AKR1B1

Reference Set (219 Compounds)

COC(=O)N(CC(=O)O)C(=O)c1c(F)ccc2c(C(F)(F)F)c(OC)ccc12 ZINC000003791654

ZINC000003791654 (search)

COc1ccc2c(C(=S)N(C)CC(=O)O)cccc2c1C(F)(F)F ZINC000003780343

ZINC000003780343 (search)

O=C(O)Cc1nn(Cc2ccc(Br)cc2F)c(=O)c2ccccc12 ZINC000000538211

ZINC000000538211 (search)

O=C(O)Cn1nc2c(c(Cc3nc4cc(C(F)(F)F)ccc4s3)c1=O)CCc1ccccc1-2 ZINC000029559496

ZINC000029559496 (search)

CC1=C(CC(=O)O)c2cccc3cccc(c23)C1=O ZINC000005766573

ZINC000005766573 (search)

CN(CC(=O)O)C(=S)c1cccc2ccccc12 ZINC000027878305

ZINC000027878305 (search)

O=C1NC(=O)[C@]2(CCOc3ccc(Br)cc32)O1 ZINC000029228177

ZINC000029228177 (search)

O=C1NC(=O)[C@]2(CCOc3c(Cl)cc(Cl)cc32)O1 ZINC000029231864

ZINC000029231864 (search)

O=C1NC(=O)[C@@]2(CCOc3ccc(F)cc32)N1 ZINC000000002070

ZINC000000002070 (search)

O=C1NC(=O)[C@@]2(CCSc3ccccc32)O1 ZINC000029228155

ZINC000029228155 (search)

Cc1cc(Cl)cc2c1OCC[C@@]21OC(=O)NC1=O ZINC000029230115

ZINC000029230115 (search)

O=C1NC(=O)[C@]2(CCSc3ccc(F)cc32)O1 ZINC000029233040

ZINC000029233040 (search)

O=C1NC(=O)[C@]2(CCOc3ccc(F)cc32)O1 ZINC000029233968

ZINC000029233968 (search)

O=C1NC(=O)[C@]2(CCSc3ccc(Cl)cc32)O1 ZINC000029239657

ZINC000029239657 (search)

COc1c(/C=C2\SC(=S)N(CC(=O)O)C2=O)ccc2ccccc12 ZINC000013782017

ZINC000013782017 (search)

O=C1C[C@@]2(C(=O)N1)C(=O)N(Cc1ccc(Br)cc1F)C(=O)c1ccc(F)cc12 ZINC000000597385

ZINC000000597385 (search)

O=C1C[C@@]2(C(=O)N1)C(=O)N(Cc1ccc(Br)cc1F)C(=O)c1ccccc12 ZINC000001492559

ZINC000001492559 (search)

O=C(O)CN1C(=O)/C(=C/c2ccc3ccccc3c2Br)SC1=S ZINC000013782018

ZINC000013782018 (search)

O=C(O)CN1C(=O)/C(=C/c2cc3ccccc3cc2Br)SC1=S ZINC000013782021

ZINC000013782021 (search)

O=C1C[C@@]2(C(=O)N1)C(=O)N(Cc1nc3ccccc3s1)C(=O)c1ccccc12 ZINC000000587142

ZINC000000587142 (search)

O=C1C[C@@]2(C(=O)N1)C(=O)N(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccccc12 ZINC000013737602

ZINC000013737602 (search)

O=C1C[C@]2(C(=O)N1)C(=O)N(Cc1nc3ccccc3s1)C(=O)c1ccc(F)cc12 ZINC000000587143

ZINC000000587143 (search)

COc1cc2ccccc2cc1/C=C1\SC(=S)N(CC(=O)O)C1=O ZINC000013782020

ZINC000013782020 (search)

O=C1C[C@@]2(C(=O)N1)C(=O)N(Cc1ccc(Br)cc1F)C(=O)c1cc(F)ccc12 ZINC000001492562

ZINC000001492562 (search)

O=C1C[C@@]2(C(=O)N1)C(=O)N(Cc1ccc(Br)cc1F)C(=O)c1cccc(F)c12 ZINC000001492561

ZINC000001492561 (search)

O=C1C[C@]2(C(=O)N1)C(=O)N(Cc1nc3cc(C(F)(F)F)ccc3s1)C(=O)c1ccccc12 ZINC000000597774

ZINC000000597774 (search)

O=C1C[C@]2(C(=O)N1)C(=O)N(Cc1ccc(Cl)c(Cl)c1)C(=O)c1ccccc12 ZINC000001492560

ZINC000001492560 (search)

