"SuperNatural II" Chemical Library
| Molecule Name | topological PSA | cLogS | MW | cLogP | H-Acceptors | H-Donors | Ro5 violations | DrugScore | Druglikeness |
|---|---|---|---|---|---|---|---|---|---|
| SN00000155 | 53.02 | -0.834 | 122.103 | -1.9322 | 3 | 0 | 0 | 0.603662022 | -1.2442 |
| SN00000156 | 17.33 | -0.792 | 163.243 | -0.939 | 2 | 1 | 0 | 0.528080428 | -2.5175 |
| SN00000157 | 117.97 | -2.648 | 276.227 | -0.3958 | 8 | 2 | 0 | 0.606998541 | -0.78165 |
| SN00000158 | 66.16 | -3.296 | 293.321 | 0.2235 | 4 | 0 | 0 | 0.709563189 | 0.43035 |
| SN00000159 | 43.36 | -1.949 | 247.341 | 1.0729 | 4 | 1 | 0 | 0.178953799 | -2.9181 |
| SN00000160 | 80.59 | -2.533 | 260.224 | -0.3917 | 6 | 0 | 0 | 0.539908343 | -0.21512 |
| SN00000161 | 20.23 | -2.056 | 128.558 | 1.9199 | 1 | 1 | 0 | 0.528120372 | -2.05 |
| SN00000162 | 69.81 | -1.741 | 333.362 | -1.4188 | 6 | 1 | 0 | 0.597455601 | 0.48783 |
| SN00000163 | 52.58 | -2.152 | 271.291 | 2.0724 | 4 | 0 | 0 | 0.607344119 | 0.62649 |
| SN00000164 | 43.6 | -1.095 | 139.181 | 1.2384 | 4 | 1 | 0 | 0.486693815 | -7.0201 |
| SN00000165 | 46.53 | -2.022 | 166.175 | 1.1151 | 3 | 1 | 0 | 0.335493284 | -1.5987 |
| SN00000166 | 52.58 | -2.943 | 259.28 | 3.328 | 4 | 0 | 0 | 0.532683605 | -1.0483 |
| SN00000167 | 72.19 | -2.131 | 178.19 | 0.5307 | 4 | 2 | 0 | 0.34830742 | 2.1353 |
| SN00000168 | 40.13 | -3.244 | 221.234 | 0.5568 | 2 | 0 | 0 | 0.419319225 | 0.17629 |
| SN00000169 | 67.77 | -1.541 | 165.191 | -1.4257 | 3 | 1 | 0 | 0.579299515 | -1.4631 |
| SN00000170 | 47.87 | -1.518 | 152.216 | -2.787 | 2 | 2 | 0 | 0.554451266 | -1.8615 |
| SN00000171 | 75.99 | -2.626 | 286.282 | 2.1941 | 5 | 2 | 0 | 0.492724759 | -0.51757 |
| SN00000172 | 35.53 | -2.651 | 150.133 | 1.7043 | 3 | 0 | 0 | 0.170363927 | -4.1785 |
| SN00000173 | 32.68 | -3.061 | 298.473 | 0.7349 | 1 | 1 | 0 | 0.51794008 | -1.6541 |
| SN00000174 | 58.2 | -2.655 | 218.255 | 0.75 | 4 | 2 | 0 | 0.200138429 | 4.1345 |
| SN00000175 | 85.89 | -1.908 | 284.355 | 0.0087001 | 5 | 0 | 0 | 0.933241629 | 4.1031 |
| SN00000176 | 16.91 | -2.146 | 287.406 | -1.3897 | 4 | 2 | 0 | 0.8325323 | 1.2507 |
| SN00000177 | 68.87 | -0.139 | 123.115 | -1.2009 | 4 | 1 | 0 | 0.142852977 | -0.67966 |
| SN00000178 | 29.54 | -0.601 | 181.214 | -3.2827 | 4 | 0 | 0 | 0.321034674 | -2.3333 |
| SN00000179 | 40.46 | -1.024 | 110.112 | 0.9682 | 2 | 2 | 0 | 0.115452572 | -2.2721 |
