ZINC 12

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	1.8	-12.51	1	5	0	83	330.207	3	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	2.15	2.19	-36.88	0	5	-1	85	329.199	3	↓ MOL2 SDF SMILES Flexibase

44243215

Analogs

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Popular Name: 1-[(5-bromo-3-pyridyl)sulfonylamino]cyclopentanecarbothioamide 1-[(5-bromo-3-pyridyl)sulfonylam…

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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)	1.28	0.58	-11.66	3	5	0	85	364.29	4	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	1.28	0.9	-37.39	2	5	-1	87	363.282	4	↓ MOL2 SDF SMILES Flexibase

44243507

Analogs

36796953
36796954
703793

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Popular Name: 5-bromo-N-cyclopentyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide 5-bromo-N-cyclopentyl-N-(2-hydro…

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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)	1.90	1.89	-8.09	1	5	0	71	349.25	5	↓ MOL2 SDF SMILES Flexibase

50656058

Analogs

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Popular Name: N-cyclopentyl-N-ethyl-6-(methylamino)pyridine-3-sulfonamide N-cyclopentyl-N-ethyl-6-(methyla…

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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	3.61	-9.07	1	5	0	62	283.397	5	↓ MOL2 SDF SMILES Flexibase

50656061

Analogs

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Popular Name: N-cyclopentyl-N-ethyl-6-(ethylamino)pyridine-3-sulfonamide N-cyclopentyl-N-ethyl-6-(ethylam…

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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)	2.53	4.37	-8.49	1	5	0	62	297.424	6	↓ MOL2 SDF SMILES Flexibase

50656064

Analogs

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Popular Name: N-cyclopentyl-N-ethyl-6-(propylamino)pyridine-3-sulfonamide N-cyclopentyl-N-ethyl-6-(propyla…

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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	5.14	-8.21	1	5	0	62	311.451	7	↓ MOL2 SDF SMILES Flexibase

50656077

Analogs

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Popular Name: N-cyclopentyl-N-ethyl-2-(methylamino)pyridine-3-sulfonamide N-cyclopentyl-N-ethyl-2-(methyla…

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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)	1.94	4.44	-9.45	1	5	0	62	283.397	5	↓ MOL2 SDF SMILES Flexibase

50656080

Analogs

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Popular Name: N-cyclopentyl-N-ethyl-2-(ethylamino)pyridine-3-sulfonamide N-cyclopentyl-N-ethyl-2-(ethylam…

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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)	2.31	5.32	-8.98	1	5	0	62	297.424	6	↓ MOL2 SDF SMILES Flexibase

50656083

Analogs

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Popular Name: N-cyclopentyl-N-ethyl-2-(propylamino)pyridine-3-sulfonamide N-cyclopentyl-N-ethyl-2-(propyla…

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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)	2.82	6.06	-8.76	1	5	0	62	311.451	7	↓ MOL2 SDF SMILES Flexibase

50656102

Analogs

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Popular Name: 5-bromo-N-cyclopentyl-N-ethyl-2-(methylamino)pyridine-3-sulfonamide 5-bromo-N-cyclopentyl-N-ethyl-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)	2.89	5.03	-7.61	1	5	0	62	362.293	5	↓ MOL2 SDF SMILES Flexibase

50656105

Analogs

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Popular Name: 5-bromo-N-cyclopentyl-N-ethyl-2-(ethylamino)pyridine-3-sulfonamide 5-bromo-N-cyclopentyl-N-ethyl-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)	3.27	5.92	-7.15	1	5	0	62	376.32	6	↓ MOL2 SDF SMILES Flexibase

50656108

Analogs

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Popular Name: 6-amino-N-cyclopentyl-N-ethyl-pyridine-3-sulfonamide 6-amino-N-cyclopentyl-N-ethyl-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)	1.78	2.7	-9.1	2	5	0	76	269.37	4	↓ MOL2 SDF SMILES Flexibase

50656113

Analogs

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Popular Name: 2-amino-N-cyclopentyl-N-ethyl-pyridine-3-sulfonamide 2-amino-N-cyclopentyl-N-ethyl-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)	1.56	3.19	-9.03	2	5	0	76	269.37	4	↓ MOL2 SDF SMILES Flexibase

