Compounds (3260 results)

All Green Yellow Leads
Scaffolds SAR Heatmap Matched Pairs
CSV SDF
Rank ID Structure Score 1664 Sim Traffic BBB Vina 3D PSA MDCK TPSA MW HBD SlogP SA
1651 BBP-22688 BBP-22688 0.464 0.422 Green 0.59 - 51 -4.7 79 386 2 4.1 3.5
1652 BBP-26190 BBP-26190 0.464 0.432 Green 0.49 - 31 -4.7 70 356 2 4.2 3.0
1653 BBP-27200 BBP-27200 0.464 0.405 Green 0.73 - 58 -4.8 76 469 2 4.3 3.6
1654 BBP-20983 BBP-20983 0.464 0.395 Yellow 0.66 -6.8 94 -4.7 83 385 2 3.6 3.2
1655 BBP-22169 BBP-22169 0.464 0.308 Green 0.64 - 55 -4.7 70 416 2 4.4 3.0
1656 BBP-19430 BBP-19430 0.464 0.310 Yellow 0.71 -7.0 49 -4.7 83 390 2 4.1 3.4
1657 BBP-21143 BBP-21143 0.464 0.381 Yellow 0.67 -6.7 72 -4.7 83 389 2 3.4 3.0
1658 BBP-19214 BBP-19214 0.464 0.333 Yellow 0.73 -6.7 62 -4.7 83 388 2 3.7 3.4
1659 BBP-23282 BBP-23282 0.464 0.304 Green 0.61 - 56 -4.7 83 375 2 3.6 3.0
1660 BBP-22911 BBP-22911 0.464 0.348 Green 0.65 - 41 -4.7 73 428 2 4.3 3.4
1661 BBP-19679 BBP-19679 0.464 0.314 Yellow 0.59 -7.0 59 -4.7 83 361 2 4.2 3.0
1662 BBP-20929 BBP-20929 0.464 0.429 Yellow 0.67 -7.0 42 -4.8 86 428 2 3.7 3.1
1663 BBP-22820 BBP-22820 0.464 0.391 Green 0.58 - 69 -4.7 79 386 2 3.8 3.7
1664 BBP-23817 BBP-23817 0.464 0.449 Green 0.50 - 31 -4.7 70 374 2 4.3 3.0
1665 BBP-00742 BBP-00742 0.464 0.481 Yellow 0.40 -7.5 65 -4.8 87 396 2 3.8 3.3
1666 BBP-20579 BBP-20579 0.464 0.293 Yellow 0.64 -7.0 84 -4.7 83 363 2 3.4 3.3
1667 BBP-22845 BBP-22845 0.464 0.388 Green 0.58 - 54 -4.7 79 400 2 4.2 3.0
1668 BBP-18328 BBP-18328 0.464 0.304 Yellow 0.70 -7.4 71 -4.8 86 437 2 4.1 3.1
1669 BBP-20928 BBP-20928 0.464 0.409 Yellow 0.62 -7.3 58 -4.7 86 414 2 3.5 3.6
1670 BBP-20948 BBP-20948 0.464 0.398 Yellow 0.72 -6.9 56 -4.8 86 428 2 3.9 3.1
1671 BBP-20299 BBP-20299 0.463 0.337 Yellow 0.52 -7.2 71 -4.7 83 367 2 3.5 2.7
1672 BBP-26945 BBP-26945 0.463 0.407 Green 0.69 - 35 -4.7 73 443 2 4.4 3.8
1673 BBP-22582 BBP-22582 0.463 0.407 Green 0.52 - 57 -4.7 70 370 2 4.5 3.2
1674 BBP-25224 BBP-25224 0.463 0.407 Green 0.53 - 24 -4.7 70 374 2 4.3 3.3
1675 BBP-18503 BBP-18503 0.463 0.237 Yellow 0.59 -7.4 68 -4.7 87 411 2 3.1 3.9
1676 BBP-20560 BBP-20560 0.463 0.311 Yellow 0.45 -7.5 71 -5.3 88 382 2 2.6 3.1
1677 BBP-21130 BBP-21130 0.463 0.393 Yellow 0.67 -7.2 68 -4.8 86 410 2 3.7 3.6
1678 BBP-20027 BBP-20027 0.463 0.283 Yellow 0.73 -6.8 58 -4.8 86 425 2 4.0 3.2
1679 BBP-20269 BBP-20269 0.463 0.345 Yellow 0.71 -7.1 46 -4.8 86 419 2 3.9 3.5
1680 BBP-23778 BBP-23778 0.463 0.438 Green 0.48 - 32 -4.7 70 356 2 4.2 2.8
1681 BBP-18764 BBP-18764 0.463 0.210 Yellow 0.73 -6.9 77 -5.3 88 378 3 2.5 3.1
1682 BBP-20994 BBP-20994 0.463 0.402 Green 0.46 -7.6 43 -4.7 83 353 2 3.7 3.1
1683 BBP-22965 BBP-22965 0.463 0.391 Green 0.62 - 66 -4.7 77 458 2 4.4 3.1
1684 BBP-26070 BBP-26070 0.463 0.436 Green 0.44 - 46 -4.7 70 356 2 4.2 2.9
1685 BBP-21827 BBP-21827 0.463 0.450 Yellow 0.56 -7.4 62 -4.7 83 397 2 4.4 3.3
1686 BBP-19454 BBP-19454 0.463 0.315 Green 0.57 -7.7 89 -4.7 87 412 2 3.9 3.1
1687 BBP-21025 BBP-21025 0.463 0.420 Yellow 0.60 -7.1 54 -4.7 83 379 2 4.3 3.2
1688 BBP-21416 BBP-21416 0.463 0.310 Yellow 0.60 -7.1 69 -5.3 86 404 2 2.5 3.0
1689 BBP-22106 BBP-22106 0.463 0.377 Yellow 0.57 -7.4 54 -4.8 86 400 2 3.7 3.0
1690 BBP-22360 BBP-22360 0.463 0.329 Green 0.50 - 34 -4.7 73 417 2 3.9 2.8
1691 BBP-27324 BBP-27324 0.463 0.395 Green 0.51 - 27 -4.7 70 356 2 4.2 3.2
1692 BBP-25237 BBP-25237 0.463 0.449 Green 0.48 - 37 -4.7 70 356 2 4.2 3.2
1693 BBP-27895 BBP-27895 0.463 0.415 Green 0.46 - 33 -4.7 70 388 2 4.2 3.0
1694 BBP-19464 BBP-19464 0.462 0.301 Green 0.52 -7.7 85 -4.7 87 398 2 3.8 3.1
1695 BBP-19949 BBP-19949 0.462 0.281 Yellow 0.66 -6.2 68 -5.3 80 368 2 2.6 3.0
1696 BBP-27726 BBP-27726 0.462 0.410 Green 0.50 - 53 -4.7 70 374 2 4.3 3.2
1697 BBP-19723 BBP-19723 0.462 0.278 Yellow 0.71 -6.6 105 -4.7 83 366 2 3.8 2.8
1698 BBP-21080 BBP-21080 0.462 0.356 Yellow 0.61 -6.8 61 -4.7 86 382 2 2.8 3.3
1699 BBP-21886 BBP-21886 0.462 0.420 Yellow 0.62 -7.0 39 -4.7 83 379 2 4.3 3.3
1700 BBP-25903 BBP-25903 0.462 0.388 Green 0.62 - 58 -4.7 79 396 2 4.4 3.0