ZINC 12

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ZINC Item

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62938612

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[(1-methyltetrazol-5-yl)amino]cyclohexanecarboxylic 4-[(1-methyltetrazol-5-yl)amino]…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.04	5.8	-52.13	1	7	-1	96	224.244	3	↓ MOL2 SDF SMILES Flexibase

62938639

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(1-methyltetrazol-5-yl)amino]cyclohexanecarboxylic 1-[(1-methyltetrazol-5-yl)amino]…

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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)	-1.26	5.47	-54.69	1	7	-1	96	224.244	3	↓ MOL2 SDF SMILES Flexibase

62938641

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-methyl-1-[(1-methyltetrazol-5-yl)amino]cyclohexanecarboxylic 4-methyl-1-[(1-methyltetrazol-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)	-1.49	6.07	-54.3	1	7	-1	96	238.271	3	↓ MOL2 SDF SMILES Flexibase

62938642

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,3R)-3-methyl-1-[(1-methyltetrazol-5-yl)amino]cyclohexanecarboxylic (1R,3R)-3-methyl-1-[(1-methyltet…

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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)	-1.25	6.08	-54.56	1	7	-1	96	238.271	3	↓ MOL2 SDF SMILES Flexibase

62938643

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,3S)-3-methyl-1-[(1-methyltetrazol-5-yl)amino]cyclohexanecarboxylic (1R,3S)-3-methyl-1-[(1-methyltet…

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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)	-1.25	4.92	-55.43	1	7	-1	96	238.271	3	↓ MOL2 SDF SMILES Flexibase

62938644

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,3R)-3-methyl-1-[(1-methyltetrazol-5-yl)amino]cyclohexanecarboxylic (1S,3R)-3-methyl-1-[(1-methyltet…

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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)	-1.25	4.92	-55.6	1	7	-1	96	238.271	3	↓ MOL2 SDF SMILES Flexibase

62938645

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,3S)-3-methyl-1-[(1-methyltetrazol-5-yl)amino]cyclohexanecarboxylic (1S,3S)-3-methyl-1-[(1-methyltet…

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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)	-1.25	6.08	-54.37	1	7	-1	96	238.271	3	↓ MOL2 SDF SMILES Flexibase

62938646

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-ethyl-1-[(1-methyltetrazol-5-yl)amino]cyclohexanecarboxylic 4-ethyl-1-[(1-methyltetrazol-5-y…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-0.80	6.73	-54.19	1	7	-1	96	252.298	4	↓ MOL2 SDF SMILES Flexibase

62938709

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,3R)-3-[(1-methyltetrazol-5-yl)amino]cyclohexanecarboxylic (1S,3R)-3-[(1-methyltetrazol-5-y…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.28	5.81	-46.74	1	7	-1	96	224.244	3	↓ MOL2 SDF SMILES Flexibase

62938710

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,3S)-3-[(1-methyltetrazol-5-yl)amino]cyclohexanecarboxylic (1S,3S)-3-[(1-methyltetrazol-5-y…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.28	6.13	-44.9	1	7	-1	96	224.244	3	↓ MOL2 SDF SMILES Flexibase

62938711

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,3R)-3-[(1-methyltetrazol-5-yl)amino]cyclohexanecarboxylic (1R,3R)-3-[(1-methyltetrazol-5-y…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.28	6.13	-44.76	1	7	-1	96	224.244	3	↓ MOL2 SDF SMILES Flexibase

62938712

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,3S)-3-[(1-methyltetrazol-5-yl)amino]cyclohexanecarboxylic (1R,3S)-3-[(1-methyltetrazol-5-y…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.28	5.81	-47.06	1	7	-1	96	224.244	3	↓ MOL2 SDF SMILES Flexibase

62938746

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-cyclohexyl-N-(1-methyltetrazol-5-yl)propane-1,3-diamine N-cyclohexyl-N-(1-methyltetrazol…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.72	4.54	-52.76	3	6	1	74	239.347	5	↓ MOL2 SDF SMILES Flexibase

62938815

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N1-(1-methyltetrazol-5-yl)cyclohexane-1,4-diamine N1-(1-methyltetrazol-5-yl)cycloh…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-0.71	2.82	-57.54	4	6	1	83	197.266	2	↓ MOL2 SDF SMILES Flexibase

62938863

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Cyclohexyl-(1-methyl-1H-tetrazol-5-yl)-amine Cyclohexyl-(1-methyl-1H-tetrazol…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.40	5.27	-9.35	1	5	0	56	181.243	2	↓ MOL2 SDF SMILES Flexibase

62938872

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[(1-methyltetrazol-5-yl)amino]cyclohexanol 4-[(1-methyltetrazol-5-yl)amino]…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-0.22	2.25	-10.84	2	6	0	76	197.242	2	↓ MOL2 SDF SMILES Flexibase

