ZINC 12

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ZINC Item

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19432408

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[2-[(1S)-1-cyclopent-2-enyl]acetyl]amino]benzoic 3-[[2-[(1S)-1-cyclopent-2-enyl]a…

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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)	2.57	6.32	-69.84	1	4	-1	69	244.27	4	↓ MOL2 SDF SMILES Flexibase

19432410

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[2-[(1R)-1-cyclopent-2-enyl]acetyl]amino]benzoic 3-[[2-[(1R)-1-cyclopent-2-enyl]a…

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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)	2.57	6.33	-68.59	1	4	-1	69	244.27	4	↓ MOL2 SDF SMILES Flexibase

20005611

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(1S)-1-cyclopent-2-enyl]-N-[5-(dimethylsulfamoyl)-2-methoxy-phenyl]acetamide 2-[(1S)-1-cyclopent-2-enyl]-N-[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)	1.98	4.23	-17.69	1	6	0	76	338.429	6	↓ MOL2 SDF SMILES Flexibase

20005614

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(1R)-1-cyclopent-2-enyl]-N-[5-(dimethylsulfamoyl)-2-methoxy-phenyl]acetamide 2-[(1R)-1-cyclopent-2-enyl]-N-[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)	1.98	4.23	-17.72	1	6	0	76	338.429	6	↓ MOL2 SDF SMILES Flexibase

20005772

Analogs

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Popular Name: diethyl diethyl

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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)	3.70	9.85	-15.08	1	6	0	82	345.395	9	↓ MOL2 SDF SMILES Flexibase

20005775

Analogs

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Popular Name: diethyl diethyl

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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)	3.70	9.87	-14.93	1	6	0	82	345.395	9	↓ MOL2 SDF SMILES Flexibase

13013002

Analogs

13013003
13013004
13013005

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(1S)-1-cyclopent-2-enyl]-N-[4-[[(1R)-2-methoxy-1-methyl-ethyl]sulfamoyl]phenyl]acetamide 2-[(1S)-1-cyclopent-2-enyl]-N-[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)	2.06	3.51	-13.21	2	6	0	85	352.456	8	↓ MOL2 SDF SMILES Flexibase

13013003

Analogs

13013004
13013005
13013002

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(1S)-1-cyclopent-2-enyl]-N-[4-[[(1S)-2-methoxy-1-methyl-ethyl]sulfamoyl]phenyl]acetamide 2-[(1S)-1-cyclopent-2-enyl]-N-[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)	2.06	3.59	-15.95	2	6	0	85	352.456	8	↓ MOL2 SDF SMILES Flexibase

13013004

Analogs

13013005
13013002
13013003

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(1R)-1-cyclopent-2-enyl]-N-[4-[[(1R)-2-methoxy-1-methyl-ethyl]sulfamoyl]phenyl]acetamide 2-[(1R)-1-cyclopent-2-enyl]-N-[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)	2.06	3.52	-14.63	2	6	0	85	352.456	8	↓ MOL2 SDF SMILES Flexibase

13013005

Analogs

13013002
13013003

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(1R)-1-cyclopent-2-enyl]-N-[4-[[(1S)-2-methoxy-1-methyl-ethyl]sulfamoyl]phenyl]acetamide 2-[(1R)-1-cyclopent-2-enyl]-N-[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)	2.06	3.59	-14.73	2	6	0	85	352.456	8	↓ MOL2 SDF SMILES Flexibase

22753693

Analogs

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Popular Name: 2-[(1S)-1-cyclopent-2-enyl]-N-[3-(difluoromethoxy)-4-methoxy-phenyl]acetamide 2-[(1S)-1-cyclopent-2-enyl]-N-[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)	2.88	6.2	-12.89	1	4	0	48	297.301	6	↓ MOL2 SDF SMILES Flexibase

22753697

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(1R)-1-cyclopent-2-enyl]-N-[3-(difluoromethoxy)-4-methoxy-phenyl]acetamide 2-[(1R)-1-cyclopent-2-enyl]-N-[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)	2.88	6.2	-12.91	1	4	0	48	297.301	6	↓ MOL2 SDF SMILES Flexibase

