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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

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Popular Name: 2-[cyclopentyl-(6-nitro-3-pyridyl)amino]ethanol 2-[cyclopentyl-(6-nitro-3-pyridy…

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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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.04 5.1 -11.4 1 6 0 82 251.286 5 ↓

Analogs

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Popular Name: N-cyclopentyl-6-(2-methoxyethoxy)pyridin-3-amine N-cyclopentyl-6-(2-methoxyethoxy…

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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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.08 3.08 -6.25 1 4 0 43 236.315 6 ↓

Analogs

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Popular Name: N-cyclopentyl-2-methoxypyridin-3-amine N-cyclopentyl-2-methoxypyridin-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.97 3.03 -4.51 1 3 0 34 192.262 3 ↓

Analogs

19868305
19868305

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Popular Name: N5-cyclopentyl-N5-methyl-pyridine-2,5-diamine N5-cyclopentyl-N5-methyl-pyridin…

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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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.19 5 -26.39 3 3 1 43 192.286 2 ↓
Hi High (pH 8-9.5) 2.19 4.52 -4.46 2 3 0 42 191.278 2 ↓

Analogs

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Popular Name: (1S,2R)-2-[(6-methoxy-3-pyridyl)amino]cyclopentanecarbonitrile (1S,2R)-2-[(6-methoxy-3-pyridyl)…

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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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.84 3.22 -8.84 1 4 0 58 217.272 3 ↓

Analogs

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Popular Name: (1S,2S)-2-[(6-methoxy-3-pyridyl)amino]cyclopentanecarbonitrile (1S,2S)-2-[(6-methoxy-3-pyridyl)…

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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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.84 3.1 -10.37 1 4 0 58 217.272 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2R)-2-[(6-methoxy-3-pyridyl)amino]cyclopentanecarbonitrile (1R,2R)-2-[(6-methoxy-3-pyridyl)…

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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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.84 3.1 -10.6 1 4 0 58 217.272 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S)-2-[(6-methoxy-3-pyridyl)amino]cyclopentanecarbonitrile (1R,2S)-2-[(6-methoxy-3-pyridyl)…

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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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.84 3.22 -9.28 1 4 0 58 217.272 3 ↓

Analogs

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Popular Name: (1S,2R)-2-[(2-isopropoxy-3-pyridyl)amino]cyclopentanecarbonitrile (1S,2R)-2-[(2-isopropoxy-3-pyrid…

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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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.36 5.23 -11.37 1 4 0 58 245.326 4 ↓

Analogs

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Popular Name: (1S,2S)-2-[(2-isopropoxy-3-pyridyl)amino]cyclopentanecarbonitrile (1S,2S)-2-[(2-isopropoxy-3-pyrid…

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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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.36 5.12 -7.91 1 4 0 58 245.326 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2R)-2-[(2-isopropoxy-3-pyridyl)amino]cyclopentanecarbonitrile (1R,2R)-2-[(2-isopropoxy-3-pyrid…

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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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.36 5.12 -8.04 1 4 0 58 245.326 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S)-2-[(2-isopropoxy-3-pyridyl)amino]cyclopentanecarbonitrile (1R,2S)-2-[(2-isopropoxy-3-pyrid…

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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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.36 5.23 -11.99 1 4 0 58 245.326 4 ↓

Analogs

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Popular Name: 2-[(6-amino-3-pyridyl)-cyclopentyl-amino]acetamide 2-[(6-amino-3-pyridyl)-cyclopent…

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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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.92 2.09 -32.01 5 5 1 86 235.311 4 ↓
Mid Mid (pH 6-8) 0.92 1.63 -11.08 4 5 0 85 234.303 4 ↓

Parameters Provided:

ring.id = 38711
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

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SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 38711 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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