0 B17R3.31811 CN1C=NC2=C(C1=O)NC3=C2C=CC=C3 MCULE-8134321752 [0,0,0,0,0,0|0,0,0]=0 1 B17R3.31811 CN1C=NC2=C(C1=O)OC3=C2C=CC=C3 MCULE-6718593764 [0,0,0,0,0,0|1,0,0]=1 2 B17R3.31811 CN1CCC2=C(C1=O)NC3=CC=CC=C23 MCULE-9691326573 [0,0,0,0,0,0|1,0,1]=2 3 B17R3.31811 CN1N=NC2=C(C1=O)NC3=C2C=CC=C3 MCULE-2316144077 [0,0,0,0,0,0|1,0,0]=1 4 B17R3.31811 NN1C=NC2=C(C1=O)NC3=C2C=CC=C3 MCULE-6686443851 [0,0,0,0,0,0|1,0,0]=1 5 B16R3.2637 BrC1=CC2=C(C=C1)C3=CC=CC=C3N2 MCULE-9731588416 [1,0,0,0,0,0|3,0,0]=4 6 B16R3.2637 CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3 MCULE-4658386723 [1,0,0,0,0,0|3,0,0]=4 7 B16R3.2637 CC1=CC2=C(C=N1)C3=CC=CC=C3N2 MCULE-2346995590 [1,0,0,0,0,0|3,0,0]=4 8 B16R3.2637 CC1=CC=C2C(=C1)NC3=C2C=CC=C3 MCULE-7653801588 [1,0,0,0,0,0|2,0,0]=3 9 B16R3.2637 CN1CCC2=C(C1)NC3=C2C=CC=C3 MCULE-2318549673 [1,0,0,0,0,0|1,0,2]=4 10 B16R3.2637 C[N+]1=CC2=C(CC1)C3=C(N2)C=CC=C3 MCULE-1304770593 [1,0,0,0,0,0|1,0,2]=4 11 B16R3.2637 C[N+]1=CC2=C(CC1)C3=C(N2)C=CC=C3 MCULE-4957211827 [1,0,0,0,0,0|1,0,2]=4 12 B16R3.2637 ClC1=CC=C2C(=C1)NC3=C2C=CC=C3 MCULE-3062050098 [1,0,0,0,0,0|3,0,0]=4 13 B16R3.2637 FC1=CC2=C(C=C1)C3=C(N2)C=CC=C3 MCULE-3926920620 [1,0,0,0,0,0|3,0,0]=4 14 B16R3.2637 IC1=CC2=C(C=C1)C3=C(N2)C=CC=C3 MCULE-9242626732 [1,0,0,0,0,0|3,0,0]=4 15 B16R3.2637 NC1=CC2=C(C=C1)C3=CC=CC=C3N2 MCULE-6046693396 [1,0,0,0,0,0|3,0,0]=4 16 B16R3.2637 OC1=CC2=C(C=C1)C3=C(N2)C=CC=C3 MCULE-8116402305 [1,0,0,0,0,0|3,0,0]=4 17 B16R3.2637 [O-][N+]1=CC2=C(C=C1)C3=CC=CC=C3N2 MCULE-1793385060 [1,0,0,0,0,0|2,0,1]=4 18 B16R3.3329 BrC1=CC=CC2=C1NC3=C2C=CC=C3 MCULE-4840876718 [1,0,0,0,0,0|3,0,0]=4 19 B16R3.3329 BrC1=NC=CC2=C1NC3=C2C=CC=C3 MCULE-3912879453 [1,0,0,0,0,0|2,0,1]=4 20 B16R3.3329 CC1=CC=CC2=C1NC3=C2C=CC=C3 MCULE-8739693160 [1,0,0,0,0,0|3,0,0]=4 21 B16R3.3329 CC1=NC=CC2=C1NC3=C2C=CC=C3 MCULE-5624408480 [1,0,0,0,0,0|2,0,1]=4 22 B16R3.3329 CC1=NC=CC2=C1NC3=CC=CC=C23 MCULE-7967173312 [1,0,0,0,0,0|2,0,1]=4 23 