62938908

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2R,3R)-2,3-dimethylcyclohexyl]-1-methyl-tetrazol-5-amine N-[(1S,2R,3R)-2,3-dimethylcycloh…

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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)	1.88	6.19	-8.87	1	5	0	56	209.297	2	↓ MOL2 SDF SMILES Flexibase

62938909

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-1-methyl-tetrazol-5-amine N-[(1S,2R,3S)-2,3-dimethylcycloh…

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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)	1.88	6.84	-8.38	1	5	0	56	209.297	2	↓ MOL2 SDF SMILES Flexibase

62938910

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2R,3R)-2,3-dimethylcyclohexyl]-1-methyl-tetrazol-5-amine N-[(1R,2R,3R)-2,3-dimethylcycloh…

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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)	1.88	6.3	-9	1	5	0	56	209.297	2	↓ MOL2 SDF SMILES Flexibase

62938911

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-1-methyl-tetrazol-5-amine N-[(1R,2R,3S)-2,3-dimethylcycloh…

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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)	1.88	6.52	-8.97	1	5	0	56	209.297	2	↓ MOL2 SDF SMILES Flexibase

62938939

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-methyl-N-[(1S,3R)-3-methylcyclohexyl]tetrazol-5-amine 1-methyl-N-[(1S,3R)-3-methylcycl…

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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)	1.41	5.89	-9.19	1	5	0	56	195.27	2	↓ MOL2 SDF SMILES Flexibase

62938940

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-methyl-N-[(1S,3S)-3-methylcyclohexyl]tetrazol-5-amine 1-methyl-N-[(1S,3S)-3-methylcycl…

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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)	1.41	6.2	-8.64	1	5	0	56	195.27	2	↓ MOL2 SDF SMILES Flexibase

62938941

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-methyl-N-[(1R,3R)-3-methylcyclohexyl]tetrazol-5-amine 1-methyl-N-[(1R,3R)-3-methylcycl…

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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)	1.41	6.2	-8.6	1	5	0	56	195.27	2	↓ MOL2 SDF SMILES Flexibase

62938942

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-methyl-N-[(1R,3S)-3-methylcyclohexyl]tetrazol-5-amine 1-methyl-N-[(1R,3S)-3-methylcycl…

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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)	1.41	5.89	-9.1	1	5	0	56	195.27	2	↓ MOL2 SDF SMILES Flexibase

62939061

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[(1-methyltetrazol-5-yl)amino]cyclohexanecarboxamide 4-[(1-methyltetrazol-5-yl)amino]…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-0.47	1.94	-18.83	3	7	0	99	224.268	3	↓ MOL2 SDF SMILES Flexibase

62939133

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2R)-2-ethylcyclohexyl]-1-methyl-tetrazol-5-amine N-[(1S,2R)-2-ethylcyclohexyl]-1-…

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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)	2.15	6.98	-8.59	1	5	0	56	209.297	3	↓ MOL2 SDF SMILES Flexibase

62939134

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2S)-2-ethylcyclohexyl]-1-methyl-tetrazol-5-amine N-[(1S,2S)-2-ethylcyclohexyl]-1-…

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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)	2.15	6.69	-8.99	1	5	0	56	209.297	3	↓ MOL2 SDF SMILES Flexibase

62939135

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2R)-2-ethylcyclohexyl]-1-methyl-tetrazol-5-amine N-[(1R,2R)-2-ethylcyclohexyl]-1-…

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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)	2.15	6.69	-8.96	1	5	0	56	209.297	3	↓ MOL2 SDF SMILES Flexibase

62939136

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2S)-2-ethylcyclohexyl]-1-methyl-tetrazol-5-amine N-[(1R,2S)-2-ethylcyclohexyl]-1-…

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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)	2.15	6.98	-8.55	1	5	0	56	209.297	3	↓ MOL2 SDF SMILES Flexibase

62939137

Analogs

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Popular Name: N-(4-ethylcyclohexyl)-1-methyl-tetrazol-5-amine N-(4-ethylcyclohexyl)-1-methyl-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)	1.86	6.54	-9.32	1	5	0	56	209.297	3	↓ MOL2 SDF SMILES Flexibase

62939186

Analogs

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Popular Name: 1-methyl-N-(4-propylcyclohexyl)tetrazol-5-amine 1-methyl-N-(4-propylcyclohexyl)t…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.42	7.6	-8.78	1	5	0	56	223.324	4	↓ MOL2 SDF SMILES Flexibase

62939277

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2R)-2-[(1-methyltetrazol-5-yl)amino]cyclohexanol (1S,2R)-2-[(1-methyltetrazol-5-y…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.25	2.29	-10.63	2	6	0	76	197.242	2	↓ MOL2 SDF SMILES Flexibase

62939278

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S)-2-[(1-methyltetrazol-5-yl)amino]cyclohexanol (1S,2S)-2-[(1-methyltetrazol-5-y…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.25	1.97	-11.26	2	6	0	76	197.242	2	↓ MOL2 SDF SMILES Flexibase

