0 B35R5.605086454 CC[C@H](Nc1ccnc2n1ncc2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0018 [0,0,0,0,0,0|3,0,0]=3 1 B35R5.605086454 CC[C@H](Nc1ccnc2n1ncc2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0018 [0,0,0,0,0,0|3,0,0]=3 2 B35R5.605086454 CC[C@H](Nc1ncnc2c1CCC2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0368 [0,0,0,0,0,0|2,0,1]=3 3 B35R5.605086454 CC[C@H](Nc1ncnc2c1CCC2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0368 [0,0,0,0,0,0|2,0,1]=3 4 B35R5.605086454 CC[C@H](Nc1ncnc2c1[nH]cc2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0194 [0,0,0,0,0,0|1,0,1]=2 5 B35R5.605086454 CC[C@H](Nc1ncnc2c1[nH]cc2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0194 [0,0,0,0,0,0|1,0,1]=2 6 B35R5.605086454 CC[C@H](Nc1ncnc2c1cc[nH]2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0055 [0,0,0,0,0,0|1,0,0]=1 7 B35R5.605086454 CC[C@H](Nc1ncnc2c1cc[nH]2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0055 [0,0,0,0,0,0|1,0,0]=1 8 B35R5.605086454 CC[C@H](Nc1ncnc2c1cco2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0417 [0,0,0,0,0,0|2,0,0]=2 9 B35R5.605086454 CC[C@H](Nc1ncnc2c1cco2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0417 [0,0,0,0,0,0|2,0,0]=2 10 B35R5.605086454 CC[C@H](Nc1ncnc2c1ccs2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0097 [0,0,0,0,0,0|2,0,0]=2 11 B35R5.605086454 CC[C@H](Nc1ncnc2c1ccs2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0097 [0,0,0,0,0,0|2,0,0]=2 12 B35R5.605086454 CC[C@H](Nc1ncnc2c1cn[nH]2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594PY0172 [0,0,0,0,0,0|2,0,0]=2 13 B35R5.605086454 CC[C@H](Nc1ncnc2c1cn[nH]2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594PY0172 [0,0,0,0,0,0|2,0,0]=2 14 B35R5.605086454 CC[C@H](Nc1ncnc2c1scc2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0180 [0,0,0,0,0,0|2,0,0]=2 15 B35R5.605086454 CC[C@H](Nc1ncnc2c1scc2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0180 [0,0,0,0,0,0|2,0,0]=2 16 B35R5.605086454 CC[C@H](Nc1ncnn2c1ccc2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP3349 [0,0,0,0,0,0|3,0,0]=3 17 B35R5.605086454 CC[C@H](Nc1ncnn2c1ccc2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP3349 [0,0,0,0,0,0|3,0,0]=3 18 B36R5.568812764 CC[C@H](Nc1nc(nc2c1CCC2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP1986 [0,1,0,0,0,0|2,0,1]=4 19 B36R5.568812764 CC[C@H](Nc1nc(nc2c1CCC2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP1986 [0,1,0,0,0,0|2,0,1]=4 20 B36R5.568812764 CC[C@H](Nc1nc(nc2c1cn[nH]2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594PY0466 [0,1,0,0,0,0|2,0,0]=3 21 B36R5.568812764 CC[C@H](Nc1nc(nc2c1cn[nH]2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594PY0466 [0,1,0,0,0,0|2,0,0]=3 22 B36R5.568812764 CC[C@H](Nc1nc(nc2c1scc2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0092 [0,1,0,0,0,0|2,0,0]=3 23 B36R5.568812764 CC[C@H](Nc1nc(nc2c1scc2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0092 [0,1,0,0,0,0|2,0,0]=3 24 B36R5.668026448 CC[C@H](Nc1ncnc2c1[nH]cc2Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0529 [0,1,0,0,0,0|1,0,1]=3 25 B36R5.668026448 CC[C@H](Nc1ncnc2c1[nH]cc2Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0529 [0,1,0,0,0,0|1,0,1]=3 26 B36R5.668026448 CC[C@H](Nc1ncnc2c1ccn2C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0456 [0,1,0,0,0,0|1,0,0]=2 27 B36R5.668026448 