ZINC 12

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Quick Search ZINC ID or SMILES

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ZINC Item

Suppliers, Protomers, & Similar Substances

53399324

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: ethyl ethyl

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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)	0.51	6.62	-49.23	1	6	1	60	299.391	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	0.51	4.37	-10.73	0	6	0	59	298.383	6	↓ MOL2 SDF SMILES Flexibase

36135018

Analogs

44804364
44804367
44804370
44804373

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,5R)-5-ethyl-2-methyl-morpholin-4-yl]-(4-piperidyl)methanone [(2R,5R)-5-ethyl-2-methyl-morpho…

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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)	0.95	4.57	-47.58	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

36135020

Analogs

44804364
44804367
44804370
44804373

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,5S)-5-ethyl-2-methyl-morpholin-4-yl]-(4-piperidyl)methanone [(2R,5S)-5-ethyl-2-methyl-morpho…

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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)	0.95	3.98	-47.01	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

36135022

Analogs

44804364
44804367
44804370
44804373
44824401

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,5R)-5-ethyl-2-methyl-morpholin-4-yl]-(4-piperidyl)methanone [(2S,5R)-5-ethyl-2-methyl-morpho…

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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)	0.95	3.92	-47.23	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

36135023

Analogs

44804364
44804367
44804370
44804373

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,5S)-5-ethyl-2-methyl-morpholin-4-yl]-(4-piperidyl)methanone [(2S,5S)-5-ethyl-2-methyl-morpho…

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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)	0.95	4.54	-47.49	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

53909324

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N,N-dimethyl-4-(morpholine-4-carbonyl)piperidine-1-carboxamide N,N-dimethyl-4-(morpholine-4-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)	-0.18	3.57	-19.31	0	6	0	53	269.345	1	↓ MOL2 SDF SMILES Flexibase

57992054

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: tert-butyl tert-butyl

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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	3.75	-20.57	1	8	0	88	369.462	6	↓ MOL2 SDF SMILES Flexibase

13679176

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N,N-dimethyl-4-(morpholine-4-carbonyl)piperidine-1-sulfonamide N,N-dimethyl-4-(morpholine-4-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)	-0.31	1.26	-13.71	0	7	0	70	305.4	3	↓ MOL2 SDF SMILES Flexibase

62839449

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,6R)-2,6-dimethylmorpholin-4-yl]-(4-methyl-4-piperidyl)methanone [(2S,6R)-2,6-dimethylmorpholin-4…

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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)	0.69	3.5	-43.02	2	4	1	46	241.355	1	↓ MOL2 SDF SMILES Flexibase

62839450

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,6S)-2,6-dimethylmorpholin-4-yl]-(4-methyl-4-piperidyl)methanone [(2S,6S)-2,6-dimethylmorpholin-4…

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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)	0.69	3.6	-43.13	2	4	1	46	241.355	1	↓ MOL2 SDF SMILES Flexibase

62839451

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,6R)-2,6-dimethylmorpholin-4-yl]-(4-methyl-4-piperidyl)methanone [(2R,6R)-2,6-dimethylmorpholin-4…

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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)	0.69	3.37	-43.09	2	4	1	46	241.355	1	↓ MOL2 SDF SMILES Flexibase

62839456

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R)-2-methylmorpholin-4-yl]-(4-methyl-4-piperidyl)methanone [(2R)-2-methylmorpholin-4-yl]-(4…

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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)	0.32	2.75	-42.74	2	4	1	46	227.328	1	↓ MOL2 SDF SMILES Flexibase

62839457

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S)-2-methylmorpholin-4-yl]-(4-methyl-4-piperidyl)methanone [(2S)-2-methylmorpholin-4-yl]-(4…

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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)	0.32	2.79	-41.85	2	4	1	46	227.328	1	↓ MOL2 SDF SMILES Flexibase

62839840

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(3R)-3-methylmorpholin-4-yl]-(4-methyl-4-piperidyl)methanone [(3R)-3-methylmorpholin-4-yl]-(4…

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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)	0.29	2.68	-41.23	2	4	1	46	227.328	1	↓ MOL2 SDF SMILES Flexibase

62839841

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(3S)-3-methylmorpholin-4-yl]-(4-methyl-4-piperidyl)methanone [(3S)-3-methylmorpholin-4-yl]-(4…

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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)	0.29	2.64	-41.1	2	4	1	46	227.328	1	↓ MOL2 SDF SMILES Flexibase

62839843

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,5R)-2,5-dimethylmorpholin-4-yl]-(4-methyl-4-piperidyl)methanone [(2R,5R)-2,5-dimethylmorpholin-4…

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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)	0.65	3.43	-42.83	2	4	1	46	241.355	1	↓ MOL2 SDF SMILES Flexibase

62839844

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,5R)-2,5-dimethylmorpholin-4-yl]-(4-methyl-4-piperidyl)methanone [(2S,5R)-2,5-dimethylmorpholin-4…

