UCSF

ZINC38141473

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) 7.89 14.34 -4.91 0 2 0 26 296.495 16

Vendor Notes

Note Type Comments Provided By
Mp [°C] 20 Acros Organics
Boiling_Point 168-170?/2mm Alfa-Aesar
Boiling_Point 168-170°/2mm Alfa-Aesar
BP [°C] 186 (p=9 torr) Acros Organics
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics
Patent Database Links US2003195367; US2006160891; US2007237741; US2007237742 ChEBI

Activity (Go SEA)

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