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62036533

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2,4,5-trifluoro-3-hydroxy-N-[[(3S,6R)-6-methyl-3-piperidyl]methyl]benzamide 2,4,5-trifluoro-3-hydroxy-N-[[(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)	2.08	3.13	-79.77	3	4	0	69	302.296	3	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	2.08	2.37	-54.64	4	4	1	66	303.304	3	↓ MOL2 SDF SMILES Flexibase

62036534

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2,4,5-trifluoro-3-hydroxy-N-[[(3S,6S)-6-methyl-3-piperidyl]methyl]benzamide 2,4,5-trifluoro-3-hydroxy-N-[[(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)	2.08	3.43	-78.58	3	4	0	69	302.296	3	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	2.08	2.67	-53.77	4	4	1	66	303.304	3	↓ MOL2 SDF SMILES Flexibase

62036535

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2,4,5-trifluoro-3-hydroxy-N-[[(3R,6R)-6-methyl-3-piperidyl]methyl]benzamide 2,4,5-trifluoro-3-hydroxy-N-[[(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)	2.08	3.43	-78.56	3	4	0	69	302.296	3	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	2.08	2.67	-53.54	4	4	1	66	303.304	3	↓ MOL2 SDF SMILES Flexibase

62036536

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2,4,5-trifluoro-3-hydroxy-N-[[(3R,6S)-6-methyl-3-piperidyl]methyl]benzamide 2,4,5-trifluoro-3-hydroxy-N-[[(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)	2.08	3.14	-79.77	3	4	0	69	302.296	3	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	2.08	2.38	-54.45	4	4	1	66	303.304	3	↓ MOL2 SDF SMILES Flexibase

62036537

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-hydroxy-N-[[(3S,6R)-6-methyl-3-piperidyl]methyl]benzamide 4-hydroxy-N-[[(3S,6R)-6-methyl-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)	1.54	2.18	-50.82	4	4	1	66	249.334	3	↓ MOL2 SDF SMILES Flexibase

62036538

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-hydroxy-N-[[(3S,6S)-6-methyl-3-piperidyl]methyl]benzamide 4-hydroxy-N-[[(3S,6S)-6-methyl-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)	1.54	2.47	-49.83	4	4	1	66	249.334	3	↓ MOL2 SDF SMILES Flexibase

62036539

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-hydroxy-N-[[(3R,6R)-6-methyl-3-piperidyl]methyl]benzamide 4-hydroxy-N-[[(3R,6R)-6-methyl-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)	1.54	2.47	-49.52	4	4	1	66	249.334	3	↓ MOL2 SDF SMILES Flexibase

62036540

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-hydroxy-N-[[(3R,6S)-6-methyl-3-piperidyl]methyl]benzamide 4-hydroxy-N-[[(3R,6S)-6-methyl-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)	1.54	2.18	-50.55	4	4	1	66	249.334	3	↓ MOL2 SDF SMILES Flexibase

62036541

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-hydroxy-N-[[(3S,6R)-6-methyl-3-piperidyl]methyl]benzamide 2-hydroxy-N-[[(3S,6R)-6-methyl-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)	2.51	3.56	-50.6	4	4	1	66	249.334	3	↓ MOL2 SDF SMILES Flexibase

62036542

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-hydroxy-N-[[(3S,6S)-6-methyl-3-piperidyl]methyl]benzamide 2-hydroxy-N-[[(3S,6S)-6-methyl-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)	2.51	3.85	-49.52	4	4	1	66	249.334	3	↓ MOL2 SDF SMILES Flexibase

62036543

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-hydroxy-N-[[(3R,6R)-6-methyl-3-piperidyl]methyl]benzamide 2-hydroxy-N-[[(3R,6R)-6-methyl-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)	2.51	3.85	-49.97	4	4	1	66	249.334	3	↓ MOL2 SDF SMILES Flexibase

62036544

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-hydroxy-N-[[(3R,6S)-6-methyl-3-piperidyl]methyl]benzamide 2-hydroxy-N-[[(3R,6S)-6-methyl-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)	2.51	3.56	-50.99	4	4	1	66	249.334	3	↓ MOL2 SDF SMILES Flexibase