CC[C@H](Nc1ncnc2c1ccn2C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0456 [0,1,0,0,0,0|1,0,0]=2 28 B36R5.668026448 CC[C@H](Nc1ncnc2c1cnn2C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP3353 [0,1,0,0,0,0|2,0,0]=3 29 B36R5.668026448 CC[C@H](Nc1ncnc2c1cnn2C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP3353 [0,1,0,0,0,0|2,0,0]=3 30 B36R5.668026448 CC[C@H](Nc1ncnc2c1ncn2C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0352 [0,1,0,0,0,0|0,0,0]=1 31 B36R5.668026448 CC[C@H](Nc1ncnc2c1ncn2C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0352 [0,1,0,0,0,0|0,0,0]=1 32 B36R5.668026448 CC[C@H](Nc1ncnc2c1scc2Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0532 [0,1,0,0,0,0|2,0,0]=3 33 B36R5.668026448 CC[C@H](Nc1ncnc2c1scc2Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0532 [0,1,0,0,0,0|2,0,0]=3 34 B36R5.668026448 CC[C@H](Nc1ncnc2c1scc2C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0636 [0,1,0,0,0,0|2,0,0]=3 35 B36R5.668026448 CC[C@H](Nc1ncnc2c1scc2C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0636 [0,1,0,0,0,0|2,0,0]=3 36 B36R5.668060396 CC[C@H](Nc1ccnc2n1nc(c2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP3359 [0,1,0,0,0,0|3,0,0]=4 37 B36R5.668060396 CC[C@H](Nc1ccnc2n1nc(c2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP3359 [0,1,0,0,0,0|3,0,0]=4 38 B36R5.668060396 CC[C@H](Nc1ncnc2c1CC(=O)N2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0135 [0,1,0,0,0,0|1,0,0]=2 39 B36R5.668060396 CC[C@H](Nc1ncnc2c1CC(=O)N2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0135 [0,1,0,0,0,0|1,0,0]=2 40 B36R5.668060396 CC[C@H](Nc1ncnc2c1cc([nH]2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0533 [0,1,0,0,0,0|1,0,0]=2 41 B36R5.668060396 CC[C@H](Nc1ncnc2c1cc([nH]2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0533 [0,1,0,0,0,0|1,0,0]=2 42 B36R5.668060396 CC[C@H](Nc1ncnc2c1cc([nH]2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0780 [0,1,0,0,0,0|1,0,0]=2 43 B36R5.668060396 CC[C@H](Nc1ncnc2c1cc([nH]2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0780 [0,1,0,0,0,0|1,0,0]=2 44 B36R5.668060396 CC[C@H](Nc1ncnc2c1cc(s2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0544 [0,1,0,0,0,0|2,0,0]=3 45 B36R5.668060396 CC[C@H](Nc1ncnc2c1cc(s2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0544 [0,1,0,0,0,0|2,0,0]=3 46 B36R5.668060396 CC[C@H](Nc1ncnc2c1nc([nH]2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP3356 [0,1,0,0,0,0|0,0,0]=1 47 B36R5.668060396 CC[C@H](Nc1ncnc2c1nc([nH]2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP3356 [0,1,0,0,0,0|0,0,0]=1 48 B36R5.668060396 CC[C@H](Nc1ncnc2c1sc(c2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0534 [0,1,0,0,0,0|2,0,0]=3 49 B36R5.668060396 CC[C@H](Nc1ncnc2c1sc(c2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0534 [0,1,0,0,0,0|2,0,0]=3 50 B36R5.668060396 CC[C@H](Nc1ncnc2c1sc(c2)I)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0012 [0,1,0,0,0,0|2,0,0]=3 51 B36R5.668060396 CC[C@H](Nc1ncnc2c1sc(c2)I)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0012 [0,1,0,0,0,0|2,0,0]=3 52 B36R5.668060396 CC[C@H](Nc1ncnn2c1cc(c2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0556 [0,1,0,0,0,0|3,0,0]=4 53 B36R5.668060396 CC[C@H](Nc1ncnn2c1cc(c2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0556 [0,1,0,0,0,0|3,0,0]=4 54 B36R5.668065002 CC[C@H](Nc1ncnc2c1c([nH]n2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594PY0042 [0,1,0,0,0,0|2,0,1]=4 55 B36R5.668065002 CC[C@H](Nc1ncnc2c1c([nH]n2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594PY0042 [0,1,0,0,0,0|2,0,1]=4 56 B36R5.668065002 CC[C@H](Nc1ncnc2c1c(c[nH]2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0065 [0,1,0,0,0,0|1,0,0]=2 57 B36R5.668065002 CC[C@H](Nc1ncnc2c1c(c[nH]2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0065 [0,1,0,0,0,0|1,0,0]=2 58 B36R5.668065002 CC[C@H](Nc1ncnc2c1c(c[nH]2)I)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0005 [0,1,0,0,0,0|1,0,0]=2 59 B36R5.668065002 CC[C@H](Nc1ncnc2c1c(c[nH]2)I)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0005 [0,1,0,0,0,0|1,0,0]=2 60 B36R5.668065002 CC[C@H](Nc1ncnc2c1c(cs2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0445 [0,1,0,0,0,0|2,0,0]=3 61 B36R5.668065002 CC[C@H](Nc1ncnc2c1c(cs2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0115 [0,1,0,0,0,0|2,0,0]=3 62 B36R5.668065002 CC[C@H](Nc1ncnc2c1c(cs2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0115 [0,1,0,0,0,0|2,0,0]=3 63 B36R5.668065002 CC[C@H](Nc1ncnc2c1c(n[nH]2)I)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594PY1247 [0,1,0,0,0,0|2,0,0]=3 64 B36R5.668065002 CC[C@H](Nc1ncnc2c1c(n[nH]2)I)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594PY1247 [0,1,0,0,0,0|2,0,0]=3 65 B36R5.668065002 CC[C@H](Nc1ncnc2c1n(cn2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0517 [0,1,0,0,0,0|0,0,2]=3 66 B36R5.668065002 CC[C@H](Nc1ncnc2c1n(cn2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0517 [0,1,0,0,0,0|0,0,2]=3 67 B36R5.668065002 CC[C@H](Nc1ncnc2c1n(nc2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP3355 [0,1,0,0,0,0|2,0,1]=4 68 B36R5.668065002 CC[C@H](Nc1ncnc2c1n(nc2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP3355 [0,1,0,0,0,0|2,0,1]=4 69 B36R5.668065002 CC[C@H](Nc1ncnn2c1c(cc2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0743 [0,1,0,0,0,0|3,0,0]=4 70 B36R5.668065002 CC[C@H](Nc1ncnn2c1c(cc2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0743 [0,1,0,0,0,0|3,0,0]=4 71 B34R4.539483868 CC[C@H](Nc1cc(ncn1)COC)c2nc3cccc(c3c(=O)n2c4ccccc4)F WXVL_AK3594LP0867 [0,0,1,0,0,0|3,0,0]=4 72 B34R4.539483868 CC[C@H](Nc1cc(ncn1)COC)c2nc3cccc(c3c(=O)n2c4ccccc4)F WXVL_AK3594LP0867 [0,0,1,0,0,0|3,0,0]=4 73 B34R4.731656076 CC[C@H](Nc1ncnc(c1C)OC)c2nc3cccc(c3c(=O)n2c4ccccc4)F WXVL_AK3594LP1011 [0,0,1,0,0,0|2,0,1]=4 74 B34R4.731656076 CC[C@H](Nc1ncnc(c1C)OC)c2nc3cccc(c3c(=O)n2c4ccccc4)F WXVL_AK3594LP1011 [0,0,1,0,0,0|2,0,1]=4 75 B34R4.731656076 CCc1ncnc(c1F)N[C@@H](CC)c2nc3cccc(c3c(=O)n2c4ccccc4)F WXVL_AK3594LP0523 [0,0,1,0,0,0|2,0,1]=4 76 B34R4.731656076 CCc1ncnc(c1F)N[C@@H](CC)c2nc3cccc(c3c(=O)n2c4ccccc4)F WXVL_AK3594LP0523 [0,0,1,0,0,0|2,0,1]=4 77 B36R5.668038401 CC[C@H](Nc1ncnc2c1CCCC2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0945 [0,0,0,0,0,1|2,0,1]=4 78 B36R5.668038401 CC[C@H](Nc1ncnc2c1CCCC2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0945 [0,0,0,0,0,1|2,0,1]=4 79 B36R5.668038401 CC[C@H](Nc1ncnc2c1cccc2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0257 [0,0,0,0,0,1|2,0,0]=3 80 B36R5.668038401 CC[C@H](Nc1ncnc2c1cccc2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0257 [0,0,0,0,0,1|2,0,0]=3 81 B36R5.668038401 CC[C@H](Nc1ncnc2c1ccnc2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0471 [0,0,0,0,0,1|1,0,1]=3 82 B36R5.668038401 