Hi,
Is there a way to calculate *distribution-coefficient* *(logD)* for a
compound?
I'm interested in calculation at PH 7.4 for some compounds.
I haven't found it in the list of descriptors:
http://www.rdkit.org/docs/GettingStartedInPython.html#list-of-available-descriptors
If not it will be nice to have such a possibility.
Regars
Adrian
------------------------------------------------------------------------------
Slashdot TV.
Video for Nerds. Stuff that matters.
http://tv.slashdot.org/
_______________________________________________
Rdkit-discuss mailing list
[email protected]
https://lists.sourceforge.net/lists/listinfo/rdkit-discuss