UCSF

ZINC04083819

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) 0.10 -2.19 -16.03 4 8 0 130 338.312 3

Vendor Notes

Note Type Comments Provided By
SOLUBILITY .; DMSO: 50 mg/mL, clear, colorless to faintly yellow Indofine
M.P 171-173 °C Indofine
Mp [°C] 248 Acros Organics
M.P 258-263 °C Indofine
Melting_Point ca 260? dec. Alfa-Aesar
Melting_Point ca 260° dec. Alfa-Aesar
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics
PUBCHEM_PATENT_ID WO1999009965A2 IBM Patent Data

Activity (Go SEA)

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