SMILES for Macrophage metalloelastase

CC(=O)N1CCC(CC1)NC(=O)c1ccc(Oc2ccc(cc2)C#C[C@]2(O)CN3CCC2CC3)cc1 |r,wU:25.27,wD:25.26,(19.25,4.07,;20.59,4.84,;20.6,6.38,;21.92,4.05,;23.26,4.81,;24.59,4.04,;24.58,2.5,;23.25,1.72,;21.91,2.51,;25.91,1.72,;27.25,2.49,;27.26,4.03,;28.58,1.71,;29.93,2.47,;31.25,1.7,;31.24,.16,;32.57,-.62,;33.91,.15,;33.92,1.69,;35.26,2.45,;36.59,1.66,;36.58,.13,;35.25,-.63,;37.93,2.42,;39.26,3.18,;40.58,3.97,;40.56,2.45,;40.55,5.5,;41.87,6.27,;43.99,5.85,;44.02,3.67,;41.9,3.23,;43.19,4.01,;43.17,5.51,;29.91,-.61,;28.58,.16,)|

BDBM50195901

CC(=O)N1CCN(CC1)C1(CNC(=O)c2ccc(OCc3cc(C)nc4ccccc34)cc2)C(=O)NC(=O)NC1=O

BDBM50216000

CC(=O)N1CC[C@@H]([C@@H](C1)NC(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1)c1n[nH]c(=S)[nH]1

BDBM50216003

CC(=O)N1C[C@@H](NC(=O)c2ccc(OCc3cc(C)nc4ccccc34)cc2)[C@H](C1)c1n[nH]c(=S)[nH]1

BDBM50554418

CC(=O)N[C@@H](CCCc1ccccc1)C(=O)N[C@H](CCc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)NO |r|

BDBM50554422

CC(=O)N[C@@H](COCc1ccccc1)C(=O)N[C@H](CCc1ccc(cc1)C(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)NO |r|

BDBM50554429

CC(=O)N[C@@H](COCc1ccccc1)C(=O)N[C@H](CCc1ccccc1)C(=O)N[C@H](Cc1ccc(C)cc1)C(=O)NO |r|

BDBM50554428

CC(=O)N[C@@H](COCc1ccccc1)C(=O)N[C@H](CCc1ccccc1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)NO |r|

BDBM50554434

CC(=O)N[C@@H](COCc1ccccc1)C(=O)N[C@H](CCc1ccccc1)C(=O)N[C@H](Cc1ccc(F)c(F)c1F)C(=O)NO |r|

BDBM50554425

CC(=O)N[C@@H](COCc1ccccc1)C(=O)N[C@H](CCc1ccccc1)C(=O)N[C@H](Cc1ccc(F)cc1)C(=O)NO |r|

BDBM50554424

CC(=O)N[C@@H](COCc1ccccc1)C(=O)N[C@H](CCc1ccccc1)C(=O)N[C@H](Cc1ccc(O)cc1)C(=O)NO |r|

BDBM50554427

CC(=O)N[C@@H](COCc1ccccc1)C(=O)N[C@H](CCc1ccccc1)C(=O)N[C@H](Cc1ccc(OC(C)=O)cc1)C(=O)NO |r|

BDBM50554426

CC(=O)N[C@@H](COCc1ccccc1)C(=O)N[C@H](CCc1ccccc1)C(=O)N[C@H](Cc1ccc(cc1)C(F)(F)F)C(=O)NO |r|

BDBM50554432

CC(=O)N[C@@H](COCc1ccccc1)C(=O)N[C@H](CCc1ccccc1)C(=O)N[C@H](Cc1cccc(C)c1)C(=O)NO |r|

BDBM50554431

CC(=O)N[C@@H](COCc1ccccc1)C(=O)N[C@H](CCc1ccccc1)C(=O)N[C@H](Cc1cccc(Cl)c1)C(=O)NO |r|

BDBM50554430

CC(=O)N[C@@H](COCc1ccccc1)C(=O)N[C@H](CCc1ccccc1)C(=O)N[C@H](Cc1cccc(F)c1)C(=O)NO |r|

BDBM50287585

CC(=O)N[C@@H](COCc1ccccc1)C(=O)N[C@H](CCc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)NO |r|

BDBM50554433

CC(=O)N[C@@H](COCc1ccccc1)C(=O)N[C@H](CCc1ccccc1)C(=O)N[C@H](Cc1ccccc1F)C(=O)NO |r|

BDBM50554419

CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CCc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)NO |r|

BDBM50554420

CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](CCc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)NO |r|

BDBM50300477

CC(=O)OC(CCc1ccc(cc1)-c1ccccc1)CC(O)=O

BDBM50152631

CC(=O)S[C@@H]1N=C(O[C@H]1C=C)\C=C\c1ccccc1 |c:5|

BDBM50300471

CC(=O)c1ccc(cc1)-c1ccc(CCC(O)CC(O)=O)cc1

BDBM50333940

CC(=O)c1ccc(cc1)-c1ccc(cc1)-c1cc(sc1F)C(=O)NC[C@H]1CC[C@@H](CC1)C(O)=O |r,wU:28.34,wD:25.27,(-8.04,-14.4,;-6.5,-14.37,;-5.76,-13.02,;-5.7,-15.68,;-4.16,-15.65,;-3.36,-16.97,;-4.1,-18.32,;-5.64,-18.35,;-6.44,-17.04,;-3.31,-19.62,;-1.76,-19.59,;-.97,-20.91,;-1.71,-22.26,;-3.25,-22.29,;-4.05,-20.98,;-.92,-23.57,;.62,-23.55,;1.11,-25.02,;-.13,-25.93,;-1.38,-25.04,;-2.84,-25.53,;2.46,-25.77,;2.48,-27.31,;3.78,-24.98,;5.12,-25.73,;6.45,-24.94,;7.79,-25.7,;9.1,-24.91,;9.09,-23.37,;7.74,-22.62,;6.41,-23.41,;10.41,-22.59,;11.76,-23.34,;10.4,-21.04,)|

BDBM50333941

CC(=O)c1ccc(cc1)-c1ccc(cc1)-c1cc(sc1F)C(=O)N[C@H](CC(O)=O)c1ccccc1 |r|

BDBM50170206

CC(=O)c1ccc(cc1)-c1ccc(cc1)-c1csc(c1)C(=O)NCCN1CCOCC1

BDBM50299058

CC(C(=O)NO)c1ccccc1S(=O)(=O)c1ccc(cc1)-c1ccccc1

BDBM50299067

CC(C(O)=O)c1ccccc1S(=O)(=O)c1ccc(cc1)-c1ccccc1

BDBM26574

CC(C)(C)c1nn2ccccc2c1Cc1ccc(cc1)C(=O)N[C@@H]1CCOC[C@@H]1C(=O)NO |r|

BDBM194646

CC(C)(Cc1ccc(cc1)C(F)(F)F)C(=O)NC[C@]1(NC(=O)NC1=O)C1CC1 |r|

BDBM50104723

CC(C)(NS(=O)(=O)c1ccccc1)C(=O)NC1=NN=C(CS1)c1ccc(Cl)cc1 |c:19,t:17|

BDBM50227565

CC(C)=CCOC(=O)c1cccc(=O)[nH]1 |(26.33,1.58,;26.33,3.12,;27.66,3.89,;25,3.89,;23.66,3.12,;22.33,3.89,;20.99,3.12,;20.99,1.58,;19.66,3.9,;19.66,5.44,;18.33,6.21,;17,5.44,;17,3.9,;15.67,3.12,;18.33,3.13,)|

BDBM50453825

CC(C)C(=O)N1CC(C1)(N(C)S(=O)(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1)C(=O)NO

BDBM50204002

CC(C)C(CS(=O)(=O)c1ccc(cc1)-c1cccc(CNC(=O)c2nc3ccccc3c(=O)[nH]2)c1)N(O)C=O

BDBM92442

CC(C)C(NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)N1CCOC1=O)C(O)=O

BDBM50195916

CC(C)C1(CNC(=O)c2ccc(OCc3cc(C)nc4ccccc34)cc2)C(=O)NC(=O)NC1=O

BDBM475582

CC(C)C1(NC(=O)NC1=O)c1occc1Sc1ccc(OCc2cccc(C)c2)cc1

BDBM50453823

CC(C)CC(=O)N1CC(C1)(N(C)S(=O)(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1)C(=O)NO

BDBM50592915

CC(C)CC(C(O)C(=O)NO)C(=O)NC(c1noc(Sc2ccccc2)n1)C(C)(C)C

BDBM475580

CC(C)CC1(NC(=O)NC1=O)c1occc1Sc1ccc(OCc2cccc(C)c2)cc1

BDBM50187427

CC(C)CNC(=O)CC[C@H](NS(=O)(=O)c1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50278365

CC(C)CNC(=O)CC[C@H](NS(=O)(=O)c1ccc(cc1)[N+]([O-])=O)C(O)=O |r|

BDBM50295497

CC(C)COC(=O)Nc1ccc2c(c1)sc1cc(ccc21)S(=O)(=O)N[C@@H](C(C)C)C(O)=O |r|

BDBM28472

CC(C)COC(=O)Nc1ccc2oc3cc(ccc3c2c1)S(=O)(=O)N[C@@H](C(C)C)C(O)=O |r|

BDBM475585

CC(C)COc1cc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)ccn1

BDBM50216010

CC(C)C[C@@H](N1CC[C@](N)(C1=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1)c1n[nH]c(=S)[nH]1

BDBM50555051

CC(C)C[C@@H]1[C@H](CCCOc2ccc(C[C@H](NC1=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cc2)C(=O)NO |r|

BDBM50555052

CC(C)C[C@@H]1[C@H](CCCOc2ccc(C[C@H](NC1=O)C(O)=O)cc2)C(=O)NO |r|

BDBM50555047

CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](Cc1ccc(OCCNC(=O)c2ccc(NN)nc2)cc1)C(O)=O |r|

BDBM50555048

CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)NCCNC(=O)c1ccc(NN)nc1 |r|

BDBM50035507

CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O |r|

BDBM50035475

CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCNC(=O)c1ccc(F)cc1)C(N)=O |r|

BDBM50555049

CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM120230

CC(C)C[C@H](NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|

BDBM50589859

CC(C)C[C@H](NC(=O)CNC(=O)CC[C@H](NS(=O)(=O)c1ccc(Cl)c(c1)C(F)(F)F)C(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1CC(N)=O |r|

BDBM50589860

CC(C)C[C@H](NC(=O)CNC(=O)CC[C@H](NS(=O)(=O)c1ccc(Cl)c(c1)C(F)(F)F)C(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(N)=O |r|

BDBM50589866

CC(C)C[C@H](NC(=O)CNC(=O)CC[C@H](NS(=O)(=O)c1ccc(Cl)c(c1)C(F)(F)F)C(O)=O)C(=O)N[C@@H](C(C)C)C(N)=O |r|

BDBM50400560

CC(C)C[C@H](NC(=O)CNS(=O)(=O)c1ccc(cc1)-c1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C)C(N)=O |r|

BDBM50400561

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)N(CC(O)=O)S(=O)(=O)c1ccc(cc1)-c1ccccc1 |r|

BDBM50606381

CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(N)=O |r|

BDBM50606385

CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1CC(N)=O |r|

BDBM50606380

CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)N(C)[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(N)=O |r|

BDBM50606384

CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)N(C)[C@@H](CC(C)C)C(=O)N1CCC[C@H]1CC(N)=O |r|

BDBM120220

CC(C)C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1)C(N)=O |r|

BDBM120201

CC(C)C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccccc1)C(N)=O |r|

BDBM120239

CC(C)C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccs1)C(N)=O |r|

BDBM50606396

CC(C)C[C@H](NC(=O)[C@H](CCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCCCNC(=O)c1ccc(Oc2ccc(cc2)C(N)=O)cc1)C(=O)N(C)[C@@H](CCC(O)=O)C(=O)N1CCC[C@H]1CC(N)=O |r|

BDBM50606395

CC(C)C[C@H](NC(=O)[C@H](CCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCCNC(=O)c1ccc(Oc2ccc(cc2)C(N)=O)cc1)C(=O)N(C)[C@@H](CCC(O)=O)C(=O)N1CCC[C@H]1CC(N)=O |r|

BDBM50606392

CC(C)C[C@H](NC(=O)[C@H](CCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCNC(=O)c1ccc(Oc2ccc(F)cc2)cc1)C(=O)N(C)[C@@H](CCC(O)=O)C(=O)N1CCC[C@H]1CC(N)=O |r|

BDBM50606393

CC(C)C[C@H](NC(=O)[C@H](CCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCNC(=O)c1ccc(Oc2ccc(cc2)C(N)=O)cc1)C(=O)N(C)[C@@H](CCC(O)=O)C(=O)N1CCC[C@H]1CC(N)=O |r|

BDBM50606391

CC(C)C[C@H](NC(=O)[C@H](CCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCNC(=O)c1ccc(Oc2ccccc2)cc1)C(=O)N(C)[C@@H](CCC(O)=O)C(=O)N1CCC[C@H]1CC(N)=O |r|

BDBM50606390

CC(C)C[C@H](NC(=O)[C@H](CCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)N(C)[C@@H](CCC(O)=O)C(=O)N1CCC[C@H]1CC(N)=O |r|

BDBM50606394

CC(C)C[C@H](NC(=O)[C@H](CCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCNC(=O)c1ccc(Oc2ccc(cc2)C(N)=O)cc1)C(=O)N(C)[C@@H](CCC(O)=O)C(=O)N1CCC[C@H]1CC(N)=O |r|

BDBM50606397

CC(C)C[C@H](NC(=O)[C@H](CCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCCCNC(=O)c1ccc(Oc2ccc(cc2)C(N)=O)cc1)C(=O)N(C)[C@@H](CCC(O)=O)C(=O)N1CCC[C@H]1CC(N)=O |r|

BDBM50360949

CC(C)Cc1nc(no1)-c1ccc2oc3cc(ccc3c2c1)S(=O)(=O)N[C@@H](C(C)C)C(O)=O |r|

BDBM50195900

CC(C)N1CCC(CC1)C1(CNC(=O)c2ccc(OCc3cc(C)nc4ccccc34)cc2)C(=O)NC(=O)NC1=O

BDBM50195910

CC(C)N1CCN(CC1)C1(CNC(=O)c2ccc(OCc3cc(C)nc4ccccc34)cc2)C(=O)NC(=O)NC1=O

BDBM50216006

CC(C)N1CC[C@@H]([C@@H](C1)NC(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1)c1n[nH]c(=S)[nH]1

BDBM50278367

CC(C)NC(=O)CC[C@H](NS(=O)(=O)c1ccc(cc1)[N+]([O-])=O)C(O)=O |r|

BDBM28465

CC(C)OC(=O)Nc1ccc2c(c1)oc1ccc(cc21)S(=O)(=O)N[C@H](C(C)C)C(O)=O |r|

BDBM50295496

CC(C)OC(=O)Nc1ccc2c(c1)sc1cc(ccc21)S(=O)(=O)N[C@@H](C(C)C)C(O)=O |r|

BDBM50227603

CC(C)OC(=O)c1cccc(=O)[nH]1

BDBM50227591

CC(C)OC(=O)c1cccc(=S)[nH]1

BDBM50161330

CC(C)ON([C@H](C(C)C)C(=O)NO)S(=O)(=O)c1ccc(cc1)-c1ccccc1

BDBM50299057

CC(C)ON([C@H](C(C)C)C(O)=O)S(=O)(=O)c1ccc(cc1)-c1ccccc1 |r|

BDBM475586

CC(C)Oc1cc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)ccn1

BDBM475590

CC(C)Oc1cccc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)c1

BDBM50466703

CC(C)[C@@H](N(CCNC(=S)N[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1NC(C)=O)S(=O)(=O)c1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50466695

CC(C)[C@@H](N(CCNC(=S)N[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)S(=O)(=O)c1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50466694

CC(C)[C@@H](N(CCNC(=S)N[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1NC(C)=O)S(=O)(=O)c1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50466705

CC(C)[C@@H](N(CCNC(=S)N[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O)S(=O)(=O)c1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50466707

CC(C)[C@@H](N([C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1NC(C)=O)S(=O)(=O)c1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50466704

