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ZINC Item

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20234969

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2,4-dimethylphenyl)-(p-tolylsulfonyl)amino]-N-(2-phenylsulfanylethyl)acetamide 2-[(2,4-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)	5.89	11.29	-23.87	1	5	0	66	468.644	9	↓ MOL2 SDF SMILES Flexibase

20234974

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(4-chlorophenyl)sulfanylethyl]-2-[(2,4-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-[2-(4-chlorophenyl)sulfanyleth…

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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)	6.57	11.81	-23.42	1	5	0	66	503.089	9	↓ MOL2 SDF SMILES Flexibase

20235047

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2,5-dimethylphenyl)-(p-tolylsulfonyl)amino]-N-(2-phenylsulfanylethyl)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)	5.89	11.29	-23.65	1	5	0	66	468.644	9	↓ MOL2 SDF SMILES Flexibase

20235051

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(4-chlorophenyl)sulfanylethyl]-2-[(2,5-dimethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-[2-(4-chlorophenyl)sulfanyleth…

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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)	6.57	12.22	-16.43	1	5	0	66	503.089	9	↓ MOL2 SDF SMILES Flexibase

20235104

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3,5-dimethylphenyl)-(p-tolylsulfonyl)amino]-N-[2-(p-tolylsulfanyl)ethyl]acetamide 2-[(3,5-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)	6.34	11.81	-23.03	1	5	0	66	482.671	9	↓ MOL2 SDF SMILES Flexibase

20235107

Analogs

Draw Identity 99% 90% 80% 70%

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

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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)	6.57	11.67	-22.74	1	5	0	66	503.089	9	↓ MOL2 SDF SMILES Flexibase

20235179

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3,4-dimethylphenyl)-(p-tolylsulfonyl)amino]-N-[2-(p-tolylsulfanyl)ethyl]acetamide 2-[(3,4-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)	6.34	11.9	-17.71	1	5	0	66	482.671	9	↓ MOL2 SDF SMILES Flexibase

20235183

Analogs

Draw Identity 99% 90% 80% 70%

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

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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)	6.57	11.68	-22.39	1	5	0	66	503.089	9	↓ MOL2 SDF SMILES Flexibase

20235234

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(4-chlorophenyl)sulfanylethyl]-2-[(2-ethylphenyl)-(p-tolylsulfonyl)amino]acetamide N-[2-(4-chlorophenyl)sulfanyleth…

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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)	6.61	12.54	-15.8	1	5	0	66	503.089	10	↓ MOL2 SDF SMILES Flexibase

20235298

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4-isopropylphenyl)-(p-tolylsulfonyl)amino]-N-(2-phenylsulfanylethyl)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)	6.58	12.15	-21.92	1	5	0	66	482.671	10	↓ MOL2 SDF SMILES Flexibase

20235302

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4-isopropylphenyl)-(p-tolylsulfonyl)amino]-N-[2-(p-tolylsulfanyl)ethyl]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)	7.02	12.51	-22.06	1	5	0	66	496.698	10	↓ MOL2 SDF SMILES Flexibase

20235305

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(4-chlorophenyl)sulfanylethyl]-2-[(4-isopropylphenyl)-(p-tolylsulfonyl)amino]acetamide N-[2-(4-chlorophenyl)sulfanyleth…

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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)	7.25	12.37	-21.7	1	5	0	66	517.116	10	↓ MOL2 SDF SMILES Flexibase

20235341

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2-chlorophenyl)-(p-tolylsulfonyl)amino]-N-(2-phenylsulfanylethyl)acetamide 2-[(2-chlorophenyl)-(p-tolylsulf…

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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)	5.69	10.86	-15.9	1	5	0	66	475.035	9	↓ MOL2 SDF SMILES Flexibase

20235343

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2-chlorophenyl)-(p-tolylsulfonyl)amino]-N-[2-(p-tolylsulfanyl)ethyl]acetamide 2-[(2-chlorophenyl)-(p-tolylsulf…

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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)	6.14	11.52	-15.88	1	5	0	66	489.062	9	↓ MOL2 SDF SMILES Flexibase

20235345

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2-chlorophenyl)-(p-tolylsulfonyl)amino]-N-[2-(4-chlorophenyl)sulfanylethyl]acetamide 2-[(2-chlorophenyl)-(p-tolylsulf…