50656123

Analogs

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Popular Name: 2-amino-5-bromo-N-cyclopentyl-N-ethyl-pyridine-3-sulfonamide 2-amino-5-bromo-N-cyclopentyl-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)	2.52	3.79	-7.31	2	5	0	76	348.266	4	↓ MOL2 SDF SMILES Flexibase

50661462

Analogs

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Popular Name: N-[(1R,2S)-2-methoxycyclopentyl]-6-(methylamino)pyridine-3-sulfonamide N-[(1R,2S)-2-methoxycyclopentyl]…

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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)	1.00	0.81	-9.95	2	6	0	80	285.369	5	↓ MOL2 SDF SMILES Flexibase

50661465

Analogs

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Popular Name: N-[(1S,2S)-2-methoxycyclopentyl]-6-(methylamino)pyridine-3-sulfonamide N-[(1S,2S)-2-methoxycyclopentyl]…

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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)	1.00	0.33	-10.61	2	6	0	80	285.369	5	↓ MOL2 SDF SMILES Flexibase

50661469

Analogs

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Popular Name: N-[(1R,2R)-2-methoxycyclopentyl]-6-(methylamino)pyridine-3-sulfonamide N-[(1R,2R)-2-methoxycyclopentyl]…

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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)	1.00	0.42	-11.31	2	6	0	80	285.369	5	↓ MOL2 SDF SMILES Flexibase

50661471

Analogs

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Popular Name: N-[(1S,2R)-2-methoxycyclopentyl]-6-(methylamino)pyridine-3-sulfonamide N-[(1S,2R)-2-methoxycyclopentyl]…

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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)	1.00	0.61	-9.91	2	6	0	80	285.369	5	↓ MOL2 SDF SMILES Flexibase

50661472

Analogs

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Popular Name: 6-(ethylamino)-N-[(1R,2S)-2-methoxycyclopentyl]pyridine-3-sulfonamide 6-(ethylamino)-N-[(1R,2S)-2-meth…

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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)	1.38	1.61	-9.44	2	6	0	80	299.396	6	↓ MOL2 SDF SMILES Flexibase

50661475

Analogs

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Popular Name: 6-(ethylamino)-N-[(1S,2S)-2-methoxycyclopentyl]pyridine-3-sulfonamide 6-(ethylamino)-N-[(1S,2S)-2-meth…

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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)	1.38	1.13	-10.11	2	6	0	80	299.396	6	↓ MOL2 SDF SMILES Flexibase

50661478

Analogs

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Popular Name: 6-(ethylamino)-N-[(1R,2R)-2-methoxycyclopentyl]pyridine-3-sulfonamide 6-(ethylamino)-N-[(1R,2R)-2-meth…

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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)	1.38	1.22	-10.78	2	6	0	80	299.396	6	↓ MOL2 SDF SMILES Flexibase

50661481

Analogs

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Popular Name: 6-(ethylamino)-N-[(1S,2R)-2-methoxycyclopentyl]pyridine-3-sulfonamide 6-(ethylamino)-N-[(1S,2R)-2-meth…

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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)	1.38	1.41	-9.41	2	6	0	80	299.396	6	↓ MOL2 SDF SMILES Flexibase

50661483

Analogs

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Popular Name: N-[(1R,2S)-2-methoxycyclopentyl]-6-(propylamino)pyridine-3-sulfonamide N-[(1R,2S)-2-methoxycyclopentyl]…

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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	2.38	-9.21	2	6	0	80	313.423	7	↓ MOL2 SDF SMILES Flexibase

50661485

Analogs

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Popular Name: N-[(1S,2S)-2-methoxycyclopentyl]-6-(propylamino)pyridine-3-sulfonamide N-[(1S,2S)-2-methoxycyclopentyl]…

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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	1.89	-9.81	2	6	0	80	313.423	7	↓ MOL2 SDF SMILES Flexibase

50661488

Analogs

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Popular Name: N-[(1R,2R)-2-methoxycyclopentyl]-6-(propylamino)pyridine-3-sulfonamide N-[(1R,2R)-2-methoxycyclopentyl]…

