ZINC 12

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ZINC Item

Suppliers, Protomers, & Similar Substances

19433737

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,6S)-2,6-dimethylmorpholin-4-yl]-[(3R,6R)-6-methyl-3-piperidyl]methanone [(2R,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)	1.12	4.23	-51.17	2	4	1	46	241.355	1	↓ MOL2 SDF SMILES Flexibase

19433739

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,6S)-2,6-dimethylmorpholin-4-yl]-[(3R,6S)-6-methyl-3-piperidyl]methanone [(2R,6S)-2,6-dimethylmorpholin-4…

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)	1.12	4.44	-35.25	2	4	1	46	241.355	1	↓ MOL2 SDF SMILES Flexibase

19433741

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,6S)-2,6-dimethylmorpholin-4-yl]-[(3S,6R)-6-methyl-3-piperidyl]methanone [(2R,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)	1.12	4.07	-44.02	2	4	1	46	241.355	1	↓ MOL2 SDF SMILES Flexibase

19433743

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,6S)-2,6-dimethylmorpholin-4-yl]-[(3S,6S)-6-methyl-3-piperidyl]methanone [(2R,6S)-2,6-dimethylmorpholin-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)	1.12	4.25	-50.5	2	4	1	46	241.355	1	↓ MOL2 SDF SMILES Flexibase

36135031

Analogs

43427472
43427473
43427474
43427475
44804327

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,5R)-5-ethyl-2-methyl-morpholin-4-yl]-[(3R)-3-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	4.53	-44.43	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

36135033

Analogs

43427472
43427473
43427474
43427475
44804327

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,5S)-5-ethyl-2-methyl-morpholin-4-yl]-[(3R)-3-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)	0.95	3.94	-44.1	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

36135034

Analogs

43427472
43427473
43427474
43427475
44804327

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,5R)-5-ethyl-2-methyl-morpholin-4-yl]-[(3R)-3-piperidyl]methanone [(2S,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)	0.95	3.88	-43.49	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

36135036

Analogs

42451889
42451891
42451893
42451895
43427472

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,5S)-5-ethyl-2-methyl-morpholin-4-yl]-[(3R)-3-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	4.5	-44.22	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

62851657

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(3S)-3-ethyl-3-piperidyl]-morpholino-methanone [(3S)-3-ethyl-3-piperidyl]-morph…

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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)	0.30	2.58	-45.41	2	4	1	46	227.328	2	↓ MOL2 SDF SMILES Flexibase

62851658

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(3R)-3-ethyl-3-piperidyl]-morpholino-methanone [(3R)-3-ethyl-3-piperidyl]-morph…

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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	2.57	-44.68	2	4	1	46	227.328	2	↓ MOL2 SDF SMILES Flexibase

62851659

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3-Methyl-piperidin-3-yl)-morpholin-4-yl-methanone (3-Methyl-piperidin-3-yl)-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)	-0.04	2.11	-43.7	2	4	1	46	213.301	1	↓ MOL2 SDF SMILES Flexibase

62851660

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3-Methyl-piperidin-3-yl)-morpholin-4-yl-methanone (3-Methyl-piperidin-3-yl)-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)	-0.04	2.05	-44.55	2	4	1	46	213.301	1	↓ MOL2 SDF SMILES Flexibase

62851661

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: morpholino-[(3S)-3-propyl-3-piperidyl]methanone morpholino-[(3S)-3-propyl-3-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)	0.86	3.34	-45.66	2	4	1	46	241.355	3	↓ MOL2 SDF SMILES Flexibase

62851662

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: morpholino-[(3R)-3-propyl-3-piperidyl]methanone morpholino-[(3R)-3-propyl-3-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)	0.86	3.33	-44.93	2	4	1	46	241.355	3	↓ MOL2 SDF SMILES Flexibase

62851773

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,6R)-2,6-dimethylmorpholin-4-yl]-[(3S)-3-ethyl-3-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	4.12	-45.79	2	4	1	46	255.382	2	↓ MOL2 SDF SMILES Flexibase

62851774

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,6R)-2,6-dimethylmorpholin-4-yl]-[(3R)-3-ethyl-3-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	4.12	-44.62	2	4	1	46	255.382	2	↓ MOL2 SDF SMILES Flexibase

