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. 2022 Jun 9;14(11):4874–4887. doi: 10.18632/aging.204117

Table 2. Adsorption, distribution, metabolism, and excretion properties of compounds.

Number Compounds Solubility level BBB level CYP2D6 Hepatotoxicity Absorption level PPB level
1 ZINC000014767731 0 4 1 1 3 0
2 ZINC000032840969 2 4 1 1 3 1
3 ZINC000043016594 1 4 1 0 2 0
4 ZINC000028968107 1 4 0 0 3 0
5 ZINC000003831332 0 4 1 1 3 0
6 ZINC000014946303 0 4 1 0 3 1
7 ZINC000169363256 3 4 1 1 1 1
8 ZINC000006003042 2 4 1 0 1 0
9 ZINC000040865806 3 3 1 1 0 1
10 ZINC000049088142 1 4 1 0 2 1
11 ZINC000044086691 1 4 1 1 3 0
12 ZINC000013451932 3 3 1 0 0 0
13 ZINC000002526389 2 4 0 0 0 0
14 ZINC000002528510 2 4 0 0 0 0
15 ZINC000027646038 3 1 1 1 0 1
16 ZINC000027646060 3 1 1 1 0 1
17 ZINC000049878068 1 4 1 1 3 1
18 ZINC000011616636 2 4 1 1 3 1
19 ZINC000001916008 1 4 1 1 3 0
20 ZINC000100772345 3 4 1 1 1 0
21 ZINC38433168 - - 1 0 - 0

BBB, blood-brain barrier; CYP2D6, cytochrome P-450 2D6; PPB, plasma protein binding.

Aqueous-solubility level: 0, extremely low; 1, very low, but possible; 2, low; 3, good.

BBB level: 0, very high penetrant; 1, high; 2, medium; 3, low; 4, undefined.

CYP2D6 level: 0, noninhibitor; 1, inhibitor.

Hepatotoxicity: 0, nontoxic; 1, toxic.

Human-intestinal absorption level: 0, good; 1, moderate; 2, poor; 3, very poor.

PPB: 0, absorbent weak; 1, absorbent strong.