… While the crystal structures for most of the drug … and molecular properties of the ligands
have been applied to associate the drug-related properties and transporter-mediated disposition. …

… solubility, log D (the apparent partition coefficient at pH 7.4), MW, and other molecular
properties, the authors were able to classify correctly the compounds into inhibitors (more than …

… percutaneous absorption of various drugs and retention of drugs in the stratum corneum [27-…
properties of the dipolar molecules capable of enhancing percutaneous penetration of drugs…

… A number of reports have linked computed molecular properties to desirable in vivo ADMET
… between molecular properties and in vitro surrogate assays vs in vivo properties within 173 …

… and functional properties can all be involved in inter-individual diŠerences in drug … , I
will also discuss the prospects for future studies on transportermediated drug disposition. …

… is one in which contemporary drug discovery is … molecules with increased molecular weight
and higher overall lipophilicity. The preponderance of molecules expressing these properties …

… approaches for predicting these properties from the compound's … of the processes involved
in drug disposition, although most … for novel molecules could be very helpful for guiding drug …

… molecular properties. Computational models were developed based on data for 165 drugs
… To further test and challenge our models, we have retrieved an additional 56 drugs listed in …

… to consider not only the physiochemical properties of the drug, but the GI luminal environment
… Its applications improve the prediction of oral absorption and disposition of new molecular …

… ) is known to markedly alter the pharmacological properties of the molecule. However, Brookes
… This is one of the very rare cases where h W racemization of a drug molecule has been …