(COCC#CCSc2nnc(o2)-c2cccc3ccccc23)cc1
BDBM50417170 FC(F)(F)c1cccc(c1)C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50417171 FC(F)(F)c1cc(ccc1Cl)C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50417172 CN(C)c1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50417173 O=C(OCC#CCSc1nnc(o1)-c1cccc2ccccc12)C1CC1
BDBM50417174 O=C(OCC#CCSc1nnc(o1)-c1cccc2ccccc12)c1cc2ccccc2o1
BDBM50417175 Fc1cc(cc(F)c1F)C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50417176 COc1ccccc1C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50417177 CS(=O)(=O)c1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50447175 COc1cccc(CNc2ccc(cc2)S(=O)(=O)Nc2nc3ccccc3s2)c1O
BDBM50447176 COc1cccc(CNc2ccc(cc2)S(=O)(=O)Nc2nc3ccccc3o2)c1O
BDBM50447177 COc1cccc(CNc2ccc(cc2)S(=O)(=O)Nc2nc3ccccc3[nH]2)c1O
BDBM50447178 COc1cccc(CNc2ccc(cc2)S(=O)(=O)Nc2nccs2)c1O
BDBM50447179 Oc1c(Cl)cccc1CNc1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2s1
BDBM50447180 COc1cccc(CNc2ccc(cc2)S(=O)(=O)Nc2nc3ccc(F)cc3s2)c1O
BDBM50447181 COc1cccc(CNc2ccc(cc2)S(=O)(=O)Nc2cccc(c2)C(C)C)c1O
BDBM50447182 COc1ccc2nc(NS(=O)(=O)c3ccc(NCc4cccc(OC)c4O)cc3)sc2c1
BDBM50447183 COc1cccc(CNc2ccc(cc2)S(=O)(=O)Nc2ccccc2)c1O
BDBM50447184 COc1cccc(CNc2ccc(cc2)S(=O)(=O)Nc2nc3c(C)cccc3s2)c1O
BDBM50446402 Oc1ccc(C(=O)Cc2ccc3ccccc3c2)c(O)c1
BDBM50446409 Oc1ccc(c(O)c1)-c1cccc2Sc3ccccc3Sc12
BDBM50446410 Oc1ccc(Cc2ccc3ccccc3c2)c(O)c1
BDBM50446411 Oc1ccc(c(O)c1)-c1ccccc1
BDBM50446412 CCCCC=Cc1cc(O)c(O)cc1O |w:5.5|
BDBM50446413 O=C1CC(=O)C(Cc2ccc3ccccc3c2)=CC1=O |c:18|
BDBM50446420 O=C1CC(=O)C(=O)C(CC2CCC3CCCCC3C2)C1=O
BDBM50011732 CNc1oc(nc1C#N)-c1cccc2ncccc12
BDBM50011734 CNc1oc(nc1C#N)-c1cccc2nccnc12
BDBM50011736 CNc1oc(nc1C#N)-c1ccc(Cl)c(Cl)c1
BDBM50011739 CNc1oc(nc1C#N)-c1ccc(cc1)-c1ccccc1
BDBM50011741 CNc1oc(nc1C#N)-c1ccc2cc[nH]c2c1
BDBM50011743 CNc1oc(nc1C#N)-c1ccc(Cl)cc1
BDBM50011783 CNc1sc(nc1C#N)-c1cccc2ccccc12
BDBM50011785 CNc1nc(C#N)c(o1)-c1cccc2ccccc12
BDBM50011787 CNc1nnc(s1)-c1cccc2ccccc12
BDBM50011792 CNc1oc(nc1C#N)-c1cccc2cnccc12
BDBM50011794 N#Cc1nc(oc1NCc1ccccc1)-c1cccc2ccccc12
BDBM50011746 CNc1oc(nc1C#N)C1CCCC1
