UCSF

ZINC05489986

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 3rd, 2006 27 No

Popular Name: 4-[(4-chlorophenyl)-hydroxy-methylene]-1-(2-hydroxyethyl)-5-(3-methoxyphenyl)-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) 2.46 5.04 -60.75 1 6 -1 90 386.811 6 ↓
Mid Mid (pH 6-8) 2.90 -2.07 -20.43 2 6 0 87 387.819 5 ↓
Mid Mid (pH 6-8) 1.87 -2.68 -13.76 1 6 0 83 387.819 6 ↓

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