UCSF

ZINC15109782

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 20th, 2008 28 No

Popular Name: (5R)-4-(4-fluorobenzoyl)-3-hydroxy-1-(2-hydroxyethyl)-5-(4-hydroxy-3-methoxy-phenyl)-5H-pyrrol-2-one (5R)-4-(4-fluorobenzoyl)-3-hydro…

Find On: PubMed — Wikipedia — Google

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) 1.25 1.92 -59.66 2 7 -1 110 386.355 6 ↓
Mid Mid (pH 6-8) 1.70 1.44 -28.85 3 7 0 107 387.363 5 ↓
Mid Mid (pH 6-8) 0.67 2.46 -18.43 2 7 0 104 387.363 6 ↓

Activity (Go SEA)

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