UCSF

ZINC05988170

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 22nd, 2006 27 No

Popular Name: 4-[(4-chlorophenyl)-hydroxy-methylene]-1-(2-hydroxyethyl)-5-(3-methoxyphenyl)-pyrrolidine-2,3-dione 4-[(4-chlorophenyl)-hydroxy-meth…

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) 2.46 4.97 -57.66 1 6 -1 90 386.811 6 ↓
Mid Mid (pH 6-8) 1.87 5.43 -22.05 1 6 0 84 387.819 6 ↓
Mid Mid (pH 6-8) 2.90 4.12 -18.77 2 6 0 87 387.819 5 ↓

Activity (Go SEA)

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