CC(C)[C@@H](N([C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)S(=O)(=O)c1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50466698

CC(C)[C@@H](N([C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1NC(C)=O)S(=O)(=O)c1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50466699

CC(C)[C@@H](N([C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O)S(=O)(=O)c1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50295507

CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)sc1cc(NC(=O)Nc3ccccc3)ccc21)C(O)=O |r|

BDBM50295484

CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)sc1ccc(NS(C)(=O)=O)cc21)C(O)=O |r|

BDBM28466

CC(C)[C@@H](NS(=O)(=O)c1ccc2oc3cc(NC(=O)Oc4ccccc4)ccc3c2c1)C(O)=O |r|

BDBM28458

CC(C)[C@@H](NS(=O)(=O)c1ccc2oc3cc(NS(=O)(=O)C(C)C)ccc3c2c1)C(O)=O |r|

BDBM28459

CC(C)[C@@H](NS(=O)(=O)c1ccc2oc3cc(NS(=O)(=O)c4c(C)noc4C)ccc3c2c1)C(O)=O |r|

BDBM28460

CC(C)[C@@H](NS(=O)(=O)c1ccc2oc3cc(NS(=O)(=O)c4ccccc4)ccc3c2c1)C(O)=O |r|

BDBM28456

CC(C)[C@@H](NS(=O)(=O)c1ccc2oc3cc(NS(C)(=O)=O)ccc3c2c1)C(O)=O |r|

BDBM28486

CC(C)[C@@H](NS(=O)(=O)c1ccc2oc3ccccc3c2c1)C(O)=O |r|

BDBM50295482

CC(C)[C@@H](NS(=O)(=O)c1ccc2sc3cc(NS(C)(=O)=O)ccc3c2c1)C(O)=O |r|

BDBM50295480

CC(C)[C@@H](NS(=O)(=O)c1ccc2sc3ccccc3c2c1)C(O)=O |r|

BDBM50104720

CC(C)[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NC1=NN=C(CS1)c1ccc(Cl)cc1 |c:20,t:18|

BDBM194645

CC(C)[C@H](Cc1ccc(cc1)C(F)(F)F)C(=O)NC[C@]1(NC(=O)NC1=O)C1CC1 |r|

BDBM28485

CC(C)[C@H](NS(=O)(=O)c1ccc(cc1)-c1ccc(NC(=O)c2cc3ccccc3o2)cc1)C(O)=O |r|

BDBM50203953

CC(C)[C@H](NS(=O)(=O)c1ccc(cc1)-c1cccc(CNC(=O)c2nc3ccccc3c(=O)[nH]2)c1)C(=O)NO |r|

BDBM50203956

CC(C)[C@H](NS(=O)(=O)c1ccc(cc1)-c1cccc(CNC(=O)c2nc3ccccc3c(=O)[nH]2)c1)C(O)=O |r|

BDBM50295512

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1cc(N)ccc21)C(O)=O |r|

BDBM50295506

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1cc(NC(=O)NCCc3cccs3)ccc21)C(O)=O |r|

BDBM28483

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1cc(NC(=O)OCCF)ccc21)C(O)=O |r|

BDBM28484

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1cc(NC(=O)Oc3ccc(F)cc3)ccc21)C(O)=O |r|

BDBM50295510

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1cc(ccc21)N1CCOC1=O)C(O)=O |r|

BDBM28479

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)NC3CCCC3)cc21)C(O)=O |r|

BDBM28481

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)NCCc3cccs3)cc21)C(O)=O |r|

BDBM28480

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)Nc3ccsc3)cc21)C(O)=O |r|

BDBM28473

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)OCCF)cc21)C(O)=O |r|

BDBM50452613

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)Oc3ccc(Br)cc3)cc21)C(O)=O |r|

BDBM28477

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)Oc3ccc(C)cc3)cc21)C(O)=O |r|

BDBM28476

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)Oc3ccc(F)cc3)cc21)C(O)=O |r|

BDBM50452615

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)Oc3ccc(I)cc3)cc21)C(O)=O |r|

BDBM28474

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)Oc3ccccc3)cc21)C(O)=O |r|

BDBM28475

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)Oc3ccccc3Cl)cc21)C(O)=O |r|

BDBM50452614

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)c3ccc(I)cc3)cc21)C(O)=O |r|

BDBM28478

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(N)=O)cc21)C(O)=O |r|

BDBM28462

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NS(=O)(=O)CC(F)(F)F)cc21)C(O)=O |r|

BDBM50452616

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NS(=O)(=O)c3ccc(I)cc3)cc21)C(O)=O |r|

BDBM28461

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(NS(C)(=O)=O)cc21)C(O)=O |r|

BDBM50026624

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-c1cc[nH]n1)C(O)=O |r|

BDBM50360964

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-c1ccc(C)o1)C(O)=O |r|

BDBM50360967

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-c1ccc(C)s1)C(O)=O |r|

BDBM50360965

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-c1ccc(Cl)o1)C(O)=O |r|

BDBM50360968

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-c1ccc[nH]1)C(O)=O |r|

BDBM50360966

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-c1cccs1)C(O)=O |r|

BDBM50360963

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-c1ccoc1)C(O)=O |r|

BDBM50360970

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-c1ncc(C)s1)C(O)=O |r|

BDBM50360969

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-c1nccs1)C(O)=O |r|

BDBM50360971

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-c1noc(C)n1)C(O)=O |r|

BDBM50360955

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-c1noc(n1)-c1ccccc1)C(O)=O |r|

BDBM50360948

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-c1noc(n1)C(C)(C)C)C(O)=O |r|

BDBM50360947

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-c1noc(n1)C(C)C)C(O)=O |r|

BDBM50360951

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-c1noc(n1)C(F)(F)F)C(O)=O |r|

BDBM50360952

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-c1noc(n1)C1CC1)C(O)=O |r|

BDBM50360953

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-c1noc(n1)C1CCC1)C(O)=O |r|

BDBM50360954

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-c1noc(n1)C1CCCCC1)C(O)=O |r|

BDBM50360956

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-c1noc(n1)C1CCOC1)C(O)=O |r|

BDBM50360959

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-n1ccc(n1)C(F)(F)F)C(O)=O |r|

BDBM50360958

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-n1cccn1)C(O)=O |r|

BDBM50360957

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)-n1cncn1)C(O)=O |r|

BDBM50360961

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)N1CCN(C)CC1)C(O)=O |r|

BDBM50360960

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)N1CCNCC1)C(O)=O |r|

BDBM50295479

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)N1CCOC1=O)C(O)=O |r|

BDBM50360962

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(cc21)N1CCOCC1)C(O)=O |r|

BDBM50295493

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)sc1cc(N)ccc21)C(O)=O |r|

BDBM50295504

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)sc1cc(NC(=O)NC3CCCC3)ccc21)C(O)=O |r|

BDBM50295505

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)sc1cc(NC(=O)NCCc3cccs3)ccc21)C(O)=O |r|

BDBM50295509

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)sc1cc(NC(=O)NCc3ccccc3)ccc21)C(O)=O |r|

BDBM50295508

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)sc1cc(NC(=O)Nc3ccccc3)ccc21)C(O)=O |r|

BDBM50295499

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)sc1cc(NC(=O)OCCC#C)ccc21)C(O)=O |r|

BDBM50295498

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)sc1cc(NC(=O)OCCS(C)(=O)=O)ccc21)C(O)=O |r|

BDBM50295501

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)sc1cc(NC(=O)Oc3ccc(C)cc3)ccc21)C(O)=O |r|

BDBM50295502

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)sc1cc(NC(=O)Oc3ccc(F)cc3)ccc21)C(O)=O |r|

BDBM50295500

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)sc1cc(NC(=O)Oc3ccccc3)ccc21)C(O)=O |r|

BDBM50295511

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)sc1cc(ccc21)N1CCOC1=O)C(O)=O |r|

BDBM50295485

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)sc1ccc(NS(C)(=O)=O)cc21)C(O)=O |r|

BDBM28457

CC(C)[C@H](NS(=O)(=O)c1ccc2oc3cc(NS(C)(=O)=O)ccc3c2c1)C(O)=O |r|

BDBM28487

CC(C)[C@H](NS(=O)(=O)c1ccc2oc3ccccc3c2c1)C(O)=O |r|

BDBM50295483

CC(C)[C@H](NS(=O)(=O)c1ccc2sc3cc(NS(C)(=O)=O)ccc3c2c1)C(O)=O |r|

BDBM50295481

CC(C)[C@H](NS(=O)(=O)c1ccc2sc3ccccc3c2c1)C(O)=O |r|

BDBM50104719

CC(C)[C@H](NS(=O)(=O)c1ccccc1)C(=O)NC1=NN=C(CS1)c1ccc(Cl)cc1 |c:20,t:18|

BDBM50361601

CC(C)[C@H]1N(CC(=O)N(O)C1=O)S(=O)(=O)c1ccc(Oc2ccccc2)cc1 |r|

BDBM50361600

CC(C)[C@H]1N(CC(=O)N(O)C1=O)S(=O)(=O)c1ccc(cc1)-c1ccccc1 |r|

BDBM26793

CC(C)c1nc2ccccc2n1Cc1ccc(cc1)C(=O)N[C@@H]1CN(C[C@@H]1C(=O)NO)C(=O)OC(C)(C)C |r|

BDBM26569

CC(C)c1nc2ccccn2c1Cc1ccc(cc1)C(=O)N[C@@H]1CCOC[C@@H]1C(=O)NO |r|

BDBM26573

CC(C)c1nn2ccccc2c1Cc1ccc(cc1)C(=O)N[C@@H]1CCOC[C@@H]1C(=O)NO |r|

BDBM26567

CC(C)c1oc2ccccc2c1Cc1ccc(cc1)C(=O)N[C@@H]1CCOC[C@@H]1C(=O)NO |r|

BDBM26566

CC(C)c1oc2ccccc2c1Cc1ccc(cc1)C(=O)N[C@@H]1CNC[C@@H]1C(=O)NO |r|

BDBM50104713

CC(NS(=O)(=O)c1ccccc1)C(=O)NC1=N[N-][C+](CS1)c1ccc(cc1)[N+]([O-])=O |t:16|

BDBM50170212

CC1CCC(CC1)OC(=O)NC(=O)c1cc(cs1)-c1ccc(OC(F)(F)F)cc1 |(-6.29,2.13,;-4.9,1.48,;-4.77,-.05,;-3.37,-.73,;-2.11,.16,;-2.24,1.7,;-3.62,2.36,;-.7,-.5,;.56,.37,;.43,1.92,;1.97,-.28,;2.11,-1.83,;.84,-2.72,;3.52,-2.49,;4.87,-1.76,;6,-2.8,;5.34,-4.18,;3.8,-3.98,;7.52,-2.58,;8.08,-1.15,;9.6,-.91,;10.56,-2.11,;12.09,-1.86,;13.06,-3.05,;13.95,-4.15,;12.73,-4.65,;14.67,-3.07,;10.01,-3.54,;8.48,-3.78,)|

BDBM50180610

CCC(CC(O)=O)C(=O)c1ccc(cc1)C#CCOCc1ccccc1

BDBM50180601

CCC(CC(O)=O)C(=O)c1ccc(cc1)C#Cc1ccccc1

BDBM50379533

CCC(NCCCC[C@@H](C[C@@H](OC)c1ccc(F)cc1)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|

BDBM50379534

CCC(NCCCC[C@@H](Oc1cc(C)c(F)c(C)c1)C(=O)NO)c1ccc(F)cc1 |r|

BDBM50195905

CCC1(CNC(=O)c2ccc(OCc3cc(C)nc4ccccc34)cc2)C(=O)NC(=O)NC1=O

BDBM605515

CCC1(NC(=O)NC1=O)c1cnccc1Sc1ccc(\C=C\c2ccnc(C)c2)cc1

BDBM475579

CCC1(NC(=O)NC1=O)c1occc1Sc1ccc(OCc2cccc(C)c2)cc1

BDBM475601

CCC1(NC(=O)NC1=O)c1occc1Sc1ccc(OCc2ccnc(C)c2)cc1

BDBM605509

CCC1(NC(=O)NC1=O)c1occc1Sc1ccc(\C=C\c2ccnc(C)c2)cc1

BDBM475581

CCCC1(NC(=O)NC1=O)c1occc1Sc1ccc(OCc2cccc(C)c2)cc1

BDBM50089198

CCCCC(CC(=O)NO)S(=O)(=O)C1CCCCC1

BDBM50089199

CCCCC(CC(=O)NO)S(=O)(=O)c1ccc2ccccc2c1

BDBM50089196

CCCCC(CC(=O)NO)S(=O)(=O)c1ccccc1

BDBM50180609

CCCCCCC(CC(O)=O)C(=O)c1ccc(cc1)C#Cc1ccc(Cl)cc1

BDBM50180603

CCCCCCC(CC(O)=O)C(=O)c1ccc(cc1)C#Cc1ccccc1

BDBM50180608

CCCCCCCCC#Cc1ccc(cc1)C(=O)CCC(O)=O

BDBM50227570

CCCCCCCn1cc(nn1)C1=NCCO1 |t:13|

BDBM50187429

CCCCCCNC(=O)CC[C@H](NS(=O)(=O)c1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50227581

CCCCCCOC(=O)c1cccc(=S)[nH]1

BDBM50227550

CCCCCCn1cc(nn1)C1=NCCO1 |t:12|

BDBM50187428

CCCCCNC(=O)CC[C@H](NS(=O)(=O)c1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50278390

CCCCCNC(=O)CC[C@H](NS(=O)(=O)c1ccc(cc1)[N+]([O-])=O)C(O)=O |r|

BDBM50227593

CCCCCOC(=O)c1cccc(=O)[nH]1

BDBM50458760

CCCCC[C@@H](CN(O)C=O)C(=O)NCNC(=O)c1cc2cccc(OC)c2o1 |r|

BDBM50458767

CCCCC[C@H](CN(O)C=O)C(=O)NCNC(=O)c1cc2cccc(OC)c2o1 |r|

BDBM50458761

CCCCC[C@H]([C@@H](CC)N(O)C=O)C(=O)NCNC(=O)c1cc2cccc(OC)c2o1 |r|

BDBM50458762

CCCCC[C@H]([C@@H](CC)N(O)C=O)C(=O)NCNC(=O)c1ccc(o1)-c1ccccc1 |r|

BDBM50458772

CCCCC[C@H]([C@H](CC)N(O)C=O)C(=O)NCNC(=O)c1cc2cccc(OC)c2o1 |r|

BDBM50187426

CCCCNC(=O)CC[C@H](NS(=O)(=O)c1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50278366

CCCCNC(=O)CC[C@H](NS(=O)(=O)c1ccc(cc1)[N+]([O-])=O)C(O)=O |r|

BDBM50386895

CCCCOC(=O)[C@@H]1[C@H](Oc2c1c(\C=C\C(=O)O[C@H](Cc1ccc(O)c(O)c1)C(O)=O)ccc2O)c1ccc(O)c(O)c1 |r|

BDBM50408913

CCCC[C@@H](CC(=O)NO)S(=O)(=O)c1ccccc1 |r|

BDBM50369525

CCCC[C@H](CC(=O)NO)S(=O)(=O)c1ccccc1 |r|

BDBM50215995

CCCN1CC[C@@H]([C@@H](C1)NC(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1)c1n[nH]c(=S)[nH]1

BDBM50216005

CCCN1C[C@@H](NC(=O)c2ccc(OCc3cc(C)nc4ccccc34)cc2)[C@H](C1)c1n[nH]c(=S)[nH]1

BDBM50187425

CCCNC(=O)CC[C@H](NS(=O)(=O)c1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM28464

