0 B10R2.7 C1=CC2=C(C=C1)SC=N2 R587656 [0,0,0,0,0,0|3,0,0]=3 1 B10R2.7 C1=CC2=C(C=C1)SCN2 S659142 [0,0,0,0,0,0|3,0,1]=4 2 B10R2.7 C1=CC2=C(C=C1)[Se]C=N2 S440051 [0,0,0,0,0,0|3,0,0]=3 3 B10R2.7 C1=CC2=C(C=CN2)C=N1 PH010447 [0,0,0,0,0,0|4,0,0]=4 4 B10R2.7 C1=CC2=C(C=N1)NC=C2 CDS007514 [0,0,0,0,0,0|4,0,0]=4 5 B10R2.7 C1=CC2=C(S1)C=NC=N2 SYX00365 [0,0,0,0,0,0|4,0,0]=4 6 B10R2.7 C1=CC2=NC=NN2C=C1 SYX00359 [0,0,0,0,0,0|3,0,1]=4 7 B10R2.7 C1=CN2C=CN=C2N=C1 CDS017059 [0,0,0,0,0,0|3,0,0]=3 8 B10R2.7 C1=CN=C2C=CNC2=C1 ADE000968 [0,0,0,0,0,0|2,0,0]=2 9 B10R2.7 C1=CN=C2C=NNC2=C1 BLN00003 [0,0,0,0,0,0|3,0,0]=3 10 B10R2.7 C1=C[N+]2=C(N=C1)SC=C2 S42812 [0,0,0,0,0,0|4,0,0]=4 11 B10R2.7 C1=C[N+]2=C(N=C1)SC=C2 S42928 [0,0,0,0,0,0|4,0,0]=4 12 B10R2.7 C1=NC2=C(N1)CCCC2 T323586 [0,0,0,0,0,0|2,0,2]=4 13 B10R2.7 [NH+]1=CSC2=C1C=CC=C2 R241989 [0,0,0,0,0,0|3,0,1]=4 14 B11R2.1 BrC1=NNC2=C1C=CC=N2 BLN00006 [0,1,0,0,0,0|3,0,0]=4 15 B11R2.1 BrC1=NNC2=CC=CN=C12 BLN00010 [0,1,0,0,0,0|3,0,0]=4 16 B11R2.1 CN1C=NC2=CC=CN=C12 ADE001232 [0,1,0,0,0,0|1,0,0]=2 17 B11R2.1 ClC1=NNC2=C1C=CC=N2 BLN00021 [0,1,0,0,0,0|3,0,0]=4 18 B11R2.1 ClC1=NNC2=C1C=CC=N2 CDS020261 [0,1,0,0,0,0|3,0,0]=4 19 B11R2.1 IC1=CNC2=NC=NC=C12 ADE000075 [0,1,0,0,0,0|3,0,0]=4 20 B11R2.1 NC1=NNC2=CC=CN=C12 BLN00041 [0,1,0,0,0,0|3,0,0]=4 21 B11R2.1 SC1=CNC2=C1C=CC=C2 CDS014121 [0,1,0,0,0,0|3,0,0]=4 22 B11R2.1 [O-][N+]1=CNC2=C1C=CC=C2 R429619 [0,1,0,0,0,0|2,0,1]=4 23 B11R2.10 CC1=NC2=CC=CN=C2N1 CBR01690 [0,1,0,0,0,0|1,0,0]=2 24 B11R2.10 CC1=N[N+]2=C(S1)N=CC=C2 S42855 [0,1,0,0,0,0|3,0,0]=4 25 B11R2.10 ClC1=NC2=C(N1)C=CC=N2 CDS010108 [0,1,0,0,0,0|1,0,0]=2 26 B11R2.10 N1C(=NC2=C1C=CC=C2)C S447102 [0,1,0,0,0,0|2,0,0]=3 27 B11R2.10 O=C1NC2=NC=CC=C2O1 CDS005683 [0,1,0,0,0,0|2,0,0]=3 28 B11R2.10 S=C1NC2=C(O1)C=CC=C2 PH000231 [0,1,0,0,0,0|3,0,0]=4 29 B11R2.10 S=C1NC2=C(O1)C=CC=C2 