UCSF

ZINC02539573

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) 2.29 -0.8 -56.45 1 6 -1 87 294.327 8

Vendor Notes

Note Type Comments Provided By
MP 58-60 °C(lit.) Indofine
Melting_Point 58-60? Alfa-Aesar
MP 59 TCI
Purity 95% Fluorochem
Purity 98% APIChem
PUBCHEM_PATENT_ID EP0167919A2; EP0167919B1; EP0284256A1 IBM Patent Data
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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