Skip to main content
. Author manuscript; available in PMC: 2018 Dec 30.
Published in final edited form as: Angew Chem Int Ed Engl. 2015 Jun 9;54(35):10244–10248. doi: 10.1002/anie.201504035

Table 1.

Summary of the binding-kinetics parameters measured for H. pylori HtrA, and physicochemical properties of compounds 1a and 2.

Compound KDm] koff [s−1] t1/2 [s] LE[a] logP[b] logS[b]
1a 27 ± 4 1.4 0.5 0.22 4.8 −8.7
2 37 ± 4 1.8 0.4 0.24 3.5 −4.3
[a]

Ligand efficiency (= −1.4 logKD/(number of non-hydrogen atoms)).

[b]

Octanol–water partition coefficient P and aqueous solubility S calculated with MOE 2011.10.