Comprehensive Characterization of Lantana camara Essential Oil from Angola: GC-MS Profiling, Antioxidant Capacity, and Drug-likeness Prediction

<i>Lantana camara</i> L. (<i>Verbenaceae</i>) is a medicinal plant widely used in traditional medicine in Angola, especially for its anti-inflammatory effects. This study evaluated the chemical composition of <i>L. camara</i> essential oil from leaves (Lc-EO) collected in Uíge Province, Angola. GC-MS analysis enabled the identification of 96 volatile compounds, with sesquiterpenes and monoterpenes as the predominant constituents. Among them, β-caryophyllene (14.49%), sabinene (9.13%), bicyclogermacrene (8.18%), α-humulene (5.66%), nerolidol (5.29%), and 1,8-cineole (5.14%) were identified as major components. The antioxidant activity of Lc-EO was assessed using DPPH, ABTS, and superoxide anion (O₂^•-) assays. Lc-EO showed strong activity in the DPPH assay (IC₅₀ = 0.72 µg/mL), moderate activity in the ABTS assay (IC₅₀ = 87.5 µg/mL), but minimal effect on O₂^•- radicals (IC₅₀ = 1491 µg/mL). It also significantly inhibited lipid peroxidation (IC₅₀ = 236.2 µg/mL). The anti-inflammatory activity of Lc-EO was assessed through its ability to inhibit protein denaturation, exhibiting a moderate effect with 28% inhibition. In silico ADMET predictions suggested drug-like properties and low predicted systemic toxicity for major compounds. The <i>Artemia salina</i> lethality assay indicated moderate general toxicity (IC₅₀ = 154.1 µg/mL), whereas the MTT viability assay revealed higher cytotoxic potency of Lc-EO (IC₅₀ = 31.58 µg/mL), highlighting model-dependent differences in sensitivity. Overall, <i>L. camara</i> essential oil shows relevant bioactivity consistent with its traditional use, particularly antioxidant and anti-inflammatory effects, while its cytotoxicity highlights the need for safety evaluation. These findings indicate that the assayed oil is a promising source of bioactive compounds, but further studies are required to support its development as a safe pharmaceutical raw material.