UCSF

ZINC00136169

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) 4.93 2.37 -47.42 1 3 -1 60 277.384 5

Vendor Notes

Note Type Comments Provided By
melting_point 1.720000000000000e+002 - 1.740000000000000e+002 KeyOrganics
MP 165 - 167 Enamine Building Blocks
MP 165...167 Enamine Building Blocks
melting_point 172 - 174 KeyOrganics
Melting_Point 172-175? Alfa-Aesar
mp 199 MolMall (formerly Molecular Diversity Preservation International)
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 98% Fluorochem
PUBCHEM_PATENT_ID EP0573393B1; US5310773 IBM Patent Data
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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