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ZINC Item

Suppliers, Protomers, & Similar Substances

6728325

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4-ethoxyphenyl)sulfonyl-phenyl-amino]-N-phenyl-acetamide 2-[(4-ethoxyphenyl)sulfonyl-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)	4.55	8.02	-21.65	1	6	0	76	410.495	8	↓ MOL2 SDF SMILES Flexibase

6728348

Analogs

1154803

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3,4-dimethylphenyl)-2-[(2,3-dimethylphenyl)-phenylsulfonyl-amino]-acetamide N-(3,4-dimethylphenyl)-2-[(2,3-d…

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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)	5.75	-1.5	-13.17	1	5	0	66	422.55	6	↓ MOL2 SDF SMILES Flexibase

6728358

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,5-dimethylphenyl)-2-[(2,3-dimethylphenyl)-phenylsulfonyl-amino]-acetamide N-(2,5-dimethylphenyl)-2-[(2,3-d…

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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)	5.75	-1.23	-13.01	1	5	0	66	422.55	6	↓ MOL2 SDF SMILES Flexibase

6728361

Analogs

1154803

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3,5-dimethylphenyl)-2-[(2,3-dimethylphenyl)-phenylsulfonyl-amino]-acetamide N-(3,5-dimethylphenyl)-2-[(2,3-d…

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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)	5.75	10.62	-20.86	1	5	0	66	422.55	6	↓ MOL2 SDF SMILES Flexibase

6728362

Analogs

1154803

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2,3-dimethylphenyl)-phenylsulfonyl-amino]-N-phenyl-acetamide 2-[(2,3-dimethylphenyl)-phenylsu…

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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)	4.92	9.82	-14.18	1	5	0	66	394.496	6	↓ MOL2 SDF SMILES Flexibase

20234905

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3,4-dimethoxyphenyl)-2-(m-tolyl-(p-tolylsulfonyl)amino)acetamide N-(3,4-dimethoxyphenyl)-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)	4.64	8.8	-25.61	1	7	0	85	454.548	8	↓ MOL2 SDF SMILES Flexibase

20234912

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-chloro-2-methoxy-phenyl)-2-(m-tolyl-(p-tolylsulfonyl)amino)acetamide N-(5-chloro-2-methoxy-phenyl)-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)	5.66	9.52	-22.92	1	6	0	76	458.967	7	↓ MOL2 SDF SMILES Flexibase

20234917

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-chloro-2-methyl-phenyl)-2-(m-tolyl-(p-tolylsulfonyl)amino)acetamide N-(5-chloro-2-methyl-phenyl)-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)	6.05	10.87	-24.67	1	5	0	66	442.968	6	↓ MOL2 SDF SMILES Flexibase

20234920

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[4-(cyanomethyl)phenyl]-2-(m-tolyl-(p-tolylsulfonyl)amino)acetamide N-[4-(cyanomethyl)phenyl]-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)	4.96	10.71	-26.69	1	6	0	90	433.533	7	↓ MOL2 SDF SMILES Flexibase

20234929

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(m-tolyl-(p-tolylsulfonyl)amino)acetamide N-[4-chloro-3-(trifluoromethyl)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)	6.49	10.99	-21.13	1	5	0	66	496.938	7	↓ MOL2 SDF SMILES Flexibase

20234953

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-chloro-2-methyl-phenyl)-2-(p-tolyl-(p-tolylsulfonyl)amino)acetamide N-(3-chloro-2-methyl-phenyl)-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)	6.05	10.36	-19.71	1	5	0	66	442.968	6	↓ MOL2 SDF SMILES Flexibase

20234956

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(p-tolyl-(p-tolylsulfonyl)amino)-N-[2-(trifluoromethyl)phenyl]acetamide 2-(p-tolyl-(p-tolylsulfonyl)amin…

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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)	5.86	10.45	-17.51	1	5	0	66	462.493	7	↓ MOL2 SDF SMILES Flexibase

20234959

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(p-tolyl-(p-tolylsulfonyl)amino)acetamide N-[4-chloro-3-(trifluoromethyl)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)	6.52	10.53	-19.91	1	5	0	66	496.938	7	↓ MOL2 SDF SMILES Flexibase

20235013

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3,4-dimethoxyphenyl)-2-[(2,4-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(3,4-dimethoxyphenyl)-2-[(2,4-…

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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)	5.04	9.18	-26.51	1	7	0	85	468.575	8	↓ MOL2 SDF SMILES Flexibase

20235016

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-chloro-2-methyl-phenyl)-2-[(2,4-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(4-chloro-2-methyl-phenyl)-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)	6.45	11.28	-21.82	1	5	0	66	456.995	6	↓ MOL2 SDF SMILES Flexibase

20235019

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-chloro-2-methyl-phenyl)-2-[(2,4-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(3-chloro-2-methyl-phenyl)-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)	6.42	11.17	-20.4	1	5	0	66	456.995	6	↓ MOL2 SDF SMILES Flexibase

