Comt

Reference Set (53 Compounds)

Oc1c(Br)cc(Br)c2cccnc12 ZINC000000001064

ZINC000000001064 (search)

N#CC(C#N)=Cc1cc(O)c(O)c([N+](=O)[O-])c1 ZINC000000002775

ZINC000000002775 (search)

CC(=O)c1cc(O)c(O)c([N+](=O)[O-])c1 ZINC000000002778

ZINC000000002778 (search)

O=Cc1cc(O)c(O)c([N+](=O)[O-])c1 ZINC000000002779

ZINC000000002779 (search)

O=C(Cc1ccccc1)c1cc(O)c(O)c([N+](=O)[O-])c1 ZINC000000008750

ZINC000000008750 (search)

CC(C)C(=O)c1ccc(O)c(O)c1 ZINC000001641376

ZINC000001641376 (search)

CC(=O)c1cc(I)c(O)c2ncccc12 ZINC000001649071

ZINC000001649071 (search)

O=[N+]([O-])c1cc(O)c(O)c([N+](=O)[O-])c1 ZINC000002170217

ZINC000002170217 (search)

Oc1c(I)cc(I)c2cccnc12 ZINC000003830942

ZINC000003830942 (search)

Oc1c(I)cc(Cl)c2cccnc12 ZINC000006409735

ZINC000006409735 (search)

O=Cc1cc(O)c(O)c(C=O)c1 ZINC000013481372

ZINC000013481372 (search)

O=C(Cc1ccccc1)c1ccc(O)c(O)c1[N+](=O)[O-] ZINC000013677658

ZINC000013677658 (search)

O=C(CCc1ccccc1)c1ccc(O)c(O)c1[N+](=O)[O-] ZINC000013677660

ZINC000013677660 (search)

O=C(CCCc1ccccc1)c1ccc(O)c(O)c1[N+](=O)[O-] ZINC000013677662

ZINC000013677662 (search)

CC(=O)/C(C)=C/c1cc(O)c(O)c([N+](=O)[O-])c1 ZINC000013883836

ZINC000013883836 (search)

O=S(=O)(O)c1cc(I)c(O)c2ncccc12 ZINC000019336232

ZINC000019336232 (search)

O=C(CCCCc1ccccc1)c1ccc(O)c(O)c1[N+](=O)[O-] ZINC000025991167

ZINC000025991167 (search)

O=C(NC12CC3CC(CC(C3)C1)C2)c1cc(O)c(O)c([N+](=O)[O-])c1 ZINC000027894576

ZINC000027894576 (search)

$O=C1/C(=C/c2cc(O)c(O)c([N+](=O)[O-])c2)CC/C1=C\c1cc(O)c(O)c([N+](=O)[O-])c1 ZINC000027895913$

ZINC000027895913 (search)

N#Cc1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)cc(O)c1O ZINC000027895919

ZINC000027895919 (search)

O=C(NC12CC3CC(CC(C3)C1)C2)c1cc(O)c(O)cc1[N+](=O)[O-] ZINC000027895924

ZINC000027895924 (search)

O=C(O)CCCCc1cc(O)c(O)c([N+](=O)[O-])c1 ZINC000027897037

ZINC000027897037 (search)

O=Cc1cc(O)c(O)c(C(F)(F)F)c1 ZINC000027897048

ZINC000027897048 (search)

CC(=O)C(=Cc1cc(O)c(O)c(C(F)(F)F)c1)C(C)=O ZINC000027899391

ZINC000027899391 (search)

O=C(O)CCCCc1cc(O)c(O)c(Cl)c1 ZINC000027902983

ZINC000027902983 (search)

O=C(O)c1cc(O)c(O)c([N+](=O)[O-])c1 ZINC000027977563

ZINC000027977563 (search)

N#Cc1cc(C=O)cc(O)c1O ZINC000027981028

ZINC000027981028 (search)

O=C(NC12CC3CC(CC(C3)C1)C2)c1cc(O)c(O)c(Cl)c1 ZINC000027982000

ZINC000027982000 (search)

