ZINC 12

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ZINC Item

Suppliers, Protomers, & Similar Substances

37092842

Analogs

37817633
37817634
35766391
35766394

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-N-cyclopentyl-N-methyl-piperidine-3-carboxamide (3R)-N-cyclopentyl-N-methyl-pipe…

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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)	1.27	5.08	-42.8	2	3	1	37	211.329	2	↓ MOL2 SDF SMILES Flexibase

37092843

Analogs

37817633
37817634
35766391
35766394

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-cyclopentyl-N-methyl-piperidine-3-carboxamide (3S)-N-cyclopentyl-N-methyl-pipe…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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)	1.27	5.04	-41.79	2	3	1	37	211.329	2	↓ MOL2 SDF SMILES Flexibase

37092990

Analogs

49091360
49091363
49091365
49091367
35773149

Draw Identity 99% 90% 80% 70%

Popular Name: (3S,6R)-N-cyclopentyl-N,6-dimethyl-piperidine-3-carboxamide (3S,6R)-N-cyclopentyl-N,6-dimeth…

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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)	1.95	5.71	-41.42	2	3	1	37	225.356	2	↓ MOL2 SDF SMILES Flexibase

37092991

Analogs

49091360
49091363
49091365
49091367
35773149

Draw Identity 99% 90% 80% 70%

Popular Name: (3S,6S)-N-cyclopentyl-N,6-dimethyl-piperidine-3-carboxamide (3S,6S)-N-cyclopentyl-N,6-dimeth…

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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)	1.95	5.74	-47.17	2	3	1	37	225.356	2	↓ MOL2 SDF SMILES Flexibase

37092992

Analogs

49091360
49091363
49091365
49091367
35773149

Draw Identity 99% 90% 80% 70%

Popular Name: (3R,6R)-N-cyclopentyl-N,6-dimethyl-piperidine-3-carboxamide (3R,6R)-N-cyclopentyl-N,6-dimeth…

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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)	1.95	5.78	-46.48	2	3	1	37	225.356	2	↓ MOL2 SDF SMILES Flexibase

37092993

Analogs

49091360
49091363
49091365
49091367
35773149

Draw Identity 99% 90% 80% 70%

Popular Name: (3R,6S)-N-cyclopentyl-N,6-dimethyl-piperidine-3-carboxamide (3R,6S)-N-cyclopentyl-N,6-dimeth…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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)	1.95	5.7	-40.55	2	3	1	37	225.356	2	↓ MOL2 SDF SMILES Flexibase

62851735

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-cyclopentyl-3-ethyl-piperidine-3-carboxamide (3S)-N-cyclopentyl-3-ethyl-piper…

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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)	1.93	4.67	-33.55	3	3	1	46	225.356	3	↓ MOL2 SDF SMILES Flexibase

62851736

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-N-cyclopentyl-3-ethyl-piperidine-3-carboxamide (3R)-N-cyclopentyl-3-ethyl-piper…

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Activity (Go SEA)

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)	1.93	4.71	-33.52	3	3	1	46	225.356	3	↓ MOL2 SDF SMILES Flexibase

62851737

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-cyclopentyl-3-propyl-piperidine-3-carboxamide (3S)-N-cyclopentyl-3-propyl-pipe…

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Activity (Go SEA)

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)	2.49	5.43	-33.88	3	3	1	46	239.383	4	↓ MOL2 SDF SMILES Flexibase

62851738

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-N-cyclopentyl-3-propyl-piperidine-3-carboxamide (3R)-N-cyclopentyl-3-propyl-pipe…

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Activity (Go SEA)

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)	2.49	5.47	-33.76	3	3	1	46	239.383	4	↓ MOL2 SDF SMILES Flexibase

62853402

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-cyclopentyl-3-ethyl-N-methyl-piperidine-3-carboxamide (3S)-N-cyclopentyl-3-ethyl-N-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)	1.85	5.78	-44.87	2	3	1	37	239.383	3	↓ MOL2 SDF SMILES Flexibase

62853403

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-N-cyclopentyl-3-ethyl-N-methyl-piperidine-3-carboxamide (3R)-N-cyclopentyl-3-ethyl-N-met…

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Activity (Go SEA)

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)	1.85	5.9	-41.97	2	3	1	37	239.383	3	↓ MOL2 SDF SMILES Flexibase

