UCSF

ZINC03875704

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) 7.36 15.95 -6.41 0 4 0 53 370.574 19

Vendor Notes

Note Type Comments Provided By
Melting_Point 67? Alfa-Aesar
Melting_Point 67° Alfa-Aesar
Mp [°C] 76 Acros Organics
Boiling_Point 166-168?/1mm Alfa-Aesar
Boiling_Point 166-168°/1mm Alfa-Aesar
BP [°C] 210 - 218 (p=5 torr) Acros Organics
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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