CC[C@H](Nc1ncnc2c1ccnc2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0471 [0,0,0,0,0,1|1,0,1]=3 83 B36R5.668038401 CC[C@H](Nc1ncnc2c1nccc2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0411 [0,0,0,0,0,1|1,0,0]=2 84 B36R5.668038401 CC[C@H](Nc1ncnc2c1nccc2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0411 [0,0,0,0,0,1|1,0,0]=2 85 B33R4.74227714 CC[C@H](Nc1ncnc(c1Br)C)c2nc3cccc(c3c(=O)n2c4ccccc4)F WXVL_AK3594LQ2336 [1,0,1,0,0,0|1,0,1]=4 86 B33R4.74227714 CC[C@H](Nc1ncnc(c1Br)C)c2nc3cccc(c3c(=O)n2c4ccccc4)F WXVL_AK3594LQ2336 [1,0,1,0,0,0|1,0,1]=4 87 B33R4.98352773 CC[C@H](Nc1ncncc1C#N)c2nc3cccc(c3c(=O)n2c4ccccc4)F WXVL_AK3594LP1249 [1,0,1,0,0,0|0,0,2]=4 88 B33R4.98352773 CC[C@H](Nc1ncncc1C#N)c2nc3cccc(c3c(=O)n2c4ccccc4)F WXVL_AK3594LP1249 [1,0,1,0,0,0|0,0,2]=4 89 B33R4.98352773 CC[C@H](Nc1ncncc1OC)c2nc3cccc(c3c(=O)n2c4ccccc4)F WXVL_AK3594LP0652 [1,0,1,0,0,0|1,0,1]=4 90 B33R4.98352773 CC[C@H](Nc1ncncc1OC)c2nc3cccc(c3c(=O)n2c4ccccc4)F WXVL_AK3594LP0652 [1,0,1,0,0,0|1,0,1]=4 91 B33R4.418801706 CC[C@H](Nc1cc(ncn1)C#N)c2nc3cccc(c3c(=O)n2c4ccccc4)F WXVL_AK3594LP1065 [1,0,1,0,0,0|0,0,2]=4 92 B33R4.418801706 CC[C@H](Nc1cc(ncn1)C#N)c2nc3cccc(c3c(=O)n2c4ccccc4)F WXVL_AK3594LP1065 [1,0,1,0,0,0|0,0,2]=4 93 B33R4.418801706 CC[C@H](Nc1cc(ncn1)OC)c2nc3cccc(c3c(=O)n2c4ccccc4)F WXVL_AK3594LP0072 [1,0,1,0,0,0|1,0,1]=4 94 B33R4.418801706 CC[C@H](Nc1cc(ncn1)OC)c2nc3cccc(c3c(=O)n2c4ccccc4)F WXVL_AK3594LP0072 [1,0,1,0,0,0|1,0,1]=4 95 B33R4.418801706 CC[C@H](Nc1cc(ncn1)SC)c2nc3cccc(c3c(=O)n2c4ccccc4)F WXVL_AK3594LP0441 [1,0,1,0,0,0|1,0,1]=4 96 B33R4.418801706 CC[C@H](Nc1cc(ncn1)SC)c2nc3cccc(c3c(=O)n2c4ccccc4)F WXVL_AK3594LP0441 [1,0,1,0,0,0|1,0,1]=4 97 B37R5.576506637 CC[C@H](NC(=O)c1cccc2c1nc[nH]2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594SE1553 [0,1,0,0,0,1|2,0,0]=4 98 B37R5.576506637 CC[C@H](NC(=O)c1cccc2c1nc[nH]2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594SE1553 [0,1,0,0,0,1|2,0,0]=4 99 B37R5.576506637 CC[C@H](NC(=O)c1nccc2c1cc[nH]2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594SE1801 [0,1,0,0,0,1|2,0,0]=4 100 B37R5.576506637 CC[C@H](NC(=O)c1nccc2c1cc[nH]2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594SE1801 [0,1,0,0,0,1|2,0,0]=4 101 B37R5.576506637 CC[C@H](NC(=O)c1nccc2c1nc[nH]2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594SE1960 [0,1,0,0,0,1|1,0,0]=3 102 B37R5.576506637 CC[C@H](NC(=O)c1nccc2c1nc[nH]2)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594SE1960 [0,1,0,0,0,1|1,0,0]=3 103 B37R5.605959628 CC[C@H](Nc1nc(nc2c1cccc2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0578 [0,1,0,0,0,1|2,0,0]=4 104 B37R5.605959628 CC[C@H](Nc1nc(nc2c1cccc2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0578 [0,1,0,0,0,1|2,0,0]=4 105 B37R5.728497058 CC[C@H](Nc1ncnc2c1ccc(c2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LQ2479 [0,1,0,0,0,1|2,0,0]=4 106 B37R5.728497058 CC[C@H](Nc1ncnc2c1ccc(c2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LQ2479 [0,1,0,0,0,1|2,0,0]=4 107 B37R5.728497058 CC[C@H](Nc1ncnc2c1ccc(c2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP1016 [0,1,0,0,0,1|2,0,0]=4 108 B37R5.728497058 CC[C@H](Nc1ncnc2c1ccc(c2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP1016 [0,1,0,0,0,1|2,0,0]=4 109 B37R5.728497058 CC[C@H](Nc1ncnc2c1ccc(c2)F)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0376 [0,1,0,0,0,1|2,0,0]=4 110 B37R5.728497058 