UCSF

ZINC08681507

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) -0.37 -16.86 -24.15 8 14 0 225 580.539 6

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0196439A1; EP0314959B1; EP0317033B1; EP0352147A2; EP0373986A1; EP0373986B1; EP0455432A1; EP0455432B1; EP0681827B1; EP0691886B1; EP0695502A1; EP0702719A1; EP0797427A1; EP0799023A1; EP0971743A1; EP1014968A1; EP1032381A1; US4006261; US5501966; US5658793; U IBM Patent Data
Target Prostaglandin G/H synthase 2(P35354)&Cytochrome P450 19A1(P11511)&Transforming growth factor beta-1(P01137)&Cyclin-dependent kinase inhibitor 1(P38936)&High affinity immunoglobulin epsilon receptor subunit beta(Q01362) Herbal Ingredients Targets

Activity (Go SEA)

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