B16R3.3329 ClC1=C2CC3=C(C2=NC=N1)C=CC=C3 MCULE-7569251642 [1,0,0,0,0,0|2,0,1]=4 24 B16R3.3329 ClC1=CC=CC2=C1NC3=C2C=CC=C3 MCULE-9311683530 [1,0,0,0,0,0|3,0,0]=4 25 B16R3.3329 ClC1=NC=NC2=C1NC3=C2C=CC=C3 MCULE-5077619424 [1,0,0,0,0,0|1,0,1]=3 26 B16R3.3329 ClC1=NC=NC2=C1OC3=C2C=CC=C3 MCULE-5620645338 [1,0,0,0,0,0|2,0,1]=4 27 B16R3.3329 ClC1=NC=NC2=C1SC3=C2C=CC=C3 MCULE-2195785818 [1,0,0,0,0,0|2,0,1]=4 28 B16R3.3329 ClC1=NC=[NH+]C2=C1NC3=C2C=CC=C3 MCULE-3601819292 [1,0,0,0,0,0|1,0,2]=4 29 B16R3.3329 FC1=C2NC3=C(C2=CC=C1)C=CC=C3 MCULE-9316723264 [1,0,0,0,0,0|3,0,0]=4 30 B16R3.3329 NC1=CC=CC2=C1NC3=CC=CC=C23 MCULE-9073642155 [1,0,0,0,0,0|3,0,0]=4 31 B16R3.3329 O=C1CCCC2=C1NC3=C2C=CC=C3 MCULE-8165438115 [1,0,0,0,0,0|2,0,1]=4 32 B16R3.3329 O=C1NC=CC2=C1NC3=C2C=CC=C3 MCULE-7536068251 [1,0,0,0,0,0|1,0,0]=2 33 B16R3.3329 O=C1NC=NC2=C1NC3=C2C=CC=C3 MCULE-5202535583 [1,0,0,0,0,0|0,0,0]=1 34 B16R3.3329 O=C1NC=NC2=C1OC3=C2C=CC=C3 MCULE-4274417239 [1,0,0,0,0,0|1,0,0]=2 35 B16R3.3329 O=C1NC=NC2=C1SC3=C2C=CC=C3 MCULE-5842945344 [1,0,0,0,0,0|1,0,0]=2 36 B16R3.3329 O=C1NC=NC2=C1SC3=C2C=CC=N3 MCULE-3207244151 [1,0,0,0,0,0|2,0,0]=3 37 B16R3.3329 O=C1NCCC2=C1NC3=C2C=CC=C3 MCULE-9673359265 [1,0,0,0,0,0|1,0,1]=3 38 B16R3.3329 O=C1NN=CC2=C1NC3=CC=CC=C23 MCULE-3054406305 [1,0,0,0,0,0|2,0,0]=3 39 B16R3.3329 O=C1NN=CC2=C1OC3=CC=CC=C23 MCULE-4350682115 [1,0,0,0,0,0|3,0,0]=4 40 B16R3.3329 OC1=CC=CC2=C1NC3=CC=CC=C23 MCULE-2067221726 [1,0,0,0,0,0|2,0,1]=4 41 B16R3.3329 SC1=NC=NC2=C1NC3=C2C=CC=C3 MCULE-5839417305 [1,0,0,0,0,0|0,1,1]=3 42 B16R3.3329 SC1=NC=NC2=C1OC3=C2C=CC=C3 MCULE-2882913970 [1,0,0,0,0,0|1,1,1]=4 43 B18R3.52499 CC1=CC=C2C(=N1)SC3=C2N=NN(C3=O)C MCULE-9059295004 [0,1,0,0,0,0|3,0,0]=4 44 B18R3.54015 CN1C=NC2=C(C1=O)N(C3=C2C=CC=C3)C MCULE-9534965264 [0,1,0,0,0,0|0,0,0]=1 45 B18R3.85684 CC1=NC2=C(NC3=C2C=CC=C3)C(=O)N1N MCULE-4141616388 [0,1,0,0,0,0|1,0,0]=2 46 B18R3.85684 CN1C(=O)C2=C(NC1=S)C3=C(O2)C=CC=C3 MCULE-3786262357 [0,1,0,0,0,0|1,0,1]=3 47 B18R3.85684 CN1C(=O)NC2=C(C1=O)NC3=C2C=CC=C3 MCULE-6592834186 [0,1,0,0,0,0|0,0,1]=2 48 B18R3.85684 NN1C(=O)NC2=C(C1=O)NC3=C2C=CC=C3 MCULE-3149657890 [0,1,0,0,0,0|1,0,1]=3 49 B18R3.4096865 CC1=CC2=C(C=C1)NC3=C2N=CN(C3=O)C MCULE-3266336130 [0,1,0,0,0,0|0,0,0]=1 50 B18R3.4096865 CC1=CC2=C(C=C1)NC3=C2N=CN(C3=O)N MCULE-1088622694 [0,1,0,0,0,0|1,0,0]=2 51 B18R3.4096865 CC1=CC2=C(C=C1)NC3=C2N=NN(C3=O)C MCULE-8704530583 [0,1,0,0,0,0|1,0,0]=2 52 B18R3.4096865 CN1C=NC2=C(C1=O)NC3=C2C=C(C=C3)Br MCULE-6736394948 [0,1,0,0,0,0|0,0,0]=1 53 B18R3.4096865 CN1N=NC2=C(C1=O)NC3=C2C=C(C=C3)Br MCULE-1485284735 [0,1,0,0,0,0|1,0,0]=2 54 B18R3.4096865 CN1N=NC2=C(C1=O)NC3=C2C=C(C=C3)F MCULE-4962469063 [0,1,0,0,0,0|1,0,0]=2 55 B18R3.4096865 NN1C=NC2=C(C1=O)NC3=C2C=C(C=C3)Br MCULE-6245809365 [0,1,0,0,0,0|1,0,0]=2 56 B18R3.4096865 NN1C=NC2=C(C1=O)NC3=C2C=C(C=C3)Cl MCULE-7738180509 [0,1,0,0,0,0|1,0,0]=2 57 B18R3.4096865 NN1C=NC2=C(C1=O)NC3=C2C=C(C=C3)F MCULE-1215223352 [0,1,0,0,0,0|1,0,0]=2 58 B16R2.35 CN1C=CN=C(C1=O)NC2=CC=NC=C2 MCULE-7710319021 [0,0,1,0,0,0|3,0,0]=4 59 B16R2.35 CN1C=CN=C(C1=O)OC2=CC=CC=C2 MCULE-6544506390 [0,0,1,0,0,0|3,0,0]=4 60 B16R2.2189 CON(C)C(=O)C1=CC2=C(N1)C=CC=C2 MCULE-1483486131 [0,0,1,0,0,0|2,0,0]=3 61 B16R2.3269 CC1=CC=C(C=C1C)C2=CC=CC=C2N MCULE-4868131384 [0,0,1,0,0,0|3,0,0]=4 62 B16R2.3269 CC1=CC=C(C=C1C)C2=CC=CC=C2N MCULE-6258118229 [0,0,1,0,0,0|3,0,0]=4 63 B16R2.3269 CC1=NN=C(NC1=O)C2=C(C=CC=C2)N MCULE-4251296138 [0,0,1,0,0,0|3,0,0]=4 64 B16R2.3355 CC1=C(OC2=C1C=CC=C2)C(=O)N(C)C MCULE-7965846285 [0,0,1,0,0,0|2,0,1]=4 65 B16R2.3355 CN(C)C(=O)C1=C(C2=CC=CC=C2S1)Cl MCULE-3263887466 [0,0,1,0,0,0|2,0,1]=4 66 B16R2.6152 CNC(=O)C1=C(C2=C(N1)C=CC=C2)C=O MCULE-8699262502 [0,0,1,0,0,0|2,0,0]=3 67 B16R2.6152 COC(=O)C1=C(C2=C(N1)C=CC=C2)CN MCULE-1703129078 [0,0,1,0,0,0|3,0,0]=4 68 B16R2.6152 COC(=O)C1=C(C2=CC=CC=C2N1)C=O MCULE-6120125359 [0,0,1,0,0,0|3,0,0]=4 69 B15R2.5 