0 B17R2.193 CC1=NN=C(N=C1O)NCC2=CC=CC=C2 MCULE-8807230362 [0,0,0,0,0,0|2,0,1]=3 1 B16R2.132 BrC1=CN=C(N=C1)NCC2=CC=CC=C2 MCULE-7036864897 [1,0,0,0,0,0|3,0,0]=4 2 B16R2.132 BrC1=CN=C(N=C1)OCC2=CC=CC=C2 MCULE-3165179589 [1,0,0,0,0,0|3,0,0]=4 3 B16R2.132 BrC1=CN=C(N=C1)SCC2=CC=CC=C2 MCULE-6575375402 [1,0,0,0,0,0|3,0,0]=4 4 B16R2.132 CC1=CN=C(N=C1)NCC2=CC=CC=C2 MCULE-7219861598 [1,0,0,0,0,0|3,0,0]=4 5 B16R2.132 OC1=CN=C(N=C1)OCC2=CC=CC=C2 MCULE-7495716044 [1,0,0,0,0,0|2,0,1]=4 6 B16R2.252 BrC1=CC=NC(=N1)OCC2=CC=CC=C2 MCULE-6018629592 [1,0,0,0,0,0|3,0,0]=4 7 B16R2.252 CC1=CC=NC(=N1)NCC2=CC=CC=C2 MCULE-9882612078 [1,0,0,0,0,0|3,0,0]=4 8 B16R2.252 CC1=CC=NC(=N1)SCC2=CC=CC=C2 MCULE-5353820487 [1,0,0,0,0,0|3,0,0]=4 9 B16R2.252 CC1=NC(=NC=C1)OCC2=CC=CC=C2 MCULE-4795031979 [1,0,0,0,0,0|3,0,0]=4 10 B16R2.252 ClC1=NC(=NC=C1)CCC2=CC=CC=C2 MCULE-5888645262 [1,0,0,0,0,0|2,0,0]=3 11 B16R2.252 ClC1=NC(=NC=C1)CSC2=CC=CC=C2 MCULE-2519087276 [1,0,0,0,0,0|3,0,0]=4 12 B16R2.252 ClC1=NC(=NC=C1)NCC2=CC=CC=C2 MCULE-2820649629 [1,0,0,0,0,0|3,0,0]=4 13 B16R2.252 ClC1=NC(=NC=C1)OCC2=CC=CC=C2 MCULE-6282066059 [1,0,0,0,0,0|3,0,0]=4 14 B16R2.252 NC1=NC(=CC=C1)CCC2=CC=CC=C2 MCULE-6237075238 [1,0,0,0,0,0|3,0,0]=4 15 B16R2.252 NC1=NC(=NC=C1)COC2=CC=CC=C2 MCULE-5232354079 [1,0,0,0,0,0|3,0,0]=4 16 B16R2.252 NC1=NC(=NC=C1)OCC2=CC=CC=C2 MCULE-5918091620 [1,0,0,0,0,0|3,0,0]=4 17 B16R2.252 O=C1C=CNC(=N1)CCC2=CC=CC=C2 MCULE-7657685117 [1,0,0,0,0,0|1,0,2]=4 18 B16R2.252 OC1=CC=CC(=C1)CCC2=CC=CC=C2 MCULE-4102666133 [1,0,0,0,0,0|3,0,0]=4 19 B16R2.252 OC1=NC(=NC=C1)SCC2=CC=CC=C2 MCULE-5796401873 [1,0,0,0,0,0|2,0,0]=3 20 B16R2.252 OC1=NC(=NN=C1)NCC2=CC=CC=C2 MCULE-9857007088 [1,0,0,0,0,0|1,0,1]=3 21 B16R2.252 OC1=NC(=NN=C1)NCC2=CC=CN=C2 MCULE-5573508136 [1,0,0,0,0,0|2,0,1]=4 22 B18R2.249 CC1=NN=C(N=C1O)NC(C)C2=CC=CC=C2 MCULE-9006234065 [0,1,0,0,0,0|2,0,1]=4 23 B18R2.2562 COC1=C(N=C(N=C1)SCC2=CC=CC=C2)O MCULE-5356210486 [0,1,0,0,0,0|2,0,1]=4 24 B18R2.2562 NC1=C(C=NC(=N1)SCC2=CC=CC=C2)C=O MCULE-9258710392 [0,1,0,0,0,0|3,0,0]=4 25 B18R2.9259 