Synthesis, antimicrobial and cytotoxic activities of tetrazole <em>N</em>-Mannich base derivatives: Investigation of DFT calculation, molecular docking, and Swiss ADME studies

Publication date: 15 March 2024Source: Journal of Molecular Structure, Volume 1300Author(s): Velmurugan Loganathan, Idhayadhulla Akbar, Anis Ahamed, Hissah Abdulrahman Alodaini, Ashraf Atef Hatamleh, Mohaed Hussain Syed Abuthkir, Raman Gurusamy

Photophysical properties of 3-arylthioimidazo[1,2-<em>a</em>]pyridine derivatives: The role of peripheral electron-donating and electron-withdrawing groups in the advance of organic materials engineering

Publication date: 15 March 2024Source: Journal of Molecular Structure, Volume 1300Author(s): Leandro H. Zucolotto Cocca, João V.P. Valverde, Julie le Bescont, Chloé Breton-Patient, Sandrine Piguel, Daniel L. Silva, Cleber R. Mendonca, Leonardo De Boni

Synthesis, crystal structure, Hirshfeld surface analysis and DFT calculations of novel clusianone analogues as anticancer agents that downregulate β-tubulin and Cdk1/Cyclin B1

Publication date: 15 March 2024Source: Journal of Molecular Structure, Volume 1300Author(s): Mohammed Khaled Bin Break, Sree Vaneesa Nagalingam, Kok Wai-Ling, Weiam Hussein, Saad Alqarni, Christophe Wiart, Teng-Jin Khoo