O=CNCCC1=CNC2=C1C=CC=C2 MCULE-2222832478 [1,0,1,0,0,0|1,0,1]=4 70 B15R2.6 CC(=O)C=CC1=CNC2=CC=CC=C12 MCULE-1503677397 [1,0,1,0,0,0|2,0,0]=4 71 B15R2.31 BrC1=CN=CC(=C1)NC2=CC=CC=C2 MCULE-8455110966 [1,0,1,0,0,0|2,0,0]=4 72 B15R2.31 CC1=CC(=CC=C1)NC2=CC=CC=C2 MCULE-5568632582 [1,0,1,0,0,0|2,0,0]=4 73 B15R2.31 CC1=CN=CC(=N1)NC2=CC=CC=C2 MCULE-7898046601 [1,0,1,0,0,0|2,0,0]=4 74 B15R2.38 NC1=C(C=NC=C1)NC2=CC=CC=C2 MCULE-9100372229 [1,0,1,0,0,0|2,0,0]=4 75 B15R2.32 NC1=C(C=CN=C1C2=CC=CC=C2)Cl MCULE-9550595801 [1,0,1,0,0,0|2,0,0]=4 76 B15R2.94 CN1C=CC(=CC1=O)C2=CC=CC=C2 MCULE-3388908256 [1,0,1,0,0,0|1,0,0]=3 77 B15R2.94 CN1C=NC(=CC1=O)C2=CC=CC=C2 MCULE-1328027974 [1,0,1,0,0,0|0,0,0]=2 78 B15R2.389 CC1=CC(=C(C=C1)C2=CC=CC=C2)N MCULE-6288890734 [1,0,1,0,0,0|2,0,0]=4 79 B15R2.4244 CN(C)C(=O)C1=CC2=C(N1)C=CC=C2 MCULE-3113362598 [1,0,1,0,0,0|0,0,1]=3 80 B15R2.4244 CN(C)C(=O)C1=CC2=C(O1)C=CC=C2 MCULE-4602552908 [1,0,1,0,0,0|1,0,1]=4 81 B15R2.308 CC1=CC=C(C=C1)C2=C(C=CC=C2)N MCULE-4179875376 [1,0,1,0,0,0|2,0,0]=4 82 B15R2.308 CC1=CC=C(C=C1)C2=CC=CC=C2N MCULE-8184714084 [1,0,1,0,0,0|2,0,0]=4 83 B15R2.308 NC1=CC=CC=C1C2=NC=C(C=C2)Cl MCULE-4350617753 [1,0,1,0,0,0|2,0,0]=4 84 B15R2.629 CN(C)C=C1NC2=C(C1=O)C=CC=C2 MCULE-4804596943 [1,0,1,0,0,0|1,0,1]=4 85 B15R2.1592 CNC(=O)C1=C(C2=C(S1)C=CC=C2)Cl MCULE-6919426616 [1,0,1,0,0,0|2,0,0]=4 86 B15R2.1592 CNC(=O)C1=C(C2=CC=CC=C2N1)C MCULE-7095222331 [1,0,1,0,0,0|0,0,1]=3 87 B15R2.1592 COC(=O)C1=C(C2=C(N1)C=CC=C2)Br MCULE-7620383988 [1,0,1,0,0,0|2,0,0]=4 88 B15R2.1592 COC(=O)C1=C(C2=C(N1)C=CC=C2)C MCULE-5349082586 [1,0,1,0,0,0|1,0,1]=4 89 B15R2.1592 COC(=O)C1=C(C2=C(N1)C=CC=C2)Cl MCULE-6274244252 [1,0,1,0,0,0|2,0,0]=4 90 B15R2.1592 COC(=O)C1=C(C2=C(N1)C=CC=C2)I MCULE-2888474431 [1,0,1,0,0,0|2,0,0]=4 91 B15R2.1592 COC(=O)C1=C(C2=C(N1)C=CC=C2)N MCULE-5276851793 [1,0,1,0,0,0|1,0,1]=4 92 B15R2.1592 COC(=O)C1=C(C2=C(N1)C=CC=C2)O MCULE-3616224354 [1,0,1,0,0,0|2,0,0]=4 93 B15R2.1592 