UCSF

ZINC04202836

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) 1.05 4.72 -48.4 3 4 1 57 235.307 3
Hi High (pH 8-9.5) 0.73 5.56 -92.9 7 9 2 133 465.533 6

Vendor Notes

Note Type Comments Provided By
MP 168-170° Oakwood Chemical
Purity 95+% Matrix Scientific
Purity 96% Fluorochem
Purity 97% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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