UCSF

ZINC06783976

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2006 31 No

Popular Name: 5-(3-ethoxy-4-hydroxy-phenyl)-1-(2-furylmethyl)-4-(hydroxy-phenyl-methylene)-pyrrolidine-2,3-dione 5-(3-ethoxy-4-hydroxy-phenyl)-1-…

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Download: MOL2 SDF SMILES Flexibase

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) 2.75 7.31 -64.44 1 7 -1 103 418.425 7 ↓
Mid Mid (pH 6-8) 3.19 0.1 -23.29 2 7 0 100 419.433 6 ↓
Mid Mid (pH 6-8) 2.17 -0.34 -14.44 1 7 0 97 419.433 7 ↓

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