CCCOC(=O)Nc1ccc2c(c1)oc1ccc(cc21)S(=O)(=O)N[C@H](C(C)C)C(O)=O |r|

BDBM28471

CCCOC(=O)Nc1ccc2oc3cc(ccc3c2c1)S(=O)(=O)N[C@@H](C(C)C)C(O)=O |r|

BDBM475591

CCCOc1cccc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)c1

BDBM50458770

CCC[C@H](CN(O)C=O)C(=O)NCNC(=O)c1cc2cccc(OC)c2o1 |r|

BDBM24006

CCCc1ccc2c(NC(=O)C22NN=C(S2)c2ccc(OC)cc2)c1 |c:14|

BDBM50278389

CCNC(=O)CC[C@H](NS(=O)(=O)c1ccc(cc1)[N+]([O-])=O)C(O)=O |r|

BDBM50295503

CCNC(=O)Nc1ccc2c(c1)sc1cc(ccc21)S(=O)(=O)N[C@@H](C(C)C)C(O)=O |r|

BDBM29022

CCOC(=O)C1CCN(CC1)C(=O)NO

BDBM50295495

CCOC(=O)Nc1ccc2c(c1)sc1cc(ccc21)S(=O)(=O)N[C@@H](C(C)C)C(O)=O |r|

BDBM50295494

CCOC(=O)Nc1ccc2c(c1)sc1cc(ccc21)S(=O)(=O)N[C@H](C(C)C)C(O)=O |r|

BDBM28470

CCOC(=O)Nc1ccc2oc3cc(ccc3c2c1)S(=O)(=O)N[C@@H](C(C)C)C(O)=O |r|

BDBM50361618

CCOC(=O)c1cc2cc(ccc2[nH]1)-c1cc(nn1C)C(=O)NCc1ccc(cc1)C(O)=O

BDBM50163799

CCOCCC1(Oc2ccc(Oc3ccc(cc3)-c3nnco3)cc2)C(=O)NC(=O)C(N)C1=O

BDBM50204007

CCOCCC1(Oc2ccc(cc2)-c2cccc(CNC(=O)c3nc4ccccc4c(=O)[nH]3)c2)C(=O)NC(=O)NC1=O

BDBM475584

CCOc1cc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)ccn1

BDBM50437788

CCOc1ccc(OC2CCN(CC2)S(=O)(=O)C[C@@]2(C)NC(=O)NC2=O)cc1 |r|

BDBM475589

CCOc1cccc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)c1

BDBM50068848

CC[C@@H](C)C[C@@H](N(Cc1ccccc1)S(=O)(=O)c1ccc(OC)cc1)C(=O)NO

BDBM50068851

CC[C@H](C)C[C@@H](N(Cc1ccccc1)S(=O)(=O)c1ccc(OC)cc1)C(=O)NO

BDBM50606382

CC[C@H](C)[C@H](N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)N1CCC[C@H]1C(N)=O |r|

BDBM50606386

CC[C@H](C)[C@H](N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)N1CCC[C@H]1CC(N)=O |r|

BDBM50606389

CC[C@H](C)[C@H](N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)N1CCC[C@H]1CC(N)=O |r|

BDBM50606388

CC[C@H](C)[C@H](N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)N1CCC[C@H]1CC(N)=O |r|

BDBM50606387

CC[C@H](C)[C@H](N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)N1CCC[C@H]1CC(N)=O |r|

BDBM50606374

CC[C@H](C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM194639

CC[C@H](Cc1ccc(cc1)C(F)(F)F)C(=O)NC[C@]1(NC(=O)NC1=O)C1CC1 |r|

BDBM120170

CC[C@H](NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1ccccc1)C(=O)N[C@@H](CC(O)=O)C(N)=O |r|

BDBM120168

CC[C@H](NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|

BDBM120206

CC[C@H](NC(=O)CCc1ccc(cc1)-c1cccc(c1)[N+]([O-])=O)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|

BDBM120193

CC[C@H](NC(=O)CCc1ccc(cc1)-c1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(N)=O |r|

BDBM120192

CC[C@H](NC(=O)CCc1ccc(cc1)-c1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|

BDBM120190

CC[C@H](NC(=O)CCc1ccc(cc1)-c1ccsc1)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|

BDBM120187

CC[C@H](NC(=O)CCc1ccc(cc1)-c1csnn1)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|

BDBM120191

CC[C@H](NC(=O)CCc1ccc(cc1)-c1nc2ccccc2s1)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|

BDBM120189

CC[C@H](NC(=O)CCc1ccc(cc1)-c1nccs1)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|

BDBM120188

CC[C@H](NC(=O)CCc1ccc(cc1)-n1cccc1)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|

BDBM120194

CC[C@H](NC(=O)[C@H](CC)NC(=O)CCc1ccc(cc1)-c1ccccc1)C(N)=O |r|

BDBM120163

CC[C@H](NC(=O)[C@H](CCCOC=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1)C(N)=O |r|

BDBM50505152

CC[N+]1=C(\C=C\C=C\C=C2\N(CCCCCC(=O)NCCCOCCOCCOCCCNC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc3cc(no3)-c3ccc(cc3)-c3cccc(Cl)c3)CP(O)(=O)c3ccc(Br)cc3)c3ccc4c(cc(cc4c3C2(C)C)S(O)(=O)=O)S(O)(=O)=O)C(C)(C)c2c1ccc1c(cc(cc21)S(O)(=O)=O)S([O-])(=O)=O |r,c:2|

BDBM26563

CCc1[nH]c2ccccc2c1Cc1ccc(cc1)C(=O)N[C@@H]1CCOC[C@@H]1C(=O)NO |r|

BDBM50360972

CCc1nc(no1)-c1ccc2oc3cc(ccc3c2c1)S(=O)(=O)N[C@@H](C(C)C)C(O)=O |r|

BDBM26572

CCc1nn2ccccc2c1Cc1ccc(cc1)C(=O)N[C@@H]1CCOC[C@@H]1C(=O)NO |r|

BDBM50335314

CN(C)CCN(C)[C@H]1COc2ccccc2-c2c(C3CCCCC3)c3ccc(cc3n2C1)C(O)=O |r|

BDBM50592901

CN(C)c1ccc(cc1)-c1cn(nn1)-c1ccc(cc1)S(=O)(=O)C1(CCOCC1)C(=O)NO

BDBM50215925

CN(C)c1nc2c(nccc2[nH]1)-c1cc(Br)c(Br)[nH]1

BDBM50256700

CN(CC(=O)NC(c1cccc(c1)[N+]([O-])=O)c1cc(Cl)c2cccnc2c1O)c1ccccc1

BDBM475602

CN(Cc1ccnc(C)c1)c1ccc(Sc2ccoc2C2NC(=O)NC2=O)cc1

BDBM50265157

CN1CC2(CC2)C[C@@H]([C@H]1C(=O)N1CCN(CC1)c1ccc(cn1)C(F)(F)F)C(=O)NO |r|

BDBM50195924

CN1CCC(CC1)C1(CNC(=O)c2ccc(OCc3cc(C)nc4ccccc34)cc2)C(=O)NC(=O)NC1=O

BDBM50362092

CN1CCC(CC1)NC(=O)c1ccc(Oc2ccc(cc2)C#C[C@]2(O)CN3CCC2CC3)cc1 |r,wU:23.25,wD:23.24,(17,-51.84,;18.33,-52.62,;19.67,-51.86,;21,-52.63,;20.98,-54.17,;19.65,-54.95,;18.32,-54.16,;22.32,-54.95,;23.66,-54.19,;23.66,-52.64,;24.99,-54.96,;26.33,-54.2,;27.66,-54.98,;27.65,-56.51,;28.98,-57.29,;30.32,-56.53,;30.33,-54.99,;31.67,-54.23,;33,-55.01,;32.99,-56.54,;31.66,-57.31,;34.33,-54.25,;35.67,-53.49,;36.98,-52.7,;36.97,-54.22,;36.96,-51.18,;38.27,-50.4,;40.4,-50.82,;40.43,-53,;38.31,-53.44,;39.6,-52.66,;39.58,-51.16,;26.32,-57.28,;24.99,-56.51,)|

BDBM50195902

CN1CCN(CC1)C1(CNC(=O)c2ccc(OCc3cc(C)nc4ccccc34)cc2)C(=O)NC(=O)NC1=O

BDBM50215989

CN1CC[C@@H]([C@@H](C1)NC(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1)c1n[nH]c(=S)[nH]1

BDBM50386892

CNC(=O)C(CCc1ccccc1)NC(=O)C(CC(C)C)CC(=O)NO

BDBM50278388

CNC(=O)CC[C@H](NS(=O)(=O)c1ccc(cc1)[N+]([O-])=O)C(O)=O |r|

BDBM50419623

CNC(=O)N1CCC(CC1)NC(=O)c1ccc(Oc2ccc(cc2)C#C[C@]2(O)CN3CCC2CC3)cc1 |r,wU:26.28,wD:26.27,(19.34,-6.08,;20.67,-6.86,;22.02,-6.1,;22.03,-4.56,;23.35,-6.88,;24.69,-6.12,;26.02,-6.9,;26,-8.44,;24.67,-9.21,;23.34,-8.43,;27.34,-9.22,;28.68,-8.45,;28.68,-6.91,;30.01,-9.23,;31.35,-8.46,;32.68,-9.24,;32.67,-10.78,;34,-11.55,;35.34,-10.79,;35.35,-9.25,;36.69,-8.49,;38.01,-9.27,;38.01,-10.81,;36.68,-11.57,;39.35,-8.51,;40.69,-7.75,;42,-6.97,;41.99,-8.49,;41.98,-5.44,;43.29,-4.66,;45.41,-5.09,;45.45,-7.26,;43.32,-7.71,;44.62,-6.93,;44.6,-5.42,;31.34,-11.55,;30.01,-10.78,)|

BDBM50129986

CNC(=O)[C@@H](NC(=O)C(CCc1ccc(Cl)cc1)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C

BDBM50129987

CNC(=O)[C@@H](NC(=O)C(CCc1ccc(Cl)cc1)CP(O)(=O)Cc1ccc(Cc2ccccc2OC)cc1)C(C)(C)C

BDBM50090259

CNC(=O)[C@@H](NC(=O)C(CCc1ccccc1)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C

BDBM50129994

CNC(=O)[C@@H](NC(=O)C(CCc1ccccc1)CP(O)(=O)Cc1ccc(Cc2ccccc2OC)cc1)C(C)(C)C

BDBM50129993

CNC(=O)[C@@H](NC(=O)C(CCc1ccccc1)CP(O)(=O)Cc1ccccc1)C(C)(C)C

BDBM50063917

CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[C@H](O)C(=O)NO)C(C)(C)C |r|

BDBM50239954

CNC(=O)[C@@H](NC(=O)c1ccc(o1)-c1ccc(CSc2nc3CCCc3c(=O)[nH]2)c(F)c1)C(C)C |r|

BDBM50555050

CNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1Cc2ccc(OCCC[C@@H]([C@@H](CC(C)C)C(=O)N1)C(=O)NO)cc2 |r|

BDBM50062351

CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)CC(=O)NO |r|

BDBM50592895

CNC(=O)[C@H](Cc1ccccc1)NC(=O)C(CC(C)C)[C@H](CC=C)C(=O)NO |r|

BDBM50419619

CNC(=O)c1ccc(Oc2ccc(cc2)C#C[C@]2(O)CN3CCC2CC3)cc1 |r,wU:17.18,wD:17.17,(18.36,-56.75,;19.7,-57.53,;21.04,-56.76,;21.04,-55.22,;22.37,-57.54,;23.71,-56.78,;25.04,-57.55,;25.03,-59.09,;26.36,-59.87,;27.7,-59.11,;27.71,-57.56,;29.05,-56.8,;30.38,-57.59,;30.37,-59.12,;29.04,-59.88,;31.72,-56.83,;33.06,-56.07,;34.37,-55.28,;34.35,-56.8,;34.34,-53.75,;35.66,-52.97,;37.78,-53.4,;37.82,-55.58,;35.69,-56.02,;36.98,-55.24,;36.97,-53.74,;23.7,-59.86,;22.37,-59.09,)|

BDBM50215933

CNc1nc2c(nccc2[nH]1)-c1cc(Br)c(Br)[nH]1

BDBM50215929

CNc1nc2c(nccc2n1C)-c1cc(Br)c(Br)[nH]1

BDBM50386893

COC(=O)C1(O)CC(OC(=O)\C=C\c2ccc(O)c(O)c2)C(O)C(C1)OC(=O)\C=C\c1ccc(O)c(O)c1 |(14.43,-.8,;15.2,.53,;16.74,.53,;17.51,1.87,;17.51,-.8,;18.28,.53,;16.19,-1.58,;16.19,-3.12,;14.85,-3.89,;13.52,-3.12,;12.19,-3.89,;13.52,-1.58,;12.18,-.81,;12.18,.73,;10.84,1.48,;10.84,3.02,;12.17,3.8,;12.17,5.34,;13.51,3.03,;14.84,3.8,;13.51,1.49,;17.51,-3.88,;17.51,-5.42,;18.84,-3.12,;18.84,-1.58,;20.18,-3.89,;21.51,-3.12,;22.84,-3.89,;21.51,-1.58,;22.85,-.81,;22.85,.73,;24.18,1.49,;24.19,3.03,;22.85,3.8,;22.85,5.34,;21.51,3.02,;20.18,3.79,;21.52,1.49,)|

BDBM50203527

COC(=O)N1CC2(CC2)C[C@@H]([C@H]1C(=O)N1CCC(=CC1)c1ccccc1)C(=O)NO |r,c:19|

BDBM28468

COC(=O)Nc1cc2oc3ccc(cc3c2cc1Br)S(=O)(=O)N[C@@H](C(C)C)C(O)=O |r|

BDBM28467

COC(=O)Nc1cc2oc3ccc(cc3c2cc1Br)S(=O)(=O)N[C@H](C(C)C)C(O)=O |r|

BDBM28482

COC(=O)Nc1ccc2c(c1)oc1cc(ccc21)S(=O)(=O)N[C@@H](C(C)C)C(O)=O |r|

BDBM50295492

COC(=O)Nc1ccc2c(c1)oc1cc(ccc21)S(=O)(=O)N[C@H](C(C)C)C(O)=O |r|

BDBM28463

COC(=O)Nc1ccc2c(c1)oc1ccc(cc21)S(=O)(=O)N[C@H](C(C)C)C(O)=O |r|

BDBM50295491

COC(=O)Nc1ccc2c(c1)sc1cc(ccc21)S(=O)(=O)N[C@@H](C(C)C)C(O)=O |r|

BDBM50295490

COC(=O)Nc1ccc2c(c1)sc1cc(ccc21)S(=O)(=O)N[C@H](C(C)C)C(O)=O |r|

BDBM50295487

COC(=O)Nc1ccc2c(c1)sc1ccc(cc21)S(=O)(=O)N[C@@H](C(C)C)C(O)=O |r|

BDBM50295486

COC(=O)Nc1ccc2c(c1)sc1ccc(cc21)S(=O)(=O)N[C@H](C(C)C)C(O)=O |r|

BDBM28469

COC(=O)Nc1ccc2oc3cc(ccc3c2c1)S(=O)(=O)N[C@@H](C(C)C)C(O)=O |r|

BDBM50554437

COC(=O)Nc1ccc2oc3cc(ccc3c2c1)S(=O)(=O)N[C@H](C(C)C)C(O)=O |r|

BDBM50295489

COC(=O)Nc1ccc2sc3cc(ccc3c2c1)S(=O)(=O)N[C@@H](C(C)C)C(O)=O |r|

BDBM50295488

COC(=O)Nc1ccc2sc3cc(ccc3c2c1)S(=O)(=O)N[C@H](C(C)C)C(O)=O |r|

BDBM50210054

COC(=O)[C@@H](Cc1ccc(O)c(O)c1)OC(=O)\C=C\c1ccc(O)c(O)c1

BDBM50386894

COC(=O)[C@@H](Cc1ccc(O)c(O)c1)OC(=O)\C=C\c1ccc(O)c2O[C@@H]([C@@H](C(=O)OC)c12)c1ccc(O)c(O)c1 |r|

BDBM50302107

COC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccccc1)N(C)C(=O)[C@H](C)NC(=O)[C@@H](NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](OC(=O)[C@@H](OC(=O)[C@H](C(C)C)N(C)C)C(C)C)C(C)C)[C@@H](C)O |r|

BDBM50300478

COC(CCc1ccc(cc1)-c1ccccc1)CC(O)=O

BDBM50360950

COCc1nc(no1)-c1ccc2oc3cc(ccc3c2c1)S(=O)(=O)N[C@@H](C(C)C)C(O)=O |r|

BDBM50466696

CO[C@@H]1O[C@H](CN([C@H](C(C)C)C(O)=O)S(=O)(=O)c2ccc(cc2)-c2ccccc2)[C@@H](O)[C@H](O)[C@H]1NC(C)=O |r|

