ZINC 12

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ZINC Item

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54670542

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3S)-4-ethyl-2-oxo-morpholin-3-yl]-N-[3-(trifluoromethoxy)phenyl]acetamide 2-[(3S)-4-ethyl-2-oxo-morpholin-…

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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)	3.67	4.22	-18.97	1	6	0	68	346.305	6	↓ MOL2 SDF SMILES Flexibase

54670544

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3R)-4-ethyl-2-oxo-morpholin-3-yl]-N-[3-(trifluoromethoxy)phenyl]acetamide 2-[(3R)-4-ethyl-2-oxo-morpholin-…

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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)	3.67	4.54	-15.32	1	6	0	68	346.305	6	↓ MOL2 SDF SMILES Flexibase

54670546

Analogs

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Popular Name: N-(2-chlorophenyl)-2-[(3S)-4-ethyl-2-oxo-morpholin-3-yl]acetamide N-(2-chlorophenyl)-2-[(3S)-4-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)	3.36	5.3	-12.61	1	5	0	59	296.754	4	↓ MOL2 SDF SMILES Flexibase

54670548

Analogs

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Popular Name: N-(2-chlorophenyl)-2-[(3R)-4-ethyl-2-oxo-morpholin-3-yl]acetamide N-(2-chlorophenyl)-2-[(3R)-4-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)	3.36	5.34	-12.14	1	5	0	59	296.754	4	↓ MOL2 SDF SMILES Flexibase

54670550

Analogs

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Popular Name: 2-[(3S)-4-ethyl-2-oxo-morpholin-3-yl]-N-(2-methoxyphenyl)acetamide 2-[(3S)-4-ethyl-2-oxo-morpholin-…

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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)	2.73	3.82	-16.48	1	6	0	68	292.335	5	↓ MOL2 SDF SMILES Flexibase

54670551

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3R)-4-ethyl-2-oxo-morpholin-3-yl]-N-(2-methoxyphenyl)acetamide 2-[(3R)-4-ethyl-2-oxo-morpholin-…

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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)	2.73	4.15	-14.1	1	6	0	68	292.335	5	↓ MOL2 SDF SMILES Flexibase

54670554

Analogs

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Popular Name: 2-[(3S)-4-ethyl-2-oxo-morpholin-3-yl]-N-(4-methyl-3-nitro-phenyl)acetamide 2-[(3S)-4-ethyl-2-oxo-morpholin-…

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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)	3.06	6.01	-21.16	1	8	0	104	321.333	5	↓ MOL2 SDF SMILES Flexibase

54670555

Analogs

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Popular Name: 2-[(3R)-4-ethyl-2-oxo-morpholin-3-yl]-N-(4-methyl-3-nitro-phenyl)acetamide 2-[(3R)-4-ethyl-2-oxo-morpholin-…

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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)	3.06	6.14	-21.53	1	8	0	104	321.333	5	↓ MOL2 SDF SMILES Flexibase

54670557

Analogs

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Popular Name: N-(3-chloro-2-methyl-phenyl)-2-[(3S)-4-ethyl-2-oxo-morpholin-3-yl]acetamide N-(3-chloro-2-methyl-phenyl)-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)	3.76	5.96	-12.99	1	5	0	59	310.781	4	↓ MOL2 SDF SMILES Flexibase

54670560

Analogs

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Popular Name: N-(3-chloro-2-methyl-phenyl)-2-[(3R)-4-ethyl-2-oxo-morpholin-3-yl]acetamide N-(3-chloro-2-methyl-phenyl)-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)	3.76	6.02	-12.8	1	5	0	59	310.781	4	↓ MOL2 SDF SMILES Flexibase

54670784

Analogs

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Popular Name: 2-[(3S)-4-ethyl-2-oxo-morpholin-3-yl]-N-(3,4,5-trimethoxyphenyl)acetamide 2-[(3S)-4-ethyl-2-oxo-morpholin-…

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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)	2.36	3.57	-21.22	1	8	0	86	352.387	7	↓ MOL2 SDF SMILES Flexibase

54670786

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3R)-4-ethyl-2-oxo-morpholin-3-yl]-N-(3,4,5-trimethoxyphenyl)acetamide 2-[(3R)-4-ethyl-2-oxo-morpholin-…

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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)	2.36	3.61	-21.72	1	8	0	86	352.387	7	↓ MOL2 SDF SMILES Flexibase

