A Membrane Permeability Database for Nonpeptidic Macrocycles

A Membrane Permeability Database for Nonpeptidic Macrocycles

we present a comprehensive online database (https://swemacrocycledb.com/), housing 5638 membrane permeability datapoints for 4216 nonpeptidic macrocycles, curated from the literature, patents, and bioactivity repositories. Provided code and raw files

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Bibliographic Details
Main Author: Qiushi Feng (19559189) (author)
Other Authors: Danjo De Chavez (19559192) (author), Jan Kihlberg (6469963) (author), Vasanthanathan Poongavanam (19559195) (author)
Published: 2025
Subjects:
Cheminformatics
Computational Chemistry
Cheminformatics and Quantitative Structure-Activity Relationships
Medicinal and Biomolecular Chemistry not elsewhere classified
Drug discovery
Macrocycle
Cell permeability
Database
WebServer
QSAR
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