UCSF

ZINC04261920

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) -2.03 -9.98 -8.6 4 6 0 99 194.183 2

Vendor Notes

Note Type Comments Provided By
Mp [°C] 186 - 194 Acros Organics
MP 192 TCI
MP 193-196 °C(lit.) Indofine
Melting_Point 193-196? Alfa-Aesar
Melting_Point 193-196° Alfa-Aesar
ALOGPS_SOLUBILITY 8.62e+02 g/l DrugBank-experimental
Purity 95% Fluorochem
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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