Chemoinformaics analysis of Aristol-9-en-3-ol
| Molecular Weight | 220.356 | nRot | 0 |
| Heavy Atom Molecular Weight | 196.164 | nRig | 13 |
| Exact Molecular Weight | 220.183 | nRing | 3 |
| Solubility: LogS | -3.647 | nHRing | 0 |
| Solubility: LogP | 3.834 | No. of Aliphatic Rings | 3 |
| Acid Count | 0 | No. of Aromatic Rings | 0 |
| Base Count | 0 | No. of Aliphatic Carbocycles Rings | 3 |
| Atoms Count | 40 | No. of Aliphatic Hetero Cycles | 0 |
| No. of Heavy Atom | 16 | No. of Aromatic Carbocycles | 0 |
| nHetero | 1 | No. of Aromatic Hetero Cycles | 0 |
| nBridge Head | 0 | No. Saturated Carbocycles | 2 |
| No. of Hydrogen atom | 24 | No. of Saturated Hetero Cycles | 0 |
| No. of Carbon atom | 15 | No. of Saturated Rings | 2 |
| No. of Nitrogen atom | 0 | No. of Arom Atom | 0 |
| No. of Oxygen atom | 1 | No. of Arom Bond | 0 |
| nHA | 1 | APOL | 41.855 |
| nHD | 1 | BPOL | 24.077 |
| QED | 0.62 |
| Synth | 4.572 |
| Natural Product Likeliness | 3.249 |
| NR-PPAR-gamma | 0.005 |
| Lipinski | Accepted |
| Pfizer | Rejected |
| GSK | Accepted |
| Golden Triangle | Accepted |
| Pgp-inh | 0.011 |
| Pgp-sub | 0.019 |
| HIA | 0.004 |
| CACO-2 | -4.451 |
| MDCK | 0.0000188 |
| BBB | 0.72 |
| PPB | 0.820418 |
| VDSS | 0.997 |
| FU | 0.183039 |
| CYP1A2-inh | 0.289 |
| CYP1A2-sub | 0.329 |
| CYP2c19-inh | 0.148 |
| CYP2c19-sub | 0.841 |
| CYP2c9-inh | 0.103 |
| CYP2c9-sub | 0.393 |
| CYP2d6-inh | 0.016 |
| CYP2d6-sub | 0.357 |
| CYP3a4-inh | 0.126 |
| CYP3a4-sub | 0.355 |
| CL | 16.67 |
| T12 | 0.093 |
| hERG | 0.008 |
| Ames | 0.011 |
| ROA | 0.805 |
| SkinSen | 0.18 |
| Carcinogencity | 0.64 |
| EI | 0.591 |
| Respiratory | 0.976 |
| NR-Aromatase | 0.048 |
| Antiviral | Yes |
| Prediction | 0.877598 |