UCSF

ZINC04098077

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) 5.98 3.11 -96.54 3 8 2 75 626.794 10

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0889731A1; US5627195; US5721215; WO1996032108A1; WO1997034624A1 IBM Patent Data

Activity (Go SEA)

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