UCSF

ZINC00090873

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) 1.92 0.48 -8.05 2 3 0 60 226.084 1

Vendor Notes

Note Type Comments Provided By
MP 160 TCI
MP 161 - 163 Enamine Building Blocks
Melting_Point 161-165? Alfa-Aesar
MP 161-165° Oakwood Chemical
MP 161...163 Enamine Building Blocks
MP 170 - 172 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% Fluorochem
PUBCHEM_PATENT_ID EP0011392A1; US4168170; US4264725 IBM Patent Data

Activity (Go SEA)

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