Chemaxon blog

12 09 2019
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Synthesis, molecular docking and biological evaluation of N,N-disubstituted 2-aminothiazolines as a new class of butyrylcholinesterase and carboxylesterase inhibitors

A series of 31 N,N-disubstituted 2-amino-5-halomethyl-2-thiazolines was designed, synthesized, and...

12 09 2019
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Screening of Pesticide and Biocide Patterns As Risk Drivers in Sediments of Major European River Mouths: Ubiquitous or River Basin-Specific Contamination?

Pesticides and biocides (PaB) are ubiquitously present in aquatic ecosystems due to their...

12 09 2019
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Purified NADH-cytochrome b5 reductase is a novel superoxide anion source inhibited by apocynin: sensitivity to nitric oxide and peroxynitrite

Cytochrome b5 reductase (Cb5R) is a pleiotropic flavoprotein that catalyzes multiple one-electron...

12 09 2019
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Site of metabolism prediction for oxidation reactions mediated by oxidoreductases based on chemical bond

MOTIVATION: The metabolites of exogenous and endogenous compounds play a pivotal role in the domain...

12 09 2019
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Far-Red and Near-Infrared Seminaphthofluorophores for Targeted Pancreatic Cancer Imaging

Molecular probes that selectively highlight pancreatic cancer (PC) tissue have the potential to...

12 09 2019
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Temperature-Dependent Estimation of Gibbs Energies Using an Updated Group-Contribution Method

Reaction-equilibrium constants determine the metabolite concentrations necessary to drive flux...

12 09 2019
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A novel codrug made of the combination of ethionamide and its potentiating booster: synthesis, self-assembly into nanoparticles and antimycobacterial evaluation

Ethionamide (ETH) is one of the most widely used second-line chemotherapeutic drugs for the...

12 09 2019
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Novel medium-throughput technique for investigating drug-cyclodextrin complexation by pH-metric titration using the partition coefficient method

The present study was aimed to develop a medium-throughput screening technique for investigation of...

12 09 2019
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Characterization of the Penetration of the Blood–Brain Barrier by High-Performance Liquid Chromatography (HPLC) Using a Stationary Phase with an Immobilized Artificial Membrane

The biological activity of drugs on organisms is associated with the pharmacokinetic properties,...

12 09 2019
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Potential of marine natural products against drug-resistant bacterial infections

Natural products have been a rich source of compounds with structural and chemical diversity for...

12 09 2019
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Occurrence of emerging persistent and mobile organic contaminants in European water samples

The release of persistent and mobile organic chemicals (PMOCs) into the aquatic environment puts...

12 09 2019
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Improvement of Cell Permeability of Human Neuronal Nitric Oxide Synthase Inhibitors Using Potent and Selective 2‑AminopyridineBased Scaffolds with a Fluorobenzene Linker

Inhibition of neuronal nitric oxide synthase (nNOS) is a promising therapeutic approach to treat...