BDBM50011748 CCCCNc1oc(nc1C#N)-c1cccc2ccccc12
BDBM50011769 C=CCNc1oc(nc1C#N)-c1cccc2ccccc12
BDBM50011773 CC(=O)Nc1oc(nc1C#N)-c1cccc2ccccc12
BDBM50011782 N#Cc1nc(oc1NC1CNC1)-c1cccc2ccccc12
BDBM50011784 CNc1ncc(o1)-c1cccc2ccccc12
BDBM50011786 CNc1nnc(o1)-c1cccc2ccccc12
BDBM50011788 CNc1oc(nc1C(=O)OC)-c1cccc2ccccc12
BDBM50011789 CNc1nc(ccc1C#N)-c1cccc2ccccc12
BDBM50011790 CNc1nccc(n1)-c1cccc2ccccc12
BDBM50011791 CNc1oc(nc1C#N)-c1ccc2ccccc2c1
BDBM50011793 CN(C)c1oc(nc1C#N)-c1cccc2ccccc12
BDBM50011795 N#Cc1nc(oc1Nc1ccccc1)-c1cccc2ccccc12
BDBM50011797 CNc1sc(nc1C(=O)OC)-c1cccc2ccccc12
BDBM50011733 CNc1oc(nc1C#N)-c1ccc2cnccc2c1
BDBM50011735 CNc1oc(nc1C#N)-c1cccc(Cl)c1Cl
BDBM50011737 CNc1oc(nc1C#N)-c1ccc2OCCOc2c1
BDBM50011738 CNc1oc(nc1C#N)-c1ccc2OCOc2c1
BDBM50011740 CNc1oc(nc1C#N)-c1ccccc1-c1ccccc1
BDBM50011742 CNc1oc(nc1C#N)-c1c[nH]c2ccccc12
BDBM50011744 CNc1oc(nc1C#N)-c1cccc(Cl)c1
BDBM50011745 CNc1oc(nc1C#N)-c1ccc(F)cc1
BDBM50011747 Nc1oc(nc1C#N)-c1cccc2ccccc12
BDBM50011749 CCCCCNc1oc(nc1C#N)-c1cccc2ccccc12
BDBM50011772 CC(C)Nc1oc(nc1C#N)-c1cccc2ccccc12
BDBM50011776 N#Cc1nc(oc1NC1COC1)-c1cccc2ccccc12
BDBM50016516 CCOC(=O)c1c(CSc2c(C)cc(C)cc2C)n(C)c2ccc(O)cc12
BDBM50020589 COc1cc(\C=C\c2cc(\C=C\c3cc(CC=C(C)C)c(O)c(OC)c3)[nH]n2)cc(CC=C(C)C)c1O |(11.47,-47.18,;10.14,-46.41,;10.14,-44.87,;11.48,-44.1,;11.47,-42.55,;12.8,-41.78,;14.14,-42.54,;15.47,-41.77,;16.81,-42.53,;18.14,-41.76,;19.48,-42.52,;20.81,-41.75,;22.14,-42.51,;23.46,-41.73,;24.8,-42.49,;26.13,-41.71,;27.47,-42.47,;28.8,-41.69,;30.13,-42.45,;28.78,-40.15,;24.81,-44.04,;26.15,-44.8,;23.48,-44.81,;23.48,-46.35,;22.15,-47.13,;22.14,-44.05,;18.13,-40.22,;15.47,-40.23,;10.14,-41.79,;8.81,-42.56,;7.48,-41.79,;6.14,-42.56,;4.81,-41.79,;3.47,-42.56,;4.81,-40.25,;8.81,-44.1,;7.47,-44.9,)|
BDBM50038459 COc1ccc(Cc2sc(nc2O)-c2ccc(Cl)cc2)cc1
BDBM50045522 CCCCCC(=O)\C=C\C=C/CCCCCCCC(O)=O
BDBM50026084 Fc1ccccc1C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50026085 COc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50026086 Fc1ncccc1C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50026087 Clc1sc(C(=O)OCC#CCSc2nnc(o2)-c2cccc3ccccc23)c(Cl)c1Cl
