UCSF

ZINC03956910

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) 1.66 -5.5 -7.3 1 6 0 66 260.286 1

Vendor Notes

Note Type Comments Provided By
Mp [°C] 107 - 110 Acros Organics
Melting_Point 107-110? Alfa-Aesar
Melting_Point 107-110° Alfa-Aesar
MP 110 TCI
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0705260A1; EP0705260B1 IBM Patent Data
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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