CC[C@H](Nc1ncnc2c1ccc(c2)F)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0376 [0,1,0,0,0,1|2,0,0]=4 111 B37R5.728501092 CC[C@H](Nc1ncnc2c1cccc2Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LQ2165 [0,1,0,0,0,1|2,0,0]=4 112 B37R5.728501092 CC[C@H](Nc1ncnc2c1cccc2Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LQ2165 [0,1,0,0,0,1|2,0,0]=4 113 B37R5.728501092 CC[C@H](Nc1ncnc2c1cccc2C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0618 [0,1,0,0,0,1|2,0,0]=4 114 B37R5.728501092 CC[C@H](Nc1ncnc2c1cccc2C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0618 [0,1,0,0,0,1|2,0,0]=4 115 B37R5.728501092 CC[C@H](Nc1ncnc2c1cccc2F)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0953 [0,1,0,0,0,1|2,0,0]=4 116 B37R5.728501092 CC[C@H](Nc1ncnc2c1cccc2F)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0953 [0,1,0,0,0,1|2,0,0]=4 117 B37R5.1139382028 CC[C@H](Nc1ncnc2c1c(ccc2)F)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP1408 [0,1,0,0,0,1|2,0,0]=4 118 B37R5.1139382028 CC[C@H](Nc1ncnc2c1c(ccc2)F)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP1408 [0,1,0,0,0,1|2,0,0]=4 119 B37R5.1139451608 CC[C@H](Nc1ncnc2c1cc(cc2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LQ2091 [0,1,0,0,0,1|2,0,0]=4 120 B37R5.1139451608 CC[C@H](Nc1ncnc2c1cc(cc2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LQ2091 [0,1,0,0,0,1|2,0,0]=4 121 B37R5.1139451608 CC[C@H](Nc1ncnc2c1cc(cc2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0622 [0,1,0,0,0,1|2,0,0]=4 122 B37R5.1139451608 CC[C@H](Nc1ncnc2c1cc(cc2)C)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0622 [0,1,0,0,0,1|2,0,0]=4 123 B37R5.1139451608 CC[C@H](Nc1ncnc2c1cc(cc2)F)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0380 [0,1,0,0,0,1|2,0,0]=4 124 B37R5.1139451608 CC[C@H](Nc1ncnc2c1cc(cc2)F)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0380 [0,1,0,0,0,1|2,0,0]=4 125 B37R5.1139451608 CC[C@H](Nc1ncnc2c1cc(cc2)I)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP3352 [0,1,0,0,0,1|2,0,0]=4 126 B37R5.1139451608 CC[C@H](Nc1ncnc2c1cc(cc2)I)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP3352 [0,1,0,0,0,1|2,0,0]=4 127 B37R5.1139451608 CC[C@H](Nc1ncnc2c1cc(cn2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LQ2122 [0,1,0,0,0,1|1,0,1]=4 128 B37R5.1139451608 CC[C@H](Nc1ncnc2c1cc(cn2)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LQ2122 [0,1,0,0,0,1|1,0,1]=4 129 B37R5.1139392632 CC[C@H](Nc1ncnc2c1cc(n2C)I)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0283 [0,2,0,0,0,0|1,0,0]=3 130 B37R5.1139392632 CC[C@H](Nc1ncnc2c1cc(n2C)I)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LR0283 [0,2,0,0,0,0|1,0,0]=3 131 B37R5.1139459472 CC[C@H](Nc1ncnc2c1c(cn2C)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP3354 [0,2,0,0,0,0|1,0,0]=3 132 B37R5.1139459472 CC[C@H](Nc1ncnc2c1c(cn2C)Br)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP3354 [0,2,0,0,0,0|1,0,0]=3 133 B37R5.1112928165 CC[C@H](Nc1ncnc2c1c(c[nH]2)C#N)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0102 [0,2,0,0,0,0|1,0,0]=3 134 B37R5.1112928165 CC[C@H](Nc1ncnc2c1c(c[nH]2)C#N)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP0102 [0,2,0,0,0,0|1,0,0]=3 135 B35R5.240907314 CC[C@H](Nc1cc2ncnn2cn1)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP3351 [0,0,1,1,0,0|0,0,2]=4 136 B35R5.240907314 CC[C@H](Nc1cc2ncnn2cn1)c3nc4cccc(c4c(=O)n3c5ccccc5)F WXVL_AK3594LP3351 [0,0,1,1,0,0|0,0,2]=4