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QSAR studies of hydrazone uncouplers of oxidative phosphorylation
D A Winkler1, G Holan, D R Smith
1CSIRO Division of Chemicals and Polymers, Melbourne, Australia.
Drug Design and Delivery
|July 1, 1988
Abstract:
Semiempirical molecular orbital calculations have been performed on a series of hydrazone uncouplers of mitochondrial oxidative phosphorylation which show insecticidal activity. Regression analysis yielded significant correlations between uncoupling activity, insecticidal potency and such physicochemical or theoretically-derived parameters as lipophilicity, pKa and atom charges.