0 B17R2.472 CC1=CC(=NC=C1Br)NC2=CC=C(C=C2)F MCULE-2779404720 [0,0,0,0,0,0|4,0,0]=4 1 B17R2.472 CC1=CC=C(C=C1)CC2=CC(=C(N=C2)I)O MCULE-3116722172 [0,0,0,0,0,0|3,0,1]=4 2 B17R2.472 CC1=NN=C(N=C1O)NC2=CC=C(C=C2)F MCULE-7575549763 [0,0,0,0,0,0|3,0,1]=4 3 B16R2.33 CC1=CC=C(C=C1)CC2=CC=C(N=N2)O MCULE-5046116329 [1,0,0,0,0,0|1,0,2]=4 4 B16R2.33 CC1=CC=C(C=C1)CC2=NN=C(C=C2)Cl MCULE-9664185454 [1,0,0,0,0,0|2,0,1]=4 5 B16R2.33 ClC1=CC=C(C=C1)CC2=NN=C(C=C2)Cl MCULE-5258542683 [1,0,0,0,0,0|1,1,1]=4 6 B16R2.33 FC1=CC=C(C=C1)CC2=CC=C(C=C2)F MCULE-6431899032 [1,0,0,0,0,0|3,0,0]=4 7 B16R2.33 FC1=CC=C(C=C1)NC2=NC=C(C=C2)Br MCULE-3641987572 [1,0,0,0,0,0|3,0,0]=4 8 B16R2.33 FC1=CC=C(C=C1)OC2=NC=C(C=C2)Br MCULE-1129727101 [1,0,0,0,0,0|3,0,0]=4 9 B16R2.33 NC1=CC=C(C=C1)CC2=CC=C(C=C2)F MCULE-1400031390 [1,0,0,0,0,0|3,0,0]=4 10 B16R2.33 NC1=CN=C(C=C1)NC2=CC=C(C=C2)F MCULE-8543541401 [1,0,0,0,0,0|3,0,0]=4 11 B16R2.33 NC1=CN=C(C=C1)OC2=CC=C(C=C2)F MCULE-6758355259 [1,0,0,0,0,0|3,0,0]=4 12 B16R2.33 NC1=CN=C(C=C1)OC2=CC=C(C=C2)F MCULE-9853075724 [1,0,0,0,0,0|3,0,0]=4 13 B16R2.33 NC1=CN=C(N=C1)CC2=CC=C(C=C2)F MCULE-9988184547 [1,0,0,0,0,0|3,0,0]=4 14 B16R2.33 O=C1C=CC(=CN1)CC2=CC=C(C=C2)F MCULE-7166898408 [1,0,0,0,0,0|1,0,0]=2 15 B16R2.33 OC1=CC=C(N=C1)OC2=CC=C(C=C2)F MCULE-5589992132 [1,0,0,0,0,0|2,0,1]=4 16 B16R2.33 OC1=NN=C(C=C1)CC2=CC=C(C=C2)Cl MCULE-6728971906 [1,0,0,0,0,0|0,1,2]=4 17 B16R2.131 CC1=CC=C(C=C1)CC2=CN=CC(=C2)O MCULE-9706646806 [1,0,0,0,0,0|2,0,1]=4 18 B16R2.131 CC1=CC=C(C=C1)CC2=C[NH+]=CC(=C2)O MCULE-3827580677 [1,0,0,0,0,0|2,0,1]=4 19 B16R2.131 FC1=CC=C(C=C1)CC2=CC(=CC=C2)Br MCULE-4955563488 [1,0,0,0,0,0|3,0,0]=4 20 B16R2.131 FC1=CC=C(C=C1)CC2=CN=CC(=C2)Br MCULE-9615305093 [1,0,0,0,0,0|2,0,1]=4 21 B16R2.131 FC1=CC=C(C=C1)CC2=NC(=CC=N2)Cl MCULE-3158400567 [1,0,0,0,0,0|3,0,0]=4 22 B16R2.131 OC1=NC(=NN=C1)NC2=CC=C(C=C2)F MCULE-2252179740 [1,0,0,0,0,0|2,0,1]=4 23 B18R2.9200 CC1=C(C(=NN=C1Cl)CC2=CC=C(C=C2)F)C MCULE-7853689901 [0,1,0,0,0,0|2,0,1]=4 