20235022

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[4-(cyanomethyl)phenyl]-2-[(2,4-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-[4-(cyanomethyl)phenyl]-2-[(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)	5.36	11.11	-28.04	1	6	0	90	447.56	7	↓ MOL2 SDF SMILES Flexibase

20235032

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-bromo-3-methyl-phenyl)-2-[(2,4-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(4-bromo-3-methyl-phenyl)-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)	6.58	11.17	-22.26	1	5	0	66	501.446	6	↓ MOL2 SDF SMILES Flexibase

20235036

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(2,4-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-[4-chloro-3-(trifluoromethyl)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)	6.89	11.34	-26.47	1	5	0	66	510.965	7	↓ MOL2 SDF SMILES Flexibase

20235040

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[2-[(2,4-dimethylphenyl)-(p-tolylsulfonyl)amino]acetyl]amino]benzamide 4-[[2-[(2,4-dimethylphenyl)-(p-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)	4.21	6.67	-27.04	3	7	0	110	451.548	7	↓ MOL2 SDF SMILES Flexibase

20235072

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2,5-dimethylphenyl)-(p-tolylsulfonyl)amino]-N-(4-fluorophenyl)acetamide 2-[(2,5-dimethylphenyl)-(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)	5.56	10.48	-15.12	1	5	0	66	426.513	6	↓ MOL2 SDF SMILES Flexibase

20235076

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[4-(cyanomethyl)phenyl]-2-[(2,5-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-[4-(cyanomethyl)phenyl]-2-[(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)	5.36	11.59	-19.56	1	6	0	90	447.56	7	↓ MOL2 SDF SMILES Flexibase

20235084

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-bromo-3-methyl-phenyl)-2-[(2,5-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(4-bromo-3-methyl-phenyl)-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)	6.58	11.68	-14.32	1	5	0	66	501.446	6	↓ MOL2 SDF SMILES Flexibase

20235088

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(2,5-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-[4-chloro-3-(trifluoromethyl)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)	6.89	11.84	-17.84	1	5	0	66	510.965	7	↓ MOL2 SDF SMILES Flexibase

20235099

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[(2,5-dimethylphenyl)-(p-tolylsulfonyl)amino]acetyl]amino]benzoic 2-[[2-[(2,5-dimethylphenyl)-(p-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)	5.44	9.9	-58.99	1	7	-1	107	451.524	7	↓ MOL2 SDF SMILES Flexibase

20235139

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3,4-dimethoxyphenyl)-2-[(3,5-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(3,4-dimethoxyphenyl)-2-[(3,5-…

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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)	5.04	9.01	-24.22	1	7	0	85	468.575	8	↓ MOL2 SDF SMILES Flexibase

20235142

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-chloro-2-methoxy-phenyl)-2-[(3,5-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(5-chloro-2-methoxy-phenyl)-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)	6.06	9.71	-21.56	1	6	0	76	472.994	7	↓ MOL2 SDF SMILES Flexibase

20235146

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-chloro-2-methyl-phenyl)-2-[(3,5-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(5-chloro-2-methyl-phenyl)-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)	6.45	11.1	-22.53	1	5	0	66	456.995	6	↓ MOL2 SDF SMILES Flexibase

20235150

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-chloro-4-methyl-phenyl)-2-[(3,5-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(3-chloro-4-methyl-phenyl)-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)	6.45	10.85	-23.85	1	5	0	66	456.995	6	↓ MOL2 SDF SMILES Flexibase

20235154

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[4-(cyanomethyl)phenyl]-2-[(3,5-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-[4-(cyanomethyl)phenyl]-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)	5.36	10.93	-27.58	1	6	0	90	447.56	7	↓ MOL2 SDF SMILES Flexibase

20235159

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-chloro-4-methoxy-phenyl)-2-[(3,5-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(3-chloro-4-methoxy-phenyl)-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)	6.06	9.62	-26.16	1	6	0	76	472.994	7	↓ MOL2 SDF SMILES Flexibase

20235161

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-bromo-3-methyl-phenyl)-2-[(3,5-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(4-bromo-3-methyl-phenyl)-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)	6.58	11.23	-15.59	1	5	0	66	501.446	6	↓ MOL2 SDF SMILES Flexibase

20235170

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[(3,5-dimethylphenyl)-(p-tolylsulfonyl)amino]acetyl]amino]benzoic 2-[[2-[(3,5-dimethylphenyl)-(p-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)	5.44	9.97	-55.17	1	7	-1	107	451.524	7	↓ MOL2 SDF SMILES Flexibase

20235202

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3,4-dimethoxyphenyl)-2-[(3,4-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(3,4-dimethoxyphenyl)-2-[(3,4-…

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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)	5.04	8.99	-23.83	1	7	0	85	468.575	8	↓ MOL2 SDF SMILES Flexibase

