UCSF

ZINC00112489

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) -1.02 3.32 -38.63 3 4 0 77 195.218 4

Vendor Notes

Note Type Comments Provided By
Melting_Point 208? dec. Alfa-Aesar
Melting_Point 208° dec. Alfa-Aesar
MP 216° Matrix Scientific
melting_point 217 - 219 KeyOrganics
MP 223 - 225 Enamine Building Blocks
MP 223...225 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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