0 B12R2.612 BrC1=NC=C2C(=C1)NN=C2I CS-0037118 [0,0,0,0,0,0|2,1,0]=3 1 B12R2.612 CC1=NC=C2C(I)=NNC2=N1 CS-B0591 [0,0,0,0,0,0|4,0,0]=4 2 B12R2.612 CC1=NNC2=NC(Cl)=NC=C12 CS-0059044 [0,0,0,0,0,0|3,1,0]=4 3 B12R2.612 ClC1=CC2=C(N=C1)C(Br)=NN2 CS-0444972 [0,0,0,0,0,0|2,1,0]=3 4 B12R2.612 FC1=CC2=C(C=C1)C(I)=NN2 CS-0054255 [0,0,0,0,0,0|1,0,0]=1 5 B12R2.612 FC1=CC2=NC=C(Br)N2C=C1 CS-0083430 [0,0,0,0,0,0|3,0,1]=4 6 B12R2.612 NC1=CNC2=CC(Br)=CC=C12 CS-0255974 [0,0,0,0,0,0|2,1,0]=3 7 B12R2.612 NC1=NN=C2C=C(Br)C=CN12 CS-0781873 [0,0,0,0,0,0|2,1,1]=4 8 B12R2.612 O=C1NCC2=CC(I)=CC=C12 CS-0466975 [0,0,0,0,0,0|1,1,2]=4 9 B12R2.612 OC1=NN=C2C=C(Cl)C=CN12 CS-0321520 [0,0,0,0,0,0|1,1,1]=3 10 B11R2.1 BrC1=NC=C2C=CC=CN21 CS-0198899 [1,0,0,0,0,0|3,0,0]=4 11 B11R2.1 CC1=CNC2=C1C=CN=C2 CS-0056698 [1,0,0,0,0,0|3,0,0]=4 12 B11R2.1 CC1=NC=C2C=CC=CN21 CS-0669417 [1,0,0,0,0,0|3,0,0]=4 13 B11R2.1 NC1=CNC2=CC=CN=C12 CS-0141583 [1,0,0,0,0,0|3,0,0]=4 14 B11R2.36 BrC1=CN2N=NC=C2C=C1 CS-0181051 [1,0,0,0,0,0|1,1,1]=4 15 B11R2.36 CC1=NC=C2C=NNC2=N1 CS-B0806 [1,0,0,0,0,0|3,0,0]=4 16 B11R2.36 ClC1=CC2=C(C=C1)C=NO2 CS-0269309 [1,0,0,0,0,0|1,1,0]=3 17 B11R2.36 FC1=CC2=C(C=C1)C=NO2 CS-0530447 [1,0,0,0,0,0|1,0,0]=2 18 B13R2.662 NCC1=NOC2=CC(F)=CC=C21 CS-0286263 [0,1,0,0,0,0|2,0,0]=3 19 B13R2.662 O=CC1=CNC2=C1C=CC(O)=C2 CS-B1236 [0,1,0,0,0,0|2,0,1]=4 20 B13R2.2130 N#CC1=CC2=C(C=N1)C(Br)=NN2 CS-0471894 [0,1,0,0,0,0|3,0,0]=4 21 B13R2.2130 O=CC1=CC2=C(C=C1)C(I)=NN2 CS-0039521 [0,1,0,0,0,0|2,0,0]=3 22 B13R2.5180 CC1=C(I)C2=C(C=C1)C(N)=NO2 CS-0610278 [0,1,0,0,0,0|3,0,0]=4 23 B13R2.5180 NC1=NNC2=C1C=CC(F)=C2F CS-0130534 [0,1,0,0,0,0|1,0,0]=2 24 B13R2.5187 CN1N=C(N)C2=C1C=C(Cl)C=C2 CS-0440071 [0,1,0,0,0,0|1,1,0]=3 25 B13R2.11634 CC1=CNC2=C1C=C(F)C(Br)=C2 CS-0055943 [0,1,0,0,0,0|2,1,0]=4 26 B13R2.11634 NC1=C(F)C=C2COB(O)C2=C1 CS-0534918 [0,1,0,0,0,0|3,0,0]=4 27 B13R2.11634 O=C1NCC2=C1C=C(Br)C(F)=C2 CS-WAA0335 [0,1,0,0,0,0|1,0,2]=4 28 B13R2.11634 O=C1NCC2=C1C=C(Cl)C(F)=C2 