UCSF

ZINC04101055

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) 0.68 1.17 -11.29 3 4 0 64 192.218 2

Vendor Notes

Note Type Comments Provided By
Melting_Point 107-111? Alfa-Aesar
Melting_Point 107-111° Alfa-Aesar
MP 110 TCI
Purity 95+% Matrix Scientific
Purity 97% Fluorochem
PUBCHEM_PATENT_ID EP0486666A1; EP0486666B1; EP0636623A1; EP0782570A1; EP0796258A1; EP0843672A1; EP0843673A1; US5399574; US5466699; US5854247; US5863935; US6025374; US6084103; US6160123; WO1991018897A1; WO1996009294A1; WO1996017842A1; WO1997006162A1; WO1997006163A1 IBM Patent Data
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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