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ZINC Item

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36972797

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(3R)-1-methyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-4-carboxylic 1-[(3R)-1-methyl-5-oxo-pyrrolidi…

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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)	-0.46	4.73	-50.59	0	6	-1	81	253.278	2	↓ MOL2 SDF SMILES Flexibase

36972799

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(3S)-1-methyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-4-carboxylic 1-[(3S)-1-methyl-5-oxo-pyrrolidi…

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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)	-0.46	4.63	-53.13	0	6	-1	81	253.278	2	↓ MOL2 SDF SMILES Flexibase

36972809

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(3R)-1-isobutyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-4-carboxylic 1-[(3R)-1-isobutyl-5-oxo-pyrroli…

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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	7.05	-49.79	0	6	-1	81	295.359	4	↓ MOL2 SDF SMILES Flexibase

36972811

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(3S)-1-isobutyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-4-carboxylic 1-[(3S)-1-isobutyl-5-oxo-pyrroli…

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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	7.07	-52.74	0	6	-1	81	295.359	4	↓ MOL2 SDF SMILES Flexibase

36974806

Analogs

46190608
46190610
49477680
49477682
49783795

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-1-[(3R)-1-isopropyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-2-carboxylic (2R)-1-[(3R)-1-isopropyl-5-oxo-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)	-1.13	7.41	-62.48	0	6	-1	81	281.332	3	↓ MOL2 SDF SMILES Flexibase

36974808

Analogs

46190608
46190610
49477680
49477682
49783795

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-1-[(3S)-1-isopropyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-2-carboxylic (2R)-1-[(3S)-1-isopropyl-5-oxo-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)	-1.13	7.34	-71.18	0	6	-1	81	281.332	3	↓ MOL2 SDF SMILES Flexibase

36974810

Analogs

46190608
46190610
49477680
49477682
49783795

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-1-[(3R)-1-isopropyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-2-carboxylic (2S)-1-[(3R)-1-isopropyl-5-oxo-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)	-1.13	7.34	-62.88	0	6	-1	81	281.332	3	↓ MOL2 SDF SMILES Flexibase

36974812

Analogs

46190608
46190610
49477680
49477682
49783795

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-1-[(3S)-1-isopropyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-2-carboxylic (2S)-1-[(3S)-1-isopropyl-5-oxo-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)	-1.13	7.27	-68.99	0	6	-1	81	281.332	3	↓ MOL2 SDF SMILES Flexibase

52411349

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-1-ethyl-4-(piperidine-1-carbonyl)pyrrolidin-2-one (4R)-1-ethyl-4-(piperidine-1-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)	0.80	5.16	-10.51	0	4	0	41	224.304	2	↓ MOL2 SDF SMILES Flexibase

52411352

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-1-ethyl-4-(piperidine-1-carbonyl)pyrrolidin-2-one (4S)-1-ethyl-4-(piperidine-1-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)	0.80	5.17	-10.79	0	4	0	41	224.304	2	↓ MOL2 SDF SMILES Flexibase

52411387

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-1-isopropyl-4-(piperidine-1-carbonyl)pyrrolidin-2-one (4R)-1-isopropyl-4-(piperidine-1…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.10	5.74	-10.24	0	4	0	41	238.331	2	↓ MOL2 SDF SMILES Flexibase

52411389

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-1-isopropyl-4-(piperidine-1-carbonyl)pyrrolidin-2-one (4S)-1-isopropyl-4-(piperidine-1…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.10	5.73	-13.61	0	4	0	41	238.331	2	↓ MOL2 SDF SMILES Flexibase

52411421

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-1-isobutyl-4-(piperidine-1-carbonyl)pyrrolidin-2-one (4R)-1-isobutyl-4-(piperidine-1-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.55	6.48	-10.12	0	4	0	41	252.358	3	↓ MOL2 SDF SMILES Flexibase

52411423

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-1-isobutyl-4-(piperidine-1-carbonyl)pyrrolidin-2-one (4S)-1-isobutyl-4-(piperidine-1-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.55	6.5	-10.41	0	4	0	41	252.358	3	↓ MOL2 SDF SMILES Flexibase