O=C1C[C@@]2(C(=O)N1)C(=O)N(Cc1ccc(Br)cc1)C(=O)c1ccccc12 ZINC000013737592

ZINC000013737592 (search)

O=C1C[C@@]2(C(=O)N1)C(=O)N(Cc1ccc(Cl)cc1)C(=O)c1ccccc12 ZINC000013737594

ZINC000013737594 (search)

O=C1C[C@@]2(C(=O)N1)C(=O)N(Cc1ccc(Br)cc1F)C(=O)c1c(F)cccc12 ZINC000001492563

ZINC000001492563 (search)

O=C1C[C@@]2(C(=O)N1)C(=O)N(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccccc12 ZINC000013737596

ZINC000013737596 (search)

COc1ccc(CN2C(=O)c3ccccc3[C@@]3(CC(=O)NC3=O)C2=O)cc1 ZINC000013737598

ZINC000013737598 (search)

Cc1cccc(CN2C(=O)c3ccccc3[C@@]3(CC(=O)NC3=O)C2=O)c1 ZINC000013737600

ZINC000013737600 (search)

O=C1C[C@]2(C(=O)N1)C(=O)N(Cc1nc3cc(C(F)(F)F)ccc3s1)C(=O)c1ccc(F)cc12 ZINC000000587146

ZINC000000587146 (search)

COc1cc2c(cc1Br)[C@]1(CC(=O)NC1=O)C(=O)N(Cc1ccc(Br)cc1F)C2=O ZINC000026165290

ZINC000026165290 (search)

O=C1C[C@@]2(C(=O)N1)C(=O)N(Cc1ccc(Br)cc1F)C(=O)c1ccc(Cl)cc12 ZINC000013737584

ZINC000013737584 (search)

COc1ccc2c(c1F)[C@]1(CC(=O)NC1=O)C(=O)N(Cc1ccc(Br)cc1F)C2=O ZINC000013737586

ZINC000013737586 (search)

O=C1C[C@]2(C(=O)N1)C(=O)N(Cc1ccc(Br)cc1F)C(=O)c1ccc(F)cc12 ZINC000001492564

ZINC000001492564 (search)

O=C1C[C@@]2(C(=O)N1)C(=O)N(Cc1ccc(Br)cc1F)C(=O)c1cc(Cl)ccc12 ZINC000013737582

ZINC000013737582 (search)

COc1ccc2c(c1)C(=O)N(Cc1ccc(Br)cc1F)C(=O)[C@@]21CC(=O)NC1=O ZINC000013737588

ZINC000013737588 (search)

O=C1C[C@@]2(C(=O)N1)C(=O)N(Cc1ccc(Br)cc1F)C(=O)c1ccc(C(F)(F)F)cc12 ZINC000013737590

ZINC000013737590 (search)

O=C(O)CN1C(=O)S/C(=C\c2cc3ccccc3cc2Cl)C1=O ZINC000013782027

ZINC000013782027 (search)

O=C(O)CN1C(=O)S/C(=C\c2ccc3ccccc3c2Br)C1=O ZINC000013782024

ZINC000013782024 (search)

COc1ccc2cc(/C=C3\SC(=S)N(CC(=O)O)C3=O)ccc2c1 ZINC000006210123

ZINC000006210123 (search)

O=C(O)CN1C(=O)/C(=C/c2ccc3ccccc3c2[N+](=O)[O-])SC1=S ZINC000013782019

ZINC000013782019 (search)

O=C(O)CN1C(=O)/C(=C/c2ccc3ccccc3c2)SC1=S ZINC000001214918

ZINC000001214918 (search)

O=C1NC(=O)[C@@]2(CCSc3ccc(F)cc32)N1 ZINC000002635399

ZINC000002635399 (search)

Cc1cc(Cl)cc2c1OCC[C@@]21NC(=O)NC1=O ZINC000026478664

ZINC000026478664 (search)

O=C1NC(=O)[C@@]2(CCOc3ccc(Cl)cc32)O1 ZINC000026479967

ZINC000026479967 (search)

O=C1NC(=O)[C@]2(CCOc3cc(Cl)c(Cl)cc32)N1 ZINC000026479985

ZINC000026479985 (search)

O=C1NC(=O)[C@]2(CCOc3ccc(Cl)cc32)N1 ZINC000026481517

ZINC000026481517 (search)

O=C1NC(=O)[C@]2(CCOc3c(Cl)cc(Cl)cc32)N1 ZINC000026485137

ZINC000026485137 (search)

