UCSF

ZINC40054690

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2010 39 No

Popular Name: (2R)-3-(3-benzyloxybenzoyl)-4-hydroxy-1-(3-hydroxypropyl)-2-(4-pentoxyphenyl)-2H-pyrrol-5-one (2R)-3-(3-benzyloxybenzoyl)-4-hy…

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) 5.64 11.37 -67.54 1 7 -1 99 528.625 14 ↓
Lo Low (pH 4.5-6) 5.64 10.61 -21.11 2 7 0 96 529.633 14 ↓

Activity (Go SEA)

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