CA2

Reference Set (61 Compounds)

CC(C)[C@@H](C(=O)N1CC2CCC(CC2)C1)n1cc(-c2ccc(S(N)(=O)=O)cc2)nn1 ZINC000045498396

ZINC000045498396 (search)

NS(=O)(=O)c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000002243201

ZINC000002243201 (search)

NS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000003875662

ZINC000003875662 (search)

NS(=O)(=O)c1ccc(Cl)c(Cl)c1 ZINC000000172748

ZINC000000172748 (search)

NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000001031283

ZINC000001031283 (search)

N#Cc1ccc(S(N)(=O)=O)cc1 ZINC000000039566

ZINC000000039566 (search)

NS(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000004262218

ZINC000004262218 (search)

NS(=O)(=O)c1ccc(NC(=S)NC(=O)c2cccs2)cc1 ZINC000002194426

ZINC000002194426 (search)

NS(=O)(=O)c1ccc(Cl)cc1 ZINC000000004726

ZINC000000004726 (search)

NS(=O)(=O)c1ccc(Br)cc1 ZINC000004369096

ZINC000004369096 (search)

NS(=O)(=O)c1cccc(Cl)c1 ZINC000000156648

ZINC000000156648 (search)

CC(=O)c1ccc(S(N)(=O)=O)cc1 ZINC000001995304

ZINC000001995304 (search)

NS(=O)(=O)c1ccc(CCNS(=O)(=O)c2ccc(F)cc2)cc1 ZINC000005715155

ZINC000005715155 (search)

C#Cc1ccc(S(N)(=O)=O)cc1 ZINC000029134554

ZINC000029134554 (search)

NS(=O)(=O)c1ccc2nc3n(c2c1)N=S=C3N1CCOCC1 ZINC000072176758

ZINC000072176758 (search)

NS(=O)(=O)c1cccc(NC(=S)NC(=O)c2cccs2)c1 ZINC000169307870

ZINC000169307870 (search)

Cc1ccc(S(=O)(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 ZINC000000261104

ZINC000000261104 (search)

Cc1ccc(S(N)(=O)=O)cc1 ZINC000000388056

ZINC000000388056 (search)

NS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1 ZINC000000184018

ZINC000000184018 (search)

NS(=O)(=O)c1cccc(NS(=O)(=O)c2ccc(F)cc2)c1 ZINC000005653031

ZINC000005653031 (search)

COc1ccc(S(N)(=O)=O)cc1 ZINC000000270975

ZINC000000270975 (search)

Cc1cccc(S(N)(=O)=O)c1 ZINC000000151233

ZINC000000151233 (search)

Cc1ccc(S(=O)(=O)NCc2ccc(S(N)(=O)=O)cc2)cc1 ZINC000003406753

ZINC000003406753 (search)

CC(=O)Nc1nnc(S(N)(=O)=O)s1 ZINC000003813042

ZINC000003813042 (search)

NS(=O)(=O)c1ccc2nc3n(c2c1)N=S=C3Cl ZINC000072187331

ZINC000072187331 (search)

Cc1ccc(S(=O)(=O)Nc2cccc(S(N)(=O)=O)c2)cc1 ZINC000004332847

ZINC000004332847 (search)

NS(=O)(=O)c1ccccc1 ZINC000000330150

ZINC000000330150 (search)

NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(F)cc2)cc1 ZINC000000288074

ZINC000000288074 (search)

NS(=O)(=O)c1cccc(NC(=S)NC(=O)c2cccc(Cl)c2)c1 ZINC000169307865

ZINC000169307865 (search)

Cc1ccc(S(=O)(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1 ZINC000000680538

ZINC000000680538 (search)

NS(=O)(=O)c1ccc2nc3n(c2c1)N=S=C3Sc1ccccc1 ZINC000072176752

ZINC000072176752 (search)

NS(=O)(=O)c1ccc2nc3n(c2c1)N=S=C3 ZINC000072169039

ZINC000072169039 (search)

CNc1ccc(S(N)(=O)=O)cc1 ZINC000028098746

ZINC000028098746 (search)

COC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](OS(N)(=O)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 ZINC000299832605