62853404

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-cyclopentyl-N,3-dimethyl-piperidine-3-carboxamide (3S)-N-cyclopentyl-N,3-dimethyl-…

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Activity (Go SEA)

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)	1.51	5.23	-33.31	2	3	1	37	225.356	2	↓ MOL2 SDF SMILES Flexibase

62853405

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-N-cyclopentyl-N,3-dimethyl-piperidine-3-carboxamide (3R)-N-cyclopentyl-N,3-dimethyl-…

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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)	1.51	5.34	-33.2	2	3	1	37	225.356	2	↓ MOL2 SDF SMILES Flexibase

62853872

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-cyclopentyl-N,3-diethyl-piperidine-3-carboxamide (3S)-N-cyclopentyl-N,3-diethyl-p…

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Activity (Go SEA)

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)	2.23	6.31	-43.62	2	3	1	37	253.41	4	↓ MOL2 SDF SMILES Flexibase

62853873

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-N-cyclopentyl-N,3-diethyl-piperidine-3-carboxamide (3R)-N-cyclopentyl-N,3-diethyl-p…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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)	2.23	6.69	-42.69	2	3	1	37	253.41	4	↓ MOL2 SDF SMILES Flexibase

62853874

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-N-cyclopentyl-N-ethyl-3-methyl-piperidine-3-carboxamide (3R)-N-cyclopentyl-N-ethyl-3-met…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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)	1.89	6.03	-33.14	2	3	1	37	239.383	3	↓ MOL2 SDF SMILES Flexibase

62853875

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-cyclopentyl-N-ethyl-3-methyl-piperidine-3-carboxamide (3S)-N-cyclopentyl-N-ethyl-3-met…

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Activity (Go SEA)

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)	1.89	6.07	-32.7	2	3	1	37	239.383	3	↓ MOL2 SDF SMILES Flexibase

62853876

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-cyclopentyl-N-ethyl-3-propyl-piperidine-3-carboxamide (3S)-N-cyclopentyl-N-ethyl-3-pro…

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Activity (Go SEA)

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)	2.79	6.86	-42.65	2	3	1	37	267.437	5	↓ MOL2 SDF SMILES Flexibase

62853877

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-N-cyclopentyl-N-ethyl-3-propyl-piperidine-3-carboxamide (3R)-N-cyclopentyl-N-ethyl-3-pro…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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)	2.79	7.44	-42.91	2	3	1	37	267.437	5	↓ MOL2 SDF SMILES Flexibase

62857180

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-(2-amino-2-oxo-ethyl)-N-cyclopentyl-3-ethyl-piperidine-3-carboxamide (3S)-N-(2-amino-2-oxo-ethyl)-N-c…

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Activity (Go SEA)

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)	0.58	2.78	-52.15	4	5	1	80	282.408	5	↓ MOL2 SDF SMILES Flexibase

62857181

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-N-(2-amino-2-oxo-ethyl)-N-cyclopentyl-3-ethyl-piperidine-3-carboxamide (3R)-N-(2-amino-2-oxo-ethyl)-N-c…

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Activity (Go SEA)

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)	0.58	2.75	-38.12	4	5	1	80	282.408	5	↓ MOL2 SDF SMILES Flexibase

62857182

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-(2-amino-2-oxo-ethyl)-N-cyclopentyl-3-methyl-piperidine-3-carboxamide (3S)-N-(2-amino-2-oxo-ethyl)-N-c…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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	2.33	-49.58	4	5	1	80	268.381	4	↓ MOL2 SDF SMILES Flexibase

62857183

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-N-(2-amino-2-oxo-ethyl)-N-cyclopentyl-3-methyl-piperidine-3-carboxamide (3R)-N-(2-amino-2-oxo-ethyl)-N-c…

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Activity (Go SEA)

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	2.49	-38.15	4	5	1	80	268.381	4	↓ MOL2 SDF SMILES Flexibase

62857184

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-(2-amino-2-oxo-ethyl)-N-cyclopentyl-3-propyl-piperidine-3-carboxamide (3S)-N-(2-amino-2-oxo-ethyl)-N-c…

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Activity (Go SEA)

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)	1.14	3.8	-40.8	4	5	1	80	296.435	6	↓ MOL2 SDF SMILES Flexibase

