Compounds (3260 results)

Rank ID Structure Score 1664 Sim Traffic BBB Vina 3D PSA MDCK TPSA MW HBD SlogP SA
1851 BBP-26505 BBP-26505 0.456 - Green 0.55 - 43 -4.7 72 413 3 3.6 3.0
1852 BBP-04172 BBP-04172 0.456 - Yellow 0.39 -7.7 60 -4.8 88 420 2 3.7 3.4
1853 BBP-19708 BBP-19708 0.456 - Yellow 0.73 -6.6 56 -4.7 83 398 2 4.0 2.7
1854 BBP-22430 BBP-22430 0.456 - Green 0.63 - 47 -4.7 70 405 2 4.5 3.3
1855 BBP-23029 BBP-23029 0.456 - Green 0.55 - 57 -4.7 79 388 2 4.2 3.1
1856 BBP-24195 BBP-24195 0.456 - Green 0.47 - 26 -4.7 70 374 2 4.3 3.3
1857 BBP-20428 BBP-20428 0.456 - Yellow 0.63 -6.9 98 -4.7 87 394 2 3.7 2.7
1858 BBP-20239 BBP-20239 0.456 - Yellow 0.72 -6.7 80 -4.7 83 413 2 3.9 3.1
1859 BBP-20606 BBP-20606 0.456 - Yellow 0.68 -6.6 73 -4.7 83 390 2 4.2 2.9
1860 BBP-22664 BBP-22664 0.456 - Green 0.48 - 56 -4.7 70 374 2 4.3 3.3
1861 BBP-21246 BBP-21246 0.456 - Yellow 0.71 -6.6 53 -4.7 86 425 2 3.5 2.9
1862 BBP-21763 BBP-21763 0.456 - Yellow 0.47 -7.5 56 -4.7 90 368 3 3.3 3.2
1863 BBP-26548 BBP-26548 0.456 - Green 0.78 - 63 -4.8 83 396 2 4.3 2.9
1864 BBP-16287 BBP-16287 0.455 - Yellow 0.66 -6.6 89 -4.7 86 400 2 3.2 2.6
1865 BBP-19703 BBP-19703 0.455 - Yellow 0.72 -7.0 76 -4.7 83 417 2 4.4 2.8
1866 BBP-20372 BBP-20372 0.455 - Yellow 0.70 -6.7 82 -4.7 83 402 2 3.8 2.9
1867 BBP-19546 BBP-19546 0.455 - Yellow 0.68 -6.9 70 -4.7 83 392 2 4.3 2.8
1868 BBP-19570 BBP-19570 0.455 - Yellow 0.56 -6.4 64 -4.7 87 412 2 4.2 3.1
1869 BBP-19421 BBP-19421 0.455 - Yellow 0.63 -7.2 55 -4.7 82 403 3 3.8 2.7
1870 BBP-25124 BBP-25124 0.455 - Green 0.53 - 30 -4.7 73 421 2 4.0 3.6
1871 BBP-29054 BBP-29054 0.455 - Green 0.44 - 35 -4.7 70 356 2 4.2 3.3
1872 BBP-16286 BBP-16286 0.455 - Yellow 0.66 -6.6 85 -4.7 86 400 2 3.2 2.6
1873 BBP-18298 BBP-18298 0.455 - Yellow 0.70 -6.9 72 -4.7 83 390 2 3.9 4.1
1874 BBP-23288 BBP-23288 0.455 - Green 0.50 - 33 -4.7 74 413 1 4.0 3.3
1875 BBP-27521 BBP-27521 0.455 - Green 0.40 - 26 -4.7 70 362 2 4.0 3.0
1876 BBP-19581 BBP-19581 0.455 - Green 0.46 -7.7 79 -4.7 87 402 2 3.4 3.1
1877 BBP-24970 BBP-24970 0.455 - Green 0.74 - 75 -4.8 83 382 2 4.0 3.0
1878 BBP-19823 BBP-19823 0.455 - Red 0.83 -7.7 38 -4.7 60 389 2 4.2 3.2
1879 BBP-21875 BBP-21875 0.455 - Yellow 0.51 -7.4 46 -4.7 83 388 2 4.5 3.1
1880 BBP-15659 BBP-15659 0.455 - Yellow 0.62 -7.3 36 -4.8 86 378 2 3.7 3.1
1881 BBP-26140 BBP-26140 0.455 - Green 0.47 - 52 -4.7 70 374 2 4.3 3.3
1882 BBP-21623 BBP-21623 0.455 - Yellow 0.65 -6.6 95 -4.7 83 370 2 3.7 2.7
1883 BBP-10290 BBP-10290 0.455 - Yellow 0.35 -7.6 96 -4.7 88 406 2 3.5 3.2
1884 BBP-20507 BBP-20507 0.455 - Yellow 0.66 -6.7 76 -4.7 86 410 2 3.2 2.9
1885 BBP-20699 BBP-20699 0.455 - Yellow 0.64 -6.8 61 -4.7 83 363 2 3.4 3.2
1886 BBP-18450 BBP-18450 0.454 - Yellow 0.68 -7.2 35 -4.8 82 434 2 4.2 2.8
1887 BBP-24936 BBP-24936 0.454 - Green 0.77 - 62 -4.7 83 387 2 4.3 3.0
1888 BBP-27287 BBP-27287 0.454 - Green 0.71 - 74 -4.8 82 456 2 4.4 3.1
1889 BBP-20764 BBP-20764 0.454 - Yellow 0.63 -6.9 68 -4.7 83 363 2 3.4 3.3
1890 BBP-22190 BBP-22190 0.454 - Green 0.46 - 53 -4.7 70 388 2 4.2 2.9
1891 BBP-19237 BBP-19237 0.454 - Yellow 0.65 -6.9 52 -4.7 83 402 2 4.1 2.9
1892 BBP-19399 BBP-19399 0.454 - Green 0.49 -7.6 78 -4.7 87 416 2 3.8 2.7
1893 BBP-18295 BBP-18295 0.454 - Yellow 0.69 -7.2 59 -4.8 86 453 2 4.0 2.8
1894 BBP-23927 BBP-23927 0.454 - Green 0.45 - 30 -4.7 70 374 2 4.3 3.0
1895 BBP-21371 BBP-21371 0.454 - Yellow 0.59 -6.9 76 -4.7 87 394 2 3.7 2.7
1896 BBP-21162 BBP-21162 0.454 - Yellow 0.54 -7.4 105 -4.7 87 412 2 3.9 2.9
1897 BBP-07419 BBP-07419 0.454 - Yellow 0.54 -7.4 71 -4.7 82 417 3 3.9 3.6
1898 BBP-22446 BBP-22446 0.454 - Green 0.44 - 62 -4.7 79 411 2 3.6 2.9
1899 BBP-27220 BBP-27220 0.454 - Green 0.69 - 57 -4.7 88 378 2 3.5 3.0
1900 BBP-19796 BBP-19796 0.454 - Yellow 0.64 -6.7 74 -4.7 87 403 1 3.2 3.3