UCSF

ZINC16994701

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 11th, 2008 27 No

Popular Name: (4E,5R)-5-(2,4-dimethoxyphenyl)-4-[hydroxy-(4-methoxyphenyl)methylene]pyrrolidine-2,3-dione (4E,5R)-5-(2,4-dimethoxyphenyl)-…

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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) 2.23 3.2 -59.12 1 7 -1 97 368.365 6 ↓
Mid Mid (pH 6-8) 2.23 2.43 -13.69 2 7 0 94 369.373 6 ↓
Mid Mid (pH 6-8) 1.65 2.79 -12.65 1 7 0 91 369.373 6 ↓

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