UCSF

ZINC05595681

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 6th, 2006 29 No

Popular Name: 4-[(4-chlorophenyl)-hydroxy-methylene]-5-(3,4-dimethoxyphenyl)-1-(2-hydroxyethyl)pyrrolidine-2,3-dio 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) 2.07 4.88 -62.16 1 7 -1 99 416.837 7 ↓
Mid Mid (pH 6-8) 2.52 -1.72 -23.5 2 7 0 96 417.845 6 ↓
Mid Mid (pH 6-8) 1.49 -2.27 -15.74 1 7 0 93 417.845 7 ↓

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