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The interaction between compound 8b and BSA was also investigated.
This is also the case with the difference between compound 4 (clog P: 2.03) and 8 (clog P: 2.05).
Notably, the difference between compound 5 and its analog compound 9 (clog P: 1.80) was found to be larger.
The dividing line between compound ecphonetic signs and neumes is slender.
A transition layer is present between compound layer and diffusion layer.
There was no direct correlation between compound exposure and in vivo activity.
Hence, theoretical investigations explore the reasons of different binding ability between compound 3 and anions.
Finally, the binding mode between compound 12g with PAK4 was proposed by molecular docking.
The interface quality between compound semiconductors and silicon dioxide is not good enough and the dielectric constant of silicon dioxide is too small.
Moreover, Aβ42 was the optimum predicted target based on the high 3D molecular similarity between compound AA36 and caprospinol.
Molecular docking indicated that the interactions between compound 3i and topoisomerase II were driven by hydrogen bonds.
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