ZINC 12

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ZINC Item

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9705907

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(3-isopropoxypropyl)-N-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(3-isopropoxypropyl)-N-[2-(m-…

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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)	3.02	-2.56	-11.55	3	8	0	109	437.496	9	↓ MOL2 SDF SMILES Flexibase

9705908

Analogs

9705905

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-hydroxyethyl)-N-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(2-hydroxyethyl)-N-[2-(m-toly…

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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)	1.40	-5.09	-13.46	4	8	0	120	381.388	6	↓ MOL2 SDF SMILES Flexibase

9705909

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(3-hydroxypropyl)-N-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(3-hydroxypropyl)-N-[2-(m-tol…

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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)	1.67	-5.03	-12.51	4	8	0	120	395.415	7	↓ MOL2 SDF SMILES Flexibase

9705910

Analogs

9705911

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-hydroxypropyl)-N-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(2-hydroxypropyl)-N-[2-(m-tol…

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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)	1.76	-4.82	-11.79	4	8	0	120	395.415	6	↓ MOL2 SDF SMILES Flexibase

9705911

Analogs

9705910

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-hydroxypropyl)-N-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(2-hydroxypropyl)-N-[2-(m-tol…

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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)	1.76	-4.89	-13.18	4	8	0	120	395.415	6	↓ MOL2 SDF SMILES Flexibase

9705912

Analogs

9705913

Draw Identity 99% 90% 80% 70%

Popular Name: N-[1-(hydroxymethyl)propyl]-N'-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N-[1-(hydroxymethyl)propyl]-N'-[…

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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)	2.26	-4.11	-11.54	4	8	0	120	409.442	7	↓ MOL2 SDF SMILES Flexibase

9705913

Analogs

9705912

Draw Identity 99% 90% 80% 70%

Popular Name: N-[1-(hydroxymethyl)propyl]-N'-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N-[1-(hydroxymethyl)propyl]-N'-[…

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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)	2.26	-4.1	-11.58	4	8	0	120	409.442	7	↓ MOL2 SDF SMILES Flexibase

9705914

Analogs

9705915

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-methoxy-1-methyl-ethyl)-N-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(2-methoxy-1-methyl-ethyl)-N-…

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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)	2.34	-2.21	-11.05	3	8	0	109	409.442	7	↓ MOL2 SDF SMILES Flexibase

9705915

Analogs

9705914

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-methoxy-1-methyl-ethyl)-N-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(2-methoxy-1-methyl-ethyl)-N-…

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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)	2.34	-2.21	-11.27	3	8	0	109	409.442	7	↓ MOL2 SDF SMILES Flexibase

9705916

Analogs

9705918

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-hydroxy-1,1-dimethyl-ethyl)-N-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(2-hydroxy-1,1-dimethyl-ethyl…

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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)	2.21	-4.03	-12.25	4	8	0	120	409.442	6	↓ MOL2 SDF SMILES Flexibase

9705917

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-[2-(2-hydroxyethoxy)ethyl]-N-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-[2-(2-hydroxyethoxy)ethyl]-N-…

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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)	1.29	-5.68	-15.07	4	9	0	129	425.441	9	↓ MOL2 SDF SMILES Flexibase

9705918

Analogs

9705916

Draw Identity 99% 90% 80% 70%

Popular Name: N'-[2-hydroxy-1-(hydroxymethyl)-1-methyl-ethyl]-N-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-[2-hydroxy-1-(hydroxymethyl)-…

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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)	1.20	-6.7	-13.11	5	9	0	140	425.441	7	↓ MOL2 SDF SMILES Flexibase

9705919

Analogs

9705906

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-ethoxypropyl)-N'-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N-(3-ethoxypropyl)-N'-[2-(m-toly…

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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)	2.66	-2.82	-11.66	3	8	0	109	423.469	9	↓ MOL2 SDF SMILES Flexibase

9705920

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: ethyl ethyl

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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)	2.27	-1.35	-11.86	3	9	0	126	423.425	8	↓ MOL2 SDF SMILES Flexibase

9705921

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2,2-dimethoxyethyl)-N-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(2,2-dimethoxyethyl)-N-[2-(m-…

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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)	1.97	-3.04	-12.43	3	9	0	118	425.441	8	↓ MOL2 SDF SMILES Flexibase

9705922

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,2-diethoxyethyl)-N'-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N-(2,2-diethoxyethyl)-N'-[2-(m-t…

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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)	2.73	-3	-12.22	3	9	0	118	453.495	10	↓ MOL2 SDF SMILES Flexibase

9705923

Analogs

9705924
22793042

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-dimethylaminoethyl)-N-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(2-dimethylaminoethyl)-N-[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)	2.06	-1.68	-45.23	4	8	1	104	409.466	7	↓ MOL2 SDF SMILES Flexibase

