UCSF

ZINC00156519

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) 1.78 4.25 -45.92 3 3 1 54 186.275 4
Mid Mid (pH 6-8) 1.78 3.94 -5.55 2 3 0 52 185.267 4

Vendor Notes

Note Type Comments Provided By
melting_point 158 - 160 KeyOrganics
Melting_Point 158-162? Alfa-Aesar
Melting_Point 158-162° Alfa-Aesar
Melting_Point ca 160? dec. Alfa-Aesar
Melting_Point ca 160° dec. Alfa-Aesar

Activity (Go SEA)

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

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