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Design, Characterization, and Docking Studies of Some Novel Isatin Derivatives for Anticonvulsant and Antidepressant
Konda Swathi1, K Sowjanya2, Lavanya Sara2
1Sri Padmavathi Mahila Visvavidyalayam, Institute of Pharmaceutical Sciences, Tirupati, Andhra Pradesh, India. kswathi84@yahoo.co.in.
Abstract:
Isatin (indoline-2,3-dione) derivatives are derived from plant origin indole derivatives by the Sandmeyer method and characterized by IR, NMR, and mass spectrometric method. Molinspiration is used to calculate the molecular properties of all the synthesized compounds and to generate bioactivity scores (GPCR ligand, ion channel inhibitor, kinase inhibitor, nuclear receptor ligand, protease inhibitor, enzyme inhibitor) of the series of compounds. ADME predicted parameters are lipophilicity, P-gp substrate, GI absorption, bioavailability, lead-likeness, and blood-brain barrier (BBB) permeability by boiled egg model. Molecular docking is performed for the synthesized compounds they compared with the standard drugs.
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