UCSF

ZINC04027271

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) 1.86 4.83 -8.26 0 2 0 26 162.188 1

Vendor Notes

Note Type Comments Provided By
Boiling_Point 120-121?/15mm Alfa-Aesar
Boiling_Point 120-121°/15mm Alfa-Aesar
MP 56 - 58 Enamine Building Blocks
Melting_Point 56-59? Alfa-Aesar
Melting_Point 56-59° Alfa-Aesar
MP 56...58 Enamine Building Blocks
MP 61-62° Oakwood Chemical
MP 61-62°C Fluorochem
Mp [°C] 62 - 64 Acros Organics
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% Fluorochem
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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