16576622

Analogs

16576625
16576628
16527274
16527275

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-1-butyl-4-[(3S,5R)-3,5-dimethylpiperidine-1-carbonyl]pyrrolidin-2-one (4S)-1-butyl-4-[(3S,5R)-3,5-dime…

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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)	2.58	7.88	-10.13	0	4	0	41	280.412	4	↓ MOL2 SDF SMILES Flexibase

16576625

Analogs

16576628
16527274
16527275

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-1-butyl-4-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]pyrrolidin-2-one (4S)-1-butyl-4-[(3R,5R)-3,5-dime…

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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)	2.58	8.1	-9.92	0	4	0	41	280.412	4	↓ MOL2 SDF SMILES Flexibase

16576628

Analogs

8270114
8270121

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-1-butyl-4-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]pyrrolidin-2-one (4R)-1-butyl-4-[(3R,5R)-3,5-dime…

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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)	2.58	8.13	-10.41	0	4	0	41	280.412	4	↓ MOL2 SDF SMILES Flexibase

62842241

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-methyl-1-[(3R)-1-methyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-4-carboxylic 4-methyl-1-[(3R)-1-methyl-5-oxo-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-0.22	4.94	-50.98	0	6	-1	81	267.305	2	↓ MOL2 SDF SMILES Flexibase

62842242

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-methyl-1-[(3S)-1-methyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-4-carboxylic 4-methyl-1-[(3S)-1-methyl-5-oxo-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-0.22	4.94	-54.07	0	6	-1	81	267.305	2	↓ MOL2 SDF SMILES Flexibase

62842522

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(3R)-1-isopropyl-5-oxo-pyrrolidine-3-carbonyl]-4-methyl-piperidine-4-carboxylic 1-[(3R)-1-isopropyl-5-oxo-pyrrol…

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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)	0.45	6.54	-50.69	0	6	-1	81	295.359	3	↓ MOL2 SDF SMILES Flexibase

62842523

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(3S)-1-isopropyl-5-oxo-pyrrolidine-3-carbonyl]-4-methyl-piperidine-4-carboxylic 1-[(3S)-1-isopropyl-5-oxo-pyrrol…

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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)	0.45	6.49	-53.5	0	6	-1	81	295.359	3	↓ MOL2 SDF SMILES Flexibase

62842530

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(3R)-1-ethyl-5-oxo-pyrrolidine-3-carbonyl]-4-methyl-piperidine-4-carboxylic 1-[(3R)-1-ethyl-5-oxo-pyrrolidin…

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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)	0.16	5.96	-50.97	0	6	-1	81	281.332	3	↓ MOL2 SDF SMILES Flexibase

62842531

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(3S)-1-ethyl-5-oxo-pyrrolidine-3-carbonyl]-4-methyl-piperidine-4-carboxylic 1-[(3S)-1-ethyl-5-oxo-pyrrolidin…

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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)	0.16	5.92	-51.01	0	6	-1	81	281.332	3	↓ MOL2 SDF SMILES Flexibase

62844726

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-ethyl-1-[(3R)-1-methyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-4-carboxylic 4-ethyl-1-[(3R)-1-methyl-5-oxo-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)	0.11	5.44	-52.87	0	6	-1	81	281.332	3	↓ MOL2 SDF SMILES Flexibase

62844727

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-ethyl-1-[(3S)-1-methyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-4-carboxylic 4-ethyl-1-[(3S)-1-methyl-5-oxo-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)	0.11	5.42	-53.07	0	6	-1	81	281.332	3	↓ MOL2 SDF SMILES Flexibase

62844807

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-ethyl-1-[(3R)-1-ethyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-4-carboxylic 4-ethyl-1-[(3R)-1-ethyl-5-oxo-py…

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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)	0.49	6.45	-52.79	0	6	-1	81	295.359	4	↓ MOL2 SDF SMILES Flexibase

62844808

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-ethyl-1-[(3S)-1-ethyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-4-carboxylic 4-ethyl-1-[(3S)-1-ethyl-5-oxo-py…

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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)	0.49	6.44	-50.46	0	6	-1	81	295.359	4	↓ MOL2 SDF SMILES Flexibase

