UCSF

ZINC01410681

Annotations

Vendors

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) 1.75 4.37 -8.82 0 3 0 36 180.203 4

Vendor Notes

Note Type Comments Provided By
BP 167 / 13 TCI
BP [°C] 168 Acros Organics
M.P 50-53 °C Indofine
Melting_Point 59-63? Alfa-Aesar
Melting_Point 59-63° Alfa-Aesar
Mp [°C] 60 - 65 Acros Organics
MP 61 TCI
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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