CC1=C(N=C(N=N1)SCC2=CC=C(C=C2)Br)O MCULE-9168075259 [0,1,0,0,0,0|2,0,1]=4 26 B18R2.9259 CC1=C(N=C(N=N1)SCC2=CC=C(C=C2)F)O MCULE-5514735002 [0,1,0,0,0,0|2,0,1]=4 27 B18R2.9259 CC1=CC=C(C=C1)CNC2=NN=C(C(=N2)O)C MCULE-4478863673 [0,1,0,0,0,0|2,0,1]=4 28 B18R2.9259 CC1=CC=C(C=C1)CSC2=NC(=C(N=N2)C)O MCULE-7646362641 [0,1,0,0,0,0|2,0,1]=4 29 B18R2.9259 CC1=NN=C(N=C1O)NCC2=CC=C(C=C2)F MCULE-6734733386 [0,1,0,0,0,0|2,0,1]=4 30 B18R2.38706 CC1=C(C(=NC(=N1)COC2=CC=CC=C2)O)Cl MCULE-2433301609 [0,1,0,0,0,0|3,0,0]=4 31 B18R2.39765 CC1=NN=C(N=C1O)NCC2=CC=CC=C2Cl MCULE-4608005068 [0,1,0,0,0,0|2,0,1]=4 32 B18R2.65908 CC1=CC(=CC=C1)CSC2=NC(=C(N=N2)C)O MCULE-7825576899 [0,1,0,0,0,0|2,0,1]=4 33 B16R2.124 CC1=NN=C(N=C1O)NC2=CC=CC=C2 MCULE-5137183527 [0,0,0,0,1,0|2,0,1]=4 34 B16R2.2884 CC1=C(NC(=N1)SCC2=CC=CC=C2)C MCULE-4571617538 [0,0,0,0,1,0|3,0,0]=4 35 B16R2.2884 CC1=C(NC(=N1)SCC2=CC=CC=C2)C MCULE-9786275474 [0,0,0,0,1,0|3,0,0]=4 36 B18R2.8976 CC1=NN=C(N=C1O)NCCC2=CC=CC=C2 MCULE-9193782877 [0,0,0,0,0,1|1,0,1]=3 37 B18R2.8976 CC1=NN=C(N=C1O)SCCC2=CC=CC=C2 MCULE-9374640014 [0,0,0,0,0,1|1,0,1]=3 38 B15R2.2195 C1=CC=C(C=C1)CCC2=CN=CC=N2 MCULE-8217849511 [2,0,0,0,0,0|1,0,1]=4 39 B15R2.2195 C1=CC=C(C=C1)CSC2=NC=CC=N2 MCULE-5589012421 [2,0,0,0,0,0|2,0,0]=4 40 B17R2.48 O=CC1=CN=C(N=C1)NCC2=CC=CC=C2 MCULE-1569648909 [1,1,0,0,0,0|2,0,0]=4 41 B17R2.48 O=CC1=CN=C(N=C1)OCC2=CC=CC=C2 MCULE-6225686673 [1,1,0,0,0,0|2,0,0]=4 42 B17R2.48 O=CC1=CN=C(N=C1)SCC2=CC=CC=C2 MCULE-4201938633 [1,1,0,0,0,0|2,0,0]=4 43 B17R2.1819 OCC1=NC(=NC=C1)CCC2=CC=CC=C2 MCULE-1977610397 [1,1,0,0,0,0|1,0,0]=3 44 B17R2.3212 CC1=CC(=NC(=N1)COC2=CC=CC=C2)O MCULE-1435906531 [1,1,0,0,0,0|2,0,0]=4 45 B17R2.3212 CC1=CC(=NC(=N1)NCC2=CC=CC=C2)O MCULE-1735670150 [1,1,0,0,0,0|2,0,0]=4 46 B17R2.3212 NC1=CC(=NC(=N1)CCC2=CC=CC=C2)O MCULE-7075241475 [1,1,0,0,0,0|1,0,0]=3 47 B17R2.5300 OC1=CC=NC(=N1)SCC2=CC(=CC=C2)Br MCULE-9230577188 [1,1,0,0,0,0|2,0,0]=4 48 B17R2.5300 OC1=CC=NC(=N1)SCC2=CC(=CC=C2)Cl MCULE-4213085762 [1,1,0,0,0,0|2,0,0]=4 49 B17R2.41893 OC1=CC=NC(=N1)SCC2=CC=CC=C2Br MCULE-2406524897 [1,1,0,0,0,0|2,0,0]=4 50 B17R2.41893 OC1=CC=NC(=N1)SCC2=CC=CC=C2Cl MCULE-5300055465 [1,1,0,0,0,0|2,0,0]=4 51 B19R2.91860 O=C(O)C1=CN=C(N=C1O)CCC2=CC=CC=C2 MCULE-5772990537 [0,2,0,0,0,0|1,0,0]=3 52 B19R2.91860 O=C(O)C1=CN=C(N=C1O)COC2=CC=CC=C2 MCULE-1156475542 [0,2,0,0,0,0|2,0,0]=4 53 B19R2.91860 O=C(O)C1=CN=C(N=C1O)SCC2=CC=CC=C2 MCULE-6816641251 [0,2,0,0,0,0|2,0,0]=4 54 B17R2.5637 NC(=O)C1=CC(=NO1)OCC2=CC=CC=C2 MCULE-2388578948 [0,0,1,1,0,0|2,0,0]=4 55 B15R2.283 NC1=CC(=NN1)CCC2=CC=CC=C2 MCULE-8426351515 [1,0,0,0,1,0|1,0,0]=3 56 B15R2.283 NC1=CC(=NO1)CCC2=CC=CC=C2 MCULE-2581461020 [1,0,0,0,1,0|2,0,0]=4 57 B15R2.283 NC1=NC(=NN1)COC2=CC=CC=C2 MCULE-3805018096 [1,0,0,0,1,0|2,0,0]=4 58 B15R2.283 NC1=NC(=NN1)NCC2=CC=CC=C2 MCULE-7396006863 [1,0,0,0,1,0|2,0,0]=4 59 B15R2.283 NC1=NC(=NN1)SCC2=CC=CC=C2 MCULE-4174785591 [1,0,0,0,1,0|2,0,0]=4 60 B15R2.283 O=C1N=C(NN1)CNC2=CC=CC=C2 MCULE-2924614906 [1,0,0,0,1,0|1,0,1]=4 61 B15R2.283 O=C1NN=C(O1)CCC2=CC=CC=C2 MCULE-7955820884 [1,0,0,0,1,0|1,0,0]=3 62 B15R2.283 S=C1NN=C(N1)CCC2=CC=CC=C2 MCULE-3669864167 [1,0,0,0,1,0|0,1,1]=4 63 B15R2.31 ClC1=NC(=NC=C1)CC2=CC=CC=C2 MCULE-8813625338 [1,0,0,0,1,0|2,0,0]=4 64 B15R2.31 NC1=NC(=NC=C1)CC2=CC=CC=C2 MCULE-9505399788 [1,0,0,0,1,0|2,0,0]=4 65 B15R2.94 CC1=C(N=C(N=C1)C2=CC=CC=C2)O MCULE-5076438198 [0,0,0,0,2,0|2,0,0]=4 66 B15R2.94 CC1=C(N=C(N=N1)C2=CC=CC=C2)O MCULE-9794189537 [0,0,0,0,2,0|1,0,1]=4 67 B15R2.94 CC1=CC(=NNC1=O)C2=CC=CC=C2 MCULE-1734270242 [0,0,0,0,2,0|2,0,0]=4 68 B15R2.94 NC1=CC(=NNC1=O)C2=CC=CC=C2 MCULE-7178341775 [0,0,0,0,2,0|2,0,0]=4 69 B15R2.94 O=C1NN=C(C=C1Cl)C2=CC=CC=C2 MCULE-9936034002 [0,0,0,0,2,0|2,0,0]=4 70 B15R2.94 OC1=C(C=NC(=N1)C2=CC=CC=C2)Br MCULE-5199549113 [0,0,0,0,2,0|2,0,0]=4 71 B15R2.94 OC1=C(C=NC(=N1)C2=CC=CC=C2)F MCULE-8299950719 [0,0,0,0,2,0|2,0,0]=4 72 B15R2.4083 O=C1CCC(=C1O)CC2=CC=CC=C2 MCULE-4608449277 [0,0,0,0,2,0|2,0,0]=4 73 B17R2.216 BrC1=CN=C(N=C1)NCCC2=CC=CC=C2 MCULE-5037455652 [1,0,0,0,0,1|2,0,0]=4 74 B19R2.11839 CC1=NN=C(N=C1O)SCCOC2=CC=CC=C2 MCULE-4273521648 [0,0,0,0,0,2|1,0,1]=4