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20004300

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-3-phenyl-N-[(1R)-1-phenylethyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2R)-3-phenyl-N-[(1R)-1-phenylet…

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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)	5.06	10.31	-17.66	2	5	0	75	450.604	8	↓ MOL2 SDF SMILES Flexibase

20004303

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-3-phenyl-N-[(1S)-1-phenylethyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2R)-3-phenyl-N-[(1S)-1-phenylet…

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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)	5.06	10.31	-18.14	2	5	0	75	450.604	8	↓ MOL2 SDF SMILES Flexibase

20004306

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-3-phenyl-N-[(1R)-1-phenylethyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2S)-3-phenyl-N-[(1R)-1-phenylet…

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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)	5.06	10.49	-15.57	2	5	0	75	450.604	8	↓ MOL2 SDF SMILES Flexibase

20004309

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-3-phenyl-N-[(1S)-1-phenylethyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2S)-3-phenyl-N-[(1S)-1-phenylet…

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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)	5.06	10.49	-15.32	2	5	0	75	450.604	8	↓ MOL2 SDF SMILES Flexibase

20004767

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-[(2-methoxyphenyl)methyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2R)-N-[(2-methoxyphenyl)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)	4.51	8.83	-18.45	2	6	0	85	466.603	9	↓ MOL2 SDF SMILES Flexibase

20004770

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-[(2-methoxyphenyl)methyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2S)-N-[(2-methoxyphenyl)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)	4.51	9.02	-15.28	2	6	0	85	466.603	9	↓ MOL2 SDF SMILES Flexibase

20004909

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-[(1R)-1-(4-chlorophenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2R)-N-[(1R)-1-(4-chlorophenyl)e…

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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)	5.74	10.86	-17.9	2	5	0	75	485.049	8	↓ MOL2 SDF SMILES Flexibase

20004912

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-[(1S)-1-(4-chlorophenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2R)-N-[(1S)-1-(4-chlorophenyl)e…

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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)	5.74	10.83	-17.91	2	5	0	75	485.049	8	↓ MOL2 SDF SMILES Flexibase

20004915

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-[(1R)-1-(4-chlorophenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2S)-N-[(1R)-1-(4-chlorophenyl)e…

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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)	5.74	11.01	-16.13	2	5	0	75	485.049	8	↓ MOL2 SDF SMILES Flexibase

20004918

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-[(1S)-1-(4-chlorophenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2S)-N-[(1S)-1-(4-chlorophenyl)e…

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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)	5.74	11.01	-15.97	2	5	0	75	485.049	8	↓ MOL2 SDF SMILES Flexibase

20004921

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-[(1R)-1-(4-methoxyphenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2R)-N-[(1R)-1-(4-methoxyphenyl)…

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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)	5.12	9.66	-19.31	2	6	0	85	480.63	9	↓ MOL2 SDF SMILES Flexibase

20004924

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2R)-N-[(1S)-1-(4-methoxyphenyl)…

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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)	5.12	9.63	-19.9	2	6	0	85	480.63	9	↓ MOL2 SDF SMILES Flexibase

20004927

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-[(1R)-1-(4-methoxyphenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2S)-N-[(1R)-1-(4-methoxyphenyl)…

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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)	5.12	9.81	-17.3	2	6	0	85	480.63	9	↓ MOL2 SDF SMILES Flexibase

20004930

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2S)-N-[(1S)-1-(4-methoxyphenyl)…

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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)	5.12	9.81	-17.06	2	6	0	85	480.63	9	↓ MOL2 SDF SMILES Flexibase

20004933

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-[(1R)-1-(3,4-dimethoxyphenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanam (2R)-N-[(1R)-1-(3,4-dimethoxyphe…

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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	9.55	-21.82	2	7	0	94	510.656	10	↓ MOL2 SDF SMILES Flexibase

20004936

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-[(1S)-1-(3,4-dimethoxyphenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanam (2R)-N-[(1S)-1-(3,4-dimethoxyphe…

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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	9.55	-22.43	2	7	0	94	510.656	10	↓ MOL2 SDF SMILES Flexibase

20004939

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-[(1R)-1-(3,4-dimethoxyphenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanam (2S)-N-[(1R)-1-(3,4-dimethoxyphe…

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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	9.72	-19.96	2	7	0	94	510.656	10	↓ MOL2 SDF SMILES Flexibase

20004942

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-[(1S)-1-(3,4-dimethoxyphenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanam (2S)-N-[(1S)-1-(3,4-dimethoxyphe…

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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	9.72	-19.73	2	7	0	94	510.656	10	↓ MOL2 SDF SMILES Flexibase

