SMILES for Histone deacetylase 9

CC(O)COC[C@H]1O[C@@H]2O[C@@H]3[C@@H](COCC(C)O)O[C@H](O[C@@H]4[C@@H](COCC(C)O)O[C@H](O[C@@H]5[C@@H](COCC(C)O)O[C@H](O[C@@H]6[C@@H](COCC(C)O)O[C@H](O[C@@H]7[C@@H](COCC(C)O)O[C@H](O[C@@H]8[C@@H](COCC(C)O)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

BDBM50044642

CC1(C)CC(=O)Nc2ccc(NC(=O)CCCCCCC(=O)NO)cc12

BDBM50044645

CC1(C)CC(=O)Nc2ccc(cc12)C(=O)NCCCCCCC(=O)NO

BDBM50044639

CC1(C)CC(=O)Nc2ccc(cc12)C(=O)NC[C@@H]1CC[C@H](CCC(=O)NO)CC1 |r,wU:17.18,20.22,(45.27,-32.85,;46.06,-34.2,;46.81,-32.85,;47.39,-34.97,;47.39,-36.51,;48.73,-37.28,;46.06,-37.28,;44.72,-36.51,;43.39,-37.28,;42.06,-36.51,;42.06,-34.97,;43.39,-34.2,;44.72,-34.97,;40.73,-34.2,;40.73,-32.66,;39.39,-34.97,;38.06,-34.2,;36.72,-34.97,;35.39,-34.2,;34.05,-34.96,;34.04,-36.5,;32.71,-37.27,;31.38,-36.49,;30.04,-37.26,;30.03,-38.8,;28.71,-36.48,;27.37,-37.24,;35.38,-37.28,;36.72,-36.51,)|

BDBM50044636

CC1(C)CC(=O)Nc2ccc(cc12)C(=O)NC[C@H]1CC[C@@H](CC1)\C=C\C(=O)NO |r,wU:17.18,wD:20.25,(21.24,-20.14,;22.02,-21.48,;22.78,-20.14,;23.36,-22.25,;23.36,-23.79,;24.69,-24.56,;22.02,-24.56,;20.69,-23.79,;19.36,-24.56,;18.02,-23.79,;18.02,-22.25,;19.36,-21.48,;20.69,-22.25,;16.7,-21.48,;16.7,-19.94,;15.36,-22.25,;14.02,-21.48,;12.69,-22.25,;12.69,-23.8,;11.35,-24.56,;10.01,-23.79,;10.02,-22.25,;11.35,-21.48,;8.67,-24.55,;7.34,-23.78,;6.01,-24.54,;6,-26.08,;4.68,-23.76,;3.34,-24.53,)|

BDBM50044638

CC1(C)CC(=O)Nc2ccc(cc12)C(=O)NC[C@H]1CC[C@H](CC1)\C=C\C(=O)NO |r,wU:17.18,20.25,(21.18,-34.58,;21.96,-35.93,;22.72,-34.58,;23.3,-36.7,;23.3,-38.24,;24.63,-39.01,;21.96,-39.01,;20.62,-38.24,;19.3,-39.01,;17.96,-38.24,;17.96,-36.7,;19.3,-35.93,;20.62,-36.7,;16.63,-35.93,;16.63,-34.39,;15.3,-36.7,;13.96,-35.93,;12.62,-36.7,;12.63,-38.24,;11.28,-39.01,;9.95,-38.24,;9.96,-36.69,;11.29,-35.93,;8.61,-39,;7.28,-38.22,;5.94,-38.99,;5.94,-40.53,;4.61,-38.21,;3.28,-38.97,)|

BDBM50044637

CC1(C)CC(=O)Nc2ccc(cc12)C(=O)NC[C@H]1CC[C@H](CCC(=O)NO)CC1 |r,wU:17.18,wD:20.22,(21.54,-26.71,;22.32,-28.05,;23.08,-26.71,;23.66,-28.82,;23.66,-30.36,;24.99,-31.13,;22.32,-31.13,;20.98,-30.36,;19.66,-31.13,;18.32,-30.36,;18.32,-28.82,;19.66,-28.05,;20.98,-28.82,;16.99,-28.05,;16.99,-26.51,;15.65,-28.82,;14.32,-28.05,;12.98,-28.82,;12.99,-30.37,;11.64,-31.14,;10.31,-30.36,;8.97,-31.12,;7.64,-30.35,;6.3,-31.11,;6.3,-32.65,;4.97,-30.34,;3.64,-31.1,;10.32,-28.82,;11.65,-28.05,)|

BDBM50044635

CC1(C)CC(=O)Nc2ccc(cc12)C(=O)NCc1ccc(\C=C\C(=O)NO)cc1

BDBM50044649

CC1(C)CC(=O)Nc2ccc(cc12)C(=O)NCc1cccc(\C=C\C(=O)NO)c1

BDBM50273526

CC1(C)N(Cc2c1cccc2C(=O)NO)c1cnc(cn1)C(F)(F)F

BDBM50273553

CC1(C)N(Cc2c1cccc2C(=O)NO)c1nc2ccc(cc2[nH]1)C(F)(F)F

BDBM50273519

CC1(C)N(Cc2c1cccc2C(N)=O)c1cnc(cn1)C(F)(F)F

BDBM50379131

CCC(=O)CCCCC[C@@H]1NC(=O)[C@H](C)NC(=O)C[C@H](CC(C)C)NC(=O)[C@H](Cc2cccc3ccccc23)NC1=O |r|

CCCC(=O)NO

CCCC(CCC)C(=O)NO

CCCC(CCC)C(O)=O

CCCC(O)=O

CCCCCCCC(=O)SCC\C=C\[C@@H]1CC(=O)NCc2nc(cs2)-c2cn(CC(=O)N[C@@H](C(C)C)C(=O)O1)nn2 |r|

BDBM50426493

CCCCCCCC(=O)SCC\C=C\[C@@H]1CC(=O)NCc2nc(cs2)-c2nnn(CC(=O)N[C@@H](C(C)C)C(=O)O1)n2 |r|

BDBM50426491

CCCCCCCC(=O)SCC\C=C\[C@@H]1CC(=O)NCc2nc(cs2)-c2nnnn2CC(=O)N[C@@H](C(C)C)C(=O)O1 |r|

BDBM50123628

CCCCCCCC(=O)SCC\C=C\[C@@H]1CC(=O)NCc2nc(cs2)C(=O)N\C(=C/C)C(=O)N[C@@H](C(C)C)C(=O)O1 |r|

BDBM50322422

CCCCCCCC(=O)SCC\C=C\[C@@H]1CC(=O)NCc2nc(cs2)C2=N[C@@](C)(CS2)C(=O)N[C@@H](C(C)C)C(=O)O1 |r,t:26|

BDBM50123619

CCCCCCCC(=O)SCC\C=C\[C@@H]1CC(=O)N[C@H](C(C)C)c2nc(cs2)C(=O)N\C(=C/C)C(=O)N[C@@H](C(C)C)C(=O)O1 |r|

BDBM50565135

CCCCCCCCCCCCCCCCNNC(=O)c1cccs1

BDBM50580056

CCCCCCCSSCC\C=C\[C@@H]1CC(=O)NCc2nc(cs2)C(=O)N\C(=C/C)C(=O)N[C@@H](CCCCN)C(=O)O1 |r|

BDBM50353232

CCCCCCc1nc2cc(\C=C\C(=O)NO)ccc2n1CCN(C)C

BDBM50353231

CCCCCCc1nc2cc(\C=C\C(=O)NO)ccc2n1CCNC(C)C

BDBM50353230

CCCCCCc1nc2cc(\C=C\C(=O)NO)ccc2n1CCNCC

BDBM50353234

CCCCCc1nc2cc(\C=C\C(=O)NO)ccc2n1CCNC(C)C

BDBM50560909

CCCCN(Cc1ccc(cc1)C(=O)NO)C(=O)Nc1ccc(CN)cc1

BDBM50503977

CCCCN(Cc1ccc(cc1)C(=O)NO)C(=O)Nc1ccc(OCCCCCn2cc(CNc3cccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c34)nn2)cc1

BDBM50398716

CCCCN(Cc1ccc(cc1)C(=O)NO)C(=O)Nc1ccccc1

BDBM163619

CCCCNNC(=O)c1ccc(Br)cc1

BDBM50354084

CCCC[C@H]1NC(=O)C[C@@H]2OC(=O)C[C@H](O)[C@H](NC(=O)[C@@H](CSSCC\C=C\2)NC1=O)[C@@H](C)CC |r,t:26|

BDBM50354085

CCCC[C@H]1NC(=O)C[C@H](OC(=O)C[C@H](O)[C@H](NC(=O)[C@@H](CS)NC1=O)[C@@H](C)CC)\C=C\CCS |r|

BDBM50353238

CCCCc1nc2cc(\C=C\C(=O)NO)ccc2n1CCN(C)C

BDBM50105330

CCCCc1nc2cc(\C=C\C(=O)NO)ccc2n1CCN(CC)CC

BDBM50353228

CCCCc1nc2cc(\C=C\C(=O)NO)ccc2n1CCNC(C)C

BDBM162846

CCCN(CCC)C[C@@H](C)NC(=O)c1ccc(cc1)-c1noc(n1)C(F)(F)F |r|

BDBM50595711

CCCN(CCCCOCCOCCOCC(=O)N[C@H](C(=O)N1C[C@H](O)C[C@H]1C(=O)NCc1ccc(cc1)-c1scnc1C)C(C)(C)C)C[C@@H](C)NC(=O)c1ccc(cc1)-c1noc(n1)C(F)(F)F |r|