62845101

Analogs

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Popular Name: 1-[(3R)-1-methyl-5-oxo-pyrrolidine-3-carbonyl]-4-propyl-piperidine-4-carboxylic 1-[(3R)-1-methyl-5-oxo-pyrrolidi…

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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)	0.67	6.16	-50.17	0	6	-1	81	295.359	4	↓ MOL2 SDF SMILES Flexibase

62845102

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(3S)-1-methyl-5-oxo-pyrrolidine-3-carbonyl]-4-propyl-piperidine-4-carboxylic 1-[(3S)-1-methyl-5-oxo-pyrrolidi…

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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)	0.67	6.18	-53.37	0	6	-1	81	295.359	4	↓ MOL2 SDF SMILES Flexibase

62868566

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-methyl-1-[(3R)-1-methyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-3-carboxylic (3S)-3-methyl-1-[(3R)-1-methyl-5…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-0.22	5.4	-54.86	0	6	-1	81	267.305	2	↓ MOL2 SDF SMILES Flexibase

62868567

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-methyl-1-[(3R)-1-methyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-3-carboxylic (3R)-3-methyl-1-[(3R)-1-methyl-5…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-0.22	5.37	-55.03	0	6	-1	81	267.305	2	↓ MOL2 SDF SMILES Flexibase

62868568

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-methyl-1-[(3S)-1-methyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-3-carboxylic (3S)-3-methyl-1-[(3S)-1-methyl-5…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-0.22	5.37	-61.22	0	6	-1	81	267.305	2	↓ MOL2 SDF SMILES Flexibase

62868569

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-methyl-1-[(3S)-1-methyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-3-carboxylic (3R)-3-methyl-1-[(3S)-1-methyl-5…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-0.22	5.31	-61.02	0	6	-1	81	267.305	2	↓ MOL2 SDF SMILES Flexibase

62869178

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Popular Name: (3R)-1-[(3R)-1-isopropyl-5-oxo-pyrrolidine-3-carbonyl]-3-methyl-piperidine-3-carboxylic (3R)-1-[(3R)-1-isopropyl-5-oxo-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)	0.45	7	-54.62	0	6	-1	81	295.359	3	↓ MOL2 SDF SMILES Flexibase

62869179

Analogs

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Popular Name: (3R)-1-[(3S)-1-isopropyl-5-oxo-pyrrolidine-3-carbonyl]-3-methyl-piperidine-3-carboxylic (3R)-1-[(3S)-1-isopropyl-5-oxo-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)	0.45	6.95	-61.15	0	6	-1	81	295.359	3	↓ MOL2 SDF SMILES Flexibase

62869180

Analogs

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Popular Name: (3S)-1-[(3R)-1-isopropyl-5-oxo-pyrrolidine-3-carbonyl]-3-methyl-piperidine-3-carboxylic (3S)-1-[(3R)-1-isopropyl-5-oxo-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)	0.45	6.96	-54.61	0	6	-1	81	295.359	3	↓ MOL2 SDF SMILES Flexibase

62869181

Analogs

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Popular Name: (3S)-1-[(3S)-1-isopropyl-5-oxo-pyrrolidine-3-carbonyl]-3-methyl-piperidine-3-carboxylic (3S)-1-[(3S)-1-isopropyl-5-oxo-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)	0.45	6.94	-61.39	0	6	-1	81	295.359	3	↓ MOL2 SDF SMILES Flexibase

62869192

Analogs

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Popular Name: (3R)-1-[(3R)-1-ethyl-5-oxo-pyrrolidine-3-carbonyl]-3-methyl-piperidine-3-carboxylic (3R)-1-[(3R)-1-ethyl-5-oxo-pyrro…

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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)	0.16	6.42	-54.81	0	6	-1	81	281.332	3	↓ MOL2 SDF SMILES Flexibase

62869193

Analogs

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Popular Name: (3R)-1-[(3S)-1-ethyl-5-oxo-pyrrolidine-3-carbonyl]-3-methyl-piperidine-3-carboxylic (3R)-1-[(3S)-1-ethyl-5-oxo-pyrro…

