Isostructurality and energetics of competitive C–H⋯π interactions in adamantane-benzoate hybrids: a computational ADME study

RSC Advances 2026 Open access

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Authors: Hiram Pérez
DOI: 10.1039/d6ra01672c
Cited by: 1
References: 60

Abstract

ADME predictions. The compounds exhibited high gastrointestinal absorption and optimal drug-likeness parameters, although their high lipophilicity suggests potential limitations in aqueous solubility. These results characterize the adamantane-benzoate scaffold as a viable candidate for future drug design.

Fields of Study & Subjects

Crystallography and molecular interactions Pharmacological Receptor Mechanisms and Effects Eicosanoids and Hypertension Pharmacology

Publication details

Journal / source
RSC Advances
Publisher
Royal Society of Chemistry (RSC)
Volume
16
Issue
32
Pages
29280–29290
Publication date
1 January 2026
Language
EN