BDBM50595712

CCCN(CCCCOCCOCCOCCOCC(=O)N[C@H](C(=O)N1C[C@H](O)C[C@H]1C(=O)NCc1ccc(cc1)-c1scnc1C)C(C)(C)C)C[C@@H](C)NC(=O)c1ccc(cc1)-c1noc(n1)C(F)(F)F |r|

BDBM50595713

CCCN(CCCCOCCOCCOCCOCCOCC(=O)N[C@H](C(=O)N1C[C@H](O)C[C@H]1C(=O)NCc1ccc(cc1)-c1scnc1C)C(C)(C)C)C[C@@H](C)NC(=O)c1ccc(cc1)-c1noc(n1)C(F)(F)F |r|

BDBM50595204

CCCNNC(=O)CCCCCCC(=O)Nc1ccccc1

BDBM476626

CCCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1

BDBM50584230

CCCNNC(=O)c1ccc(CNC(=O)c2cc3ccccc3[nH]2)cc1

BDBM50244779

CCCNNC(=O)c1ccc(NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccc(OC)cc2)cc1 |r|

BDBM50507257

CCCNc1ccc2C(=O)N(CCCCCC(=O)NO)C(=O)c3cccc1c23

BDBM50458479

CCCc1nn(C)c2c1nc([nH]c2=O)-c1cc(Cc2ccc(s2)C(=O)NO)ccc1OCC

BDBM50105329

CCN(CC)Cc1ccc2cc(COC(=O)Nc3ccc(cc3)C(=O)NO)ccc2c1

BDBM49152

CCN1CCN(CC1)C(c1cccnc1)c1cc(Cl)c2cccnc2c1O

BDBM50353233

CCNCCn1c(CC\C=C/CC)nc2cc(\C=C\C(=O)NO)ccc12

BDBM50593116

CCNNC(=O)c1ccc(CN2c3ccccc3C=Cc3ccncc23)cc1 |c:19|

BDBM618068

CCNc1nc2ccc(cc2[nH]1)-c1cn(Cc2ccc(cn2)-c2nnc(o2)C(F)F)nn1

BDBM50348384

CCOC(=O)CC(=O)CSc1nc(C)cc(=O)[nH]1

BDBM50494415

CCOC(=O)NCCCC(=O)NCCc1ccccc1

BDBM50354089

CC[C@H](C)[C@H]1NC(=O)[C@@H](CS)NC(=O)[C@@H](CCSC)NC(=O)C[C@H](OC(=O)C[C@@H]1O)\C=C\CCS |r|

BDBM50354088

CC[C@H](C)[C@H]1NC(=O)[C@H]2CSSCC\C=C\[C@H](CC(=O)N[C@H](CCSC)C(=O)N2)OC(=O)C[C@@H]1O |r,t:14|

BDBM50527608

CC[C@H](Nc1ncnc2[nH]cnc12)c1nc2cccc(CCCCC(=O)NO)c2c(=O)n1-c1ccccc1 |r|

BDBM50527619

CC[C@H](Nc1ncnc2[nH]cnc12)c1nc2cccc(CCCCCC(=O)NO)c2c(=O)n1-c1ccccc1 |r|

BDBM50527602

CC[C@H](Nc1ncnc2[nH]cnc12)c1nc2cccc(CNc3ncc(cn3)C(=O)NO)c2c(=O)n1-c1ccccc1 |r|

BDBM50527627

CC[C@H](Nc1ncnc2[nH]cnc12)c1nc2cccc(NCc3ccc(cc3)C(=O)NO)c2c(=O)n1-c1ccccc1 |r|

BDBM50348372

CN(C(C)=O)c1ccc(cc1)C(=O)CSc1nc(C)cc(=O)[nH]1

BDBM50353229

CN(C)CC(C)(C)Cn1c(CC(C)(C)C)nc2cc(\C=C\C(=O)NO)ccc12

BDBM50248570

CN(C)CC(C)(C)Cn1c(CCc2ccccc2)nc2cc(\C=C\C(=O)NO)ccc12

BDBM24622

CN(C)Cc1c(oc2ccccc12)C(=O)NCCOc1ccc(cc1)C(=O)NO

BDBM50588334

CN(CC#C)Cc1cccc(NC(=O)CCCCCCC(=O)NO)c1

BDBM323702

CN(CCc1ccccc1)S(=O)(=O)c1cccc(\C=C\C(=O)NO)c1

BDBM323709

CN(Cc1ccc(\C=C\C(=O)NO)cc1)CC12CC3CC(CC(C3)C1)C2 |TLB:19:20:24:18.23.17,23:18:25:24.22.21,23:22:25:18.19.17,THB:19:18:24:25.20.21|

BDBM323718

CN(Cc1ccc(\C=C\C(=O)NO)cc1F)CC12CC3CC(CC(C3)C1)C2 |TLB:20:21:25:19.24.18,24:19:26:25.23.22,24:23:26:19.20.18,THB:20:19:25:26.21.22|

BDBM50369345

CN(Cc1ccc(cc1F)C(=O)NO)CC12CC3CC(CC(C3)C1)C2 |THB:20:19:16:22.21.23,20:21:18.19.24:16,23:21:18:24.15.16,23:15:18:22.20.21|

BDBM323711

CN(Cc1ccc2C=C(CCc2c1)C(=O)NO)CC12CC3CC(CC(C3)C1)C2 |c:7,TLB:25:20:27:26.24.23,25:24:27:20.21.19,21:22:26:20.25.19,THB:21:20:26:27.22.23|

BDBM50517220

CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCP(O)(O)=O)P(O)(O)=O

BDBM50516203

CN(Cc1nc(no1)C1CCN(Cc2ccc(C)cc2)CC1)c1ncc(cn1)C(=O)NO

BDBM50188637

CN(Cc1nc2c(nc(nc2n1C)-c1ccc(N)cc1)N1CCOCC1)c1ncc(cn1)C(=O)NO

BDBM50188899

CN(Cc1nc2c(nc(nc2n1C)-c1ccncc1)N1CCOCC1)c1ncc(cn1)C(=O)NO

BDBM50188959

CN(Cc1nc2c(nc(nc2n1C)-c1cnc(N)nc1)N1CCOCC1)c1ncc(cn1)C(=O)NO

BDBM323701

CN(c1ccccc1)S(=O)(=O)c1cccc(\C=C\C(=O)NO)c1

BDBM531084

CN(c1ncc(cn1)C(=O)NO)C12CC3CC(CC(C3)C1)C2 |TLB:21:12:19:15.16.17,1:12:15:18.19.17,THB:21:16:19:20.13.12,20:18:15:21.13.12,20:12:15:18.19.17|

