NQO1

Reference Set (99 Compounds)

O=c1oc2c3c(ccc2c(O)c1Cc1c(O)c2ccc4c(c2oc1=O)CCCC4)CCCC3 ZINC000045258780

ZINC000045258780 (search)

Cc1cc2oc(=O)c(Cc3c(O)c4cc(C)c(C)cc4oc3=O)c(O)c2cc1C ZINC000045261493

ZINC000045261493 (search)

Cc1ccc2c(O)c(Cc3c(O)c4ccc(C)c(C)c4oc3=O)c(=O)oc2c1C ZINC000045258683

ZINC000045258683 (search)

O=c1oc2c3c(ccc2c(O)c1Cc1ccc2ccccc2c1)CCCC3 ZINC000045258686

ZINC000045258686 (search)

Cc1cc2oc(=O)c(Cc3ccc4ccccc4c3)c(O)c2cc1C ZINC000045255186

ZINC000045255186 (search)

O=c1oc2ccccc2c(O)c1Cc1c(O)c2ccccc2oc1=O ZINC000003869855

ZINC000003869855 (search)

COc1cccc2oc(=O)c(Cc3c(O)c4c(OC)cccc4oc3=O)c(O)c12 ZINC000045285367

ZINC000045285367 (search)

O=c1oc2cc(F)ccc2c(O)c1Cc1c(O)c2ccc(F)cc2oc1=O ZINC000045301137

ZINC000045301137 (search)

O=c1oc2ccc(F)cc2c(O)c1Cc1c(O)c2cc(F)ccc2oc1=O ZINC000045256688

ZINC000045256688 (search)

O=c1oc2c(Br)cc(Br)cc2c(O)c1Cc1c(O)c2cc(Br)cc(Br)c2oc1=O ZINC000049679408

ZINC000049679408 (search)

O=c1c(Cc2c(O)oc3cc(O)ccc3c2=O)c(O)oc2cc(O)ccc12 ZINC000100788520

ZINC000100788520 (search)

COc1ccc2c(O)c(Cc3c(O)c4ccc(OC)cc4oc3=O)c(=O)oc2c1 ZINC000006424491

ZINC000006424491 (search)

O=c1oc2ccc3c(c2c(O)c1Cc1ccc2ccccc2c1)CCCC3 ZINC000045290875

ZINC000045290875 (search)

O=c1oc2ccc3c(c2c(O)c1Cc1cccc2ccccc12)CCCC3 ZINC000045257930

ZINC000045257930 (search)

O=c1oc2c3c(ccc2c(O)c1Cc1cccc2ccccc12)CCCC3 ZINC000045261496

ZINC000045261496 (search)

Cc1cc2oc(=O)c(Cc3cccc4ccccc34)c(O)c2cc1C ZINC000045254451

ZINC000045254451 (search)

O=c1oc2ccc(Cl)cc2c(O)c1Cc1c(O)c2cc(Cl)ccc2oc1=O ZINC000045284980

ZINC000045284980 (search)

Cc1ccc(Cc2c(O)c3cc(C)c(C)cc3oc2=O)cc1C ZINC000045256971

ZINC000045256971 (search)

COc1ccc2oc(=O)c(Cc3c(O)c4cc(OC)ccc4oc3=O)c(O)c2c1 ZINC000045318899

ZINC000045318899 (search)

Cc1ccc2oc(=O)c(Cc3c(O)c4cc(C)ccc4oc3=O)c(O)c2c1 ZINC000045258649

ZINC000045258649 (search)

O=c1oc2ccccc2c(O)c1Cc1ccc2ccccc2c1 ZINC000045260211

ZINC000045260211 (search)

O=c1oc2ccc3c(c2c(O)c1Cc1ccccc1)CCCC3 ZINC000045284805

ZINC000045284805 (search)

O=c1oc2ccccc2c(O)c1Cc1cccc2ccccc12 ZINC000045318850

ZINC000045318850 (search)

Cc1ccc(Cc2c(O)c3ccccc3oc2=O)cc1C ZINC000045298892

ZINC000045298892 (search)