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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)	0.65	3.36	-41.19	2	4	1	46	241.355	1	↓ MOL2 SDF SMILES Flexibase

62839845

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,5S)-2,5-dimethylmorpholin-4-yl]-(4-methyl-4-piperidyl)methanone [(2R,5S)-2,5-dimethylmorpholin-4…

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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)	0.65	3.41	-41.28	2	4	1	46	241.355	1	↓ MOL2 SDF SMILES Flexibase

62839846

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,5S)-2,5-dimethylmorpholin-4-yl]-(4-methyl-4-piperidyl)methanone [(2S,5S)-2,5-dimethylmorpholin-4…

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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)	0.65	3.48	-41.83	2	4	1	46	241.355	1	↓ MOL2 SDF SMILES Flexibase

62839856

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R)-2-ethylmorpholin-4-yl]-(4-methyl-4-piperidyl)methanone [(2R)-2-ethylmorpholin-4-yl]-(4-…

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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)	0.83	3.58	-42.59	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

62839857

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S)-2-ethylmorpholin-4-yl]-(4-methyl-4-piperidyl)methanone [(2S)-2-ethylmorpholin-4-yl]-(4-…

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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)	0.83	3.57	-43	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

62839876

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,5R)-5-ethyl-2-methyl-morpholin-4-yl]-(4-methyl-4-piperidyl)methanone [(2R,5R)-5-ethyl-2-methyl-morpho…

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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)	1.19	4.3	-42.46	2	4	1	46	255.382	2	↓ MOL2 SDF SMILES Flexibase

62839877

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,5S)-5-ethyl-2-methyl-morpholin-4-yl]-(4-methyl-4-piperidyl)methanone [(2R,5S)-5-ethyl-2-methyl-morpho…

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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)	1.19	4	-41.16	2	4	1	46	255.382	2	↓ MOL2 SDF SMILES Flexibase

62839878

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,5R)-5-ethyl-2-methyl-morpholin-4-yl]-(4-methyl-4-piperidyl)methanone [(2S,5R)-5-ethyl-2-methyl-morpho…

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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)	1.19	4	-41.2	2	4	1	46	255.382	2	↓ MOL2 SDF SMILES Flexibase

62839879

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,5S)-5-ethyl-2-methyl-morpholin-4-yl]-(4-methyl-4-piperidyl)methanone [(2S,5S)-5-ethyl-2-methyl-morpho…

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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)	1.19	4.48	-42.11	2	4	1	46	255.382	2	↓ MOL2 SDF SMILES Flexibase

62839927

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2,2-dimethylmorpholin-4-yl)-(4-methyl-4-piperidyl)methanone (2,2-dimethylmorpholin-4-yl)-(4-…

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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)	0.77	3.27	-43.56	2	4	1	46	241.355	1	↓ MOL2 SDF SMILES Flexibase

62839930

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(3R)-3-ethylmorpholin-4-yl]-(4-methyl-4-piperidyl)methanone [(3R)-3-ethylmorpholin-4-yl]-(4-…

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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)	0.83	3.25	-40.87	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

62839931

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(3S)-3-ethylmorpholin-4-yl]-(4-methyl-4-piperidyl)methanone [(3S)-3-ethylmorpholin-4-yl]-(4-…

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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)	0.83	3.25	-40.89	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

62841252

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3,3-dimethylmorpholin-4-yl)-(4-methyl-4-piperidyl)methanone (3,3-dimethylmorpholin-4-yl)-(4-…

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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)	0.77	3.31	-40.86	2	4	1	46	241.355	1	↓ MOL2 SDF SMILES Flexibase

62841348

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-4-(4-methylpiperidine-4-carbonyl)morpholine-2-carboxylic (2S)-4-(4-methylpiperidine-4-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)	-0.81	3.37	-77.25	2	6	0	86	256.302	2	↓ MOL2 SDF SMILES Flexibase

62841349

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-4-(4-methylpiperidine-4-carbonyl)morpholine-2-carboxylic (2R)-4-(4-methylpiperidine-4-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)	-0.81	3.39	-76.23	2	6	0	86	256.302	2	↓ MOL2 SDF SMILES Flexibase

62841403

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4-methyl-4-piperidyl)-[(6R)-2,2,6-trimethylmorpholin-4-yl]methanone (4-methyl-4-piperidyl)-[(6R)-2,2…

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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)	1.13	4	-43.57	2	4	1	46	255.382	1	↓ MOL2 SDF SMILES Flexibase

62841404

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4-methyl-4-piperidyl)-[(6S)-2,2,6-trimethylmorpholin-4-yl]methanone (4-methyl-4-piperidyl)-[(6S)-2,2…

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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)	1.13	4.22	-43.31	2	4	1	46	255.382	1	↓ MOL2 SDF SMILES Flexibase

62847485

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4-ethyl-4-piperidyl)-morpholino-methanone (4-ethyl-4-piperidyl)-morpholino…

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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)	0.30	2.51	-42.7	2	4	1	46	227.328	2	↓ MOL2 SDF SMILES Flexibase