BDBM50044647

CN1C(=O)CC(C)(C)c2cc(ccc12)C(=O)NCCCCCCC(=O)NO

BDBM50517218

CN1CCC(CNC(=O)c2cccc(c2)-c2noc(n2)C(F)(F)F)(CC1)c1nc(cs1)-c1ccccc1

BDBM50517219

CN1CCC(CNC(=O)c2cccc(c2)C(=O)NO)(CC1)c1nc(cs1)-c1ccccc1

BDBM50544037

CN1CCN(CC1)c1ccc(c(N)c1)[N+]([O-])=O

BDBM50380399

CN1CCc2c(C1)c1ccccc1n2Cc1ccc(cc1)C(=O)NO

BDBM50511231

CN1CCc2c(C1)sc1nc([nH]c(=O)c21)-c1cc(C)c(OCCCCCC(=O)NO)c(C)c1

BDBM50399006

CN1C[C@@H]([C@H](C1)c1ccc(\C=C\C(=O)Nc2ccccc2N)cc1)C(=O)Nc1ccc(Cl)cc1 |r|

BDBM50399004

CN1C[C@@H]([C@H](C1)c1ccc(\C=C\C(=O)Nc2ccccc2N)cc1F)C(=O)Nc1ccc(Cl)cc1 |r|

BDBM50399005

CN1C[C@H]([C@@H](C1)c1ccc(\C=C\C(=O)Nc2ccccc2N)cc1)C(=O)Nc1ccc(Cl)cc1 |r|

BDBM50341847

CNC(=O)C(CCCCCCC(=O)NC1c2ccccc2-c2ccccc12)N=O

BDBM50341849

CNC(=O)C(CCCCCCC(=O)Nc1ccc(cc1)-c1ccccc1)N=O

BDBM50341848

CNC(=O)C(CCCCCCC(=O)Nc1ccc(cc1)N(C)C)N=O

BDBM50341845

CNC(=O)C(CCCCCCC(=O)Nc1ccc2ccccc2c1)N=O

BDBM50341850

CNC(=O)C(CCCCCCC(=O)Nc1cccc(Br)c1)N=O

BDBM50341854

CNC(=O)C(CCCCCCC(=O)Nc1cccc(c1)-c1ccc(Cl)nc1)N=O

BDBM50341852

CNC(=O)C(CCCCCCC(=O)Nc1cccc(c1)-c1ccc(cc1)C(O)=O)N=O

BDBM50341851

CNC(=O)C(CCCCCCC(=O)Nc1cccc(c1)-c1ccccc1)N=O

BDBM50341853

CNC(=O)C(CCCCCCC(=O)Nc1cccc(c1)-c1cccnc1)N=O

BDBM50341855

CNC(=O)C(CCCCCCC(=O)Nc1cccc(c1)-c1cncc2cc(Cl)ccc12)N=O

BDBM50341844

CNC(=O)C(CCCCCCC(=O)Nc1ccccc1)N=O

BDBM50341846

CNC(=O)C(CCCCCCC(=O)Nc1cnc2ccccc2c1)N=O

BDBM50341840

CNC(=O)C(CCCCCCNC(=O)c1cc(on1)-c1ccc(N)cc1)N=O

BDBM50341838

CNC(=O)C(CCCCCCNC(=O)c1cc(on1)-c1ccc(NC(=O)OC(C)(C)C)cc1)N=O

BDBM50341839

CNC(=O)C(CCCCCCNC(=O)c1cc(on1)-c1cccc(N)c1)N=O

BDBM50341837

CNC(=O)C(CCCCCCNC(=O)c1cc(on1)-c1cccc(NC(=O)OC(C)(C)C)c1)N=O

BDBM50341841

CNC(=O)C(CCCCC[C@H](N(Cc1ccc(OC)cc1)C(=O)OC(C)(C)C)C(=O)Nc1ccccc1)N=O |r|

BDBM50341843

CNC(=O)C(CCCCC[C@H](N(Cc1ccccc1)Cc1ccccc1)C(=O)Nc1ccccc1)N=O |r|

BDBM50341842

CNC(=O)C(CCCCC[C@H](NCc1ccc(OC)cc1)C(=O)Nc1ccccc1)N=O |r|

BDBM50348381

COC(=O)CSc1nc(C)cc(=O)[nH]1

BDBM50278221

COC(=O)c1ccc(CO\N=C\c2ccc(\C=C\C(=O)NO)cc2)cc1

BDBM587537

COC(=O)c1cccc2c1CN(c1cnc(cn1)C(F)(F)F)C2(C)C

BDBM50348390

COc1cc(C)nc(SCC(=O)c2ccc(NC(C)=O)cc2)n1

BDBM50565547

COc1cc(OC)c2c(nc(nc2c1)-c1cc(C)c(OCCCCCC(=O)NO)c(C)c1)N1CCN(C)CC1

BDBM50565548

COc1cc(OC)c2c(nc(nc2c1)-c1cc(C)c(OCCCCCC(=O)NO)c(C)c1)N1CCS(=O)(=O)CC1

BDBM50333090

COc1cc2CCCOC(CCCCCC(=O)NO)C(=O)Nc3ccccc3OCc(c2)c1

BDBM50333093

COc1cc2CCCO[C@@H](CCCCCC(=O)NO)C(=O)Nc3ccccc3OCc(c2)c1 |r|

BDBM50333094

COc1cc2CCCO[C@H](CCCCCC(=O)NO)C(=O)Nc3ccccc3OCc(c2)c1 |r|

BDBM50333087

COc1cc2COc3ccccc3NC(=O)C(CCCCCC(=O)NO)OC\C=C/c(c2)c1 |c:29|

BDBM50333089

COc1cc2COc3ccccc3NC(=O)[C@@H](CCCCCC(=O)NO)OC\C=C/c(c2)c1 |r,c:29|

BDBM50333088

COc1cc2COc3ccccc3NC(=O)[C@H](CCCCCC(=O)NO)OC\C=C/c(c2)c1 |r,c:29|

BDBM191640

COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3F)ccnc2cc1OCCCC(=O)NO

BDBM191641

COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3F)ccnc2cc1OCCCCCC(=O)NO

BDBM50285590

COc1cc2ccn(CCCCOc3cccc(NC(=O)CCCCCCC(=O)NO)c3)c2c(OC)c1OC

BDBM50285592

COc1cc2ccn(CCOc3ccc(NC(=O)CCCCCCC(=O)NO)cc3)c2cc1OC

BDBM50285591

COc1cc2ccn(CCOc3cccc(NC(=O)CCCCCCC(=O)NO)c3)c2c(OC)c1OC

BDBM50551537

COc1cc2nc3ccccc3c(Nc3ccc(cc3)C(=O)NO)c2c(OC)c1OC

BDBM50307768

COc1cc2ncnc(Nc3cccc(c3)C#C)c2cc1OCCCCCCC(=O)NO

BDBM50333091

COc1ccc(COC(CCCCCC(=O)NO)C(=O)Nc2ccccc2)cc1 |w:8.8|

BDBM50397360

COc1ccc(Cn2ccc3ccc(cc23)C(=O)NO)cc1

BDBM50463739

COc1ccc(Nc2c(NCCCCCC(=O)NO)c(=O)c2=O)cc1

BDBM50574023

COc1ccc(\C=C/c2cc(OC)c(OC)c(OC)c2)cc1\C=C\C(=O)Nc1ccccc1N

BDBM23269

COc1ccc(\C=C\C(=O)NO)cc1

BDBM119703

COc1ccc(cc1)-c1cc(-c2ccoc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO

BDBM119704

COc1ccc(cc1)-c1cc(-c2ccsc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO

BDBM50293361

COc1ccc(cc1)-c1ccc(\C=C\C(=O)NO)cc1

BDBM50293369

COc1ccc(cc1)-c1ccc(\C=C\C=C\C(=O)NO)cc1

BDBM50188891

COc1ccc(cc1)-c1nc(N2CCOCC2)c2nc(CN(C)c3ncc(cn3)C(=O)NO)n(C)c2n1

BDBM50348374

COc1ccc(cc1)C(=O)CSc1nc(C)cc(=O)[nH]1

BDBM50005732

COc1ccc(cc1C12CC3CC(CC(C3)C1)C2)-c1ccc(\C=C\C=C\C(=O)NO)cc1 |TLB:11:12:10.9.15:16,THB:11:10:12.17.13:16,13:12:9:15.14.16,13:14:11.12.17:9|

BDBM50579542

COc1ccc(cc1OC(C(C)C)C(=O)NO)N(C)c1nc(C)nc2ccccc12

BDBM50151375

COc1ccc(cc1OCCCC(=O)NO)N(C)c1nc(C)nc2ccccc12

BDBM50188897

COc1ccc(cn1)-c1nc(N2CCOCC2)c2nc(CN(C)c3ncc(cn3)C(=O)NO)n(C)c2n1

BDBM50188961

COc1ccc(cn1)-c1nc(N2CCOCC2)c2sc(CN(C)c3ncc(cn3)C(=O)NO)cc2n1

BDBM272135

COc1ccc(nc1)-c1nc2C[C@](Cc2s1)(C(=O)NO)c1cccc(F)c1C |r|

BDBM124205

COc1ccc(nc1)N(CCCCCCC(=O)NO)c1ccccn1

BDBM323706

COc1ccc2Sc3ccccc3N(CCCCCC(=O)NO)C(=O)c2c1

BDBM50517567

COc1ccc2Sc3ccccc3N(Cc3ccc(cc3)C(=O)NO)c2c1

BDBM50570672

COc1ccc2[S+]([O-])c3ccccc3N(Cc3ccc(cc3)C(=O)NO)c2c1

BDBM50581678

COc1ccc2[nH]cc(CCN(Cc3ccc(cc3)C(=O)NO)C(=O)\C=C\c3ccc(O)c(OC)c3)c2c1

BDBM323707

COc1ccc2c(c1)C(=O)N(CCCCCC(=O)NO)c1ccccc1S2(=O)=O

BDBM50259808

COc1ccc2c(cn(Cc3ccc(cc3)C(=O)NO)c2c1)C(=O)c1cc(OC)c(OC)c(OC)c1

BDBM50044648

COc1ccc2cc(ccc2n1)C(=O)NCCCCCCC(=O)NO

BDBM50285589

COc1ccc2n(CCOc3ccc(NC(=O)CCCCCCC(=O)NO)cc3)ccc2c1

BDBM50581675

COc1ccc2n(Cc3ccc(cc3)C(=O)NO)cc(CCNC(C)=O)c2c1

BDBM50551536

COc1ccc2nc3cc(Cl)ccc3c(Nc3ccc(cc3)C(=O)NO)c2n1

BDBM50297445

COc1cccc2c(c[nH]c12)C(CCCCCC(=O)NO)c1c[nH]c2c(OC)cccc12

BDBM50570667

CSc1ccc2Sc3ccccc3N(Cc3ccc(cc3)C(=O)NO)c2c1

BDBM50570673

CSc1ccc2[S+]([O-])c3ccccc3N(Cc3ccc(cc3)C(=O)NO)c2c1

BDBM50561967

CSc1ccccc1C(=O)NCCCC[C@H](NC(=O)c1cncs1)c1ncc([nH]1)-c1ccc2ccccc2c1 |r|

BDBM50014160

C[C@@H](NC(=O)c1cccc(=S)n1O)C(O)=O |r|

BDBM50525406

C[C@@H](\C=C(/C)\C=C\C(=O)NO)C(=O)c1ccc(cc1)N(C)C

BDBM197337

C[C@@H](\C=C\C(=O)NO)\C=C(/C)C(=O)c1ccc(cc1)N(C)C |r|

BDBM50530002

C[C@@H]1CN(CCO1)C(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(CCCCCCC(=O)NO)c2n1 |r|

BDBM162865

C[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(cc1)-c1noc(n1)C(F)(F)F |r|

