UCSF

ZINC00409765

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) 2.59 1.03 -47.01 0 2 -1 40 155.217 2

Vendor Notes

Note Type Comments Provided By
Melting_Point 5? Alfa-Aesar
Melting_Point Alfa-Aesar
Boiling_Point 264-266? Alfa-Aesar
Boiling_Point 264-266° Alfa-Aesar
Melting_Point 30-34? Alfa-Aesar
Melting_Point 30-34° Alfa-Aesar
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0055917A1; US4397849 IBM Patent Data
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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