CS-WAA0298 [0,1,0,0,0,0|1,0,2]=4 29 B13R2.11634 O=C1NCC2=C1C=C(F)C(F)=C2 CS-WAA0131 [0,1,0,0,0,0|1,0,2]=4 30 B13R2.11642 O=C1NCC2=C1C(F)=CC(F)=C2 CS-WAA0320 [0,1,0,0,0,0|1,0,2]=4 31 B11R1.22 CC1=CC=C(\C(C)=N\O)C=C1 CS-0324021 [0,0,1,0,0,0|3,0,0]=4 32 B11R1.22 NCC(=O)C1=CC=C(I)C=C1 CS-0764716 [0,0,1,0,0,0|1,1,1]=4 33 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 CS-0168493 [0,0,1,0,0,0|2,0,1]=4 34 B11R1.37 N#CC1=CC(F)=CC=C1C=O CS-0045055 [0,0,1,0,0,0|1,0,2]=4 35 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 CS-W020416 [0,0,1,0,0,0|2,0,1]=4 36 B11R1.166 CC(=O)C1=C(N)C=C(Br)C=C1 CS-W006736 [0,0,1,0,0,0|1,1,1]=4 37 B11R1.166 CC(O)C1=CC=C(F)C=C1F CS-0378118 [0,0,1,0,0,0|2,0,1]=4 38 B11R1.166 C[C@@H](O)C1=CC=C(F)C=C1Br CS-0238227 [0,0,1,0,0,0|2,0,1]=4 39 B11R1.166 N=C(N)C1=CC=C(Br)C=C1F CS-M2562 [0,0,1,0,0,0|2,1,0]=4 40 B13R2.3683 ClC1=CC2=C(C=C1)C=C(Br)N=C2 CS-0082163 [0,0,0,0,0,1|2,1,0]=4 41 B13R2.3683 FC1=CC2=CN=C(Cl)N=C2C=C1 CS-0148873 [0,0,0,0,0,1|2,0,0]=3 42 B13R2.3683 NC1=CN=C2C=C(F)C=CC2=C1 CS-0449796 [0,0,0,0,0,1|2,0,1]=4 43 B13R2.3683 NC1=NC=C2C=C(F)C=CC2=N1 CS-0084750 [0,0,0,0,0,1|2,0,0]=3 44 B13R2.3683 OC1=CC2=C(C=N1)C=C(Br)C=C2 CS-0054289 [0,0,0,0,0,1|1,1,0]=3 45 B13R2.3683 OC1=CC=C2C=C(I)C=CC2=C1 CS-0312290 [0,0,0,0,0,1|2,1,0]=4 46 B13R2.3683 OC1=CN=C2C=C(Cl)C=CC2=C1 CS-0216850 [0,0,0,0,0,1|1,1,1]=4 47 B13R2.5179 BrC1=CC2=C(C=C1)C(Br)=CN=C2 CS-0139734 [0,0,0,0,0,1|2,1,0]=4 48 B13R2.5179 CC1=NC=CC2=CC(Br)=CC=C21 CS-0210851 [0,0,0,0,0,1|2,1,0]=4 49 B13R2.5179 ClC1=C2C=CC(Br)=CC2=NN=C1 CS-0133637 [0,0,0,0,0,1|1,1,1]=4 50 B13R2.5179 NC1=C2C=CC(F)=CC2=CC=C1 CS-0254560 [0,0,0,0,0,1|3,0,0]=4 51 B13R2.5179 OC1=CC=NC2=CC(Cl)=CC=C12 CS-W017251 [0,0,0,0,0,1|1,1,1]=4 52 B10R1.13 O=C(O)C1=CC=C(I)C=C1 CS-W014112 [1,0,1,0,0,0|1,1,0]=4 53 B10R1.15 C\C(=N/O)C1=CC=CC=C1 CS-0160349 [1,0,1,0,0,0|2,0,0]=4 54 B10R1.10 OCCC1=CC(F)=CC=C1 CS-W021390 [1,0,1,0,0,0|1,0,1]=4 55 B10R1.30 CNC1=C(N)C=CC(F)=C1 CS-0216852 [1,0,1,0,0,0|2,0,0]=4 