UCSF

ZINC40123386

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 24th, 2010 28 No

Popular Name: (2R)-2-(3-ethoxy-4-hydroxy-phenyl)-4-hydroxy-3-(4-methoxy-3-methyl-benzoyl)-1,2-dihydropyrrol-5-one (2R)-2-(3-ethoxy-4-hydroxy-pheny…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 2.28 3.11 -55.94 2 7 -1 108 382.392 6 ↓
Lo Low (pH 4.5-6) 2.28 2.35 -15.73 3 7 0 105 383.4 6 ↓

Activity (Go SEA)

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