1, 2, 3-Triazoles of 8-hydroxyquinoline and HBT: Synthesis and studies (DNA binding, antimicrobial, molecular docking, ADME, and DFT)
A new series of 1, 2, 3-triazole hybrids containing either 2-or 4-hydroxyphenyl benzothiazole
(2-or 4-HBT) and naphthalen-1-ol or 8-hydroxyquinoline (8-HQ) was synthesized in high …
(2-or 4-HBT) and naphthalen-1-ol or 8-hydroxyquinoline (8-HQ) was synthesized in high …
Synthesis and biological evaluation of anti-tubercular activity of Schiff bases of 2-Amino thiazoles
R Cordeiro, M Kachroo - Bioorganic & Medicinal Chemistry Letters, 2020 - Elsevier
Tuberculosis, an infectious disease, has been reported to cause the death of 1.5 million in
2018. Due to the emergence of Multi-Drug Resistant-TB, Extensively Drug Resistant-TB, and …
2018. Due to the emergence of Multi-Drug Resistant-TB, Extensively Drug Resistant-TB, and …
In silico approach for potential antimicrobial agents through antiviral, molecular docking, molecular dynamics, pharmacokinetic and bioactivity predictions of …
SMA Kawsar, MA Hosen, Y El Bakri… - Arab Journal of Basic …, 2022 - Taylor & Francis
Carbohydrates derivatives played an important and vital role in a large part to design new
potential drug against various pathogens, in medicinal chemistry. Also, monosaccharide …
potential drug against various pathogens, in medicinal chemistry. Also, monosaccharide …
Novel piperazine based compounds as potential inhibitors for SARS-CoV-2 Protease Enzyme: Synthesis and molecular docking study
Structurally diverse piperazine-based compounds hybrid with thiadiazole, isatin or with
sulfur/nitrogen, functionalities were synthesized. The structures of the new compounds were …
sulfur/nitrogen, functionalities were synthesized. The structures of the new compounds were …
Molecular hybrid of 1, 2, 3-triazole and schiff base as potential antibacterial agents: DFT, molecular docking and ADME studies
Hybrid drugs help combat antibacterial drug resistance, which is an increasing problem
globally. In addition to saving time and money, hybrid drugs offer multiple benefits. Using the …
globally. In addition to saving time and money, hybrid drugs offer multiple benefits. Using the …
[HTML][HTML] Anti-inflammatory activity screening of Kalanchoe pinnata methanol extract and its validation using a computational simulation approach
H Agarwal, VK Shanmugam - Informatics in Medicine Unlocked, 2019 - Elsevier
Anti-inflammatory activity possessing bio-compounds were identified from Kalanchoe
pinnata methanolic leaf extract using Gas chromatography-mass spectrometry (GC-MS) …
pinnata methanolic leaf extract using Gas chromatography-mass spectrometry (GC-MS) …
[HTML][HTML] Molecular simulation-based investigation of highly potent natural products to abrogate formation of the nsp10–nsp16 complex of sars-cov-2
The SARS-CoV-2 non-structural protein (nsp) nsp10–nsp16 complex is essential for the 2′-
O-methylation of viral mRNA, a crucial step for evading the innate immune system, and it is …
O-methylation of viral mRNA, a crucial step for evading the innate immune system, and it is …
[HTML][HTML] A model to study the inhibition of nsP2B-nsP3 protease of dengue virus with imidazole, oxazole, triazole thiadiazole, and thiazolidine based scaffolds
A theoretical model was developed to allosterically inhibit the biological activity of dengue
virus (DENV) by targeting the non-structural protein ns2B-nsP3 protease based on the in …
virus (DENV) by targeting the non-structural protein ns2B-nsP3 protease based on the in …
Chemical constituents isolated from the aerial parts of Helleborus cyclophyllus (A. Braun) Boiss.(Ranunculaceae), evaluation of their antioxidant and anti-inflammatory …
OS Tsiftsoglou, MK Stefanakis… - Natural Product …, 2022 - Taylor & Francis
Chemical investigation of ethyl acetate extract from the aerial parts of Helleborus
cyclophyllus (A. Braun) Boiss. led to the isolation of ten natural products, and their structures …
cyclophyllus (A. Braun) Boiss. led to the isolation of ten natural products, and their structures …
Investigations on a novel biologically active organic molecule of 5-Chloro-1-(4-piperidyl)-2-benzimidazolinone by spectroscopic, molecular docking, and quantum …
R Arivazhagan, C Sridevi, A Prakasam - Journal of Molecular Structure, 2023 - Elsevier
Abstract The FT-IR, FT-Raman, UV-Vis, 1 H, and 13 C NMR spectroscopic, molecular
structure, and electronic behavior of 5-Chloro-1-(4-piperidyl)-2-benzimidazolinone (CPBI) …
structure, and electronic behavior of 5-Chloro-1-(4-piperidyl)-2-benzimidazolinone (CPBI) …