UCSF

ZINC06786468

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2006 30 No

Popular Name: 4-benzoyl-3-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxy-phenyl)-5H-pyrrol-2-one 4-benzoyl-3-hydroxy-1-[2-(2-hydr…

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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) 0.98 2.53 -68.79 2 8 -1 119 412.418 9 ↓
Mid Mid (pH 6-8) 1.42 1.04 -28.58 3 8 0 117 413.426 8 ↓
Mid Mid (pH 6-8) 0.39 1.87 -22.65 2 8 0 113 413.426 9 ↓

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