BDBM50026088 Clc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50026089 O=C(OCC#CCSc1nnc(o1)-c1cccc2ccccc12)C1CCCC1
BDBM50026091 Fc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1cccc(F)c1
BDBM50026170 Brc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50026174 Fc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50026078 Fc1ccc(C(=O)OCC#CCSc2nnc(o2)-c2cccc3ccccc23)c(F)c1
BDBM50026079 Fc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1ccc(F)cc1
BDBM50026080 Clc1ccsc1C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50026081 FC(F)Oc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50026082 O=C(OCC#CCSc1nnc(o1)-c1cccc2ccccc12)c1csc2ccccc12
BDBM50026083 FC(F)(F)Sc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)-c1cccc2ccccc12
BDBM50045523 CCCCC\C=C/CC(=O)\C=C\C=C/C\C=C/CCCC(O)=O
BDBM47298 CCC(=O)NC(c1cccs1)c1cc([N+]([O-])=O)c2cccnc2c1O
BDBM32020 CC(Cc1ccc(O)c(O)c1)C(C)Cc1ccc(O)c(O)c1
BDBM50109568 Fc1ccc(NC(=O)c2cc[nH]n2)c(Cl)c1
BDBM50123745 CCN([C@H]1CCN(C1)C(C)c1ccc(F)cc1)S(=O)(=O)NCCc1c(n[nH]c1-c1cnccn1)-c1cccs1 |r|
BDBM50123798 CCN([C@@H]1CCN(C1)C(C)c1ccc(F)cc1)S(=O)(=O)NCCc1nc([nH]c1-c1ccc(OC)cc1)-c1cccs1
BDBM50123667 CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(=O)CC
BDBM50123669 CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(=O)C[C@@H](C)CCCC(C)C |r|
BDBM50109566 Clc1ccccc1NC(=O)c1cc[nH]n1
BDBM50123672 CCCCCCCCCC(=O)c1c([nH]c2cc(Cl)ccc12)C(=O)OCC
BDBM50123679 CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(=O)CCc1ccccc1
BDBM50123674 CCCCCC(=O)c1c([nH]c2cc(Cl)ccc12)C(=O)OCC
BDBM50105867 CCCCCNC(=O)n1ccc(n1)C(=O)Nc1ccc(F)cc1Cl
BDBM50148010 COc1ccc(-c2cc([nH]n2)-c2ccc(C)cc2)c(O)c1
BDBM50148011 Cc1ccc(cc1)-c1cc([nH]n1)-c1ccc(C)cc1O
BDBM50148015 COc1ccc(cc1)-c1cc([nH]n1)-c1cc(OC)ccc1O
BDBM50148016 Oc1ccccc1-c1cc([nH]n1)-c1ccccc1
BDBM50148017 Oc1ccccc1-c1cc([nH]n1)-c1ccco1
BDBM50148018 COc1ccc(cc1)-c1cc([nH]n1)-c1ccccc1O
BDBM50109814 Fc1ccc(NC(=O)c2n[nH]c(Cl)c2Cl)c(Cl)c1
BDBM50109539 Clc1ccc(NC(=O)c2cc[nH]n2)nc1
BDBM50109561 Clc1cnc(NC(=O)c2cc[nH]n2)s1
