Experimental n-octanol/water Partition/Distribution Coefficients Database for Small Molecules
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We critically compiled experimental values of log<em>P</em><sub>N, </sub>pK<sub>a</sub>, log<em>P</em><sub>I</sub>, and log<em>D</em><sub>pH</sub> of 225 entries based on earlier literature reports. The experimental technique of log<em>P</em><sub>N</sub> , log<em>D</em><sub>pH</sub>, and log<em>P</em><sub>I</sub> for each molecule were thoroughly revised and added to the database. The molecules were classified between acids and bases according to their functional groups and pK<sub>a</sub> values.
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Zenodo创建时间：
2023-05-22