PH000865 [0,1,0,0,0,0|3,0,0]=4 30 B11R2.10 [S-]C1=NC2=C(S1)C=CC=C2 S813435 [0,1,0,0,0,0|3,0,0]=4 31 B11R2.36 BrC1=CC2=C(C=C1)NN=N2 CDS007659 [0,1,0,0,0,0|3,0,0]=4 32 B11R2.36 BrC1=CC2=C(C=C1)SC=N2 CDS006877 [0,1,0,0,0,0|3,0,0]=4 33 B11R2.36 BrC1=CC2=C(C=NN2)N=C1 BLN00048 [0,1,0,0,0,0|3,0,0]=4 34 B11R2.36 BrC1=CC=C2NC=CC2=N1 CDS022967 [0,1,0,0,0,0|2,0,0]=3 35 B11R2.36 BrC1=CC=C2NC=CC2=N1 PHB00045 [0,1,0,0,0,0|2,0,0]=3 36 B11R2.36 BrC1=CC=C2OC=NC2=C1 BML00292 [0,1,0,0,0,0|3,0,0]=4 37 B11R2.36 BrC1=CC=C2OC=NC2=C1 CDS016654 [0,1,0,0,0,0|3,0,0]=4 38 B11R2.36 BrC1=CN2N=CN=C2N=C1 CBR02199 [0,1,0,0,0,0|2,0,1]=4 39 B11R2.36 BrC1=CN=C2C=CNC2=C1 ADE000947 [0,1,0,0,0,0|2,0,0]=3 40 B11R2.36 BrC1=CN=C2C=COC2=C1 ADE001159 [0,1,0,0,0,0|3,0,0]=4 41 B11R2.36 BrC1=CN=C2NN=CC2=C1 ADE000064 [0,1,0,0,0,0|3,0,0]=4 42 B11R2.36 BrC1=CN=C2OC=CC2=C1 ADE001191 [0,1,0,0,0,0|3,0,0]=4 43 B11R2.36 BrC1=NC2=C(C=C1)NN=C2 BLN00049 [0,1,0,0,0,0|3,0,0]=4 44 B11R2.36 BrC1=NC2=C(C=CN2)C=C1 CDS022311 [0,1,0,0,0,0|2,0,0]=3 45 B11R2.36 CC1=CC2=C(C=C1)NN=N2 CDS000420 [0,1,0,0,0,0|3,0,0]=4 46 B11R2.36 CC1=CC2=C(N=C1)NC=C2 ADE000939 [0,1,0,0,0,0|2,0,0]=3 47 B11R2.36 CC1=CC=C2NN=CC2=N1 BLN00044 [0,1,0,0,0,0|3,0,0]=4 48 B11R2.36 ClC1=CC=C2N=CSC2=N1 UPL0010 [0,1,0,0,0,0|2,0,0]=3 49 B11R2.36 ClC1=CC=C2NC=CC2=N1 ADE000995 [0,1,0,0,0,0|2,0,0]=3 50 B11R2.36 ClC1=CC=C2NN=CC2=N1 BLN00012 [0,1,0,0,0,0|3,0,0]=4 51 B11R2.36 ClC1=CN=C2C=CNC2=C1 ADE000965 [0,1,0,0,0,0|2,0,0]=3 52 B11R2.36 ClC1=CN=C2C=COC2=C1 ADE001142 [0,1,0,0,0,0|3,0,0]=4 53 B11R2.36 ClC1=CN=C2NC=CC2=C1 ADE000883 [0,1,0,0,0,0|2,0,0]=3 54 B11R2.36 ClC1=NC2=C(C=CN2)C=N1 ANV00113 [0,1,0,0,0,0|3,0,0]=4 55 B11R2.36 ClC1=NN2C=CN=C2C=C1 CDS005940 [0,1,0,0,0,0|3,0,0]=4 56 B11R2.36 FC1=CC2=C(C=C1)OC=N2 CDS022749 [0,1,0,0,0,0|3,0,0]=4 57 B11R2.36 FC1=CC=C2NC=NC2=C1 CDS008386 [0,1,0,0,0,0|2,0,0]=3 