UCSF

ZINC05999112

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) 2.33 -4.71 -12.44 3 6 0 88 360.406 6

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0906761A2; WO1998020113A1; WO1999055846A1; WO2000005350A1; WO2000059946A1 IBM Patent Data

Activity (Go SEA)

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