O=C1NC(=O)[C@]2(CCSc3cc(Cl)c(Cl)cc32)N1 ZINC000026487968

ZINC000026487968 (search)

COc1cccc2c3c(ccc12)[C@@]1(CCO3)NC(=O)NC1=O ZINC000026488745

ZINC000026488745 (search)

O=C1NC(=O)[C@]2(CCn3c(=O)ccc4cc(Cl)cc2c43)N1 ZINC000026491663

ZINC000026491663 (search)

O=C1NC(=O)[C@]2(CCOc3c2cc(Cl)c2ccccc32)N1 ZINC000026492053

ZINC000026492053 (search)

O=C1NC(=O)[C@]2(CCS(=O)(=O)c3c(Cl)cc(Cl)cc32)N1 ZINC000026492901

ZINC000026492901 (search)

O=C1NC(=O)[C@]2(CCSc3c(Cl)cc(Cl)cc32)N1 ZINC000026497613

ZINC000026497613 (search)

COc1ccc2cc(/C=C3\SC(=O)N(CC(=O)O)C3=O)ccc2c1 ZINC000013782028

ZINC000013782028 (search)

COc1cc2ccccc2cc1/C=C1\SC(=O)N(CC(=O)O)C1=O ZINC000013782025

ZINC000013782025 (search)

COc1c(/C=C2\SC(=O)N(CC(=O)O)C2=O)ccc2ccccc12 ZINC000013782023

ZINC000013782023 (search)

O=C(O)CN1C(=O)S/C(=C\c2cc3ccccc3cc2Br)C1=O ZINC000013782026

ZINC000013782026 (search)

Cc1c(CC(=O)O)c2cc(OC(=O)CCC(=O)OCc3ccccc3)ccc2n1C(=O)c1ccc(Cl)cc1 ZINC000029465420

ZINC000029465420 (search)

O=C(O)CN1C(=O)S/C(=C\c2ccc3ccccc3c2)C1=O ZINC000013782022

ZINC000013782022 (search)

Cc1c(CC(=O)O)c2cc(OC(=O)CCC(=O)O[C@H](C)c3ccccc3)ccc2n1C(=O)c1ccc(Cl)cc1 ZINC000029466526

ZINC000029466526 (search)

CCC(CC)OC(=O)CCC(=O)Oc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccc(Cl)cc1 ZINC000013862795

ZINC000013862795 (search)

O=C1C[C@]2(C(=O)N1)C(=O)N(Cc1ccc(Br)cc1F)C(=O)c1ccccc12 ZINC000001492576

ZINC000001492576 (search)

CSc1ccc2c(c1)[C@@]1(CCO2)NC(=O)NC1=O ZINC000026479973

ZINC000026479973 (search)

Cc1ccc(C)c2c1OCC[C@@]21NC(=O)NC1=O ZINC000026484298

ZINC000026484298 (search)

O=C1NC(=O)[C@]2(CCOc3cc(C(F)(F)F)ccc32)N1 ZINC000026488237

ZINC000026488237 (search)

O=C(O)[C@@H]1CCOc2c1cc(Cl)c1ccccc21 ZINC000026489581

ZINC000026489581 (search)

O=C1NC(=O)[C@]2(CCSc3cc(Cl)ccc32)N1 ZINC000026490137

ZINC000026490137 (search)

O=C1NC(=O)[C@]2(CCOc3c(Cl)cccc32)N1 ZINC000026491261

ZINC000026491261 (search)

Cc1cc(C)c2c(c1C)OCC[C@@]21NC(=O)NC1=O ZINC000026497021

ZINC000026497021 (search)

Cc1c(CC(=O)O)c2cc(OC(=O)CCC(=O)C(C)C)ccc2n1C(=O)c1ccc(Cl)cc1 ZINC000013862794

ZINC000013862794 (search)

Cc1c(CC(=O)O)c2cc(OC(=O)CCCC(C)C)ccc2n1C(=O)c1ccc(Cl)cc1 ZINC000013862793

ZINC000013862793 (search)

CCCCCCC(=O)Oc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccc(Cl)cc1 ZINC000013862792

ZINC000013862792 (search)

Cc1c(CC(=O)O)c2cc(O)ccc2n1C(=O)c1ccc(Cl)cc1 ZINC000006068955

ZINC000006068955 (search)

Cc1c(CC(=O)O)c2cc(OCCO)ccc2n1C(=O)c1ccc(Cl)cc1 ZINC000013862791

ZINC000013862791 (search)

