Re: [Rdkit-discuss] MolLogP

Hi Jean-Marc, On Sat, Apr 25, 2020 at 8:46 PM Jean-Marc Nuzillard < jm.nuzill...@univ-reims.fr> wrote: > > Lipinski's rule of 5 indicates logP <5. > Is rdkit.Chem.Crippen.MolLogP() the suitable function > to calculate this logP? > Yes, that is a logP model of the sort that one would use for

[Rdkit-discuss] MolLogP

Dear all, Lipinski's rule of 5 indicates logP <5. Is rdkit.Chem.Crippen.MolLogP() the suitable function to calculate this logP? JM -- Jean-Marc Nuzillard Institut de Chimie Moléculaire de Reims, CNRS UMR 7312 Faculté des Sciences Exactes et Naturelles, Bâtiment 18 BP 1039 51687 REIMS Cedex 2