BDBM50466701

CO[C@@H]1O[C@H](CN([C@H](C(C)C)C(O)=O)S(=O)(=O)c2ccc(cc2)-c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O |r|

BDBM50466700

CO[C@@H]1O[C@H](CN([C@H](C(C)C)C(O)=O)S(=O)(=O)c2ccc(cc2)-c2ccccc2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1NC(C)=O |r|

BDBM50466697

CO[C@@H]1O[C@H](CN([C@H](C(C)C)C(O)=O)S(=O)(=O)c2ccc(cc2)-c2ccccc2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |r|

BDBM50466702

CO[C@@H]1O[C@H](CNC(=S)NCCN([C@H](C(C)C)C(O)=O)S(=O)(=O)c2ccc(cc2)-c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O |r|

BDBM50466706

CO[C@@H]1O[C@H](CNC(=S)NCCN([C@H](C(C)C)C(O)=O)S(=O)(=O)c2ccc(cc2)-c2ccccc2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |r|

BDBM50340758

CO[C@H](C[C@H](CCCCNCc1ccc(F)cc1)C(=O)NO)c1ccc(F)cc1 |r|

BDBM475583

COc1cc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)ccn1

BDBM153387

COc1cc(NC(=S)NNC(=O)c2cc(Br)c(Br)n2C)cc(OC)c1OC

BDBM50137281

COc1cc2C(N(CCc2cc1O)S(=O)(=O)c1ccccc1)C(=O)NO

BDBM50554436

COc1ccc(CCC[C@H](NC(=O)CN2CCOCC2)C(=O)N[C@H](CCc2ccc(OC)cc2)C(=O)N[C@H](Cc2ccc(C)cc2)C(=O)NO)cc1 |r|

BDBM50554421

COc1ccc(CCC[C@H](NC(C)=O)C(=O)N[C@H](CCc2ccccc2)C(=O)N[C@H](Cc2ccccc2)C(=O)NO)cc1 |r|

BDBM50434226

COc1ccc(CCS(=O)(=O)N2CCC[C@H]2C(=O)NO)cc1 |r|

BDBM50434227

COc1ccc(CCS(=O)(=O)NCC(=O)NO)cc1

BDBM50554435

COc1ccc(CC[C@@H](NC(=O)[C@H](CCCc2ccccc2)NC(=O)CN2CCOCC2)C(=O)N[C@H](Cc2ccc(C)cc2)C(=O)NO)cc1 |r|

BDBM50554423

COc1ccc(CC[C@@H](NC(=O)[C@H](COCc2ccccc2)NC(C)=O)C(=O)N[C@H](Cc2ccccc2)C(=O)NO)cc1 |r|

BDBM50227538

COc1ccc(COC(=O)c2cccc(=O)[nH]2)cc1

BDBM50227579

COc1ccc(COC(=O)c2cccc(=S)[nH]2)cc1

BDBM50429233

COc1ccc(C[C@@H](OC(=O)\C=C\c2ccc(OCc3ccccc3)c(OCc3ccccc3)c2)C(O)=O)cc1OC |r|

BDBM50429232

COc1ccc(C[C@H](OC(=O)\C=C\c2ccc(OCc3ccccc3)c(OCc3ccccc3)c2)C(O)=O)cc1OC |r|

BDBM50299063

COc1ccc(Oc2ccc(cc2)S(=O)(=O)c2ccccc2C(=O)NO)cc1

BDBM50299051

COc1ccc(Oc2ccc(cc2)S(=O)(=O)c2ccccc2CC(=O)NO)cc1

BDBM50299062

COc1ccc(Oc2ccc(cc2)S(=O)(=O)c2ccccc2CC(O)=O)cc1

BDBM50455850

COc1ccc(cc1)-c1ccc(Sc2ccccc2C(=O)CS(C)(=O)=O)cc1

BDBM50455845

COc1ccc(cc1)-c1ccc(Sc2ccccc2C(CCC(O)=O)C(O)=O)cc1

BDBM50455775

COc1ccc(cc1)-c1ccc(Sc2ccccc2C2CCC(=O)N(O)C2=O)cc1

BDBM50455767

COc1ccc(cc1)-c1ccc(Sc2ccccc2CC(=O)NO)cc1

BDBM50455848

COc1ccc(cc1)-c1ccc(Sc2ccccc2CC(=O)NS(=O)(=O)C(F)(F)F)cc1

BDBM50455777

COc1ccc(cc1)-c1ccc(Sc2ccccc2CC(=O)NS(C)(=O)=O)cc1

BDBM50455846

COc1ccc(cc1)-c1ccc(Sc2ccccc2CC(O)=O)cc1

BDBM50455849

COc1ccc(cc1)-c1ccc(Sc2ccccc2CP(O)(O)=O)cc1

BDBM50455847

COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)c1ccccc1C(=O)CS(C)(=O)=O

BDBM50299059

COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)c1ccccc1C(=O)NO

BDBM50299056

COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)c1ccccc1C(C)C(=O)NO

BDBM50299060

COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)c1ccccc1C(C)C(O)=O

BDBM50455765

COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)c1ccccc1C(CCC(O)=O)C(O)=O

BDBM50455766

COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)c1ccccc1C1CCC(=O)N(O)C1=O

BDBM50299052

COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)c1ccccc1CC(=O)NO

BDBM50455764

COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)c1ccccc1CC(=O)NS(=O)(=O)C(F)(F)F

BDBM50455776

COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)c1ccccc1CC(=O)NS(C)(=O)=O

BDBM50299055

COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)c1ccccc1CC(O)=O

BDBM50455763

COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)c1ccccc1CP(O)(O)=O

BDBM50592903

COc1ccc(cc1)-c1cn(nn1)-c1ccc(cc1)S(=O)(=O)C1(CCOCC1)C(=O)NO

BDBM50170202

COc1ccc(cc1)-c1csc(c1)C(=O)NCCN1CCOCC1

BDBM50104708

COc1ccc(cc1)C1=NN=C(NC(=O)[C@H](C)NS(=O)(=O)c2ccccc2)SC1 |t:9,11|

BDBM24008

COc1ccc(cc1)C1=NNC2(S1)C(=O)N(Cc1ccccc1)c1ccc(C)cc21 |t:9|

BDBM24007

COc1ccc(cc1)C1=NNC2(S1)C(=O)N(Cc1ccccc1)c1ccccc21 |t:9|

BDBM24009

COc1ccc(cc1)C1=NNC2(S1)C(=O)N(c1ccc(C)cc21)c1ccccc1C |t:9|

BDBM13080

COc1ccc(cc1)S(=O)(=O)N(CC(C)C)CC(=O)NO

BDBM50209097

COc1ccc(cc1)S(=O)(=O)N(CCCCCNC(=O)CCCCC(=O)NCCNC(=O)CCN(CCNC(=O)OC(C)(C)C)CCC(=O)NCCNC(=O)CCCCC(=O)NCCCCCN([C@H](CO)C(=O)NO)S(=O)(=O)c1ccc(OC)cc1)[C@H](CO)C(=O)NO |r|

BDBM50332946

COc1ccc(cc1)S(=O)(=O)N(CCO)CC(=O)NO

BDBM50332945

COc1ccc(cc1)S(=O)(=O)N(CCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)CC(=O)NO |r|

BDBM50332947

COc1ccc(cc1)S(=O)(=O)N(C[C@H](O)CO)CC(=O)NO |r|

BDBM50332948

COc1ccc(cc1)S(=O)(=O)N(C[C@H](O)CO)[C@H](CO)C(=O)NO |r|

BDBM11337

COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)C(C)C(=O)NO

BDBM13123

COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)[C@@H](C(=O)NO)c1ccccc1 |r|

BDBM11343

COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)[C@@H](C(C)C)C(=O)NO |r|

BDBM13118

COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)[C@@H](C)C(=O)NO |r|

BDBM13126

COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)[C@H](C(C)C)C(=O)NO |r|

BDBM13119

COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)[C@H](C)C(=O)NO |r|

BDBM50068850

COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)[C@H](C1CCCC1)C(=O)NO

BDBM50068854

COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)[C@H](C1CCNCC1)C(=O)NO

BDBM13122

COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)[C@H](CC(C)C)C(=O)NO |r|

BDBM50068852

COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)[C@H](CCCCNC(=O)Oc1ccccc1)C(=O)NO

BDBM50068847

COc1ccc(cc1)S(=O)(=O)N(Cc1ccccn1)[C@@H](C(C)C)C(=O)NO

BDBM50068853

COc1ccc(cc1)S(=O)(=O)N(Cc1ccccn1)[C@H](C(C)C)C(=O)NO

BDBM50068849

COc1ccc(cc1)S(=O)(=O)N(Cc1ccccn1)[C@H](CC(C)C)C(=O)NO

BDBM8465

COc1ccc(cc1)S(=O)(=O)N(Cc1cccnc1)[C@H](C(C)C)C(=O)NO |r|

BDBM50361599

COc1ccc(cc1)S(=O)(=O)N1CC(=O)N(O)C(=O)[C@H]1C(C)C |r|

BDBM50137276

COc1ccc(cc1)S(=O)(=O)N1CCc2cc(O)c(OC)cc2C1C(=O)NO

BDBM50137286

COc1ccc(cc1)S(=O)(=O)N1CCc2cc(O)ccc2C1C(=O)NO

BDBM50137283

COc1ccc(cc1)S(=O)(=O)N1CCc2cc(OCc3ccccc3)ccc2C1C(=O)NO

BDBM11328

COc1ccc(cc1)S(=O)(=O)NCC(=O)NO

BDBM50332949

COc1ccc(cc1)S(=O)(=O)N[C@H](CO)C(=O)NO |r|

BDBM50332950

COc1ccc(cc1)S(=O)(=O)N[C@H]([C@@H](C)O)C(=O)NO |r|

BDBM50299068

COc1ccc(cc1)S(=O)(=O)c1ccccc1C(=O)NO

BDBM50299053

COc1ccc(cc1)S(=O)(=O)c1ccccc1CC(=O)NO

BDBM50299069

COc1ccc(cc1)S(=O)(=O)c1ccccc1CC(O)=O

BDBM50270673

COc1ccc2nc[nH]c2c1

BDBM50227578

COc1cccc(COC(=O)c2cccc(=O)[nH]2)c1

BDBM50227568

COc1cccc(COC(=O)c2cccc(=S)[nH]2)c1

BDBM120210

COc1cccc(c1)-c1ccc(CCC(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(N)=O)cc1 |r|

BDBM50458768

COc1cccc2cc(oc12)C(=O)NCNC(=O)CCN(O)C=O

BDBM50458769

COc1cccc2cc(oc12)C(=O)NCNC(=O)[C@@H](CN(O)C=O)Cc1ccccc1 |r|

BDBM50419626

CS(=O)(=O)N1CCC(CC1)NC(=O)c1ccc(Oc2ccc(cc2)C#C[C@]2(O)CN3CCC2CC3)cc1 |r,wU:26.28,wD:26.27,(-10.6,4.16,;-9.26,4.93,;-10.04,6.26,;-8.49,6.27,;-7.92,4.14,;-6.58,4.9,;-5.25,4.12,;-5.26,2.58,;-6.6,1.81,;-7.93,2.6,;-3.93,1.81,;-2.59,2.57,;-2.59,4.12,;-1.26,1.8,;.08,2.56,;1.41,1.78,;1.4,.25,;2.73,-.53,;4.07,.23,;4.08,1.77,;5.42,2.53,;6.75,1.75,;6.74,.22,;5.41,-.55,;8.08,2.51,;9.42,3.27,;10.73,4.06,;10.72,2.54,;10.71,5.58,;12.02,6.36,;14.15,5.94,;14.18,3.76,;12.05,3.32,;13.35,4.09,;13.33,5.6,;.07,-.52,;-1.26,.25,)|

BDBM50299066

CS(=O)c1ccc(Oc2ccc(cc2)S(=O)(=O)c2ccccc2C(=O)NO)cc1

BDBM50606379

CSCC[C@H](N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)N1CCC[C@H]1C(N)=O |r|

BDBM50606383

CSCC[C@H](N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)N1CCC[C@H]1CC(N)=O |r|

BDBM50589870

CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)CC[C@H](NS(=O)(=O)c1ccc(Cl)c(c1)C(F)(F)F)C(O)=O)C(N)=O |r|

BDBM50589873

CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)CC[C@H](NS(=O)(=O)c1ccc(Cl)c(c1)C(F)(F)F)C(O)=O)C(N)=O |r|

BDBM50606373

CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCCNS(=O)(=O)c1ccc(cc1)-c1ccccc1)C(=O)N1CCC[C@H]1C(N)=O |r|

BDBM50606378

CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCCS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)N1CCC[C@H]1C(N)=O |r|

BDBM50606377

CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)N1CCC[C@H]1C(N)=O |r|

BDBM50606372

CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCCNS(=O)(=O)c1ccc(cc1)-c1ccccc1)C(=O)N1CCC[C@H]1C(N)=O |r|

BDBM50606376

CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCNS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)N1CCC[C@H]1C(N)=O |r|

BDBM50606371

CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CCNS(=O)(=O)c1ccc(cc1)-c1ccccc1)C(=O)N1CCC[C@H]1C(N)=O |r|

BDBM50606375

CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CNS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)N1CCC[C@H]1C(N)=O |r|

BDBM50606370

CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CNS(=O)(=O)c1ccc(cc1)-c1ccccc1)C(=O)N1CCC[C@H]1C(N)=O |r|

BDBM50300470

CSc1ccc(cc1)-c1ccc(CCC(O)CC(O)=O)cc1

BDBM26789

CSc1nc2ccccc2n1Cc1ccc(cc1)C(=O)N[C@@H]1CN(C[C@@H]1C(=O)NO)C(=O)OC(C)(C)C |r|

BDBM50131661

C[C@@H](C[C@@H](CO)NC(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO

BDBM50131660

C[C@@H](C[C@@H](COC(=O)CCC(O)=O)NC(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO

BDBM50238242

C[C@@H](Cc1ccc(cc1)C(F)(F)F)C(=O)NC[C@]1(NC(=O)NC1=O)C1CC1 |r|

BDBM50104718

C[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NC1=NN=C(CS1)c1ccc(Br)cc1 |c:18,t:16|

BDBM50104716

C[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NC1=NN=C(CS1)c1ccc(C)cc1 |c:18,t:16|

BDBM50104710

C[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NC1=NN=C(CS1)c1ccc(Cl)cc1 |c:18,t:16|

BDBM50104717

C[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NC1=NN=C(CS1)c1ccc(F)cc1 |c:18,t:16|

BDBM50104709

C[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NC1=NN=C(CS1)c1ccc(cc1)C#N |c:18,t:16|

BDBM50386896

C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](COC(=O)\C=C\c3ccc(O)c(O)c3)O[C@@H](OCCc3ccc(O)c(O)c3)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O |r|

BDBM50365344

C[C@@](CCc1ccc(cc1)-c1ccccc1)(C(=O)NO)S(C)(=O)=O |r|

BDBM50168737

C[C@@]1(O)CCCN([C@H]1C(=O)NO)S(=O)(=O)c1ccc(OCc2ccc(F)cc2Cl)cc1

BDBM194638

C[C@H](Cc1ccc(cc1)C(F)(F)F)C(=O)NC[C@]1(NC(=O)NC1=O)C1CC1 |r|

BDBM120227

C[C@H](NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|

BDBM50426080

C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1)CP(O)(=O)c1ccc(Br)cc1)C(N)=O |r|

BDBM50426079

C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1cc(no1)-c1ccccc1)CP(O)(=O)c1ccc(Br)cc1)C(N)=O |r|

BDBM120175

C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1ccccc1)C(N)=O |r|

BDBM120217

C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1)C(N)=O |r|

BDBM120198

C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccccc1)C(N)=O |r|

BDBM120236

C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccs1)C(N)=O |r|

BDBM50505154

C[C@H](NC(=O)[C@H](Cc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1)CP(O)(=O)c1ccc(Br)cc1)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|