Cc1c(CC(=O)O)c2cc(OCCCO)ccc2n1C(=O)c1ccc(Cl)cc1 ZINC000013862790

ZINC000013862790 (search)

COc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccc(Cl)cc1 ZINC000000601283

ZINC000000601283 (search)

O=C(O)CNc1ccc(NC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc1 ZINC000001741717

ZINC000001741717 (search)

Cc1cc(C)c2c(c1)-c1nn(CC(=O)O)c(=O)cc1CC2 ZINC000013604584

ZINC000013604584 (search)

COc1cc2c(cc1OC)-c1nn(CCCC(=O)O)c(=O)cc1CC2 ZINC000013604593

ZINC000013604593 (search)

Nc1nc2ncc(CN(C(=O)C(F)(F)F)c3ccc(C(=O)O)cc3)nc2c(=O)[nH]1 ZINC000006565581

ZINC000006565581 (search)

O=c1cnn(Cc2ccccc2)c(=O)[nH]1 ZINC000000146377

ZINC000000146377 (search)

O=C1NC(=O)[C@@]2(CCOc3ccccc32)N1 ZINC000003268277

ZINC000003268277 (search)

O=C1NC(=O)[C@@]2(CCSc3ccccc32)N1 ZINC000022217689

ZINC000022217689 (search)

O=C1NC(=O)[C@@]2(CCOc3c2ccc2cccnc32)N1 ZINC000026478854

ZINC000026478854 (search)

COc1ccc2c(c1)CC[C@@]21NC(=O)NC1=O ZINC000026481504

ZINC000026481504 (search)

O=C1NC[C@@]2(CCOc3ccc(Cl)cc32)N1 ZINC000026483208

ZINC000026483208 (search)

O=C(O)[C@@H]1CCSc2cc(Cl)c(Cl)cc21 ZINC000026485233

ZINC000026485233 (search)

O=C(O)[C@@H]1CCOc2c(Cl)cc(Cl)cc21 ZINC000026486430

ZINC000026486430 (search)

Cc1cc(C)c2c(c1)[C@@]1(CCO2)NC(=O)NC1=O ZINC000026488223

ZINC000026488223 (search)

O=C1NC(=O)[C@@]2(CCCc3ncccc32)N1 ZINC000026490246

ZINC000026490246 (search)

O=C1NC(=O)[C@@]2(CCOc3ccc4ccccc4c32)N1 ZINC000026490671

ZINC000026490671 (search)

COc1cccc2c1CCC[C@@]21NC(=O)NC1=O ZINC000026493181

ZINC000026493181 (search)

O=C1NC(=O)[C@@]2(CCOc3ccc(Oc4ccccc4)cc32)N1 ZINC000026493448

ZINC000026493448 (search)

COc1ccc2c(c1)[C@@]1(CCS2)NC(=O)NC1=O ZINC000026495120

ZINC000026495120 (search)

COc1ccc2c(c1)[C@@]1(CC2)NC(=O)NC1=O ZINC000026496107

ZINC000026496107 (search)

O=C(O)CN1C(=O)S/C(=C\c2ccc(Oc3ccccc3)cc2)C1=O ZINC000066262650

ZINC000066262650 (search)

O=c1cc(-c2ccc3c(c2)OCCO3)oc2cc(OCCO[N+](=O)[O-])cc(O)c12 ZINC000096273311

ZINC000096273311 (search)

COc1cc(/C=C2\SC(=S)N(CC(=O)O)C2=O)ccc1OCC(N)=O ZINC000008112987

ZINC000008112987 (search)

O=C(O)CN1C(=O)/C(=C/c2ccc(Oc3ccccc3)cc2)SC1=S ZINC000066251096

ZINC000066251096 (search)

O=c1cc(-c2ccc3c(c2)OCCO3)oc2cc(OCCCCO[N+](=O)[O-])cc(O)c12 ZINC000096273328

ZINC000096273328 (search)

COc1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)cc1OCC(N)=O ZINC000013362991

ZINC000013362991 (search)

NC(=O)COc1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)cc1 ZINC000039983411

ZINC000039983411 (search)

NC(=O)COc1cccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)c1 ZINC000169341023

ZINC000169341023 (search)

O=C(O)CN1C(=O)/C(=C/c2cccc(OCc3ccccc3)c2)SC1=S ZINC000000967110

ZINC000000967110 (search)

O=C(CCCCO[N+](=O)[O-])OCOc1cc(O)c2c(=O)cc(-c3ccccc3)oc2c1 ZINC000049115807

ZINC000049115807 (search)