BDBM50109562 O=C(Nc1cnc2ccccc2c1)c1cc[nH]n1
BDBM50109563 O=C(Nc1ccc2ncccc2c1)c1cc[nH]n1
BDBM50109564 O=C(Nc1cc2ccccc2cn1)c1cc[nH]n1
BDBM50109565 Fc1ccc(NC(=O)c2cc[nH]n2)cc1
BDBM50109567 Clc1ccc(NC(=O)c2cc[nH]n2)cc1Cl
BDBM50109569 FC(F)(F)c1ccc(NC(=O)c2cc[nH]n2)cc1
BDBM50109571 O=C(Nc1ccccn1)c1cc[nH]n1
BDBM50109576 Fc1c[nH]nc1C(=O)Nc1ccc(F)cc1Cl
BDBM50109577 Fc1ccc(NC(=O)c2n[nH]cc2Br)c(Cl)c1
BDBM50109578 Fc1ccc(NC(=O)c2n[nH]c(Cl)c2Br)c(Cl)c1
BDBM50109643 Fc1ccc(NC(=O)c2cc(I)[nH]n2)c(Cl)c1
BDBM50109645 Fc1ccc(NC(=O)c2n[nH]cc2C(F)(F)F)c(Cl)c1
BDBM50109646 Fc1ccc(NC(=O)c2cc([nH]n2)C(F)(F)F)c(Cl)c1
BDBM50109648 Fc1ccc(NC(=O)c2n[nH]c(c2C(F)(F)F)C(F)(F)F)c(Cl)c1
BDBM50109651 Cc1c(n[nH]c1[Si](C)(C)C)C(=O)Nc1ccc(F)cc1Cl
BDBM50109700 FC(F)c1cc(n[nH]1)C(=O)Nc1ccc(F)cc1Cl
BDBM50109707 O=C(Nc1ccccc1)c1cc[nH]n1
BDBM50109729 Clc1[nH]nc(c1Cl)-c1nc2ccc(Cl)cc2o1
BDBM50109730 Fc1ccc(NC(=O)c2n[nH]cc2Cl)c(Cl)c1
BDBM50109731 Nc1c[nH]nc1C(=O)Nc1ccc(F)cc1Cl
BDBM50109732 Nc1cc(n[nH]1)C(=O)Nc1ccc(F)cc1Cl
BDBM50109733 Cc1c[nH]nc1C(=O)Nc1ccc(F)cc1Cl
BDBM50109734 Cc1cc(n[nH]1)C(=O)Nc1ccc(F)cc1Cl
BDBM50109735 CCCCc1c[nH]nc1C(=O)Nc1ccc(F)cc1Cl
BDBM50109736 CC(C)(C)c1cc(n[nH]1)C(=O)Nc1ccc(F)cc1Cl
BDBM50109737 O=C(Nc1ccccc1)c1cn[nH]n1
BDBM50109738 Fc1ccc(NC(=O)c2cn[nH]n2)cc1
BDBM50109739 Clc1ccccc1NC(=O)c1cn[nH]n1
BDBM50109740 Fc1ccc(NC(=O)c2cn[nH]n2)c(Cl)c1
BDBM50109741 Clc1ccc(Cl)c(NC(=O)c2cn[nH]n2)c1
BDBM50109742 Fc1ccc(NC(=O)c2cn[nH]n2)nc1
BDBM50109743 O=C(Nc1cnc2ccccc2c1)c1cn[nH]n1
BDBM50109744 Fc1ccc2cc(NC(=O)c3cn[nH]n3)cnc2c1
BDBM50109746 Clc1ccc2nc(oc2c1)-c1cc[nH]n1
BDBM50109747 Clc1ccc2oc(nc2c1)-c1cc[nH]n1
BDBM50109748 Fc1ccc2nc(oc2c1)-c1cc[nH]n1
BDBM50109749 Fc1ccc2oc(nc2c1)-c1cc[nH]n1
BDBM50109751 Clc1cc(n[nH]1)-c1nc2ccc(Cl)cc2o1
BDBM50109752 FC(F)c1[nH]nc(C(=O)Nc2ccc(F)cc2Cl)c1Cl
BDBM50109780 [O-][N+](=O)c1c[nH]nc1C(=O)Nc1ccc(F)cc1Cl
BDBM50109642 Fc1ccc(NC(=O)c2n[nH]cc2I)c(Cl)c1
BDBM50109781 [O-][N+](=O)c1cc(n[nH]1)C(=O)Nc1ccc(F)cc1Cl
BDBM50148019 Cc1ccccc1-c1cc([nH]n1)-c1ccccc1O
BDBM50148021 COc1ccc(cc1)C(=O)c1c[nH]nc1-c1cc(C)ccc1O
BDBM50148023 Cc1ccc(O)c(c1)-c1cc([nH]n1)-c1cccc(Br)c1