O=c1oc2c3c(ccc2c(O)c1Cc1ccccc1)CCCC3 ZINC000045289111

ZINC000045289111 (search)

Cc1cc2oc(=O)c(Cc3ccccc3)c(O)c2cc1C ZINC000045285559

ZINC000045285559 (search)

COc1cc2oc(=O)c(Cc3c(O)c4cc(OC)c(OC)cc4oc3=O)c(O)c2cc1OC ZINC000045259186

ZINC000045259186 (search)

CC(C)CCNc1ccc2nnn3c4ccccc4c(=O)c1c23 ZINC000101321766

ZINC000101321766 (search)

C[N+](C)([O-])CCNc1ccc2nnn3c4ccccc4c(=O)c1c23 ZINC000101321770

ZINC000101321770 (search)

CN(C)c1ccc(C(c2c(O)oc3ccccc3c2=O)c2c(O)oc3ccccc3c2=O)cc1 ZINC000004062977

ZINC000004062977 (search)

CC(C)CCNc1ccc2nnn3c4ccc(Br)cc4c(=O)c1c23 ZINC000101321754

ZINC000101321754 (search)

O=c1c(C(c2ccc(C(c3c(O)oc4ccccc4c3=O)c3c(O)oc4ccccc4c3=O)cc2)c2c(O)oc3ccccc3c2=O)c(O)oc2ccccc12 ZINC000095609774

ZINC000095609774 (search)

COc1ccc2c(c1)c(=O)c1c(NCCN(C)C)ccc3nnn2c31 ZINC000005732922

ZINC000005732922 (search)

O=c1c(C(c2ccc3ccccc3c2)c2c(O)oc3ccccc3c2=O)c(O)oc2ccccc12 ZINC000005835001

ZINC000005835001 (search)

O=c1oc2ccccc2c(O)c1Cc1ccccc1 ZINC000006580932

ZINC000006580932 (search)

O=c1c2cc(Br)ccc2n2nnc3ccc(NCCCO)c1c32 ZINC000101321764

ZINC000101321764 (search)

O=c1oc2ccccc2c(O)c1C(c1ccc2c(c1)-c1ccccc1C2)c1c(O)c2ccccc2oc1=O ZINC000028826676

ZINC000028826676 (search)

CN(C)CCNc1ccc2nnn3c4ccc(F)cc4c(=O)c1c23 ZINC000101321745

ZINC000101321745 (search)

O=c1oc2ccccc2c(O)c1[C@@H]1c2ccccc2Oc2c1c(=O)oc1ccccc21 ZINC000006576216

ZINC000006576216 (search)

O=c1c2ccccc2n2nnc3ccc(NCCCO)c1c32 ZINC000101321768

ZINC000101321768 (search)

COc1ccc2c(c1)c(=O)c1c(NCCCO)ccc3nnn2c31 ZINC000101321761

ZINC000101321761 (search)

COc1ccc(C(c2c(O)c3ccccc3oc2=O)c2c(O)c3ccccc3oc2=O)cc1 ZINC000004179475

ZINC000004179475 (search)

O=C1O[C@@H]2C=CC=CC2=C2Oc3c(c(=O)oc4ccccc34)[C@H](c3c(O)c4ccccc4oc3=O)[C@H]12 ZINC000028826685

ZINC000028826685 (search)

O=C(/C=C/c1ccc(O)cc1)c1c(O)c2ccccc2oc1=O ZINC000167418260

ZINC000167418260 (search)

COc1ccc2c(c1)c(=O)c1c(NCC[N+](C)(C)[O-])ccc3nnn2c31 ZINC000101321779

ZINC000101321779 (search)

O=c1c(C(c2ccc(/C=C/c3ccccc3)cc2)c2c(O)oc3ccccc3c2=O)c(O)oc2ccccc12 ZINC000100788524

ZINC000100788524 (search)

O=c1c(C(c2cnc3ccccc3c2)c2c(O)oc3ccccc3c2=O)c(O)oc2ccccc12 ZINC000005580899

ZINC000005580899 (search)

Fc1ccccc1[C@H]1CC(c2ccc3ccccc3c2)=Nc2ccccc2S1 ZINC000005810693

ZINC000005810693 (search)

