UCSF

ZINC05577331

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 6th, 2006 26 No

Popular Name: 4-[(4-chlorophenyl)-hydroxy-methylene]-5-(4-hydroxy-3-methoxy-phenyl)-1-methyl-pyrrolidine-2,3-dione 4-[(4-chlorophenyl)-hydroxy-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) 2.40 5.46 -56.94 1 6 -1 90 372.784 4 ↓
Mid Mid (pH 6-8) 2.84 -1.81 -18.34 2 6 0 87 373.792 3 ↓
Mid Mid (pH 6-8) 1.81 -1.49 -11.86 1 6 0 83 373.792 4 ↓

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