62851775

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,6R)-2,6-dimethylmorpholin-4-yl]-[(3S)-3-ethyl-3-piperidyl]methanone [(2R,6R)-2,6-dimethylmorpholin-4…

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)	1.02	4.34	-44.96	2	4	1	46	255.382	2	↓ MOL2 SDF SMILES Flexibase

62851776

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,6R)-2,6-dimethylmorpholin-4-yl]-[(3R)-3-ethyl-3-piperidyl]methanone [(2R,6R)-2,6-dimethylmorpholin-4…

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)	1.02	4.05	-44.96	2	4	1	46	255.382	2	↓ MOL2 SDF SMILES Flexibase

62851777

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,6R)-2,6-dimethylmorpholin-4-yl]-[(3R)-3-methyl-3-piperidyl]methanone [(2S,6R)-2,6-dimethylmorpholin-4…

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)	0.69	3.73	-35.82	2	4	1	46	241.355	1	↓ MOL2 SDF SMILES Flexibase

62851778

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,6S)-2,6-dimethylmorpholin-4-yl]-[(3R)-3-methyl-3-piperidyl]methanone [(2S,6S)-2,6-dimethylmorpholin-4…

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)	0.69	3.82	-35.83	2	4	1	46	241.355	1	↓ MOL2 SDF SMILES Flexibase

62851779

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,6R)-2,6-dimethylmorpholin-4-yl]-[(3R)-3-methyl-3-piperidyl]methanone [(2R,6R)-2,6-dimethylmorpholin-4…

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)	0.69	3.63	-35.79	2	4	1	46	241.355	1	↓ MOL2 SDF SMILES Flexibase

62851780

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,6R)-2,6-dimethylmorpholin-4-yl]-[(3S)-3-propyl-3-piperidyl]methanone [(2S,6R)-2,6-dimethylmorpholin-4…

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)	1.58	4.88	-46.05	2	4	1	46	269.409	3	↓ MOL2 SDF SMILES Flexibase

62851781

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,6R)-2,6-dimethylmorpholin-4-yl]-[(3R)-3-propyl-3-piperidyl]methanone [(2S,6R)-2,6-dimethylmorpholin-4…

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)	1.58	4.82	-45.92	2	4	1	46	269.409	3	↓ MOL2 SDF SMILES Flexibase

62851782

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,6R)-2,6-dimethylmorpholin-4-yl]-[(3S)-3-propyl-3-piperidyl]methanone [(2R,6R)-2,6-dimethylmorpholin-4…

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)	1.58	4.91	-44.55	2	4	1	46	269.409	3	↓ MOL2 SDF SMILES Flexibase

62851783

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,6R)-2,6-dimethylmorpholin-4-yl]-[(3R)-3-propyl-3-piperidyl]methanone [(2R,6R)-2,6-dimethylmorpholin-4…

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)	1.58	4.94	-45.96	2	4	1	46	269.409	3	↓ MOL2 SDF SMILES Flexibase

62851808

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(3S)-3-ethyl-3-piperidyl]-[(2R)-2-methylmorpholin-4-yl]methanone [(3S)-3-ethyl-3-piperidyl]-[(2R)…

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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	3.32	-45.52	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

62851809

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(3R)-3-ethyl-3-piperidyl]-[(2R)-2-methylmorpholin-4-yl]methanone [(3R)-3-ethyl-3-piperidyl]-[(2R)…

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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	3.32	-44.82	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

62851810

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(3S)-3-ethyl-3-piperidyl]-[(2S)-2-methylmorpholin-4-yl]methanone [(3S)-3-ethyl-3-piperidyl]-[(2S)…

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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	3.37	-45.61	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

62851811

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(3R)-3-ethyl-3-piperidyl]-[(2S)-2-methylmorpholin-4-yl]methanone [(3R)-3-ethyl-3-piperidyl]-[(2S)…

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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	3.37	-44.47	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

62851812

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R)-2-methylmorpholin-4-yl]-[(3R)-3-methyl-3-piperidyl]methanone [(2R)-2-methylmorpholin-4-yl]-[(…

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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	2.98	-35.58	2	4	1	46	227.328	1	↓ MOL2 SDF SMILES Flexibase