62036545

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methoxy-N-[[(3S,6R)-6-methyl-3-piperidyl]methyl]benzamide 2-methoxy-N-[[(3S,6R)-6-methyl-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)	2.58	5.58	-51.06	3	4	1	55	263.361	4	↓ MOL2 SDF SMILES Flexibase

62036546

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methoxy-N-[[(3S,6S)-6-methyl-3-piperidyl]methyl]benzamide 2-methoxy-N-[[(3S,6S)-6-methyl-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)	2.58	5.87	-50.03	3	4	1	55	263.361	4	↓ MOL2 SDF SMILES Flexibase

62036547

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methoxy-N-[[(3R,6R)-6-methyl-3-piperidyl]methyl]benzamide 2-methoxy-N-[[(3R,6R)-6-methyl-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)	2.58	5.87	-50.03	3	4	1	55	263.361	4	↓ MOL2 SDF SMILES Flexibase

62036548

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methoxy-N-[[(3R,6S)-6-methyl-3-piperidyl]methyl]benzamide 2-methoxy-N-[[(3R,6S)-6-methyl-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)	2.58	5.58	-51.03	3	4	1	55	263.361	4	↓ MOL2 SDF SMILES Flexibase

62036549

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-tert-butyl-N-[[(3S,6R)-6-methyl-3-piperidyl]methyl]benzamide 4-tert-butyl-N-[[(3S,6R)-6-methy…

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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)	3.73	7.34	-48.62	3	3	1	46	289.443	4	↓ MOL2 SDF SMILES Flexibase

62036550

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-tert-butyl-N-[[(3S,6S)-6-methyl-3-piperidyl]methyl]benzamide 4-tert-butyl-N-[[(3S,6S)-6-methy…

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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)	3.73	7.63	-47.59	3	3	1	46	289.443	4	↓ MOL2 SDF SMILES Flexibase

62036551

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-tert-butyl-N-[[(3R,6R)-6-methyl-3-piperidyl]methyl]benzamide 4-tert-butyl-N-[[(3R,6R)-6-methy…

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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)	3.73	7.63	-47.61	3	3	1	46	289.443	4	↓ MOL2 SDF SMILES Flexibase

62036552

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-tert-butyl-N-[[(3R,6S)-6-methyl-3-piperidyl]methyl]benzamide 4-tert-butyl-N-[[(3R,6S)-6-methy…

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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)	3.73	7.34	-48.62	3	3	1	46	289.443	4	↓ MOL2 SDF SMILES Flexibase

62036553

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(3S,6R)-6-methyl-3-piperidyl]methyl]-2-(trifluoromethyl)benzamide N-[[(3S,6R)-6-methyl-3-piperidyl…

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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)	2.87	6.06	-53.84	3	3	1	46	301.332	4	↓ MOL2 SDF SMILES Flexibase

62036554

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(3S,6S)-6-methyl-3-piperidyl]methyl]-2-(trifluoromethyl)benzamide N-[[(3S,6S)-6-methyl-3-piperidyl…

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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)	2.87	6.35	-52.82	3	3	1	46	301.332	4	↓ MOL2 SDF SMILES Flexibase

62036555

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(3R,6R)-6-methyl-3-piperidyl]methyl]-2-(trifluoromethyl)benzamide N-[[(3R,6R)-6-methyl-3-piperidyl…

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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)	2.87	6.35	-52.8	3	3	1	46	301.332	4	↓ MOL2 SDF SMILES Flexibase

62036556

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(3R,6S)-6-methyl-3-piperidyl]methyl]-2-(trifluoromethyl)benzamide N-[[(3R,6S)-6-methyl-3-piperidyl…

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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)	2.87	6.06	-53.81	3	3	1	46	301.332	4	↓ MOL2 SDF SMILES Flexibase

