UCSF

ZINC15109779

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 20th, 2008 28 No

Popular Name: (5S)-4-(4-fluorobenzoyl)-3-hydroxy-1-(2-hydroxyethyl)-5-(4-hydroxy-3-methoxy-phenyl)-5H-pyrrol-2-one (5S)-4-(4-fluorobenzoyl)-3-hydro…

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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) 1.25 2.33 -61.72 2 7 -1 110 386.355 6 ↓
Mid Mid (pH 6-8) 1.70 1.39 -27.58 3 7 0 107 387.363 5 ↓
Mid Mid (pH 6-8) 0.67 2.38 -20.15 2 7 0 104 387.363 6 ↓

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