UCSF

ZINC04521503

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) 2.44 3.04 -49.07 0 5 -1 69 352.41 6
Hi High (pH 8-9.5) 1.72 7.53 -53.27 0 3 -1 43 204.249 2

Vendor Notes

Note Type Comments Provided By
MP 187-190 °C Indofine
Melting_Point 187-190? Alfa-Aesar
MP 187-190° Oakwood Chemical
Purity >98% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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