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. 2017 May 29;11:1623–1642. doi: 10.2147/DDDT.S136692

Table 4.

Pharmacokinetic parameters important for oral bioavailability and protein binding parameters of synthesized compounds

Comp % ABS MW Volume Donor HB Acceptor HB Lipinski’s violation QPlogPo/w

Rule <80% is high, >25% is poor <500 500.0–2,000.0 <5 <10 ≤1 −2.0 to 6.5
1A 100 395.316 1,041.638 0 1 1 6.493
2A 100 439.369 1,168.198 0 1.75 1 6.799
3A 100 436.525 1,261.8 0 4 1 6.007
4A 100 392.472 1,138.921 1 3.25 1 5.196
5A 100 425.342 1,105.697 0 1.75 1 6.476
6A 100 436.525 1,261.747 0 4 1 6.006
7A 100 332.419 1,011.802 1 1.75 1 5.108
8A 100 394.92 1,041.638 0 1 1 6.493
9A 100 394.92 1,159.867 0 1.75 1 6.724
10A 100 364.892 1,065.077 0 1 1 6.576
11A 100 380.891 1,097.431 0 1.75 1 6.402
12A 100 350.865 1,033.256 0 1 1 6.419
13A 100 394.918 1,159.867 0 1.75 1 6.724
14A 100 394.918 1,159.815 0 1.75 1 6.724
15A 100 364.892 1,095.69 0 1 1 6.741
1B 100 381.289 972.937 0 1 1 6.036
2B 100 336.838 942.479 0 1 1 5.672
3B 100 395.316 1,037.84 0 1 1 6.374
4B 100 425.342 1,080.745 0 1.75 1 6.247
5B 100 395.316 1,016.635 0 1 1 6.264
6B 100 411.315 1,037.038 0 1.75 1 6.018
7B 100 425.342 1,101.954 0 1.75 1 6.357
8B 100 392.472 1,122.39 0 3.25 1 5.516
9B 100 422.498 1,177.838 0 4 1 5.445
10B 100 350.865 1,008.558 0 1 1 6.191
11B 100 380.891 1,072.663 0 1.75 1 6.174
12B 100 336.838 964.548 0 1 1 5.961
13B 100 366.864 1,028.656 0 1.75 1 5.943
14B 100 350.865 1,029.454 0 1 1 6.3
15B 100 380.891 1,093.555 0 1.75 1 6.282

Abbreviations: ABS, absorbance; QPlogPo/w, octanol/water partition coefficients; MW, molecular weight; HB, H-bonds.