20235206

Analogs

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Popular Name: N-(3-chloro-4-methyl-phenyl)-2-[(3,4-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(3-chloro-4-methyl-phenyl)-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)	6.45	10.8	-23.74	1	5	0	66	456.995	6	↓ MOL2 SDF SMILES Flexibase

20235209

Analogs

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Popular Name: N-[4-(cyanomethyl)phenyl]-2-[(3,4-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-[4-(cyanomethyl)phenyl]-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)	5.36	10.88	-27.47	1	6	0	90	447.56	7	↓ MOL2 SDF SMILES Flexibase

20235221

Analogs

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Popular Name: N-(4-bromo-3-methyl-phenyl)-2-[(3,4-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(4-bromo-3-methyl-phenyl)-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)	6.58	11.02	-21.19	1	5	0	66	501.446	6	↓ MOL2 SDF SMILES Flexibase

20235223

Analogs

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Popular Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(3,4-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-[4-chloro-3-(trifluoromethyl)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)	6.89	11.18	-25.79	1	5	0	66	510.965	7	↓ MOL2 SDF SMILES Flexibase

20235254

Analogs

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Popular Name: 2-[(2-ethylphenyl)-(p-tolylsulfonyl)amino]-N-(4-fluorophenyl)acetamide 2-[(2-ethylphenyl)-(p-tolylsulfo…

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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	9.72	-16.49	1	5	0	66	426.513	7	↓ MOL2 SDF SMILES Flexibase

20235257

Analogs

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Popular Name: N-(4-chloro-2-methyl-phenyl)-2-[(2-ethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(4-chloro-2-methyl-phenyl)-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)	6.49	12	-13.85	1	5	0	66	456.995	7	↓ MOL2 SDF SMILES Flexibase

20235260

Analogs

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Popular Name: N-(3-chloro-2-methyl-phenyl)-2-[(2-ethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(3-chloro-2-methyl-phenyl)-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)	6.47	11.92	-13.06	1	5	0	66	456.995	7	↓ MOL2 SDF SMILES Flexibase

20235264

Analogs

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Popular Name: 2-[(2-ethylphenyl)-(p-tolylsulfonyl)amino]-N-[2-(trifluoromethyl)phenyl]acetamide 2-[(2-ethylphenyl)-(p-tolylsulfo…

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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)	6.28	11.94	-11.31	1	5	0	66	476.52	8	↓ MOL2 SDF SMILES Flexibase

20235268

Analogs

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Popular Name: N-[4-(cyanomethyl)phenyl]-2-[(2-ethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-[4-(cyanomethyl)phenyl]-2-[(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)	5.40	11.11	-27.38	1	6	0	90	447.56	8	↓ MOL2 SDF SMILES Flexibase

20235274

Analogs

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Popular Name: N-(3-chloro-4-methoxy-phenyl)-2-[(2-ethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(3-chloro-4-methoxy-phenyl)-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)	6.10	10.54	-14.66	1	6	0	76	472.994	8	↓ MOL2 SDF SMILES Flexibase

20235278

Analogs

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Popular Name: N-(4-bromo-3-methyl-phenyl)-2-[(2-ethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(4-bromo-3-methyl-phenyl)-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)	6.62	10.9	-15.81	1	5	0	66	501.446	7	↓ MOL2 SDF SMILES Flexibase

20235285

Analogs

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Popular Name: 4-[[2-[(2-ethylphenyl)-(p-tolylsulfonyl)amino]acetyl]amino]benzamide 4-[[2-[(2-ethylphenyl)-(p-tolyls…

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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)	4.25	6.41	-21.1	3	7	0	110	451.548	8	↓ MOL2 SDF SMILES Flexibase

20235287

Analogs

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Popular Name: 2-[[2-[(2-ethylphenyl)-(p-tolylsulfonyl)amino]acetyl]amino]benzoic 2-[[2-[(2-ethylphenyl)-(p-tolyls…

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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)	5.48	9.63	-52.94	1	7	-1	107	451.524	8	↓ MOL2 SDF SMILES Flexibase

20235325

Analogs

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Popular Name: 2-[(4-isopropylphenyl)-(p-tolylsulfonyl)amino]-N-(2-methoxy-5-methyl-phenyl)acetamide 2-[(4-isopropylphenyl)-(p-tolyls…

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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)	6.51	10.56	-19.51	1	6	0	76	466.603	8	↓ MOL2 SDF SMILES Flexibase

20235329

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-chloro-4-methyl-phenyl)-2-[(4-isopropylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(3-chloro-4-methyl-phenyl)-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)	7.13	11.48	-23.16	1	5	0	66	471.022	7	↓ MOL2 SDF SMILES Flexibase

20235332

Analogs

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Popular Name: N-(3-chloro-4-methoxy-phenyl)-2-[(4-isopropylphenyl)-(p-tolylsulfonyl)amino]acetamide N-(3-chloro-4-methoxy-phenyl)-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)	6.74	10.25	-25.43	1	6	0	76	487.021	8	↓ MOL2 SDF SMILES Flexibase

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SQL Query Was

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