UCSF

ZINC52263522

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2010 17 Yes

Popular Name: (2S,3R)-3-hydroxy-3-(3-hydroxyphenyl)-2-isopropyl-butanoic (2S,3R)-3-hydroxy-3-(3-hydroxyph…

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) 2.70 2.91 -41.52 2 4 -1 81 237.275 4 ↓

Activity (Go SEA)

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