62857185

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-N-(2-amino-2-oxo-ethyl)-N-cyclopentyl-3-propyl-piperidine-3-carboxamide (3R)-N-(2-amino-2-oxo-ethyl)-N-c…

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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)	1.14	3.35	-54.09	4	5	1	80	296.435	6	↓ MOL2 SDF SMILES Flexibase

62857366

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-allyl-N-cyclopentyl-3-ethyl-piperidine-3-carboxamide (3S)-N-allyl-N-cyclopentyl-3-eth…

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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)	2.49	6.98	-43.7	2	3	1	37	265.421	5	↓ MOL2 SDF SMILES Flexibase

62857367

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-N-allyl-N-cyclopentyl-3-ethyl-piperidine-3-carboxamide (3R)-N-allyl-N-cyclopentyl-3-eth…

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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)	2.49	6.95	-41.55	2	3	1	37	265.421	5	↓ MOL2 SDF SMILES Flexibase

62857368

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-allyl-N-cyclopentyl-3-methyl-piperidine-3-carboxamide (3S)-N-allyl-N-cyclopentyl-3-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)	2.16	6.42	-41.98	2	3	1	37	251.394	4	↓ MOL2 SDF SMILES Flexibase

62857369

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-N-allyl-N-cyclopentyl-3-methyl-piperidine-3-carboxamide (3R)-N-allyl-N-cyclopentyl-3-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)	2.16	6.62	-32.91	2	3	1	37	251.394	4	↓ MOL2 SDF SMILES Flexibase

62857370

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-allyl-N-cyclopentyl-3-propyl-piperidine-3-carboxamide (3S)-N-allyl-N-cyclopentyl-3-pro…

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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)	3.05	7.76	-42.76	2	3	1	37	279.448	6	↓ MOL2 SDF SMILES Flexibase

62857371

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-N-allyl-N-cyclopentyl-3-propyl-piperidine-3-carboxamide (3R)-N-allyl-N-cyclopentyl-3-pro…

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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)	3.05	7.71	-42.54	2	3	1	37	279.448	6	↓ MOL2 SDF SMILES Flexibase

62857720

Analogs

42453499
42453500
42453501
42453502
44807489

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-N-cyclopentyl-3-ethyl-N-(2-hydroxyethyl)piperidine-3-carboxamide (3S)-N-cyclopentyl-3-ethyl-N-(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)	1.22	3.74	-40.31	3	4	1	57	269.409	5	↓ MOL2 SDF SMILES Flexibase

62857721

Analogs

42453499
42453500
42453501
42453502
44807489

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-N-cyclopentyl-3-ethyl-N-(2-hydroxyethyl)piperidine-3-carboxamide (3R)-N-cyclopentyl-3-ethyl-N-(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)	1.22	3.65	-41.66	3	4	1	57	269.409	5	↓ MOL2 SDF SMILES Flexibase

62857722

Analogs

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Popular Name: (3S)-N-cyclopentyl-N-(2-hydroxyethyl)-3-methyl-piperidine-3-carboxamide (3S)-N-cyclopentyl-N-(2-hydroxye…

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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)	0.88	3.11	-41.92	3	4	1	57	255.382	4	↓ MOL2 SDF SMILES Flexibase

62857723

Analogs

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Popular Name: (3R)-N-cyclopentyl-N-(2-hydroxyethyl)-3-methyl-piperidine-3-carboxamide (3R)-N-cyclopentyl-N-(2-hydroxye…

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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)	0.88	3.43	-42.71	3	4	1	57	255.382	4	↓ MOL2 SDF SMILES Flexibase

62857724

Analogs

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Popular Name: (3S)-N-cyclopentyl-N-(2-hydroxyethyl)-3-propyl-piperidine-3-carboxamide (3S)-N-cyclopentyl-N-(2-hydroxye…

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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)	1.78	4.66	-38.14	3	4	1	57	283.436	6	↓ MOL2 SDF SMILES Flexibase

62857725

Analogs

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Popular Name: (3R)-N-cyclopentyl-N-(2-hydroxyethyl)-3-propyl-piperidine-3-carboxamide (3R)-N-cyclopentyl-N-(2-hydroxye…