COc1cccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)c1 ZINC000013343658

ZINC000013343658 (search)

O=c1cc(-c2ccc(O)c(O)c2)oc2cc(OCCO[N+](=O)[O-])cc(O)c12 ZINC000096273327

ZINC000096273327 (search)

CC(/C=C1\SC(=S)N(CC(=O)O)C1=O)=C\c1ccccc1 ZINC000001533688

ZINC000001533688 (search)

O=C(O)CN1C(=O)/C(=C/c2ccc(OCc3ccccc3)cc2)SC1=S ZINC000001238457

ZINC000001238457 (search)

COc1ccc(/C=C2\SC(=O)N(CC(=O)O)C2=O)cc1OCC(=O)O ZINC000028822569

ZINC000028822569 (search)

O=C(CCCCCCO[N+](=O)[O-])OCOc1cc(O)c2c(=O)cc(-c3ccccc3)oc2c1 ZINC000049110740

ZINC000049110740 (search)

O=C(O)COc1cccc(/C=C2\SC(=O)N(CC(=O)O)C2=O)c1 ZINC000016904965

ZINC000016904965 (search)

COc1ccc(/C=C/c2ccc(/C=C3\SC(=O)N(CC(=O)O)C3=O)cc2)cc1 ZINC000072175495

ZINC000072175495 (search)

COc1cc(/C=C2\SC(=O)N(CC(=O)O)C2=O)ccc1OCC(=O)O ZINC000028822568

ZINC000028822568 (search)

O=C(O)CN1C(=O)S/C(=C\c2ccc(/C=C/c3ccccc3)cc2)C1=O ZINC000072173320

ZINC000072173320 (search)

O=c1cc(-c2ccccc2)oc2cc(OCCCCO[N+](=O)[O-])cc(O)c12 ZINC000040891709

ZINC000040891709 (search)

O=C(O)CN1C(=O)S/C(=C\C=C\c2ccc(C(F)(F)F)cc2)C1=O ZINC000072174954

ZINC000072174954 (search)

O=C(CCO[N+](=O)[O-])OCOc1cc(O)c2c(=O)cc(-c3ccccc3)oc2c1 ZINC000049070738

ZINC000049070738 (search)

Cc1ccc(/C=C/c2ccc(/C=C3\SC(=O)N(CC(=O)O)C3=O)cc2)cc1 ZINC000072175123

ZINC000072175123 (search)

CC(=O)Oc1cc(OCCCCO[N+](=O)[O-])cc2oc(-c3ccccc3)cc(=O)c12 ZINC000049124829

ZINC000049124829 (search)

O=C(O)CN1C(=O)/C(=C/c2cccc(Oc3ccccc3)c2)SC1=S ZINC000000966884

ZINC000000966884 (search)

CC(=O)Oc1cc(OCCCCCCO[N+](=O)[O-])cc2oc(-c3ccccc3)cc(=O)c12 ZINC000049783661

ZINC000049783661 (search)

O=C(COc1cc(O)c2c(=O)cc(-c3ccc4c(c3)OCCO4)oc2c1)OCCO[N+](=O)[O-] ZINC000096273325

ZINC000096273325 (search)

O=c1cc(-c2ccc3c(c2)OCCO3)oc2cc(OCCCCCCO[N+](=O)[O-])cc(O)c12 ZINC000096273326

ZINC000096273326 (search)

O=c1cc(-c2ccc(O)c(O)c2)oc2cc(OCCCCO[N+](=O)[O-])cc(O)c12 ZINC000096273324

ZINC000096273324 (search)

O=c1cc(-c2ccccc2)oc2cc(OCCO[N+](=O)[O-])cc(O)c12 ZINC000040393143

ZINC000040393143 (search)

O=c1cc(-c2ccc(O)c(O)c2)oc2cc(OCCCCCCO[N+](=O)[O-])cc(O)c12 ZINC000096273322

ZINC000096273322 (search)

O=C(COc1cc(O)c2c(=O)cc(-c3ccc4c(c3)OCCO4)oc2c1)OCCCCO[N+](=O)[O-] ZINC000096273323

ZINC000096273323 (search)

COc1cc(/C=C2\SC(=O)N(CC(=O)O)C2=O)ccc1OCC(N)=O ZINC000169341021

ZINC000169341021 (search)

CCOC(=O)COc1cc(O)c2c(=O)cc(-c3ccc4c(c3)OCCO4)oc2c1 ZINC000096273321

ZINC000096273321 (search)

