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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 2-(cyclopentylmethyl)-1H-benzimidazol-5-amine 2-(cyclopentylmethyl)-1H-benzimi…

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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) 2.55 5.07 -7.85 3 3 0 55 215.3 2 ↓
Mid Mid (pH 6-8) 2.55 5.47 -27.35 4 3 1 56 216.308 2 ↓

Analogs

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Popular Name: 2-(cyclopentylmethyl)-1-methyl-benzimidazole-5-carboxylic 2-(cyclopentylmethyl)-1-methyl-b…

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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) 3.45 9.33 -57.18 0 4 -1 58 257.313 3 ↓
Mid Mid (pH 6-8) 3.45 9.79 -53.07 1 4 0 59 258.321 3 ↓

Analogs

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Popular Name: 3-[2-(cyclopentylmethyl)benzimidazol-1-yl]propanoic 3-[2-(cyclopentylmethyl)benzimid…

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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 10.35 -43.31 0 4 -1 58 271.34 5 ↓
Mid Mid (pH 6-8) 3.08 10.82 -41.7 1 4 0 59 272.348 5 ↓

Analogs

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Popular Name: 1H-Benzimidazole, 2-(cyclopentylmethyl)- (9CI) 1H-Benzimidazole, 2-(cyclopentyl…

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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) 3.50 7.19 -7.55 1 2 0 29 200.285 2 ↓

Analogs

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Popular Name: 2-[2-(cyclopentylmethyl)benzimidazol-1-yl]acetic 2-[2-(cyclopentylmethyl)benzimid…

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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) 2.81 9.86 -47.18 0 4 -1 58 257.313 4 ↓
Mid Mid (pH 6-8) 2.81 10.33 -34.54 1 4 0 59 258.321 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(cyclopentylmethyl)-1H-benzimidazole-5-carboxylic 2-(cyclopentylmethyl)-1H-benzimi…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 3.38 7.73 -49.51 1 4 -1 69 243.286 3 ↓
Mid Mid (pH 6-8) 3.38 8.13 -54.99 2 4 0 70 244.294 3 ↓

Parameters Provided:

ring.id = 46132
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

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 = 46132 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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