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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)	1.78	4.6	-43.46	3	4	1	57	283.436	6	↓ MOL2 SDF SMILES Flexibase

62857730

Analogs

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Popular Name: (3S)-N-cyclopentyl-N-(2-dimethylaminoethyl)-3-ethyl-piperidine-3-carboxamide (3S)-N-cyclopentyl-N-(2-dimethyl…

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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	7.68	-89.04	3	4	2	41	297.487	6	↓ MOL2 SDF SMILES Flexibase

62857731

Analogs

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Popular Name: (3R)-N-cyclopentyl-N-(2-dimethylaminoethyl)-3-ethyl-piperidine-3-carboxamide (3R)-N-cyclopentyl-N-(2-dimethyl…

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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	7.57	-94.73	3	4	2	41	297.487	6	↓ MOL2 SDF SMILES Flexibase

62857732

Analogs

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Popular Name: (3S)-N-cyclopentyl-N-(2-dimethylaminoethyl)-3-methyl-piperidine-3-carboxamide (3S)-N-cyclopentyl-N-(2-dimethyl…

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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	7.25	-87.27	3	4	2	41	283.46	5	↓ MOL2 SDF SMILES Flexibase

62857733

Analogs

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Popular Name: (3R)-N-cyclopentyl-N-(2-dimethylaminoethyl)-3-methyl-piperidine-3-carboxamide (3R)-N-cyclopentyl-N-(2-dimethyl…

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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	7.44	-81.17	3	4	2	41	283.46	5	↓ MOL2 SDF SMILES Flexibase

62858584

Analogs

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Popular Name: 1-[[(3S)-3-ethylpiperidine-3-carbonyl]amino]cyclopentanecarboxylic 1-[[(3S)-3-ethylpiperidine-3-car…

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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)	-0.73	5.64	-55.62	3	5	0	86	268.357	4	↓ MOL2 SDF SMILES Flexibase

62858585

Analogs

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Popular Name: 1-[[(3R)-3-ethylpiperidine-3-carbonyl]amino]cyclopentanecarboxylic 1-[[(3R)-3-ethylpiperidine-3-car…

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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)	-0.73	5.69	-65.52	3	5	0	86	268.357	4	↓ MOL2 SDF SMILES Flexibase

62858586

Analogs

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Popular Name: 1-[[(3S)-3-methylpiperidine-3-carbonyl]amino]cyclopentanecarboxylic 1-[[(3S)-3-methylpiperidine-3-ca…

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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)	-1.06	5.22	-62.6	3	5	0	86	254.33	3	↓ MOL2 SDF SMILES Flexibase

62858587

Analogs

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Popular Name: 1-[[(3R)-3-methylpiperidine-3-carbonyl]amino]cyclopentanecarboxylic 1-[[(3R)-3-methylpiperidine-3-ca…

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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)	-1.06	5.23	-62.1	3	5	0	86	254.33	3	↓ MOL2 SDF SMILES Flexibase

62858588

Analogs

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Popular Name: 1-[[(3S)-3-propylpiperidine-3-carbonyl]amino]cyclopentanecarboxylic 1-[[(3S)-3-propylpiperidine-3-ca…

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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)	-0.17	6.4	-55.56	3	5	0	86	282.384	5	↓ MOL2 SDF SMILES Flexibase

62858589

Analogs

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Popular Name: 1-[[(3R)-3-propylpiperidine-3-carbonyl]amino]cyclopentanecarboxylic 1-[[(3R)-3-propylpiperidine-3-ca…

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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)	-0.17	6.45	-65.9	3	5	0	86	282.384	5	↓ MOL2 SDF SMILES Flexibase

62858778

Analogs

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Popular Name: 2-[cyclopentyl-[(3S)-3-ethylpiperidine-3-carbonyl]amino]acetic 2-[cyclopentyl-[(3S)-3-ethylpipe…

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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)	0.18	7.06	-28.96	2	5	0	77	282.384	5	↓ MOL2 SDF SMILES Flexibase

62858779

Analogs

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Popular Name: 2-[cyclopentyl-[(3R)-3-ethylpiperidine-3-carbonyl]amino]acetic 2-[cyclopentyl-[(3R)-3-ethylpipe…

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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)	0.18	6.5	-59.65	2	5	0	77	282.384	5	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

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