62939279

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2R)-2-[(1-methyltetrazol-5-yl)amino]cyclohexanol (1R,2R)-2-[(1-methyltetrazol-5-y…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.25	1.97	-11.19	2	6	0	76	197.242	2	↓ MOL2 SDF SMILES Flexibase

62939280

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S)-2-[(1-methyltetrazol-5-yl)amino]cyclohexanol (1R,2S)-2-[(1-methyltetrazol-5-y…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.25	2.16	-9.55	2	6	0	76	197.242	2	↓ MOL2 SDF SMILES Flexibase

62939295

Analogs

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Popular Name: [1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol [1-[(1-methyltetrazol-5-yl)amino…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.84	2.7	-9.03	2	6	0	76	211.269	3	↓ MOL2 SDF SMILES Flexibase

62939296

Analogs

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Popular Name: [4-methyl-1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol [4-methyl-1-[(1-methyltetrazol-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)	0.61	3.08	-8.97	2	6	0	76	225.296	3	↓ MOL2 SDF SMILES Flexibase

62939297

Analogs

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Popular Name: [(1R,3R)-3-methyl-1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol [(1R,3R)-3-methyl-1-[(1-methylte…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.85	3.31	-9.11	2	6	0	76	225.296	3	↓ MOL2 SDF SMILES Flexibase

62939298

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(1R,3S)-3-methyl-1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol [(1R,3S)-3-methyl-1-[(1-methylte…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.85	2.26	-9.16	2	6	0	76	225.296	3	↓ MOL2 SDF SMILES Flexibase

62939299

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(1S,3R)-3-methyl-1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol [(1S,3R)-3-methyl-1-[(1-methylte…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.85	2.26	-9.23	2	6	0	76	225.296	3	↓ MOL2 SDF SMILES Flexibase

62939300

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(1S,3S)-3-methyl-1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol [(1S,3S)-3-methyl-1-[(1-methylte…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.85	4.04	-10.24	2	6	0	76	225.296	3	↓ MOL2 SDF SMILES Flexibase

62939380

Analogs

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Popular Name: (1R,2S)-N1-(1-methyltetrazol-5-yl)cyclohexane-1,2-diamine (1R,2S)-N1-(1-methyltetrazol-5-y…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-0.24	3.07	-56.51	4	6	1	83	197.266	2	↓ MOL2 SDF SMILES Flexibase

62939381

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S)-N1-(1-methyltetrazol-5-yl)cyclohexane-1,2-diamine (1S,2S)-N1-(1-methyltetrazol-5-y…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-0.24	2.72	-56.49	4	6	1	83	197.266	2	↓ MOL2 SDF SMILES Flexibase

62939382

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2R)-N1-(1-methyltetrazol-5-yl)cyclohexane-1,2-diamine (1R,2R)-N1-(1-methyltetrazol-5-y…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-0.24	2.72	-56.86	4	6	1	83	197.266	2	↓ MOL2 SDF SMILES Flexibase

62939383

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2R)-N1-(1-methyltetrazol-5-yl)cyclohexane-1,2-diamine (1S,2R)-N1-(1-methyltetrazol-5-y…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-0.24	3.07	-56.07	4	6	1	83	197.266	2	↓ MOL2 SDF SMILES Flexibase

62939515

Analogs

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Popular Name: 2-[cyclohexyl-(1-methyltetrazol-5-yl)amino]ethanol 2-[cyclohexyl-(1-methyltetrazol-…

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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)	1.01	3.14	-9.69	1	6	0	67	225.296	4	↓ MOL2 SDF SMILES Flexibase

69676604

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2R,4R)-2,4-dimethylcyclohexyl]-1-methyl-tetrazol-5-amine N-[(1S,2R,4R)-2,4-dimethylcycloh…

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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)	1.65	6.96	-8.48	1	5	0	56	209.297	2	↓ MOL2 SDF SMILES Flexibase

69676608

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2R,4S)-2,4-dimethylcyclohexyl]-1-methyl-tetrazol-5-amine N-[(1S,2R,4S)-2,4-dimethylcycloh…

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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)	1.65	6.33	-8.93	1	5	0	56	209.297	2	↓ MOL2 SDF SMILES Flexibase

69676610

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2R,4R)-2,4-dimethylcyclohexyl]-1-methyl-tetrazol-5-amine N-[(1R,2R,4R)-2,4-dimethylcycloh…

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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)	1.65	6.66	-9.06	1	5	0	56	209.297	2	↓ MOL2 SDF SMILES Flexibase

69676614

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2R,4S)-2,4-dimethylcyclohexyl]-1-methyl-tetrazol-5-amine N-[(1R,2R,4S)-2,4-dimethylcycloh…

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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)	1.65	6.43	-9.02	1	5	0	56	209.297	2	↓ MOL2 SDF SMILES Flexibase

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Structural Results Found: (before additional filtering)

SQL Query Was

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