Computational Assessment of a Dual-Action Ru(II)-Based Complex: Photosensitizer in Photodynamic Therapy and Intercalating Agent for Inducing DNA Damage.
Journal
Inorganic chemistry
ISSN: 1520-510X
Titre abrégé: Inorg Chem
Pays: United States
ID NLM: 0366543
Informations de publication
Date de publication:
12 Jun 2023
12 Jun 2023
Historique:
medline:
13
6
2023
pubmed:
30
5
2023
entrez:
29
5
2023
Statut:
ppublish
Résumé
A combined quantum-mechanical and classical molecular dynamics study of a recent Ru(II) complex with potential dual anticancer action is reported here. The main basis for the multiple action relies on the merocyanine ligand, whose electronic structure allows the drug to be able to absorb within the therapeutic window and in turn efficiently generate
Identifiants
pubmed: 37248070
doi: 10.1021/acs.inorgchem.3c00592
pmc: PMC10265706
doi:
Substances chimiques
Photosensitizing Agents
0
Intercalating Agents
0
Ligands
0
Ruthenium
7UI0TKC3U5
Types de publication
Journal Article
Langues
eng
Sous-ensembles de citation
IM
Pagination
8948-8959Références
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