56 B10R1.30 NCC1=CC(F)=CC=C1O CS-0626397 [1,0,1,0,0,0|1,0,1]=4 57 B10R1.61 O=C(O)C1=C(F)C=CC=C1 CS-0188334 [1,0,1,0,0,0|2,0,0]=4 58 B10R2.7 C1=CC=C2NC=NC2=C1 CS-0379189 [2,0,0,0,0,0|2,0,0]=4 59 B12R1.126 CC(C)(O)C1=CC=C(F)C=C1N CS-0616719 [0,1,1,0,0,0|1,0,1]=4 60 B12R1.232 CC(=O)C1=CC(Br)=C(F)C=C1N CS-0371925 [0,1,1,0,0,0|1,0,1]=4 61 B12R1.232 NC(=O)C1=CC(F)=C(F)C=C1N CS-0226691 [0,1,1,0,0,0|0,0,2]=4 62 B12R1.232 NC1=CC(Br)=C(Br)C=C1C(=O)O CS-0028798 [0,1,1,0,0,0|1,1,0]=4 63 B12R1.232 O=C(O)C1=CC(Cl)=C(F)C=C1Cl CS-0566239 [0,1,1,0,0,0|2,0,0]=4 64 B12R1.452 C#CC1=CC=C(C(=O)O)C(N)=C1 CS-0609643 [0,1,1,0,0,0|2,0,0]=4 65 B12R1.452 N#CC1=CC=C(C(=O)O)C(N)=C1 CS-0102040 [0,1,1,0,0,0|2,0,0]=4 66 B12R1.893 CC1=C(Br)C(C(=O)O)=CC=C1F CS-0572378 [0,1,1,0,0,0|2,0,0]=4 67 B12R1.1000 CC1=C(C(=O)O)C(N)=CC(Br)=C1 CS-0196551 [0,1,1,0,0,0|1,1,0]=4 68 B12R2.1 OCC1=NC=C2C=CC=CN21 CS-1038486 [1,1,0,0,0,0|2,0,0]=4 69 B12R2.132 CC1=CC2=C(C=N1)NN=C2Br CS-0469092 [1,1,0,0,0,0|2,0,0]=4 70 B12R2.132 CC1=CC=C2NN=C(Br)C2=N1 CS-WAA0151 [1,1,0,0,0,0|2,0,0]=4 71 B12R2.132 CC1=CNC2=C1C=C(F)C=C2 CS-0063939 [1,1,0,0,0,0|2,0,0]=4 72 B12R2.132 CC1=NNC2=C1N=C(Br)C=C2 CS-0197757 [1,1,0,0,0,0|2,0,0]=4 73 B12R2.132 ClC1=CNC2=C1C=C(Br)C=C2 CS-0375925 [1,1,0,0,0,0|2,0,0]=4 74 B12R2.132 NC1=CC2=C(C=C1)NC=C2Br CS-0284272 [1,1,0,0,0,0|2,0,0]=4 75 B12R2.132 OC1=NOC2=CC=C(Cl)C=C21 CS-0005505 [1,1,0,0,0,0|1,0,0]=3 76 B12R2.196 BrC1=CC=CC2=C1NN=C2I CS-0050084 [1,1,0,0,0,0|1,0,0]=3 77 B12R2.196 BrC1=NC=CC2=C1NN=C2I CS-0433511 [1,1,0,0,0,0|2,0,0]=4 78 B12R2.196 OC1=NOC2=C1C=CC=C2Br CS-0453174 [1,1,0,0,0,0|1,0,0]=3 79 B12R2.203 CC1=CNC2=CC=CC(F)=C12 CS-0439764 [1,1,0,0,0,0|2,0,0]=4 80 B12R2.203 CC1=NOC2=CC=CC(O)=C21 CS-0340451 [1,1,0,0,0,0|2,0,0]=4 81 B12R2.203 NC1=NNC2=C1C(=O)NC=C2 CS-0171518 [1,1,0,0,0,0|2,0,0]=4 82 B12R2.203 NC1=NNC2=C1C(Br)=CC=C2 CS-W009221 [1,1,0,0,0,0|1,0,0]=3 83 B12R2.2028 CN1C=C(N)C2=C1C=CC=C2 CS-0693770 [1,1,0,0,0,0|2,0,0]=4 84 B12R2.44 