Chemoinformaics analysis of O-Acetylquinovic acid
| Molecular Weight | 528.73 | nRot | 3 |
| Heavy Atom Molecular Weight | 480.346 | nRig | 29 |
| Exact Molecular Weight | 528.345 | nRing | 5 |
| Solubility: LogS | -4.142 | nHRing | 0 |
| Solubility: LogP | 5.435 | No. of Aliphatic Rings | 5 |
| Acid Count | 2 | No. of Aromatic Rings | 0 |
| Base Count | 0 | No. of Aliphatic Carbocycles Rings | 5 |
| Atoms Count | 86 | No. of Aliphatic Hetero Cycles | 0 |
| No. of Heavy Atom | 38 | No. of Aromatic Carbocycles | 0 |
| nHetero | 6 | No. of Aromatic Hetero Cycles | 0 |
| nBridge Head | 0 | No. Saturated Carbocycles | 4 |
| No. of Hydrogen atom | 48 | No. of Saturated Hetero Cycles | 0 |
| No. of Carbon atom | 32 | No. of Saturated Rings | 4 |
| No. of Nitrogen atom | 0 | No. of Arom Atom | 0 |
| No. of Oxygen atom | 6 | No. of Arom Bond | 0 |
| nHA | 4 | APOL | 90.2581 |
| nHD | 2 | BPOL | 52.4939 |
| QED | 0.311 |
| Synth | 4.901 |
| Natural Product Likeliness | 2.919 |
| NR-PPAR-gamma | 0.5 |
| Lipinski | Rejected |
| Pfizer | Accepted |
| GSK | Rejected |
| Golden Triangle | Rejected |
| Pgp-inh | 0 |
| Pgp-sub | 0 |
| HIA | 0.008 |
| CACO-2 | -5.637 |
| MDCK | 0.0000143 |
| BBB | 0.093 |
| PPB | 0.95359 |
| VDSS | 0.511 |
| FU | 0.0302772 |
| CYP1A2-inh | 0.005 |
| CYP1A2-sub | 0.19 |
| CYP2c19-inh | 0.007 |
| CYP2c19-sub | 0.825 |
| CYP2c9-inh | 0.142 |
| CYP2c9-sub | 0.868 |
| CYP2d6-inh | 0.003 |
| CYP2d6-sub | 0.105 |
| CYP3a4-inh | 0.116 |
| CYP3a4-sub | 0.249 |
| CL | 1.537 |
| T12 | 0.111 |
| hERG | 0.001 |
| Ames | 0.007 |
| ROA | 0.108 |
| SkinSen | 0.026 |
| Carcinogencity | 0.051 |
| EI | 0.671 |
| Respiratory | 0.971 |
| NR-Aromatase | 0.341 |
| Antiviral | Yes |
| Prediction | 0.744416 |