Compounds (7 results) Scaffold: CC(C1CCCC1)C1CCCC(C2CCCC(CC3CC... ×

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
469 BBP-19664 BBP-19664 0.524 0.312 Yellow 0.69 -6.9 64 -4.7 79 378 2 3.5 3.2
1457 BBP-21656 BBP-21656 0.473 0.284 Green 0.58 -7.8 103 -4.7 87 383 2 3.9 3.1
1503 BBP-22302 BBP-22302 0.471 0.319 Green 0.66 - 68 -4.7 74 400 2 4.4 3.4
1848 BBP-19878 BBP-19878 0.456 0.274 Yellow 0.59 -7.3 62 -4.7 87 379 2 4.1 3.2
2071 BBP-19623 BBP-19623 0.445 0.274 Yellow 0.60 -7.1 80 -4.7 87 411 2 4.3 3.3
2106 BBP-19977 BBP-19977 0.443 0.277 Yellow 0.55 -7.2 78 -4.7 87 397 2 4.0 3.2
2196 BBP-19909 BBP-19909 0.438 0.287 Yellow 0.57 -6.9 95 -4.7 87 397 2 4.0 3.2