Chemoinformaics analysis of 6-Methylcoumarin
| Molecular Weight | 160.172 | nRot | 0 |
| Heavy Atom Molecular Weight | 152.108 | nRig | 12 |
| Exact Molecular Weight | 160.052 | nRing | 2 |
| Solubility: LogS | -2.52 | nHRing | 1 |
| Solubility: LogP | 2.105 | No. of Aliphatic Rings | 0 |
| Acid Count | 0 | No. of Aromatic Rings | 2 |
| Base Count | 0 | No. of Aliphatic Carbocycles Rings | 0 |
| Atoms Count | 20 | No. of Aliphatic Hetero Cycles | 0 |
| No. of Heavy Atom | 12 | No. of Aromatic Carbocycles | 1 |
| nHetero | 2 | No. of Aromatic Hetero Cycles | 1 |
| nBridge Head | 0 | No. Saturated Carbocycles | 0 |
| No. of Hydrogen atom | 8 | No. of Saturated Hetero Cycles | 0 |
| No. of Carbon atom | 10 | No. of Saturated Rings | 0 |
| No. of Nitrogen atom | 0 | No. of Arom Atom | 10 |
| No. of Oxygen atom | 2 | No. of Arom Bond | 11 |
| nHA | 2 | APOL | 23.6383 |
| nHD | 0 | BPOL | 10.6297 |
| QED | 0.552 |
| Synth | 1.777 |
| Natural Product Likeliness | -0.037 |
| NR-PPAR-gamma | 0.006 |
| Lipinski | Accepted |
| Pfizer | Accepted |
| GSK | Accepted |
| Golden Triangle | Rejected |
| Pgp-inh | 0.004 |
| Pgp-sub | 0.986 |
| HIA | 0.004 |
| CACO-2 | -4.637 |
| MDCK | 0.0000188 |
| BBB | 0.136 |
| PPB | 0.898329 |
| VDSS | 0.636 |
| FU | 0.0946214 |
| CYP1A2-inh | 0.979 |
| CYP1A2-sub | 0.94 |
| CYP2c19-inh | 0.555 |
| CYP2c19-sub | 0.166 |
| CYP2c9-inh | 0.129 |
| CYP2c9-sub | 0.806 |
| CYP2d6-inh | 0.468 |
| CYP2d6-sub | 0.884 |
| CYP3a4-inh | 0.225 |
| CYP3a4-sub | 0.419 |
| CL | 10.971 |
| T12 | 0.665 |
| hERG | 0.177 |
| Ames | 0.175 |
| ROA | 0.233 |
| SkinSen | 0.216 |
| Carcinogencity | 0.898 |
| EI | 0.989 |
| Respiratory | 0.06 |
| NR-Aromatase | 0.011 |
| Antiviral | No |
| Prediction | 0.738556 |