BDBM50552915

C[C@H](CN1CCC[C@@H]1C)NC(=O)c1ccc(cc1)-c1noc(n1)C(F)(F)F |r|

BDBM50514463

C[C@H](NC(=O)c1nc(sc1C1CC1)-c1ncc(s1)-c1ccccc1)c1ccc(cc1)C(=O)NO |r|

BDBM50005711

C[C@H](\C=C(/C)\C=C\C(=O)NO)C(=O)c1ccc(cc1)N(C)C |r|

BDBM197336

C[C@H](\C=C\C(=O)NO)\C=C(/C)C(=O)c1ccc(cc1)N(C)C |r|

BDBM50570669

C\C(=N/O)c1ccc2Sc3ccccc3N(Cc3ccc(cc3)C(=O)NO)c2c1

BDBM50570675

C\C(=N/O)c1ccc2[S+]([O-])c3ccccc3N(Cc3ccc(cc3)C(=O)NO)c2c1

BDBM50268042

C\C(\C=C\c1ccccc1)=C/C(=O)NCCCCCC(=O)NO

BDBM50354086

C\C=C1/NC(=O)[C@@H](CS)NC(=O)[C@H](CC(=O)C[C@H](OC(=O)[C@@H](NC1=O)C(C)C)\C=C\CCS)C(C)C |r|

BDBM50123617

C\C=C1/NC(=O)[C@H](CS)NC(=O)[C@H](NC(=O)C[C@H](OC(=O)[C@@H](NC1=O)C(C)C)\C=C\CCS)C(C)C |r|

BDBM50123620

C\C=C1/NC(=O)c2csc(CNC(=O)C[C@H](OC(=O)[C@@H](NC1=O)C(C)C)\C=C\CCS)n2 |r|

BDBM50123634

C\C=C1/NC(=O)c2csc(CNC(=O)C[C@H](OC(=O)[C@@H](NC1=O)C(C)C)\C=C\CCSC(C)=O)n2 |r|

BDBM50123618

C\C=C1/NC(=O)c2csc(n2)[C@H](NC(=O)C[C@H](OC(=O)[C@@H](NC1=O)C(C)C)\C=C\CCS)C(C)C |r|

BDBM50354087

C\C=C1\NC(=O)[C@@H](CS)NC(=O)[C@H](NC(=O)C[C@H](OC(=O)[C@@H](NC1=O)C(C)C)\C=C\CCS)C(C)C |r|

BDBM29589

Cc1[nH]c2ccccc2c1CCNCc1ccc(\C=C\C(=O)NO)cc1

BDBM50161828

Cc1[nH]c2ccccc2c1\C=C\c1ccccc1-c1ccc(\C=C\C(=O)NO)cc1

BDBM272095

Cc1c(F)cccc1C1(CCc2c(C1)cnn2-c1ccccc1)C(=O)NO

BDBM418467

Cc1c(F)cccc1C1(CCc2c(C1)cnn2CC(F)(F)F)C(=O)NO

BDBM418468

Cc1c(F)cccc1C1(CCc2c(C1)cnn2Cc1ccc(F)cc1)C(=O)NO

BDBM272148

Cc1c(F)cccc1C1(CCc2cn(CC(F)(F)F)nc2CC1)C(=O)NO

BDBM272147

Cc1c(F)cccc1C1(CCc2cnc(nc2CC1)C1CC1)C(=O)NO

BDBM272105

Cc1c(F)cccc1C1(CCc2nc(NS(=O)(=O)c3ccccc3)sc2C1)C(=O)NO

BDBM272104

Cc1c(F)cccc1C1(CCc2nc([nH]c(=O)c2C1)C1CC1)C(=O)NO

BDBM418479

Cc1c(F)cccc1C1(CCc2nc(cnc2C1)-c1ccccc1)C(=O)NO

BDBM418478

Cc1c(F)cccc1C1(CCc2nc(cnc2C1)C1CC1)C(=O)NO

BDBM272111

Cc1c(F)cccc1C1(CCc2nc(ncc2C1)-c1ccccc1)C(=O)NO

BDBM272110

Cc1c(F)cccc1C1(CCc2nc(ncc2C1)C1CC1)C(=O)NO

BDBM272107

Cc1c(F)cccc1C1(CCc2nc(sc2C1)-c1cncnc1)C(=O)NO

BDBM272106

Cc1c(F)cccc1C1(CCc2nc(sc2C1)C1CC1)C(=O)NO

BDBM272109

Cc1c(F)cccc1C1(CCc2ncncc2C1)C(=O)NO

BDBM272108

Cc1c(F)cccc1C1(CCc2ncsc2C1)C(=O)NO

BDBM272103

Cc1c(F)cccc1C1(CCc2nn(CC(F)(F)F)c(C3CC3)c2C1)C(=O)NO

BDBM272099

Cc1c(F)cccc1C1(CCc2nn(CC(F)(F)F)cc2C1)C(=O)NO

BDBM272100

Cc1c(F)cccc1C1(CCc2nn(Cc3ccc(F)cc3)cc2C1)C(=O)NO

BDBM272097

Cc1c(F)cccc1C1(CCc2nn(cc2C1)-c1ccccc1F)C(=O)NO

BDBM272146

Cc1c(F)cccc1C1(Cc2ccccc2C1)C(=O)NO

BDBM272127

Cc1c(F)cccc1C1(Cc2nc(Cc3cccc(c3)C(F)(F)F)sc2C1)C(=O)NO

BDBM272128

Cc1c(F)cccc1C1(Cc2nc(sc2C1)-c1cccc(F)c1)C(=O)NO

BDBM272125

Cc1c(F)cccc1C1(Cc2nc(sc2C1)-c1ccccc1F)C(=O)NO

BDBM272118

Cc1c(F)cccc1[C@@]1(CCc2c1cnn2-c1ccccc1)C(=O)NO |r|

BDBM272123

Cc1c(F)cccc1[C@@]1(CCc2c1cnn2C1CC1)C(=O)NO |r|

BDBM272158

Cc1c(F)cccc1[C@@]1(CCc2c1cnn2Cc1ccccc1)C(=O)NO |r|

BDBM272113

Cc1c(F)cccc1[C@@]1(CCc2nc(ncc12)-c1ccccc1Cl)C(=O)NO |r|

BDBM272142

Cc1c(F)cccc1[C@@]1(CCc2nc(sc12)-c1ccc(F)cc1)C(=O)NO |r|

BDBM272136

Cc1c(F)cccc1[C@@]1(CCc2nc(sc12)C1CC1)C(=O)NO |r|

BDBM272159

Cc1c(F)cccc1[C@@]1(CCc2nn(Cc3ccccc3)cc12)C(=O)NO |r|

BDBM272160

Cc1c(F)cccc1[C@@]1(CCc2nn(Cc3ccccc3F)cc12)C(=O)NO |r|

BDBM272085

Cc1c(F)cccc1[C@@]1(Cc2cn(nc2C1)-c1ccc(OC(F)F)cc1)C(=O)NO |r|

BDBM272092

Cc1c(F)cccc1[C@@]1(Cc2cn(nc2C1)-c1ncccc1Cl)C(=O)NO |r|

BDBM272093

Cc1c(F)cccc1[C@@]1(Cc2cn(nc2C1)-c1ncccc1F)C(=O)NO |r|

BDBM272119

Cc1c(F)cccc1[C@@]1(Cc2cnc(nc2C1)-c1ccc(F)cc1)C(=O)NO |r|

BDBM272112

Cc1c(F)cccc1[C@@]1(Cc2cnc(nc2C1)-c1ccccc1Cl)C(=O)NO |r|

BDBM272124

Cc1c(F)cccc1[C@@]1(Cc2cnc(nc2C1)-c1cccnc1)C(=O)NO |r|

BDBM272120

Cc1c(F)cccc1[C@@]1(Cc2cnc(nc2C1)C(F)(F)F)C(=O)NO |r|

BDBM272116

Cc1c(F)cccc1[C@@]1(Cc2cnc(nc2C1)C1CC1)C(=O)NO |r|

BDBM272122

Cc1c(F)cccc1[C@@]1(Cc2cnn(C3CC3)c2C1)C(=O)NO |r|

BDBM272082

Cc1c(F)cccc1[C@@]1(Cc2cnn(C3CCCC3)c2C1)C(=O)NO |r|

BDBM272157

Cc1c(F)cccc1[C@@]1(Cc2cnn(Cc3ccccc3)c2C1)C(=O)NO |r|

BDBM272078

Cc1c(F)cccc1[C@@]1(Cc2cnn(c2C1)-c1c(F)cccc1Cl)C(=O)NO |r,wD:8.8,(-.17,-3.49,;1.37,-3.49,;2.14,-4.83,;1.37,-6.16,;3.68,-4.83,;4.45,-3.49,;3.68,-2.16,;2.14,-2.16,;1.37,-.83,;.12,-1.73,;-1.13,-.83,;-2.67,-.83,;-3.14,.64,;-1.9,1.54,;-.65,.64,;.89,.64,;-1.9,3.08,;-.56,3.85,;.77,3.08,;-.56,5.39,;-1.9,6.16,;-3.23,5.39,;-3.23,3.85,;-4.56,3.08,;2.77,-.2,;4.02,-1.11,;2.93,1.33,;4.56,2.27,)|

BDBM272075

Cc1c(F)cccc1[C@@]1(Cc2cnn(c2C1)-c1c(F)cccc1F)C(=O)NO |r,wU:8.27,(-1.7,-2.72,;-.37,-3.49,;-.37,-5.03,;-1.7,-5.8,;.96,-5.8,;2.3,-5.03,;2.3,-3.49,;.96,-2.72,;.96,-1.18,;-.28,-2.09,;-1.53,-1.18,;-3.07,-1.18,;-3.54,.28,;-2.3,1.18,;-1.05,.28,;.49,.28,;-2.3,2.72,;-3.63,3.49,;-4.97,2.72,;-3.63,5.03,;-2.3,5.8,;-.96,5.03,;-.96,3.49,;.37,2.72,;2.3,-.41,;2.3,1.13,;3.63,-1.18,;4.97,-.41,)|