54670977

Analogs

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Popular Name: N-(2-ethoxyphenyl)-2-[(3S)-4-ethyl-2-oxo-morpholin-3-yl]acetamide N-(2-ethoxyphenyl)-2-[(3S)-4-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)	3.11	4.76	-16.18	1	6	0	68	306.362	6	↓ MOL2 SDF SMILES Flexibase

54670979

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-ethoxyphenyl)-2-[(3R)-4-ethyl-2-oxo-morpholin-3-yl]acetamide N-(2-ethoxyphenyl)-2-[(3R)-4-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)	3.11	5.09	-13.79	1	6	0	68	306.362	6	↓ MOL2 SDF SMILES Flexibase

54670981

Analogs

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Popular Name: 2-[(3S)-4-ethyl-2-oxo-morpholin-3-yl]-N-(2-nitrophenyl)acetamide 2-[(3S)-4-ethyl-2-oxo-morpholin-…

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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)	2.64	5.49	-15.98	1	8	0	104	307.306	5	↓ MOL2 SDF SMILES Flexibase

54670983

Analogs

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Popular Name: 2-[(3R)-4-ethyl-2-oxo-morpholin-3-yl]-N-(2-nitrophenyl)acetamide 2-[(3R)-4-ethyl-2-oxo-morpholin-…

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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)	2.64	5.8	-15.41	1	8	0	104	307.306	5	↓ MOL2 SDF SMILES Flexibase

54670985

Analogs

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Popular Name: N-(2,5-dimethylphenyl)-2-[(3S)-4-ethyl-2-oxo-morpholin-3-yl]acetamide N-(2,5-dimethylphenyl)-2-[(3S)-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)	3.55	6.19	-14.89	1	5	0	59	290.363	4	↓ MOL2 SDF SMILES Flexibase

54670987

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,5-dimethylphenyl)-2-[(3R)-4-ethyl-2-oxo-morpholin-3-yl]acetamide N-(2,5-dimethylphenyl)-2-[(3R)-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)	3.55	6.25	-14.23	1	5	0	59	290.363	4	↓ MOL2 SDF SMILES Flexibase

54670989

Analogs

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Popular Name: N-(2,5-dichlorophenyl)-2-[(3S)-4-ethyl-2-oxo-morpholin-3-yl]acetamide N-(2,5-dichlorophenyl)-2-[(3S)-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)	4.01	5.81	-12.52	1	5	0	59	331.199	4	↓ MOL2 SDF SMILES Flexibase

54670991

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,5-dichlorophenyl)-2-[(3R)-4-ethyl-2-oxo-morpholin-3-yl]acetamide N-(2,5-dichlorophenyl)-2-[(3R)-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)	4.01	5.86	-12.28	1	5	0	59	331.199	4	↓ MOL2 SDF SMILES Flexibase

54670993

Analogs

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Popular Name: 2-[(3S)-4-ethyl-2-oxo-morpholin-3-yl]-N-(2-methyl-5-nitro-phenyl)acetamide 2-[(3S)-4-ethyl-2-oxo-morpholin-…

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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)	3.06	6.22	-23.18	1	8	0	104	321.333	5	↓ MOL2 SDF SMILES Flexibase

54670995

Analogs

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Popular Name: 2-[(3R)-4-ethyl-2-oxo-morpholin-3-yl]-N-(2-methyl-5-nitro-phenyl)acetamide 2-[(3R)-4-ethyl-2-oxo-morpholin-…

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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)	3.06	6.3	-20.92	1	8	0	104	321.333	5	↓ MOL2 SDF SMILES Flexibase

54670997

Analogs

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Popular Name: N-(2,3-dichlorophenyl)-2-[(3S)-4-ethyl-2-oxo-morpholin-3-yl]acetamide N-(2,3-dichlorophenyl)-2-[(3S)-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)	3.99	5.77	-12.09	1	5	0	59	331.199	4	↓ MOL2 SDF SMILES Flexibase

54670999

Analogs

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Popular Name: N-(2,3-dichlorophenyl)-2-[(3R)-4-ethyl-2-oxo-morpholin-3-yl]acetamide N-(2,3-dichlorophenyl)-2-[(3R)-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)	3.99	5.81	-11.55	1	5	0	59	331.199	4	↓ MOL2 SDF SMILES Flexibase

54672177

Analogs

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Popular Name: 2-[(3R)-2-oxomorpholin-3-yl]-N-phenyl-acetamide 2-[(3R)-2-oxomorpholin-3-yl]-N-p…