ZINC000299832605 (search)

CSC1=S=Nn2c1nc1ccc(S(N)(=O)=O)cc12 ZINC000072187330

ZINC000072187330 (search)

CN1CCN(C2=S=Nn3c2nc2ccc(S(N)(=O)=O)cc23)CC1 ZINC000072168385

ZINC000072168385 (search)

NS(=O)(=O)c1cccc(NC(=S)NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000009139268

ZINC000009139268 (search)

CS(=O)(=O)C1=S=Nn2c1nc1ccc(S(N)(=O)=O)cc12 ZINC000072176757

ZINC000072176757 (search)

NS(=O)(=O)c1ccc(CCNC(=O)c2ccccc2)cc1 ZINC000000172705

ZINC000000172705 (search)

NS(=O)(=O)c1ccc(CCNC(=O)c2ccc(F)cc2)cc1 ZINC000003565703

ZINC000003565703 (search)

NS(=O)(=O)c1ccc(CNC(=O)c2ccccc2)cc1 ZINC000000251799

ZINC000000251799 (search)

NS(=O)(=O)c1ccc(CNC(=O)c2ccc(F)cc2)cc1 ZINC000000226545

ZINC000000226545 (search)

Nc1ccc(S(N)(=O)=O)cc1 ZINC000000002101

ZINC000000002101 (search)

COC(=O)[C@]12CC[C@@H](C)[C@H](C)[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](OS(N)(=O)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 ZINC000299831873

ZINC000299831873 (search)

CC(C)(C)C(=O)NC(=S)Nc1cccc(S(N)(=O)=O)c1 ZINC000169307871

ZINC000169307871 (search)

COC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)C[C@@H](O)[C@H](OS(N)(=O)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 ZINC000299836368

ZINC000299836368 (search)

COC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC(=O)[C@@H]3[C@@]4(C)CC[C@H](OS(N)(=O)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 ZINC000299836411

ZINC000299836411 (search)

COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OS(N)(=O)=O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1 ZINC000299826563

ZINC000299826563 (search)

COC(=O)[C@]12CC[C@@H](C(C)=O)[C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](OS(N)(=O)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 ZINC000299833987

ZINC000299833987 (search)

C=C(C)[C@@H]1CC[C@]2(C(=O)OC)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OS(N)(=O)=O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12 ZINC000299832653

ZINC000299832653 (search)

NS(=O)(=O)c1cccc(NC(=S)NC(=O)C23CC4CC(CC(C4)C2)C3)c1 ZINC000005616286

ZINC000005616286 (search)

NS(=O)(=O)c1cccc(NC(=S)NC(=O)c2ccc(Cl)cc2)c1 ZINC000169307866

ZINC000169307866 (search)

NS(=O)(=O)c1cccc(NC(=S)NC(=O)c2ccco2)c1 ZINC000169307869

ZINC000169307869 (search)

NS(=O)(=O)c1ccc(C(=O)OC/C=C/COC(=O)c2ccccc2)cc1 ZINC000028564350

ZINC000028564350 (search)

NS(=O)(=O)c1ccc(C(=O)OC/C=C/COC(=O)c2ccc(S(N)(=O)=O)cc2)cc1 ZINC000028564364

ZINC000028564364 (search)

NS(=O)(=O)c1ccc(C(=O)OC/C=C/CO)cc1 ZINC000028564532

ZINC000028564532 (search)

C=CCCCOC(=O)c1ccc(S(N)(=O)=O)cc1 ZINC000028564544

ZINC000028564544 (search)

C=CCOC(=O)c1ccc(S(N)(=O)=O)cc1 ZINC000028564501

ZINC000028564501 (search)

NS(=O)(=O)c1ccc(C(=O)OC/C=C\CO)cc1 ZINC000028564534

ZINC000028564534 (search)

NS(=O)(=O)c1ccc(C(=O)OC/C=C\COC(=O)c2ccc(S(N)(=O)=O)cc2)cc1 ZINC000028564372

ZINC000028564372 (search)

NS(=O)(=O)c1ccc(C(=O)O)cc1 ZINC000000001099

ZINC000000001099 (search)