BDBM50530230

C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)COCCOCCNC(=O)CCOCCOCCOCCNC(=O)CCc1ccc(cc1)\C(\C=C\C1=[N+](CCCCS(O)(=O)=O)c2ccc3c(cc(cc3c2C1(C)C)S(O)(=O)=O)S(O)(=O)=O)=C/C=C1/N(CCCCS(O)(=O)=O)c2ccc3c(cc(cc3c2C1(C)C)S(O)(=O)=O)S([O-])(=O)=O)P(O)(=O)C[C@@H](CCc1ccccc1)C(O)=O |r,c:54|

BDBM50104706

C[C@H](NS(=O)(=O)Cc1ccccc1)C(=O)NC1=NN=C(CS1)c1ccc(Cl)cc1 |c:19,t:17|

BDBM50104705

C[C@H](NS(=O)(=O)c1ccccc1)C(=O)NC1=NN=C(CS1)C12CC3CC(CC(C3)C1)C2 |r,c:18,t:16,TLB:18:21:24.23.28:26,THB:22:23:26:30.21.29,22:21:24.23.28:26,29:21:24:28.27.26,29:27:24:30.22.21|

BDBM50104722

C[C@H](NS(=O)(=O)c1ccccc1)C(=O)NC1=NN=C(CS1)c1ccc(Br)cc1 |c:18,t:16|

BDBM50104712

C[C@H](NS(=O)(=O)c1ccccc1)C(=O)NC1=NN=C(CS1)c1ccc(C)cc1 |c:18,t:16|

BDBM50104721

C[C@H](NS(=O)(=O)c1ccccc1)C(=O)NC1=NN=C(CS1)c1ccc(Cl)cc1 |c:18,t:16|

BDBM50104711

C[C@H](NS(=O)(=O)c1ccccc1)C(=O)NC1=NN=C(CS1)c1ccc(Cl)s1 |c:18,t:16|

BDBM50104704

C[C@H](NS(=O)(=O)c1ccccc1)C(=O)NC1=NN=C(CS1)c1ccc(F)cc1 |c:18,t:16|

BDBM50104707

C[C@H](NS(=O)(=O)c1ccccc1)C(=O)NC1=NN=C(CS1)c1ccc(cc1)C#N |c:18,t:16|

BDBM50104715

C[C@H](NS(=O)(=O)c1ccccc1)C(=O)NC1=NN=C(CS1)c1ccc(cc1)C(F)(F)F |c:18,t:16|

BDBM50104714

C[C@H](NS(=O)(=O)c1cccs1)C(=O)NC1=NN=C(CS1)c1ccc(Cl)cc1 |c:17,t:15|

BDBM50033809

C[C@]1(CNC(=O)COc2ccc(Cl)cc2)NC(=O)NC1=O |r|

BDBM50437790

C[C@]1(CS(=O)(=O)N2CCC(CC2)Oc2ccc(Cl)cc2)NC(=O)NC1=O |r|

BDBM50437789

C[C@]1(CS(=O)(=O)N2CCC(CC2)Oc2ccc(F)cc2)NC(=O)NC1=O |r|

BDBM50437787

C[C@]1(CS(=O)(=O)N2CCC(CC2)Oc2ccc(OC(F)(F)F)cc2)NC(=O)NC1=O |r|

BDBM50437791

C[C@]1(CS(=O)(=O)N2CCC(CC2)Oc2ccc(cc2)C(F)(F)F)NC(=O)NC1=O |r|

BDBM50301404

Cc1[nH]c(c(Br)c1Br)-c1nccc2[nH]c(N)nc12

BDBM50301403

Cc1[nH]c(cc1Br)-c1nccc2[nH]c(N)nc12

BDBM26562

Cc1[nH]c2ccccc2c1Cc1ccc(cc1)C(=O)N[C@@H]1CCOC[C@@H]1C(=O)NO |r|

BDBM26561

Cc1[nH]c2ccccc2c1Cc1ccc(cc1)C(=O)N[C@@H]1CN(CC#C)C[C@@H]1C(=O)NO |r|

BDBM26560

Cc1[nH]c2ccccc2c1Cc1ccc(cc1)C(=O)N[C@@H]1CNC[C@@H]1C(=O)NO |r|

BDBM50301409

Cc1c(Br)[nH]c(c1Br)-c1nccc2[nH]c(N)nc12

BDBM50386429

Cc1c2CC[C@H](NC(=O)c3cc(nc4c(F)cnn34)C(=O)NCc3ccc(F)c(c3)C(F)(F)F)c2ccc1C(O)=O |r|

BDBM50386430

Cc1c2CC[C@H](NC(=O)c3cc(nc4ccnn34)C(=O)NCc3ccc4OCC(=O)Nc4c3)c2ccc1C(O)=O |r|

BDBM50264772

Cc1cc(=O)c(O)c(o1)C(=O)NCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1

BDBM256500

Cc1cc(CNC(=O)c2cc(ncn2)C(=O)NCc2ccc(cc2)C(O)=O)ccc1F

BDBM475576

Cc1cc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)c[n+]([O-])c1

BDBM475577

Cc1cc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)cc[n+]1[O-]

BDBM475517

Cc1cc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)ccn1

BDBM50215993

Cc1cc(COc2ccc(cc2)C(=O)NC(C)(C)Cc2n[nH]c(=S)[nH]2)c2ccccc2n1

BDBM50216007

Cc1cc(COc2ccc(cc2)C(=O)NC2(Cc3n[nH]c(=S)[nH]3)CCN(CC2)C(=O)OC(C)(C)C)c2ccccc2n1

BDBM50216004

Cc1cc(COc2ccc(cc2)C(=O)NC2(Cc3n[nH]c(=S)[nH]3)CCOCC2)c2ccccc2n1

BDBM50195907

Cc1cc(COc2ccc(cc2)C(=O)NC2CN(CC22C(=O)NC(=O)NC2=O)C(=O)C(C)(C)C)c2ccccc2n1 |w:15.15|

BDBM50195897

Cc1cc(COc2ccc(cc2)C(=O)NC2CN(CC22C(=O)NC(=O)NC2=O)C(=O)OC(C)(C)C)c2ccccc2n1 |w:15.15|

BDBM50195917

Cc1cc(COc2ccc(cc2)C(=O)NC2CN(CC22C(=O)NC(=O)NC2=O)C(=O)c2cccnc2)c2ccccc2n1 |w:15.15|

BDBM50195921

Cc1cc(COc2ccc(cc2)C(=O)NC2CN(CC22C(=O)NC(=O)NC2=O)S(C)(=O)=O)c2ccccc2n1 |w:15.15|

BDBM50195909

Cc1cc(COc2ccc(cc2)C(=O)NC2COCC22C(=O)NC(=O)NC2=O)c2ccccc2n1 |w:15.15|

BDBM50195906

Cc1cc(COc2ccc(cc2)C(=O)NCC2(C)C(=O)NC(=O)NC2=O)c2ccccc2n1

BDBM50201248

Cc1cc(COc2ccc(cc2)C(=O)NCC2(C)NC(=O)NC2=O)c2ccccc2n1

BDBM50195914

Cc1cc(COc2ccc(cc2)C(=O)NCC2(C3CCN(CC3)C(=O)C(C)(C)C)C(=O)NC(=O)NC2=O)c2ccccc2n1

BDBM50195928

Cc1cc(COc2ccc(cc2)C(=O)NCC2(C3CCN(CC3)C(=O)OC(C)(C)C)C(=O)NC(=O)NC2=O)c2ccccc2n1

BDBM50195915

Cc1cc(COc2ccc(cc2)C(=O)NCC2(C3CCN(CC3)C3CCOCC3)C(=O)NC(=O)NC2=O)c2ccccc2n1

BDBM50195895

Cc1cc(COc2ccc(cc2)C(=O)NCC2(C3CCN(CC3)S(C)(=O)=O)C(=O)NC(=O)NC2=O)c2ccccc2n1

BDBM50195911

Cc1cc(COc2ccc(cc2)C(=O)NCC2(C3CCNCC3)C(=O)NC(=O)NC2=O)c2ccccc2n1

BDBM50195899

Cc1cc(COc2ccc(cc2)C(=O)NCC2(Cc3ccccc3)C(=O)NC(=O)NC2=O)c2ccccc2n1

BDBM50195896

Cc1cc(COc2ccc(cc2)C(=O)NCC2(N3CCN(CC#C)CC3)C(=O)NC(=O)NC2=O)c2ccccc2n1

BDBM50195903

Cc1cc(COc2ccc(cc2)C(=O)NCC2(N3CCN(CC3)C(=O)C(C)(C)C)C(=O)NC(=O)NC2=O)c2ccccc2n1

BDBM50195908

Cc1cc(COc2ccc(cc2)C(=O)NCC2(N3CCN(CC3)C(=O)c3cccnc3)C(=O)NC(=O)NC2=O)c2ccccc2n1

BDBM50195898

Cc1cc(COc2ccc(cc2)C(=O)NCC2(N3CCN(CC3)S(C)(=O)=O)C(=O)NC(=O)NC2=O)c2ccccc2n1

BDBM50195920

Cc1cc(COc2ccc(cc2)C(=O)NCC2(N3CCN(Cc4ccccc4)CC3)C(=O)NC(=O)NC2=O)c2ccccc2n1

BDBM50195923

Cc1cc(COc2ccc(cc2)C(=O)NCC2(NC(=O)OC(C)(C)C)C(=O)NC(=O)NC2=O)c2ccccc2n1

BDBM50215997

Cc1cc(COc2ccc(cc2)C(=O)NCCc2n[nH]c(=S)[nH]2)c2ccccc2n1

BDBM50208345

Cc1cc(COc2ccc(cc2)C(=O)NCc2n[nH]c(=O)[nH]2)c2ccccc2n1

BDBM50215990

Cc1cc(COc2ccc(cc2)C(=O)NCc2n[nH]c(=S)[nH]2)c2ccccc2n1

BDBM50215996

Cc1cc(COc2ccc(cc2)C(=O)N[C@@H]2CCC[C@@H]2c2n[nH]c(=S)[nH]2)c2ccccc2n1

BDBM50216009

Cc1cc(COc2ccc(cc2)C(=O)N[C@@H]2CCNC[C@@H]2c2n[nH]c(=S)[nH]2)c2ccccc2n1

BDBM50216002

Cc1cc(COc2ccc(cc2)C(=O)N[C@@H]2CCOC[C@@H]2c2n[nH]c(=S)[nH]2)c2ccccc2n1

BDBM50216001

Cc1cc(COc2ccc(cc2)C(=O)N[C@@H]2CN(CC#C)CC[C@@H]2c2n[nH]c(=S)[nH]2)c2ccccc2n1

BDBM50229322

Cc1cc(COc2ccc(cc2)C(=O)N[C@@H]2CN(CC#C)C[C@@H]2C(=O)NO)c2ccccc2n1 |r|

BDBM50215992

Cc1cc(COc2ccc(cc2)C(=O)N[C@@H]2CN(CC[C@@H]2c2n[nH]c(=S)[nH]2)C(=O)OC(C)(C)C)c2ccccc2n1

BDBM50215994

Cc1cc(COc2ccc(cc2)C(=O)N[C@@H]2CN(CC[C@@H]2c2n[nH]c(=S)[nH]2)S(C)(=O)=O)c2ccccc2n1

BDBM50215998

Cc1cc(COc2ccc(cc2)C(=O)N[C@@H]2CN(C[C@@H]2c2n[nH]c(=S)[nH]2)C(=O)OC(C)(C)C)c2ccccc2n1

BDBM50216008

Cc1cc(COc2ccc(cc2)C(=O)N[C@@H]2CNCC[C@@H]2c2n[nH]c(=S)[nH]2)c2ccccc2n1

BDBM50215999

Cc1cc(COc2ccc(cc2)C(=O)N[C@@H]2CNC[C@@H]2c2n[nH]c(=S)[nH]2)c2ccccc2n1

BDBM50208346

Cc1cc(COc2ccc(cc2)C(=O)N[C@H]2CN(C[C@@H]2c2n[nH]c(=O)[nH]2)C(=O)OC(C)(C)C)c2ccccc2n1

BDBM50208347

Cc1cc(COc2ccc(cc2)C(=O)Nc2ccccc2-c2[nH]c(=O)[nH]c2O)c2ccccc2n1

BDBM50208340

Cc1cc(COc2ccc(cc2)C(=O)Nc2ccccc2C(=O)c2c[nH]c(=O)[nH]2)c2ccccc2n1

BDBM50208344

Cc1cc(COc2ccc(cc2)C(=O)Nc2ccccc2Cc2c[nH]c(=O)[nH]2)c2ccccc2n1

BDBM50208343

Cc1cc(COc2ccc(cc2)C(=O)Nc2ccccc2Cc2n[nH]c(=O)[nH]2)c2ccccc2n1

BDBM50236675

Cc1cc(COc2ccc(cc2)S(=O)(=O)N2CCN(C(C2)C(=O)NO)C(=O)C(C)(C)C)c2CCCCc2n1

BDBM50208342

Cc1cc(COc2ccc(cc2)S(=O)(=O)NCC2(C)NC(=O)NC2=O)c2ccccc2n1

BDBM50208341

Cc1cc(COc2ccc(cc2)S(=O)(=O)NCc2n[nH]c(=O)[nH]2)c2ccccc2n1

BDBM50340754

Cc1cc(C[C@H](CCCCNCc2ccc(F)cc2)C(=O)NO)cc(C)c1F |r|

BDBM50329265

Cc1cc(N[C@H](CCCCNCc2ccc(F)cc2)C(=O)NO)cc(C)c1F |r|

BDBM50340768

Cc1cc(O[C@H](CCCCNCc2ccc(F)cc2)C(=O)NO)cc(C)c1F |r|

BDBM475597

Cc1cc(Sc2ccc(OCc3cccc(C)c3)cc2)c(o1)C1NC(=O)NC1=O

BDBM475596

Cc1cc(Sc2ccc(OCc3cccc(CO)c3)cc2)c(o1)C1NC(=O)NC1=O

BDBM50301408

Cc1cc([nH]c1Br)-c1nccc2[nH]c(N)nc12

BDBM605513

Cc1cc(\C=C\c2ccc(Oc3ccncc3C3NC(=O)NC3=O)cc2)ccn1

BDBM605512

Cc1cc(\C=C\c2ccc(Sc3ccncc3C3NC(=O)NC3=O)cc2)ccn1

BDBM605508

Cc1cc(\C=C\c2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)ccn1

BDBM605517

Cc1cc(\C=C\c2ccc(Sc3ccsc3C3NC(=O)NC3=O)cc2)ccn1

BDBM605519

Cc1cc(\C=C\c2ccc(Sc3cnn(C)c3C3NC(=O)NC3=O)cc2)ccn1

BDBM50305842

Cc1cc(cc(n1)C(=O)NCc1ccc(F)cc1)-c1nnn(C[C@H]2CC[C@@H](CC2)C(O)=O)n1 |r,wU:26.31,wD:23.24,(30.11,-12.24,;29.32,-10.92,;30.07,-9.57,;29.28,-8.26,;27.74,-8.27,;26.98,-9.62,;27.77,-10.94,;25.44,-9.64,;24.69,-10.98,;24.66,-8.31,;23.12,-8.33,;22.33,-7.01,;23.08,-5.67,;22.3,-4.34,;20.75,-4.36,;19.97,-3.04,;20,-5.72,;20.79,-7.03,;30.03,-6.91,;29.39,-5.51,;30.52,-4.46,;31.87,-5.21,;33.27,-4.57,;34.61,-5.32,;34.63,-6.85,;35.98,-7.6,;37.3,-6.81,;37.27,-5.26,;35.93,-4.52,;38.65,-7.56,;38.68,-9.1,;39.97,-6.77,;31.57,-6.73,)|