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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)	0.16	6.44	-55.28	0	6	-1	81	281.332	3	↓ MOL2 SDF SMILES Flexibase

62869194

Analogs

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Popular Name: (3S)-1-[(3R)-1-ethyl-5-oxo-pyrrolidine-3-carbonyl]-3-methyl-piperidine-3-carboxylic (3S)-1-[(3R)-1-ethyl-5-oxo-pyrro…

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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)	0.16	6.37	-54.72	0	6	-1	81	281.332	3	↓ MOL2 SDF SMILES Flexibase

62869195

Analogs

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Popular Name: (3S)-1-[(3S)-1-ethyl-5-oxo-pyrrolidine-3-carbonyl]-3-methyl-piperidine-3-carboxylic (3S)-1-[(3S)-1-ethyl-5-oxo-pyrro…

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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)	0.16	6.4	-55.36	0	6	-1	81	281.332	3	↓ MOL2 SDF SMILES Flexibase

62869841

Analogs

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Popular Name: (3S)-3-ethyl-1-[(3R)-1-methyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-3-carboxylic (3S)-3-ethyl-1-[(3R)-1-methyl-5-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.11	5.9	-54.02	0	6	-1	81	281.332	3	↓ MOL2 SDF SMILES Flexibase

62869842

Analogs

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Popular Name: (3R)-3-ethyl-1-[(3R)-1-methyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-3-carboxylic (3R)-3-ethyl-1-[(3R)-1-methyl-5-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.11	5.83	-54.22	0	6	-1	81	281.332	3	↓ MOL2 SDF SMILES Flexibase

62869843

Analogs

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Popular Name: (3S)-3-ethyl-1-[(3S)-1-methyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-3-carboxylic (3S)-3-ethyl-1-[(3S)-1-methyl-5-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.11	5.88	-60.71	0	6	-1	81	281.332	3	↓ MOL2 SDF SMILES Flexibase

62869844

Analogs

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Popular Name: (3R)-3-ethyl-1-[(3S)-1-methyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-3-carboxylic (3R)-3-ethyl-1-[(3S)-1-methyl-5-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.11	5.77	-59.91	0	6	-1	81	281.332	3	↓ MOL2 SDF SMILES Flexibase

62870003

Analogs

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Popular Name: (3S)-3-ethyl-1-[(3R)-1-ethyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-3-carboxylic (3S)-3-ethyl-1-[(3R)-1-ethyl-5-o…

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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)	0.49	6.91	-53.76	0	6	-1	81	295.359	4	↓ MOL2 SDF SMILES Flexibase

62870004

Analogs

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Popular Name: (3R)-3-ethyl-1-[(3R)-1-ethyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-3-carboxylic (3R)-3-ethyl-1-[(3R)-1-ethyl-5-o…

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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)	0.49	6.84	-54.01	0	6	-1	81	295.359	4	↓ MOL2 SDF SMILES Flexibase

62870005

Analogs

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Popular Name: (3S)-3-ethyl-1-[(3S)-1-ethyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-3-carboxylic (3S)-3-ethyl-1-[(3S)-1-ethyl-5-o…

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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)	0.49	6.91	-54.35	0	6	-1	81	295.359	4	↓ MOL2 SDF SMILES Flexibase

62870006

Analogs

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Popular Name: (3R)-3-ethyl-1-[(3S)-1-ethyl-5-oxo-pyrrolidine-3-carbonyl]piperidine-3-carboxylic (3R)-3-ethyl-1-[(3S)-1-ethyl-5-o…

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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)	0.49	6.84	-54.16	0	6	-1	81	295.359	4	↓ MOL2 SDF SMILES Flexibase

62870783

Analogs

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Popular Name: (3S)-1-[(3R)-1-methyl-5-oxo-pyrrolidine-3-carbonyl]-3-propyl-piperidine-3-carboxylic (3S)-1-[(3R)-1-methyl-5-oxo-pyrr…

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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)	0.67	6.65	-54.51	0	6	-1	81	295.359	4	↓ MOL2 SDF SMILES Flexibase

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Structural Results Found: (before additional filtering)

SQL Query Was

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