C#CC1=CC2=C(C=CN2)C=C1 CS-0266225 [1,1,0,0,0,0|2,0,0]=4 85 B12R2.44 NCC1=CC=C2N=NNC2=C1 CS-0254527 [1,1,0,0,0,0|2,0,0]=4 86 B12R2.44 OCC1=CC=C2C=NNC2=C1 CS-0052543 [1,1,0,0,0,0|1,0,0]=3 87 B12R2.82 ClC1=C(Br)C2=C(C=CN2)C=C1 CS-0564497 [1,1,0,0,0,0|1,1,0]=4 88 B12R2.82 ClC1=C(Br)C=CC2=C1NC=C2 CS-0617788 [1,1,0,0,0,0|1,1,0]=4 89 B12R2.82 FC1=CC=C2C=COC2=C1Br CS-0146599 [1,1,0,0,0,0|2,0,0]=4 90 B12R2.100 ClC1=C(I)C=C2C=NNC2=N1 CS-0653097 [1,1,0,0,0,0|1,1,0]=4 91 B12R2.100 FC1=CC2=C(C=C1Cl)NN=C2 CS-0050221 [1,1,0,0,0,0|0,1,0]=3 92 B12R2.100 FC1=CC2=C(C=NN2)C=C1Br CS-D1263 [1,1,0,0,0,0|0,0,0]=2 93 B12R2.100 NC1=C(F)C=C2C=CNC2=C1 CS-0155537 [1,1,0,0,0,0|2,0,0]=4 94 B12R2.100 NC1=CC2=C(C=C1Cl)NC=C2 CS-0055868 [1,1,0,0,0,0|1,1,0]=4 95 B12R2.246 CC1=C2C=CNC2=CC(N)=C1 CS-0542379 [1,1,0,0,0,0|2,0,0]=4 96 B12R2.246 CC1=C2C=NNC2=NC(Cl)=C1 CS-0183987 [1,1,0,0,0,0|1,1,0]=4 97 B12R2.246 CC1=CC(O)=C2C=NNC2=N1 CS-0529511 [1,1,0,0,0,0|2,0,0]=4 98 B12R2.246 CC1=NC(Cl)=CC2=C1C=NN2 CS-0492676 [1,1,0,0,0,0|1,1,0]=4 99 B12R2.246 ClC1=CC(Br)=CC2=C1C=CN2 CS-W019333 [1,1,0,0,0,0|1,1,0]=4 100 B12R2.606 FC1=CC=C2SC(=S)NC2=C1 CS-0040885 [1,1,0,0,0,0|2,0,0]=4 101 B14R2.2332 COC1=NC=C2C=C(Br)C=CC2=N1 CS-0653654 [0,1,0,0,0,1|1,1,0]=4 102 B14R2.28472 FC1=CC2=C(C=C1F)C(Cl)=NC=C2 CS-0774942 [0,1,0,0,0,1|2,0,0]=4 103 B14R2.28472 O=C1C=CNC2=C1C=C(F)C(F)=C2 CS-0609795 [0,1,0,0,0,1|1,0,1]=4 104 B14R2.28472 OC1=C2C=C(F)C(F)=CC2=CC=C1 CS-0226555 [0,1,0,0,0,1|2,0,0]=4 105 B14R2.300 CC(=O)C1=NNC2=C1C=CC(Br)=C2 CS-0324758 [0,2,0,0,0,0|0,1,1]=4 106 B14R2.300 NC1=CC2=C(C=C1)C(C(=O)O)=NN2 CS-0312280 [0,2,0,0,0,0|1,0,0]=3 107 B14R2.4217 O=C1NC2=C(C=CC(Cl)=C2)\C1=N\O CS-0626905 [0,2,0,0,0,0|1,1,0]=4 108 B14R2.36882 COC1=CC2=C(C(F)=C1)C(I)=NN2 CS-0646859 [0,2,0,0,0,0|2,0,0]=4 109 B12R1.49 CC1=CC=C(N\C(S)=N\N)C=C1 CS-W016002 [0,0,1,0,0,1|1,1,0]=4 110 B12R1.233 N=C(N)NC1=CC=C(F)C=C1Cl CS-M2115 [0,0,1,0,0,1|2,0,0]=4 111 B12R1.233 O=C(O)CC1=C(Br)C=C(F)C=C1 CS-W005090 [0,0,1,0,0,1|2,0,0]=4