UCSF

ZINC89222411

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
Hi High (pH 8-9.5) 1.38 4.59 -93.23 7 7 2 113 396.52 4

Vendor Notes

Note Type Comments Provided By
Melting_Point 70? Alfa-Aesar
Melting_Point 70° Alfa-Aesar
Boiling_Point 218-220? Alfa-Aesar
Boiling_Point 218-220° Alfa-Aesar
Purity 95% Fluorochem
Patent Database Links EP1342716; WO2005054245 ChEBI

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.