23917529

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(1S)-1-cyclopent-2-enyl]-N-(4-methyl-3-sulfamoyl-phenyl)acetamide 2-[(1S)-1-cyclopent-2-enyl]-N-(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)	1.75	2.46	-16.87	3	5	0	89	294.376	4	↓ MOL2 SDF SMILES Flexibase

23917531

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(1R)-1-cyclopent-2-enyl]-N-(4-methyl-3-sulfamoyl-phenyl)acetamide 2-[(1R)-1-cyclopent-2-enyl]-N-(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)	1.75	2.44	-22.63	3	5	0	89	294.376	4	↓ MOL2 SDF SMILES Flexibase

58313397

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[3-chloro-2-(2-methoxyethoxy)phenyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide N-[3-chloro-2-(2-methoxyethoxy)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)	3.21	7.02	-8.61	1	4	0	48	309.793	7	↓ MOL2 SDF SMILES Flexibase

58313400

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[3-chloro-2-(2-methoxyethoxy)phenyl]-2-[(1R)-cyclopent-2-en-1-yl]acetamide N-[3-chloro-2-(2-methoxyethoxy)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)	3.21	7.02	-8.62	1	4	0	48	309.793	7	↓ MOL2 SDF SMILES Flexibase

14016035

Analogs

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Popular Name: dimethyl dimethyl

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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)	2.95	8.03	-13.71	1	6	0	82	317.341	7	↓ MOL2 SDF SMILES Flexibase

14016038

Analogs

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Popular Name: dimethyl dimethyl

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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)	2.95	8.04	-13.64	1	6	0	82	317.341	7	↓ MOL2 SDF SMILES Flexibase

62823568

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[(1S)-cyclopent-2-en-1-yl]acetyl]amino]-5-nitro-benzoic 2-[[2-[(1S)-cyclopent-2-en-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)	2.66	8.3	-40.11	1	7	-1	115	289.267	5	↓ MOL2 SDF SMILES Flexibase

62823569

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[(1R)-cyclopent-2-en-1-yl]acetyl]amino]-5-nitro-benzoic 2-[[2-[(1R)-cyclopent-2-en-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)	2.66	8.32	-40.45	1	7	-1	115	289.267	5	↓ MOL2 SDF SMILES Flexibase

62823797

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[(1S)-cyclopent-2-en-1-yl]acetyl]amino]-4-nitro-benzoic 2-[[2-[(1S)-cyclopent-2-en-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)	2.66	8.34	-38.67	1	7	-1	115	289.267	5	↓ MOL2 SDF SMILES Flexibase

62823798

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[(1R)-cyclopent-2-en-1-yl]acetyl]amino]-4-nitro-benzoic 2-[[2-[(1R)-cyclopent-2-en-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)	2.66	8.4	-38.42	1	7	-1	115	289.267	5	↓ MOL2 SDF SMILES Flexibase

62824012

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[(1S)-cyclopent-2-en-1-yl]acetyl]amino]-5-iodo-benzoic 2-[[2-[(1S)-cyclopent-2-en-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)	3.78	8.7	-42.03	1	4	-1	69	370.166	4	↓ MOL2 SDF SMILES Flexibase

62824013

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-[(1R)-cyclopent-2-en-1-yl]acetyl]amino]-5-iodo-benzoic 2-[[2-[(1R)-cyclopent-2-en-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)	3.78	8.73	-42.32	1	4	-1	69	370.166	4	↓ MOL2 SDF SMILES Flexibase

62825058

Analogs

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Popular Name: 3,5-dibromo-2-[[2-[(1S)-cyclopent-2-en-1-yl]acetyl]amino]benzoic 3,5-dibromo-2-[[2-[(1S)-cyclopen…

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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)	4.24	8.87	-41.22	1	4	-1	69	402.062	4	↓ MOL2 SDF SMILES Flexibase

62825059

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,5-dibromo-2-[[2-[(1R)-cyclopent-2-en-1-yl]acetyl]amino]benzoic 3,5-dibromo-2-[[2-[(1R)-cyclopen…

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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)	4.24	8.94	-41.34	1	4	-1	69	402.062	4	↓ MOL2 SDF SMILES Flexibase

