UCSF

ZINC40111681

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 24th, 2010 36 No

Popular Name: (2R)-2-(3,4-dimethoxyphenyl)-4-hydroxy-1-(2-hydroxyethyl)-3-(4-pyrrolidin-1-ylsulfonylbenzoyl)-2H-py (2R)-2-(3,4-dimethoxyphenyl)-4-h…

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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) 1.11 3.04 -63.82 1 10 -1 137 515.564 9 ↓
Lo Low (pH 4.5-6) 1.11 2.29 -21.91 2 10 0 134 516.572 9 ↓

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