62851813

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S)-2-methylmorpholin-4-yl]-[(3R)-3-methyl-3-piperidyl]methanone [(2S)-2-methylmorpholin-4-yl]-[(…

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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	2.98	-35.74	2	4	1	46	227.328	1	↓ MOL2 SDF SMILES Flexibase

62851814

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R)-2-methylmorpholin-4-yl]-[(3S)-3-methyl-3-piperidyl]methanone [(2R)-2-methylmorpholin-4-yl]-[(…

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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	3.04	-35.26	2	4	1	46	227.328	1	↓ MOL2 SDF SMILES Flexibase

62851815

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S)-2-methylmorpholin-4-yl]-[(3S)-3-methyl-3-piperidyl]methanone [(2S)-2-methylmorpholin-4-yl]-[(…

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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	3.05	-35.09	2	4	1	46	227.328	1	↓ MOL2 SDF SMILES Flexibase

62851816

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R)-2-methylmorpholin-4-yl]-[(3S)-3-propyl-3-piperidyl]methanone [(2R)-2-methylmorpholin-4-yl]-[(…

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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	4.09	-45.75	2	4	1	46	255.382	3	↓ MOL2 SDF SMILES Flexibase

62851817

Analogs

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Popular Name: [(2R)-2-methylmorpholin-4-yl]-[(3R)-3-propyl-3-piperidyl]methanone [(2R)-2-methylmorpholin-4-yl]-[(…

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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	-45.03	2	4	1	46	255.382	3	↓ MOL2 SDF SMILES Flexibase

62851818

Analogs

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Popular Name: [(2S)-2-methylmorpholin-4-yl]-[(3S)-3-propyl-3-piperidyl]methanone [(2S)-2-methylmorpholin-4-yl]-[(…

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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	4.13	-45.86	2	4	1	46	255.382	3	↓ MOL2 SDF SMILES Flexibase

62851819

Analogs

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Popular Name: [(2S)-2-methylmorpholin-4-yl]-[(3R)-3-propyl-3-piperidyl]methanone [(2S)-2-methylmorpholin-4-yl]-[(…

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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	4.13	-44.7	2	4	1	46	255.382	3	↓ MOL2 SDF SMILES Flexibase

62853878

Analogs

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

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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	3.25	-44.35	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

62853879

Analogs

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

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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	3.24	-43.63	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

62853880

Analogs

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

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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	3.19	-44.59	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

62853881

Analogs

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

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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	3.17	-43.68	2	4	1	46	241.355	2	↓ MOL2 SDF SMILES Flexibase

62853882

Analogs

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

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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	2.94	-34.64	2	4	1	46	227.328	1	↓ MOL2 SDF SMILES Flexibase

62853883

Analogs

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

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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)	0.29	2.88	-34.81	2	4	1	46	227.328	1	↓ MOL2 SDF SMILES Flexibase

62853884

Analogs

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

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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	2.84	-34.99	2	4	1	46	227.328	1	↓ MOL2 SDF SMILES Flexibase

62853885

Analogs

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

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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)	0.29	2.85	-35.13	2	4	1	46	227.328	1	↓ MOL2 SDF SMILES Flexibase

62853886

Analogs

Draw Identity 99% 90% 80% 70%

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

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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	4.01	-44.66	2	4	1	46	255.382	3	↓ MOL2 SDF SMILES Flexibase

62853887

Analogs

Draw Identity 99% 90% 80% 70%

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

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)	1.19	4	-43.89	2	4	1	46	255.382	3	↓ MOL2 SDF SMILES Flexibase

62853888

Analogs

Draw Identity 99% 90% 80% 70%

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

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)	1.19	3.95	-44.83	2	4	1	46	255.382	3	↓ MOL2 SDF SMILES Flexibase

62853889

Analogs

Draw Identity 99% 90% 80% 70%

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

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)	1.19	3.94	-43.83	2	4	1	46	255.382	3	↓ MOL2 SDF SMILES Flexibase

62853896

Analogs

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Popular Name: [(2S,5S)-2,5-dimethylmorpholin-4-yl]-[(3S)-3-ethyl-3-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	4.08	-45.49	2	4	1	46	255.382	2	↓ MOL2 SDF SMILES Flexibase

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Structural Results Found: (before additional filtering)

SQL Query Was

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