COc1ccc(/C=C2\SC(=O)N(CC(=O)O)C2=O)cc1OCC(N)=O ZINC000169341020

ZINC000169341020 (search)

CCCCOC(=O)COc1cc(O)c2c(=O)cc(-c3ccc4c(c3)OCCO4)oc2c1 ZINC000096273320

ZINC000096273320 (search)

NC(=O)COc1ccc(/C=C2\SC(=O)N(CC(=O)O)C2=O)cc1 ZINC000004704761

ZINC000004704761 (search)

COc1ccc(/C=C2\SC(=O)N(CC(=O)O)C2=O)cc1O ZINC000049112018

ZINC000049112018 (search)

O=C(O)COc1ccc(/C=C2\SC(=O)N(CC(=O)O)C2=O)cc1 ZINC000016904964

ZINC000016904964 (search)

CCOc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1 ZINC000096273319

ZINC000096273319 (search)

COc1cc(/C=C2\SC(=O)N(CC(=O)O)C2=O)ccc1O ZINC000013758870

ZINC000013758870 (search)

O=c1cc(-c2ccccc2)oc2cc(OCCCCCCO[N+](=O)[O-])cc(O)c12 ZINC000040892292

ZINC000040892292 (search)

O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 ZINC000018185774

ZINC000018185774 (search)

CCCCOc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1 ZINC000096273318

ZINC000096273318 (search)

COc1ccc(/C=C/C=C2\SC(=O)N(CC(=O)O)C2=O)cc1 ZINC000072170857

ZINC000072170857 (search)

CC(=O)Oc1cc(OCCO[N+](=O)[O-])cc2oc(-c3ccccc3)cc(=O)c12 ZINC000049785128

ZINC000049785128 (search)

O=C1NC2(C(=O)N1S(=O)(=O)c1ccc(Cl)cc1)c1ccccc1-c1ccccc12 ZINC000299852423

ZINC000299852423 (search)

O=C(O)CC1(CC(=O)O)CCCC1 ZINC000000249320

ZINC000000249320 (search)

O=C1NC(=O)[C@@]2(CCS(=O)(=O)c3ccc(F)cc32)N1 ZINC000002635395

ZINC000002635395 (search)

O=C1NC(=O)[C@]2(CCSc3ccc(Br)cc32)N1 ZINC000026478153

ZINC000026478153 (search)

O=C1NC(=O)[C@]2(CCSc3ccc(Cl)cc32)N1 ZINC000026478167

ZINC000026478167 (search)

O=C1NC(=O)[C@@]2(CCOc3c(-c4ccccc4)cccc32)N1 ZINC000026479103

ZINC000026479103 (search)

O=C1NC(=O)[C@@]2(CCn3c(=O)ccc4cccc2c43)N1 ZINC000026485419

ZINC000026485419 (search)

O=C1NC(=O)[C@@]2(CCOc3c2ccc2ncccc32)N1 ZINC000026488757

ZINC000026488757 (search)

O=C1NC(=O)[C@]2(CC[S@+]([O-])c3ccc(F)cc32)N1 ZINC000026496524

ZINC000026496524 (search)

O=C1NC(=O)[C@]2(CCOc3ccc(Br)cc32)N1 ZINC000026498233

ZINC000026498233 (search)

NC(=O)COc1cccc(/C=C2\SC(=O)N(CC(=O)O)C2=O)c1 ZINC000169341018

ZINC000169341018 (search)

COc1ccc(S(=O)(=O)N2C(=O)NC3(C2=O)c2ccccc2-c2ccccc23)cc1 ZINC000299850161

ZINC000299850161 (search)

Cc1ccc(/C=C/C=C2\SC(=O)N(CC(=O)O)C2=O)cc1 ZINC000072174935

ZINC000072174935 (search)

O=C1NC(=S)S/C1=C\c1cccc(OCc2ccccc2)c1 ZINC000001199750

ZINC000001199750 (search)

CCOc1cc(O)c2c(=O)cc(-c3ccc4c(c3)OCCO4)oc2c1 ZINC000096273317

ZINC000096273317 (search)

O=C(O)CN1C(=O)S/C(=C\c2ccc(/C=C/c3ccc(C(F)(F)F)cc3)cc2)C1=O ZINC000072170734

ZINC000072170734 (search)

CCCCOc1cc(O)c2c(=O)cc(-c3ccc4c(c3)OCCO4)oc2c1 ZINC000096273316

ZINC000096273316 (search)

