0 B9R1.8 BrCCC1=NC=CC=C1 BB54-3597 [0,0,0,0,0,0|1,0,0]=1 1 B9R1.8 CCNC1=CC=CN=C1 BB58-1378 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.8 CNCC1=NC=CC=C1 BB55-7031 [0,0,0,0,0,0|1,0,0]=1 3 B9R1.8 CNCC1=NC=CN=C1 BB54-5692 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.8 CNCC1=NC=NC=C1 BB57-2309 [0,0,0,0,0,0|2,0,0]=2 5 B9R1.8 ClCCC1=NC=CC=C1 BB54-3546 [0,0,0,0,0,0|1,0,0]=1 6 B9R1.8 N#CCC1=CC=CN=C1 BB54-4766 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.8 N#CCC1=NC=CC=C1 BB53-1348 [0,0,0,0,0,0|1,0,1]=2 8 B9R1.8 NCCC1=NC=CN=C1 BB55-7667 [0,0,0,0,0,0|2,0,0]=2 9 B9R1.8 NOCC1=CC=CC=C1 BB05-2313 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.8 OCCC1=NC=CC=C1 BB01-4800 [0,0,0,0,0,0|1,0,0]=1 11 B9R1.8 OCCC1=NC=CN=C1 BB57-7201 [0,0,0,0,0,0|2,0,0]=2 12 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 BB56-0588 [0,0,0,0,0,0|2,0,1]=3 13 B9R1.8 [C-]#[N+]CC1=CC=CN=C1 BB56-1200 [0,0,0,0,0,0|3,0,1]=4 14 B8R1.2 CNC1=NC=CN=C1 BB54-3963 [1,0,0,0,0,0|2,0,0]=3 15 B8R1.2 ClCC1=CC=CN=C1 BB60-7973 [1,0,0,0,0,0|3,0,0]=4 16 B8R1.2 ClCC1=NN=CC=C1 BB32-1188 [1,0,0,0,0,0|2,0,0]=3 17 B8R1.2 NCC1=NC=CN=C1 BB58-0829 [1,0,0,0,0,0|2,0,0]=3 18 B8R1.2 NCC1=NC=NC=C1 BB57-2308 [1,0,0,0,0,0|2,0,0]=3 19 B8R1.2 OCC1=NC=CN=C1 BB58-0100 [1,0,0,0,0,0|2,0,0]=3 20 B10R1.1 CC1=CC=C(CON)C=C1 BB05-1789 [0,1,0,0,0,0|3,0,0]=4 21 B10R1.1 CCCC1=CN=C(O)N=C1 BB58-1072 [0,1,0,0,0,0|3,0,0]=4 22 B10R1.1 CCNC1=CC=C(Br)C=C1 BB31-7412 [0,1,0,0,0,0|2,0,0]=3 23 B10R1.1 CCNC1=CC=C(Cl)N=N1 BB55-4296 [0,1,0,0,0,0|2,0,0]=3 24 B10R1.1 CCNC1=CC=C(F)C=C1 BB01-5251 [0,1,0,0,0,0|2,0,0]=3 25 B10R1.1 CNCC1=CC=C(Br)C=C1 BB57-3005 [0,1,0,0,0,0|2,0,0]=3 26 B10R1.1 CNCC1=CC=C(Cl)N=C1 BB53-1663 [0,1,0,0,0,0|3,0,0]=4 27 B10R1.1 CNCC1=CC=C(O)C=C1 BB05-4614 [0,1,0,0,0,0|2,0,0]=3 28 B10R1.1 CNCC1=CC=C(O)C=C1 BB12-1375 [0,1,0,0,0,0|2,0,0]=3 29 B10R1.1 CSCC1=CC=C(Cl)N=C1 BB53-1554 [0,1,0,0,0,0|3,0,0]=4 30 B10R1.1 