62847486

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: morpholino-(4-propyl-4-piperidyl)methanone morpholino-(4-propyl-4-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)	0.86	3.27	-42.97	2	4	1	46	241.355	3	↓ MOL2 SDF SMILES Flexibase

62847525

Analogs

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Popular Name: [(2S,6R)-2,6-dimethylmorpholin-4-yl]-(4-ethyl-4-piperidyl)methanone [(2S,6R)-2,6-dimethylmorpholin-4…

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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)	1.02	4.05	-42.83	2	4	1	46	255.382	2	↓ MOL2 SDF SMILES Flexibase

62847526

Analogs

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Popular Name: [(2R,6R)-2,6-dimethylmorpholin-4-yl]-(4-ethyl-4-piperidyl)methanone [(2R,6R)-2,6-dimethylmorpholin-4…

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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)	1.02	3.99	-42.75	2	4	1	46	255.382	2	↓ MOL2 SDF SMILES Flexibase

62847527

Analogs

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Popular Name: [(2S,6S)-2,6-dimethylmorpholin-4-yl]-(4-ethyl-4-piperidyl)methanone [(2S,6S)-2,6-dimethylmorpholin-4…

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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)	1.02	4.11	-43.99	2	4	1	46	255.382	2	↓ MOL2 SDF SMILES Flexibase

62847528

Analogs

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Popular Name: [(2S,6R)-2,6-dimethylmorpholin-4-yl]-(4-propyl-4-piperidyl)methanone [(2S,6R)-2,6-dimethylmorpholin-4…

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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)	1.58	4.78	-44.18	2	4	1	46	269.409	3	↓ MOL2 SDF SMILES Flexibase

62847529

Analogs

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Popular Name: [(2R,6R)-2,6-dimethylmorpholin-4-yl]-(4-propyl-4-piperidyl)methanone [(2R,6R)-2,6-dimethylmorpholin-4…

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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)	1.58	4.88	-43.25	2	4	1	46	269.409	3	↓ MOL2 SDF SMILES Flexibase

62847530

Analogs

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Popular Name: [(2S,6S)-2,6-dimethylmorpholin-4-yl]-(4-propyl-4-piperidyl)methanone [(2S,6S)-2,6-dimethylmorpholin-4…

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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)	1.58	4.91	-42.77	2	4	1	46	269.409	3	↓ MOL2 SDF SMILES Flexibase

62847539

Analogs

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Popular Name: (4-ethyl-4-piperidyl)-[(2R)-2-methylmorpholin-4-yl]methanone (4-ethyl-4-piperidyl)-[(2R)-2-me…

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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)	0.66	3.26	-42.82	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

62847540

Analogs

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Popular Name: (4-ethyl-4-piperidyl)-[(2S)-2-methylmorpholin-4-yl]methanone (4-ethyl-4-piperidyl)-[(2S)-2-me…

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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)	0.66	3.3	-42.59	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

62847541

Analogs

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Popular Name: [(2R)-2-methylmorpholin-4-yl]-(4-propyl-4-piperidyl)methanone [(2R)-2-methylmorpholin-4-yl]-(4…

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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	4.02	-43.02	2	4	1	46	255.382	3	↓ MOL2 SDF SMILES Flexibase

62847542

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S)-2-methylmorpholin-4-yl]-(4-propyl-4-piperidyl)methanone [(2S)-2-methylmorpholin-4-yl]-(4…

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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	4.08	-43.73	2	4	1	46	255.382	3	↓ MOL2 SDF SMILES Flexibase

62848219

Analogs

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Popular Name: (4-ethyl-4-piperidyl)-[(3S)-3-methylmorpholin-4-yl]methanone (4-ethyl-4-piperidyl)-[(3S)-3-me…

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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)	0.63	3.2	-42.36	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

62848220

Analogs

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Popular Name: (4-ethyl-4-piperidyl)-[(3R)-3-methylmorpholin-4-yl]methanone (4-ethyl-4-piperidyl)-[(3R)-3-me…

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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)	0.63	3.12	-41.71	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

62848221

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(3S)-3-methylmorpholin-4-yl]-(4-propyl-4-piperidyl)methanone [(3S)-3-methylmorpholin-4-yl]-(4…

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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)	1.19	3.95	-41.99	2	4	1	46	255.382	3	↓ MOL2 SDF SMILES Flexibase

62848222

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(3R)-3-methylmorpholin-4-yl]-(4-propyl-4-piperidyl)methanone [(3R)-3-methylmorpholin-4-yl]-(4…

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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)	1.19	3.89	-43.06	2	4	1	46	255.382	3	↓ MOL2 SDF SMILES Flexibase

62848225

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,5S)-2,5-dimethylmorpholin-4-yl]-(4-ethyl-4-piperidyl)methanone [(2S,5S)-2,5-dimethylmorpholin-4…

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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)	0.99	4.02	-42.65	2	4	1	46	255.382	2	↓ MOL2 SDF SMILES Flexibase

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SQL Query Was

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