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ZINC Item

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10969051

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[1-(4-methylsulfonylphenyl)ethyl]-3-(2-oxopyrrolidin-1-yl)-benzamide N-[1-(4-methylsulfonylphenyl)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)	1.30	-3.66	-28.56	1	6	0	84	386.473	5	↓ MOL2 SDF SMILES Flexibase

10969055

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[1-(4-methylsulfonylphenyl)ethyl]-3-(2-oxopyrrolidin-1-yl)-benzamide N-[1-(4-methylsulfonylphenyl)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)	1.30	-3.66	-28.75	1	6	0	84	386.473	5	↓ MOL2 SDF SMILES Flexibase

36140863

Analogs

6695420

Draw Identity 99% 90% 80% 70%

Popular Name: N-benzyl-N-methyl-3-(2-oxopyrrolidin-1-yl)benzamide N-benzyl-N-methyl-3-(2-oxopyrrol…

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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)	1.64	9.46	-23.06	0	4	0	41	308.381	4	↓ MOL2 SDF SMILES Flexibase

13256868

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-(4-chlorophenyl)-3-[[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]propanoic (3R)-3-(4-chlorophenyl)-3-[[3-(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)	1.34	8.61	-70.29	1	6	-1	90	385.827	6	↓ MOL2 SDF SMILES Flexibase

13256869

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-(4-chlorophenyl)-3-[[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]propanoic (3S)-3-(4-chlorophenyl)-3-[[3-(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)	1.34	8.63	-70.06	1	6	-1	90	385.827	6	↓ MOL2 SDF SMILES Flexibase

13256874

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-(4-chlorophenyl)propanoic (3R)-3-[[4-chloro-3-(2-oxopyrrol…

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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)	1.97	10.46	-56.69	1	6	-1	90	420.272	6	↓ MOL2 SDF SMILES Flexibase

13256875

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-(4-chlorophenyl)propanoic (3S)-3-[[4-chloro-3-(2-oxopyrrol…

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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)	1.97	10.35	-54.14	1	6	-1	90	420.272	6	↓ MOL2 SDF SMILES Flexibase

13257222

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-(3,4-dimethoxyphenyl)-3-[[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]propanoic (3R)-3-(3,4-dimethoxyphenyl)-3-[…

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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	8.12	-70.51	1	8	-1	108	411.434	8	↓ MOL2 SDF SMILES Flexibase

13257223

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-(3,4-dimethoxyphenyl)-3-[[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]propanoic (3S)-3-(3,4-dimethoxyphenyl)-3-[…

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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	8.13	-70.33	1	8	-1	108	411.434	8	↓ MOL2 SDF SMILES Flexibase

13257228

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-(3,4-dimethoxyphenyl)propanoic (3R)-3-[[4-chloro-3-(2-oxopyrrol…

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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)	0.94	9.14	-61.27	1	8	-1	108	445.879	8	↓ MOL2 SDF SMILES Flexibase

13257229

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-(3,4-dimethoxyphenyl)propanoic (3S)-3-[[4-chloro-3-(2-oxopyrrol…

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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)	0.94	9.06	-58.64	1	8	-1	108	445.879	8	↓ MOL2 SDF SMILES Flexibase

13257807

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-(4-fluorophenyl)-3-[[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]propanoic (3R)-3-(4-fluorophenyl)-3-[[3-(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)	0.83	8.15	-70.35	1	6	-1	90	369.372	6	↓ MOL2 SDF SMILES Flexibase

13257808

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-(4-fluorophenyl)-3-[[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]propanoic (3S)-3-(4-fluorophenyl)-3-[[3-(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)	0.83	8.18	-70.07	1	6	-1	90	369.372	6	↓ MOL2 SDF SMILES Flexibase

13257813

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-(4-fluorophenyl)propanoic (3R)-3-[[4-chloro-3-(2-oxopyrrol…

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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)	1.46	10.01	-56.78	1	6	-1	90	403.817	6	↓ MOL2 SDF SMILES Flexibase

13257814

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-(4-fluorophenyl)propanoic (3S)-3-[[4-chloro-3-(2-oxopyrrol…

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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)	1.46	9.9	-54.33	1	6	-1	90	403.817	6	↓ MOL2 SDF SMILES Flexibase

13258203

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-[[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-(p-tolyl)propanoic (3R)-3-[[3-(2-oxopyrrolidin-1-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)	1.11	8.77	-74.44	1	6	-1	90	365.409	6	↓ MOL2 SDF SMILES Flexibase

13258204

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-[[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-(p-tolyl)propanoic (3S)-3-[[3-(2-oxopyrrolidin-1-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)	1.11	9.61	-69.04	1	6	-1	90	365.409	6	↓ MOL2 SDF SMILES Flexibase

13258209

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-(p-tolyl)propanoic (3R)-3-[[4-chloro-3-(2-oxopyrrol…

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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)	1.74	10.62	-59.65	1	6	-1	90	399.854	6	↓ MOL2 SDF SMILES Flexibase

13258210

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-(p-tolyl)propanoic (3S)-3-[[4-chloro-3-(2-oxopyrrol…

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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)	1.74	10.54	-56.95	1	6	-1	90	399.854	6	↓ MOL2 SDF SMILES Flexibase