62036561

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-methoxy-N-[[(3S,6R)-6-methyl-3-piperidyl]methyl]benzamide 4-methoxy-N-[[(3S,6R)-6-methyl-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)	2.08	4.32	-49.37	3	4	1	55	263.361	4	↓ MOL2 SDF SMILES Flexibase

62036562

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-methoxy-N-[[(3S,6S)-6-methyl-3-piperidyl]methyl]benzamide 4-methoxy-N-[[(3S,6S)-6-methyl-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)	2.08	4.61	-48.35	3	4	1	55	263.361	4	↓ MOL2 SDF SMILES Flexibase

62036563

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-methoxy-N-[[(3R,6R)-6-methyl-3-piperidyl]methyl]benzamide 4-methoxy-N-[[(3R,6R)-6-methyl-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)	2.08	4.61	-48.33	3	4	1	55	263.361	4	↓ MOL2 SDF SMILES Flexibase

62036564

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-methoxy-N-[[(3R,6S)-6-methyl-3-piperidyl]methyl]benzamide 4-methoxy-N-[[(3R,6S)-6-methyl-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)	2.08	4.32	-49.36	3	4	1	55	263.361	4	↓ MOL2 SDF SMILES Flexibase

62036565

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-fluoro-N-[[(3S,6R)-6-methyl-3-piperidyl]methyl]benzamide 2-fluoro-N-[[(3S,6R)-6-methyl-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)	2.13	5.09	-53.7	3	3	1	46	251.325	3	↓ MOL2 SDF SMILES Flexibase

62036566

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-fluoro-N-[[(3S,6S)-6-methyl-3-piperidyl]methyl]benzamide 2-fluoro-N-[[(3S,6S)-6-methyl-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)	2.13	5.38	-52.66	3	3	1	46	251.325	3	↓ MOL2 SDF SMILES Flexibase

62036567

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-fluoro-N-[[(3R,6R)-6-methyl-3-piperidyl]methyl]benzamide 2-fluoro-N-[[(3R,6R)-6-methyl-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)	2.13	5.38	-52.65	3	3	1	46	251.325	3	↓ MOL2 SDF SMILES Flexibase

62036568

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-fluoro-N-[[(3R,6S)-6-methyl-3-piperidyl]methyl]benzamide 2-fluoro-N-[[(3R,6S)-6-methyl-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)	2.13	5.09	-53.69	3	3	1	46	251.325	3	↓ MOL2 SDF SMILES Flexibase

62036585

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-methyl-N-[[(3R,6S)-6-methyl-3-piperidyl]methyl]benzamide 4-methyl-N-[[(3R,6S)-6-methyl-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)	2.47	5.7	-45.88	3	3	1	46	247.362	3	↓ MOL2 SDF SMILES Flexibase

62036586

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-methyl-N-[[(3S,6S)-6-methyl-3-piperidyl]methyl]benzamide 4-methyl-N-[[(3S,6S)-6-methyl-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)	2.47	5.98	-44.92	3	3	1	46	247.362	3	↓ MOL2 SDF SMILES Flexibase

62036587

Analogs

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Popular Name: 4-methyl-N-[[(3R,6R)-6-methyl-3-piperidyl]methyl]benzamide 4-methyl-N-[[(3R,6R)-6-methyl-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)	2.47	5.98	-44.93	3	3	1	46	247.362	3	↓ MOL2 SDF SMILES Flexibase

62036588

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-methyl-N-[[(3S,6R)-6-methyl-3-piperidyl]methyl]benzamide 4-methyl-N-[[(3S,6R)-6-methyl-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)	2.47	5.7	-45.89	3	3	1	46	247.362	3	↓ MOL2 SDF SMILES Flexibase

62036605

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-ethoxy-N-[[(3R,6S)-6-methyl-3-piperidyl]methyl]benzamide 2-ethoxy-N-[[(3R,6S)-6-methyl-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)	2.95	6.5	-47.98	3	4	1	55	277.388	5	↓ MOL2 SDF SMILES Flexibase

