UCSF

ZINC01433306

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) -0.87 3 -56.11 1 5 -1 78 214.241 4
Hi High (pH 8-9.5) 4.28 7.33 -6.68 0 5 0 46 328.449 10

Vendor Notes

Note Type Comments Provided By
Melting_Point 129-133? Alfa-Aesar
MP 129-133° Oakwood Chemical
Mp [°C] 133 - 140 Acros Organics
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95+% Matrix Scientific
Purity 97% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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