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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	1.99	-10.53	2	6	0	80	313.423	7	↓ MOL2 SDF SMILES Flexibase

50661491

Analogs

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Popular Name: N-[(1S,2R)-2-methoxycyclopentyl]-6-(propylamino)pyridine-3-sulfonamide N-[(1S,2R)-2-methoxycyclopentyl]…

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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	2.17	-9.14	2	6	0	80	313.423	7	↓ MOL2 SDF SMILES Flexibase

50661533

Analogs

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Popular Name: N-[(1R,2S)-2-methoxycyclopentyl]-2-(methylamino)pyridine-3-sulfonamide N-[(1R,2S)-2-methoxycyclopentyl]…

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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)	0.78	1.56	-9.91	2	6	0	80	285.369	5	↓ MOL2 SDF SMILES Flexibase

50661535

Analogs

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Popular Name: N-[(1S,2S)-2-methoxycyclopentyl]-2-(methylamino)pyridine-3-sulfonamide N-[(1S,2S)-2-methoxycyclopentyl]…

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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)	0.78	1.13	-10.44	2	6	0	80	285.369	5	↓ MOL2 SDF SMILES Flexibase

50661537

Analogs

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Popular Name: N-[(1R,2R)-2-methoxycyclopentyl]-2-(methylamino)pyridine-3-sulfonamide N-[(1R,2R)-2-methoxycyclopentyl]…

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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)	0.78	1.16	-11.23	2	6	0	80	285.369	5	↓ MOL2 SDF SMILES Flexibase

50661540

Analogs

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Popular Name: N-[(1S,2R)-2-methoxycyclopentyl]-2-(methylamino)pyridine-3-sulfonamide N-[(1S,2R)-2-methoxycyclopentyl]…

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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)	0.78	1.42	-9.54	2	6	0	80	285.369	5	↓ MOL2 SDF SMILES Flexibase

50661542

Analogs

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Popular Name: 2-(ethylamino)-N-[(1R,2S)-2-methoxycyclopentyl]pyridine-3-sulfonamide 2-(ethylamino)-N-[(1R,2S)-2-meth…

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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	2.38	-9.66	2	6	0	80	299.396	6	↓ MOL2 SDF SMILES Flexibase

50661545

Analogs

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Popular Name: 2-(ethylamino)-N-[(1S,2S)-2-methoxycyclopentyl]pyridine-3-sulfonamide 2-(ethylamino)-N-[(1S,2S)-2-meth…

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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	1.96	-10.19	2	6	0	80	299.396	6	↓ MOL2 SDF SMILES Flexibase

50661547

Analogs

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Popular Name: 2-(ethylamino)-N-[(1R,2R)-2-methoxycyclopentyl]pyridine-3-sulfonamide 2-(ethylamino)-N-[(1R,2R)-2-meth…

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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	1.98	-10.95	2	6	0	80	299.396	6	↓ MOL2 SDF SMILES Flexibase

50661550

Analogs

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Popular Name: 2-(ethylamino)-N-[(1S,2R)-2-methoxycyclopentyl]pyridine-3-sulfonamide 2-(ethylamino)-N-[(1S,2R)-2-meth…

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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	2.25	-9.3	2	6	0	80	299.396	6	↓ MOL2 SDF SMILES Flexibase

50661553

Analogs

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Popular Name: N-[(1R,2S)-2-methoxycyclopentyl]-2-(propylamino)pyridine-3-sulfonamide N-[(1R,2S)-2-methoxycyclopentyl]…

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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)	1.66	3.14	-9.43	2	6	0	80	313.423	7	↓ MOL2 SDF SMILES Flexibase

50661555

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2S)-2-methoxycyclopentyl]-2-(propylamino)pyridine-3-sulfonamide N-[(1S,2S)-2-methoxycyclopentyl]…

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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)	1.66	2.72	-9.94	2	6	0	80	313.423	7	↓ MOL2 SDF SMILES Flexibase

50661557

Analogs

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Popular Name: N-[(1R,2R)-2-methoxycyclopentyl]-2-(propylamino)pyridine-3-sulfonamide N-[(1R,2R)-2-methoxycyclopentyl]…