62826353

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-bromo-2-[[2-[(1S)-cyclopent-2-en-1-yl]acetyl]amino]benzoic 3-bromo-2-[[2-[(1S)-cyclopent-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)	3.48	8.48	-48.79	1	4	-1	69	323.166	4	↓ MOL2 SDF SMILES Flexibase

62826354

Analogs

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Popular Name: 3-bromo-2-[[2-[(1R)-cyclopent-2-en-1-yl]acetyl]amino]benzoic 3-bromo-2-[[2-[(1R)-cyclopent-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)	3.48	8.33	-45.47	1	4	-1	69	323.166	4	↓ MOL2 SDF SMILES Flexibase

62839175

Analogs

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Popular Name: N-[3-(2-aminoethoxy)phenyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide N-[3-(2-aminoethoxy)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)	1.52	4.42	-49.56	4	4	1	66	261.345	6	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	1.52	3.98	-9.64	3	4	0	64	260.337	6	↓ MOL2 SDF SMILES Flexibase

62839176

Analogs

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Popular Name: N-[3-(2-aminoethoxy)phenyl]-2-[(1R)-cyclopent-2-en-1-yl]acetamide N-[3-(2-aminoethoxy)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)	1.52	4.43	-44.92	4	4	1	66	261.345	6	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	1.52	3.99	-12.89	3	4	0	64	260.337	6	↓ MOL2 SDF SMILES Flexibase

66444637

Analogs

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Popular Name: 2-[(1S)-cyclopent-2-en-1-yl]-N-[3-(difluoromethylsulfonyl)phenyl]acetamide 2-[(1S)-cyclopent-2-en-1-yl]-N-[…

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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)	2.08	4.64	-12.65	1	4	0	63	315.341	5	↓ MOL2 SDF SMILES Flexibase

66444639

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(1R)-cyclopent-2-en-1-yl]-N-[3-(difluoromethylsulfonyl)phenyl]acetamide 2-[(1R)-cyclopent-2-en-1-yl]-N-[…

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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)	2.08	4.65	-12.88	1	4	0	63	315.341	5	↓ MOL2 SDF SMILES Flexibase

63008888

Analogs

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Popular Name: 4-[[2-[(1S)-cyclopent-2-en-1-yl]acetyl]amino]-3-fluoro-benzoic 4-[[2-[(1S)-cyclopent-2-en-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)	2.68	7.4	-49.17	1	4	-1	69	262.26	4	↓ MOL2 SDF SMILES Flexibase

63008889

Analogs

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Popular Name: 4-[[2-[(1R)-cyclopent-2-en-1-yl]acetyl]amino]-3-fluoro-benzoic 4-[[2-[(1R)-cyclopent-2-en-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)	2.68	7.39	-49.11	1	4	-1	69	262.26	4	↓ MOL2 SDF SMILES Flexibase

69516745

Analogs

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Popular Name: N-[4-(allylsulfamoylmethyl)phenyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide N-[4-(allylsulfamoylmethyl)pheny…

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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)	2.45	4.99	-18.39	2	5	0	75	334.441	8	↓ MOL2 SDF SMILES Flexibase

69516747

Analogs

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Popular Name: N-[4-(allylsulfamoylmethyl)phenyl]-2-[(1R)-cyclopent-2-en-1-yl]acetamide N-[4-(allylsulfamoylmethyl)pheny…

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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)	2.45	5	-16.85	2	5	0	75	334.441	8	↓ MOL2 SDF SMILES Flexibase

55476274

Analogs

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Popular Name: 2-chloro-4-[[2-[(1S)-cyclopent-2-en-1-yl]acetyl]amino]-N-(2-methoxyethyl)benzamide 2-chloro-4-[[2-[(1S)-cyclopent-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)	2.46	5.44	-17.58	2	5	0	67	336.819	7	↓ MOL2 SDF SMILES Flexibase

55476280

Analogs

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Popular Name: 2-chloro-4-[[2-[(1R)-cyclopent-2-en-1-yl]acetyl]amino]-N-(2-methoxyethyl)benzamide 2-chloro-4-[[2-[(1R)-cyclopent-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)	2.46	5.45	-17.45	2	5	0	67	336.819	7	↓ MOL2 SDF SMILES Flexibase

