期刊
ADMET AND DMPK
卷 6, 期 2, 页码 85-104出版社
IAPC PUBLISHING
DOI: 10.5599/admet.529
关键词
ElogD; EPSA; lipophilicity; exposed polarity
Applications of chromatography derived lipophilicity, polarity, and 3D concepts such as conformational states, exposed polarity and intramolecular hydrogen bonds (IMHB), are discussed along with recently developed methods for incorporating these concepts into drug design strategies. In addition, the drug design process is described with examples and practices used at Pfizer, as well as experimental and computed parameters used for parallel optimization of properties leading to drug candidate nominations.
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