NNC(=O)C1=C(C2=C(N1)C=CC=C2)Br MCULE-8078958402 [1,0,1,0,0,0|2,0,0]=4 94 B15R2.1592 NNC(=O)C1=C(C2=C(N1)C=CC=C2)Cl MCULE-3379250990 [1,0,1,0,0,0|2,0,0]=4 95 B15R2.1592 NNC(=O)C1=C(C2=C(N1)C=CC=C2)I MCULE-9376370067 [1,0,1,0,0,0|2,0,0]=4 96 B15R2.1592 NNC(=O)C1=C(C2=C(N1)C=CC=C2)N MCULE-5089227219 [1,0,1,0,0,0|1,0,1]=4 97 B15R3.3 C1=CC2=C(C=C1)C3=C(C2)C=CC=N3 MCULE-3040413679 [2,0,0,0,0,0|2,0,0]=4 98 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)C=CC=C3 MCULE-7610805198 [2,0,0,0,0,0|2,0,0]=4 99 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)C=NC=C3 MCULE-5748858495 [2,0,0,0,0,0|1,0,1]=4 100 B15R3.3 C1=CC2=C(C=C1)C3=CC=NC=C3N2 MCULE-7379210172 [2,0,0,0,0,0|1,0,1]=4 101 B15R3.3 C1=CC2=C(C=C1)C3=NC=CN=C3N2 MCULE-1631663449 [2,0,0,0,0,0|2,0,0]=4 102 B15R3.3 C1=CC2=NC3=CNC=CC3=C2C=C1 MCULE-3588336488 [2,0,0,0,0,0|1,0,1]=4 103 B15R3.3 C1=CN=C2C(=C1)NC3=C2C=CC=C3 MCULE-3024575954 [2,0,0,0,0,0|1,0,0]=3 104 B17R2.1273 CN(C)C=NC1=C(NC2=C1C=CC=C2)C=O MCULE-8722270273 [0,1,1,0,0,0|0,0,0]=2 105 B17R2.17509 CN1C=CC(=C(C1=O)C#N)C2=CC=CC=C2 MCULE-4142520365 [0,1,1,0,0,0|1,0,1]=4 106 B17R2.4295 COC(=O)C1=C(C2=C(N1)C=CC=C2)/C=N/O MCULE-1230582484 [0,1,1,0,0,0|2,0,0]=4 107 B17R2.4295 COC(=O)C1=C(C2=CC=CC=C2N1)C=NO MCULE-5637493609 [0,1,1,0,0,0|2,0,0]=4 108 B17R3.1577 COC1=CC=C2C(=C1)NC3=C2C=CC=C3 MCULE-7608124863 [1,1,0,0,0,0|2,0,0]=4 109 B17R3.30284 CC1=CC2=C(C=C1)C3=C(N2)C=C(C=C3)C MCULE-8635925490 [1,1,0,0,0,0|2,0,0]=4 110 B17R3.30495 CC1=CC2=C(C=C1)C3=C(N2)C(=CC=C3)C MCULE-8797130966 [1,1,0,0,0,0|2,0,0]=4 111 B17R3.31819 CC1=CC2=C(N=C1)C3=C(C2=O)C=CC=C3 MCULE-7830666236 [1,1,0,0,0,0|2,0,0]=4 112 B17R3.633 CNC1=NC=NC2=C1NC3=C2C=CC=C3 MCULE-2077341808 [1,1,0,0,0,0|1,0,1]=4 113 B17R3.633 COC1=NC=NC2=C1NC3=C2C=CC=C3 MCULE-8515416423 [1,1,0,0,0,0|0,0,2]=4 114 B17R3.633 NNC1=NC=NC2=C1NC3=CC=CC=C23 MCULE-9398972951 [1,1,0,0,0,0|1,0,1]=4 115 B17R3.633 O=CC1=NC=CC2=C1NC3=C2C=CC=C3 MCULE-4537422152 [1,1,0,0,0,0|1,0,1]=4 