UCSF

ZINC40079242

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2010 32 No

Popular Name: (2S)-2-(3,4-dimethoxyphenyl)-4-hydroxy-1-(2-hydroxyethyl)-3-(4-isopropoxybenzoyl)-2H-pyrrol-5-one (2S)-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) 2.19 5.4 -59.95 1 8 -1 108 440.472 9 ↓
Lo Low (pH 4.5-6) 2.19 4.67 -16.27 2 8 0 106 441.48 9 ↓

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