Calculated LogD is higher than logP

User 92a07cc890

12-09-2014 08:55:51

Could you investigate, why the calculated logD("7.4")  is higher than the logP() (4.78 vs 4.26) for this smiles?


C1=C(N2C(=O)C(C3=CC=C(OC4=CC=C(OC)C=C4)C=C3)=NN2)C=CC2NC=CC1=2


I use version 14.7.14.


Thanks Istvan

User 851ac690a0

15-09-2014 13:28:45

Hi,


Thanks for reporting this problem. 


It will be fixed in the next bug fix release.


Jozsi

User 851ac690a0

16-09-2014 15:32:19

Hi,


 


I've attached the fixed logD result. It will available in the next bug fix release.


 


Jozsi