UCSF

ZINC04097913

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) 0.48 -5.41 -15.95 6 10 0 170 432.381 4
Hi High (pH 8-9.5) 0.48 -4.44 -65.19 5 10 -1 173 431.373 4

Vendor Notes

Note Type Comments Provided By
Molecular_Solubility 2.283 Bitter DB
M.P. 254 C Indofine
MP 256-257o C Indofine
PUBCHEM_PATENT_ID EP0273771A2; EP0273771B1; EP0347226A1; EP0419567B1; EP0592583A1; EP0647408A1; EP0647408B1; EP0682877A1; EP0723536A1; EP0742012A2; EP0795553A1; EP0796624A2; EP0812837A1; EP0827698B1; EP0829261A2; EP0829261A3; EP0834262A1; EP0837139A3; EP0896795A1; EP090314 IBM Patent Data
Target Eukaryotic translation initiation factor 6(P56537)&Caspase-8(Q14790) Herbal Ingredients Targets
APPEARANCE Off white to beige microcrystalline powder Indofine
SOLUBILITY Soluble in DMSO Indofine

Activity (Go SEA)

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