UCSF

ZINC04521837

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) 8.87 18.81 -7.83 0 4 0 53 426.682 23

Vendor Notes

Note Type Comments Provided By
Mp [°C] 55 Acros Organics
Boiling_Point 211-213?/1mm Alfa-Aesar
Boiling_Point 211-213°/1mm Alfa-Aesar
BP [°C] 212 (p=1 torr) Acros Organics
BP 377 TCI
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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