9705924

Analogs

22793042
9705923

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-diethylaminoethyl)-N'-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N-(2-diethylaminoethyl)-N'-[2-(m…

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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)	2.81	-1.63	-43.7	4	8	1	104	437.52	9	↓ MOL2 SDF SMILES Flexibase

9705925

Analogs

9705926

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(3-dimethylaminopropyl)-N-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(3-dimethylaminopropyl)-N-[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)	2.33	-1.55	-45.64	4	8	1	104	423.493	8	↓ MOL2 SDF SMILES Flexibase

9705926

Analogs

9705925

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-diethylaminopropyl)-N'-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N-(3-diethylaminopropyl)-N'-[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)	3.08	-1.24	-43.8	4	8	1	104	451.547	10	↓ MOL2 SDF SMILES Flexibase

9705927

Analogs

9705928

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-diethylamino-1-methyl-butyl)-N'-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N-(4-diethylamino-1-methyl-butyl…

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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)	3.68	-0.31	-43.89	4	8	1	104	479.601	11	↓ MOL2 SDF SMILES Flexibase

9705928

Analogs

9705927

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-diethylamino-1-methyl-butyl)-N'-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N-(4-diethylamino-1-methyl-butyl…

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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)	3.68	-0.58	-41.91	4	8	1	104	479.601	11	↓ MOL2 SDF SMILES Flexibase

9705970

Analogs

9705897

Draw Identity 99% 90% 80% 70%

Popular Name: N'-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-N-pentyl-oxamide N'-[2-(m-tolylcarbamoyl)benzofur…

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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)	3.97	-1.88	-10.77	3	7	0	100	407.47	8	↓ MOL2 SDF SMILES Flexibase

9705977

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-[2-(2-hydroxyethylamino)ethyl]-N-[2-(m-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-[2-(2-hydroxyethylamino)ethyl…

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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)	0.83	-6.55	-48.43	6	9	1	137	425.465	9	↓ MOL2 SDF SMILES Flexibase

9705978

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-methyl-N-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-methyl-N-[2-(p-tolylcarbamoyl…

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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)	2.05	-2.33	-11.88	3	7	0	100	351.362	4	↓ MOL2 SDF SMILES Flexibase

9705979

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-ethyl-N'-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N-ethyl-N'-[2-(p-tolylcarbamoyl)…

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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)	2.43	-2.24	-11.18	3	7	0	100	365.389	5	↓ MOL2 SDF SMILES Flexibase

9705980

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-propyl-N'-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N-propyl-N'-[2-(p-tolylcarbamoyl…

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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	-2.16	-10.97	3	7	0	100	379.416	6	↓ MOL2 SDF SMILES Flexibase

9705981

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-chloroethyl)-N-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(2-chloroethyl)-N-[2-(p-tolyl…

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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)	2.66	-2.58	-11.97	3	7	0	100	399.834	6	↓ MOL2 SDF SMILES Flexibase

9705982

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-bromoethyl)-N-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(2-bromoethyl)-N-[2-(p-tolylc…

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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)	2.79	-3.2	-11.78	3	7	0	100	444.285	6	↓ MOL2 SDF SMILES Flexibase

9705983

Analogs

9706056
9705811

Draw Identity 99% 90% 80% 70%

Popular Name: N-butyl-N'-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N-butyl-N'-[2-(p-tolylcarbamoyl)…

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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)	3.49	-2.04	-10.86	3	7	0	100	393.443	7	↓ MOL2 SDF SMILES Flexibase

9705984

Analogs

9705988
9705816

Draw Identity 99% 90% 80% 70%

Popular Name: N'-isopropyl-N-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-isopropyl-N-[2-(p-tolylcarbam…

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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)	2.73	-1.7	-11.25	3	7	0	100	379.416	5	↓ MOL2 SDF SMILES Flexibase

9705985

Analogs

9705813

Draw Identity 99% 90% 80% 70%

Popular Name: N'-isobutyl-N-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-isobutyl-N-[2-(p-tolylcarbamo…

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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)	3.18	-1.66	-10.67	3	7	0	100	393.443	6	↓ MOL2 SDF SMILES Flexibase

9705986

Analogs

9705987
9705814
9705815

Draw Identity 99% 90% 80% 70%

Popular Name: N'-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-N-sec-butyl-oxamide N'-[2-(p-tolylcarbamoyl)benzofur…

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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)	3.26	-1.33	-11.15	3	7	0	100	393.443	6	↓ MOL2 SDF SMILES Flexibase

9705987

Analogs

9705814
9705815
9705986

Draw Identity 99% 90% 80% 70%

Popular Name: N'-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-N-sec-butyl-oxamide N'-[2-(p-tolylcarbamoyl)benzofur…

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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)	3.26	-1.33	-11.09	3	7	0	100	393.443	6	↓ MOL2 SDF SMILES Flexibase