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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)	6.37	11.38	-15.88	1	5	0	66	509.48	9	↓ MOL2 SDF SMILES Flexibase

20235433

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4-chlorophenyl)-(p-tolylsulfonyl)amino]-N-[2-(4-chlorophenyl)sulfanylethyl]acetamide 2-[(4-chlorophenyl)-(p-tolylsulf…

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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	10.95	-21.16	1	5	0	66	509.48	9	↓ MOL2 SDF SMILES Flexibase

20235494

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3-bromophenyl)-(p-tolylsulfonyl)amino]-N-(2-phenylsulfanylethyl)acetamide 2-[(3-bromophenyl)-(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)	5.85	10.63	-18.88	1	5	0	66	519.486	9	↓ MOL2 SDF SMILES Flexibase

20235533

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4-bromophenyl)-(p-tolylsulfonyl)amino]-N-(2-phenylsulfanylethyl)acetamide 2-[(4-bromophenyl)-(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)	5.87	10.48	-21.75	1	5	0	66	519.486	9	↓ MOL2 SDF SMILES Flexibase

20235675

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(4-chlorophenyl)sulfanylethyl]-2-[(2-ethoxyphenyl)-(p-tolylsulfonyl)amino]acetamide N-[2-(4-chlorophenyl)sulfanyleth…

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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)	6.13	12.03	-15.38	1	6	0	76	519.088	11	↓ MOL2 SDF SMILES Flexibase

20235696

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(4-chlorophenyl)sulfanylethyl]-2-[(4-ethoxyphenyl)-(p-tolylsulfonyl)amino]acetamide N-[2-(4-chlorophenyl)sulfanyleth…

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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)	6.17	10.66	-22.86	1	6	0	76	519.088	11	↓ MOL2 SDF SMILES Flexibase

20235748

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2,4-dimethoxyphenyl)-(p-tolylsulfonyl)amino]-N-(2-phenylsulfanylethyl)acetamide 2-[(2,4-dimethoxyphenyl)-(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)	5.10	8.91	-20.6	1	7	0	85	500.642	11	↓ MOL2 SDF SMILES Flexibase

20235752

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2,4-dimethoxyphenyl)-(p-tolylsulfonyl)amino]-N-[2-(p-tolylsulfanyl)ethyl]acetamide 2-[(2,4-dimethoxyphenyl)-(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)	5.55	9.62	-22.56	1	7	0	85	514.669	11	↓ MOL2 SDF SMILES Flexibase

20235863

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-phenylsulfanylethyl)-2-[p-tolylsulfonyl-[3-(trifluoromethyl)phenyl]amino]acetamide N-(2-phenylsulfanylethyl)-2-[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)	5.93	11.25	-28.46	1	5	0	66	508.587	10	↓ MOL2 SDF SMILES Flexibase

20235867

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(p-tolylsulfanyl)ethyl]-2-[p-tolylsulfonyl-[3-(trifluoromethyl)phenyl]amino]acetamide N-[2-(p-tolylsulfanyl)ethyl]-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)	6.38	11.92	-28.39	1	5	0	66	522.614	10	↓ MOL2 SDF SMILES Flexibase

20235923

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2,5-dimethoxyphenyl)-(p-tolylsulfonyl)amino]-N-(2-phenylsulfanylethyl)acetamide 2-[(2,5-dimethoxyphenyl)-(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)	5.10	10.2	-23.25	1	7	0	85	500.642	11	↓ MOL2 SDF SMILES Flexibase

20235927

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2,5-dimethoxyphenyl)-(p-tolylsulfonyl)amino]-N-[2-(p-tolylsulfanyl)ethyl]acetamide 2-[(2,5-dimethoxyphenyl)-(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)	5.55	10.87	-23.17	1	7	0	85	514.669	11	↓ MOL2 SDF SMILES Flexibase

20235976

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3,4-dimethoxyphenyl)-(p-tolylsulfonyl)amino]-N-(2-phenylsulfanylethyl)acetamide 2-[(3,4-dimethoxyphenyl)-(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)	4.71	9.22	-20.22	1	7	0	85	500.642	11	↓ MOL2 SDF SMILES Flexibase