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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)	2.10	2.57	-8.75	2	5	0	67	234.255	3	↓ MOL2 SDF SMILES Flexibase

54672178

Analogs

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Popular Name: 2-[(3S)-2-oxomorpholin-3-yl]-N-phenyl-acetamide 2-[(3S)-2-oxomorpholin-3-yl]-N-p…

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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)	2.10	2.68	-10.52	2	5	0	67	234.255	3	↓ MOL2 SDF SMILES Flexibase

54672195

Analogs

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Popular Name: N-(2,4-dimethylphenyl)-2-[(3S)-4-ethyl-2-oxo-morpholin-3-yl]acetamide N-(2,4-dimethylphenyl)-2-[(3S)-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)	3.55	5.94	-17.38	1	5	0	59	290.363	4	↓ MOL2 SDF SMILES Flexibase

54672196

Analogs

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Popular Name: N-(2,4-dimethylphenyl)-2-[(3R)-4-ethyl-2-oxo-morpholin-3-yl]acetamide N-(2,4-dimethylphenyl)-2-[(3R)-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)	3.55	6.25	-14.21	1	5	0	59	290.363	4	↓ MOL2 SDF SMILES Flexibase

54672197

Analogs

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Popular Name: N-(2,4-dichlorophenyl)-2-[(3S)-4-ethyl-2-oxo-morpholin-3-yl]acetamide N-(2,4-dichlorophenyl)-2-[(3S)-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)	4.01	5.57	-13.58	1	5	0	59	331.199	4	↓ MOL2 SDF SMILES Flexibase

54672198

Analogs

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Popular Name: N-(2,4-dichlorophenyl)-2-[(3R)-4-ethyl-2-oxo-morpholin-3-yl]acetamide N-(2,4-dichlorophenyl)-2-[(3R)-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)	4.01	5.86	-10.91	1	5	0	59	331.199	4	↓ MOL2 SDF SMILES Flexibase

54672199

Analogs

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Popular Name: 2-[(3S)-4-ethyl-2-oxo-morpholin-3-yl]-N-(2-methyl-4-nitro-phenyl)acetamide 2-[(3S)-4-ethyl-2-oxo-morpholin-…

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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)	3.06	5.98	-20.07	1	8	0	104	321.333	5	↓ MOL2 SDF SMILES Flexibase

54672200

Analogs

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Popular Name: 2-[(3R)-4-ethyl-2-oxo-morpholin-3-yl]-N-(2-methyl-4-nitro-phenyl)acetamide 2-[(3R)-4-ethyl-2-oxo-morpholin-…

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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)	3.06	6.29	-16.59	1	8	0	104	321.333	5	↓ MOL2 SDF SMILES Flexibase

54672205

Analogs

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Popular Name: N-(o-tolyl)-2-[(3R)-2-oxomorpholin-3-yl]acetamide N-(o-tolyl)-2-[(3R)-2-oxomorphol…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.51	3.48	-8.71	2	5	0	67	248.282	3	↓ MOL2 SDF SMILES Flexibase

54672206

Analogs

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Popular Name: N-(o-tolyl)-2-[(3S)-2-oxomorpholin-3-yl]acetamide N-(o-tolyl)-2-[(3S)-2-oxomorphol…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.51	3.58	-10.54	2	5	0	67	248.282	3	↓ MOL2 SDF SMILES Flexibase

55562807

Analogs

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Popular Name: 2-[(3S)-4-ethyl-2-oxo-morpholin-3-yl]-N-phenyl-acetamide 2-[(3S)-4-ethyl-2-oxo-morpholin-…

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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)	2.73	4.66	-14.22	1	5	0	59	262.309	4	↓ MOL2 SDF SMILES Flexibase

55562808

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3R)-4-ethyl-2-oxo-morpholin-3-yl]-N-phenyl-acetamide 2-[(3R)-4-ethyl-2-oxo-morpholin-…

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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)	2.73	4.75	-14.09	1	5	0	59	262.309	4	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

ring.id = 137785
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 137785 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

Permalink

//zinc12.docking.org/results/combination?ring.id=137785&filter.purchasability=annotated

Embed Link to Results

<div id="zinc-link"></div>
<script type="text/javascript" src="//zinc12.docking.org/js/embed.js"></script>
<script type="text/javascript">
    window.zinc.embed('zinc-link', {
        "ring.id": "137785"        

    });
</script>

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