UCSF

ZINC04528806

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Vendors

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) 2.36 2.47 -5.63 1 2 0 33 121.139 1
Ref Reference (pH 7) 1.54 2.55 -3.29 0 2 0 29 121.139 2
Ref Reference (pH 7) 2.36 2.32 -5.07 1 2 0 33 121.139 1

Vendor Notes

Note Type Comments Provided By
Boiling_Point 118-120?/10mm Alfa-Aesar
Boiling_Point 118-120°/10mm Alfa-Aesar
BP 123 / 28 TCI
Melting_Point 33-35? Alfa-Aesar
Melting_Point 33-35° Alfa-Aesar
Purity 90% Fluorochem
Purity 94% Fluorochem

Activity (Go SEA)

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