Compounds (14 results) Scaffold: C1CCC(CC2CCCC(C3CCC4CC(C5CC5)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
50 BBP-20221 BBP-20221 0.563 0.315 Yellow 0.72 -7.4 46 -4.7 61 378 1 3.9 3.0
91 BBP-19141 BBP-19141 0.552 0.337 Green 0.66 -7.6 51 -4.7 70 382 2 4.0 2.9
98 BBP-19154 BBP-19154 0.551 0.319 Yellow 0.68 -7.4 43 -4.7 61 396 1 4.0 3.2
179 BBP-21281 BBP-21281 0.541 0.326 Yellow 0.70 -7.2 52 -4.7 57 363 2 4.4 2.8
186 BBP-20063 BBP-20063 0.540 0.348 Yellow 0.70 -7.2 54 -4.7 70 382 2 4.0 3.1
188 BBP-19146 BBP-19146 0.540 0.330 Yellow 0.67 -7.3 50 -4.7 70 378 2 4.1 2.9
231 BBP-21095 BBP-21095 0.537 0.333 Yellow 0.64 -7.2 51 -4.7 70 364 2 3.8 2.8
354 BBP-20414 BBP-20414 0.530 0.292 Yellow 0.70 -6.9 40 -4.7 61 392 1 4.2 3.1
442 BBP-21179 BBP-21179 0.525 0.295 Yellow 0.68 -7.0 32 -4.7 61 410 1 4.4 3.2
540 BBP-20139 BBP-20139 0.521 0.345 Yellow 0.65 -6.7 57 -4.7 70 364 2 3.8 3.0
784 BBP-20354 BBP-20354 0.509 0.312 Yellow 0.61 -7.4 52 -4.7 74 447 1 4.3 3.5
1246 BBP-22276 BBP-22276 0.485 0.287 Green 0.67 - 50 -4.7 70 381 2 4.3 2.8
1273 BBP-19159 BBP-19159 0.483 0.344 Yellow 0.63 -7.2 64 -4.7 83 383 2 3.4 3.1
1749 BBP-19931 BBP-19931 0.460 0.295 Yellow 0.59 -6.8 68 -4.7 87 394 1 3.0 3.3