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
1451 BBP-27400 BBP-27400 0.474 0.346 Green 0.57 - 28 -4.7 74 415 1 4.3 3.3
1452 BBP-28097 BBP-28097 0.474 0.438 Green 0.57 - 35 -4.7 70 356 2 4.2 3.2
1453 BBP-19296 BBP-19296 0.474 0.326 Green 0.69 -7.7 72 -4.8 83 420 2 4.4 3.1
1454 BBP-23276 BBP-23276 0.474 0.360 Green 0.65 - 100 -5.3 81 381 2 2.4 3.4
1455 BBP-29167 BBP-29167 0.474 0.402 Green 0.50 - 32 -4.7 70 370 2 4.0 2.8
1456 BBP-20159 BBP-20159 0.473 0.330 Green 0.65 -7.8 62 -4.7 83 406 2 3.9 3.5
1457 BBP-21656 BBP-21656 0.473 0.284 Green 0.58 -7.8 103 -4.7 87 383 2 3.9 3.1
1458 BBP-22866 BBP-22866 0.473 0.337 Green 0.48 - 53 -4.7 74 371 1 3.6 3.4
1459 BBP-23054 BBP-23054 0.473 0.322 Green 0.59 - 53 -4.7 70 366 2 4.0 3.1
1460 BBP-26008 BBP-26008 0.473 0.412 Green 0.58 - 35 -4.7 70 370 2 4.5 3.2
1461 BBP-26435 BBP-26435 0.473 0.395 Green 0.59 - 48 -4.7 70 352 2 4.3 3.1
1462 BBP-20883 BBP-20883 0.473 0.286 Yellow 0.61 -7.2 70 -4.8 84 433 2 4.1 3.0
1463 BBP-19800 BBP-19800 0.473 0.263 Yellow 0.75 -6.8 72 -4.7 84 396 2 3.3 2.9
1464 BBP-20251 BBP-20251 0.473 0.311 Yellow 0.76 -6.8 73 -4.7 83 395 2 3.8 2.8
1465 BBP-22581 BBP-22581 0.473 0.423 Green 0.57 - 25 -4.7 73 399 2 4.2 2.9
1466 BBP-22851 BBP-22851 0.473 0.344 Green 0.65 - 40 -4.7 73 413 2 3.9 3.4
1467 BBP-17320 BBP-17320 0.473 0.284 Yellow 0.72 -7.4 65 -4.7 85 396 3 3.2 2.6
1468 BBP-20074 BBP-20074 0.473 0.369 Yellow 0.65 -6.7 67 -4.7 83 383 2 3.4 3.2
1469 BBP-21606 BBP-21606 0.473 0.337 Yellow 0.66 -6.9 73 -4.7 83 353 2 3.2 2.8
1470 BBP-21632 BBP-21632 0.473 0.272 Yellow 0.78 -6.7 65 -4.7 83 378 2 3.6 2.7
1471 BBP-22298 BBP-22298 0.473 0.307 Green 0.63 - 63 -4.7 70 402 2 4.4 3.1
1472 BBP-26643 BBP-26643 0.473 0.425 Green 0.74 - 31 -4.7 73 408 2 4.2 4.5
1473 BBP-26124 BBP-26124 0.473 0.410 Green 0.70 - 44 -4.8 76 457 2 4.2 3.1
1474 BBP-26447 BBP-26447 0.473 0.365 Green 0.56 - 32 -4.7 70 384 2 4.4 3.0
1475 BBP-29965 BBP-29965 0.473 0.222 Green 0.62 - 63 -4.7 76 374 2 3.4 3.1
1476 BBP-20518 BBP-20518 0.473 0.286 Yellow 0.78 -6.5 71 -4.7 83 378 2 3.6 2.7
1477 BBP-19689 BBP-19689 0.472 0.341 Green 0.66 -7.7 60 -4.8 86 407 2 3.7 3.4
1478 BBP-22041 BBP-22041 0.472 0.374 Yellow 0.62 -6.9 57 -4.8 86 423 2 4.4 3.7
1479 BBP-22752 BBP-22752 0.472 0.356 Green 0.63 - 48 -4.7 73 417 2 3.7 3.4
1480 BBP-19653 BBP-19653 0.472 0.286 Yellow 0.66 -6.8 69 -5.3 86 382 2 2.7 2.7
1481 BBP-21469 BBP-21469 0.472 0.318 Yellow 0.54 -7.1 60 -4.7 83 357 2 3.2 2.8
1482 BBP-21481 BBP-21481 0.472 0.297 Yellow 0.63 -7.5 86 -4.7 87 390 2 3.9 2.7
1483 BBP-25958 BBP-25958 0.472 0.442 Green 0.54 - 41 -4.7 70 370 2 4.5 2.9
1484 BBP-18365 BBP-18365 0.472 0.271 Yellow 0.68 -7.3 74 -4.8 82 444 2 3.9 2.9
1485 BBP-19231 BBP-19231 0.472 0.326 Yellow 0.74 -6.8 61 -4.7 83 395 2 3.8 2.8
1486 BBP-21525 BBP-21525 0.472 0.301 Yellow 0.62 -7.5 100 -4.7 87 394 2 3.7 2.7
1487 BBP-22509 BBP-22509 0.472 0.308 Green 0.64 - 66 -4.7 70 373 2 4.0 3.2
1488 BBP-22941 BBP-22941 0.472 0.364 Green 0.64 - 57 -4.7 73 410 2 4.1 2.9
1489 BBP-22729 BBP-22729 0.472 0.373 Green 0.64 - 57 -4.7 73 413 2 3.7 3.8
1490 BBP-26014 LEAD BBP-26014 0.472 0.455 Green 0.49 - 46 -4.7 70 374 2 4.3 3.1
1491 BBP-19998 BBP-19998 0.472 0.278 Green 0.54 -8.2 80 -4.8 87 403 2 4.5 3.3
1492 BBP-20366 BBP-20366 0.472 0.311 Yellow 0.77 -6.5 78 -4.7 83 381 2 3.5 2.8
1493 BBP-20488 BBP-20488 0.472 0.304 Yellow 0.51 -7.2 81 -4.7 89 384 2 3.5 4.2
1494 BBP-25371 BBP-25371 0.472 0.402 Green 0.56 - 32 -4.7 70 352 2 4.3 3.0
1495 BBP-25532 BBP-25532 0.472 0.366 Green 0.48 - 34 -4.7 74 371 1 3.6 3.4
1496 BBP-18250 BBP-18250 0.472 0.337 Yellow 0.56 -6.6 79 -4.7 83 361 2 3.4 3.0
1497 BBP-19469 BBP-19469 0.472 0.298 Yellow 0.52 -7.0 47 -4.7 79 439 2 4.4 2.8
1498 BBP-27527 BBP-27527 0.472 0.429 Green 0.71 - 87 -4.8 88 408 2 3.9 2.9
1499 BBP-06765 BBP-06765 0.471 0.395 Yellow 0.60 -7.4 66 -4.7 86 430 2 3.6 3.3
1500 BBP-22659 BBP-22659 0.471 0.405 Green 0.75 - 62 -4.7 73 428 2 4.5 3.9