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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: N-[(2S)-2-(benzimidazol-1-yl)propyl]cyclopentanamine N-[(2S)-2-(benzimidazol-1-yl)pro…

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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) 3.04 9.11 -51.06 2 3 1 34 244.362 4 ↓
Lo Low (pH 4.5-6) 3.04 9.59 -103.08 3 3 2 36 245.37 4 ↓

Analogs

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Popular Name: N-[(2R)-2-(benzimidazol-1-yl)propyl]cyclopentanamine N-[(2R)-2-(benzimidazol-1-yl)pro…

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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) 3.04 9.16 -50.98 2 3 1 34 244.362 4 ↓
Lo Low (pH 4.5-6) 3.04 9.64 -103.07 3 3 2 36 245.37 4 ↓

Analogs

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Popular Name: N-[(2S)-2-(5,6-dimethylbenzimidazol-1-yl)propyl]cyclopentanamine N-[(2S)-2-(5,6-dimethylbenzimida…

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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) 3.85 10.38 -50.74 2 3 1 34 272.416 4 ↓
Lo Low (pH 4.5-6) 3.85 10.86 -103.38 3 3 2 36 273.424 4 ↓

Analogs

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Popular Name: N-[(2R)-2-(5,6-dimethylbenzimidazol-1-yl)propyl]cyclopentanamine N-[(2R)-2-(5,6-dimethylbenzimida…

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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) 3.85 10.38 -50.86 2 3 1 34 272.416 4 ↓
Lo Low (pH 4.5-6) 3.85 10.86 -103.71 3 3 2 36 273.424 4 ↓

Analogs

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Popular Name: N-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]cyclopentanamine N-[2-(5,6-dimethylbenzimidazol-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.48 10 -52.06 2 3 1 34 258.389 4 ↓
Lo Low (pH 4.5-6) 3.48 10.48 -105.78 3 3 2 36 259.397 4 ↓

Analogs

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Popular Name: N-[(2S)-2-(2-methylbenzimidazol-1-yl)propyl]cyclopentanamine N-[(2S)-2-(2-methylbenzimidazol-…

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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) 3.13 8.84 -51.65 2 3 1 34 258.389 4 ↓
Lo Low (pH 4.5-6) 3.13 9.28 -96.37 3 3 2 36 259.397 4 ↓

Analogs

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Popular Name: N-[(2R)-2-(2-methylbenzimidazol-1-yl)propyl]cyclopentanamine N-[(2R)-2-(2-methylbenzimidazol-…

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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) 3.13 8.9 -51.8 2 3 1 34 258.389 4 ↓
Lo Low (pH 4.5-6) 3.13 9.34 -96.39 3 3 2 36 259.397 4 ↓

Analogs

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Popular Name: N-[(2S)-2-(5,6-difluorobenzimidazol-1-yl)propyl]cyclopentanamine N-[(2S)-2-(5,6-difluorobenzimida…

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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) 3.28 9.24 -55.47 2 3 1 34 280.342 4 ↓

Analogs

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Popular Name: N-[(2R)-2-(5,6-difluorobenzimidazol-1-yl)propyl]cyclopentanamine N-[(2R)-2-(5,6-difluorobenzimida…

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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) 3.28 9.29 -55.4 2 3 1 34 280.342 4 ↓

Analogs

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Popular Name: N-[2-(5,6-difluorobenzimidazol-1-yl)ethyl]cyclopentanamine N-[2-(5,6-difluorobenzimidazol-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.91 8.9 -56.83 2 3 1 34 266.315 4 ↓

Analogs

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Popular Name: N-[(2S)-2-(2-ethylbenzimidazol-1-yl)propyl]cyclopentanamine N-[(2S)-2-(2-ethylbenzimidazol-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.70 9.44 -51.94 2 3 1 34 272.416 5 ↓
Lo Low (pH 4.5-6) 3.70 9.86 -95.59 3 3 2 36 273.424 5 ↓

Analogs

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Popular Name: N-[(2R)-2-(2-ethylbenzimidazol-1-yl)propyl]cyclopentanamine N-[(2R)-2-(2-ethylbenzimidazol-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.70 9.49 -51.92 2 3 1 34 272.416 5 ↓
Lo Low (pH 4.5-6) 3.70 9.91 -94.94 3 3 2 36 273.424 5 ↓

Parameters Provided:

ring.id = 72454
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 = 72454 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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