UCSF

ZINC04175349

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) 7.62 13.52 -1.36 1 1 0 20 386.664 5

Vendor Notes

Note Type Comments Provided By
Melting_Point 147-150? Alfa-Aesar
Melting_Point 147-150° Alfa-Aesar
Boiling_Point 360? Alfa-Aesar
Boiling_Point 360° Alfa-Aesar
Therapy emulsifying agent SMDC Pharmakon
PUBCHEM_PATENT_ID EP0892963A1; WO1997027559A1 IBM Patent Data

Activity (Go SEA)

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