MTasa Dengue Zika
Molecule Name | topological PSA | cLogS | MW | cLogP | H-Acceptors | H-Donors | Ro5 violations | DrugScore | Druglikeness |
---|---|---|---|---|---|---|---|---|---|
162957 | 86.99 | -2.97 | 286.282 | 2.1967 | 5 | 3 | 0 | 0.685823577 | 0.21902 |
164041 | 108.97 | -2.551 | 270.219 | -1.6804 | 8 | 3 | 0 | 0.875168042 | 1.9928 |
165142 | 128.36 | -1.537 | 312.281 | -1.7038 | 10 | 3 | 0 | 0.79517531 | 0.83099 |
165211 | 138.07 | -2.66 | 309.281 | -1.5461 | 10 | 4 | 0 | 0.903663542 | 4.0585 |
165600 | 125.1 | -2.8 | 250.261 | -1.2853 | 8 | 3 | 0 | 0.747703269 | 0.46311 |
165852 | 129.2 | -1.969 | 268.228 | -2.3815 | 9 | 4 | 0 | 0.827637452 | 1.076 |
167888 | None | -1.632 | 283.263 | -2.2487 | 9 | 4 | 0 | 0.894867672 | 2.0489 |
168948 | 105.32 | -2.708 | 265.272 | -0.5632 | 8 | 3 | 0 | 0.820313924 | 1.2245 |
169487 | 85.3 | -1.945 | 193.209 | -0.5706 | 6 | 2 | 0 | 0.95906541 | 4.643 |
170343 | 125.76 | -1.533 | 277.283 | -1.0456 | 8 | 4 | 0 | 0.875596639 | 1.6555 |
171185 | 125.87 | -3.615 | 335.319 | -0.5223 | 10 | 3 | 0 | 0.816828714 | 2.6977 |
172963 | 127.19 | -1.125 | 281.271 | -2.4222 | 9 | 4 | 0 | 0.828619456 | 1.0115 |
173775 | 161.01 | -2.139 | 282.259 | -3.2042 | 10 | 5 | 0 | 0.930336067 | 3.9083 |
174465 | 129.2 | -2.347 | 282.255 | -2.0222 | 9 | 4 | 0 | 0.755264936 | 0.48054 |
174466 | 155.22 | -2.441 | 297.27 | -2.4471 | 10 | 5 | 0 | 0.78180393 | 0.80267 |
174560 | 89.85 | -3.25 | 239.302 | -1.4537 | 6 | 2 | 0 | 0.883918274 | 2.9786 |
174743 | 112.78 | -2.349 | 325.324 | 0.8314 | 10 | 2 | 0 | 0.820854792 | 1.4485 |
175226 | 119.97 | -0.713 | 264.24 | -1.8204 | 8 | 4 | 0 | 0.950886017 | 3.5023 |
175227 | 142.84 | -0.965 | 279.255 | -2.1951 | 9 | 4 | 0 | 0.524104094 | 1.5382 |
175228 | 130.31 | -1.069 | 263.256 | -1.1785 | 8 | 4 | 0 | 0.898947508 | 1.8902 |
179374 | 85.3 | -1.884 | 191.193 | -0.7561 | 6 | 2 | 0 | 0.886357862 | 1.6291 |
181231 | 20.31 | -3.105 | 231.338 | 3.7378 | 2 | 0 | 0 | 0.65307991 | 0.41113 |
182844 | 124.29 | -3.533 | 424.532 | 2.4541 | 7 | 4 | 0 | 0.698634867 | 1.8914 |
184655 | 49.33 | -3.748 | 227.262 | 2.6768 | 3 | 2 | 0 | 0.675807146 | 0.495 |
185299 | 145.99 | -0.91 | 255.233 | -3.0865 | 9 | 5 | 0 | 0.964372982 | 5.3512 |