UCSF

ZINC40116947

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 24th, 2010 26 No

Popular Name: (2S)-2-(3-bromo-4-hydroxy-5-methoxy-phenyl)-4-hydroxy-3-(4-methylbenzoyl)-1,2-dihydropyrrol-5-one (2S)-2-(3-bromo-4-hydroxy-5-meth…

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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) 2.89 3.46 -58.08 2 6 -1 99 417.235 4 ↓
Hi High (pH 8-9.5) 2.89 4.38 -114.74 1 6 -2 102 416.227 4 ↓
Lo Low (pH 4.5-6) 2.89 2.69 -16.7 3 6 0 96 418.243 4 ↓

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