UCSF

ZINC65527749

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 23 Yes

Popular Name: 6-[2-[(1R)-1-hydroxyethyl]-1-methyl-benzimidazol-5-yl]-7H-pyrrolo[3,4-b]pyridin-5-one 6-[2-[(1R)-1-hydroxyethyl]-1-met…

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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) 1.08 4.27 -25.54 1 6 0 71 308.341 2 ↓
Mid Mid (pH 6-8) 1.08 4.91 -34.58 2 6 1 73 309.349 2 ↓

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

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