Compounds (14 results) Scaffold: C1CCC(C2CC2C2CCCC(CC3CCCC3)C2)... ×

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
307 BBP-19358 BBP-19358 0.532 0.341 Green 0.62 -7.7 33 -4.7 70 370 2 3.9 3.6
544 BBP-20566 BBP-20566 0.521 0.308 Yellow 0.74 -7.3 76 -4.7 74 393 2 4.3 3.6
640 BBP-20270 BBP-20270 0.516 0.299 Yellow 0.67 -7.2 55 -4.7 66 355 2 4.4 3.9
702 BBP-20973 BBP-20973 0.513 0.318 Yellow 0.56 -7.2 49 -4.7 70 370 2 3.9 3.7
869 BBP-19299 BBP-19299 0.506 0.295 Yellow 0.71 -7.0 36 -4.7 70 398 2 4.4 4.0
950 BBP-19477 BBP-19477 0.501 0.279 Yellow 0.63 -6.7 40 -4.7 66 355 2 4.4 3.6
1033 BBP-20943 BBP-20943 0.496 0.318 Yellow 0.58 -6.8 46 -4.7 70 384 2 4.2 3.9
1172 BBP-23143 BBP-23143 0.489 0.307 Green 0.74 - 57 -4.7 57 369 2 4.5 3.6
1223 BBP-20816 BBP-20816 0.486 0.319 Yellow 0.73 -6.4 64 -4.7 74 397 2 4.1 3.6
1296 BBP-21519 BBP-21519 0.482 0.329 Yellow 0.59 -6.2 46 -4.7 70 352 2 3.7 3.8
1360 BBP-22305 BBP-22305 0.478 0.284 Green 0.67 - 45 -4.7 66 355 2 4.3 3.7
1418 BBP-22891 BBP-22891 0.475 0.319 Green 0.66 - 21 -4.7 70 384 2 4.3 3.8
1943 BBP-17639 BBP-17639 0.452 0.311 Green 0.60 -7.6 103 -4.7 87 380 2 3.4 3.6
2278 BBP-18346 BBP-18346 0.433 0.278 Yellow 0.48 -7.0 78 -4.7 89 354 2 3.4 3.7