Research Article
Network Pharmacology Deciphering Mechanisms of Volatiles of Wendan Granule for the Treatment of Alzheimer’s Disease
Table 1
Candidate compounds ADME values and molecular information.
| Compound Name | Molecular Formula | Molecular Weight | RA (%) | OB (%) | Caco-2 | BBB |
| Senkyunolide A | C12H16O2 | 192 | 7.271 | 26.56 | 1.3 | 1.34 | Trans-ligustilide | C13H18O | 190 | 6.62 | 23.5 | 1.28 | 1.2 | dl-3n-butylphthalide | C12H14O2 | 190 | 6.273 | 47.9 | 1.3 | 1.32 | 3-Butylidenephthalide | C12H12O2 | 188 | 4.138 | 42.44 | 1.32 | 1.27 | Methyl eugenol | C11H14O2 | 178 | 2.987 | 73.36 | 1.47 | 1.41 | T-Muurolol | C15H26O | 222 | 3.129 | 30.41 | 1.36 | 1.44 | Sedanolide | C12H18O2 | 194 | 3.522 | 62.46 | 1.24 | 1.4 | γ-Asarone | C12H16O3 | 208 | 14.658 | 22.76 | 1.5 | 1.33 | β-Asarone | C12H16O3 | 208 | 15.798 | 35.61 | 1.45 | 1.24 | Linalool | C10H18O | 154 | 2.74 | 38.29 | 1.29 | 1.33 | Isocalamendiol | C15H26O2 | 238 | 2.518 | 57.63 | 0.94 | 0.74 | Thymol | C10H14O | 150 | 2.125 | 41.47 | 1.6 | 1.68 |
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