O=C(COc1cc(O)c2c(=O)cc(-c3ccc4c(c3)OCCO4)oc2c1)OCCCCCCO[N+](=O)[O-] ZINC000096273315

ZINC000096273315 (search)

O=C(O)CN1C(=O)S/C(=C\C=C\c2ccccc2)C1=O ZINC000019770127

ZINC000019770127 (search)

O=C1NC(=O)C2(c3ccccc3-c3ccccc32)N1S(=O)(=O)c1ccc(Cl)cc1 ZINC000299852747

ZINC000299852747 (search)

O=C(CN1C(=O)S/C(=C\c2ccc(O)cc2)C1=O)NO ZINC000042879068

ZINC000042879068 (search)

O=C1NC2(C(=O)N1S(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1-c1ccccc12 ZINC000299850931

ZINC000299850931 (search)

CCCCCCOc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1 ZINC000096273313

ZINC000096273313 (search)

O=C1NC(=S)S/C1=C\c1cccc2ccccc12 ZINC000001452720

ZINC000001452720 (search)

Cc1ccc(S(=O)(=O)N2C(=O)NC(=O)C23c2ccccc2-c2ccccc23)cc1 ZINC000299852671

ZINC000299852671 (search)

CCCCCCCC[C@@H]1[C@H](O)NC(=O)C2=CN([C@@H]3O[C@H](CO[P@@](=O)(O)O[C@@H]4[C@@H](CO[P@@](=O)(O)OP(=O)(O)O)O[C@@H](n5cnc6c(N)ncnc65)[C@@H]4O)[C@@H](O)[C@H]3O)C=C[C@H]21 ZINC000261183192

ZINC000261183192 (search)

O=C(O)CN1C(=O)/C(=C\c2ccc3ccccc3c2)S/C1=N\c1ccccc1 ZINC000072174788

ZINC000072174788 (search)

O=C(O)CN1C(=O)c2cccc3cccc(c23)C1=O ZINC000003871501

ZINC000003871501 (search)

CCCCCCOC(=O)COc1cc(O)c2c(=O)cc(-c3ccc4c(c3)OCCO4)oc2c1 ZINC000096273312

ZINC000096273312 (search)

Cc1ccc(S(=O)(=O)N2C(=O)NC3(C2=O)c2ccccc2-c2ccccc23)cc1 ZINC000299850103

ZINC000299850103 (search)

O=C1NC(=S)S/C1=C\c1cccc(Oc2ccccc2)c1 ZINC000002779401

ZINC000002779401 (search)

O=C1S/C(=C\c2ccc(O)cc2)C(=O)N1CC(=O)C(F)(F)F ZINC000049807561

ZINC000049807561 (search)

O=C1S/C(=C\c2ccc(O)cc2)C(=O)N1CC(O)(O)C(F)(F)F ZINC000049807647

ZINC000049807647 (search)

O=C(CN1C(=O)S/C(=C\c2ccc(Oc3ccccc3)cc2)C1=O)NO ZINC000040939659

ZINC000040939659 (search)

O=C1NC(=O)C2(c3ccccc3-c3ccccc32)N1S(=O)(=O)c1ccc(Br)cc1 ZINC000299852937

ZINC000299852937 (search)

O=C(CN1C(=O)S/C(=C\c2cccc3ccccc23)C1=O)NO ZINC000045497533

ZINC000045497533 (search)

O=C(O)CN1C(=O)/C(=C\c2ccc(Oc3ccccc3)cc2)S/C1=N\c1ccccc1 ZINC000072174872

ZINC000072174872 (search)

O=C1N=C(S)S/C1=C\c1ccc(O)cc1 ZINC000004106401

ZINC000004106401 (search)

O=C(O)CN1C(=O)/C(=C\c2ccc(OCc3ccccc3)cc2)S/C1=N\c1ccccc1 ZINC000072174873

ZINC000072174873 (search)

Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO[P@@](=O)(O)OP(=O)(O)O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](N3C=C[C@@H]4C(=C3)C(=O)N[C@@H](O)[C@@H]4c3ccccc3)[C@H](O)[C@@H]2O)[C@H]1O ZINC000169317075

ZINC000169317075 (search)

COc1ccc(/C=C2\SC(=S)NC2=O)cc1 ZINC000012368669

ZINC000012368669 (search)

O=C1NC2(C(=O)N1S(=O)(=O)c1ccc(Br)cc1)c1ccccc1-c1ccccc12 ZINC000299852798

ZINC000299852798 (search)