20004945

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-[(1R)-1-(2-methoxyphenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2R)-N-[(1R)-1-(2-methoxyphenyl)…

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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)	5.07	9.73	-20.59	2	6	0	85	480.63	9	↓ MOL2 SDF SMILES Flexibase

20004948

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2R)-N-[(1S)-1-(2-methoxyphenyl)…

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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)	5.07	9.71	-21.25	2	6	0	85	480.63	9	↓ MOL2 SDF SMILES Flexibase

20004951

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-[(1R)-1-(2-methoxyphenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2S)-N-[(1R)-1-(2-methoxyphenyl)…

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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)	5.07	9.89	-18.01	2	6	0	85	480.63	9	↓ MOL2 SDF SMILES Flexibase

20004954

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2S)-N-[(1S)-1-(2-methoxyphenyl)…

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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)	5.07	10.09	-17.91	2	6	0	85	480.63	9	↓ MOL2 SDF SMILES Flexibase

20004969

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-[(1R)-1-(4-methylsulfanylphenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propa (2R)-N-[(1R)-1-(4-methylsulfanyl…

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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)	5.50	11.39	-18.95	2	5	0	75	496.698	9	↓ MOL2 SDF SMILES Flexibase

20004972

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-[(1S)-1-(4-methylsulfanylphenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propa (2R)-N-[(1S)-1-(4-methylsulfanyl…

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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)	5.50	11.36	-19.54	2	5	0	75	496.698	9	↓ MOL2 SDF SMILES Flexibase

20004975

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-[(1R)-1-(4-methylsulfanylphenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propa (2S)-N-[(1R)-1-(4-methylsulfanyl…

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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)	5.50	11.53	-17.05	2	5	0	75	496.698	9	↓ MOL2 SDF SMILES Flexibase

20004978

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-[(1S)-1-(4-methylsulfanylphenyl)ethyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propa (2S)-N-[(1S)-1-(4-methylsulfanyl…

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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)	5.50	11.53	-16.9	2	5	0	75	496.698	9	↓ MOL2 SDF SMILES Flexibase

20004981

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-[(3,4-dimethoxyphenyl)methyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2R)-N-[(3,4-dimethoxyphenyl)met…

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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)	4.15	8.68	-20.3	2	7	0	94	496.629	10	↓ MOL2 SDF SMILES Flexibase

20004984

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-[(3,4-dimethoxyphenyl)methyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2S)-N-[(3,4-dimethoxyphenyl)met…

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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)	4.15	8.87	-18.34	2	7	0	94	496.629	10	↓ MOL2 SDF SMILES Flexibase

20004987

Analogs

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Popular Name: (2S)-N-[(4-fluorophenyl)methyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2S)-N-[(4-fluorophenyl)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)	4.67	9.69	-15.84	2	5	0	75	454.567	8	↓ MOL2 SDF SMILES Flexibase

20004989

Analogs

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Popular Name: (2R)-N-[(4-fluorophenyl)methyl]-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide (2R)-N-[(4-fluorophenyl)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)	4.67	9.52	-17.47	2	5	0	75	454.567	8	↓ MOL2 SDF SMILES Flexibase

20005142

Analogs

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Popular Name: (2S)-N-benzyl-2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-phenyl-propanamide (2S)-N-benzyl-2-[(3,4-dimethoxyp…

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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)	2.95	7.05	-17.94	2	7	0	94	454.548	10	↓ MOL2 SDF SMILES Flexibase

20005145

Analogs

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Popular Name: (2R)-N-benzyl-2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-phenyl-propanamide (2R)-N-benzyl-2-[(3,4-dimethoxyp…

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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)	2.95	6.76	-20.82	2	7	0	94	454.548	10	↓ MOL2 SDF SMILES Flexibase

20005148

Analogs

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Popular Name: (2S)-2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-phenyl-N-(p-tolylmethyl)propanamide (2S)-2-[(3,4-dimethoxyphenyl)sul…

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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)	3.40	7.72	-17.88	2	7	0	94	468.575	10	↓ MOL2 SDF SMILES Flexibase

20005150

Analogs

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Popular Name: (2R)-2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-phenyl-N-(p-tolylmethyl)propanamide (2R)-2-[(3,4-dimethoxyphenyl)sul…

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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)	3.40	7.43	-20.74	2	7	0	94	468.575	10	↓ MOL2 SDF SMILES Flexibase

20005153

Analogs

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Popular Name: (2S)-N-[(2-chlorophenyl)methyl]-2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-phenyl-propanamide (2S)-N-[(2-chlorophenyl)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)	3.58	7.49	-17.97	2	7	0	94	488.993	10	↓ MOL2 SDF SMILES Flexibase

