ZINC 12

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Quick Search ZINC ID or SMILES

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ZINC Item

Suppliers, Protomers, & Similar Substances

12537649

Analogs

12537650
12537651
12537652

Draw Identity 99% 90% 80% 70%

Popular Name: methyl methyl

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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)	2.30	8.69	-11.76	1	6	0	68	366.417	5	↓ MOL2 SDF SMILES Flexibase

12537650

Analogs

12537651
12537652
12537649

Draw Identity 99% 90% 80% 70%

Popular Name: methyl methyl

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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)	2.30	8.71	-9.42	1	6	0	68	366.417	5	↓ MOL2 SDF SMILES Flexibase

12537651

Analogs

12537652
12537649
12537650

Draw Identity 99% 90% 80% 70%

Popular Name: methyl methyl

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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)	2.30	8.77	-12.36	1	6	0	68	366.417	5	↓ MOL2 SDF SMILES Flexibase

12537652

Analogs

12537649
12537650

Draw Identity 99% 90% 80% 70%

Popular Name: methyl methyl

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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)	2.30	8.61	-10.8	1	6	0	68	366.417	5	↓ MOL2 SDF SMILES Flexibase

54426742

Analogs

12595534
12595538

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-[4-(1-methylethoxy)phenyl]-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	3.31	9.31	-11.78	1	5	0	51	366.461	5	↓ MOL2 SDF SMILES Flexibase

54426743

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-[4-(1-methylethoxy)phenyl]-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	3.31	9.54	-14.43	1	5	0	51	366.461	5	↓ MOL2 SDF SMILES Flexibase

54426746

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-[4-(1-methylethoxy)phenyl]-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	3.31	9.46	-15.33	1	5	0	51	366.461	5	↓ MOL2 SDF SMILES Flexibase

54426747

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-[4-(1-methylethoxy)phenyl]-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	3.31	9.4	-10.83	1	5	0	51	366.461	5	↓ MOL2 SDF SMILES Flexibase

54426750

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-[3-methoxy-4-(2-methoxyethoxy)phenyl]-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	2.06	7.98	-15.94	1	7	0	69	412.486	8	↓ MOL2 SDF SMILES Flexibase

54426752

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-[3-methoxy-4-(2-methoxyethoxy)phenyl]-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	2.06	8.11	-18.85	1	7	0	69	412.486	8	↓ MOL2 SDF SMILES Flexibase

54426754

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-[3-methoxy-4-(2-methoxyethoxy)phenyl]-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	2.06	7.98	-19.53	1	7	0	69	412.486	8	↓ MOL2 SDF SMILES Flexibase

54426756

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-[3-methoxy-4-(2-methoxyethoxy)phenyl]-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	2.06	7.98	-15.2	1	7	0	69	412.486	8	↓ MOL2 SDF SMILES Flexibase

54426855

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2-(3-ethoxyphenyl)-2,3-dihydro-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2-(3-ethoxy…

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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)	2.93	8.77	-12.6	1	5	0	51	352.434	5	↓ MOL2 SDF SMILES Flexibase

54426856

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2-(3-ethoxyphenyl)-2,3-dihydro-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2-(3-ethoxy…

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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)	2.93	8.91	-13.84	1	5	0	51	352.434	5	↓ MOL2 SDF SMILES Flexibase

54426858

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2-(3-ethoxyphenyl)-2,3-dihydro-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2-(3-ethoxy…

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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)	2.93	8.76	-16.14	1	5	0	51	352.434	5	↓ MOL2 SDF SMILES Flexibase

54426859

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2-(3-ethoxyphenyl)-2,3-dihydro-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2-(3-ethoxy…

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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)	2.93	8.77	-10.47	1	5	0	51	352.434	5	↓ MOL2 SDF SMILES Flexibase

54426878

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-[3-(2-methoxyethoxy)phenyl]-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	2.44	8.04	-14.54	1	6	0	60	382.46	7	↓ MOL2 SDF SMILES Flexibase

54426879

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-[3-(2-methoxyethoxy)phenyl]-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	2.44	8.18	-15.4	1	6	0	60	382.46	7	↓ MOL2 SDF SMILES Flexibase

54426880

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-[3-(2-methoxyethoxy)phenyl]-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	2.44	8.04	-17.95	1	6	0	60	382.46	7	↓ MOL2 SDF SMILES Flexibase

54426881

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-[3-(2-methoxyethoxy)phenyl]-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	2.44	8.04	-12.09	1	6	0	60	382.46	7	↓ MOL2 SDF SMILES Flexibase

66131743

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-methyl-2-(4-methylphenyl)-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	3.41	9.01	-14.12	1	4	0	42	336.435	3	↓ MOL2 SDF SMILES Flexibase

66131744

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-methyl-2-(4-methylphenyl)-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	3.41	9.2	-13.89	1	4	0	42	336.435	3	↓ MOL2 SDF SMILES Flexibase

66131745

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-methyl-2-(4-methylphenyl)-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	3.41	9.83	-14.08	1	4	0	42	336.435	3	↓ MOL2 SDF SMILES Flexibase

66131746

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-methyl-2-(4-methylphenyl)-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	3.41	9.7	-10.08	1	4	0	42	336.435	3	↓ MOL2 SDF SMILES Flexibase

66131751

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2-ethyl-2,3-dihydro-2-phenyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2-ethyl-2,3…

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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)	3.47	9.15	-13.36	1	4	0	42	336.435	4	↓ MOL2 SDF SMILES Flexibase

66131752

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2-ethyl-2,3-dihydro-2-phenyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2-ethyl-2,3…