58 B11R2.36 FC1=CN=C2NC=CC2=C1 ADE000902 [0,1,0,0,0,0|2,0,0]=3 59 B11R2.36 IC1=CN=C2C=CNC2=C1 ADE000967 [0,1,0,0,0,0|2,0,0]=3 60 B11R2.36 IC1=CN=C2C=COC2=C1 ADE001138 [0,1,0,0,0,0|3,0,0]=4 61 B11R2.36 IC1=CN=C2NC=CC2=C1 ADE000885 [0,1,0,0,0,0|2,0,0]=3 62 B11R2.36 IC1=CN=C2NN=CC2=C1 ADE000069 [0,1,0,0,0,0|3,0,0]=4 63 B11R2.36 N1C=NC2=C1N=CC(=C2)Br ANV00244 [0,1,0,0,0,0|1,0,0]=2 64 B11R2.36 NC1=CC2=C(C=C1)NC=N2 CDS003539 [0,1,0,0,0,0|2,0,0]=3 65 B11R2.36 NC1=CC2=C(C=C1)NN=N2 CDS000711 [0,1,0,0,0,0|3,0,0]=4 66 B11R2.36 NC1=CC=C2N=COC2=C1 CDS013806 [0,1,0,0,0,0|3,0,0]=4 67 B11R2.36 NC1=CN=C2C=CNC2=C1 ADE000966 [0,1,0,0,0,0|2,0,0]=3 68 B11R2.36 NC1=CN=C2NC=CC2=C1 ADE000889 [0,1,0,0,0,0|2,0,0]=3 69 B11R2.36 OC1=CC=C2NC=NC2=C1 CBR02476 [0,1,0,0,0,0|2,0,0]=3 70 B11R2.36 OC1=CN=C2C=CNC2=C1 ADE000960 [0,1,0,0,0,0|2,0,0]=3 71 B11R2.36 OC1=CN=C2C=COC2=C1 ADE001146 [0,1,0,0,0,0|3,0,0]=4 72 B11R2.36 OC1=CN=C2NC=CC2=C1 ADE000886 [0,1,0,0,0,0|2,0,0]=3 73 B11R2.36 OC1=NN2C=CN=C2C=C1 SYX00185 [0,1,0,0,0,0|3,0,0]=4 74 B11R2.106 BrC1=C2NN=NC2=CC=C1 CDS021140 [0,1,0,0,0,0|3,0,0]=4 75 B11R2.106 ClC1=NC=NC2=C1N=CS2 CDS021287 [0,1,0,0,0,0|3,0,0]=4 76 B11R2.106 IC1=C2C=CNC2=NC=C1 ADE000928 [0,1,0,0,0,0|2,0,0]=3 77 B11R2.106 NC1=C2C=CNC2=NC=C1 ADE000973 [0,1,0,0,0,0|2,0,0]=3 78 B11R2.106 NC1=C2OC=CC2=NC=C1 ADE001178 [0,1,0,0,0,0|3,0,0]=4 79 B11R2.106 OC1=C2C=CNC2=NC=C1 ADE000935 [0,1,0,0,0,0|2,0,0]=3 80 B11R2.106 OC1=CC=CC2=C1N=CN2 CDS008334 [0,1,0,0,0,0|2,0,0]=3 81 B11R2.106 OC1=CC=CC2=C1N=CO2 CDS009144 [0,1,0,0,0,0|3,0,0]=4 82 B11R2.106 OC1=CC=CC2=C1NC=C2 CDS005198 [0,1,0,0,0,0|3,0,0]=4 83 B11R2.106 [O-][N+]1=C2NC=CC2=CC=C1 PH009705 [0,1,0,0,0,0|2,0,1]=4 84 B9R1.8 C(=O)NC1=CN=CC=C1 S243426 [0,0,1,0,0,0|2,0,0]=3 85 B9R1.8 C/C=C/C1=CC=CC=N1 PH007383 [0,0,1,0,0,0|3,0,0]=4 86 B9R1.8 NCCC1=CC=CN=C1 CDS003709 [0,0,1,0,0,0|2,0,1]=4 