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
1401 BBP-20445 BBP-20445 0.476 0.308 Yellow 0.70 -7.4 59 -4.8 83 432 1 3.9 3.2
1402 BBP-22518 BBP-22518 0.476 0.295 Green 0.67 - 88 -4.7 74 401 2 3.9 3.2
1403 BBP-23246 BBP-23246 0.476 0.290 Green 0.63 - 42 -4.7 74 403 1 3.5 3.7
1404 BBP-20532 BBP-20532 0.476 0.278 Yellow 0.70 -7.1 93 -4.7 83 366 2 3.8 2.8
1405 BBP-22180 BBP-22180 0.476 0.321 Green 0.56 - 69 -4.7 70 370 2 3.9 2.7
1406 BBP-25987 LEAD BBP-25987 0.476 0.455 Green 0.53 - 40 -4.7 70 370 2 4.5 3.1
1407 BBP-19515 BBP-19515 0.476 0.286 Green 0.53 -7.6 58 -4.7 83 393 2 3.8 3.1
1408 BBP-20358 BBP-20358 0.476 0.308 Yellow 0.70 -6.9 54 -4.7 83 390 2 4.2 3.3
1409 BBP-22253 BBP-22253 0.476 0.326 Green 0.71 - 56 -4.7 73 413 2 3.9 3.4
1410 BBP-22532 BBP-22532 0.476 0.306 Green 0.70 - 74 -4.7 79 432 2 3.6 3.5
1411 BBP-22600 BBP-22600 0.476 0.422 Green 0.69 - 44 -4.8 76 443 2 3.7 3.5
1412 BBP-23058 BBP-23058 0.476 0.303 Green 0.64 - 57 -4.7 79 400 2 3.9 2.8
1413 BBP-20171 BBP-20171 0.475 0.344 Yellow 0.56 -6.8 51 -4.7 83 408 2 4.2 3.0
1414 BBP-21855 BBP-21855 0.475 0.425 Yellow 0.59 -7.4 58 -4.7 82 419 2 3.3 3.0
1415 BBP-18379 BBP-18379 0.475 0.275 Yellow 0.61 -7.0 75 -4.7 83 365 3 4.5 2.6
1416 BBP-26263 BBP-26263 0.475 0.346 Green 0.47 - 45 -4.7 74 371 1 3.6 3.3
1417 BBP-29011 BBP-29011 0.475 0.383 Green 0.52 - 43 -4.7 73 389 2 3.6 2.9
1418 BBP-22891 BBP-22891 0.475 0.319 Green 0.66 - 21 -4.7 70 384 2 4.3 3.8
1419 BBP-22985 BBP-22985 0.475 0.266 Green 0.54 - 46 -4.7 70 370 2 4.2 2.9
1420 BBP-26388 LEAD BBP-26388 0.475 0.458 Green 0.74 - 46 -4.8 76 473 2 4.1 3.2
1421 BBP-18608 BBP-18608 0.475 0.264 Yellow 0.61 -6.7 71 -4.7 84 359 2 4.1 2.8
1422 BBP-22350 BBP-22350 0.475 0.269 Green 0.57 - 41 -4.7 61 405 1 4.0 3.3
1423 BBP-03672 BBP-03672 0.475 0.379 Yellow 0.76 -6.9 59 -4.8 82 444 2 3.9 3.3
1424 BBP-25126 BBP-25126 0.475 0.400 Green 0.57 - 53 -4.7 70 370 2 4.5 3.0
1425 BBP-26514 BBP-26514 0.475 0.373 Green 0.57 - 40 -4.7 70 352 2 4.3 2.8
1426 BBP-26635 BBP-26635 0.475 0.402 Green 0.45 - 68 -4.7 79 416 2 4.2 3.2
1427 BBP-19278 BBP-19278 0.475 0.348 Yellow 0.69 -7.1 80 -4.7 83 381 2 3.6 3.4
1428 BBP-22152 BBP-22152 0.475 0.345 Green 0.56 - 55 -4.7 70 356 2 4.2 2.8
1429 BBP-25823 BBP-25823 0.475 0.430 Green 0.71 - 53 -4.7 79 429 2 4.4 2.8
1430 BBP-25965 LEAD BBP-25965 0.475 0.455 Green 0.52 - 33 -4.7 73 403 2 4.0 3.1
1431 BBP-28527 BBP-28527 0.475 0.400 Green 0.54 - 37 -4.7 70 400 1 4.2 3.3
1432 BBP-20408 BBP-20408 0.475 0.311 Yellow 0.76 -6.6 70 -4.7 83 381 2 3.5 2.7
1433 BBP-21670 BBP-21670 0.475 0.277 Yellow 0.71 -6.6 101 -4.7 86 424 2 3.5 2.6
1434 BBP-22233 BBP-22233 0.475 0.315 Green 0.63 - 70 -4.7 70 402 2 4.0 2.8
1435 BBP-24538 BBP-24538 0.475 0.405 Green 0.54 - 31 -4.7 70 356 2 4.2 2.9
1436 BBP-19322 BBP-19322 0.474 0.330 Yellow 0.58 -7.3 52 -4.7 83 367 2 3.7 3.4
1437 BBP-19488 BBP-19488 0.474 0.378 Yellow 0.73 -7.4 78 -4.7 86 383 3 3.7 3.0
1438 BBP-22485 BBP-22485 0.474 0.348 Green 0.68 - 45 -4.7 79 400 2 3.9 3.0
1439 BBP-24554 BBP-24554 0.474 0.405 Green 0.50 - 32 -4.7 70 370 2 4.0 2.8
1440 BBP-28251 BBP-28251 0.474 0.398 Green 0.58 - 42 -4.7 70 356 2 4.2 3.1
1441 BBP-19453 BBP-19453 0.474 0.309 Yellow 0.67 -6.8 55 -5.3 86 386 2 2.6 2.7
1442 BBP-19216 BBP-19216 0.474 0.280 Yellow 0.49 -7.5 62 -4.7 83 371 2 3.0 3.0
1443 BBP-20303 BBP-20303 0.474 0.313 Yellow 0.65 -6.8 66 -4.9 86 382 2 2.7 2.7
1444 BBP-22317 BBP-22317 0.474 0.329 Green 0.59 - 40 -4.7 70 352 2 4.3 2.8
1445 BBP-25301 BBP-25301 0.474 0.422 Green 0.65 - 55 -4.7 82 433 2 3.3 3.0
1446 BBP-28687 BBP-28687 0.474 0.432 Green 0.54 - 63 -4.7 79 386 2 4.2 3.1
1447 BBP-20513 BBP-20513 0.474 0.289 Yellow 0.78 -6.6 68 -4.7 83 378 2 3.6 2.7
1448 BBP-21894 BBP-21894 0.474 0.470 Yellow 0.74 -7.1 52 -4.8 86 428 2 3.8 3.2
1449 BBP-23556 BBP-23556 0.474 0.432 Green 0.54 - 31 -4.7 70 356 2 4.2 2.9
1450 BBP-27321 BBP-27321 0.474 0.398 Green 0.59 - 27 -4.7 70 384 2 4.4 2.9