Chemoinformaics analysis of .alpha.-Elemene
| Molecular Weight | 204.357 | nRot | 2 |
| Heavy Atom Molecular Weight | 180.165 | nRig | 8 |
| Exact Molecular Weight | 204.188 | nRing | 1 |
| Solubility: LogS | -4.992 | nHRing | 0 |
| Solubility: LogP | 4.751 | No. of Aliphatic Rings | 1 |
| Acid Count | 0 | No. of Aromatic Rings | 0 |
| Base Count | 0 | No. of Aliphatic Carbocycles Rings | 1 |
| Atoms Count | 39 | No. of Aliphatic Hetero Cycles | 0 |
| No. of Heavy Atom | 15 | No. of Aromatic Carbocycles | 0 |
| nHetero | 0 | No. of Aromatic Hetero Cycles | 0 |
| nBridge Head | 0 | No. Saturated Carbocycles | 0 |
| No. of Hydrogen atom | 24 | No. of Saturated Hetero Cycles | 0 |
| No. of Carbon atom | 15 | No. of Saturated Rings | 0 |
| No. of Nitrogen atom | 0 | No. of Arom Atom | 0 |
| No. of Oxygen atom | 0 | No. of Arom Bond | 0 |
| nHA | 0 | APOL | 41.053 |
| nHD | 0 | BPOL | 24.077 |
| QED | 0.562 |
| Synth | 4.138 |
| Natural Product Likeliness | 2.208 |
| NR-PPAR-gamma | 0.017 |
| Lipinski | Accepted |
| Pfizer | Rejected |
| GSK | Rejected |
| Golden Triangle | Accepted |
| Pgp-inh | 0.955 |
| Pgp-sub | 0.004 |
| HIA | 0.012 |
| CACO-2 | -4.596 |
| MDCK | 0.0000125 |
| BBB | 0.051 |
| PPB | 0.969419 |
| VDSS | 2.395 |
| FU | 0.055056 |
| CYP1A2-inh | 0.373 |
| CYP1A2-sub | 0.868 |
| CYP2c19-inh | 0.423 |
| CYP2c19-sub | 0.934 |
| CYP2c9-inh | 0.203 |
| CYP2c9-sub | 0.281 |
| CYP2d6-inh | 0.823 |
| CYP2d6-sub | 0.485 |
| CYP3a4-inh | 0.882 |
| CYP3a4-sub | 0.795 |
| CL | 2.829 |
| T12 | 0.439 |
| hERG | 0.011 |
| Ames | 0.016 |
| ROA | 0.071 |
| SkinSen | 0.257 |
| Carcinogencity | 0.724 |
| EI | 0.712 |
| Respiratory | 0.863 |
| NR-Aromatase | 0.09 |
| Antiviral | Yes |
| Prediction | 0.821931 |