Computational study of ADME-Tox prediction of selected phytochemicals from Punica granatum peels

Pomegranate ( ) is one of the oldest well-known edible fruits, which has originated in Central Asia but now it has a widespread geographical distribution throughout the world. Phytochemicals are isolated from the pomegranate peels that show different nutritional and pharmaceutical properties. Absorp...

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Bibliographic Details
Published in:Open Chemistry 2024-02, Vol.22 (1), p.253-8
Main Authors: Batool, Aneeqa, Parveen, Shagufta, Shafiq, Nusrat, Rashid, Maryam, Salamatullah, Ahmad Mohammad, Ibenmoussa, Samir, Bourhia, Mohammed
Format: Article
Language:English
Subjects:
absorption
ADMET
bioavailability
lipophilicity
PC properties
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Summary:Pomegranate ( ) is one of the oldest well-known edible fruits, which has originated in Central Asia but now it has a widespread geographical distribution throughout the world. Phytochemicals are isolated from the pomegranate peels that show different nutritional and pharmaceutical properties. Absorption, distribution, metabolism, excretion, and toxicity (ADME-Tox) were performed to check the adsorption, distribution, metabolism, excretion, and toxicity of compounds. Previous studies mainly focused on the physico-chemical properties but other parameters are also important for the ADMET study. Six active phytochemicals , , , , , and show good ADMET properties and can be used for drug discovery in the future.
ISSN:2391-5420
2391-5420
DOI:10.1515/chem-2023-0188