N#CCC1=CC=C(N)C=C1 BB12-4851 [0,1,0,0,0,0|2,0,1]=4 31 B10R1.1 NNCC1=CC=C(Cl)C=C1 BB57-4024 [0,1,0,0,0,0|3,0,0]=4 32 B10R1.1 NNCC1=CC=C(F)C=C1 BB57-4012 [0,1,0,0,0,0|3,0,0]=4 33 B10R1.1 [C-]#[N+]CC1=CC=C(Cl)C=C1 BB56-1770 [0,1,0,0,0,0|2,0,1]=4 34 B10R1.4 CC1=CC=CC=C1CCN BB12-2271 [0,1,0,0,0,0|2,0,0]=3 35 B10R1.4 CC1=CC=CC=C1CNN BB55-6543 [0,1,0,0,0,0|3,0,0]=4 36 B10R1.4 CCNC1=CC=CC=C1N BB12-3022 [0,1,0,0,0,0|2,0,0]=3 37 B10R1.4 CCOC1=C(N)N=CC=C1 BB54-3639 [0,1,0,0,0,0|3,0,0]=4 38 B10R1.4 CCOC1=NC=CC=C1N BB32-2785 [0,1,0,0,0,0|1,0,0]=2 39 B10R1.4 NNCC1=C(F)C=CC=C1 BB57-4010 [0,1,0,0,0,0|3,0,0]=4 40 B10R1.4 NNCC1=CC=CC=C1Cl BB57-1614 [0,1,0,0,0,0|3,0,0]=4 41 B10R1.10 CC1=CC=CC(CCN)=N1 BB55-7666 [0,1,0,0,0,0|1,0,0]=2 42 B10R1.10 CC1=CC=CC(\C=N\O)=N1 BB57-4721 [0,1,0,0,0,0|2,0,1]=4 43 B10R1.10 CCNC1=NC(C)=CC=C1 BB58-1376 [0,1,0,0,0,0|1,0,0]=2 44 B10R1.10 CCSC1=NC(N)=CC=N1 BB12-1744 [0,1,0,0,0,0|2,0,0]=3 45 B10R1.10 CNCC1=CC(O)=CC=C1 BB12-1357 [0,1,0,0,0,0|2,0,0]=3 46 B10R1.10 CNCC1=NC(C)=NC=C1 BB55-8308 [0,1,0,0,0,0|2,0,0]=3 47 B10R1.10 COCC1=CC=CC(N)=C1 BB57-5775 [0,1,0,0,0,0|2,0,0]=3 48 B10R1.10 N#CCC1=NC(Cl)=CC=C1 BB58-5322 [0,1,0,0,0,0|1,0,1]=3 49 B10R1.10 NNCC1=CC(Cl)=CC=C1 BB57-4023 [0,1,0,0,0,0|3,0,0]=4 50 B10R1.10 NNCC1=CC(F)=CC=C1 BB57-4011 [0,1,0,0,0,0|3,0,0]=4 51 B10R1.15 CC(C=O)C1=CC=CC=C1 BB17-2274 [0,1,0,0,0,0|2,0,1]=4 52 B10R1.15 CCC(=O)C1=NC=CC=C1 BB12-2185 [0,1,0,0,0,0|0,0,1]=2 53 B10R1.15 CCC(N)C1=CC=CC=C1 BB05-0915 [0,1,0,0,0,0|1,0,0]=2 54 B10R1.15 CCC(N)C1=CC=CC=C1 BB55-1056 [0,1,0,0,0,0|1,0,0]=2 55 B10R1.15 CNC(C)C1=CC=CC=C1 BB12-1671 [0,1,0,0,0,0|2,0,0]=3 56 B10R1.15 COC(=N)C1=NC=CN=C1 BB12-1722 [0,1,0,0,0,0|2,0,1]=4 57 B10R1.15 COC(=O)C1=NC=CN=C1 BB01-2777 [0,1,0,0,0,0|2,0,1]=4 58 B10R1.15 NC(CO)C1=CC=CC=C1 BB01-6618 [0,1,0,0,0,0|2,0,0]=3 59 B10R1.15 NCC(=O)C1=CC=CC=C1 BB26-0680 [0,1,0,0,0,0|2,0,1]=4 60 B10R1.15 N\C(=N/O)C1=NC=CC=C1 BB12-3473 [0,1,0,0,0,0|2,0,1]=4 61 B10R1.17 BrCCCC1=CN=CC=C1 BB54-3595 [0,1,0,0,0,0|2,0,0]=3 62 B10R1.17 BrCCOC1=CC=CC=C1 BB17-1654 [0,1,0,0,0,0|2,0,0]=3 63 B10R1.17 ClCCCC1=CC=NC=C1 BB57-3431 [0,1,0,0,0,0|2,0,0]=3 64 B10R1.17 N#CCCC1=NC=CC=C1 BB12-1756 [0,1,0,0,0,0|0,0,1]=2 65 B10R1.17 NCCCC1=CC=CC=N1 BB54-0788 [0,1,0,0,0,0|0,0,0]=1 66 B10R1.17 NCCCC1=CC=NC=C1 BB57-3430 [0,1,0,0,0,0|2,0,0]=3 67 B10R1.17 NC\C=C\C1=CC=CC=C1 BB12-1612 [0,1,0,0,0,0|1,0,2]=4 68 B10R1.17 OCCCC1=CC=NC=C1 BB57-6720 [0,1,0,0,0,0|2,0,0]=3 69 B10R1.17 [C-]#[N+]CCC1=CC=NC=C1 BB56-1803 [0,1,0,0,0,0|2,0,1]=4 70 B10R1.18 CC(=O)CC1=NC=CC=C1 BB55-8084 [0,1,0,0,0,0|0,0,1]=2 71 B10R1.18 CC(=O)CC1=NC=CN=C1 BB57-2158 [0,1,0,0,0,0|1,0,1]=3 72 B10R1.18 CC(N)CC1=CC=CN=C1 BB57-1084 [0,1,0,0,0,0|2,0,0]=3 73 B10R1.18 CC(N)CC1=NC=CN=C1 BB55-7668 [0,1,0,0,0,0|1,0,0]=2 74 B10R1.18 CC(O)CC1=NC=CC=C1 BB55-7547 [0,1,0,0,0,0|0,0,0]=1 75 B10R1.18 CC(O)CC1=NC=CN=C1 BB55-6193 [0,1,0,0,0,0|1,0,0]=2 76 B10R1.18 N=C(N)CC1=CC=CC=C1 BB31-4317 [0,1,0,0,0,0|2,0,1]=4 77 B10R1.18 O=[N+]([O-])NC1=NC=CC=C1 BB58-4973 [0,1,0,0,0,0|3,0,0]=4 78 B10R2.7 C1=CC2=C(N=C1)NC=C2 BB12-3415 [0,0,0,1,0,0|1,0,2]=4 79 B10R2.7 C1=NC=C2CNCC2=N1 BB31-8911 [0,0,0,1,0,0|2,0,0]=3 80 B8R1.8 BrCCN1C=CC=N1 BB55-6368 [0,0,0,0,1,0|2,0,0]=3 81 B8R1.8 BrCCN1C=CN=C1 BB12-2762 [0,0,0,0,1,0|3,0,0]=4 82 B8R1.8 BrCCN1C=NC=N1 BB57-2506 [0,0,0,0,1,0|3,0,0]=4 83 B8R1.8 CCCC1=CC=CS1 BB05-4767 [0,0,0,0,1,0|1,0,0]=2 84 B8R1.8 CCCC1=CNN=C1 BB12-3540 [0,0,0,0,1,0|2,0,0]=3 85 B8R1.8 CCCN1C=CN=C1 BB12-1504 [0,0,0,0,1,0|2,0,0]=3 86 B8R1.8 CNCC1=CC=NN1 BB05-3097 [0,0,0,0,1,0|2,0,1]=4 87 B8R1.8 CNCC1=CC=NN1 BB57-2508 [0,0,0,0,1,0|2,0,1]=4 88 B8R1.8 CNCC1=CN=CS1 BB58-0523 [0,0,0,0,1,0|3,0,0]=4 89 B8R1.8 CNCC1=NC=CN1 BB55-8370 [0,0,0,0,1,0|2,0,0]=3 90 B8R1.8 CNCC1=NC=CS1 BB55-8215 [0,0,0,0,1,0|2,0,0]=3 91 B8R1.8 COCC1=NC=CN1 BB58-3125 [0,0,0,0,1,0|2,0,0]=3 92 B8R1.8 COCC1=NC=NN1 BB58-1064 [0,0,0,0,1,0|3,0,0]=4 93 B8R1.8 N#CCC1=CSC=C1 BB20-4629 [0,0,0,0,1,0|2,0,1]=4 94 B8R1.8 N#CCN1C=CC=N1 BB57-0111 [0,0,0,0,1,0|2,0,1]=4 95 B8R1.8 NCCC1=CC=CO1 BB01-5388 [0,0,0,0,1,0|2,0,0]=3 96 B8R1.8 NCCC1=CNN=C1 BB05-4724 [0,0,0,0,1,0|3,0,0]=4 97 B8R1.8 NCCC1=CNN=C1 BB54-4003 [0,0,0,0,1,0|3,0,0]=4 98 B8R1.8 NCCC1=CSC=C1 BB55-8410 [0,0,0,0,1,0|2,0,0]=3 99 B8R1.8 NCCC1=CSC=N1 BB58-4849 [0,0,0,0,1,0|2,0,0]=3 100 B8R1.8 NCCC1=NC=CN1 BB12-2787 [0,0,0,0,1,0|2,0,0]=3 101 B8R1.8 NCCC1=NC=NN1 BB54-5250 [0,0,0,0,1,0|3,0,0]=4 102 B8R1.8 NCCC1=NNC=C1 BB57-2155 [0,0,0,0,1,0|2,0,0]=3 103 B8R1.8 NCCC1=NNN=C1 BB58-1334 [0,0,0,0,1,0|3,0,0]=4 104 B8R1.8 NCCN1C=CC=C1 BB57-3156 [0,0,0,0,1,0|2,0,0]=3 105 B8R1.8 NCCN1C=CN=C1 BB05-4770 [0,0,0,0,1,0|3,0,0]=4 106 B8R1.8 NCCN1C=CN=C1 BB56-2159 [0,0,0,0,1,0|3,0,0]=4 107 B8R1.8 NCCN1C=CN=C1 BB56-2917 [0,0,0,0,1,0|3,0,0]=4 108 B8R1.8 OCCC1=CNN=C1 BB05-0885 [0,0,0,0,1,0|3,0,0]=4 109 B8R1.8 OCCC1=CNN=C1 BB55-3042 [0,0,0,0,1,0|3,0,0]=4 110 B7R1.3 CC1=CC=NC=N1 BB17-0193 [2,0,0,0,0,0|1,0,0]=3 111 B9R1.1 CC1=CN=C(C=O)C=C1 BB12-2174 [1,1,0,0,0,0|1,0,1]=4 112 B9R1.1 CC1=CN=C(CCl)C=N1 BB58-1084 [1,1,0,0,0,0|2,0,0]=4 113 B9R1.1 CC1=CN=C(CO)C=N1 BB58-1085 [1,1,0,0,0,0|2,0,0]=4 114 B9R1.1 CNC1=CC=C(Cl)N=N1 BB55-4295 [1,1,0,0,0,0|2,0,0]=4 115 B9R1.1 N#CC1=CC=C(N)C=N1 BB01-7921 [1,1,0,0,0,0|1,0,1]=4 116 B9R1.1 NCC1=CC=C(N)C=C1 BB54-2061 [1,1,0,0,0,0|2,0,0]=4 117 B9R1.1 NCC1=CC=C(O)C=C1 BB12-1603 [1,1,0,0,0,0|2,0,0]=4 118 B9R1.1 NNC1=NC=C(Br)C=C1 BB57-2449 [1,1,0,0,0,0|2,0,0]=4 119 B9R1.1 NNC1=NC=C(F)C=C1 BB12-1190 [1,1,0,0,0,0|2,0,0]=4 120 B9R1.2 CC1=CC=CC(CN)=N1 BB58-1073 [1,1,0,0,0,0|1,0,0]=3 121 B9R1.2 CCC1=CC=NC(N)=N1 BB12-3720 [1,1,0,0,0,0|1,0,0]=3 122 B9R1.2 CCC1=CC=NC(O)=N1 BB12-3719 [1,1,0,0,0,0|1,0,0]=3 123 B9R1.2 CNC1=CC(C)=CC=C1 BB01-7304 [1,1,0,0,0,0|2,0,0]=4 124 B9R1.2 CNC1=CC(F)=CC=C1 BB01-7291 [1,1,0,0,0,0|2,0,0]=4 125 B9R1.2 COC1=NC(Cl)=NC=C1 