Table 4.
Physicochemical properties of the identified compounds from EAF for good oral bioavailability.
| Compound |
Lipinski Rules |
Lipinski's Violations |
||||
|---|---|---|---|---|---|---|
| MW |
HBA |
HBD |
Log P |
MR |
||
| ≤500 | ≤10 | ≤5 | ≤5 | 40–130 | ≤1 | |
| Cyclopropane, nonyl- | 168.32 | 0 | 0 | 4.73 | 57.68 | 0 |
| Phenol,2,4-bis(1,1-dimethylethyl)- | 206.32 | 1 | 1 | 3.09 | 67.01 | 0 |
| Dodecanoic acid, methyl ester | 214.34 | 2 | 0 | 4.10 | 65.89 | 0 |
| E−14-Hexadecenal | 238.41 | 1 | 0 | 5.13 | 78.75 | 1 |
| Tridecanoic acid, 12-methyl-, methyl ester | 242.40 | 2 | 0 | 4.75 | 75.50 | 0 |
| E−15-Heptadecenal | 252.44 | 1 | 0 | 5.50 | 83.56 | 1 |
| 9-Hexadecenoic acid, methyl ester, (Z)- | 268.43 | 2 | 0 | 5.26 | 84.64 | 1 |
| Hexadecanoic acid, methyl ester | 270.45 | 2 | 9 | 5.54 | 85.12 | 2 |
| 1-Heneicosanol | 312.57 | 1 | 1 | 7.25 | 104.22 | 1 |
| n-Heptadecanol-1 | 256.5 | 1 | 1 | 7.8 | 82.34 | 1 |
| 9,12-Octadecadienoic acid, methyl ester | 294.47 | 2 | 0 | 5.69 | 93.98 | 1 |
| 9-Octadecenoic acid (Z)-, methyl ester | 296.49 | 2 | 0 | 5.95 | 94.26 | 1 |
| 11-Octadecenoic acid, methyl ester | 296.49 | 2 | 9 | 5.95 | 94.26 | 2 |
| Methyl stearate | 298.50 | 2 | 0 | 6.24 | 94.73 | 1 |
| Nonacos-1-ene | 406.77 | 0 | 0 | 11.21 | 141.04 | 2 |
MW, molecular weight (g/mol); HBA, hydrogen bond acceptor; HBD, hydrogen bond donor; Log P, lipophilicity; MR, molar refractivity.