BDBM272072

Cc1c(F)cccc1[C@@]1(Cc2cnn(c2C1)-c1ccc(Cl)cc1)C(=O)NO |r|

BDBM272069

Cc1c(F)cccc1[C@@]1(Cc2cnn(c2C1)-c1ccc(F)cc1)C(=O)NO |r|

BDBM272155

Cc1c(F)cccc1[C@@]1(Cc2cnn(c2C1)-c1ccc(F)cc1Cl)C(=O)NO |r|

BDBM272081

Cc1c(F)cccc1[C@@]1(Cc2cnn(c2C1)-c1ccc(F)cc1F)C(=O)NO |r|

BDBM272080

Cc1c(F)cccc1[C@@]1(Cc2cnn(c2C1)-c1ccc(F)cn1)C(=O)NO |r|

BDBM272084

Cc1c(F)cccc1[C@@]1(Cc2cnn(c2C1)-c1ccc(OC(F)F)cc1)C(=O)NO |r|

BDBM272068

Cc1c(F)cccc1[C@@]1(Cc2cnn(c2C1)-c1cccc(Cl)c1)C(=O)NO |r|

BDBM272074

Cc1c(F)cccc1[C@@]1(Cc2cnn(c2C1)-c1cccc(Cl)c1F)C(=O)NO |r|

BDBM272070

Cc1c(F)cccc1[C@@]1(Cc2cnn(c2C1)-c1cccc(F)c1)C(=O)NO |r|

BDBM272065

Cc1c(F)cccc1[C@@]1(Cc2cnn(c2C1)-c1ccccc1)C(=O)NO |r|

BDBM272071

Cc1c(F)cccc1[C@@]1(Cc2cnn(c2C1)-c1ccccc1Cl)C(=O)NO |r|

BDBM272067

Cc1c(F)cccc1[C@@]1(Cc2cnn(c2C1)-c1ccccc1F)C(=O)NO |r|

BDBM272083

Cc1c(F)cccc1[C@@]1(Cc2cnn(c2C1)-c1cnccn1)C(=O)NO |r|

BDBM272131

Cc1c(F)cccc1[C@@]1(Cc2nc(sc2C1)-c1ccc(F)cc1)C(=O)NO |r|

BDBM272132

Cc1c(F)cccc1[C@@]1(Cc2nc(sc2C1)-c1ccnn1C)C(=O)NO |r|

BDBM272143

Cc1c(F)cccc1[C@@]1(Cc2nn(C)c(c2C1)-c1ccc(F)cc1)C(=O)NO |r|

BDBM272144

Cc1c(F)cccc1[C@@]1(Cc2snc(c2C1)-c1ccccc1)C(=O)NO |r|

BDBM272115

Cc1c(F)cccc1[C@]1(CCc2nc(ccc12)C1CC1)C(=O)NO |r|

BDBM272121

Cc1c(F)cccc1[C@]1(CCc2nc(ncc12)C1CC1)C(=O)NO |r|

BDBM272114

Cc1c(F)cccc1[C@]1(Cc2cnc(nc2C1)C1CC1)C(=O)NO |r|

BDBM272094

Cc1c(F)cccc1[C@]1(Cc2cnn(c2C1)-c1ccccc1)C(=O)NO |r|

BDBM272130

Cc1c(F)cccc1[C@]1(Cc2nc(sc2C1)-c1ccc(F)cc1)C(=O)NO |r|

BDBM272154

Cc1c(F)cccc1[C@]1(Cc2nc(sc2C1)-c1ccc(F)cn1)C(=O)NO |r|

BDBM272133

Cc1c(F)cccc1[C@]1(Cc2nc(sc2C1)-c1ccnn1C)C(=O)NO |r|

BDBM272145

Cc1c(F)cccc1[C@]1(Cc2snc(c2C1)-c1ccccc1)C(=O)NO |r|

BDBM272140

Cc1c(cnn1C)-c1nc2CC(Cc2s1)(C(=O)NO)c1cccc(F)c1C

BDBM218226

Cc1cc(-c2ccc(cc2)C(=O)NO)c2ccccc12

BDBM272134

Cc1cc(-c2nc3C[C@](Cc3s2)(C(=O)NO)c2cccc(F)c2C)n(C)n1 |r|

BDBM50348383

Cc1cc(=O)[nH]c(SCC(=O)C(C)(C)C)n1

BDBM50348387

Cc1cc(=O)[nH]c(SCC(=O)NCCCCCCc2ccccc2)n1

BDBM50348385

Cc1cc(=O)[nH]c(SCC(=O)NCCCCc2ccccc2)n1

BDBM96613

Cc1cc(=O)[nH]c(SCC(=O)NCCc2ccccc2)n1

BDBM50348376

Cc1cc(=O)[nH]c(SCC(=O)c2ccc(Cl)cc2)n1

BDBM50348373

Cc1cc(=O)[nH]c(SCC(=O)c2ccc(NC(=O)c3ccccc3)cc2)n1

BDBM55151

Cc1cc(=O)[nH]c(SCC(=O)c2ccc(O)c(O)c2)n1

BDBM50348377

Cc1cc(=O)[nH]c(SCC(=O)c2ccc(O)cc2)n1

BDBM50348375

Cc1cc(=O)[nH]c(SCC(=O)c2ccc(cc2)C(C)(C)C)n1

BDBM50348379

Cc1cc(=O)[nH]c(SCC(=O)c2ccc3CC(=O)Nc3c2)n1

BDBM50348378

Cc1cc(=O)[nH]c(SCC(=O)c2ccc3OCCOc3c2)n1

BDBM50348397

Cc1cc(=O)[nH]c(SCC(=O)c2ccccc2)n1

BDBM50348380

Cc1cc(=O)[nH]c(SCC(=O)c2cccs2)n1

BDBM272156

Cc1cc(C)nc(n1)-n1cc2C[C@@](Cc2n1)(C(=O)NO)c1cccc(F)c1C |r|

BDBM272138

Cc1cc(F)ccc1-c1nc2CC(Cc2s1)(C(=O)NO)c1cccc(F)c1C

BDBM272087

Cc1cc(F)ccc1-n1cc2C[C@@](Cc2n1)(C(=O)NO)c1cccc(F)c1C |r|

BDBM272086

Cc1cc(F)ccc1-n1ncc2C[C@@](Cc12)(C(=O)NO)c1cccc(F)c1C |r|

BDBM425853

Cc1cc(O)cc(C)c1-c1nc2ccc(cc2[nH]1)C(=O)NO

BDBM218225

Cc1cc2ccccc2c1-c1ccc(cc1)C(=O)NO

BDBM218161

Cc1cc2ccccc2n1Cc1ccc(cc1)C(=O)NO

BDBM272076

Cc1ccc(C)c(c1)-n1ncc2C[C@@](Cc12)(C(=O)NO)c1cccc(F)c1C |r|

BDBM50502571

Cc1ccc(CN2C(CCC(=O)Nc3ccc(cc3)C(=O)NO)C(=O)N(C2=O)c2ccc(Cl)cc2)cc1

BDBM207628

Cc1ccc(NC(=O)CCCCCC(=O)Nc2ccccc2N)cc1

BDBM50570678

Cc1ccc(NC(=O)c2ccc3Sc4ccccc4N(Cc4ccc(cc4)C(=O)NO)c3c2)nc1

BDBM50020164

Cc1ccc(cc1)-c1csc(NC(=O)CCCCCCS)n1

BDBM272073

Cc1ccc(cc1)-n1ncc2C[C@@](Cc12)(C(=O)NO)c1cccc(F)c1C |r|

BDBM50020162

Cc1ccc(cc1F)-c1csc(NC(=O)CCCCCCS)n1

BDBM124203

Cc1ccc(nc1)N(CCCCCCC(=O)NO)c1ccccn1

BDBM272077

Cc1cccc(C)c1-n1ncc2C[C@@](Cc12)(C(=O)NO)c1cccc(F)c1C |r,wD:13.22,(-4.97,2.72,;-3.63,3.49,;-3.63,5.03,;-2.3,5.8,;-.96,5.03,;-.96,3.49,;.37,2.72,;-2.3,2.72,;-2.3,1.18,;-3.54,.28,;-3.07,-1.18,;-1.53,-1.18,;-.28,-2.09,;.96,-1.18,;.49,.28,;-1.05,.28,;2.3,-.41,;2.3,1.13,;3.63,-1.18,;4.97,-.41,;.96,-2.72,;2.3,-3.49,;2.3,-5.03,;.96,-5.8,;-.37,-5.03,;-1.7,-5.8,;-.37,-3.49,;-1.7,-2.72,)|

BDBM272079

Cc1cccc(F)c1-n1ncc2C[C@@](Cc12)(C(=O)NO)c1cccc(F)c1C |r,wD:13.22,(-4.97,2.72,;-3.63,3.49,;-3.63,5.03,;-2.3,5.8,;-.96,5.03,;-.96,3.49,;.37,2.72,;-2.3,2.72,;-2.3,1.18,;-3.54,.28,;-3.07,-1.18,;-1.53,-1.18,;-.28,-2.09,;.96,-1.18,;.49,.28,;-1.05,.28,;2.3,-.41,;2.3,1.13,;3.63,-1.18,;4.97,-.41,;.96,-2.72,;2.3,-3.49,;2.3,-5.03,;.96,-5.8,;-.37,-5.03,;-1.7,-5.8,;-.37,-3.49,;-1.7,-2.72,)|

