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J. Encinar

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Jul 2026

ADMET-Driven Chemical Navigability Rules for Early-Stage Virtual Compound Prioritization

Clinical attrition in drug development is frequently driven by suboptimal pharmacokinetic and toxicological (ADMET) properties rather than inadequate target efficacy. Accordingly, early-stage ADMET assessment has become an increasingly important component of Structure-Based Drug Design (SBDD). Here, we present empirica...

J. Encinar, Chen Yang, Raquel Fernández-Ginés et al. · 0 citations

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