24 B18R2.9200 NN1C(=O)C(=NNC1=S)CC2=CC=C(C=C2)F MCULE-4405712815 [0,1,0,0,0,0|2,1,0]=4 25 B16R2.1128 CC1=CN(N=C1N)CC2=CC=C(C=C2)F MCULE-1721074080 [0,0,0,0,1,0|3,0,0]=4 26 B16R2.1128 NC1=NN(C=C1Br)CC2=CC=C(C=C2)F MCULE-9142221478 [0,0,0,0,1,0|3,0,0]=4 27 B16R2.1128 NC1=NN(C=C1Cl)CC2=CC=C(C=C2)F MCULE-8200003621 [0,0,0,0,1,0|3,0,0]=4 28 B16R2.2864 CC1=CC=C(C=C1)C2=CC(=O)C(=O)NN2 MCULE-4651120692 [0,0,0,0,1,0|1,0,2]=4 29 B16R2.2864 CC1=CC=C(C=C1)C2=NNC(=O)C(=C2)N MCULE-5770996987 [0,0,0,0,1,0|2,0,0]=3 30 B16R2.2864 NC1=CC(=NNC1=O)C2=CC=C(C=C2)Cl MCULE-7088886260 [0,0,0,0,1,0|1,1,0]=3 31 B16R2.2864 NC1=CC=C(C=C1O)C2=CC=C(C=C2)F MCULE-4453145307 [0,0,0,0,1,0|3,0,0]=4 32 B16R2.2864 NC1=NN=C(C=C1Br)C2=CC=C(C=C2)F MCULE-5274318488 [0,0,0,0,1,0|2,0,1]=4 33 B16R2.2864 O=C1C=C(NNC1=O)C2=CC=C(C=C2)Cl MCULE-9930561584 [0,0,0,0,1,0|0,1,2]=4 34 B16R2.2864 O=C1C=NC(=CN1O)C2=CC=C(C=C2)Cl MCULE-4437665593 [0,0,0,0,1,0|2,1,0]=4 35 B16R2.2864 OC1=C(C=NC(=N1)C2=CC=C(C=C2)F)Br MCULE-6984595557 [0,0,0,0,1,0|3,0,0]=4 36 B18R2.9259 CC1=C(N=C(N=N1)SCC2=CC=C(C=C2)F)O MCULE-5514735002 [0,0,0,0,0,1|2,0,1]=4 37 B18R2.9259 CC1=NN=C(N=C1O)NCC2=CC=C(C=C2)F MCULE-6734733386 [0,0,0,0,0,1|2,0,1]=4 38 B15R2.29 CC1=CC=C(C=C1)CC2=CC=CC=N2 MCULE-3206492026 [2,0,0,0,0,0|2,0,0]=4 39 B15R2.29 ClC1=CC=C(C=C1)CC2=CC=CC=N2 MCULE-5512024146 [2,0,0,0,0,0|1,1,0]=4 40 B15R2.29 ClC1=CC=C(N=N1)CC2=CC=CC=C2 MCULE-5518260508 [2,0,0,0,0,0|1,0,1]=4 41 B15R2.29 FC1=CC=C(C=C1)CC2=CC=CC=C2 MCULE-5406753070 [2,0,0,0,0,0|2,0,0]=4 42 B15R2.29 NC1=CC=C(C=C1)CC2=CC=CC=N2 MCULE-2176964770 [2,0,0,0,0,0|2,0,0]=4 43 B15R2.29 NC1=CC=C(C=C1)CC2=CC=CC=N2 MCULE-7404266288 [2,0,0,0,0,0|2,0,0]=4 44 B15R2.29 NC1=CC=C(N=C1)CC2=CC=CC=C2 MCULE-8488700743 [2,0,0,0,0,0|2,0,0]=4 45 B15R2.29 OC1=CC=C(C=C1)CC2=NC=CC=C2 MCULE-8255094331 [2,0,0,0,0,0|2,0,0]=4 46 B15R2.29 OC1=CC=C(N=C1)CC2=CC=CC=C2 MCULE-1803061281 [2,0,0,0,0,0|1,0,1]=4 47 B15R2.31 OC1=CC(=CC=C1)CC2=CC=CC=C2 MCULE-3911731207 [2,0,0,0,0,0|2,0,0]=4 48 B15R2.31 