UCSF

ZINC01699410

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) 3.97 6.07 -0.02 0 0 0 0 112.216 1

Vendor Notes

Note Type Comments Provided By
Boiling_Point 124?/0.1mm Alfa-Aesar
Boiling_Point 124°/0.1mm Alfa-Aesar
BP 126 TCI
Melting_Point 134-137? Alfa-Aesar
Melting_Point 134-137° Alfa-Aesar
Melting_Point 222?/10mm subl. Alfa-Aesar
Melting_Point 222°/10mm subl. Alfa-Aesar

Activity (Go SEA)

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