Abstract:
2-arylbenzothiazole derivatives containing electron-donating group labeled with
11C or
123I generally displayed high binding affinity for β-amyloid (Aβ) plaques, and were potential Aβ imaging agents. In the article, Aβ binding affinity parameter, lg
Ki was used as dependent variable. Some molecule structure parameters obtained by structure optimization performed by Gaussian 98 for windows software were used as independent variable. The quantitative structure-activity relationship for twenty-eight 2-arylbenzothiazole derivatives as Aβ imaging agents was studied. The results indicate that lg
Ki is correlated linearly with lg
P, V
m, lg V
m, H
e and E
HOMO. Among them, the lipophilicity parameter (lg
P) is a main factor of affecting Aβ binding affinity.