OC1=CC(=CN=C1)CC2=CC=CC=C2 MCULE-8506684689 [2,0,0,0,0,0|1,0,1]=4 49 B17R2.2 O=CC1=CC=C(C=C1)CC2=CC=C(C=C2)F MCULE-3525977166 [1,1,0,0,0,0|2,0,0]=4 50 B17R2.2 O=CC1=CN=C(C=C1)OC2=CC=C(C=C2)F MCULE-3488487951 [1,1,0,0,0,0|2,0,0]=4 51 B17R2.470 CC1=NN(C(=C1O)C)CC2=CC=C(C=C2)F MCULE-4531161799 [0,1,0,0,1,0|2,0,0]=4 52 B17R2.70 COC1=CC=C(C=C1)C2=NNC(=O)C(=C2)N MCULE-3509920341 [0,1,0,0,1,0|2,0,0]=4 53 B17R2.146997 CN1C=C(C=C(C1=O)N)C2=CC=C(C=C2)F MCULE-8284339438 [0,1,0,0,1,0|2,0,0]=4 54 B17R2.616 NNC(=O)C1=CC=C(O1)C2=CC=C(C=C2)F MCULE-6605564994 [0,0,1,1,0,0|0,0,2]=4 55 B15R1.881 O=C(O)C(=CC(=O)C1=CC=C(C=C1)F)O MCULE-8505705601 [0,0,1,0,1,0|2,0,0]=4 56 B15R2.3 CC1=CC=C(C=C1)C2=CNC(=O)C=C2 MCULE-8594562503 [1,0,0,0,1,0|2,0,0]=4 57 B15R2.3 CC1=CC=C(C=C1)C2=NNC(=O)C=C2 MCULE-5905487279 [1,0,0,0,1,0|1,0,0]=3 58 B15R2.3 CC1=CC=C(C=C1)C2=NNC(=S)C=C2 MCULE-3278496020 [1,0,0,0,1,0|1,1,0]=4 59 B15R2.3 CC1=CN=C(C=C1)C2=CC=C(C=C2)F MCULE-8000801226 [1,0,0,0,1,0|2,0,0]=4 60 B15R2.3 FC1=CC=C(C=C1)C2=NC=C(C=C2)Br MCULE-9398081240 [1,0,0,0,1,0|2,0,0]=4 61 B15R2.3 FC1=CC=C(C=C1)C2=NC=C(C=C2)Cl MCULE-4005061083 [1,0,0,0,1,0|2,0,0]=4 62 B15R2.3 FC1=CC=C(C=C1)C2=NN=C(C=C2)Cl MCULE-2427177917 [1,0,0,0,1,0|1,0,1]=4 63 B15R2.3 FC1=CC=C(C=C1)C2=NNC(=S)C=C2 MCULE-1179651347 [1,0,0,0,1,0|0,1,0]=3 64 B15R2.3 NC1=CC=C(C=C1)C2=NNC(=O)C=C2 MCULE-7652986618 [1,0,0,0,1,0|1,0,0]=3 65 B15R2.3 NC1=CC=C(N=C1)C2=CC=C(C=C2)F MCULE-3244916324 [1,0,0,0,1,0|2,0,0]=4 66 B15R2.3 NC1=NN=C(C=C1)C2=CC=C(C=C2)F MCULE-3015168720 [1,0,0,0,1,0|1,0,1]=4 67 B15R2.3 O=C1C=CC(=NN1)C2=CC=C(C=C2)Br MCULE-6110342354 [1,0,0,0,1,0|0,1,0]=3 68 B15R2.3 O=C1C=CC(=NN1)C2=CC=C(C=C2)Cl MCULE-2297887523 [1,0,0,0,1,0|0,1,0]=3 69 B15R2.3 O=C1C=CC(=NN1)C2=CC=C(C=C2)F MCULE-9364872132 [1,0,0,0,1,0|0,0,0]=2 70 B15R2.3 O=C1C=CC(=NN1)C2=CC=C(C=C2)I MCULE-5939380052 [1,0,0,0,1,0|0,1,0]=3 71 B15R2.3 O=C1C=CC(=NN1)C2=CC=C(C=C2)O MCULE-8432196338 [1,0,0,0,1,0|1,0,0]=3 72 B15R2.3 O=C1CCC(=NN1)C2=CC=C(C=C2)F