Why Ortho- and Para-Hydroxy Metabolites Can Scavenge Free Radicals That the Parent Atorvastatin Cannot? Important Pharmacologic Insight from Quantum Chemistry.

Bâldea, Ioan

Bâldea, Ioan.

Affiliation

Bâldea I; Theoretical Chemistry, Heidelberg University, Im Neuenheimer Feld 229, D-69120 Heidelberg, Germany.

Molecules ; 27(15)2022 Aug 08.

Article in En | MEDLINE | ID: mdl-35956986

Subject(s)

Hydrogen; Protons; Antioxidants/chemistry; Atorvastatin; Free Radical Scavengers/chemistry; Free Radicals/chemistry; Hydrogen/chemistry; Thermodynamics

Key words

DPPH radical; HAT; SET-PT; SPLET; antioxidant mechanisms; atorvastatin; global chemical reactivity indices; quantum chemistry; radical-scavenging activity; solvent effects

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Full text: 1 Collection: 01-internacional Database: MEDLINE Main subject: Protons / Hydrogen Language: En Journal: Molecules Journal subject: BIOLOGIA Year: 2022 Document type: Article Affiliation country: Germany

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