Design and Synthesis of Carbothioamide/Carboxamide-Based Pyrazoline Analogs as Potential Anticancer Agents: Apoptosis, Molecular Docking, ADME Assay, and DNA Binding Studies
Manish Rana, Md Imam Faizan, Sajad Hussain Dar, Tanveer Ahmad, Rahis Uddin
Abstract
values of 0.132 ± 0.012 and 0.215 ± 0.025 μg/mL, respectively. In silico molecular docking of pyrazoline derivatives was also performed using autodock vina software against the DNA hexamer with PDB ID: 1Z3F and ADMET properties to explore their best hits.
Topics & Concepts
HeLaChemistryPyrazolineMTT assayDocking (animal)ADMEIC50A549 cellStereochemistryApoptosisBiochemistryIn vitroMedicinal chemistryNursingMedicineSynthesis and biological activitySynthesis and Characterization of Heterocyclic CompoundsClick Chemistry and Applications