116 B17R3.34483 CC1=CC(=NC2=C1NC3=C2C=CC=C3)C MCULE-3600461833 [1,1,0,0,0,0|2,0,0]=4 117 B17R3.34483 CC1=CC(=NC2=C1NC3=C2C=CC=C3)C MCULE-5061784455 [1,1,0,0,0,0|2,0,0]=4 118 B17R3.34483 CC1=NC2=C(OC3=C2C=CC=C3)C(=O)N1 MCULE-7686338369 [1,1,0,0,0,0|1,0,0]=3 119 B17R3.34483 CC1=NC2=C(OC3=C2C=CC=C3)C(=O)O1 MCULE-3472146247 [1,1,0,0,0,0|2,0,0]=4 120 B17R3.34483 CC1=NC2=C(OC3=C2C=CC=C3)C(=S)N1 MCULE-4421052917 [1,1,0,0,0,0|1,1,0]=4 121 B17R3.34483 CC1=NC2=C(SC3=NC=CC=C23)C(=O)N1 MCULE-3608758222 [1,1,0,0,0,0|2,0,0]=4 122 B17R3.34483 CC1CC2=C(NC3=C2C=CC=C3)C(=O)N1 MCULE-7286588149 [1,1,0,0,0,0|1,0,1]=4 123 B17R3.34483 O=C1CC2=C(NC3=CC=CC=C23)C(=O)O1 MCULE-5510062434 [1,1,0,0,0,0|2,0,0]=4 124 B17R3.34483 O=C1NC(=O)C2=C(N1)C3=CC=CC=C3O2 MCULE-3587345721 [1,1,0,0,0,0|1,0,1]=4 125 B17R3.34483 O=C1NC(=S)NC2=C1OC3=C2C=CC=C3 MCULE-8807462780 [1,1,0,0,0,0|1,0,1]=4 126 B17R3.51119 O=C1NC=NC2=C1SC3=CC=CC(=C23)F MCULE-6601743184 [1,1,0,0,0,0|1,0,0]=3 127 B17R3.51120 O=C1NCCC2=C1NC3=C2C=CC=C3Cl MCULE-3811095896 [1,1,0,0,0,0|1,0,1]=4 128 B17R3.51174 CN1C2=CC=CC=C2C3=C1C(=O)NN=C3 MCULE-6614980466 [1,1,0,0,0,0|2,0,0]=4 129 B17R3.284867 CC1=CC2=C(C=C1)NC3=C2C=NNC3=O MCULE-9324431687 [1,1,0,0,0,0|2,0,0]=4 130 B17R3.284867 CC1=CC2=C(C=C1)NC3=C2N=CN=C3Cl MCULE-6329433659 [1,1,0,0,0,0|1,0,1]=4 131 B17R3.284867 CC1=CC2=C(C=C1)NC3=C2N=CN=C3S MCULE-4459301660 [1,1,0,0,0,0|0,1,1]=4 132 B17R3.284867 CC1=CC2=C(C=C1)NC3=C2N=CNC3=O MCULE-4059534697 [1,1,0,0,0,0|0,0,0]=2 133 B17R3.284867 CC1=CC=C2NC3=C(C2=C1)CCNC3=O MCULE-2557569732 [1,1,0,0,0,0|1,0,1]=4 134 B17R3.284867 ClC1=CC=C2NC3=C(C2=C1)N=CN=C3Cl MCULE-2441245337 [1,1,0,0,0,0|1,0,1]=4 135 B17R3.284867 FC1=CC2=C(C=C1)NC3=C2N=CN=C3Cl MCULE-8328544502 [1,1,0,0,0,0|1,0,1]=4 136 B17R3.284867 FC1=CC2=C(C=C1)NC3=C2N=CN=C3S MCULE-4441449593 [1,1,0,0,0,0|0,1,1]=4 137 B17R3.284867 O=C1C=CSC2=C1NC3=C2C=C(C=C3)Br MCULE-2051197557 [1,1,0,0,0,0|2,0,0]=4 138 B17R3.284867 O=C1NC=NC2=C1NC3=C2C=C(C=C3)Br