UCSF

ZINC53356665

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2010 26 Yes

Popular Name: [(2R)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-[2-(trifluoromethyl)phenyl]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) 3.33 8.95 -17.88 1 4 0 49 359.351 3 ↓
Lo Low (pH 4.5-6) 3.33 9.46 -33.96 2 4 1 50 360.359 3 ↓

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

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