Chemoinformaics analysis of PIPERONYLIC-ACID
| Molecular Weight | 166.132 | nRot | 1 |
| Heavy Atom Molecular Weight | 160.084 | nRig | 11 |
| Exact Molecular Weight | 166.027 | nRing | 2 |
| Solubility: LogS | -2.528 | nHRing | 1 |
| Solubility: LogP | 1.788 | No. of Aliphatic Rings | 1 |
| Acid Count | 1 | No. of Aromatic Rings | 1 |
| Base Count | 0 | No. of Aliphatic Carbocycles Rings | 0 |
| Atoms Count | 18 | No. of Aliphatic Hetero Cycles | 1 |
| No. of Heavy Atom | 12 | No. of Aromatic Carbocycles | 1 |
| nHetero | 4 | No. of Aromatic Hetero Cycles | 0 |
| nBridge Head | 0 | No. Saturated Carbocycles | 0 |
| No. of Hydrogen atom | 6 | No. of Saturated Hetero Cycles | 0 |
| No. of Carbon atom | 8 | No. of Saturated Rings | 0 |
| No. of Nitrogen atom | 0 | No. of Arom Atom | 6 |
| No. of Oxygen atom | 4 | No. of Arom Bond | 6 |
| nHA | 3 | APOL | 20.5688 |
| nHD | 1 | BPOL | 10.3592 |
| QED | 0.679 |
| Synth | 1.694 |
| Natural Product Likeliness | 0.056 |
| NR-PPAR-gamma | 0.004 |
| Lipinski | Accepted |
| Pfizer | Accepted |
| GSK | Accepted |
| Golden Triangle | Rejected |
| Pgp-inh | 0.001 |
| Pgp-sub | 0.001 |
| HIA | 0.003 |
| CACO-2 | -4.96 |
| MDCK | 0.0000162 |
| BBB | 0.362 |
| PPB | 0.768894 |
| VDSS | 0.278 |
| FU | 0.259419 |
| CYP1A2-inh | 0.369 |
| CYP1A2-sub | 0.218 |
| CYP2c19-inh | 0.052 |
| CYP2c19-sub | 0.058 |
| CYP2c9-inh | 0.082 |
| CYP2c9-sub | 0.118 |
| CYP2d6-inh | 0.169 |
| CYP2d6-sub | 0.153 |
| CYP3a4-inh | 0.089 |
| CYP3a4-sub | 0.088 |
| CL | 9.023 |
| T12 | 0.888 |
| hERG | 0.042 |
| Ames | 0.029 |
| ROA | 0.078 |
| SkinSen | 0.237 |
| Carcinogencity | 0.842 |
| EI | 0.974 |
| Respiratory | 0.115 |
| NR-Aromatase | 0.004 |
| Antiviral | No |
| Prediction | 0.813454 |