MCULE-6761261851 [1,1,0,0,0,0|0,0,0]=2 139 B17R3.284867 O=C1NC=NC2=C1NC3=C2C=C(C=C3)F MCULE-3944632378 [1,1,0,0,0,0|0,0,0]=2 140 B17R3.284867 O=C1NC=NC2=C1OC3=C2C=C(C=C3)Br MCULE-4423859746 [1,1,0,0,0,0|1,0,0]=3 141 B17R3.284867 O=C1NC=NC2=C1OC3=CC=C(C=C23)Cl MCULE-3635820052 [1,1,0,0,0,0|1,0,0]=3 142 B17R3.284867 O=C1NCCC2=C1NC3=C2C=C(C=C3)Br MCULE-2546477426 [1,1,0,0,0,0|1,0,1]=4 143 B17R3.284867 O=C1NCCC2=C1NC3=C2C=C(C=C3)Cl MCULE-5138010157 [1,1,0,0,0,0|1,0,1]=4 144 B17R3.284867 O=C1NCCC2=C1NC3=C2C=C(C=C3)F MCULE-6577104822 [1,1,0,0,0,0|1,0,1]=4 145 B17R3.284867 O=C1NCCC2=C1NC3=CC=C(C=C23)I MCULE-5179573357 [1,1,0,0,0,0|1,0,1]=4 146 B17R3.284867 O=C1NN=CC2=C1NC3=CC=C(C=C23)F MCULE-7591768397 [1,1,0,0,0,0|2,0,0]=4 147 B17R3.284867 S=C1NC=NC2=C1NC3=CC=C(C=C23)Br MCULE-4800321910 [1,1,0,0,0,0|0,1,0]=3 148 B17R3.284867 S=C1NC=NC2=C1OC3=CC=C(C=C23)Cl MCULE-1888451601 [1,1,0,0,0,0|1,1,0]=4 149 B17R3.284867 SC1=NC=NC2=C1NC3=CC=C(C=C23)Cl MCULE-6694197146 [1,1,0,0,0,0|0,1,1]=4 150 B19R3.67868 CC1=CC2=NC3=C(C=CC=C3)C=C2C(=O)N1C MCULE-4086818221 [0,1,0,0,0,1|2,0,0]=4 151 B19R3.67868 CN1C(=O)C2=C(C=C3C=CC=CC3=C2)NC1=S MCULE-8309652875 [0,1,0,0,0,1|1,0,1]=4 152 B19R3.306925 COC1=CC=C2C(=C1)NC3=C2N=CN(C3=O)N MCULE-7721223086 [0,2,0,0,0,0|1,0,0]=3 153 B19R3.7700926 CC1=CC2=C(N=C1C)SC3=C2N=CN(C3=O)C MCULE-3247681487 [0,2,0,0,0,0|2,0,0]=4 154 B19R3.10047665 CC1=CC(=NC2=C1C3=C(O2)C(=O)N(C=N3)C)C MCULE-2931166116 [0,2,0,0,0,0|2,0,0]=4 155 B19R3.10047665 CC1=CC(=NC2=C1C3=C(S2)C(=O)N(C=N3)C)C MCULE-7355290279 [0,2,0,0,0,0|2,0,0]=4 156 B19R3.260533 CSC1=NC2=C(OC3=C2C=CC=C3)C(=O)N1C MCULE-6125248190 [0,2,0,0,0,0|1,0,0]=3 157 B19R3.7805850 CC1=CC2=C(C=C1)NC3=C2N=C(N(C3=O)N)C MCULE-8247802561 [0,2,0,0,0,0|1,0,0]=3 158 B19R3.7805850 CC1=CC2=C(C=C1)NC3=C2NC(=O)N(C3=O)N MCULE-8125960086 [0,2,0,0,0,0|1,0,1]=4 159 B19R3.7805850 CC1=CC2=C(C=C1)NC3=C2NC(=S)N(C3=O)N MCULE-6114643713 [0,2,0,0,0,0|1,0,1]=4 160 