UCSF

ZINC00153945

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) 0.96 1.33 -43.04 4 2 1 40 137.206 2

Vendor Notes

Note Type Comments Provided By
BP 100°/0.11mm Fluorochem
MP 143-146° Matrix Scientific
BP 148-152° Matrix Scientific
Purity 95% Fluorochem
Warnings Corrosive/Stored under Argon/Air Sensitive Matrix Scientific
PUBCHEM_PATENT_ID EP0882715A1 IBM Patent Data
Warnings Irritant Matrix Scientific

Activity (Go SEA)

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