BDBM50147966 Oc1ccc(Br)cc1-c1cc([nH]n1)-c1ccccc1
BDBM50147981 Oc1ccc(Br)cc1-c1cc([nH]n1)-c1ccccc1Cl
BDBM50147986 Oc1ccc(Cl)cc1-c1cc([nH]n1)-c1ccccc1Cl
BDBM50148009 c1c(n[nH]c1-c1ccccc1)-c1ccccc1
BDBM50148013 Cc1ccc(-c2cc([nH]n2)-c2ccccc2Cl)c(O)c1
BDBM50105864 CCCCCCNC(=O)n1nc(cc1C)C(=O)Nc1ccc(F)cc1Cl
BDBM50105865 CC(=O)n1ccc(n1)C(=O)Nc1ccc(Cl)c(Cl)c1
BDBM50105866 Fc1ccc(NC(=O)c2ccn(n2)C(=O)Nc2ccc3OCOc3c2)c(Cl)c1
BDBM50105868 CCOC(=O)CCCCCNC(=O)n1ccc(n1)C(=O)Nc1ccc(F)cc1Cl
BDBM50105869 Fc1ccc(NC(=O)c2ccn(n2)S(=O)(=O)c2cccc(c2)C(F)(F)F)c(Cl)c1
BDBM50105870 Fc1ccc(NC(=O)c2ccn(n2)C(=S)Nc2ccc3OCOc3c2)c(Cl)c1
BDBM50105871 CCCCCCNC(=O)n1cc(C)c(n1)C(=O)Nc1cccc2OC(F)(F)Oc12
BDBM50109570 Fc1ccc(NC(=O)c2cc[nH]n2)c(c1)C(F)(F)F
BDBM50109649 Fc1ccc(NC(=O)c2n[nH]c(c2Cl)C(F)(F)F)c(Cl)c1
BDBM50109702 Clc1ccc(NC(=O)c2cn[nH]n2)c(Cl)c1
BDBM50109745 c1cc(n[nH]1)-c1nc2ccccc2o1
BDBM50109812 O=C(Nc1ccc2ccccc2n1)c1cc[nH]n1
BDBM50109813 Fc1ccc(NC(=O)c2cc(Cl)[nH]n2)c(Cl)c1
BDBM50109815 Fc1ccc(NC(=O)c2cc[nH]n2)nc1
BDBM50148014 COc1ccc(O)c(c1)-c1cc([nH]n1)-c1ccc(F)cc1
BDBM50180652 CN1CCN(CC(=O)N2N=C3C(CCC\C3=C/c3ccccc3)C2c2ccccc2)CC1 |c:9|
BDBM50180653 [I-].C[n+]1cn(\N=C\c2ccccc2)c2ccccc12
BDBM50180654 c1c2ccccn2c2cc-3c(n[n+]12)-c1cccc2cccc-3c12
BDBM50206304 CCCCCCCCCCCCNC(=O)c1cc(sc1N)-c1ccccc1
BDBM50206305 CCCCCNC(=O)c1cc(sc1N)-c1ccccc1
BDBM50206306 CCCCNC(=O)c1cc(sc1N)-c1ccccc1
BDBM50206307 COCCNC(=O)c1cc(sc1N)-c1ccccc1
BDBM50206303 CCCCCCCC(=O)Nc1sc(cc1C(=O)NCCCC)-c1ccccc1
BDBM50206315 Nc1sc(cc1C(=O)NCC#C)-c1ccccc1
BDBM50206316 CCCCNC(=O)c1cc(sc1NC(=O)CCC)-c1ccccc1
BDBM50206317 CCCCNC(=O)c1c(N)sc(c1C)-c1ccccc1
BDBM50206318 [#6]-[#6]-[#6]-[#6]-[#7]-[#6](=O)-c1cc(sc1-[#7])-[#6](-[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6]
BDBM50206319 Cc1[nH]c2ccccc2c1C(=O)c1cc(Cc2ccccc2)sc1N
BDBM50206320 CCCCNC(=O)c1c(N)sc(c1CCCC)-c1ccccc1
BDBM50206308 CCCCNC(=O)c1cc(sc1NC(C)=O)-c1ccccc1
BDBM50206309 CCCCNC(=O)c1c(N)sc(c1CCCC)-c1ccc(Cl)cc1
BDBM50206311 CCCCNC(=O)c1cc(CCCCCCCC=C)sc1N
BDBM50206312 CCCCCCCCNC(=O)c1cc(sc1N)-c1ccccc1
BDBM50206314 Nc1sc(cc1C(=O)NCC=C)-c1ccccc1
BDBM50200541 CC1=NN(C(=O)C1)c1ccccc1 |t:1|