UCSF

ZINC17784346

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2008 27 No

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

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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) 1.88 2.37 -64.49 2 7 -1 108 368.365 6 ↓
Mid Mid (pH 6-8) 1.30 2.75 -14.32 2 7 0 102 369.373 6 ↓
Lo Low (pH 4.5-6) 1.88 1.55 -23.04 3 7 0 105 369.373 6 ↓

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