BDBM272089

Cc1cccc(c1)-n1cc2C[C@@](Cc2n1)(C(=O)NO)c1cccc(F)c1C |r|

BDBM272088

Cc1cccc(c1)-n1ncc2C[C@@](Cc12)(C(=O)NO)c1cccc(F)c1C |r|

BDBM272137

Cc1ccccc1-c1nc2CC[C@](C(=O)NO)(c2s1)c1cccc(F)c1C |r|

BDBM272101

Cc1ccccc1-n1ncc2CC(CCc12)(C(=O)NO)c1cccc(F)c1C

BDBM272066

Cc1ccccc1-n1ncc2C[C@@](Cc12)(C(=O)NO)c1cccc(F)c1C |r|

BDBM218163

Cc1cn(Cc2ccc(cc2)C(=O)NO)c2ccccc12

BDBM272091

Cc1cnccc1-n1cc2C[C@@](Cc2n1)(C(=O)NO)c1cccc(F)c1C |r|

BDBM272090

Cc1cnccc1-n1ncc2C[C@@](Cc12)(C(=O)NO)c1cccc(F)c1C |r|

BDBM50252391

Cc1nc2ccccc2n1Cc1ccc(cc1F)C(=O)NO

BDBM50503692

Cc1ncc(cn1)-c1ccc(cc1)C(C(=O)NO)c1ccccc1F

BDBM50595707

Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)COCCOCCOCC(F)(F)c2cnc(nc2)-c2ccc(cc2)C(C(=O)NO)c2ccccc2F)C(C)(C)C)cc1 |r|

BDBM50595708

Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)COCCOCCOCCOCC(F)(F)c2cnc(nc2)-c2ccc(cc2)C(C(=O)NO)c2ccccc2F)C(C)(C)C)cc1 |r|

BDBM50595709

Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)COCCOCCOCCOCCOCC(F)(F)c2cnc(nc2)-c2ccc(cc2)C(C(=O)NO)c2ccccc2F)C(C)(C)C)cc1 |r|

BDBM50565587

Cl.CN(C)CCOc1ccc(cc1)-c1cc(=O)c2c(O)cc(OCCCCCC(=O)NO)cc2o1

BDBM50353227

Cl.Cl.CCCCc1nc2cc(\C=C\C(=O)NO)ccc2n1CCN(CC)CC

BDBM618078

Cn1c(N)nc2cc(ccc12)-c1cn(Cc2ccc(cc2)-c2nnc(o2)C(F)F)nn1

BDBM618066

Cn1c(N)nc2cc(ccc12)-c1cn(Cc2ccc(cn2)-c2nnc(o2)C(F)F)nn1

BDBM618054

Cn1c(N)nc2cc(ccc12)-c1nnn(Cc2ccc(cc2)-c2nnc(o2)C(F)F)n1

BDBM50044646

Cn1c2ccc(cc2ccc1=O)C(=O)NCCCCCCC(=O)NO

BDBM323704

Cn1cc(CCNCc2ccc(\C=C\C(=O)NO)cc2)c2ccccc12

BDBM50105327

Cn1cc(CNCC2CCN(CC2)c2ncc(cn2)C(=O)NO)c2ccccc12

BDBM50470579

Cn1cc(cn1)-c1ccc(cc1)S(=O)(=O)n1ccc(\C=C\C(=O)Nc2ccccc2N)c1

BDBM50568248

FC(F)(F)c1nc(no1)-c1ccc(cc1)C(=O)NC1CCN(Cc2ccccc2)C1

BDBM50552919

FC(F)(F)c1nc(no1)-c1ccc(cc1)C(=O)NCCN1CCCC1

BDBM50446481

FC(F)(F)c1nc(no1)-c1cccc(c1)C(=O)NCC1(CCOCC1)c1nc(cs1)-c1ccccc1

BDBM618052

FC(F)c1nnc(o1)-c1ccc(Cn2cc(nn2)-c2ccc(NC3=NCCN3)cc2)cc1 |t:25|

BDBM618070

FC(F)c1nnc(o1)-c1ccc(Cn2cc(nn2)-c2ccc3NC(=O)C4(CCNCC4)c3c2)nc1

BDBM618050

FC(F)c1nnc(o1)-c1ccc(Cn2cc(nn2)-c2ccc3nc(Cl)[nH]c3c2)nc1

BDBM618064

FC(F)c1nnc(o1)-c1ccc(Cn2cc(nn2)-c2cccc(NC(=O)N3CCOCC3)c2)cc1F

BDBM618044

FC(F)c1nnc(o1)-c1ccc(Cn2cc(nn2)-c2cccc(NC(=O)N3CCOCC3)c2)nc1

BDBM618076

FC(F)c1nnc(o1)-c1ccc(Cn2cnc(c2)-c2ccc(NC3=NCCN3)cc2)cc1 |t:25|

BDBM618072

FC(F)c1nnc(o1)-c1ccc(Cn2cnc(c2)-c2ccc(NC3=NCCN3)cc2)nc1 |t:25|

BDBM617985

FC(F)c1nnc(o1)-c1ccc(Cn2nnc(n2)-c2ccc3CNC(=O)c3c2)nc1

BDBM50020163

Fc1ccc(cc1)-c1csc(NC(=O)CCCCCCS)n1

BDBM50020161

Fc1cccc(c1)-c1csc(NC(=O)CCCCCCS)n1

BDBM50571528

NC(=O)c1ccc2N(Cc3ccc(cc3)C(=O)NO)CCCc2c1

BDBM50570676

NC(=O)c1ccc2Sc3ccccc3N(Cc3ccc(\C=C\C(=O)NO)cc3)c2c1

BDBM50570668

NC(=O)c1ccc2Sc3ccccc3N(Cc3ccc(cc3)C(=O)NO)c2c1

BDBM50570674

NC(=O)c1ccc2[S+]([O-])c3ccccc3N(Cc3ccc(cc3)C(=O)NO)c2c1

BDBM50392111

NC(=O)c1ccccc1Nc1cccc(OCCc2ccccc2)c1

BDBM50560908

NCc1ccc(NC(=O)N(CCCCO)Cc2ccc(cc2)C(=O)NO)cc1

BDBM50457079

Nc1cc(F)ccc1NC(=O)c1ccc(CNC(=O)\C=C\c2cccnc2)cc1

BDBM50276074

Nc1ccc(cc1NC(=O)c1ccc(nc1)N1CCC2(CNC2=O)CC1)-c1cccs1

BDBM182757

Nc1ccc(cc1NC(=O)c1ccc2nc(ccc2c1)N1CCNCC1)-c1cccs1

BDBM618062

Nc1ccc(cn1)-c1cn(Cc2ccc(-c3nnc(o3)C(F)F)c(F)c2)nn1

BDBM618074

Nc1ccc(cn1)-c1cn(Cc2ccc(-c3nnc(o3)C(F)F)c(F)c2F)nn1

BDBM618056

Nc1ccc(cn1)-c1cn(Cc2ccc(cn2)-c2nnc(o2)C(F)F)cn1

BDBM617987

Nc1ccc(cn1)-c1cn(Cc2ccc(cn2)-c2nnc(o2)C(F)F)nn1

BDBM618058

Nc1ccc(cn1)-c1cnn(Cc2ccc(cn2)-c2nnc(o2)C(F)F)c1

BDBM50555460

Nc1ccc(cn1)-c1nc(N2CCOCC2)c2ncn(CCCCCCC(=O)NO)c2n1

BDBM50297448

Nc1ccccc1NC(=O)CCCCCC(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12

BDBM50222414

Nc1ccccc1NC(=O)CCCCCCC(=O)Nc1ccccc1

BDBM50580276

Nc1ccccc1NC(=O)c1ccc(CCn2ncc3c2nc(N)n2nc(nc32)-c2ccco2)cc1

BDBM19410

Nc1ccccc1NC(=O)c1ccc(CNC(=O)OCc2cccnc2)cc1

BDBM119709

Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1

BDBM50113971

Nc1ccccc1NC(=O)c1ccc(CNC2=N[C@@H]([C@@H](O2)c2ccccc2)c2ccccc2)cc1 |r,t:17|

BDBM50564441

Nc1ccccc1NC(=O)c1ccc(Cn2cnc3c(Nc4ccc(F)c(Cl)c4)nc(N)nc23)cc1

BDBM618048

Nc1nc2cc(ccc2[nH]1)-c1cn(Cc2ccc(cc2)-c2nnc(o2)C(F)F)nn1

BDBM618046

Nc1nc2cc(ccc2o1)-c1nnn(Cc2ccc(cn2)-c2nnc(o2)C(F)F)n1

BDBM617942

Nc1nc2cc(ccc2s1)-c1cn(Cc2ccc(cn2)-c2nnc(o2)C(F)F)nn1

BDBM618060

Nc1nc2ccc(cc2s1)-c1cn(Cc2ccc(cc2)-c2nnc(o2)C(F)F)nn1

BDBM617829

Nc1nc2ccc(cc2s1)-c1cn(Cc2ccc(cn2)-c2nnc(o2)C(F)F)nn1

BDBM50555464

Nc1ncc(cn1)-c1nc(N2CCOCC2)c2ccn(CCCCCCC(=O)NO)c2n1

BDBM50437405

Nc1ncnc2n(nc(-c3ccc(Cl)cc3)c12)-c1cccc(c1)-c1cnnn1CCCCCC(=O)NO

BDBM50544391

O=C(NC(c1ccccc1)c1ccccc1)c1cc(nc2ccccc12)-c1cc2ccccc2o1

BDBM34233

O=c1n([se]c2ccccc12)-c1ccccc1

BDBM50511825

OC(=O)C(F)(F)F.CCCNNC(=O)\C=C\c1ccc(CNCCc2c(C)[nH]c3ccccc23)cc1

BDBM50579533

OC(=O)CCCO\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2ccccc12

BDBM50014161

OC(=O)[C@H](NC(=O)c1cccc(=S)n1O)c1ccccc1 |r|

BDBM50119287

OC(=O)c1cccc(=S)n1O

BDBM50304783

OCC(\C=C\c1ccc(F)cc1)N1CCN(CC1)c1ncc(cn1)C(=O)NO

BDBM50279258

OCCCCN(Cc1ccc(cc1)C(=O)NO)C(=O)Nc1ccccc1

BDBM198121

OCCN(C(=O)Cc1ccc(cc1)C(=O)NO)c1ccccc1

BDBM50587717

OCCN(C(=O)Cc1ccccc1)C(=O)Cc1ccc(cc1)C(=O)NO

BDBM19428

OCCN(CCc1c[nH]c2ccccc12)Cc1ccc(\C=C\C(=O)NO)cc1

BDBM50252388

OCCN(Cc1ccc(cc1)C(=O)NO)C(=O)Cc1ccccc1

BDBM22449

OCc1ccc(cc1)[C@@H]1C[C@H](CSc2nc(c(o2)-c2ccccc2)-c2ccccc2)O[C@@H](O1)c1ccc(NC(=O)CCCCCCC(=O)NO)cc1 |r|

