Synthesis, molecular modeling study, and quantum-chemical-based investigations of isoindoline-1, 3-diones as antimycobacterial agents
The condensation of phthalic anhydride afforded structurally modified isoindoline-1, 3-dione
derivatives with selected amino-containing compounds. The title compounds (2–30) have …
derivatives with selected amino-containing compounds. The title compounds (2–30) have …
Molecular modelling study and antibacterial evaluation of diphenylmethane derivatives as potential fabi inhibitors
The need for new antibiotics has become a major worldwide challenge as bacterial strains
keep developing resistance to the existing drugs at an alarming rate. Enoyl-acyl carrier …
keep developing resistance to the existing drugs at an alarming rate. Enoyl-acyl carrier …
Rational design based on bioactive conformation analysis of pyrimidinylbenzoates as acetohydroxyacid synthase inhibitors by integrating molecular docking, CoMFA …
YZ He, YX Li, XL Zhu, Z Xi, C Niu, J Wan… - Journal of chemical …, 2007 - ACS Publications
Pyrimidinylthiobenzoates constitute an important kind of herbicides targeting
acetohydroxyacid synthase (AHAS, EC 2.2. 1.6), which catalyze the first common step in …
acetohydroxyacid synthase (AHAS, EC 2.2. 1.6), which catalyze the first common step in …
Design, synthesis, molecular docking and in silico ADMET investigations of novel piperidine-bearing cinnamic acid hybrids as potent antimicrobial agents
In order to combat microbial infections and to address the issue of multi-drug resistance, a
class of novel piperidine-bearing cinnamic acid hybrids 4a–4l were synthesized and …
class of novel piperidine-bearing cinnamic acid hybrids 4a–4l were synthesized and …
Synthesis, structure, molecular docking, and structure–activity relationship analysis of enamines: 3-Aryl-4-alkylaminofuran-2 (5H)-ones as potential antibacterials
ZP Xiao, XB He, ZY Peng, TJ Xiong, J Peng… - Bioorganic & medicinal …, 2011 - Elsevier
Thirty-one 3-aryl-4-alkylaminofuran-2 (5H)-ones were designed, prepared and tested for
their antibacterial activity. Some of them showed significant antibacterial activity against …
their antibacterial activity. Some of them showed significant antibacterial activity against …
Synthesis, docking, computational studies, and antimicrobial evaluations of new dipeptide derivatives based on nicotinoylglycylglycine hydrazide
HS Khalaf, AM Naglah, MA Al-Omar, GO Moustafa… - Molecules, 2020 - mdpi.com
Within a series of dipeptide derivatives (5–11), compound 4 was refluxed with d-glucose, d-
xylose, acetylacetone, diethylmalonate, carbon disulfide, ethyl cyanoacetate, and ethyl …
xylose, acetylacetone, diethylmalonate, carbon disulfide, ethyl cyanoacetate, and ethyl …
Novel benzimidazole-based compounds as antimicrobials: Synthesis, molecular docking, molecular dynamics and in silico ADME profile studies
© 2022 Slovensko Kemijsko Drustvo. All rights reserved. Some novel benzimidazole
derivatives were synthesized and their antimicrobial activities were evaluated. Compounds …
derivatives were synthesized and their antimicrobial activities were evaluated. Compounds …
Studies of Staphylococcus Aureus Fabi Inhibitors: Fragment-Based Approach Based on Holographic Structure–Activity Relationship Analyses
T Kronenberger, LR Asse Jr, C Wrenger… - Future medicinal …, 2017 - Taylor & Francis
Aim: FabI is a key enzyme in the fatty acid metabolism of Gram-positive bacteria such as
Staphylococcus aureus and is an established drug target for known antibiotics such as …
Staphylococcus aureus and is an established drug target for known antibiotics such as …
In vitro antibacterial and in silico docking studies of two Schiff bases on Staphylococcus aureus and its target proteins
JT Kakkassery, VP Raphael, R Johnson - Future Journal of …, 2021 - Springer
Background Schiff base compounds have extensive applications in various fields such as
analytical, inorganic, organic, and biological fields. They have excellent pharmacology …
analytical, inorganic, organic, and biological fields. They have excellent pharmacology …
Insight into the screening of potential beta-lactamase inhibitors as anti-bacterial chemical agents through pharmacoinformatics study
P Parida, S Bhowmick, A Saha… - Journal of Biomolecular …, 2021 - Taylor & Francis
Drug resistance is an unsolved and major concern in the bacterial infection. Continuous
development of drug-resistance to the antibiotics exponentially rises the danger of bacterial …
development of drug-resistance to the antibiotics exponentially rises the danger of bacterial …