87 B9R1.8 NCCC1=CC=CN=C1 CDS022961 [0,0,1,0,0,0|2,0,1]=4 88 B9R1.8 O=C=NC1=CC=CN=C1 CDS004476 [0,0,1,0,0,0|2,0,1]=4 89 B9R1.12 C(=O)/C=C/C1=CC=CN1 L166448 [0,0,1,0,0,0|3,0,0]=4 90 B9R1.15 CNC1=NC=CC=C1Cl T169315 [0,0,1,0,0,0|2,0,1]=4 91 B9R1.15 COC1=NC=CC=C1N CDS002836 [0,0,1,0,0,0|2,0,1]=4 92 B9R1.15 COC1=NC=CN=C1I SYX00132 [0,0,1,0,0,0|2,0,1]=4 93 B9R1.15 NC1=C(N=CC=C1)C=O CDS022545 [0,0,1,0,0,0|3,0,0]=4 94 B9R1.15 NC1=NC=CC=C1CO ADE000265 [0,0,1,0,0,0|3,0,0]=4 95 B11R2.20 C1=CC2=C(C=C1)C=NC=C2 R702455 [0,0,0,0,0,1|3,0,0]=4 96 B11R2.20 C1=CC2=CN=CC=C2N=C1 ADE000839 [0,0,0,0,0,1|2,0,0]=3 97 B11R2.20 C1=CC=C2N=CNCC2=C1 PH008283 [0,0,0,0,0,1|2,0,0]=3 98 B11R2.20 C1=CN=C2CCCNC2=C1 T316458 [0,0,0,0,0,1|2,0,1]=4 99 B11R2.20 C1=CN=C2N=CC=CC2=C1 CDS021459 [0,0,0,0,0,1|2,0,0]=3 100 B11R2.20 C1=CN=C2NCCCC2=C1 CDS022647 [0,0,0,0,0,1|2,0,1]=4 101 B11R2.20 C1=CN=C2OCCNC2=C1 ADE001247 [0,0,0,0,0,1|2,0,1]=4 102 B11R2.20 C1=C[N+]2=C(N=C1)N=CC=C2 S11860 [0,0,0,0,0,1|3,0,0]=4 103 B8R1.2 NCC1=CN=CC=C1 S763780 [1,0,1,0,0,0|1,0,1]=4 104 B8R1.2 NCC1=CN=CC=N1 CDS009594 [1,0,1,0,0,0|0,0,1]=3 105 B8R1.2 O=CC1=CN=CC=N1 CDS008587 [1,0,1,0,0,0|1,0,0]=3 106 B8R1.5 CC1=NC=CN=C1Cl CDS013629 [1,0,1,0,0,0|1,0,1]=4 107 B8R1.5 CC1=NC=CN=C1S PH014228 [1,0,1,0,0,0|1,0,1]=4 108 B8R1.5 NC1=CC=CN=C1O CDS007860 [1,0,1,0,0,0|2,0,0]=4 109 B10R1.1 CC1=CN=C(C=N1)CNN PH019269 [0,1,1,0,0,0|2,0,0]=4 110 B10R1.4 CC1=C(N=CC=C1)NC=O S906697 [0,1,1,0,0,0|2,0,0]=4 111 B10R1.18 CC(=O)CC1=CN=CC=N1 CDS013843 [0,1,1,0,0,0|2,0,0]=4 112 B10R1.18 CC(=O)NC1=CC=CC=N1 S357146 [0,1,1,0,0,0|2,0,0]=4 113 B10R1.18 NC(=O)CC1=CC=CC=N1 S561525 [0,1,1,0,0,0|2,0,0]=4 114 B10R1.18 O=C(O)CC1=CN=CC=N1 CDS003770 [0,1,1,0,0,0|2,0,0]=4 115 B10R2.2 NC1=NC2=C(S1)SC=C2 CDS024425 [0,1,0,0,1,0|2,0,0]=4 116 B12R2.24 CC1=CC2=C(C=C1)N=CC=N2 PH011260 [0,1,0,0,0,1|2,0,0]=4 117 