UCSF

ZINC02529905

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) 3.82 6.55 -3.48 0 0 0 0 232.098 2

Vendor Notes

Note Type Comments Provided By
Boiling_Point 50-54?/60mm Alfa-Aesar
BP 50-54°/60 mbar Matrix Scientific
Boiling_Point 50-54°/60mm Alfa-Aesar
Purity 95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

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