Compounds (23 results) Scaffold: C1CCC(CC2CC(CC3CCC(C4CCCC4)CC3... ×

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
1215 BBP-23380 BBP-23380 0.487 0.416 Green 0.78 - 42 -4.7 73 422 2 4.5 3.5
1581 BBP-27850 BBP-27850 0.468 0.435 Green 0.67 - 32 -4.7 72 425 3 4.1 3.3
1672 BBP-26945 BBP-26945 0.463 0.407 Green 0.69 - 35 -4.7 73 443 2 4.4 3.8
2241 BBP-27292 BBP-27292 0.435 0.437 Yellow 0.79 - 45 -4.8 86 423 2 3.9 3.7
2427 BBP-27438 BBP-27438 0.425 0.435 Yellow 0.67 - 47 -4.8 86 408 2 4.0 3.1
2443 BBP-28985 BBP-28985 0.424 0.488 Yellow 0.75 - 62 -4.8 86 440 2 4.0 3.7
2467 BBP-26280 BBP-26280 0.423 0.471 Yellow 0.76 - 66 -4.8 86 437 2 4.2 3.8
2488 BBP-27215 BBP-27215 0.421 0.458 Yellow 0.70 - 34 -4.8 86 423 2 4.3 3.2
2599 BBP-27280 BBP-27280 0.417 0.452 Yellow 0.61 - 47 -4.8 86 408 2 4.0 3.1
2610 BBP-27406 BBP-27406 0.417 0.471 Yellow 0.74 - 65 -4.8 85 440 3 3.9 3.4
2674 BBP-27197 BBP-27197 0.413 0.416 Yellow 0.64 - 53 -4.7 85 426 3 3.5 3.3
2789 BBP-26161 BBP-26161 0.407 0.470 Yellow 0.59 - 52 -4.7 85 426 3 3.5 3.3
2853 BBP-26947 BBP-26947 0.403 0.469 Yellow 0.65 - 45 -4.7 82 425 3 4.3 3.7
2900 BBP-27467 BBP-27467 0.398 0.446 Yellow 0.67 - 64 -4.7 82 425 3 4.3 3.7
2911 BBP-27908 BBP-27908 0.397 0.454 Yellow 0.61 - 52 -4.8 82 456 2 4.4 3.6
2923 BBP-28279 BBP-28279 0.396 0.420 Yellow 0.59 - 44 -4.8 86 423 2 4.4 3.7
2964 BBP-28822 BBP-28822 0.391 0.506 Yellow 0.48 - 75 -4.8 88 428 2 4.2 3.3
2999 BBP-23594 BBP-23594 0.386 0.420 Yellow 0.79 - 58 -4.7 73 422 2 4.5 3.5
3010 BBP-23639 BBP-23639 0.383 0.344 Yellow 0.78 - 37 -4.7 73 425 2 4.3 3.7
3168 BBP-23641 BBP-23641 0.336 0.420 Red 0.78 - 39 -4.8 86 423 2 3.9 3.7
3172 BBP-23417 BBP-23417 0.334 0.416 Red 0.77 - 38 -4.8 86 423 2 3.9 3.7
3180 BBP-23450 BBP-23450 0.331 0.412 Red 0.63 - 52 -4.8 86 390 2 3.9 3.0
3219 BBP-23574 BBP-23574 0.314 0.402 Red 0.73 - 47 -4.8 82 452 2 4.5 3.6