UCSF

ZINC01677974

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) 4.08 1.07 -6.1 2 3 0 52 253.301 5

Vendor Notes

Note Type Comments Provided By
Boiling_Point 322? Alfa-Aesar
Boiling_Point 322° Alfa-Aesar
Melting_Point 64-66? Alfa-Aesar
Melting_Point 64-66° Alfa-Aesar

Activity (Go SEA)

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