UCSF

ZINC05800507

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 14th, 2006 29 No

Popular Name: 4-(hydroxy-phenyl-methylene)-5-(3-methoxyphenyl)-1-(5-methylisoxazol-3-yl)-pyrrolidine-2,3-dione 4-(hydroxy-phenyl-methylene)-5-(…

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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) 2.94 9.34 -58.69 0 7 -1 96 389.387 5 ↓
Mid Mid (pH 6-8) 3.38 2.39 -24.57 1 7 0 92 390.395 4 ↓
Mid Mid (pH 6-8) 2.35 1.71 -15.27 0 7 0 89 390.395 5 ↓

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