ZINC 12

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Quick Search ZINC ID or SMILES

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ZINC Item

Suppliers, Protomers, & Similar Substances

38590588

Analogs

38590589
38590591
38590593

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(4-chlorophenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole (1S)-1-(4-chlorophenyl)-6,8-dime…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.69	11.8	-11.7	0	5	0	60	423.896	3	↓ MOL2 SDF SMILES Flexibase

38590589

Analogs

38590591
38590593
38590588

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(4-chlorophenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole (1R)-1-(4-chlorophenyl)-6,8-dime…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.69	11.83	-9.18	0	5	0	60	423.896	3	↓ MOL2 SDF SMILES Flexibase

38590591

Analogs

38590593
38590588
38590589

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(4-chlorophenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole (1S)-1-(4-chlorophenyl)-6,8-dime…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.69	11.86	-9.14	0	5	0	60	423.896	3	↓ MOL2 SDF SMILES Flexibase

38590593

Analogs

38590588
38590589
38590591

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(4-chlorophenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole (1R)-1-(4-chlorophenyl)-6,8-dime…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.69	11.79	-11.77	0	5	0	60	423.896	3	↓ MOL2 SDF SMILES Flexibase

38590684

Analogs

38590688
38590692
38590696
38591985
38591989

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-6,8-dimethyl-1-(p-tolyl)-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole-3,9-di (1R)-6,8-dimethyl-1-(p-tolyl)-2-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.46	11.56	-12.14	0	5	0	60	403.478	3	↓ MOL2 SDF SMILES Flexibase

38590688

Analogs

38590692
38590696
38591985
38591989
38591993

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-6,8-dimethyl-1-(p-tolyl)-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole-3,9-di (1S)-6,8-dimethyl-1-(p-tolyl)-2-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.46	11.94	-12.27	0	5	0	60	403.478	3	↓ MOL2 SDF SMILES Flexibase

38590692

Analogs

38590696
38591985
38591989
38591993
38591997

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-6,8-dimethyl-1-(p-tolyl)-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole-3,9-di (1R)-6,8-dimethyl-1-(p-tolyl)-2-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.46	11.76	-12.55	0	5	0	60	403.478	3	↓ MOL2 SDF SMILES Flexibase

38590696

Analogs

38591985
38591989
38591993
38591997
40513163

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-6,8-dimethyl-1-(p-tolyl)-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole-3,9-di (1S)-6,8-dimethyl-1-(p-tolyl)-2-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.46	11.99	-10.01	0	5	0	60	403.478	3	↓ MOL2 SDF SMILES Flexibase

38590837

Analogs

38590839
38590842
40513199

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(3-bromophenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole- (1R)-1-(3-bromophenyl)-6,8-dimet…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.80	11.92	-9.74	0	5	0	60	468.347	3	↓ MOL2 SDF SMILES Flexibase

38590839

Analogs

38590842
40513199
38590837

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(3-bromophenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole- (1S)-1-(3-bromophenyl)-6,8-dimet…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.80	11.95	-9.52	0	5	0	60	468.347	3	↓ MOL2 SDF SMILES Flexibase

38590842

Analogs

40513199
38590837
38590839

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(3-bromophenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole- (1R)-1-(3-bromophenyl)-6,8-dimet…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.80	11.89	-11.54	0	5	0	60	468.347	3	↓ MOL2 SDF SMILES Flexibase

38590926

Analogs

38590931
38590937
38590941

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(4-fluorophenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole (1S)-1-(4-fluorophenyl)-6,8-dime…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.18	11.35	-12.17	0	5	0	60	407.441	3	↓ MOL2 SDF SMILES Flexibase

38590931

Analogs

38590937
38590941
38590926

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(4-fluorophenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole (1R)-1-(4-fluorophenyl)-6,8-dime…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.18	11.38	-9.54	0	5	0	60	407.441	3	↓ MOL2 SDF SMILES Flexibase

38590937

Analogs

38590941
38590926
38590931

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(4-fluorophenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole (1S)-1-(4-fluorophenyl)-6,8-dime…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.18	11.4	-9.52	0	5	0	60	407.441	3	↓ MOL2 SDF SMILES Flexibase

38590941

Analogs

38590926
38590931
38590937

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(4-fluorophenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole (1R)-1-(4-fluorophenyl)-6,8-dime…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.18	11.34	-12.2	0	5	0	60	407.441	3	↓ MOL2 SDF SMILES Flexibase

38591060

Analogs

38591063
38591066
38591069

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(3,4-dichlorophenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyr (1S)-1-(3,4-dichlorophenyl)-6,8-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.30	12.25	-11.32	0	5	0	60	458.341	3	↓ MOL2 SDF SMILES Flexibase

38591063

Analogs

38591066
38591069
38591060

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(3,4-dichlorophenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyr (1R)-1-(3,4-dichlorophenyl)-6,8-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.30	12.28	-9.21	0	5	0	60	458.341	3	↓ MOL2 SDF SMILES Flexibase

