UCSF

ZINC04803379

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) 4.12 2.62 -7.06 0 2 0 26 238.286 5

Vendor Notes

Note Type Comments Provided By
BP [°C] 195 - 200 (p=5 torr) Acros Organics
Boiling_Point 195-200?/5mm Alfa-Aesar
Boiling_Point 195-200°/5mm Alfa-Aesar
Mp [°C] 33 - 37 Acros Organics
Melting_Point 34-36? Alfa-Aesar
Melting_Point 34-36° Alfa-Aesar
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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