COc1ccc(S(=O)(=O)N2C(=O)NC(=O)C23c2ccccc2-c2ccccc23)cc1 ZINC000299852353

ZINC000299852353 (search)

COc1cccc(/C=C2\SC(=S)NC2=O)c1 ZINC000016989176

ZINC000016989176 (search)

NC(=O)CN1C(=O)S/C(=C\c2ccc(O)cc2)C1=O ZINC000040413478

ZINC000040413478 (search)

Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO[P@@](=O)(O)OP(=O)(O)O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](N3C=C[C@@H]4C(=C3)C(=O)N[C@@H](O)[C@@H]4Cc3ccccc3)[C@H](O)[C@@H]2O)[C@H]1O ZINC000169317070

ZINC000169317070 (search)

O=C(CN1C(=O)S/C(=C\c2ccc(OCc3ccccc3)cc2)C1=O)NO ZINC000040939960

ZINC000040939960 (search)

O=c1cc(-c2ccccc2)oc2cc(O)cc(O)c12 ZINC000003872070

ZINC000003872070 (search)

O=C1NC(=O)C2(c3ccccc3-c3ccccc32)N1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000299851867

ZINC000299851867 (search)

O=C1S/C(=C\c2ccc(Oc3ccccc3)cc2)C(=O)N1CC(O)(O)C(F)(F)F ZINC000049807985

ZINC000049807985 (search)

O=C1S/C(=C\c2ccc(Oc3ccccc3)cc2)C(=O)N1CC(=O)C(F)(F)F ZINC000049808309

ZINC000049808309 (search)

NC(=O)COc1cccc(/C=C2\SC(=S)NC2=O)c1 ZINC000107887723

ZINC000107887723 (search)

COc1ccc(/C=C2\SC(=S)NC2=O)cc1OCC(N)=O ZINC000023162631

ZINC000023162631 (search)

O=C1NC(=O)[C@]2(CCOc3ccc(F)cc32)N1 ZINC000002574862

ZINC000002574862 (search)

O=C1NC(=O)[C@]2(CCSc3ccc(F)cc32)N1 ZINC000002635400

ZINC000002635400 (search)

C[C@@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O ZINC000004175638

ZINC000004175638 (search)

O=C(O)[C@@H]1CCOc2ccc(Cl)cc21 ZINC000026479654

ZINC000026479654 (search)

O=C1NC(=O)[C@@]2(CCS(=O)(=O)c3ccccc32)N1 ZINC000026489862

ZINC000026489862 (search)

O=C1NC(=O)[C@@]2(CCc3cc4c(cc32)OCO4)N1 ZINC000026493189

ZINC000026493189 (search)

Cc1cc(Cl)cc2c1OCC[C@@H]2C(=O)O ZINC000026495007

ZINC000026495007 (search)

O=C1NC(=O)[C@]2(CCOc3c(Cl)cc(-c4ccccc4)cc32)N1 ZINC000026496554

ZINC000026496554 (search)

COc1cc2c(cc1OC)[C@@]1(CC2)NC(=O)NC1=O ZINC000026497605

ZINC000026497605 (search)

Cc1ccc2c(c1)[C@@]1(CCO2)NC(=O)NC1=O ZINC000026498372

ZINC000026498372 (search)

COc1ccc2c(c1)[C@@]1(CCO2)NC(=O)NC1=O ZINC000026498982

ZINC000026498982 (search)

O=C(O)Cc1ccc2c(=O)cc(Cc3ccc(O)cc3)oc2c1 ZINC000013797598

ZINC000013797598 (search)

Cc1onc2c(=O)n(CC(=O)O)nc(-c3ccc(Cl)cc3)c12 ZINC000000023662

ZINC000000023662 (search)

O=c1cc(-c2ccccc2)oc2cc(O)c([N+](=O)[O-])cc12 ZINC000013797572

ZINC000013797572 (search)

O=c1cc(-c2ccccc2)oc2cc(O)c(O)cc12 ZINC000003871176

ZINC000003871176 (search)

Cc1onc2c(=O)n(CC(=O)O)nc(-c3cccc([N+](=O)[O-])c3)c12 ZINC000013797627

ZINC000013797627 (search)

Cc1onc2c(=O)n(CC(=O)O)nc(-c3ccc([N+](=O)[O-])cc3)c12 ZINC000013797624

ZINC000013797624 (search)

Cc1onc2c(=O)n(CC(=O)O)nc(-c3ccccc3[N+](=O)[O-])c12 ZINC000013797630

ZINC000013797630 (search)

O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)ccc12 ZINC000006092199

ZINC000006092199 (search)