20235980

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3,4-dimethoxyphenyl)-(p-tolylsulfonyl)amino]-N-[2-(p-tolylsulfanyl)ethyl]acetamide 2-[(3,4-dimethoxyphenyl)-(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)	5.16	9.89	-20.16	1	7	0	85	514.669	11	↓ MOL2 SDF SMILES Flexibase

20236033

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3,5-dichlorophenyl)-(p-tolylsulfonyl)amino]-N-(2-phenylsulfanylethyl)acetamide 2-[(3,5-dichlorophenyl)-(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)	6.35	11.13	-16.23	1	5	0	66	509.48	9	↓ MOL2 SDF SMILES Flexibase

20236036

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3,5-dichlorophenyl)-(p-tolylsulfonyl)amino]-N-[2-(p-tolylsulfanyl)ethyl]acetamide 2-[(3,5-dichlorophenyl)-(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)	6.80	11.79	-16.19	1	5	0	66	523.507	9	↓ MOL2 SDF SMILES Flexibase

20236105

Analogs

15835789

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2-fluorophenyl)-(p-tolylsulfonyl)amino]-N-[2-(p-tolylsulfanyl)ethyl]acetamide 2-[(2-fluorophenyl)-(p-tolylsulf…

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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)	5.63	10.93	-27.46	1	5	0	66	472.607	9	↓ MOL2 SDF SMILES Flexibase

20236109

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(4-chlorophenyl)sulfanylethyl]-2-[(2-fluorophenyl)-(p-tolylsulfonyl)amino]acetamide N-[2-(4-chlorophenyl)sulfanyleth…

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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	10.7	-18.03	1	5	0	66	493.025	9	↓ MOL2 SDF SMILES Flexibase

20236144

Analogs

Draw Identity 99% 90% 80% 70%

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

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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)	5.23	9.91	-22.17	1	5	0	66	458.58	9	↓ MOL2 SDF SMILES Flexibase

20236148

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4-fluorophenyl)-(p-tolylsulfonyl)amino]-N-[2-(p-tolylsulfanyl)ethyl]acetamide 2-[(4-fluorophenyl)-(p-tolylsulf…

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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)	5.68	10.64	-21.71	1	5	0	66	472.607	9	↓ MOL2 SDF SMILES Flexibase

20236194

Analogs

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Popular Name: 2-[(5-chloro-2-methoxy-phenyl)-(p-tolylsulfonyl)amino]-N-(2-phenylsulfanylethyl)acetamide 2-[(5-chloro-2-methoxy-phenyl)-(…

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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)	5.73	11.42	-21.48	1	6	0	76	505.061	10	↓ MOL2 SDF SMILES Flexibase

20236246

Analogs

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Popular Name: 2-[(2-methoxy-5-methyl-phenyl)-(p-tolylsulfonyl)amino]-N-[2-(p-tolylsulfanyl)ethyl]acetamide 2-[(2-methoxy-5-methyl-phenyl)-(…

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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)	5.94	12.23	-23.5	1	6	0	76	498.67	10	↓ MOL2 SDF SMILES Flexibase

20236249

Analogs

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

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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)	6.17	12.07	-15.81	1	6	0	76	519.088	10	↓ MOL2 SDF SMILES Flexibase

20236281

Analogs

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Popular Name: 2-[(4-chloro-2-methyl-phenyl)-(p-tolylsulfonyl)amino]-N-[2-(p-tolylsulfanyl)ethyl]acetamide 2-[(4-chloro-2-methyl-phenyl)-(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)	6.57	11.8	-22.77	1	5	0	66	503.089	9	↓ MOL2 SDF SMILES Flexibase

20236284

Analogs

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Popular Name: 2-[(4-chloro-2-methyl-phenyl)-(p-tolylsulfonyl)amino]-N-[2-(4-chlorophenyl)sulfanylethyl]acetamide 2-[(4-chloro-2-methyl-phenyl)-(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)	6.80	11.66	-22.44	1	5	0	66	523.507	9	↓ MOL2 SDF SMILES Flexibase

