Compounds (21 results) Scaffold: C1CCC(CC2CC(CC3CCCC3)C(C3CC3)C... ×

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
144 BBP-26909 BBP-26909 0.545 0.551 Yellow 0.84 -7.2 36 -4.8 76 455 2 3.9 3.1
162 BBP-27312 BBP-27312 0.543 0.494 Yellow 0.81 -7.5 53 -4.8 76 451 2 4.1 3.0
175 BBP-28029 LEAD BBP-28029 0.541 0.579 Green 0.79 -7.7 30 -4.8 76 469 2 4.2 3.1
484 BBP-26995 BBP-26995 0.523 0.494 Yellow 0.84 -6.5 27 -4.8 76 455 2 3.9 3.0
625 BBP-25581 BBP-25581 0.517 0.579 Yellow 0.80 -6.8 35 -4.8 76 473 2 4.1 3.1
681 BBP-15555 BBP-15555 0.514 0.476 Yellow 0.86 -6.3 31 -4.8 76 437 2 3.8 2.9
710 BBP-27076 BBP-27076 0.513 0.494 Yellow 0.84 -6.1 46 -4.8 76 455 2 3.9 3.0
738 BBP-27354 BBP-27354 0.511 0.500 Yellow 0.82 -6.3 50 -4.8 76 455 2 3.9 3.0
1755 BBP-15587 BBP-15587 0.460 0.471 Yellow 0.76 -7.1 53 -4.8 82 438 2 4.2 3.0
2136 BBP-26944 BBP-26944 0.442 0.544 Yellow 0.78 - 69 -4.8 82 441 2 4.0 3.1
2352 BBP-27221 BBP-27221 0.429 0.488 Yellow 0.75 - 35 -4.8 86 423 2 4.4 3.1
2434 BBP-27150 BBP-27150 0.425 0.524 Yellow 0.66 - 49 -4.7 89 456 2 3.3 3.2
2605 BBP-27208 BBP-27208 0.417 0.449 Yellow 0.76 - 40 -4.8 82 456 2 4.4 3.6
2623 BBP-27339 BBP-27339 0.416 0.571 Yellow 0.69 - 44 -4.8 82 459 2 4.2 3.1
2676 BBP-27392 BBP-27392 0.413 0.512 Yellow 0.69 - 66 -4.8 89 472 2 3.8 3.2
2679 BBP-27232 BBP-27232 0.413 0.512 Yellow 0.74 - 48 -4.8 82 456 2 4.4 3.7
2700 BBP-27308 BBP-27308 0.412 0.449 Yellow 0.73 - 43 -4.8 82 456 2 4.4 3.6
2703 BBP-27510 BBP-27510 0.412 0.571 Yellow 0.69 - 54 -4.8 82 456 2 4.3 3.1
3052 BBP-27032 BBP-27032 0.375 0.512 Red 0.81 - 25 -4.8 76 451 2 4.1 3.1
3098 BBP-27244 BBP-27244 0.364 0.465 Red 0.81 - 31 -4.8 76 469 2 4.3 3.0
3144 BBP-27549 BBP-27549 0.349 0.524 Red 0.79 - 31 -4.8 76 469 2 4.3 3.6