Alkylated benzimidazoles: Design, synthesis, docking, DFT analysis, ADMET property, molecular dynamics and activity against HIV and YFV

A series of alkylated benzimidazole derivatives was synthesized and screened for their anti-HIV, anti-YFV, and broad-spectrum antiviral properties. The physicochemical parameters and drug-like properties of the compounds were assessed first, and then docking studies and MD simulations on HIV-RT allo...

Descripció completa

Guardat en:
Dades bibliogràfiques
Publicat a:Comput Biol Chem
Autors principals: Srivastava, Ritika, Gupta, Sunil K., Naaz, Farha, Sen Gupta, Parth Sarthi, Yadav, Madhu, Singh, Vishal Kumar, Singh, Anuradha, Rana, Malay Kumar, Gupta, Satish Kumar, Schols, Dominique, Singh, Ramendra K.
Format: Artigo
Idioma:Inglês
Publicat: Elsevier Ltd. 2020
Matèries:
Article
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC7537607/
https://ncbi.nlm.nih.gov/pubmed/33068917
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.compbiolchem.2020.107400
Etiquetes: Afegir etiqueta
Sense etiquetes, Sigues el primer a etiquetar aquest registre!

Ítems similars