Novel quercetin and apigenin-acetamide derivatives: design, synthesis, characterization, biological evaluation and molecular docking studies
Daniel Isika, Mustafa Çeşme, Francis J. Osonga, Omowunmi A. Sadik
Abstract
, for 1S3 and 2S3, respectively. The compound-DNA docked model correlated with our experimental results, and they are groove binders. Furthermore, mutagenicity potential was examined. 1S3 and its metabolites showed no mutagenic activity for both TA98 and TA100 strains. 2S3 did not show any mutagenic activity for the strain TA 98, while its metabolites were only active at high doses. Both 2S3 and its metabolites showed mutagenic activity in the TA100 strain.
Topics & Concepts
ApigeninAcetamideDocking (animal)ChemistryQuercetinCombinatorial chemistryFlavonoidStereochemistryMoleculeComputational biologyBiochemistryOrganic chemistryBiologyAntioxidantMedicineNursingComputational Drug Discovery MethodsPhytochemicals and Antioxidant ActivitiesNatural product bioactivities and synthesis