UCSF

ZINC00056519

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) 1.45 4.01 -115.3 0 4 -2 80 236.076 2

Vendor Notes

Note Type Comments Provided By
MP 154 TCI
MP 162-164° Matrix Scientific
Purity 97% Matrix Scientific
Melting_Point ca 156? Alfa-Aesar
Melting_Point ca 156° Alfa-Aesar
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

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