UCSF

ZINC00409168

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) 0.72 -0.54 -8.85 2 3 0 50 168.192 4

Vendor Notes

Note Type Comments Provided By
BP 202 / 22 TCI
Boiling_Point 315? Alfa-Aesar
Boiling_Point 315° Alfa-Aesar
MP 54 TCI
MP 54-56° Oakwood Chemical
Melting_Point 56-60? Alfa-Aesar
Melting_Point 56-60° Alfa-Aesar

Activity (Go SEA)

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