38591066

Analogs

38591069
38591060
38591063

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(3,4-dichlorophenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyr (1S)-1-(3,4-dichlorophenyl)-6,8-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.30	12.31	-9.11	0	5	0	60	458.341	3	↓ MOL2 SDF SMILES Flexibase

38591069

Analogs

38591060
38591063
38591066

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(3,4-dichlorophenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyr (1R)-1-(3,4-dichlorophenyl)-6,8-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.30	12.24	-11.42	0	5	0	60	458.341	3	↓ MOL2 SDF SMILES Flexibase

38591168

Analogs

38591171
38591174
38591177

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(4-bromophenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole- (1S)-1-(4-bromophenyl)-6,8-dimet…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.82	11.91	-11.63	0	5	0	60	468.347	3	↓ MOL2 SDF SMILES Flexibase

38591171

Analogs

38591174
38591177
38591168

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(4-bromophenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole- (1R)-1-(4-bromophenyl)-6,8-dimet…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.82	11.93	-9.17	0	5	0	60	468.347	3	↓ MOL2 SDF SMILES Flexibase

38591174

Analogs

38591177
38591168
38591171

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(4-bromophenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole- (1S)-1-(4-bromophenyl)-6,8-dimet…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.82	11.96	-9.09	0	5	0	60	468.347	3	↓ MOL2 SDF SMILES Flexibase

38591177

Analogs

38591168
38591171
38591174

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(4-bromophenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole- (1R)-1-(4-bromophenyl)-6,8-dimet…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.82	11.9	-11.68	0	5	0	60	468.347	3	↓ MOL2 SDF SMILES Flexibase

38591266

Analogs

38591269
38591272
38591275
38592789
38592790

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(3-methoxy-4-pentoxy-phenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2 (1R)-1-(3-methoxy-4-pentoxy-phen…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.60	13.37	-13.67	0	7	0	78	505.611	9	↓ MOL2 SDF SMILES Flexibase

38591269

Analogs

38591272
38591275
38592789
38592790
38592791

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(3-methoxy-4-pentoxy-phenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2 (1S)-1-(3-methoxy-4-pentoxy-phen…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.60	13.74	-14.23	0	7	0	78	505.611	9	↓ MOL2 SDF SMILES Flexibase

38591272

Analogs

38591275
38592789
38592790
38592791
38592792

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(3-methoxy-4-pentoxy-phenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2 (1R)-1-(3-methoxy-4-pentoxy-phen…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.60	13.58	-14.38	0	7	0	78	505.611	9	↓ MOL2 SDF SMILES Flexibase

38591275

Analogs

38592789
38592790
38592791
38592792
38592850

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(3-methoxy-4-pentoxy-phenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2 (1S)-1-(3-methoxy-4-pentoxy-phen…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.60	13.8	-12.09	0	7	0	78	505.611	9	↓ MOL2 SDF SMILES Flexibase

38591442

Analogs

38591446
38591450
38591455
38593837
38593839

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(4-ethoxy-3-methoxy-phenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2, (1R)-1-(4-ethoxy-3-methoxy-pheny…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.03	11.01	-14.03	0	7	0	78	463.53	6	↓ MOL2 SDF SMILES Flexibase

38591446

Analogs

38591450
38591455
38593837
38593839
38593841

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(4-ethoxy-3-methoxy-phenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2, (1S)-1-(4-ethoxy-3-methoxy-pheny…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.03	11.38	-14.62	0	7	0	78	463.53	6	↓ MOL2 SDF SMILES Flexibase

38591450

Analogs

38591455
38593837
38593839
38593841
38593843

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(4-ethoxy-3-methoxy-phenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2, (1R)-1-(4-ethoxy-3-methoxy-pheny…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.03	11.23	-14.73	0	7	0	78	463.53	6	↓ MOL2 SDF SMILES Flexibase

38591455

Analogs

38593837
38593839
38593841
38593843
38591442

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(4-ethoxy-3-methoxy-phenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2, (1S)-1-(4-ethoxy-3-methoxy-pheny…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.03	11.43	-12.52	0	7	0	78	463.53	6	↓ MOL2 SDF SMILES Flexibase

38591578

Analogs

38591581
38591584
38591588
38591985
38594286

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(4-tert-butylphenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyr (1S)-1-(4-tert-butylphenyl)-6,8-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.72	13.6	-11.86	0	5	0	60	445.559	4	↓ MOL2 SDF SMILES Flexibase

38591581

Analogs

38591584
38591588
38591985
38594286
38594288

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(4-tert-butylphenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyr (1R)-1-(4-tert-butylphenyl)-6,8-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.72	13.63	-9.74	0	5	0	60	445.559	4	↓ MOL2 SDF SMILES Flexibase

38591584

Analogs

38591588
38591985
38594286
38594288
38594290

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(4-tert-butylphenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyr (1S)-1-(4-tert-butylphenyl)-6,8-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.72	13.66	-9.66	0	5	0	60	445.559	4	↓ MOL2 SDF SMILES Flexibase

