UCSF

ZINC05408730

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 1st, 2006 27 No

Popular Name: 5-(4-chlorophenyl)-4-[(3,4-dimethoxyphenyl)-hydroxy-methylene]-1-methyl-pyrrolidine-2,3-dione 5-(4-chlorophenyl)-4-[(3,4-dimet…

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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) 2.70 7.26 -57.48 0 6 -1 79 386.811 5 ↓
Mid Mid (pH 6-8) 3.15 1.08 -19.98 1 6 0 76 387.819 4 ↓
Mid Mid (pH 6-8) 2.12 0.41 -13.2 0 6 0 72 387.819 5 ↓

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