B12R2.24 CC1=NC2=C(C=C1)C=NC=C2 PH008439 [0,1,0,0,0,1|2,0,0]=4 118 B12R2.24 CC1=NC2=NC=CC=C2C=C1 ADE000831 [0,1,0,0,0,1|2,0,0]=4 119 B12R2.24 IC1=CN=C2C=CC=NC2=C1 ADE000848 [0,1,0,0,0,1|2,0,0]=4 120 B12R2.24 NC1=CC=C2C=NC=CC2=N1 CDS006673 [0,1,0,0,0,1|2,0,0]=4 121 B12R2.24 NC1=CN=C2C=CC=NC2=C1 ADE000870 [0,1,0,0,0,1|2,0,0]=4 122 B12R2.24 NC1=NCC2=CC=CC=C2N1 PH012493 [0,1,0,0,0,1|2,0,0]=4 123 B12R2.24 O=C1COC2=NC=CC=C2N1 ADE001249 [0,1,0,0,0,1|2,0,0]=4 124 B12R2.24 O=C1CSC2=NC=CC=C2N1 PH011261 [0,1,0,0,0,1|2,0,0]=4 125 B12R2.24 OC1=CN=C2C=CC=NC2=C1 ADE000860 [0,1,0,0,0,1|2,0,0]=4 126 B12R2.1081 ClC1=CC=NC2=C1C=NC=C2 CDS023178 [0,1,0,0,0,1|2,0,0]=4 127 B12R2.18 CC1=C(C2=CC=CN=C2N1)I PHB00180 [0,2,0,0,0,0|2,0,0]=4 128 B12R2.18 CN1C(=NC2=C1C=CC=C2)N S11372 [0,2,0,0,0,0|2,0,0]=4 129 B12R2.132 BrC1=CNC2=NC=C(C=C12)I ADE000897 [0,2,0,0,0,0|2,0,0]=4 130 B12R2.132 CC1=CN=C2NC=C(C2=C1)I ADE000940 [0,2,0,0,0,0|2,0,0]=4 131 B12R2.132 CN1C=NC2=CC=C(C=C12)Br CDS008133 [0,2,0,0,0,0|2,0,0]=4 132 B12R2.132 CN1C=NC2=CC=C(C=C12)N CDS019276 [0,2,0,0,0,0|2,0,0]=4 133 B12R2.132 ClC1=CC=C2NC=C(C2=N1)I ADE001376 [0,2,0,0,0,0|2,0,0]=4 134 B12R2.132 ClC1=CN=C2NC=C(C2=C1)I ADE000899 [0,2,0,0,0,0|2,0,0]=4 135 B12R2.132 FC1=CN=C2NC=C(C2=C1)I ADE000905 [0,2,0,0,0,0|2,0,0]=4 136 B12R2.196 CN1C=CC2=C(C=CN=C12)Cl CDS023532 [0,2,0,0,0,0|2,0,0]=4 137 B12R2.203 ClC1=C2C(=CNC2=NC=C1)Br SYX00215 [0,2,0,0,0,0|2,0,0]=4 138 B12R2.203 ClC1=C2C(=CNC2=NC=C1)I ADE000946 [0,2,0,0,0,0|2,0,0]=4 139 B12R2.612 BrC1=CN=C2C(=CNC2=C1)I ADE000951 [0,2,0,0,0,0|2,0,0]=4 140 B12R2.612 CN1C=CC2=CC(=CN=C12)O ADE000927 [0,2,0,0,0,0|2,0,0]=4 141 B12R2.612 CN1C=NC2=CC(=CC=C12)Br CDS023161 [0,2,0,0,0,0|2,0,0]=4 142 B12R2.612 CN1C=NC2=CC(=CN=C12)Br ADE001214 [0,2,0,0,0,0|1,0,0]=3 143 B12R2.612 CN1C=NC2=CC(=CN=C12)Cl ADE001227 [0,2,0,0,0,0|1,0,0]=3 144 B12R2.612 