O=[N+]([O-])c1cc(Cl)cc(O)c1O ZINC000027983364

ZINC000027983364 (search)

N#Cc1cc(O)c(O)c([N+](=O)[O-])c1 ZINC000027985035

ZINC000027985035 (search)

O=C(NC12CC3CC(CC(C3)C1)C2)c1cc(O)c(O)cc1Cl ZINC000027985609

ZINC000027985609 (search)

O=[N+]([O-])c1cc(CO)cc(O)c1O ZINC000027988049

ZINC000027988049 (search)

Cc1c(Cl)c(C)[n+]([O-])c(Cl)c1-c1noc(-c2cc(O)c(O)c([N+](=O)[O-])c2)n1 ZINC000034602275

ZINC000034602275 (search)

CCN(CC)C(=O)/C(C#N)=C/c1cc(O)c(O)c([N+](=O)[O-])c1 ZINC000035342787

ZINC000035342787 (search)

Cc1ccc(C(=O)c2cc(O)c(O)c([N+](=O)[O-])c2)cc1 ZINC000035342789

ZINC000035342789 (search)

CC(=O)C(=Cc1cc(O)c(O)c([N+](=O)[O-])c1)C(C)=O ZINC000035645588

ZINC000035645588 (search)

CCOC(=O)/C(C#N)=C/c1cc(O)c(O)c([N+](=O)[O-])c1 ZINC000036295148

ZINC000036295148 (search)

CN(C)C(=O)/C(C#N)=C/c1cc(O)c(O)c([N+](=O)[O-])c1 ZINC000036295151

ZINC000036295151 (search)

COc1cc(C(=O)/C=C/c2cc(O)c(O)c([N+](=O)[O-])c2)cc(OC)c1OC ZINC000036295153

ZINC000036295153 (search)

O=C(/C=C/c1cc(O)c(O)c([N+](=O)[O-])c1)c1ccccc1 ZINC000036295155

ZINC000036295155 (search)

C[C@@H](O)c1cc(=O)c(O)cn1-c1cccc(-c2ccccc2)c1 ZINC000118900997

ZINC000118900997 (search)

O=c1ccn(-c2cccc(-c3ccccc3)c2)cc1O ZINC000144182227

ZINC000144182227 (search)

O=c1ccn(-c2cc(-c3ccccc3)ccn2)cc1O ZINC000145060860

ZINC000145060860 (search)

Cn1c(-c2cccc(-c3ccccc3)c2)ncc(O)c1=O ZINC000148067150

ZINC000148067150 (search)

O=c1ccn(-c2cc(-c3ccc(Cl)c(Cl)c3)ccn2)cc1O ZINC000149855317

ZINC000149855317 (search)

CC(C)(C)c1nc(-c2ccnc(-n3ccc(=O)c(O)c3)c2)cs1 ZINC000150179779

ZINC000150179779 (search)

CC(C)c1cc(=O)c(O)cn1-c1cccc(-c2ccccc2)c1 ZINC000150202889

ZINC000150202889 (search)

CCC(CC)C(=O)/C(C#N)=C/c1cc(O)c(O)c([N+](=O)[O-])c1 ZINC000199466778

ZINC000199466778 (search)

O=c1ccn(-c2cc(-c3cccc(C(F)(F)F)n3)ccn2)cc1O ZINC000221456785

ZINC000221456785 (search)

CCC[C@H](O)c1cc(=O)c(O)cn1-c1cccc(-c2ccccc2)c1 ZINC000299858251

ZINC000299858251 (search)

CC(C)[C@H](O)c1cc(=O)c(O)cn1-c1cccc(-c2ccccc2)c1 ZINC000299863036

ZINC000299863036 (search)

O=c1cc([C@@H](O)c2ccccc2)n(-c2cccc(-c3ccccc3)c2)cc1O ZINC000299870614

ZINC000299870614 (search)

O=c1ccn(-c2cc(-c3cnn(Cc4ccccc4)c3)ccn2)cc1O ZINC000653856881

ZINC000653856881 (search)