B19R3.7805850 NN1C(=O)NC2=C(C1=O)NC3=C2C=C(C=C3)F MCULE-9710122834 [0,2,0,0,0,0|1,0,1]=4 161 B19R3.104467 C#CCN1C=NC2=C(C1=O)OC3=C2C=CC=C3 MCULE-7961093986 [0,2,0,0,0,0|1,0,0]=3 162 B19R3.104467 N#CCN1C=NC2=C(C1=O)OC3=C2C=CC=C3 MCULE-2102612963 [0,2,0,0,0,0|1,0,0]=3 163 B19R3.3660004 COC1=CC2=C(C=C1)NC3=C2N=CN(C3=O)C MCULE-5402501381 [0,2,0,0,0,0|0,0,0]=2 164 B19R3.3660004 COC1=CC2=C(C=C1)NC3=C2N=CN(C3=O)N MCULE-2942683580 [0,2,0,0,0,0|1,0,0]=3 165 B15R2.321 CC1=C(C(=NN1C)C2=CC=CC=C2)Br MCULE-4075090942 [0,0,1,0,1,0|2,0,0]=4 166 B15R2.321 CC1=C(N(N=C1C2=CC=CC=C2)C)N MCULE-1439204930 [0,0,1,0,1,0|2,0,0]=4 167 B15R2.321 CC1=C(N(N=C1C2=CC=CC=C2)C)N MCULE-9196303555 [0,0,1,0,1,0|2,0,0]=4 168 B15R2.554 CC1=C(C=CC=C1)C2=NN(C(=C2)N)C MCULE-1205102567 [0,0,1,0,1,0|2,0,0]=4 169 B15R2.554 CN1N=C(C=C1N)C2=C(C=CC=C2)Br MCULE-7433396119 [0,0,1,0,1,0|2,0,0]=4 170 B15R2.554 CN1N=C(C=C1N)C2=C(C=CC=C2)O MCULE-9544012430 [0,0,1,0,1,0|2,0,0]=4 171 B15R2.554 CN1N=C(C=C1N)C2=CC=CC=C2Cl MCULE-4372042602 [0,0,1,0,1,0|2,0,0]=4 172 B15R2.554 CN1N=C(C=C1N)C2=CC=CC=C2F MCULE-6996003406 [0,0,1,0,1,0|2,0,0]=4 173 B15R2.7473 CN1C=NC(=C1N)C2=C(C=CC=C2)Br MCULE-9906171234 [0,0,1,0,1,0|2,0,0]=4 174 B15R2.7473 CN1C=NC(=C1N)C2=C(C=CC=C2)F MCULE-7199287298 [0,0,1,0,1,0|2,0,0]=4 175 B15R3.2009 CC1=NC2=C(S1)NC3=CC=CC=C23 MCULE-5330226496 [1,0,0,0,1,0|2,0,0]=4 176 B15R3.2009 CC1=NN2C(=C1)NC3=C2C=CC=C3 MCULE-5261790675 [1,0,0,0,1,0|2,0,0]=4 177 B17R2.39935 CN1C=CC(=CC(C1=O)N)C2=CC=CC=C2 MCULE-3781740384 [0,0,1,0,0,1|1,0,1]=4 178 B17R2.39935 CN1C=CC(=CC(C1=O)N)C2=CC=CC=C2 MCULE-6199700719 [0,0,1,0,0,1|1,0,1]=4 179 B17R2.5115 CC1=C(C=CC=C1)NC2=CC(=O)N(C=N2)C MCULE-6718763596 [0,0,1,0,0,1|1,0,0]=3 180 B17R2.5115 CN1C=NC(=CC1=O)NC2=C(C=CC=C2)F MCULE-4621088398 [0,0,1,0,0,1|1,0,0]=3 181 B17R3.4465 O=C1NC=CC2=C3C=CC=CC3=CC=C12 MCULE-2222125234 [1,0,0,0,0,1|2,0,0]=4 182 B19R3.178411 CN1CCCCC2=C(C1=O)NC3=C2C=CC=C3 MCULE-3317266400 [0,0,0,0,0,2|1,0,1]=4