UCSF

ZINC00396143

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) 0.62 0.26 -10.41 1 3 0 54 200.259 3

Vendor Notes

Note Type Comments Provided By
Boiling_Point 178-181?/0.2mm Alfa-Aesar
Boiling_Point 178-181°/0.2mm Alfa-Aesar
BP 195 / 23 TCI
Melting_Point 50-53? Alfa-Aesar
Melting_Point 50-53° Alfa-Aesar
MP 50-56° Oakwood Chemical
MP 54-58° Fluorochem
MP 55 TCI
Purity 98% Fluorochem
Purity >98% Fluorochem

Activity (Go SEA)

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