MCULE-5098454587 [1,0,0,0,1,0|0,0,2]=4 73 B15R2.3 OC1=CC=C(N=C1)C2=CC=C(C=C2)F MCULE-1057618170 [1,0,0,0,1,0|1,0,1]=4 74 B15R2.3 S=C1C=CC(=NN1)C2=CC=C(C=C2)Br MCULE-6692300309 [1,0,0,0,1,0|0,2,0]=4 75 B15R2.98 FC1=CC=C(C=C1)CC2=CC=C(S2)I MCULE-8478043991 [1,0,0,0,1,0|2,0,0]=4 76 B15R2.98 NC1=NN(C=C1)CC2=CC=C(C=C2)F MCULE-7977104806 [1,0,0,0,1,0|2,0,0]=4 77 B15R2.98 O=C1CC(=NN1)NC2=CC=C(C=C2)F MCULE-8179393704 [1,0,0,0,1,0|1,0,1]=4 78 B15R2.94 CC1=CC(=NNC1=O)C2=CC=CC=C2 MCULE-1734270242 [1,0,0,0,1,0|1,0,0]=3 79 B15R2.94 NC1=CC(=NNC1=O)C2=CC=CC=C2 MCULE-7178341775 [1,0,0,0,1,0|1,0,0]=3 80 B15R2.94 O=C1C=C(NNC1=O)C2=CC=CC=C2 MCULE-1288841335 [1,0,0,0,1,0|0,0,2]=4 81 B15R2.94 O=C1NN=C(C=C1Cl)C2=CC=CC=C2 MCULE-9936034002 [1,0,0,0,1,0|1,0,0]=3 82 B15R2.94 OC1=CC(=NN=C1Cl)C2=CC=CC=C2 MCULE-8389432340 [1,0,0,0,1,0|1,0,1]=4 83 B15R2.4083 O=C1CCC(=C1O)CC2=CC=CC=C2 MCULE-4608449277 [1,0,0,0,1,0|2,0,0]=4 84 B15R2.28 FC1=CC=C(C=C1)C2=NC=CC(=C2)Br MCULE-8948111980 [1,0,0,0,1,0|2,0,0]=4 85 B15R2.28 NC1=CC(=NC=C1)C2=CC=C(C=C2)F MCULE-4775447856 [1,0,0,0,1,0|2,0,0]=4 86 B15R2.28 OC1=CC(=CC=C1)C2=CC=C(C=C2)F MCULE-8601011559 [1,0,0,0,1,0|2,0,0]=4 87 B15R2.28 OC1=CC(=CN=C1)C2=CC=C(C=C2)F MCULE-9824394854 [1,0,0,0,1,0|1,0,1]=4 88 B15R2.28 OC1=NC=NC(=C1)C2=CC=C(C=C2)F MCULE-2315859376 [1,0,0,0,1,0|2,0,0]=4 89 B15R2.18933 CC1=C(C(=NO1)C2=CC=C(C=C2)F)O MCULE-9306154588 [0,0,0,0,2,0|2,0,0]=4 90 B15R2.18933 CC1=C(NN=C1C2=CC=C(C=C2)F)N MCULE-2515625484 [0,0,0,0,2,0|2,0,0]=4 91 B17R2.207 CC1=CC=C(C=C1)C=CC2=NNC(=O)C=C2 MCULE-5178766584 [1,0,0,0,0,1|1,0,1]=4 92 B17R2.207 CC1=CC=C(N=N1)NCC2=CC=C(C=C2)F MCULE-7415495383 [1,0,0,0,0,1|1,0,1]=4 93 B17R2.207 FC1=CC=C(C=C1)CNC2=CC=C(N=N2)Cl MCULE-9565082508 [1,0,0,0,0,1|1,0,1]=4 94 B17R2.207 FC1=CC=C(C=C1)COC2=NC=C(C=C2)Br MCULE-8826360227 [1,0,0,0,0,1|2,0,0]=4 95 B17R2.215 FC1=CC=C(C=C1)COC2=CC(=CC=N2)Br MCULE-9970341359 [1,0,0,0,0,1|2,0,0]=4 96 B17R2.215 OC1=NC(=NN=C1)NCC2=CC=C(C=C2)F MCULE-9659029757 [1,0,0,0,0,1|1,0,1]=4