UCSF

ZINC53356777

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2010 28 Yes

Popular Name: [(2R)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(2,4,5-trimethoxyphenyl)methanone [(2R)-2-(1H-benzimidazol-2-yl)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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.66 7.49 -20.23 1 7 0 77 381.432 5 ↓
Lo Low (pH 4.5-6) 2.66 7.99 -34.97 2 7 1 78 382.44 5 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.