62036606

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-ethoxy-N-[[(3S,6S)-6-methyl-3-piperidyl]methyl]benzamide 2-ethoxy-N-[[(3S,6S)-6-methyl-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)	2.95	6.79	-46.97	3	4	1	55	277.388	5	↓ MOL2 SDF SMILES Flexibase

62036607

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-ethoxy-N-[[(3R,6R)-6-methyl-3-piperidyl]methyl]benzamide 2-ethoxy-N-[[(3R,6R)-6-methyl-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)	2.95	6.79	-46.96	3	4	1	55	277.388	5	↓ MOL2 SDF SMILES Flexibase

62036608

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-ethoxy-N-[[(3S,6R)-6-methyl-3-piperidyl]methyl]benzamide 2-ethoxy-N-[[(3S,6R)-6-methyl-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)	2.95	6.5	-47.96	3	4	1	55	277.388	5	↓ MOL2 SDF SMILES Flexibase

62036621

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4-dimethoxy-N-[[(3S,6R)-6-methyl-3-piperidyl]methyl]benzamide 3,4-dimethoxy-N-[[(3S,6R)-6-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)	1.66	4.23	-53.95	3	5	1	64	293.387	5	↓ MOL2 SDF SMILES Flexibase

62036622

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4-dimethoxy-N-[[(3S,6S)-6-methyl-3-piperidyl]methyl]benzamide 3,4-dimethoxy-N-[[(3S,6S)-6-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)	1.66	4.52	-52.98	3	5	1	64	293.387	5	↓ MOL2 SDF SMILES Flexibase

62036623

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4-dimethoxy-N-[[(3R,6R)-6-methyl-3-piperidyl]methyl]benzamide 3,4-dimethoxy-N-[[(3R,6R)-6-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)	1.66	4.52	-52.94	3	5	1	64	293.387	5	↓ MOL2 SDF SMILES Flexibase

62036624

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4-dimethoxy-N-[[(3R,6S)-6-methyl-3-piperidyl]methyl]benzamide 3,4-dimethoxy-N-[[(3R,6S)-6-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)	1.66	4.23	-53.91	3	5	1	64	293.387	5	↓ MOL2 SDF SMILES Flexibase

62036625

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2,3-dimethyl-N-[[(3R,6S)-6-methyl-3-piperidyl]methyl]benzamide 2,3-dimethyl-N-[[(3R,6S)-6-methy…

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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)	2.82	6.26	-44.71	3	3	1	46	261.389	3	↓ MOL2 SDF SMILES Flexibase

62036626

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2,3-dimethyl-N-[[(3S,6S)-6-methyl-3-piperidyl]methyl]benzamide 2,3-dimethyl-N-[[(3S,6S)-6-methy…

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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)	2.82	6.55	-43.91	3	3	1	46	261.389	3	↓ MOL2 SDF SMILES Flexibase

62036627

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2,3-dimethyl-N-[[(3R,6R)-6-methyl-3-piperidyl]methyl]benzamide 2,3-dimethyl-N-[[(3R,6R)-6-methy…

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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)	2.82	6.55	-43.88	3	3	1	46	261.389	3	↓ MOL2 SDF SMILES Flexibase

62036628

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2,3-dimethyl-N-[[(3S,6R)-6-methyl-3-piperidyl]methyl]benzamide 2,3-dimethyl-N-[[(3S,6R)-6-methy…

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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)	2.82	6.26	-44.8	3	3	1	46	261.389	3	↓ MOL2 SDF SMILES Flexibase

62036645

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methyl-N-[[(3R,6S)-6-methyl-3-piperidyl]methyl]benzamide 2-methyl-N-[[(3R,6S)-6-methyl-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)	2.42	5.7	-44.87	3	3	1	46	247.362	3	↓ MOL2 SDF SMILES Flexibase

62036646

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methyl-N-[[(3S,6S)-6-methyl-3-piperidyl]methyl]benzamide 2-methyl-N-[[(3S,6S)-6-methyl-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)	2.42	5.99	-43.84	3	3	1	46	247.362	3	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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Structural Results Found: (before additional filtering)

SQL Query Was

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