13259147

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-(2-chlorophenyl)-3-[[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]propanoic (3R)-3-(2-chlorophenyl)-3-[[3-(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)	1.30	9.09	-64.51	1	6	-1	90	385.827	6	↓ MOL2 SDF SMILES Flexibase

13259148

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-(2-chlorophenyl)-3-[[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]propanoic (3S)-3-(2-chlorophenyl)-3-[[3-(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)	1.30	9.46	-70.01	1	6	-1	90	385.827	6	↓ MOL2 SDF SMILES Flexibase

13259153

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-(2-chlorophenyl)propanoic (3R)-3-[[4-chloro-3-(2-oxopyrrol…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.93	10.05	-55.84	1	6	-1	90	420.272	6	↓ MOL2 SDF SMILES Flexibase

13259154

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-(2-chlorophenyl)propanoic (3S)-3-[[4-chloro-3-(2-oxopyrrol…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.93	10.51	-58.38	1	6	-1	90	420.272	6	↓ MOL2 SDF SMILES Flexibase

13261576

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]methyl]benzoic 4-[[[4-chloro-3-(2-oxopyrrolidin…

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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)	2.41	8.4	-58.96	1	6	-1	90	371.8	5	↓ MOL2 SDF SMILES Flexibase

13427361

Analogs

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Popular Name: (3R)-3-(4-methoxyphenyl)-3-[[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]propanoic (3R)-3-(4-methoxyphenyl)-3-[[3-(…

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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	7.4	-74.54	1	7	-1	99	381.408	7	↓ MOL2 SDF SMILES Flexibase

13427363

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-(4-methoxyphenyl)-3-[[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]propanoic (3S)-3-(4-methoxyphenyl)-3-[[3-(…

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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	8.23	-68.8	1	7	-1	99	381.408	7	↓ MOL2 SDF SMILES Flexibase

13427372

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-(4-methoxyphenyl)propanoic (3R)-3-[[4-chloro-3-(2-oxopyrrol…

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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)	1.35	9.24	-59.63	1	7	-1	99	415.853	7	↓ MOL2 SDF SMILES Flexibase

13427374

Analogs

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Popular Name: (3S)-3-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-(4-methoxyphenyl)propanoic (3S)-3-[[4-chloro-3-(2-oxopyrrol…

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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)	1.35	9.13	-56.99	1	7	-1	99	415.853	7	↓ MOL2 SDF SMILES Flexibase

13427904

Analogs

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Popular Name: (3R)-3-[[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-phenyl-propanoic (3R)-3-[[3-(2-oxopyrrolidin-1-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)	0.67	8.92	-69.03	1	6	-1	90	351.382	6	↓ MOL2 SDF SMILES Flexibase

13427905

Analogs

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Popular Name: (3S)-3-[[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-phenyl-propanoic (3S)-3-[[3-(2-oxopyrrolidin-1-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)	0.67	8.11	-73.74	1	6	-1	90	351.382	6	↓ MOL2 SDF SMILES Flexibase

13427910

Analogs

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Popular Name: (3R)-3-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-phenyl-propanoic (3R)-3-[[4-chloro-3-(2-oxopyrrol…

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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)	1.30	9.94	-59.54	1	6	-1	90	385.827	6	↓ MOL2 SDF SMILES Flexibase

13427911

Analogs

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Popular Name: (3S)-3-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-phenyl-propanoic (3S)-3-[[4-chloro-3-(2-oxopyrrol…

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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)	1.30	9.85	-56.79	1	6	-1	90	385.827	6	↓ MOL2 SDF SMILES Flexibase

13429350

Analogs

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Popular Name: 3-[benzyl-[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]propanoic 3-[benzyl-[3-(2-oxopyrrolidin-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)	1.16	9.76	-54.76	0	6	-1	81	365.409	7	↓ MOL2 SDF SMILES Flexibase

13429356

Analogs

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Popular Name: 3-[benzyl-[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]propanoic 3-[benzyl-[4-chloro-3-(2-oxopyrr…

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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)	1.79	11.16	-54.62	0	6	-1	81	399.854	7	↓ MOL2 SDF SMILES Flexibase

14245960

Analogs

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Popular Name: 4-chloro-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-3-(2-oxopyrrolidin-1-yl)benzamide 4-chloro-N-[[4-(methylsulfamoylm…

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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)	1.63	5.65	-24.57	2	7	0	96	435.933	7	↓ MOL2 SDF SMILES Flexibase

14797805

Analogs

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Popular Name: N-[(2-methoxyphenyl)methyl]-3-(2-oxopyrrolidin-1-yl)benzamide N-[(2-methoxyphenyl)methyl]-3-(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)	1.88	7.09	-22.12	1	5	0	59	324.38	5	↓ MOL2 SDF SMILES Flexibase

62887896

Analogs

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Popular Name: N-allyl-N-[(3-nitrophenyl)methyl]-3-(2-oxopyrrolidin-1-yl)benzamide N-allyl-N-[(3-nitrophenyl)methyl…

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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)	2.22	11.62	-31.81	0	7	0	86	379.416	7	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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Structural Results Found: (before additional filtering)

SQL Query Was

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