UCSF

ZINC00439311

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) 4.15 9.46 -47.15 0 2 -1 40 265.21 3

Vendor Notes

Note Type Comments Provided By
Melting_Point 167-170? Alfa-Aesar
Melting_Point 167-170° Alfa-Aesar
MP 169 - 171 Enamine Building Blocks
MP 169-171° Matrix Scientific
MP 169...171 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 97% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

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