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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)	1.66	2.74	-10.79	2	6	0	80	313.423	7	↓ MOL2 SDF SMILES Flexibase

50661560

Analogs

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Popular Name: N-[(1S,2R)-2-methoxycyclopentyl]-2-(propylamino)pyridine-3-sulfonamide N-[(1S,2R)-2-methoxycyclopentyl]…

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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)	1.66	3.01	-9.09	2	6	0	80	313.423	7	↓ MOL2 SDF SMILES Flexibase

50661622

Analogs

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Popular Name: 5-bromo-N-[(1R,2S)-2-methoxycyclopentyl]-2-(methylamino)pyridine-3-sulfonamide 5-bromo-N-[(1R,2S)-2-methoxycycl…

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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	2.15	-8.09	2	6	0	80	364.265	5	↓ MOL2 SDF SMILES Flexibase

50661625

Analogs

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Popular Name: 5-bromo-N-[(1S,2S)-2-methoxycyclopentyl]-2-(methylamino)pyridine-3-sulfonamide 5-bromo-N-[(1S,2S)-2-methoxycycl…

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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	1.72	-9.04	2	6	0	80	364.265	5	↓ MOL2 SDF SMILES Flexibase

50661628

Analogs

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Popular Name: 5-bromo-N-[(1R,2R)-2-methoxycyclopentyl]-2-(methylamino)pyridine-3-sulfonamide 5-bromo-N-[(1R,2R)-2-methoxycycl…

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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	1.75	-9.86	2	6	0	80	364.265	5	↓ MOL2 SDF SMILES Flexibase

50661631

Analogs

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Popular Name: 5-bromo-N-[(1S,2R)-2-methoxycyclopentyl]-2-(methylamino)pyridine-3-sulfonamide 5-bromo-N-[(1S,2R)-2-methoxycycl…

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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	2.02	-7.72	2	6	0	80	364.265	5	↓ MOL2 SDF SMILES Flexibase

50661632

Analogs

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Popular Name: 5-bromo-2-(ethylamino)-N-[(1R,2S)-2-methoxycyclopentyl]pyridine-3-sulfonamide 5-bromo-2-(ethylamino)-N-[(1R,2S…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.11	2.97	-7.75	2	6	0	80	378.292	6	↓ MOL2 SDF SMILES Flexibase

50661635

Analogs

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Popular Name: 5-bromo-2-(ethylamino)-N-[(1S,2S)-2-methoxycyclopentyl]pyridine-3-sulfonamide 5-bromo-2-(ethylamino)-N-[(1S,2S…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.11	2.55	-8.67	2	6	0	80	378.292	6	↓ MOL2 SDF SMILES Flexibase

50661638

Analogs

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Popular Name: 5-bromo-2-(ethylamino)-N-[(1R,2R)-2-methoxycyclopentyl]pyridine-3-sulfonamide 5-bromo-2-(ethylamino)-N-[(1R,2R…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.11	2.57	-9.45	2	6	0	80	378.292	6	↓ MOL2 SDF SMILES Flexibase

50661640

Analogs

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Popular Name: 5-bromo-2-(ethylamino)-N-[(1S,2R)-2-methoxycyclopentyl]pyridine-3-sulfonamide 5-bromo-2-(ethylamino)-N-[(1S,2R…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.11	2.84	-7.42	2	6	0	80	378.292	6	↓ MOL2 SDF SMILES Flexibase

50661643

Analogs

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Popular Name: 6-amino-N-[(1S,2R)-2-methoxycyclopentyl]pyridine-3-sulfonamide 6-amino-N-[(1S,2R)-2-methoxycycl…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.63	-0.2	-10.49	3	6	0	94	271.342	4	↓ MOL2 SDF SMILES Flexibase

50661646

Analogs

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Popular Name: 6-amino-N-[(1S,2S)-2-methoxycyclopentyl]pyridine-3-sulfonamide 6-amino-N-[(1S,2S)-2-methoxycycl…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.63	-0.6	-10.43	3	6	0	94	271.342	4	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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filter.purchasability = annotated
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Structural Results Found: (before additional filtering)

SQL Query Was

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