COC1=CC(=O)c2c(c(COc3ccc([N+](=O)[O-])cc3)c(C)n2C)C1=O ZINC000000587989

ZINC000000587989 (search)

O=c1c(C(c2cccc(C(c3c(O)oc4ccccc4c3=O)c3c(O)oc4ccccc4c3=O)c2)c2c(O)oc3ccccc3c2=O)c(O)oc2ccccc12 ZINC000096902001

ZINC000096902001 (search)

C[N+](C)([O-])CCNc1ccc2nnn3c4ccc(Br)cc4c(=O)c1c23 ZINC000101321773

ZINC000101321773 (search)

O=C1C=C(NCCc2c[nH]c3ccccc23)C(=O)c2ncccc21 ZINC000200519047

ZINC000200519047 (search)

O=c1c(C(c2cccs2)c2c(O)oc3ccccc3c2=O)c(O)oc2ccccc12 ZINC000005835088

ZINC000005835088 (search)

CCCC(c1c(O)c2ccccc2oc1=O)c1c(O)c2ccccc2oc1=O ZINC000005819733

ZINC000005819733 (search)

COc1cc(C(c2c(O)oc3ccccc3c2=O)c2c(O)oc3ccccc3c2=O)ccc1O ZINC000005835076

ZINC000005835076 (search)

O=C(/C=C/c1ccc(Cl)cc1)c1c(O)c2ccccc2oc1=O ZINC000005948683

ZINC000005948683 (search)

CN(C)CCNc1ccc2nnn3c4ccc(O)cc4c(=O)c1c23 ZINC000005140451

ZINC000005140451 (search)

CN(C)CCNc1ccc2nnn3c4ccc(Br)cc4c(=O)c1c23 ZINC000101321740

ZINC000101321740 (search)

COc1ccc(Nc2ccc3nnn4c5ccccc5c(=O)c2c34)cc1 ZINC000101321776

ZINC000101321776 (search)

O=c1c(C(c2ccc(-c3ccccc3)cc2)c2c(O)oc3ccccc3c2=O)c(O)oc2ccccc12 ZINC000100788473

ZINC000100788473 (search)

CN(C)c1ccc(/C=C/C(=O)c2c(O)c3ccccc3oc2=O)cc1 ZINC000096034870

ZINC000096034870 (search)

c1ccc2sc(-c3c4ccccc4cc4ccc5ccccc5c34)cc2c1 ZINC000001656970

ZINC000001656970 (search)

COC(=O)C(c1c(O)c2ccccc2oc1=O)c1c(O)c2ccccc2oc1=O ZINC000045283296

ZINC000045283296 (search)

O=c1c(C(c2cc(OCc3ccccc3)cc(OCc3ccccc3)c2)c2c(O)oc3ccccc3c2=O)c(O)oc2ccccc12 ZINC000005835045

ZINC000005835045 (search)

CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@H]1Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000045318072

ZINC000045318072 (search)

O=c1c(C(c2ccco2)c2c(O)oc3ccccc3c2=O)c(O)oc2ccccc12 ZINC000006576212

ZINC000006576212 (search)

S=C(Cc1ccc2c3c([nH]c2c1)CCCC3)N1CCOCC1 ZINC000000233279

ZINC000000233279 (search)

O=C(O)c1ccc(C(c2c(O)oc3ccccc3c2=O)c2c(O)oc3ccccc3c2=O)cc1 ZINC000026507316

ZINC000026507316 (search)

CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@H]1Nc1ccc([N+](=O)[O-])cc1 ZINC000040403204

ZINC000040403204 (search)

CN(C)CCNc1ccc2nnn3c4ccccc4c(=O)c1c23 ZINC000005732905

ZINC000005732905 (search)

O=C1c2ccccc2C(=O)c2c(O)c(NCCCN3CCOCC3)cc(O)c21 ZINC000031960099

ZINC000031960099 (search)

O=c1c2ccccc2c(=O)c2c1c(O)cc1[nH]c3ccccc3[nH]c12 ZINC000101100279

ZINC000101100279 (search)