BDBM50555461

OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(CCCCCCC(=O)NO)c2n1

BDBM50568243

ONC(=N)c1ccc2nc([nH]c2c1)-c1cccc(c1)-c1cn2ccccc2n1

BDBM50503690

ONC(=O)C(c1ccc(cc1)-c1ncc(cn1)C(F)(F)F)c1ccccc1F

BDBM50207561

ONC(=O)C(c1ccccc1)c1ccccc1

BDBM272150

ONC(=O)C1(CCc2cn(CC(F)(F)F)nc2CC1)c1ccccc1

BDBM272153

ONC(=O)C1(Cc2ccccc2C1)c1ccccc1

BDBM50429525

ONC(=O)C1=CCCC1 |t:4|

BDBM50446482

ONC(=O)C1c2ccccc2-c2ccccc12

BDBM50494414

ONC(=O)CCCC(=O)NCCc1ccccc1

BDBM337661

ONC(=O)CCCCCC(=O)Nc1ccccc1

BDBM50297446

ONC(=O)CCCCCC(c1c[nH]c2ccc(cc12)[N+]([O-])=O)c1c[nH]c2ccc(cc12)[N+]([O-])=O

BDBM50297444

ONC(=O)CCCCCC(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12

BDBM50333086

ONC(=O)CCCCCC1OCCCCCCCOc2ccccc2NC1=O

BDBM50333085

ONC(=O)CCCCCC1OCCCCCCOc2ccccc2NC1=O

BDBM50333092

ONC(=O)CCCCCC1OCCCCCOc2ccccc2NC1=O

BDBM50587716

ONC(=O)CCCCCCC(=O)N\N=C\c1cnc(nc1)N(c1ccccc1)c1ccccc1

BDBM50044641

ONC(=O)CCCCCCC(=O)Nc1ccc2NC(=O)CCc2c1

BDBM50044640

ONC(=O)CCCCCCC(=O)Nc1ccc2[nH]c(=O)ccc2c1

BDBM19149

ONC(=O)CCCCCCC(=O)Nc1ccccc1

BDBM50265845

ONC(=O)CCCCCCC(=O)Nc1ccccc1CN1CC[C@H](O)C1 |r|

BDBM50356635

ONC(=O)CCCCCCC(=O)Nc1cnn(Cc2cc(CN=[N+]=[N-])cc(c2)N=[N+]=[N-])c1

BDBM124207

ONC(=O)CCCCCCN(c1ccccn1)c1cc(OCc2ccccc2)ccn1

BDBM124206

ONC(=O)CCCCCCN(c1ccccn1)c1cc2ccccc2cn1

BDBM124200

ONC(=O)CCCCCCN(c1ccccn1)c1ccc2ccccc2n1

BDBM50356634

ONC(=O)CCCCCCNC(=O)c1cc(on1)-c1ccc(NC(=O)c2cc(CN=[N+]=[N-])cc(c2)N=[N+]=[N-])cc1

BDBM50044644

ONC(=O)CCCCCCNC(=O)c1ccc2NC(=O)CCc2c1

BDBM50044643

ONC(=O)CCCCCCNC(=O)c1ccc2[nH]c(=O)ccc2c1

BDBM50439674

ONC(=O)CCCCCCNC(=O)c1cnc(nc1)N(c1ccccc1)c1ccccc1

BDBM110036

ONC(=O)CCCCCCNC(=O)c1cnc(nc1)N(c1ccccc1)c1ccccc1Cl

BDBM50507258

ONC(=O)CCCCCN1C(=O)c2cccc3c(NCc4ccccc4)ccc(C1=O)c23

BDBM50328678

ONC(=O)CCCCCN1C(=O)c2cccc3cccc(C1=O)c23

BDBM50319209

ONC(=O)CCCCCNC(=O)NC(=O)c1ccc(Br)cc1

BDBM50319235

ONC(=O)CCCCCNC(=O)NC(=O)c1ccccc1

BDBM50268121

ONC(=O)CCCCCNC(=O)\C=C\c1ccc(Cl)cc1F

BDBM50268063

ONC(=O)CCCCCNC(=O)\C=C\c1ccc2cccnc2c1

BDBM50087845

ONC(=O)CCCCSc1nc(cc(=O)[nH]1)-c1ccc(cc1)-c1ccccc1

BDBM50026429

ONC(=O)CCCCc1ccn(Cc2ccc(Nc3ccccc3)cc2)n1

BDBM50026431

ONC(=O)CCCCc1ccn(Cc2ccc(cc2)-c2ccccc2)n1

BDBM50026450

ONC(=O)CCCCc1ccn(Cc2cccc(c2)-c2ccccc2)n1

BDBM50026430

ONC(=O)CCCCc1ccn(n1)-c1ccccc1

BDBM50579532

ONC(=O)CCCO\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2ccccc12

BDBM50587186

ONC(=O)CCCSC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cccc2ccccc12 |r|

BDBM50587185

ONC(=O)CCCSC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1 |r|

BDBM50587184

ONC(=O)CCCSC[C@H](NC(=O)c1ccccc1)C(=O)Nc1ccccc1 |r|

BDBM50015142

ONC(=O)CCCc1ccccc1

BDBM50462732

ONC(=O)CCc1ccc(Nc2c3ccccc3nc3ccccc23)cc1

BDBM50551541

ONC(=O)Cc1ccc(Nc2c3ccccc3nc3ccccc23)cc1

BDBM272151

ONC(=O)[C@@]1(CCc2ccccc12)c1ccccc1 |r|

BDBM50534338

ONC(=O)[C@H](Cc1ccccc1)n1nnc(c1C#CC1CC1)-c1ccccc1 |r|

BDBM50534339

ONC(=O)[C@H](Cc1ccccc1)n1nnc(c1C#Cc1ccccc1)-c1ccccc1 |r|

BDBM272152

ONC(=O)[C@]1(CCc2ccccc12)c1ccccc1 |r|

BDBM323716

ONC(=O)\C=C\c1ccc(CN(CCF)CC23CC4CC(CC(C4)C2)C3)cc1 |TLB:19:20:24:18.23.17,23:18:25:24.22.21,23:22:25:18.19.17,THB:19:18:24:25.20.21|

BDBM323717

ONC(=O)\C=C\c1ccc(CNCC23CC4CC(CC(C4)C2)C3)c(F)c1 |TLB:16:17:21:15.20.14,20:15:22:21.19.18,20:19:22:15.16.14,THB:16:15:21:22.17.18|

BDBM323708

ONC(=O)\C=C\c1ccc(CNCC23CC4CC(CC(C4)C2)C3)cc1 |TLB:16:17:21:15.20.14,20:15:22:21.19.18,20:19:22:15.16.14,THB:16:15:21:22.17.18|

BDBM323712

ONC(=O)\C=C\c1ccc(CNCC2CCCCC2)cc1

BDBM50592855

ONC(=O)\C=C\c1ccc(CNc2ccc3nc4CCCCCn4c(=O)c3c2)cc1

BDBM50087841

ONC(=O)\C=C\c1ccc(NC(=O)C(Cc2ccccc2)c2ccccc2)cn1

BDBM50143215

ONC(=O)\C=C\c1ccc(\C=C(\CNC2CC2)c2ccc(F)cc2)cc1

BDBM50278222

ONC(=O)\C=C\c1ccc(\C=N\OCCN2CCOCC2)cc1

BDBM50278219

ONC(=O)\C=C\c1ccc(\C=N\OCc2c(F)c(F)c(F)c(F)c2F)cc1

BDBM50278220

ONC(=O)\C=C\c1ccc(\C=N\OCc2ccc(cc2)[N+]([O-])=O)cc1

BDBM50005730

ONC(=O)\C=C\c1ccc(c(Cl)c1)-c1ccc(CC#N)c(c1)C12CC3CC(CC(C3)C1)C2 |TLB:25:26:24.23.29:30,THB:25:24:26.31.27:30,27:26:23:29.28.30,27:28:25.26.31:23|

BDBM50278344

ONC(=O)\C=C\c1ccc(cc1)-c1cc(CN2CCOCC2)on1

BDBM50005744

ONC(=O)\C=C\c1ccc(cc1)-c1ccc(O)c(c1)C12CC3CC(CC(C3)C1)C2 |TLB:22:23:21.20.26:27,THB:22:21:23.28.24:27,24:23:20:26.25.27,24:25:22.23.28:20|

BDBM50293358

ONC(=O)\C=C\c1ccc(cc1)-c1ccc(O)cc1

BDBM50140176

ONC(=O)\C=C\c1ccc(cc1)C(F)(F)F

BDBM50297447

ONC(=O)\C=C\c1ccc(cc1)C(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12

BDBM50531608

ONC(=O)\C=C\c1ccc2C(=O)c3ccccc3C(=O)c2c1

BDBM50248476

ONC(=O)\C=C\c1ccc2n(CCN3CCCC3)c(CCc3ccccc3)nc2c1

BDBM50248522

ONC(=O)\C=C\c1ccc2n(CCN3CCCCC3)c(CCc3ccccc3)nc2c1

BDBM323710

ONC(=O)\C=C\c1cccc(CNC23CC4CC(CC(C4)C2)C3)c1 |TLB:16:17:21:15.20.14,20:15:22:21.19.18,20:19:22:15.16.14,THB:16:15:21:22.17.18|

