Chemoinformaics analysis of Amyl propionate
| Molecular Weight | 144.214 | nRot | 5 |
| Heavy Atom Molecular Weight | 128.086 | nRig | 1 |
| Exact Molecular Weight | 144.115 | nRing | 0 |
| Solubility: LogS | -2.523 | nHRing | 0 |
| Solubility: LogP | 2.874 | No. of Aliphatic Rings | 0 |
| Acid Count | 0 | No. of Aromatic Rings | 0 |
| Base Count | 0 | No. of Aliphatic Carbocycles Rings | 0 |
| Atoms Count | 26 | No. of Aliphatic Hetero Cycles | 0 |
| No. of Heavy Atom | 10 | No. of Aromatic Carbocycles | 0 |
| nHetero | 2 | No. of Aromatic Hetero Cycles | 0 |
| nBridge Head | 0 | No. Saturated Carbocycles | 0 |
| No. of Hydrogen atom | 16 | 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 | 0 |
| No. of Oxygen atom | 2 | No. of Arom Bond | 0 |
| nHA | 2 | APOL | 25.6327 |
| nHD | 0 | BPOL | 18.6553 |
| QED | 0.436 |
| Synth | 1.766 |
| Natural Product Likeliness | 0.265 |
| NR-PPAR-gamma | 0.006 |
| Lipinski | Accepted |
| Pfizer | Accepted |
| GSK | Accepted |
| Golden Triangle | Rejected |
| Pgp-inh | 0.014 |
| Pgp-sub | 0.009 |
| HIA | 0.002 |
| CACO-2 | -4.285 |
| MDCK | 0.0000308 |
| BBB | 0.964 |
| PPB | 0.766932 |
| VDSS | 0.566 |
| FU | 0.366025 |
| CYP1A2-inh | 0.974 |
| CYP1A2-sub | 0.581 |
| CYP2c19-inh | 0.677 |
| CYP2c19-sub | 0.536 |
| CYP2c9-inh | 0.274 |
| CYP2c9-sub | 0.373 |
| CYP2d6-inh | 0.032 |
| CYP2d6-sub | 0.168 |
| CYP3a4-inh | 0.048 |
| CYP3a4-sub | 0.226 |
| CL | 11.457 |
| T12 | 0.772 |
| hERG | 0.071 |
| Ames | 0.006 |
| ROA | 0.037 |
| SkinSen | 0.831 |
| Carcinogencity | 0.216 |
| EI | 0.981 |
| Respiratory | 0.171 |
| NR-Aromatase | 0.009 |
| Antiviral | No |
| Prediction | 0.938148 |