UCSF

ZINC17779953

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) 0.54 1.34 -10.64 3 6 0 98 215.234 4
Hi High (pH 8-9.5) 0.54 1.52 -44.07 2 6 -1 101 214.226 4
Hi High (pH 8-9.5) 0.54 2.61 -48.27 2 6 -1 101 214.226 4
Lo Low (pH 4.5-6) 0.54 0.63 -26.97 4 6 1 99 216.242 4

Vendor Notes

Note Type Comments Provided By
MP 188 TCI
MP 195-197° Oakwood Chemical
Purity 95% Fluorochem

Activity (Go SEA)

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