20005156

Analogs

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Popular Name: (2R)-N-[(2-chlorophenyl)methyl]-2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-phenyl-propanamide (2R)-N-[(2-chlorophenyl)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)	3.58	7.2	-21.21	2	7	0	94	488.993	10	↓ MOL2 SDF SMILES Flexibase

20005159

Analogs

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Popular Name: (2S)-N-[(4-chlorophenyl)methyl]-2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-phenyl-propanamide (2S)-N-[(4-chlorophenyl)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)	3.63	7.57	-18.62	2	7	0	94	488.993	10	↓ MOL2 SDF SMILES Flexibase

20005162

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-[(4-chlorophenyl)methyl]-2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-phenyl-propanamide (2R)-N-[(4-chlorophenyl)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)	3.63	7.28	-21.42	2	7	0	94	488.993	10	↓ MOL2 SDF SMILES Flexibase

20005165

Analogs

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Popular Name: (2S)-N-[(2,4-dichlorophenyl)methyl]-2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-phenyl-propanamide (2S)-N-[(2,4-dichlorophenyl)meth…

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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)	4.23	8.04	-18.03	2	7	0	94	523.438	10	↓ MOL2 SDF SMILES Flexibase

20005168

Analogs

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Popular Name: (2R)-N-[(2,4-dichlorophenyl)methyl]-2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-phenyl-propanamide (2R)-N-[(2,4-dichlorophenyl)meth…

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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)	4.23	7.76	-20.15	2	7	0	94	523.438	10	↓ MOL2 SDF SMILES Flexibase

20005171

Analogs

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Popular Name: (2R)-2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-[(4-methoxyphenyl)methyl]-3-phenyl-propanamide (2R)-2-[(3,4-dimethoxyphenyl)sul…

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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)	3.01	6.08	-22.15	2	8	0	103	484.574	11	↓ MOL2 SDF SMILES Flexibase

20005174

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-[(4-methoxyphenyl)methyl]-3-phenyl-propanamide (2S)-2-[(3,4-dimethoxyphenyl)sul…

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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)	3.01	6.37	-19.43	2	8	0	103	484.574	11	↓ MOL2 SDF SMILES Flexibase

20005177

Analogs

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Popular Name: (2S)-2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-phenyl-N-[(1S)-1-phenylethyl]propanamide (2S)-2-[(3,4-dimethoxyphenyl)sul…

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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)	3.51	7.92	-18.93	2	7	0	94	468.575	10	↓ MOL2 SDF SMILES Flexibase

20005180

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-phenyl-N-[(1S)-1-phenylethyl]propanamide (2R)-2-[(3,4-dimethoxyphenyl)sul…

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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)	3.51	7.63	-22.11	2	7	0	94	468.575	10	↓ MOL2 SDF SMILES Flexibase

20005183

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-phenyl-N-[(1R)-1-phenylethyl]propanamide (2S)-2-[(3,4-dimethoxyphenyl)sul…

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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)	3.51	7.92	-19.11	2	7	0	94	468.575	10	↓ MOL2 SDF SMILES Flexibase

20005186

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-phenyl-N-[(1R)-1-phenylethyl]propanamide (2R)-2-[(3,4-dimethoxyphenyl)sul…

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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)	3.51	7.57	-22.08	2	7	0	94	468.575	10	↓ MOL2 SDF SMILES Flexibase

20005627

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-[(2-methoxyphenyl)methyl]-3-phenyl-propanamide (2R)-2-[(3,4-dimethoxyphenyl)sul…

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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	6.15	-22.45	2	8	0	103	484.574	11	↓ MOL2 SDF SMILES Flexibase

20005630

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-[(2-methoxyphenyl)methyl]-3-phenyl-propanamide (2S)-2-[(3,4-dimethoxyphenyl)sul…

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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	6.44	-18.58	2	8	0	103	484.574	11	↓ MOL2 SDF SMILES Flexibase

20005746

Analogs

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Popular Name: (2S)-N-[(1S)-1-(4-chlorophenyl)ethyl]-2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-phenyl-propanamide (2S)-N-[(1S)-1-(4-chlorophenyl)e…

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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)	4.19	8.44	-19.72	2	7	0	94	503.02	10	↓ MOL2 SDF SMILES Flexibase

20005749

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-[(1S)-1-(4-chlorophenyl)ethyl]-2-[(3,4-dimethoxyphenyl)sulfonylamino]-3-phenyl-propanamide (2R)-N-[(1S)-1-(4-chlorophenyl)e…

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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)	4.19	8.15	-22.38	2	7	0	94	503.02	10	↓ 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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<script type="text/javascript" src="//zinc12.docking.org/js/embed.js"></script>
<script type="text/javascript">
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