20236351

Analogs

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Popular Name: 2-[(5-chloro-2-methyl-phenyl)-(p-tolylsulfonyl)amino]-N-[2-(p-tolylsulfanyl)ethyl]acetamide 2-[(5-chloro-2-methyl-phenyl)-(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)	6.57	11.79	-25.05	1	5	0	66	503.089	9	↓ MOL2 SDF SMILES Flexibase

20236354

Analogs

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Popular Name: 2-[(5-chloro-2-methyl-phenyl)-(p-tolylsulfonyl)amino]-N-[2-(4-chlorophenyl)sulfanylethyl]acetamide 2-[(5-chloro-2-methyl-phenyl)-(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)	6.80	12.07	-16.94	1	5	0	66	523.507	9	↓ MOL2 SDF SMILES Flexibase

20236408

Analogs

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Popular Name: 2-[(3-chloro-2-methyl-phenyl)-(p-tolylsulfonyl)amino]-N-[2-(p-tolylsulfanyl)ethyl]acetamide 2-[(3-chloro-2-methyl-phenyl)-(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)	6.54	11.73	-21.17	1	5	0	66	503.089	9	↓ MOL2 SDF SMILES Flexibase

20236411

Analogs

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Popular Name: 2-[(3-chloro-2-methyl-phenyl)-(p-tolylsulfonyl)amino]-N-[2-(4-chlorophenyl)sulfanylethyl]acetamide 2-[(3-chloro-2-methyl-phenyl)-(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)	6.77	11.96	-15.65	1	5	0	66	523.507	9	↓ MOL2 SDF SMILES Flexibase

20236461

Analogs

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Popular Name: 2-[(3-chloro-4-methyl-phenyl)-(p-tolylsulfonyl)amino]-N-(2-phenylsulfanylethyl)acetamide 2-[(3-chloro-4-methyl-phenyl)-(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)	6.12	11.09	-16.28	1	5	0	66	489.062	9	↓ MOL2 SDF SMILES Flexibase

20236465

Analogs

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Popular Name: 2-[(3-chloro-4-methyl-phenyl)-(p-tolylsulfonyl)amino]-N-[2-(p-tolylsulfanyl)ethyl]acetamide 2-[(3-chloro-4-methyl-phenyl)-(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)	6.57	11.76	-16.17	1	5	0	66	503.089	9	↓ MOL2 SDF SMILES Flexibase

20236467

Analogs

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Popular Name: 2-[(3-chloro-4-methyl-phenyl)-(p-tolylsulfonyl)amino]-N-[2-(4-chlorophenyl)sulfanylethyl]acetamide 2-[(3-chloro-4-methyl-phenyl)-(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)	6.80	11.61	-16.16	1	5	0	66	523.507	9	↓ MOL2 SDF SMILES Flexibase

20236519

Analogs

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Popular Name: 2-[(3-chloro-4-methoxy-phenyl)-(p-tolylsulfonyl)amino]-N-(2-phenylsulfanylethyl)acetamide 2-[(3-chloro-4-methoxy-phenyl)-(…

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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)	5.73	9.88	-17.65	1	6	0	76	505.061	10	↓ MOL2 SDF SMILES Flexibase

20236522

Analogs

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Popular Name: 2-[(3-chloro-4-methoxy-phenyl)-(p-tolylsulfonyl)amino]-N-[2-(p-tolylsulfanyl)ethyl]acetamide 2-[(3-chloro-4-methoxy-phenyl)-(…

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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)	6.17	10.54	-17.58	1	6	0	76	519.088	10	↓ MOL2 SDF SMILES Flexibase

20239086

Analogs

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Popular Name: 2-[benzenesulfonyl-(4-nitrophenyl)amino]-N-[2-(4-chlorophenyl)sulfanylethyl]acetamide 2-[benzenesulfonyl-(4-nitropheny…

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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)	5.25	10.43	-23.92	1	8	0	112	506.005	10	↓ MOL2 SDF SMILES Flexibase

20239135

Analogs

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Popular Name: 2-[benzenesulfonyl-(2,4-dichlorophenyl)amino]-N-[2-(p-tolylsulfanyl)ethyl]acetamide 2-[benzenesulfonyl-(2,4-dichloro…

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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)	6.35	10.97	-19.2	1	5	0	66	509.48	9	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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Structural Results Found: (before additional filtering)

SQL Query Was

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