Imidazolium ionic liquids as effective antiseptics and disinfectants against drug resistant S. aureus: In silico and in vitro studies

D Hodyna, V Kovalishyn, I Semenyuta… - … Biology and Chemistry, 2018 - Elsevier
Аbstract This paper describes Quantitative Structure-Activity Relationships (QSAR) studies,
molecular docking and in vitro antibacterial activity of several potent imidazolium-based …

Structure-activity relationship modeling and experimental validation of the imidazolium and pyridinium based ionic liquids as potential antibacterials of MDR …

IV Semenyuta, MM Trush, VV Kovalishyn… - International Journal of …, 2021 - mdpi.com
Online Chemical Modeling Environment (OCHEM) was used for QSAR analysis of a set of
ionic liquids (ILs) tested against multi-drug resistant (MDR) clinical isolate Acinetobacter …

Predictive modeling of antibacterial activity of ionic liquids by machine learning methods

DM Makarov, YA Fadeeva, EA Safonova… - … Biology and Chemistry, 2022 - Elsevier
Structural variation and different bioactivity of ionic liquids (ILs) make them highly promising
for the development of novel biocides. Application of computational methods to the …

Antibacterial activity of imidazolium‐based ionic liquids investigated by QSAR modeling and experimental studies

D Hodyna, V Kovalishyn, S Rogalsky… - Chemical Biology & …, 2016 - Wiley Online Library
Predictive QSAR models for the inhibitors of B. subtilis and P s. aeruginosa among
imidazolium‐based ionic liquids were developed using literary data. The regression QSAR …

Synthesis, Characterization, Biological Evaluation, and In Silico Studies of Imidazolium-, Pyridinium-, and Ammonium-Based Ionic Liquids Containing n-Butyl Side …

R Hassan, F Nazir, M Roosh, A Qaisar, U Habib… - Molecules, 2022 - mdpi.com
Ionic liquids (ILs) have emerged as active pharmaceutical ingredients because of their
excellent antibacterial and biological activities. Herein, we used the green-chemistry …

Antimicrobial properties of novel ionic liquids derived from imidazolium cation with phenolic functional groups

L Guzmán, C Parra-Cid, E Guerrero-Muñoz… - Bioorganic …, 2021 - Elsevier
Bacterial infections are nowadays among the major threats to public health worldwide. Thus,
there is an urgent and increased need for new antimicrobial agents. As a result, the …

New 1, 3-oxazolylphosphonium salts as potential biocides: QSAR study, synthesis, antibacterial activity and toxicity evaluation

MM Trush, V Kovalishyn… - Letters in Drug …, 2018 - ingentaconnect.com
Background: Due to the increase of multidrug-resistant microorganisms, the search for
biologically active molecules does not stop. In the present study, we developed the effective …

Synthesis, evaluation, and in silico studies of imidazolium and pyridinium-based ionic liquids with Dioctyl succinamic acid anion for enhanced antibacterial …

SH Kazmi, A Arshad, S Hafeez, F Adnan… - Journal of Molecular …, 2024 - Elsevier
A substantial public health risk is bacterial infections, but the effectiveness of antibiotics has
declined due to their overuse. In the quest for effective antimicrobial agents, Ionic liquids …

Synthesis, spectroscopic and molecular docking studies of imidazolium and pyridinium based ionic liquids with HSA as potential antimicrobial agents

MM Trush, IV Semenyuta, SI Vdovenko… - Journal of Molecular …, 2017 - Elsevier
The interaction between human serum albumin (HSA) and synthesized imidazolium and
pyridinium based ionic liquids (ILs), as good potential microbial growth inhibitors, was …

In silico and in vitro studies of a number PILs as new antibacterials against MDR clinical isolate Acinetobacter baumannii

MM Trush, V Kovalishyn, D Hodyna… - Chemical Biology & …, 2020 - Wiley Online Library
QSAR analysis of a set of previously synthesized phosphonium ionic liquids (PILs) tested
against Gram‐negative multidrug‐resistant clinical isolate Acinetobacter baumannii was …