UCSF

ZINC02007479

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) 1.63 3.31 -8.58 1 3 0 50 175.187 0

Vendor Notes

Note Type Comments Provided By
Melting_Point 244-248? Alfa-Aesar
Melting_Point 244-248° Alfa-Aesar
Mp [°C] 245 Acros Organics
MP 245 - 247 Enamine Building Blocks
MP 245...247 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 96% Fluorochem
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.