UCSF

ZINC54965453

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) 1.31 4.06 -11.26 3 6 0 91 294.351 10

Vendor Notes

Note Type Comments Provided By
Melting_Point 115-118? Alfa-Aesar
Melting_Point 115-118° Alfa-Aesar
MP 115-118°C Indofine
Purity 95% Fluorochem
Purity 98% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

Rings

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