CN1C=NC2=CC(=CN=C12)I ADE001215 [0,2,0,0,0,0|1,0,0]=3 145 B12R2.612 CN1C=NC2=CC(=CN=C12)N ADE001231 [0,2,0,0,0,0|1,0,0]=3 146 B12R2.612 CN1C=NC2=CC(=CN=C12)O ADE001223 [0,2,0,0,0,0|1,0,0]=3 147 B12R2.32 CSC1=NC2=C(N1)C=CC=C2 R429929 [0,2,0,0,0,0|2,0,0]=4 148 B12R2.32 C[Se]C1=NC2=C(N1)C=CC=C2 S202851 [0,2,0,0,0,0|2,0,0]=4 149 B12R2.32 ClCC1=NC2=C(N1)C=CC=C2 S934852 [0,2,0,0,0,0|2,0,0]=4 150 B12R2.32 NCC1=NC2=NC=CC=C2N1 CDS019145 [0,2,0,0,0,0|1,0,0]=3 151 B12R2.32 O=CC1=NC2=C(N1)C=CC=C2 PH006841 [0,2,0,0,0,0|2,0,0]=4 152 B12R2.32 SCC1=NC2=CC=CC=C2N1 CBR00787 [0,2,0,0,0,0|2,0,0]=4 153 B12R2.202 CC1=NC2=C(N1)N=CN=C2Cl CDS009066 [0,2,0,0,0,0|2,0,0]=4 154 B12R2.202 ClC1=CC=NC2=C1C=C(N2)I CVT00093 [0,2,0,0,0,0|2,0,0]=4 155 B12R2.202 N1C(=NC2=C1N=CN=C2O)S S458120 [0,2,0,0,0,0|2,0,0]=4 156 B12R2.202 O=C1CC2=C(C=CN=C2N1)Cl CDS023561 [0,2,0,0,0,0|2,0,0]=4 157 B12R2.606 BrC1=CN=C2NC(=CC2=C1)I ADE001093 [0,2,0,0,0,0|2,0,0]=4 158 B12R2.606 CC1=CC2=CC(=CN=C2N1)Br ADE001092 [0,2,0,0,0,0|2,0,0]=4 159 B12R2.606 CC1=CC2=CC=C(N=C2N1)Cl CVT00123 [0,2,0,0,0,0|2,0,0]=4 160 B12R2.606 CC1=CC=C2NC(=NC2=C1)N CDS005473 [0,2,0,0,0,0|2,0,0]=4 161 B12R2.606 CC1=NC2=CC(=CC=C2N1)O CBR02477 [0,2,0,0,0,0|2,0,0]=4 162 B12R2.606 CC1=NC2=CC=C(C=C2N1)N CDS022382 [0,2,0,0,0,0|2,0,0]=4 163 B12R2.606 N1C(=NC2=C1C=CC(=C2)Br)Cl KOB0075 [0,2,0,0,0,0|2,0,0]=4 164 B12R2.606 N1C(=NC2=C1C=CC(=C2)Cl)C S438812 [0,2,0,0,0,0|2,0,0]=4 165 B12R2.606 N1C2=CC=C(C=C2N=C1C)Br ANV00243 [0,2,0,0,0,0|2,0,0]=4 166 B12R2.606 NC1=NC2=C(N1)C=CC(=C2)Br CDS022313 [0,2,0,0,0,0|2,0,0]=4 167 B12R2.606 NC1=NC2=C(N1)C=CC(=C2)Cl PH016109 [0,2,0,0,0,0|2,0,0]=4 168 B12R2.606 O=C1CC2=CC(=CN=C2N1)F ADE001070 [0,2,0,0,0,0|2,0,0]=4 169 B12R2.606 O=C1NC2=C(N1)N=C(C=C2)Cl CDS022312 [0,2,0,0,0,0|1,0,1]=4 170 B12R2.606 O=C1NC2=NC=C(C=C2O1)Br CDS005180 [0,2,0,0,0,0|2,0,0]=4 171 B12R2.606 