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The system optimised the molecules that were most likely to succeed in terms of potency, metabolicstability, synthetic accessibility, and more. The novel molecules were further ranked based on their ADME and selectivity profiles.
The continued popularity of these different ring systems means that an awareness of their potential routes of metabolism is helpful for medicinal chemists. Table 1: Data from J.
Advanced Drug Delivery Reviews , 64:417, 2012. Cyclic Peptide Design, Chapter 2: Strategies to Enhance MetabolicStabilities. References Lipinski CA, Lombardo F, Dominy BW, Feeney PJ. Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings. Springer, 2019.
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