BDBM605514

Cc1cc(ccn1)C#Cc1ccc(Oc2ccncc2C2NC(=O)NC2=O)cc1

BDBM605511

Cc1cc(ccn1)C#Cc1ccc(Sc2ccncc2C2NC(=O)NC2=O)cc1

BDBM605455

Cc1cc(ccn1)C#Cc1ccc(Sc2ccoc2C2NC(=O)NC2=O)cc1

BDBM605516

Cc1cc(ccn1)C#Cc1ccc(Sc2ccsc2C2NC(=O)NC2=O)cc1

BDBM605518

Cc1cc(ccn1)C#Cc1ccc(Sc2cnn(C)c2C2NC(=O)NC2=O)cc1

BDBM50170210

Cc1ccc(COC(=O)NC(=O)c2cc(cs2)-c2ccc(OC(F)(F)F)cc2)cc1

BDBM50170203

Cc1ccc(COC(=O)NC(=O)c2cc(cs2)-c2ccc(cc2)-c2ccccc2)cc1

BDBM50170207

Cc1ccc(COC(=O)NC(=O)c2cc(cs2)-c2ccc(cc2)-c2ccccc2O)cc1

BDBM50227586

Cc1ccc(COC(=O)c2cccc(=O)[nH]2)cc1

BDBM50227582

Cc1ccc(COC(=O)c2cccc(=S)[nH]2)cc1

BDBM379557

Cc1ccc(Cl)cc1N1CCN(CC1)C(=O)CCC1(NC(=O)NC1=O)C1CC1

BDBM46421

Cc1ccc(Oc2ccc(cc2)C(=O)NCc2ccncc2)cc1

BDBM50152637

Cc1ccc(cc1)C1=N[C@@H](S)[C@@H](O1)C=C |t:8|

BDBM50137282

Cc1ccc(cc1)S(=O)(=O)N1CCc2cc(O)ccc2C1C(=O)NO

BDBM50137285

Cc1ccc(cc1)S(=O)(=O)N1CCc2cc(OCc3ccccc3)ccc2C1C(=O)NO

BDBM120242

Cc1ccc(s1)-c1ccc(CCC(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(N)=O)cc1 |r|

BDBM92447

Cc1ccc(s1)-c1ccc(CCC(=O)N[C@@H](CCC(O)=O)C(N)=O)cc1 |r|

BDBM50270676

Cc1ccc2OCC(=O)Nc2c1

BDBM50227572

Cc1cccc(COC(=O)c2cccc(=S)[nH]2)c1

BDBM475578

Cc1cccc(COc2ccc(Sc3ccoc3C3(C)NC(=O)NC3=O)cc2)c1

BDBM475575

Cc1cccc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)[n+]1O

BDBM475392

Cc1cccc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)n1

BDBM475389

Cc1ccnc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)c1

BDBM120257

Cc1ccsc1-c1ccc(CCC(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(N)=O)cc1 |r|

BDBM475418

Cc1cncc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)c1

BDBM120245

Cc1csc(c1)-c1ccc(CCC(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(N)=O)cc1 |r|

BDBM50270675

Cc1nc(cs1)-c1ccc2NC(=O)CCc2c1

BDBM120186

Cc1nc(no1)-c1ccc(CCC(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(N)=O)cc1 |r|

BDBM26791

Cc1nc2ccccc2n1Cc1ccc(cc1)C(=O)N[C@@H]1CN(C[C@@H]1C(=O)NO)C(=O)OC(C)(C)C |r|

BDBM26568

Cc1nc2ccccn2c1Cc1ccc(cc1)C(=O)N[C@@H]1CCOC[C@@H]1C(=O)NO |r|

BDBM26564

Cc1oc2ccccc2c1Cc1ccc(cc1)C(=O)N[C@@H]1CCOC[C@@H]1C(=O)NO |r|

BDBM26565

Cc1oc2ccccc2c1Cc1ccc(cc1)C(=O)N[C@@H]1CNC[C@@H]1C(=O)NO |r|

BDBM50575718

Clc1cc(Cl)cc(c1)N1CCN(CC1)C(=O)CC[C@H]1NC(=O)NC1=O |r|

BDBM50227571

Clc1ccc(COC(=O)c2cccc(=O)[nH]2)cc1

BDBM50227556

Clc1ccc(COC(=O)c2cccc(=S)[nH]2)cc1

BDBM153386

Clc1ccc(NC(=S)NNC(=O)c2cc(Br)c(Br)[nH]2)cc1

BDBM50441574

Clc1ccc(OCC(=O)NNC(=S)NCCCCC2CCCCC2)cc1

BDBM50227589

Clc1cccc(COC(=O)c2cccc(=O)[nH]2)c1

BDBM50227554

Clc1ccccc1COC(=O)c1cccc(=O)[nH]1

BDBM50215932

Cn1c(Br)c(Br)cc1-c1nccc2[nH]c(N)nc12

BDBM153389

Cn1c(Br)c(Br)cc1C(=O)NNC(=O)Nc1ccco1

BDBM153388

Cn1c(Br)c(Br)cc1C(=O)NNC(=S)Nc1ccccc1F

BDBM50215934

Cn1c(N)nc2c(nccc12)-c1cc(Br)c(Br)[nH]1

BDBM50265079

Cn1c2ccc(cc2c(=O)n(Cc2ccc(cc2)C(O)=O)c1=O)C#CCc1ccccc1

BDBM50270674

Cn1cc2CSc3ccc(Cl)cc3-c2n1

BDBM120185

Cn1ccc(n1)-c1ccc(CCC(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(N)=O)cc1 |r|

BDBM50238241

FC(F)(F)c1ccc(CCC(=O)NC[C@]2(NC(=O)NC2=O)C2CC2)cc1 |r|

BDBM50371234

FC(F)(F)c1ccc(COC(=O)c2cccc(=O)[nH]2)cc1

BDBM50227544

FC(F)(F)c1ccc(COC(=O)c2cccc(=S)[nH]2)cc1

BDBM194644

FC(F)(F)c1ccc(C[C@@H](C2CC2)C(=O)NC[C@]2(NC(=O)NC2=O)C2CC2)cc1 |r|

BDBM50238243

FC(F)(F)c1ccc2oc(cc2c1)C(=O)NC[C@]1(NC(=O)NC1=O)C1CC1 |r|

BDBM50227549

FC(F)(F)c1cccc(COC(=O)c2cccc(=O)[nH]2)c1

BDBM50227535

FC(F)(F)c1cccc(COC(=O)c2cccc(=S)[nH]2)c1

BDBM50227562

Fc1c(F)c(F)c(COC(=O)c2cccc(=O)[nH]2)c(F)c1F

BDBM50227580

Fc1cc(F)c(COC(=O)c2cccc(=O)[nH]2)c(F)c1

BDBM50227548

Fc1cc(F)c(COC(=O)c2cccc(=O)[nH]2)cc1F

BDBM50227592

Fc1cc(F)c(COC(=O)c2cccc(=S)[nH]2)cc1F

BDBM50227534

Fc1cc(F)cc(COC(=O)c2cccc(=O)[nH]2)c1

BDBM50227557

Fc1ccc(COC(=O)c2cccc(=O)[nH]2)cc1

BDBM50227527

Fc1ccc(COC(=O)c2cccc(=S)[nH]2)cc1

BDBM50227547

Fc1ccc(F)c(COC(=O)c2cccc(=O)[nH]2)c1

BDBM50227576

Fc1ccc(F)c(COC(=O)c2cccc(=S)[nH]2)c1

BDBM50227585

Fc1cccc(COC(=O)c2cccc(=O)[nH]2)c1

BDBM50227528

Fc1cccc(COC(=O)c2cccc(=S)[nH]2)c1

BDBM50227604

Fc1cccc(F)c1COC(=O)c1cccc(=O)[nH]1

BDBM50227531

Fc1cccc(F)c1COC(=O)c1cccc(=S)[nH]1

BDBM50227552

Fc1ccccc1COC(=O)c1cccc(=O)[nH]1

BDBM120218

NC(=O)C(Cc1cnc[nH]1)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1 |r|

BDBM27878

NC(=O)CC1CCCc2sc3nc([nH]c(=O)c3c12)C(=O)NCc1ccc2OCC(=O)Nc2c1

BDBM120172

NC(=O)CC[C@H](NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|

BDBM120249

NC(=O)CC[C@H](NC(=O)CCc1ccc(cc1)-c1cc(cs1)-c1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|

BDBM120174

NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1ccccc1)C(N)=O |r|

BDBM120173

NC(=O)CC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1ccccc1)C(N)=O |r|

BDBM120250

NC(=O)CC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cc(cs1)-c1ccccc1)C(N)=O |r|

BDBM120213

NC(=O)CC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1)C(N)=O |r|

BDBM120232

NC(=O)CC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccs1)C(N)=O |r|

BDBM50278364

NC(=O)CC[C@H](NS(=O)(=O)c1ccc(cc1)[N+]([O-])=O)C(O)=O |r|

BDBM50104974

NC(=O)CNC(=O)[C@@H]1CCCCNC(=O)OCCC[C@@H]([C@@H](Cc2ccc(cc2)-c2ccccc2C(F)(F)F)C(=O)N1)C(=O)NO

BDBM50333939

NC(=O)C[C@@H](NC(=O)c1cc(c(F)s1)-c1ccc(OC(F)(F)F)cc1)c1ccccc1 |r|

BDBM120159

NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@@H](CCC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1 |r|

BDBM50592891

NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@@H](Cc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1)CP(O)(=O)c1ccc(Br)cc1 |r|

BDBM92441

NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)C(Cc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1)CP(O)(=O)c1ccc(Br)cc1 |r|

BDBM120157

NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1 |r|

BDBM92443

NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cc(cs1)-c1ccccc1 |r|

BDBM120162

NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1 |r|

BDBM120171

NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1ccccc1 |r|

BDBM120160

NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1 |r|

BDBM120252

NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cc(cs1)-c1ccccc1 |r|

BDBM120215

NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1 |r|

BDBM120196

NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccccc1 |r|

BDBM120234

NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccs1 |r|

BDBM120156

NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1 |r|

BDBM120167

NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cc(no1)-c1ccccc1 |r|

BDBM92445

NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cc(cs1)-c1ccccc1 |r|

BDBM92448

NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1 |r|

BDBM92449

NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(s1)-c1ccccc1 |r|

BDBM120158

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](CCC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1 |r|

BDBM50592892

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccccc1 |r|

BDBM120161

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1 |r|

BDBM120169

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1ccccc1 |r|

BDBM120251

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)CCc1ccc(cc1)-c1cc(cs1)-c1ccccc1 |r|

BDBM120225

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1 |r|

BDBM120155

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1 |r|

BDBM120166

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cc(no1)-c1ccccc1 |r|

BDBM120177

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cc(on1)-c1ccccc1 |r|

BDBM120181

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(COc2ccccc2)cc1 |r|

BDBM120183

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(I)cc1 |r|

BDBM120180

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(Oc2ccccc2)cc1 |r|

BDBM120209

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cc(Cl)cc(Cl)c1 |r|

BDBM120246

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cc(cs1)-c1ccccc1 |r|

BDBM120212

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1 |r|

BDBM120243

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(s1)-c1ccccc1 |r|

BDBM120244

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(s1)-c1nc2ccccc2s1 |r|

BDBM120211

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccc(CO)c1 |r|

BDBM120208

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccc(Cl)c1 |r|

BDBM120204

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccc(N)c1 |r|

BDBM120205

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccc(O)c1 |r|

BDBM120207

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccc(c1)C(O)=O |r|

BDBM120231

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccs1 |r|

BDBM120184

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ncccn1 |r|

BDBM120182

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)C#Cc1ccccc1 |r|

BDBM120176

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cn(nn1)-c1ccccc1 |r|

BDBM120179

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1csc(n1)-c1ccccc1 |r|

BDBM120178

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1noc(n1)-c1ccccc1 |r|

BDBM120258

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](CC(O)=O)Cc1ccc(cc1)-c1cc(cs1)-c1ccccc1 |r|

BDBM50265078

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1)CP(O)(=O)c1ccc(Br)cc1 |r|

BDBM50426081

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1cc(no1)-c1ccccc1)CP(O)(=O)c1ccc(Br)cc1 |r|

BDBM120253

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCOC=O)NC(=O)CCc1ccc(cc1)-c1cc(cs1)-c1ccccc1 |r|

BDBM120229

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CO)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1 |r|

BDBM120226

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1 |r|

BDBM120255

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CCc1ccc(cc1)-c1cc(cs1)-c1ccccc1 |r|

BDBM120228

NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1 |r|

BDBM92446

NC(=O)[C@H](CCC(O)=O)NC(=O)c1ccc(cc1)-c1cc(cs1)-c1ccccc1 |r|

BDBM120164

NC(=O)[C@H](CCCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1 |r|

BDBM120254

NC(=O)[C@H](CCCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cc(cs1)-c1ccccc1 |r|

BDBM120165

NC(=O)[C@H](CCCC(O)=O)NC(=O)[C@H](CCCOC=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1 |r|

