Hey RDKitters, I am trying to understand how logD is calculated for fragments from the following paper:
Landry, Matthew L., and James J. Crawford. 2020. “LogD Contributions of Substituents Commonly Used in Medicinal Chemistry.” *ACS Medicinal Chemistry Letters* 11 (1): 72–76. Link to the full article: https://drive.google.com/file/d/1FX82B7NFHGd5aDx1KEG5t9nnXZdgJ4HG/view?usp=sharing My question is: what do the reported logD values exactly mean? For example, in Table 1 of the paper, the Delta logD of methyl (Me) group is 0.30 for radius=0 Does this mean that when a methyl group (Me) is attached to a fragment A, the logD of the new fragment increases by +0.30? -- Best, Ganesh
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