O=c1oc2ccccc2c(O)c1C(c1ccc(Cl)cc1)c1c(O)c2ccccc2oc1=O ZINC000005618522

ZINC000005618522 (search)

O=c1c(C(c2ccc(O)cc2)c2c(O)oc3ccccc3c2=O)c(O)oc2ccccc12 ZINC000005835069

ZINC000005835069 (search)

Cc1cc2c(cc1C)-c1occ(C)c1C(=O)C2=O ZINC001772577146

ZINC001772577146 (search)

COc1ccc(N[C@@H]2C3=C(OC2(C)C)c2ccccc2C(=O)C3=O)c([N+](=O)[O-])c1 ZINC000049784823

ZINC000049784823 (search)

CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@@H]1Nc1cccc([N+](=O)[O-])c1 ZINC000028870982

ZINC000028870982 (search)

Cc1coc2c1C(=O)C(=O)c1c(C)ccc(C)c1-2 ZINC001772646205

ZINC001772646205 (search)

CC1(C)CCC2=C(O1)c1ccccc1C(=O)C2=O ZINC000001531790

ZINC000001531790 (search)

Oc1ccccc1C(=NNc1ccccc1)c1ccccc1O ZINC000004962613

ZINC000004962613 (search)

O=C1c2ccccc2C(=O)c2c(O)c(NCCCN(CCO)CCO)cc(O)c21 ZINC000005393058

ZINC000005393058 (search)

Cn1c2cc(O)ccc2c2c3nc4ccccc4nc3cc(O)c21 ZINC000005579959

ZINC000005579959 (search)

Cc1cc2c(cc1C)-c1occc1C(=O)C2=O ZINC001772607718

ZINC001772607718 (search)

CCc1coc2c1C(=O)C(=O)c1cc(C)ccc1-2 ZINC001772650276

ZINC001772650276 (search)

Nc1cc(=O)oc2ccccc12 ZINC000000337346

ZINC000000337346 (search)

O=c1c2ccccc2n2nnc3ccc(NCCc4ccccc4)c1c32 ZINC000101321750

ZINC000101321750 (search)

CC(C)c1ccc(C(c2c(O)oc3ccccc3c2=O)c2c(O)oc3ccccc3c2=O)cc1 ZINC000003954452

ZINC000003954452 (search)

CCOc1ccc(OCC)cc1 ZINC000000394919

ZINC000000394919 (search)

COc1ccc2c(c1)c(=O)c1c(NCCc3ccccc3)ccc3nnn2c31 ZINC000101321756

ZINC000101321756 (search)

Cc1ccc2c(c1)-c1occ(C)c1C(=O)C2=O ZINC000136899294

ZINC000136899294 (search)

O=c1c(C(c2ccccc2)c2c(O)oc3ccccc3c2=O)c(O)oc2ccccc12 ZINC000100788497

ZINC000100788497 (search)

COc1ccc2c(c1)C1=C(C(=O)C2=O)C(C)(C)[C@@H](C)O1 ZINC000299854952

ZINC000299854952 (search)

O=c1c(C(c2ccccc2)c2c(O)oc3cc(O)ccc3c2=O)c(O)oc2cc(O)ccc12 ZINC000100788501

ZINC000100788501 (search)

Nc1ccc(O)c2c1C(=O)c1c(O)c(S(=O)(=O)O)cc(N)c1C2=O ZINC000003846907

ZINC000003846907 (search)

O=c1c(C(c2ccccn2)c2c(O)oc3cc(O)ccc3c2=O)c(O)oc2cc(O)ccc12 ZINC000100788463

ZINC000100788463 (search)

Cc1ccc2c(c1)C(=O)C(=O)c1c(C)coc1-2 ZINC000136899360

ZINC000136899360 (search)

Oc1cc(O)cc(-c2c(O)cc(O)cc2O)c1 ZINC000004023085

ZINC000004023085 (search)

COc1ccc(OC)c2cc3ccccc3cc12 ZINC000001697899

ZINC000001697899 (search)

CN(C)CCNc1ccc2ncn3c4ccc(O)cc4c(=O)c1c23 ZINC000005502555

ZINC000005502555 (search)