BDBM120219

NC(=O)[C@H](CO)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1 |r|

BDBM120200

NC(=O)[C@H](CO)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccccc1 |r|

BDBM120238

NC(=O)[C@H](CO)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccs1 |r|

BDBM120216

NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1 |r|

BDBM120197

NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccccc1 |r|

BDBM120235

NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccs1 |r|

BDBM120199

NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccccc1 |r|

BDBM120237

NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccs1 |r|

BDBM475598

NC(=O)c1cc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)ccn1

BDBM475588

NC(=O)c1ccc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)cc1

BDBM475587

NC(=O)c1cccc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)c1

BDBM50592914

NC1CCCCC1NC(=O)P(O)(O)=O

BDBM120224

NCCCC[C@H](NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|

BDBM120214

NCCCC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1)C(N)=O |r|

BDBM120195

NCCCC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccccc1)C(N)=O |r|

BDBM120233

NCCCC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccs1)C(N)=O |r|

BDBM50239952

NCCNS(=O)(=O)c1ccc(cc1)-c1ccc(CSc2nc3CCCc3c(=O)[nH]2)cc1

BDBM50372742

N[C@@H]1CCCC[C@H]1NC(=O)P(O)(O)=O

BDBM50234465

N[C@H]1CCCC[C@H]1NC(=O)P(O)(O)=O |r|

BDBM27877

Nc1c(N2CCc3ccc(CNC(=O)c4nc5sc6CS(=O)(=O)CCc6c5c(=O)[nH]4)cc3C2)c(=O)c1=O

BDBM50137277

Nc1ccc(cc1)S(=O)(=O)N1CCc2cc(O)ccc2C1C(=O)NO

BDBM50301400

Nc1nc2c(nccc2[nH]1)-c1[nH]c(Br)c(Br)c1Br

BDBM50301420

Nc1nc2c(nccc2[nH]1)-c1[nH]c(Br)c(Br)c1CCc1ccccc1

BDBM50301419

Nc1nc2c(nccc2[nH]1)-c1[nH]c(Br)c(CCCc2ccccc2)c1Br

BDBM50301417

Nc1nc2c(nccc2[nH]1)-c1[nH]c(Br)c(CCc2ccc(cc2)C(F)(F)F)c1Br

BDBM50301416

Nc1nc2c(nccc2[nH]1)-c1[nH]c(Br)c(CCc2cccc(c2)C(F)(F)F)c1Br

BDBM50301414

Nc1nc2c(nccc2[nH]1)-c1[nH]c(Br)c(CCc2ccccc2)c1Br

BDBM50301415

Nc1nc2c(nccc2[nH]1)-c1[nH]c(Br)c(CCc2ccccc2C(F)(F)F)c1Br

BDBM50301412

Nc1nc2c(nccc2[nH]1)-c1[nH]c(Br)c(Cc2ccccc2)c1Br

BDBM50215926

Nc1nc2c(nccc2[nH]1)-c1cc(Br)c(Br)[nH]1

BDBM50301402

Nc1nc2c(nccc2[nH]1)-c1cc(Br)c(Cl)[nH]1

BDBM50301407

Nc1nc2c(nccc2[nH]1)-c1cc(Br)c([nH]1)-c1ccc(cc1)-c1ccccc1

BDBM50301406

Nc1nc2c(nccc2[nH]1)-c1cc(Br)c([nH]1)-c1cccc(c1)-c1ccccc1

BDBM50301405

Nc1nc2c(nccc2[nH]1)-c1cc(Br)c([nH]1)-c1ccccc1

BDBM50215928

Nc1nc2c(nccc2[nH]1)-c1cc(Br)c[nH]1

BDBM50301418

Nc1nc2c(nccc2[nH]1)-c1cc(CCCc2ccccc2)c(Br)[nH]1

BDBM50301413

Nc1nc2c(nccc2[nH]1)-c1cc(CCc2ccccc2)c(Br)[nH]1

BDBM50301411

Nc1nc2c(nccc2[nH]1)-c1cc(Cc2ccccc2)c(Br)[nH]1

BDBM50301401

Nc1nc2c(nccc2[nH]1)-c1cc(Cl)c(Cl)[nH]1

BDBM50301410

Nc1nc2c(nccc2[nH]1)-c1cc(c(Br)[nH]1)-c1ccccc1

BDBM50215930

Nc1nc2c(nccc2[nH]1)-c1ccc(Br)[nH]1

BDBM50215927

Nc1nc2c(nccc2[nH]1)-c1ccc[nH]1

BDBM50203959

O=C(Cc1n[nH]c(=O)[nH]1)N1CCN(CC1)c1cccc(CNC(=O)c2nc3ccccc3c(=O)[nH]2)c1

BDBM50215991

O=C(NCCCc1n[nH]c(=S)[nH]1)c1ccc(OCc2ccnc3ccccc23)cc1

BDBM50170209

O=C(NCCN1CCOCC1)c1cc(cs1)-c1ccc(cc1)-c1ccccc1

BDBM50170201

O=C(NCCN1CCOCC1)c1cc(cs1)-c1ccc(cc1)-c1ccncc1

BDBM50170208

O=C(NCCN1CCOCC1)c1cc(cs1)-c1ccc(cc1)C1CCCCC1

BDBM50203955

O=C(NCc1cccc(c1)-c1ccc(CS(=O)(=O)Cc2n[nH]c(=O)[nH]2)cc1)c1nc2ccccc2c(=O)[nH]1

BDBM50227567

O=C(OC1CCC1)c1cccc(=O)[nH]1

BDBM50227539

O=C(OC1CCC1)c1cccc(=S)[nH]1

BDBM50227583

O=C(OC1CCCCC1)c1cccc(=O)[nH]1

BDBM50227588

O=C(OC1CCCCC1)c1cccc(=S)[nH]1

BDBM50227559

O=C(OCCCCOc1ccccc1)c1cccc(=O)[nH]1

BDBM50227602

O=C(OCCCCOc1ccccc1)c1cccc(=S)[nH]1

BDBM50227542

O=C(OCCCc1ccccc1)c1cccc(=S)[nH]1

BDBM50227595

O=C(OCCOc1ccccc1)c1cccc(=O)[nH]1

BDBM50227541

O=C(OCCc1ccccc1)c1cccc(=O)[nH]1

BDBM50227599

O=C(OCCc1ccccc1)c1cccc(=S)[nH]1

BDBM50227587

O=C(OC\C=C\c1ccccc1)c1cccc(=O)[nH]1

BDBM50227532

O=C(OCc1ccc(Oc2ccccc2)cc1)c1cccc(=S)[nH]1

BDBM50227590

O=C(OCc1ccc(cc1)-c1ccccc1)c1cccc(=S)[nH]1

BDBM50227540

O=C(OCc1ccc2OCOc2c1)c1cccc(=O)[nH]1

BDBM50227574

O=C(OCc1cccc(Oc2ccccc2)c1)c1cccc(=O)[nH]1

BDBM50227575

O=C(OCc1cccc(Oc2ccccc2)c1)c1cccc(=S)[nH]1

BDBM50227553

O=C(OCc1cccc(c1)-c1ccccc1)c1cccc(=O)[nH]1

BDBM50227601

O=C(OCc1cccc(c1)-c1ccccc1)c1cccc(=S)[nH]1

BDBM50227551

O=C(OCc1ccccc1)c1cccc(=O)[nH]1

BDBM50227533

O=C(OCc1ccccc1)c1cccc(=S)[nH]1

BDBM50234334

O=C(OCc1ccccc1)c1cn2c(cc(=O)n(Cc3ccccc3)c2=O)s1

BDBM50227545

O=C(Oc1ccc2ccccc2c1)c1cccc(=O)[nH]1

BDBM50227584

O=C(Oc1ccc2ccccc2c1)c1cccc(=S)[nH]1

BDBM50227555

O=C(Oc1cccc2ccccc12)c1cccc(=O)[nH]1

BDBM50227543

O=C(Oc1cccc2ccccc12)c1cccc(=S)[nH]1

BDBM50227529

O=C(Oc1ccco1)c1cccc(=O)[nH]1

BDBM50227537

O=C(Oc1cccs1)c1cccc(=O)[nH]1

BDBM50227596

O=C(Oc1ccsc1)c1cccc(=O)[nH]1

BDBM50227561

O=C(Oc1ccsc1)c1cccc(=S)[nH]1

BDBM50203954

OC(=O)C1CCCCN1S(=O)(=O)CCCOc1cccc(CNC(=O)c2nc3ccccc3c(=O)[nH]2)c1

BDBM29023

OC(=O)C1[C@@H]2OC[C@H](CN1Cc1ccc(cc1)-c1ccccc1)O2 |r|

BDBM50300476

OC(=O)CC(=O)CCc1ccc(cc1)-c1ccccc1

BDBM50180606

OC(=O)CC(CC1CCCC1)C(=O)c1ccc(cc1)C#Cc1ccccc1

BDBM50180604

OC(=O)CC(Cc1ccc(F)cc1)C(=O)c1ccc(cc1)C#Cc1ccccc1

BDBM50180602

OC(=O)CC(Cc1ccccc1)C(=O)c1ccc(cc1)C#Cc1ccccc1

BDBM50180605

OC(=O)CCC(=O)c1ccc(cc1)C#CCOCc1ccccc1

BDBM120256

OC(=O)CC[C@H](NC(=O)CCc1ccc(cc1)-c1cc(cs1)-c1ccccc1)C(=O)Nc1cccc(CC(O)=O)c1 |r|

BDBM120221

OC(=O)CC[C@H](NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1)C(=O)N1CCCC(CC(O)=O)C1 |r|

BDBM120222

OC(=O)CC[C@H](NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1)C(=O)Nc1cccc(CC(O)=O)c1 |r|

BDBM120202

OC(=O)CC[C@H](NC(=O)CCc1ccc(cc1)-c1ccccc1)C(=O)N1CCCC(CC(O)=O)C1 |r|

BDBM120203

OC(=O)CC[C@H](NC(=O)CCc1ccc(cc1)-c1ccccc1)C(=O)Nc1cccc(CC(O)=O)c1 |r|

BDBM120240

OC(=O)CC[C@H](NC(=O)CCc1ccc(cc1)-c1cccs1)C(=O)N1CCCC(CC(O)=O)C1 |r|

BDBM120241

OC(=O)CC[C@H](NC(=O)CCc1ccc(cc1)-c1cccs1)C(=O)Nc1cccc(CC(O)=O)c1 |r|

BDBM50434220

OC(=O)CNS(=O)(=O)CCc1ccc(Cl)s1

BDBM50434223

OC(=O)CNS(=O)(=O)CCc1ccc(cc1)-c1ccccc1

BDBM50400562

OC(=O)CNS(=O)(=O)c1ccc(cc1)-c1ccccc1

BDBM50300473

OC(=O)CS(=O)(=O)CCc1ccc(cc1)-c1ccccc1

BDBM50300474

OC(=O)CS(=O)CCc1ccc(cc1)-c1ccccc1

BDBM50300475

OC(=O)CSCCc1ccc(cc1)-c1ccccc1

BDBM50333938

OC(=O)C[C@@H](NC(=O)c1cc(c(F)s1)-c1ccc(OC(F)(F)F)cc1)c1ccccc1 |r|

BDBM50333942

OC(=O)C[C@@H](NC(=O)c1cc(c(F)s1)-c1ccc(cc1)-c1ccncc1)c1ccccc1 |r|

BDBM50264813

OC(=O)C[C@@H](NC(=O)c1cc(cs1)-c1ccc(cc1)-c1ccncc1)c1ccccc1 |r|

BDBM50346324

OC(=O)Cc1ccc(CNC(=O)c2cc(cs2)-c2ccc(cc2)-c2ccccc2)cc1

BDBM50346325

OC(=O)Cc1ccc(CNC(=O)c2cc(cs2)-c2ccc(cc2)-c2ccccc2O)cc1

BDBM50427870

OC(=O)Cc1ccccc1S(=O)(=O)c1ccc(cc1)-c1ccc(F)cc1

BDBM50427869

OC(=O)Cc1ccccc1S(=O)(=O)c1ccc(cc1)-c1ccc(NC(=O)CF)cc1

BDBM50427868

OC(=O)Cc1ccccc1S(=O)(=O)c1ccc(cc1)-c1ccc(OCCF)cc1

BDBM50299061

OC(=O)Cc1ccccc1S(=O)(=O)c1ccc(cc1)-c1ccccc1

BDBM50170204

OC(=O)[C@@H](NC(=O)c1cc(cs1)-c1ccc(OC(F)(F)F)cc1)c1ccccc1

BDBM50434218

OC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)s1 |r|

BDBM29014

OC(=O)[C@@H]1O[C@H]2CN(Cc3ccc(cc3)-c3ccccc3)C(=O)[C@@H]1O2 |r|

BDBM29015

OC(=O)[C@@H]1O[C@H]2CN(Cc3ccc(cc3)-c3ccccc3)C[C@@H]1O2 |r|

BDBM29019

OC(=O)[C@@H]1O[C@H]2CN(Cc3ccccc3)C(=O)[C@@H]1O2 |r|

BDBM29020

OC(=O)[C@@H]1O[C@H]2CN(Cc3ccccc3)C[C@@H]1O2 |r|

BDBM50187430

OC(=O)[C@H](CCC(=O)NC1CCCCC1)NS(=O)(=O)c1ccc(cc1)-c1ccccc1 |r|

BDBM50187435

OC(=O)[C@H](CCC(=O)NCCc1ccccc1)NS(=O)(=O)c1ccc(cc1)-c1ccccc1 |r|

BDBM50187440

OC(=O)[C@H](CCC(=O)NCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)NS(=O)(=O)c1ccc(cc1)-c1ccccc1 |r|

BDBM50187452

OC(=O)[C@H](CCC(=O)NCc1ccc(F)cc1)NS(=O)(=O)c1ccc(cc1)-c1ccccc1 |r|

BDBM50187432

OC(=O)[C@H](CCC(=O)NCc1ccccc1)NS(=O)(=O)c1ccc(cc1)-c1ccccc1 |r|

BDBM50278363

OC(=O)[C@H](CCC(=O)NCc1ccccc1)NS(=O)(=O)c1ccc(cc1)[N+]([O-])=O |r|

BDBM50187443

OC(=O)[C@H](CCC(=O)NCc1ccccc1Cl)NS(=O)(=O)c1ccc(cc1)-c1ccccc1 |r|

BDBM50187431

OC(=O)[C@H](CCC(=O)Nc1ccccc1)NS(=O)(=O)c1ccc(cc1)-c1ccccc1 |r|

BDBM50589862

OC(=O)[C@H](CCc1ccccc1)NS(=O)(=O)c1ccc(Cl)c(c1)C(F)(F)F |r|

BDBM50170211

OC(=O)[C@H](NC(=O)c1cc(cs1)-c1ccc(OC(F)(F)F)cc1)c1ccccc1

BDBM50170205

OC(=O)[C@H](NC(=O)c1cc(cs1)-c1ccc(cc1)-c1ccncc1)c1ccccc1

BDBM50333937

OC(=O)[C@H]1CC[C@H](CNC(=O)c2cc(c(F)s2)-c2ccc(OC(F)(F)F)cc2)CC1 |r,wU:3.2,wD:6.6,(34.59,-15.9,;33.25,-15.15,;33.23,-13.61,;31.92,-15.94,;31.94,-17.48,;30.62,-18.26,;29.28,-17.5,;27.96,-18.29,;26.62,-17.54,;25.29,-18.33,;25.32,-19.87,;23.95,-17.58,;23.46,-16.12,;21.92,-16.14,;21.46,-17.61,;19.99,-18.09,;22.71,-18.5,;21.12,-14.82,;21.87,-13.47,;21.07,-12.16,;19.53,-12.19,;18.73,-10.87,;17.19,-10.91,;16.39,-9.59,;16.45,-12.26,;15.66,-10.75,;18.79,-13.55,;19.59,-14.86,;29.25,-15.97,;30.58,-15.18,)|

BDBM50333934

OC(=O)[C@H]1CC[C@H](CNC(=O)c2cc(cs2)-c2ccc(OC(F)(F)F)cc2)CC1 |r,wU:3.2,wD:6.6,(10.39,-2.44,;9.05,-1.69,;9.03,-.15,;7.72,-2.47,;7.74,-4.02,;6.42,-4.8,;5.08,-4.04,;3.76,-4.83,;2.41,-4.08,;1.09,-4.87,;1.11,-6.41,;-.26,-4.12,;-.75,-2.65,;-2.29,-2.68,;-2.75,-4.14,;-1.49,-5.03,;-3.08,-1.36,;-2.34,-.01,;-3.13,1.31,;-4.67,1.27,;-5.47,2.59,;-7.01,2.56,;-7.81,3.87,;-7.75,1.21,;-8.55,2.71,;-5.42,-.08,;-4.61,-1.39,;5.05,-2.51,;6.38,-1.72,)|

BDBM50333935

OC(=O)[C@H]1CC[C@H](CNC(=O)c2cc(ns2)-c2ccc(OC(F)(F)F)cc2)CC1 |r,wU:3.2,wD:6.6,(32.12,-2.91,;30.78,-2.15,;30.76,-.61,;29.45,-2.94,;29.47,-4.48,;28.15,-5.26,;26.81,-4.51,;25.49,-5.3,;24.14,-4.55,;22.82,-5.34,;22.84,-6.87,;21.47,-4.59,;20.98,-3.12,;19.45,-3.14,;18.98,-4.61,;20.24,-5.5,;18.65,-1.83,;19.39,-.48,;18.6,.84,;17.06,.81,;16.26,2.12,;14.72,2.09,;13.92,3.41,;13.98,.74,;13.18,2.24,;16.32,-.55,;17.12,-1.86,;26.78,-2.97,;28.11,-2.19,)|

BDBM50333936

OC(=O)[C@H]1CC[C@H](CNC(=O)c2cc(sn2)-c2ccc(OC(F)(F)F)cc2)CC1 |r,wU:3.2,wD:6.6,(10.57,-14.74,;9.23,-13.99,;9.21,-12.45,;7.9,-14.78,;7.91,-16.32,;6.6,-17.1,;5.26,-16.34,;3.93,-17.13,;2.59,-16.38,;1.27,-17.17,;1.29,-18.71,;-.08,-16.42,;-.57,-14.96,;-2.11,-14.98,;-2.57,-16.45,;-1.32,-17.34,;-2.9,-13.66,;-2.16,-12.31,;-2.95,-11,;-4.5,-11.03,;-5.29,-9.71,;-6.83,-9.75,;-7.63,-8.43,;-7.57,-11.1,;-8.37,-9.6,;-5.24,-12.39,;-4.44,-13.7,;5.22,-14.81,;6.55,-14.02,)|

