UCSF

ZINC03860540

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) 3.06 -1.22 -3.5 0 1 0 3 173.259 0

Vendor Notes

Note Type Comments Provided By
Boiling_Point 170-173?/31mm Alfa-Aesar
Boiling_Point 170-173°/31mm Alfa-Aesar
Melting_Point 239-242? Alfa-Aesar
BP 280 TCI
Melting_Point 32-37? Alfa-Aesar
Melting_Point 32-37° Alfa-Aesar
Mp [°C] 34 - 36 Acros Organics
MP 37 TCI
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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