Compounds (3260 results)

Rank ID Structure Score 1664 Sim Traffic BBB Vina TPSA MW HBD SlogP SA
1 BBP-19373 BBP-19373 0.716 0.307 Green 0.75 -11.8 70 384 2 3.5 3.4
2 BBP-19847 BBP-19847 0.691 0.287 Green 0.79 -11.8 74 402 2 4.5 3.5
3 BBP-20936 LEAD BBP-20936 0.685 0.330 Green 0.65 -11.3 70 396 2 4.4 2.9
4 BBP-20312 BBP-20312 0.672 0.292 Green 0.70 -11.3 73 403 2 3.4 2.6
5 BBP-20330 BBP-20330 0.642 0.302 Green 0.65 -10.6 73 403 2 3.4 2.7
6 BBP-19265 BBP-19265 0.623 0.315 Green 0.74 -10.3 70 412 2 4.3 3.3
7 BBP-20392 BBP-20392 0.622 0.280 Green 0.66 -10.5 73 432 2 4.0 2.8
8 BBP-29015 LEAD BBP-29015 0.622 0.471 Green 0.83 -10.0 76 469 2 4.3 3.0
9 BBP-19846 BBP-19846 0.617 0.297 Green 0.63 -11.2 79 398 3 4.0 3.3
10 BBP-19792 LEAD BBP-19792 0.613 0.322 Green 0.76 -10.2 86 405 2 3.3 2.8
11 BBP-17489 BBP-17489 0.605 0.227 Green 0.64 -9.4 64 400 2 4.1 2.8
12 BBP-20502 BBP-20502 0.604 0.304 Green 0.82 -7.9 70 378 2 3.9 3.2
13 BBP-22105 BBP-22105 0.597 0.348 Green 0.72 -10.8 83 399 2 3.8 3.4
14 BBP-19906 BBP-19906 0.595 0.298 Yellow 0.80 -7.5 73 393 2 3.4 2.7
15 BBP-19935 BBP-19935 0.593 0.280 Yellow 0.81 -7.2 76 405 2 2.6 2.7
16 BBP-19827 BBP-19827 0.593 0.274 Green 0.70 -10.5 86 396 2 2.8 2.7
17 BBP-18735 BBP-18735 0.590 0.247 Yellow 0.78 -7.0 64 353 1 2.5 3.0
18 BBP-20865 BBP-20865 0.588 0.229 Green 0.68 -10.3 83 387 2 4.0 2.9
19 BBP-20707 BBP-20707 0.587 0.281 Green 0.56 -11.0 79 415 3 4.5 3.3
20 BBP-21552 BBP-21552 0.586 0.312 Green 0.73 -8.3 70 392 2 4.3 3.7
21 BBP-20293 LEAD BBP-20293 0.585 0.341 Green 0.73 -7.8 79 394 2 3.7 3.5
22 BBP-19512 BBP-19512 0.584 0.326 Green 0.72 -10.3 83 381 2 3.7 3.3
23 BBP-21722 BBP-21722 0.583 0.292 Green 0.60 -10.5 86 368 2 2.5 2.6
24 BBP-20424 BBP-20424 0.578 0.272 Yellow 0.78 -7.5 75 378 2 3.6 4.2
25 BBP-06255 BBP-06255 0.577 0.419 Yellow 0.75 -7.1 73 405 2 3.8 3.8
26 BBP-21771 BBP-21771 0.575 0.277 Green 0.73 -7.8 61 400 2 4.4 3.1
27 BBP-20252 BBP-20252 0.575 0.293 Green 0.63 -8.0 70 388 2 4.4 3.1
28 BBP-20355 BBP-20355 0.574 0.278 Green 0.59 -8.3 61 374 1 3.3 3.1
29 BBP-25942 BBP-25942 0.574 0.513 Yellow 0.60 -7.5 70 382 2 4.3 3.1
30 BBP-02209 BBP-02209 0.574 0.500 Yellow 0.78 -6.9 76 455 2 3.9 3.1
31 BBP-19170 LEAD BBP-19170 0.574 0.333 Green 0.64 -8.1 70 364 2 3.8 2.7
32 BBP-21742 BBP-21742 0.572 0.272 Yellow 0.78 -7.3 57 352 2 4.3 3.7
33 BBP-19681 BBP-19681 0.572 0.276 Yellow 0.79 -7.4 73 390 2 3.2 3.2
34 BBP-22082 BBP-22082 0.572 0.371 Yellow 0.82 -7.2 76 455 2 3.9 3.1
35 BBP-19302 BBP-19302 0.572 0.308 Green 0.74 -8.0 61 388 1 3.7 3.4
36 BBP-19377 BBP-19377 0.571 0.330 Green 0.68 -10.3 86 414 2 3.4 3.3
37 BBP-22120 BBP-22120 0.569 0.319 Yellow 0.72 -7.0 73 417 2 3.4 3.2
38 BBP-18358 BBP-18358 0.569 0.276 Green 0.74 -7.6 70 360 2 3.7 2.8
39 BBP-19262 BBP-19262 0.568 0.304 Green 0.76 -7.9 61 384 1 3.9 3.5
40 BBP-19767 BBP-19767 0.568 0.284 Yellow 0.68 -7.3 70 360 2 4.3 2.8
41 BBP-21240 BBP-21240 0.567 0.318 Green 0.82 -7.8 57 373 2 4.3 3.1
42 BBP-19247 BBP-19247 0.567 0.315 Green 0.76 -7.8 61 402 1 4.1 3.0
43 BBP-27404 BBP-27404 0.567 0.463 Yellow 0.77 -7.3 78 421 2 4.5 3.2
44 BBP-19294 BBP-19294 0.566 0.308 Green 0.74 -7.8 61 388 1 3.7 3.4
45 BBP-19865 BBP-19865 0.565 0.266 Green 0.72 -8.0 73 423 2 4.1 2.4
46 BBP-27389 BBP-27389 0.565 0.462 Yellow 0.71 -7.1 70 384 2 4.4 3.0
47 BBP-18257 BBP-18257 0.565 0.322 Yellow 0.82 -7.3 61 384 1 3.9 2.8
48 BBP-21115 BBP-21115 0.564 0.272 Yellow 0.63 -7.3 70 374 2 3.8 3.5
49 BBP-21456 BBP-21456 0.564 0.264 Green 0.61 -7.7 61 377 1 3.9 3.1
50 BBP-20221 BBP-20221 0.563 0.315 Yellow 0.72 -7.4 61 378 1 3.9 3.0