BDBM50300480

OC(CCc1ccc(cc1)-c1cc2ccccc2o1)CC(O)=O

BDBM50300466

OC(CCc1ccc(cc1)-c1ccc(OCc2ccccc2)cc1)CC(O)=O

BDBM50300467

OC(CCc1ccc(cc1)-c1ccc(Oc2ccccc2)cc1)CC(O)=O

BDBM50300472

OC(CCc1ccc(cc1)-c1ccc(cc1)C#N)CC(O)=O

BDBM50300469

OC(CCc1ccc(cc1)-c1ccc-2c(Cc3ccccc-23)c1)CC(O)=O

BDBM50300468

OC(CCc1ccc(cc1)-c1ccc2c(c1)oc1ccccc21)CC(O)=O

BDBM50300481

OC(CCc1ccc(cc1)-c1cccc(c1)C#N)CC(O)=O

BDBM50300465

OC(CCc1ccc(cc1)-c1ccccc1)CC(O)=O

BDBM50300479

OC(CCc1ccc(cc1)-c1ccncc1)CC(O)=O

BDBM50049400

OC1C(=O)C(Oc2cc(O)cc(O)c12)c1ccc(O)c(O)c1

BDBM50386897

OC1C(=O)[C@H](Oc2cc(O)cc(O)c12)c1cc(O)c(O)c(O)c1 |r|

BDBM50180607

OCC#Cc1ccc(cc1)C(=O)CCC(O)=O

BDBM50332951

OCCN(CC(=O)NO)S(=O)(=O)c1ccc(F)cc1

BDBM50332952

OCCN(CC(=O)NO)S(=O)(=O)c1ccc(cc1)-c1ccccc1

BDBM50332953

OC[C@@H](O)CN(CC(=O)NO)S(=O)(=O)c1ccc(cc1)-c1ccccc1 |r|

BDBM50152645

OC[C@@H]1N=C(O[C@H]1C=C)\C=C/C=C/c1ccccc1 |c:3|

BDBM50152634

OC[C@@H]1N=C(O[C@H]1C=C)c1ccc(Br)cc1 |c:3|

BDBM50152643

OC[C@@H]1N=C(O[C@H]1C=C)c1ccc(cc1)[N+]([O-])=O |c:3|

BDBM50152639

OC[C@@H]1N=C(O[C@H]1C=C)c1ccccc1 |c:3|

BDBM475594

OCc1ccc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)cc1

BDBM475592

OCc1cccc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)c1

BDBM475593

OCc1ccccc1COc1ccc(Sc2ccoc2C2NC(=O)NC2=O)cc1

BDBM50592904

ONC(=O)C(Cc1ccccc1)NS(=O)(=O)c1ccc(cc1)-c1cn(nn1)-c1ccc(cc1)-c1ccccc1

BDBM50148216

ONC(=O)C1(CCOCC1)NS(=O)(=O)c1ccc(Oc2ccc(F)cc2)cc1

BDBM50592902

ONC(=O)C1(CCOCC1)S(=O)(=O)c1ccc(cc1)-n1cc(nn1)-c1ccc(cc1)-c1ccccc1

BDBM50203961

ONC(=O)C1CCCCN1S(=O)(=O)CCCOc1cccc(CNC(=O)c2nc3ccccc3c(=O)[nH]2)c1

BDBM50137278

ONC(=O)C1N(CCc2cc(O)ccc12)S(=O)(=O)c1cc(Cl)ccc1Cl

BDBM50137279

ONC(=O)C1N(CCc2cc(O)ccc12)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O

BDBM50137284

ONC(=O)C1N(CCc2cc(O)ccc12)S(=O)(=O)c1ccccc1

BDBM50137280

ONC(=O)C1N(CCc2cc(OCc3ccccc3)ccc12)S(=O)(=O)c1cc(Cl)ccc1Cl

BDBM50137287

ONC(=O)C1N(CCc2cc(OCc3ccccc3)ccc12)S(=O)(=O)c1ccccc1

BDBM50428828

ONC(=O)C1N(CCc2cc(Oc3ccccc3)ccc12)S(=O)(=O)c1cc(Cl)ccc1Cl

BDBM50100095

ONC(=O)CN1Cc2c(Cl)cccc2NC1=O

BDBM50100097

ONC(=O)CN1Cc2c(Cl)cccc2NS1(=O)=O

BDBM50434221

ONC(=O)CNS(=O)(=O)CCc1ccc(Cl)s1

BDBM50434225

ONC(=O)CNS(=O)(=O)CCc1ccc(Oc2ccccc2)cc1

BDBM50434214

ONC(=O)CNS(=O)(=O)CCc1ccc2OCOc2c1

BDBM50434216

ONC(=O)CNS(=O)(=O)CCc1ccccc1

BDBM50294120

ONC(=O)CNS(=O)(=O)c1ccc(cc1)-c1ccccc1

BDBM50434217

ONC(=O)CNS(=O)(=O)c1ccccc1

BDBM50299054

ONC(=O)Cc1ccccc1S(=O)(=O)c1ccc(cc1)-c1ccccc1

BDBM29018

ONC(=O)N1C[C@H]2O[C@@H](C1)[C@@H](O2)C(=O)NCc1ccc(cc1)-c1ccccc1 |r|

BDBM50434219

ONC(=O)[C@@H]1CCCN1S(=O)(=O)CCc1ccc(Cl)s1 |r|

BDBM50434213

ONC(=O)[C@@H]1CCCN1S(=O)(=O)CCc1ccc2OCOc2c1 |r|

BDBM50366175

ONC(=O)[C@@H]1CS(=O)(=O)CN1S(=O)(=O)c1ccc(Oc2ccc(Cl)cc2)cc1 |r|

BDBM50366174

ONC(=O)[C@@H]1CS(=O)(=O)CN1S(=O)(=O)c1ccc(cc1)-c1ccccc1 |r|

BDBM50366173

ONC(=O)[C@@H]1CS(=O)CN1S(=O)(=O)c1ccc(cc1)-c1ccccc1 |r|

BDBM29016

ONC(=O)[C@@H]1O[C@H]2CN(Cc3ccc(cc3)-c3ccccc3)C(=O)[C@@H]1O2 |r|

BDBM29017

ONC(=O)[C@@H]1O[C@H]2CN(Cc3ccc(cc3)-c3ccccc3)C[C@@H]1O2 |r|

BDBM29021

ONC(=O)[C@@H]1O[C@H]2CN(Cc3ccccc3)C(=O)[C@@H]1O2 |r|

BDBM50151732

ONC(=O)[C@@]1(O)COCC[C@H]1S(=O)(=O)c1ccc(OCc2ccc(Cl)cc2Cl)cc1

BDBM50434224

ONC(=O)[C@H]1CCCN1S(=O)(=O)CCc1ccc(Oc2ccccc2)cc1 |r|

BDBM50434222

ONC(=O)[C@H]1CCCN1S(=O)(=O)CCc1ccc(cc1)-c1ccccc1 |r|

BDBM50434215

ONC(=O)[C@H]1CCCN1S(=O)(=O)CCc1ccccc1 |r|

BDBM50104976

ONC(=O)[C@H]1CCCOC(=O)NCCCC[C@H](NC(=O)[C@@H]1Cc1ccc(cc1)-c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C(=O)NCC(=O)N1CCNCC1

BDBM50104973

ONC(=O)[C@H]1CCCOC(=O)NCCCC[C@H](NC(=O)[C@@H]1Cc1ccc(cc1)-c1ccccc1C(F)(F)F)C(=O)NCC(=O)N1CCNCC1

BDBM50104975

ONC(=O)[C@H]1CCCOC(=O)NCCCC[C@H](NC(=O)[C@@H]1Cc1ccc(cc1)-c1ccccc1C(F)(F)F)C(=O)NCC(=O)N1CCOCC1 |r|

BDBM26571

ONC(=O)[C@H]1COCC[C@H]1NC(=O)c1ccc(Cc2c(nc3ccccn23)C(F)(F)F)cc1 |r|

BDBM26570

ONC(=O)[C@H]1COCC[C@H]1NC(=O)c1ccc(Cc2c(nc3ccccn23)C2CC2)cc1 |r|

BDBM26575

ONC(=O)[C@H]1COCC[C@H]1NC(=O)c1ccc(Cc2c(nn3ccccc23)C(F)(F)F)cc1 |r|

BDBM26806

ONC(=O)[C@H]1COCC[C@H]1NC(=O)c1ccc(Cn2c(nc3ccccc23)C(F)(F)F)cc1 |r|

BDBM50367253

ONC(=O)[C@H]1C[C@@H](CC[C@@H]1C(=O)N1CCC(CC1)c1ccccc1)OC(=O)N1CCCC1 |r|

BDBM50140176

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

BDBM50299065

ONC(=O)c1ccccc1S(=O)(=O)c1ccc(Oc2ccccc2)cc1

BDBM50299064

ONC(=O)c1ccccc1S(=O)(=O)c1ccc(cc1)-c1ccccc1

BDBM50396791

OP(O)(=O)C(=O)NCCCCCCNS(=O)(=O)c1ccc(Oc2ccccc2)cc1

BDBM50396792

OP(O)(=O)C(=O)NCCCCCNS(=O)(=O)c1ccc(Oc2ccccc2)cc1

BDBM50216172

OP(O)(=O)C(Cl)(Cl)P(O)(O)=O

BDBM50309147

O[C@H]([C@@H](O)C(=O)N1CCCC1c1cccc(Cl)c1)C(=O)NCCc1cccs1 |r|

BDBM50309154

O[C@H]([C@@H](O)C(=O)N1CCCC1c1ccccc1)C(=O)NCCc1cc(Cc2ccccc2)cs1 |r|

BDBM50309132

O[C@H]([C@@H](O)C(=O)N1CCN(CC1)c1ccccc1Cl)C(=O)NCCc1cccs1 |r|

BDBM50362091

O[C@]1(CN2CCC1CC2)C#Cc1ccc(Oc2ccc(cc2)C(=O)NC2CCCS(=O)(=O)C2)cc1 |r,wU:1.0,wD:1.10,(7.27,-37.19,;7.29,-35.67,;7.26,-34.14,;8.58,-33.36,;10.7,-33.79,;10.73,-35.96,;8.61,-36.41,;9.9,-35.63,;9.88,-34.12,;5.98,-36.45,;4.64,-37.21,;3.3,-37.97,;1.97,-37.19,;.63,-37.95,;.62,-39.49,;-.72,-40.25,;-2.05,-39.48,;-2.04,-37.94,;-3.36,-37.16,;-4.71,-37.93,;-4.71,-39.48,;-3.38,-40.25,;-6.04,-37.15,;-6.03,-35.61,;-7.38,-37.92,;-8.71,-37.14,;-8.7,-35.6,;-10.03,-34.82,;-11.37,-35.58,;-11.38,-37.13,;-12.16,-38.46,;-12.94,-37.12,;-10.05,-37.91,;1.96,-40.27,;3.29,-39.51,)|

BDBM50419624

O[C@]1(CN2CCC1CC2)C#Cc1ccc(Oc2ccc(cc2)C(=O)NC2CCN(CC2)C(=O)C2CC2)cc1 |r,wU:1.0,wD:1.10,(10.79,-8.71,;10.8,-7.2,;10.78,-5.67,;12.09,-4.89,;14.21,-5.31,;14.25,-7.49,;12.12,-7.93,;13.42,-7.16,;13.4,-5.65,;9.49,-7.98,;8.15,-8.74,;6.82,-9.5,;5.49,-8.72,;4.15,-9.48,;4.14,-11.02,;2.8,-11.78,;1.47,-11,;1.48,-9.47,;.15,-8.69,;-1.19,-9.45,;-1.19,-11,;.14,-11.77,;-2.52,-8.68,;-2.52,-7.13,;-3.86,-9.44,;-5.19,-8.67,;-5.18,-7.13,;-6.51,-6.35,;-7.85,-7.11,;-7.86,-8.65,;-6.53,-9.44,;-9.18,-6.33,;-9.17,-4.78,;-10.53,-7.09,;-12.07,-7.08,;-11.31,-8.42,;5.48,-11.8,;6.81,-11.03,)|

BDBM50419622

O[C@]1(CN2CCC1CC2)C#Cc1ccc(Oc2ccc(cc2)C(=O)NC2CCN(CC2)C2CC2)cc1 |r,wU:1.0,wD:1.10,(10.02,-21.98,;10.03,-20.46,;10.01,-18.94,;11.32,-18.16,;13.44,-18.58,;13.48,-20.76,;11.35,-21.2,;12.64,-20.42,;12.63,-18.92,;8.72,-21.25,;7.38,-22.01,;6.04,-22.77,;4.72,-21.98,;3.38,-22.74,;3.37,-24.29,;2.03,-25.05,;.7,-24.27,;.71,-22.73,;-.62,-21.96,;-1.96,-22.72,;-1.96,-24.27,;-.63,-25.04,;-3.29,-21.94,;-3.28,-20.4,;-4.63,-22.71,;-5.96,-21.93,;-5.95,-20.39,;-7.28,-19.62,;-8.62,-20.38,;-8.63,-21.92,;-7.3,-22.71,;-9.95,-19.59,;-10.72,-18.25,;-11.5,-19.58,;4.71,-25.06,;6.04,-24.3,)|

BDBM50419620

O[C@]1(CN2CCC1CC2)C#Cc1ccc(Oc2ccc(cc2)C(=O)NC2CCS(=O)(=O)C2)cc1 |r,wU:1.0,wD:1.10,(10.24,-51.9,;10.26,-50.38,;10.24,-48.85,;11.55,-48.08,;13.67,-48.5,;13.71,-50.67,;11.58,-51.12,;12.87,-50.34,;12.86,-48.84,;8.95,-51.16,;7.61,-51.92,;6.27,-52.68,;4.95,-51.9,;3.61,-52.66,;3.6,-54.2,;2.26,-54.97,;.93,-54.19,;.94,-52.65,;-.39,-51.87,;-1.73,-52.64,;-1.73,-54.19,;-.4,-54.96,;-3.06,-51.86,;-3.06,-50.32,;-4.4,-52.63,;-5.74,-51.85,;-5.74,-50.3,;-7.2,-49.82,;-8.12,-51.07,;-9.46,-51.84,;-9.45,-50.29,;-7.21,-52.32,;4.93,-54.98,;6.27,-54.22,)|

BDBM50419621

O[C@]1(CN2CCC1CC2)C#Cc1ccc(Oc2ccc(cc2)C(=O)NC2CCS(=O)(=O)CC2)cc1 |r,wU:1.0,wD:1.10,(39.65,-21.2,;39.67,-19.68,;39.65,-18.15,;40.96,-17.38,;43.08,-17.8,;43.12,-19.98,;40.99,-20.42,;42.28,-19.64,;42.27,-18.14,;38.36,-20.47,;37.02,-21.23,;35.68,-21.99,;34.35,-21.2,;33.02,-21.96,;33,-23.51,;31.67,-24.27,;30.33,-23.49,;30.35,-21.95,;29.02,-21.18,;27.68,-21.94,;27.67,-23.49,;29,-24.26,;26.34,-21.16,;26.35,-19.62,;25,-21.93,;23.67,-21.15,;23.68,-19.61,;22.36,-18.84,;21.01,-19.59,;19.46,-19.59,;20.23,-18.25,;21,-21.14,;22.34,-21.93,;34.34,-24.28,;35.68,-23.52,)|

BDBM50418802

O[C@]1(CN2CCC1CC2)C#Cc1ccc(Oc2ccc(cc2)C(=O)NCc2ccncn2)cc1 |r,wU:1.0,wD:1.10,(4.69,-4.9,;3.94,-6.24,;5.47,-6.23,;6.25,-7.56,;5.48,-8.9,;3.94,-8.9,;3.17,-7.57,;4.49,-6.79,;4.89,-8.27,;3.17,-4.9,;2.4,-3.58,;1.62,-2.24,;.08,-2.24,;-.69,-.91,;.09,.42,;-.68,1.76,;-2.23,1.76,;-2.99,.43,;-4.53,.43,;-5.3,1.76,;-4.54,3.09,;-2.99,3.09,;-6.84,1.75,;-7.61,3.08,;-7.61,.41,;-9.15,.41,;-9.92,1.74,;-9.15,3.08,;-9.92,4.41,;-11.47,4.4,;-12.25,3.06,;-11.47,1.73,;1.62,.43,;2.39,-.9,)|

BDBM50240863

Oc1[nH]c(=O)[nH]c1-c1ccccc1

BDBM7460

Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O

BDBM7459

Oc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(O)c(O)c1

BDBM475595

Oc1cccc(COc2ccc(Sc3ccoc3C3NC(=O)NC3=O)cc2)c1

BDBM27857

On1c(cccc1=O)C(=O)NCc1ccc(cc1)-c1ccccc1

BDBM224012

Sc1cccc2cc(cnc12)C(=O)NCCc1nccs1

BDBM50505151

[3H]CC([3H])C(=O)NCCCOCCOCCOCCCNC(=O)[C@H](CO)NC(=O)[C@H](CC)NC(=O)[C@H](Cc1cc(no1)-c1ccc(cc1)C1(N=N1)C(F)(F)F)CP(O)(=O)c1ccccc1 |r,c:51|

BDBM50246196

[Na+].[O-]S(=O)(=O)CCCNC(=O)CCCCC1CCSS1

BDBM153385

[O-][N+](=O)c1ccc(NC(=S)NNC(=O)c2cc(Br)c(Br)[nH]2)cc1