55553779

Analogs

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Popular Name: 2-[(1S)-cyclopent-2-en-1-yl]-N-[4-(2-diethylaminoethyloxy)phenyl]acetamide 2-[(1S)-cyclopent-2-en-1-yl]-N-[…

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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)	3.52	9.74	-36.99	2	4	1	43	317.453	9	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	3.52	7.25	-9.22	1	4	0	42	316.445	9	↓ MOL2 SDF SMILES Flexibase

55553780

Analogs

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Popular Name: 2-[(1R)-cyclopent-2-en-1-yl]-N-[4-(2-diethylaminoethyloxy)phenyl]acetamide 2-[(1R)-cyclopent-2-en-1-yl]-N-[…

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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)	3.52	9.72	-37.59	2	4	1	43	317.453	9	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	3.52	7.26	-9.11	1	4	0	42	316.445	9	↓ MOL2 SDF SMILES Flexibase

69742418

Analogs

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Popular Name: N-(2-acetamido-4,5-difluoro-phenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide N-(2-acetamido-4,5-difluoro-phen…

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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)	2.08	6.06	-15.99	2	4	0	58	294.301	4	↓ MOL2 SDF SMILES Flexibase

69742421

Analogs

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Popular Name: N-(2-acetamido-4,5-difluoro-phenyl)-2-[(1R)-cyclopent-2-en-1-yl]acetamide N-(2-acetamido-4,5-difluoro-phen…

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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)	2.08	6.06	-15.67	2	4	0	58	294.301	4	↓ MOL2 SDF SMILES Flexibase

65576738

Analogs

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Popular Name: 2-[(1R)-cyclopent-2-en-1-yl]-N-(2,3,4-trifluorophenyl)acetamide 2-[(1R)-cyclopent-2-en-1-yl]-N-(…

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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)	3.03	6.95	-6.73	1	2	0	29	255.239	3	↓ MOL2 SDF SMILES Flexibase

69808660

Analogs

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Popular Name: 2-[2-[[2-[(1S)-cyclopent-2-en-1-yl]acetyl]amino]anilino]-N-(ethylcarbamoyl)acetamide 2-[2-[[2-[(1S)-cyclopent-2-en-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)	2.12	5.32	-22.01	4	7	0	99	344.415	7	↓ MOL2 SDF SMILES Flexibase

69808662

Analogs

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Popular Name: 2-[2-[[2-[(1R)-cyclopent-2-en-1-yl]acetyl]amino]anilino]-N-(ethylcarbamoyl)acetamide 2-[2-[[2-[(1R)-cyclopent-2-en-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)	2.12	5.32	-22.18	4	7	0	99	344.415	7	↓ MOL2 SDF SMILES Flexibase

40769662

Analogs

40769664

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Popular Name: N-(4-amino-3-methoxy-phenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide N-(4-amino-3-methoxy-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)	2.15	4.01	-9.42	3	4	0	64	246.31	4	↓ MOL2 SDF SMILES Flexibase

40769664

Analogs

40769662

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-amino-3-methoxy-phenyl)-2-[(1R)-cyclopent-2-en-1-yl]acetamide N-(4-amino-3-methoxy-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)	2.15	4.02	-9.41	3	4	0	64	246.31	4	↓ MOL2 SDF SMILES Flexibase

48783078

Analogs

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Popular Name: N-(3-acetamido-4-methyl-phenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide N-(3-acetamido-4-methyl-phenyl)-…

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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)	2.27	6.51	-12.67	2	4	0	58	272.348	4	↓ MOL2 SDF SMILES Flexibase

48783080

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-acetamido-4-methyl-phenyl)-2-[(1R)-cyclopent-2-en-1-yl]acetamide N-(3-acetamido-4-methyl-phenyl)-…

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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)	2.27	6.51	-12.59	2	4	0	58	272.348	4	↓ MOL2 SDF SMILES Flexibase

48794636

Analogs

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Popular Name: 5-chloro-2-[[2-[(1S)-cyclopent-2-en-1-yl]acetyl]amino]-N-methyl-benzamide 5-chloro-2-[[2-[(1S)-cyclopent-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)	2.48	5.98	-8.58	2	4	0	58	292.766	4	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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Structural Results Found: (before additional filtering)

SQL Query Was

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