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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)	3.47	9.53	-10.22	1	4	0	42	336.435	4	↓ MOL2 SDF SMILES Flexibase

66131753

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2-ethyl-2,3-dihydro-2-phenyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2-ethyl-2,3…

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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)	3.47	9.59	-10	1	4	0	42	336.435	4	↓ MOL2 SDF SMILES Flexibase

66131754

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2-ethyl-2,3-dihydro-2-phenyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2-ethyl-2,3…

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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)	3.47	9.29	-13.58	1	4	0	42	336.435	4	↓ MOL2 SDF SMILES Flexibase

66131755

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-methyl-2-(3-nitrophenyl)-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	2.90	9.26	-15.85	1	7	0	87	367.405	4	↓ MOL2 SDF SMILES Flexibase

66131756

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-methyl-2-(3-nitrophenyl)-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	2.90	9.81	-12.18	1	7	0	87	367.405	4	↓ MOL2 SDF SMILES Flexibase

66131757

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-methyl-2-(3-nitrophenyl)-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	2.90	9.74	-12.14	1	7	0	87	367.405	4	↓ MOL2 SDF SMILES Flexibase

66131758

Analogs

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Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-methyl-2-(3-nitrophenyl)-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	2.90	9.89	-15.77	1	7	0	87	367.405	4	↓ MOL2 SDF SMILES Flexibase

66131759

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2-butyl-2,3-dihydro-2-phenyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2-butyl-2,3…

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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)	4.53	10.69	-12.89	1	4	0	42	364.489	6	↓ MOL2 SDF SMILES Flexibase

66131760

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2-butyl-2,3-dihydro-2-phenyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2-butyl-2,3…

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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)	4.53	11.07	-9.81	1	4	0	42	364.489	6	↓ MOL2 SDF SMILES Flexibase

66131761

Analogs

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Popular Name: 4(1H)-quinazolinone, 2-butyl-2,3-dihydro-2-phenyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2-butyl-2,3…

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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)	4.53	11.12	-9.69	1	4	0	42	364.489	6	↓ MOL2 SDF SMILES Flexibase

66131762

Analogs

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Popular Name: 4(1H)-quinazolinone, 2-butyl-2,3-dihydro-2-phenyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2-butyl-2,3…

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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)	4.53	10.83	-13.18	1	4	0	42	364.489	6	↓ MOL2 SDF SMILES Flexibase

66131769

Analogs

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Popular Name: 4(1H)-quinazolinone, 2-(4-bromophenyl)-2,3-dihydro-2-methyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2-(4-bromop…

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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)	3.77	9.17	-13.83	1	4	0	42	401.304	3	↓ MOL2 SDF SMILES Flexibase

66131770

Analogs

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Popular Name: 4(1H)-quinazolinone, 2-(4-bromophenyl)-2,3-dihydro-2-methyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2-(4-bromop…

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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)	3.77	9.72	-10.3	1	4	0	42	401.304	3	↓ MOL2 SDF SMILES Flexibase

66131771

Analogs

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Popular Name: 4(1H)-quinazolinone, 2-(4-bromophenyl)-2,3-dihydro-2-methyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2-(4-bromop…

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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)	3.77	9.65	-9.94	1	4	0	42	401.304	3	↓ MOL2 SDF SMILES Flexibase

66131772

Analogs

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Popular Name: 4(1H)-quinazolinone, 2-(4-bromophenyl)-2,3-dihydro-2-methyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2-(4-bromop…

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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)	3.77	9.8	-14.13	1	4	0	42	401.304	3	↓ MOL2 SDF SMILES Flexibase

66131773

Analogs

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Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-methyl-2-phenyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	2.96	8.55	-13.88	1	4	0	42	322.408	3	↓ MOL2 SDF SMILES Flexibase

66131774

Analogs

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Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-methyl-2-phenyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	2.96	9.09	-10.51	1	4	0	42	322.408	3	↓ MOL2 SDF SMILES Flexibase

66131775

Analogs

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Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-methyl-2-phenyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	2.96	9.02	-10.13	1	4	0	42	322.408	3	↓ MOL2 SDF SMILES Flexibase

66131776

Analogs

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Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-methyl-2-phenyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	2.96	9.17	-14.11	1	4	0	42	322.408	3	↓ MOL2 SDF SMILES Flexibase

66131781

Analogs

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Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-phenyl-2-propyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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	9.91	-13.06	1	4	0	42	350.462	5	↓ MOL2 SDF SMILES Flexibase

66131782

Analogs

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Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-phenyl-2-propyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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	10.29	-10.01	1	4	0	42	350.462	5	↓ MOL2 SDF SMILES Flexibase

66131783

Analogs

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Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-phenyl-2-propyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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	10.34	-9.83	1	4	0	42	350.462	5	↓ MOL2 SDF SMILES Flexibase

66131784

Analogs

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Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-phenyl-2-propyl-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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	10.05	-13.37	1	4	0	42	350.462	5	↓ MOL2 SDF SMILES Flexibase

66131789

Analogs

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Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-methyl-2-(4-nitrophenyl)-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	2.92	9.26	-17.62	1	7	0	87	367.405	4	↓ MOL2 SDF SMILES Flexibase

66131790

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4(1H)-quinazolinone, 2,3-dihydro-2-methyl-2-(4-nitrophenyl)-3-[(tetrahydro-2-furanyl)methyl]- 4(1H)-quinazolinone, 2,3-dihydro…

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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)	2.92	9.81	-13.72	1	7	0	87	367.405	4	↓ MOL2 SDF SMILES Flexibase

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SQL Query Was

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