BDBM25150

ONC(=O)\C=C\c1cccc(c1)S(=O)(=O)Nc1ccccc1

BDBM50015233

ONC(=O)\C=C\c1cccc(c1)S(=O)(=O)n1ccc2cccnc12

BDBM50015088

ONC(=O)\C=C\c1ccccc1

BDBM50531329

ONC(=O)\C=C\c1cccn(CCCc2ccc3ccccc3c2)c1=O

BDBM50513916

ONC(=O)c1cc(CCNC(=O)c2ccc(Cl)c(Cl)c2)on1

BDBM50531051

ONC(=O)c1cc(F)c(Cn2nnc(n2)-c2ncccn2)c(F)c1

BDBM50573491

ONC(=O)c1cc(F)c(Cn2nnnc2-c2cccs2)c(F)c1

BDBM50559388

ONC(=O)c1ccc(CCCN2CCC(CN[C@H]3C[C@@H]3c3ccccc3)CC2)cc1 |r|

BDBM50283687

ONC(=O)c1ccc(CCN2C(=O)c3cccc4c(ccc(C2=O)c34)N2CCOCC2)cc1

BDBM50595960

ONC(=O)c1ccc(CN(C2CC2)S(=O)(=O)c2cc(F)c(F)c(F)c2F)cc1

BDBM50583624

ONC(=O)c1ccc(CN(Cc2cccnc2)S(=O)(=O)c2cc(F)c(F)c(F)c2F)cc1

BDBM50563274

ONC(=O)c1ccc(CN2C(=O)c3cccc(F)c3C2=O)cc1-c1ccccc1

BDBM50563273

ONC(=O)c1ccc(CN2C(=O)c3ccccc3C2=O)cc1-c1ccccc1

BDBM50563275

ONC(=O)c1ccc(CN2C(=O)c3ccccc3S2(=O)=O)cc1-c1ccccc1

BDBM50531317

ONC(=O)c1ccc(CN2C3CCS(=O)(=O)C3c3ccccc23)cc1

BDBM417049

ONC(=O)c1ccc(CN2CCCc3cc(Cl)ccc23)cc1

BDBM50517570

ONC(=O)c1ccc(CN2c3ccccc3Sc3ccc(Cl)cc23)cc1

BDBM50570679

ONC(=O)c1ccc(CN2c3ccccc3Sc3ccc(cc23)C(=O)Nc2ccc(Br)cn2)cc1

BDBM50570677

ONC(=O)c1ccc(CN2c3ccccc3Sc3ccc(cc23)C(=O)Nc2ccccn2)cc1

BDBM50517565

ONC(=O)c1ccc(CN2c3ccccc3Sc3ccc(cc23)C(F)(F)F)cc1

BDBM50517568

ONC(=O)c1ccc(CN2c3ccccc3Sc3ccccc23)cc1

BDBM50570670

ONC(=O)c1ccc(CN2c3ccccc3[S+]([O-])c3ccc(Cl)cc23)cc1

BDBM50570671

ONC(=O)c1ccc(CN2c3ccccc3[S+]([O-])c3ccc(cc23)C(F)(F)F)cc1

BDBM50517575

ONC(=O)c1ccc(CN2c3ccccc3[S+]([O-])c3ccccc23)cc1

BDBM119440

ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1

BDBM119695

ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccsc2)-c2ccc(O)cc2)cc1

BDBM50555680

ONC(=O)c1ccc(CNC(=O)c2c(F)c(F)c(F)c(F)c2F)cc1

BDBM50513915

ONC(=O)c1ccc(CNC(=O)c2ccc(Cl)c(Cl)c2)cc1

BDBM50247556

ONC(=O)c1ccc(CNc2cccc3cccnc23)cc1

BDBM50247553

ONC(=O)c1ccc(CNc2cccc3ncccc23)cc1

BDBM50531341

ONC(=O)c1ccc(Cn2c3CCS(=O)(=O)Cc3c3cc(F)ccc23)cc1

BDBM50531339

ONC(=O)c1ccc(Cn2c3CCS(=O)(=O)Cc3c3ccccc23)cc1

BDBM50252392

ONC(=O)c1ccc(Cn2c3CCS(=O)(=O)c3c3ccccc23)cc1

BDBM50531323

ONC(=O)c1ccc(Cn2c3CCSCc3c3cc(F)ccc23)cc1

BDBM50531342

ONC(=O)c1ccc(Cn2c3CC[S+]([O-])Cc3c3cc(F)ccc23)cc1

BDBM218159

ONC(=O)c1ccc(Cn2ccc3ccccc23)cc1

BDBM50531013

ONC(=O)c1ccc(Cn2nnc(n2)-c2ncccn2)cc1

BDBM50531020

ONC(=O)c1ccc(Cn2nnnc2-c2cccs2)cc1

BDBM50587718

ONC(=O)c1ccc(Cn2sc3ccccc3c2=O)cc1

BDBM50502572

ONC(=O)c1ccc(NC(=O)CCC2N(Cc3ccc(Br)cc3)C(=O)N(C2=O)c2ccc(Cl)cc2)cc1

BDBM50502570

ONC(=O)c1ccc(NC(=O)CCC2N(Cc3ccccc3)C(=O)N(C2=O)c2ccc(Cl)cc2)cc1

BDBM50551534

ONC(=O)c1ccc(Nc2c3CCCCc3nc3ccccc23)cc1

BDBM50551544

ONC(=O)c1ccc(Nc2c3ccccc3nc3ccc(Br)cc23)cc1

BDBM50551543

ONC(=O)c1ccc(Nc2c3ccccc3nc3ccc(F)cc23)cc1

BDBM50551539

ONC(=O)c1ccc(Nc2c3ccccc3nc3ccc(OC(F)(F)F)cc23)cc1

BDBM50551538

ONC(=O)c1ccc(Nc2c3ccccc3nc3ccc(OCc4ccccc4)cc23)cc1

BDBM50551540

ONC(=O)c1ccc(Nc2c3ccccc3nc3ccccc23)cc1

BDBM50551535

ONC(=O)c1ccc(Nc2ccnc3ccccc23)cc1

BDBM218224

ONC(=O)c1ccc(cc1)-c1ccc2ccccc12

BDBM50531609

ONC(=O)c1ccc2C(=O)c3ccccc3C(=O)c2c1

BDBM50027664

ONC(=O)c1ccc2CCN(Cc3ccc(o3)-c3cccc(c3)[N+]([O-])=O)Cc2c1

BDBM50027662

ONC(=O)c1ccc2CC[C@H](Cc2c1)Nc1nccc(n1)-c1cccnc1 |r|

BDBM425854

ONC(=O)c1ccc2nc([nH]c2c1)-c1ccccc1C(F)(F)F

BDBM50551542

ONC(=O)c1cccc(Nc2c3ccccc3nc3ccccc23)c1

BDBM421500

ONC(=O)c1cccc(Nc2nc3cc(Cl)c(Cl)cc3o2)c1

BDBM50015184

ONC(=O)c1ccccc1

BDBM50304782

ONC(=O)c1cnc(nc1)N1CCN(CC1)S(=O)(=O)c1ccc2ccccc2c1

BDBM32188

Oc1c(I)cc(Cl)c2cccnc12

BDBM617923

Oc1ccc(cc1NC(=O)N1CCOCC1)-c1nnn(Cc2ccc(cn2)-c2nnc(o2)C(F)F)n1

BDBM19131

SCCCCCCC(=O)Nc1nc(cs1)-c1ccccc1

BDBM50268097

[#8]-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#6]-[#7]-[#6](=O)\[#6]=[#6]-1\c2ccccc2-c2ccccc-12

BDBM50048864

[H][C@@]12CC(=O)N[C@H](C(C)C)C(=O)N[C@]([H])(CSSCC\C=C\1)C(=O)N\C(=C/C)C(=O)N[C@@H](C(C)C)C(=O)O2 |r,t:20|

BDBM50531319

[H][C@@]12CCCC[C@@]1([H])N(Cc1ccc(cc1)C(=O)NO)c1cc(ccc1CCC2)C(F)(F)F |r|

BDBM50531340

[H][C@@]12CCCC[C@@]1([H])N(Cc1ccc(cc1)C(=O)NO)c1ccccc1C2 |r|

BDBM50531320

[H][C@@]12CCCC[C@@]1([H])N(Cc1ccc(cc1)C(=O)NO)c1ccccc1CC2 |r|

BDBM50531318

[H][C@@]12CCCC[C@@]1([H])N(Cc1ccc(cc1)C(=O)NO)c1ccccc1CCC2 |r|

BDBM50548181

[H][C@@]12CCCC[C@]1([H])N(Cc1ccc(cc1)C(=O)NO)c1ccccc1S(=O)(=O)C2 |r|

BDBM50252390

[H][C@]12CCCC[C@@]1([H])N(Cc1ccc(cc1)C(=O)NO)c1ccccc1S(=O)(=O)C2 |r|

BDBM50189911

[H][C@]12CC[C@]([H])(C[C@H](C1)C(=O)Nc1cc(ccc1N)-c1ccc(F)cc1)O2 |r|

BDBM50531343

[H][C@]12Cc3ccccc3N(Cc3ccc(cc3)C(=O)NO)[C@]1([H])CCCCC2 |r|

BDBM36184

[O-]C(=O)CCCc1ccccc1