UCSF

ZINC02597098

Annotations

Vendors

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) -0.06 0.09 -97.28 1 6 -2 109 154.081 2

Vendor Notes

Note Type Comments Provided By
melting_point 287 - 289 KeyOrganics
MP 287° Matrix Scientific
Mp [°C] 292 - 295 Acros Organics
MP 292-295° Matrix Scientific
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Purity 97% Fluorochem
Melting_Point ca 294? dec. Alfa-Aesar
Melting_Point ca 294° dec. Alfa-Aesar
Warnings IRRITANT Matrix Scientific
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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

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