Design, synthesis and biological evaluation of novel 5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazole-3-thiols as an anticancer agent

Title
Design, synthesis and biological evaluation of novel 5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazole-3-thiols as an anticancer agent
Authors
Keywords
Structure-based design, 1,2,4-triazole-3-thiol, Single crystal X-ray diffraction, Molecular docking and dynamics, In silico ADME, In vitro antiproliferative activity
Journal
JOURNAL OF MOLECULAR STRUCTURE
Volume 1231, Issue -, Pages 130000
Publisher
Elsevier BV
Online
2021-01-28
DOI
10.1016/j.molstruc.2021.130000

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