Human Database
| Molecule Name | topological PSA | cLogS | MW | cLogP | H-Acceptors | H-Donors | Ro5 violations | DrugScore | Druglikeness |
|---|---|---|---|---|---|---|---|---|---|
| HMDB00156 | 94.83 | -0.075 | 134.087 | -1.6884 | 5 | 3 | 0 | 0.826420362 | 0.70851 |
| HMDB00157 | 74.69 | -1.897 | 136.114 | -0.0154 | 5 | 2 | 0 | 0.206667191 | -0.07667 |
| HMDB00158 | 83.55 | -1.245 | 181.19 | -1.8949 | 4 | 3 | 0 | 0.488770646 | -11.045 |
| HMDB00159 | 63.32 | -1.541 | 165.191 | -1.5492 | 3 | 2 | 0 | 0.487682014 | -11.045 |
| HMDB00161 | 63.32 | -0.406 | 89.0936 | -2.9911 | 3 | 2 | 0 | 0.505502316 | -3.896 |
| HMDB00162 | 49.33 | -0.708 | 115.131 | -2.6125 | 3 | 2 | 0 | 0.502634137 | -4.0386 |
| HMDB00163 | 189.53 | 0.551 | 342.296 | -4.4579 | 11 | 8 | 2 | 0.279940466 | -7.6104 |
| HMDB00164 | 26.02 | -0.253 | 31.0577 | -0.7536 | 1 | 1 | 0 | 0.203002855 | -1.8447 |
| HMDB00167 | 83.55 | -0.277 | 119.119 | -3.5585 | 4 | 3 | 0 | 0.495201054 | -12.838 |
| HMDB00168 | 106.41 | -0.227 | 132.119 | -4.2108 | 5 | 3 | 0 | 0.494903585 | -13.655 |
| HMDB00169 | 110.38 | 0.251 | 180.155 | -2.6208 | 6 | 5 | 0 | 0.504361353 | -3.7768 |
| HMDB00172 | 63.32 | -1.106 | 131.174 | -1.864 | 3 | 2 | 0 | 0.491836922 | -10.908 |
| HMDB00174 | 90.15 | -0.256 | 164.156 | -1.6941 | 5 | 4 | 0 | 0.786241014 | 0.38132 |
| HMDB00175 | 175.73 | -0.044 | 348.207 | -5.6802 | 12 | 5 | 1 | 0.463555411 | -18.253 |
| HMDB00176 | 74.6 | -0.246 | 116.072 | -0.9188 | 4 | 2 | 0 | 0.333210515 | 1.9085 |
| HMDB00177 | 92.0 | -0.38 | 155.156 | -3.5054 | 5 | 3 | 0 | 0.493668531 | -8.9499 |
| HMDB00181 | 103.78 | -0.949 | 197.189 | -2.2406 | 5 | 4 | 0 | 0.489176397 | -11.045 |
| HMDB00182 | 89.34 | -0.785 | 146.189 | -4.6792 | 4 | 3 | 0 | 0.492840235 | -18.213 |
| HMDB00186 | 189.53 | 0.551 | 342.296 | -4.4579 | 11 | 8 | 2 | 0.279940466 | -7.6104 |
| HMDB00187 | 83.55 | 0.101 | 105.093 | -3.9178 | 4 | 3 | 0 | 0.496312663 | -10.074 |
| HMDB00189 | 273.34 | 1.779 | 508.165 | -10.078 | 18 | 7 | 3 | 0.368671539 | -30.44 |
| HMDB00190 | 57.53 | -0.33 | 90.0776 | -0.8665 | 3 | 2 | 0 | 0.553167729 | -2.02 |
| HMDB00191 | 100.62 | -0.151 | 133.103 | -3.813 | 5 | 3 | 0 | 0.495010353 | -11.987 |
| HMDB00192 | 126.64 | -1.132 | 240.303 | -5.5478 | 6 | 4 | 0 | 0.484934422 | -6.7623 |
| HMDB00193 | 132.13 | 0.02 | 192.123 | -2.292 | 7 | 4 | 0 | 0.836540201 | 0.84622 |
