UCSF

ZINC40100394

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2010 30 No

Popular Name: (2R)-2-(3-ethoxy-4-hydroxy-phenyl)-4-hydroxy-1-(2-hydroxyethyl)-3-(3-methoxybenzoyl)-2H-pyrrol-5-one (2R)-2-(3-ethoxy-4-hydroxy-pheny…

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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) 1.49 2.06 -66.13 2 8 -1 119 412.418 8 ↓
Lo Low (pH 4.5-6) 1.49 1.31 -20.18 3 8 0 117 413.426 8 ↓

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