UCSF

ZINC15230025

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 21st, 2008 29 No

Popular Name: (5R)-4-(4-chlorobenzoyl)-5-(4-fluorophenyl)-3-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-5H-pyrrol-2-one (5R)-4-(4-chlorobenzoyl)-5-(4-fl…

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) 2.48 5.64 -59.71 1 6 -1 90 418.828 8 ↓
Mid Mid (pH 6-8) 2.92 4.55 -32.84 2 6 0 87 419.836 7 ↓
Mid Mid (pH 6-8) 1.89 5.57 -24.56 1 6 0 84 419.836 8 ↓

Activity (Go SEA)

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