9705988

Analogs

9705816
9705984

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-N'-tert-butyl-oxamide N-[2-(p-tolylcarbamoyl)benzofura…

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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)	3.24	-1.35	-10.97	3	7	0	100	393.443	5	↓ MOL2 SDF SMILES Flexibase

9705989

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-allyl-N-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-allyl-N-[2-(p-tolylcarbamoyl)…

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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)	2.70	-1.77	-10.85	3	7	0	100	377.4	6	↓ MOL2 SDF SMILES Flexibase

9705990

Analogs

9705818

Draw Identity 99% 90% 80% 70%

Popular Name: N'-isopentyl-N-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-isopentyl-N-[2-(p-tolylcarbam…

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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)	3.71	-1.73	-10.83	3	7	0	100	407.47	7	↓ MOL2 SDF SMILES Flexibase

9705991

Analogs

9705994
9705819

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-methoxyethyl)-N-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(2-methoxyethyl)-N-[2-(p-toly…

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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)	2.04	-2.9	-11.93	3	8	0	109	395.415	7	↓ MOL2 SDF SMILES Flexibase

9705992

Analogs

9706005
9705820

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(3-methoxypropyl)-N-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(3-methoxypropyl)-N-[2-(p-tol…

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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)	2.31	-2.84	-11.81	3	8	0	109	409.442	8	↓ MOL2 SDF SMILES Flexibase

9705993

Analogs

9705821

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(3-isopropoxypropyl)-N-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(3-isopropoxypropyl)-N-[2-(p-…

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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)	3.05	-2.6	-11.64	3	8	0	109	437.496	9	↓ MOL2 SDF SMILES Flexibase

9705994

Analogs

9705991

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-hydroxyethyl)-N-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(2-hydroxyethyl)-N-[2-(p-toly…

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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)	1.42	-5.13	-13.14	4	8	0	120	381.388	6	↓ MOL2 SDF SMILES Flexibase

9705995

Analogs

9705823

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(3-hydroxypropyl)-N-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(3-hydroxypropyl)-N-[2-(p-tol…

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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)	1.69	-5.07	-12.57	4	8	0	120	395.415	7	↓ MOL2 SDF SMILES Flexibase

9705996

Analogs

9705997
9705824
9705825

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-hydroxypropyl)-N-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(2-hydroxypropyl)-N-[2-(p-tol…

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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)	1.79	-4.83	-11.95	4	8	0	120	395.415	6	↓ MOL2 SDF SMILES Flexibase

9705997

Analogs

9705824
9705825
9705996

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-hydroxypropyl)-N-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(2-hydroxypropyl)-N-[2-(p-tol…

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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)	1.79	-4.87	-11.91	4	8	0	120	395.415	6	↓ MOL2 SDF SMILES Flexibase

9705998

Analogs

9705999
9705826
9705827

Draw Identity 99% 90% 80% 70%

Popular Name: N-[1-(hydroxymethyl)propyl]-N'-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N-[1-(hydroxymethyl)propyl]-N'-[…

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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)	2.29	-4.08	-11.7	4	8	0	120	409.442	7	↓ MOL2 SDF SMILES Flexibase

9705999

Analogs

9705826
9705827
9705998

Draw Identity 99% 90% 80% 70%

Popular Name: N-[1-(hydroxymethyl)propyl]-N'-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N-[1-(hydroxymethyl)propyl]-N'-[…

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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)	2.29	-4.08	-11.77	4	8	0	120	409.442	7	↓ MOL2 SDF SMILES Flexibase

9706000

Analogs

9706001
9705828
9705829

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-methoxy-1-methyl-ethyl)-N-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(2-methoxy-1-methyl-ethyl)-N-…

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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)	2.37	-2.19	-11.41	3	8	0	109	409.442	7	↓ MOL2 SDF SMILES Flexibase

9706001

Analogs

9705828
9705829
9706000

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-methoxy-1-methyl-ethyl)-N-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(2-methoxy-1-methyl-ethyl)-N-…

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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)	2.37	-2.18	-11.16	3	8	0	109	409.442	7	↓ MOL2 SDF SMILES Flexibase

9706002

Analogs

9706004
9705830
9705832

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-hydroxy-1,1-dimethyl-ethyl)-N-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-(2-hydroxy-1,1-dimethyl-ethyl…

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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)	2.23	-4.03	-12.48	4	8	0	120	409.442	6	↓ MOL2 SDF SMILES Flexibase

9706003

Analogs

9705831

Draw Identity 99% 90% 80% 70%

Popular Name: N'-[2-(2-hydroxyethoxy)ethyl]-N-[2-(p-tolylcarbamoyl)benzofuran-3-yl]-oxamide N'-[2-(2-hydroxyethoxy)ethyl]-N-…

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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)	1.31	-5.71	-14.69	4	9	0	129	425.441	9	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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Structural Results Found: (before additional filtering)

SQL Query Was

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Embed Link to Results

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