Synthesis, characterization, DFT calculations, antimicrobial activity, molecular docking, and ADMET study of new pyrazole-carboxamide derivatives

pkCSM: Predicting Small-Molecule Pharmacokinetic and Toxicity Properties Using Graph-Based Signatures

Douglas E. V. Pires, Tom L. Blundell, David B. Ascher · Journal of Medicinal Chemistry · 2015 · 5.4K citations · Full text

Pharmacy, Pharmacokinetics, Pharmacology +17

Gabedit—A graphical user interface for computational chemistry softwares

A. Allouche · Journal of Computational Chemistry · 2010 · 2.4K citations · Full text

Natural Sciences, Chemistry, Computational Chemistry +16

Synthesis, structure–activity relationships, and in vitro antibacterial and antifungal activity evaluations of novel pyrazole carboxylic and dicarboxylic acid derivatives

Samet Mert, Rahmi Kasımoğulları, Tuba İça et al. · European Journal of Medicinal Chemistry · 2014 · 169 citations

Pharmacy, Medicinal Chemistry, Pharmacology +17

One-pot synthesis of amides from carboxylic acids activated using thionyl chloride

Antonella Leggio, Emilia Lucia Belsito, Maria Luisa Di Gioia et al. · RSC Advances · 2016 · 114 citations

Natural Sciences, Chemistry, Organic Chemistry +6

Synthesis, Molecular structure, Spectral Characterization, Molecular docking and biological activities of (E)-N-(2-methoxy benzylidene) anthracene-2-amine and Co(II), Cu(II) and Zn(II) complexes

P.G. Aravindan, K. Sivaraj, C. Kamal et al. · Journal of Molecular Structure · 2020 · 65 citations

Natural Sciences, Chemistry, Medicinal Chemistry +17