UCSF

ZINC05445506

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 2nd, 2006 27 No

Popular Name: 4-[(4-chlorophenyl)-hydroxy-methylene]-5-(2,4-dimethoxyphenyl)-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) 3.10 6.89 -55.54 0 6 -1 79 386.811 5 ↓
Mid Mid (pH 6-8) 3.54 0.97 -20.46 1 6 0 76 387.819 4 ↓
Mid Mid (pH 6-8) 2.51 0.64 -12.46 0 6 0 72 387.819 5 ↓

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