UCSF

ZINC02539278

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) 4.23 7.75 -3.97 0 0 0 0 262.58 3

Vendor Notes

Note Type Comments Provided By
Melting_Point 29-33? Alfa-Aesar
Melting_Point 29-33° Alfa-Aesar
MP 30-32° Matrix Scientific
Boiling_Point 46?/3mm Alfa-Aesar
Boiling_Point 46°/3mm Alfa-Aesar
BP 84 / 30 TCI
Purity 97% Matrix Scientific
Warnings CORROSIVE Matrix Scientific

Activity (Go SEA)

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

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