Results 101 to 110 of about 10,523 (171)

Molecular modelling and antimicrobial activity of newly synthesized benzothiazolo[3,2-a]pyrimidine clubbed thiazole derivatives

Heliyon
A series of benzothiazolopyrimidine-thiazole conjugates 7, 8, and 9 were produced through the reactions of 8-acetylbenzothiazolopyrimidine-thiosemicarbazone compound 6 with chloroacetone, (un)substituted phenacyl chlorides, and ethyl chloroacetate ...
Arwa Alharbi, Adel I. Alalawy, Shaker T. Alsharif, Alaa M. Alqahtani, Ali H. Alessa, Mansoor Alsahag, Ali Alisaac, Nashwa M. El-Metwaly   +7 more
doaj   +1 more source

Консенсус-прогноз фармакокінетичних параметрів ADMET для лікоподібних молекул з використанням онлайн-платформ SWISSADME та ADMETLAB 3.0

Науковий керівник: Кириченко Олександр Васильович, доктор хімічних наук, старший науковий співробітник кафедри органічної хіміїВивчені та порівняні дві безкоштовних онлайн-платформ SwissADME та AMDETLab 3.0, аналізі їх характеристик, врахування ...
Зосімова, Любов Владиславівна
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Structural activity of synthesized pyrimidine-thiophene and pyrimidine-thiadiazole conjugates as anticancer agents

Results in Chemistry
New pyrimidine linked thiophene conjugates 5a-d and thiadiazole conjugates 7a-d through a carboxamide bridge were synthesized and characterized by the spectral data (IR, NMR and mass).
Abeer Mogadem, Abrar Bayazeed, Abdulmajeed F. Alrefaei, Sara A. Alqarni, Jihan Qurban, Majid A. Bamaga, E.F.M. El-Zaidia, Nashwa M. El-Metwaly   +7 more
doaj   +1 more source

In silico prediction of octahydro-1H-indole-2-carboxamide derivatives as novel acetylcholinesterase inhibitors: a comprehensive computational study

Egyptian Journal of Medical Human Genetics
Background Alzheimer’s disease (AD) is a progressive neurodegenerative disorder characterised by cognitive decline and memory loss. Acetylcholinesterase (AChE)inhibition remains a crucial therapeutic strategy for AD treatment.
Satyavani Meesala, Swathi Nageswara, Rajkiran Kolakota, Muni Kumar Dokka, Mumpi Giri, Priyadarsini Bada, Vidya Sagar Jerra   +6 more
doaj   +1 more source

Study of the Lipophilicity and ADMET Parameters of New Anticancer Diquinothiazines with Pharmacophore Substituents

Pharmaceuticals
Lipophilicity is one of the principal parameters that describe the pharmacokinetic behavior of a drug, including its absorption, distribution, metabolism, elimination, and toxicity.
Daria Klimoszek, Małgorzata Jeleń, Małgorzata Dołowy, Beata Morak-Młodawska   +3 more
doaj   +1 more source

Design and Synthesis of Hybrid Compounds for Potential Treatment of Bacterial Co-Infections: In Vitro Antibacterial and In Silico Studies

Antibiotics
Background: The need for innovative therapeutic strategies to enhance patient outcomes has increased due to the rise in bacterial co-infections associated with COVID-19. Methods: In this study, ten hybrid compounds were synthesized by combining two known
Vuyolwethu Khwaza, Opeoluwa O. Oyedeji, Eric Morifi, Mutshinyalo Nwamadi, Thierry Youmbi Fonkui, Derek Tantoh Ndinteh, Blessing A. Aderibigbe   +6 more
doaj   +1 more source

Evaluation of synthesized methoxy chalcones for therapeutic potential through in vitro and in silico methods [PDF]

Chalcones are the precursors of flavonoids and have a wide range of biological activities. A series of methoxy chalcones (1-12) were synthesized using the Claisen-Schmidt method and identified by NMR analyses.
Tatar Yılmaz, Gizem, Şener, Sıla Özlem, Yalçın, Can Özgür, Yaylı, Nurettin, Aliyazıcıoğlu, Rezzan, Erik, Zeynep, Erik, İshak, Karaoğlu, Şengül Alpay, TATAR YILMAZ, GİZEM, ALİYAZICIOĞLU, REZZAN, YALÇIN, CAN ÖZGÜR, ALPAY KARAOĞLU, ŞENGÜL, YAYLI, NURETTİN, ŞENER, SILA ÖZLEM   +13 more
core   +1 more source

Design and Synthesis of Caffeine-Based Derivatives with Antioxidant and Neuroprotective Activity: In Vitro Evaluation and SwissADME Profiling

Antioxidants
Oxidative stress and excitotoxicity are key contributors to neuronal damage in various neurodegenerative diseases. Caffeine, a widely used neuroactive compound with moderate antioxidant properties, may benefit from structural modifications to enhance its
Denitsa Stefanova, Alime Garip, Virginia Tzankova, Stefan Kostov, Emilio Mateev, Alexander Zlatkov, Yavor Mitkov   +6 more
doaj   +1 more source

Identification of a novel natural compound inhibitor targeting AmpC β-lactamase to combat multidrug-resistant Pseudomonas aeruginosa

Frontiers in Microbiology
IntroductionAntimicrobial resistance (AMR) remains one of the most urgent threats to global public health, driven by the rising prevalence of multidrug-resistant (MDR) pathogens such as Pseudomonas aeruginosa.
Santhosh Mudipalli Elavarasu, Sasikumar K   +1 more
doaj   +1 more source

Untargeted GC–MS metabolic profiling of Eurotium chevalieri AUMC 16390 (PX498623) reveals a putative steroidal metabolite with antibacterial and anti-inflammatory potential

BMC Biotechnology
Background This study investigated the exometabolome bioactive metabolites produced by Eurotium chevalieri AUMC 16,390 (accession number PX498623), a strain identified through ITS rDNA sequencing with 100% identity.
O. M. O. El-Maghraby, Kaoud Salama, M. S. Youssef, M. Marwa Abdel-Kareem, A. Randa Fathy   +4 more
doaj   +1 more source