UCSF

ZINC04522854

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) 5.20 2.41 -4.17 0 1 0 3 287.406 4

Vendor Notes

Note Type Comments Provided By
mp 161 MolMall (formerly Molecular Diversity Preservation International)
PUBCHEM_PATENT_ID EP0712506A1; WO1995004955A1 IBM Patent Data

Activity (Go SEA)

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