"Dengue" Chemical Library
| Molecule Name | topological PSA | cLogS | MW | cLogP | H-Acceptors | H-Donors | Ro5 violations | DrugScore | Druglikeness |
|---|---|---|---|---|---|---|---|---|---|
| 156461 | 63.93 | -4.56 | 431.658 | 3.5872 | 4 | 3 | 0 | 0.609850362 | 4.1725 |
| 160020 | 16.96 | -3.982 | 294.44 | 5.1529 | 2 | 1 | 1 | 0.3593936 | -1.5162 |
| 166754 | 147.58 | -4.296 | 428.424 | 1.3943 | 10 | 3 | 0 | 0.488538031 | 1.0582 |
| 167158 | 57.23 | -5.554 | 437.534 | 4.5101 | 6 | 0 | 0 | 0.254639255 | -2.2277 |
| 170601 | 35.16 | -3.84 | 382.509 | 3.507 | 4 | 1 | 0 | 0.717252493 | 4.4566 |
| 175087 | 31.5 | -4.179 | 437.585 | 4.3302 | 4 | 1 | 0 | 0.58720863 | 4.3874 |
| 176340 | 229.45 | -3.201 | 599.6 | -0.3169 | 14 | 4 | 2 | 0.063163607 | -3.6968 |
| 177807 | 74.91 | -4.258 | 389.454 | 2.7008 | 6 | 1 | 0 | 0.676172903 | 2.0639 |
| 182369 | 71.6 | -4.555 | 482.626 | 3.6728 | 6 | 3 | 0 | 0.557451392 | 5.1956 |
| 189073 | 163.86 | -2.552 | 474.513 | -0.1218 | 9 | 4 | 0 | 0.089896179 | -2.1595 |
| 200535 | 21.7 | -5.044 | 371.479 | 4.8977 | 3 | 0 | 0 | 0.504607967 | 2.9203 |
| 205594 | 73.4 | -3.617 | 348.401 | 2.3791 | 5 | 2 | 0 | 0.796834418 | 3.5083 |
| 214104 | 103.7 | -1.813 | 293.298 | 0.4458 | 6 | 3 | 0 | 0.225960484 | -5.4296 |
| 248531 | 109.41 | -3.543 | 370.384 | 1.8557 | 7 | 2 | 0 | 0.723334006 | 1.3071 |
| 249346 | 118.8 | -3.341 | 373.388 | 0.8906 | 8 | 2 | 0 | 0.293904741 | 3.3349 |
| 251577 | 109.41 | -4.107 | 370.384 | 1.7841 | 7 | 2 | 0 | 0.607337208 | 4.1328 |
| 269352 | 178.52 | -4.438 | 474.517 | 1.4826 | 10 | 4 | 0 | 0.331166851 | -0.835 |
| 270180 | 39.19 | -5.847 | 313.355 | 4.8332 | 3 | 0 | 0 | 0.156365728 | -3.6823 |
| 273787 | 97.98 | -6.178 | 465.551 | 5.2015 | 6 | 4 | 1 | 0.260029312 | 1.4669 |
| 275187 | 36.1 | -4.523 | 300.36 | 4.0398 | 3 | 1 | 0 | 0.397075572 | 4.0477 |
| 278316 | 19.03 | -3.701 | 280.414 | 3.7824 | 2 | 1 | 0 | 0.487462282 | -0.96757 |
| 282368 | 59.16 | -3.854 | 355.457 | 3.8221 | 4 | 1 | 0 | 0.215303334 | -17.86 |
| 290547 | 40.16 | -5.95 | 373.407 | 4.5577 | 5 | 0 | 0 | 0.272904346 | 2.8062 |
| 295668 | 62.4 | -3.116 | 352.433 | 2.4949 | 5 | 1 | 0 | 0.432755676 | -3.2175 |
| 308408 | 145.6 | -5.478 | 437.431 | 2.0724 | 9 | 1 | 0 | 0.2828891 | -12.339 |