38591588

Analogs

38591985
38594286
38594288
38594290
38594292

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(4-tert-butylphenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyr (1R)-1-(4-tert-butylphenyl)-6,8-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.72	13.59	-11.89	0	5	0	60	445.559	4	↓ MOL2 SDF SMILES Flexibase

38591786

Analogs

38591791
38591795
38591800
21783027
21783031

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(4-hydroxy-3-methoxy-phenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2 (1S)-1-(4-hydroxy-3-methoxy-phen…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.35	8.41	-14.1	1	7	0	89	435.476	4	↓ MOL2 SDF SMILES Flexibase

38591791

Analogs

38591795
38591800
38591786
21783027
21783031

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(4-hydroxy-3-methoxy-phenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2 (1R)-1-(4-hydroxy-3-methoxy-phen…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.35	8.44	-12.48	1	7	0	89	435.476	4	↓ MOL2 SDF SMILES Flexibase

38591795

Analogs

38591800
38591786
38591791
21783027
21783031

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(4-hydroxy-3-methoxy-phenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2 (1S)-1-(4-hydroxy-3-methoxy-phen…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.35	8.46	-11.88	1	7	0	89	435.476	4	↓ MOL2 SDF SMILES Flexibase

38591800

Analogs

38591786
38591791
38591795
21783027

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(4-hydroxy-3-methoxy-phenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2 (1R)-1-(4-hydroxy-3-methoxy-phen…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.35	8.4	-14.77	1	7	0	89	435.476	4	↓ MOL2 SDF SMILES Flexibase

38591870

Analogs

38591872
38591874
38591876
38593837
38593839

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(3-ethoxy-4-hydroxy-phenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2, (1R)-1-(3-ethoxy-4-hydroxy-pheny…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.73	8.94	-13.5	1	7	0	89	449.503	5	↓ MOL2 SDF SMILES Flexibase

38591872

Analogs

38591874
38591876
38593837
38593839
38593841

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(3-ethoxy-4-hydroxy-phenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2, (1S)-1-(3-ethoxy-4-hydroxy-pheny…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.73	9.31	-14.75	1	7	0	89	449.503	5	↓ MOL2 SDF SMILES Flexibase

38591874

Analogs

38591876
38593837
38593839
38593841
38593843

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(3-ethoxy-4-hydroxy-phenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2, (1R)-1-(3-ethoxy-4-hydroxy-pheny…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.73	9.15	-14.15	1	7	0	89	449.503	5	↓ MOL2 SDF SMILES Flexibase

38591876

Analogs

38593837
38593839
38593841
38593843
38591870

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(3-ethoxy-4-hydroxy-phenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2, (1S)-1-(3-ethoxy-4-hydroxy-pheny…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.73	9.37	-12.46	1	7	0	89	449.503	5	↓ MOL2 SDF SMILES Flexibase

38591985

Analogs

38591989
38591993
38591997
38594286
38594288

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(4-ethylphenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole- (1R)-1-(4-ethylphenyl)-6,8-dimet…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.93	12.33	-11.92	0	5	0	60	417.505	4	↓ MOL2 SDF SMILES Flexibase

38591989

Analogs

38591993
38591997
40513163
38590684
38590688

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(4-ethylphenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole- (1S)-1-(4-ethylphenyl)-6,8-dimet…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.93	12.69	-12.08	0	5	0	60	417.505	4	↓ MOL2 SDF SMILES Flexibase

38591993

Analogs

38591997
40513163
38590684
38590688
38590692

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(4-ethylphenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole- (1R)-1-(4-ethylphenyl)-6,8-dimet…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.93	12.54	-12.32	0	5	0	60	417.505	4	↓ MOL2 SDF SMILES Flexibase

38591997

Analogs

40513163
38590684
38590688
38590692
38590696

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(4-ethylphenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrole- (1S)-1-(4-ethylphenyl)-6,8-dimet…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.93	12.75	-9.85	0	5	0	60	417.505	4	↓ MOL2 SDF SMILES Flexibase

38592286

Analogs

38592290
38592293
38592297

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(3-methoxyphenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrol (1S)-1-(3-methoxyphenyl)-6,8-dim…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.05	10.58	-13.11	0	6	0	69	419.477	4	↓ MOL2 SDF SMILES Flexibase

38592290

Analogs

38592293
38592297
38592286

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(3-methoxyphenyl)-6,8-dimethyl-2-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrol (1R)-1-(3-methoxyphenyl)-6,8-dim…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.05	10.61	-11.71	0	6	0	69	419.477	4	↓ MOL2 SDF SMILES Flexibase

38592293

Analogs

38592297
38592286
38592290

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(3-methoxyphenyl)-6,8-dimethyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-chromeno[2,3-c]pyrrol (1S)-1-(3-methoxyphenyl)-6,8-dim…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.05	10.64	-11.47	0	6	0	69	419.477	4	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
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Structural Results Found: (before additional filtering)

SQL Query Was

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