OC1=NC2=C(N1)C=C(C=C2)Cl S802360 [0,2,0,0,0,0|2,0,0]=4 172 B12R2.606 OC1=NC2=C(N1)C=CC(=C2)Cl S802042 [0,2,0,0,0,0|2,0,0]=4 173 B12R2.606 OC1=NC2=CC(=CN=C2N1)Br ADE001244 [0,2,0,0,0,0|1,0,0]=3 174 B12R2.606 OC1=NC2=NC=C(C=C2N1)Br T316016 [0,2,0,0,0,0|1,0,0]=3 175 B12R2.606 SC1=NC2=CC(=CC=C2N1)Cl TMT00049 [0,2,0,0,0,0|2,0,0]=4 176 B12R2.44 COC1=CN=C2NC=CC2=C1 ADE000892 [0,2,0,0,0,0|2,0,0]=4 177 B12R2.44 ClCC1=CN=C2NC=CC2=C1 ADE000894 [0,2,0,0,0,0|2,0,0]=4 178 B12R2.44 N#CC1=CC2=C(C=C1)NC=N2 JRD0289 [0,2,0,0,0,0|2,0,0]=4 179 B12R2.44 N#CC1=CC=C2NC=CC2=N1 ADE000997 [0,2,0,0,0,0|2,0,0]=4 180 B12R2.44 N#CC1=CN=C2C=CNC2=C1 ADE000948 [0,2,0,0,0,0|2,0,0]=4 181 B12R2.44 N#CC1=CN=C2NC=CC2=C1 ADE000896 [0,2,0,0,0,0|2,0,0]=4 182 B12R2.44 O=CC1=CN=C2C=CNC2=C1 ADE000961 [0,2,0,0,0,0|2,0,0]=4 183 B12R2.44 O=CC1=CN=C2NC=CC2=C1 ADE000887 [0,2,0,0,0,0|2,0,0]=4 184 B12R2.44 OCC1=CC=C2C=CNC2=N1 ADE001337 [0,2,0,0,0,0|2,0,0]=4 185 B12R2.44 OCC1=CC=C2NC=NC2=C1 CDS015837 [0,2,0,0,0,0|2,0,0]=4 186 B12R2.44 OCC1=CN=C2C=CNC2=C1 ADE000963 [0,2,0,0,0,0|2,0,0]=4 187 B12R2.44 OCC1=CN=C2NC=CC2=C1 ADE000893 [0,2,0,0,0,0|2,0,0]=4 188 B12R2.82 CC1=C2C=CNC2=NC=C1Cl ADE000993 [0,2,0,0,0,0|2,0,0]=4 189 B12R2.82 CC1=C2C=CNC2=NC=C1F ADE001062 [0,2,0,0,0,0|2,0,0]=4 190 B12R2.82 CC1=CN=C2NC=CC2=C1Cl ADE000979 [0,2,0,0,0,0|2,0,0]=4 191 B12R2.82 ClC1=C(C2=C(N=C1)NC=C2)I ADE000989 [0,2,0,0,0,0|2,0,0]=4 192 B12R2.82 ClC1=C2C=CNC2=NC=C1Br CVT00115 [0,2,0,0,0,0|2,0,0]=4 193 B12R2.82 ClC1=C2C=CNC2=NC=C1I ADE000983 [0,2,0,0,0,0|2,0,0]=4 194 B12R2.82 ClC1=CN=C2NC=CC2=C1Cl ADE001014 [0,2,0,0,0,0|2,0,0]=4 195 B12R2.82 FC1=CN=C2NC=CC2=C1Cl ADE001015 [0,2,0,0,0,0|2,0,0]=4 196 B12R2.82 FC1=CN=C2NC=CC2=C1I ADE000982 [0,2,0,0,0,0|2,0,0]=4 197 B12R2.82 NC1=C2C=CNC2=NC=C1Cl ADE001007 [0,2,0,0,0,0|2,0,0]=4 198 B12R2.82 NC1=[N+](C=NC2=C1N=CN2)[O-] S540668 [0,2,0,0,0,0|2,0,0]=4 199 B12R2.82 OC1=C(C2=C(N=C1)NC=C2)Cl ADE000991 [0,2,0,0,0,0|2,0,0]=4 200 B12R2.82 OC1=C2C=CNC2=NC=C1Cl ADE000990 [0,2,0,0,0,0|2,0,0]=4 201 B12R2.82 OC1=C2C=CNC2=NC=C1F ADE001023 [0,2,0,0,0,0|2,0,0]=4 202 B12R2.100 ClC1=C(C=C2NC=NC2=C1)Cl ANV00150 [0,2,0,0,0,0|2,0,0]=4 203 B12R2.100 ClC1=C(N=C2NC=CC2=C1)I ADE001094 [0,2,0,0,0,0|2,0,0]=4 204 B12R2.100 FC1=C(C=C2N=CNC2=C1)Br CDS023617 [0,2,0,0,0,0|2,0,0]=4 205 B12R2.100 FC1=C(N=C2NC=CC2=C1)I ADE001071 [0,2,0,0,0,0|2,0,0]=4 206 B12R2.100 N1C=NC2=C1C=C(C(=C2)Cl)C S274585 [0,2,0,0,0,0|2,0,0]=4 207 B12R2.100 OC1=C(C=C2C=CNC2=N1)Cl ADE001308 [0,2,0,0,0,0|2,0,0]=4 208 B12R2.246 CC1=CC(=CC2=C1N=CN2)Cl L480681 [0,2,0,0,0,0|2,0,0]=4 209 B12R2.246 FC1=NC(=C2NC=NC2=N1)Cl CDS004760 [0,2,0,0,0,0|2,0,0]=4 210 B12R2.246 N1C=NC2=C1N=C(N=C2O)S S448524 [0,2,0,0,0,0|2,0,0]=4 211 B12R2.246 NC1=NC(=NC2=C1N=CN2)O CDS000009 [0,2,0,0,0,0|2,0,0]=4 212 B12R2.246 SC1=NC2=C(N=CN2)C(=N1)S S459070 [0,2,0,0,0,0|2,0,0]=4 213 B12R2.315 C(=O)C1=C2C=CNC2=NC=C1 CVT00121 [0,2,0,0,0,0|2,0,0]=4 214 B12R2.315 COC1=C2C=CNC2=NC=C1 ADE000907 [0,2,0,0,0,0|2,0,0]=4 215 B7R1.3 BrC1=CN=CC=N1 CDS005022 [2,0,1,0,0,0|1,0,0]=4 216 B7R1.3 NC1=CC=CC=N1 S822329 [2,0,1,0,0,0|1,0,0]=4 217 B7R1.3 [O-]C1=CN=CC=N1 S451452 [2,0,1,0,0,0|1,0,0]=4 218 B9R1.1 NCC1=NC=C(N=C1)Cl CDS021292 [1,1,1,0,0,0|0,0,1]=4 219 B13R2.662 CCN1C=NC2=C1N=CC(=C2)Br CDS022815 [0,3,0,0,0,0|1,0,0]=4 220 B13R2.45 CN1C(=NC2=CC=CN=C12)CN PH019301 [0,3,0,0,0,0|1,0,0]=4 221 B13R2.2130 CN1C=NC2=CC(=CN=C12)C#N ADE001221 [0,3,0,0,0,0|1,0,0]=4 222 B13R2.2130 CN1C=NC2=CC(=CN=C12)C=O ADE001222 [0,3,0,0,0,0|1,0,0]=4 223 B13R2.2130 CN1C=NC2=CC(=CN=C12)CO ADE001233 [0,3,0,0,0,0|1,0,0]=4 224 B13R2.2130 COC1=CN=C2C(=C1)N=CN2C ADE001240 [0,3,0,0,0,0|1,0,0]=4 225 B13R2.13083 CC1=NC2=C(C=C1Br)NC(=N2)O S136891 [0,3,0,0,0,0|1,0,0]=4