BB10-0746 [1,1,0,0,0,0|2,0,0]=4 126 B9R1.2 COC1=NC=CC(N)=N1 BB20-3494 [1,1,0,0,0,0|2,0,0]=4 127 B9R1.2 CSC1=NC(C)=CC=N1 BB12-1624 [1,1,0,0,0,0|2,0,0]=4 128 B9R1.2 N#CC1=NC=CC(O)=C1 BB32-2603 [1,1,0,0,0,0|1,0,1]=4 129 B9R1.2 NC1=NC(CO)=CC=N1 BB12-1255 [1,1,0,0,0,0|2,0,0]=4 130 B9R1.2 NCC1=CC=CC(Cl)=C1 BB01-4636 [1,1,0,0,0,0|2,0,0]=4 131 B9R1.2 NCC1=CC=NC(N)=N1 BB12-1254 [1,1,0,0,0,0|2,0,0]=4 132 B9R1.2 NNC1=NC(Br)=CC=C1 BB55-7967 [1,1,0,0,0,0|2,0,0]=4 133 B9R1.2 OCC1=NC(O)=CC=C1 BB57-1045 [1,1,0,0,0,0|1,0,0]=3 134 B9R1.6 CC(N)C1=CC=NC=C1 BB05-0766 [1,1,0,0,0,0|2,0,0]=4 135 B9R1.6 NC(=S)C1=NC=CC=C1 BB54-4111 [1,1,0,0,0,0|1,0,1]=4 136 B9R1.15 CC1=C(CBr)N=CC=C1 BB05-1496 [1,1,0,0,0,0|1,0,0]=3 137 B9R1.15 CC1=NC=CN=C1CCl BB20-6880 [1,1,0,0,0,0|2,0,0]=4 138 B9R1.15 CNC1=C(C)C=CC=C1 BB01-7286 [1,1,0,0,0,0|2,0,0]=4 139 B9R1.15 CNC1=CC=CC=C1N BB12-2750 [1,1,0,0,0,0|2,0,0]=4 140 B9R1.15 CNC1=NC=CC=C1Cl BB12-1745 [1,1,0,0,0,0|1,0,0]=3 141 B9R1.15 CNC1=NC=CN=C1Cl BB12-1107 [1,1,0,0,0,0|2,0,0]=4 142 B9R1.15 CSC1=NC=CC=C1N BB58-0115 [1,1,0,0,0,0|1,0,0]=3 143 B9R1.7 CC1=CN(CCN)N=C1 BB05-4398 [0,1,0,0,1,0|2,0,0]=4 144 B9R1.7 CC1=CN(CCO)N=C1 BB05-2449 [0,1,0,0,1,0|2,0,0]=4 145 B9R1.7 CC1=NC(CCN)=CS1 BB20-1571 [0,1,0,0,1,0|2,0,0]=4 146 B9R1.7 CC1=NN(CCBr)C=C1 BB54-3615 [0,1,0,0,1,0|2,0,0]=4 147 B9R1.7 CC1=NN(CCN)C=C1 BB05-2434 [0,1,0,0,1,0|2,0,0]=4 148 B9R1.7 CC1=NN(CCO)C=C1 BB05-2450 [0,1,0,0,1,0|2,0,0]=4 149 B9R1.7 CCCC1=NC(Br)=CN1 BB12-3517 [0,1,0,0,1,0|1,0,0]=3 150 B9R1.7 CCCC1=NC(N)=NO1 BB12-3446 [0,1,0,0,1,0|2,0,0]=4 151 B9R1.7 CCCC1=NN=C(Br)S1 BB58-0828 [0,1,0,0,1,0|2,0,0]=4 152 B9R1.7 CCCC1=NN=C(Cl)S1 BB58-0825 [0,1,0,0,1,0|2,0,0]=4 153 B9R1.7 CCCC1=NN=C(O)O1 BB12-3090 [0,1,0,0,1,0|2,0,0]=4 154 B9R1.7 CCCN1C=C(N)C=N1 BB05-4006 [0,1,0,0,1,0|1,0,0]=3 155 B9R1.7 CCCN1C=C(N)C=N1 BB12-1645 [0,1,0,0,1,0|1,0,0]=3 156 B9R1.7 CCCN1C=CC(N)=N1 BB05-2156 [0,1,0,0,1,0|1,0,0]=3 157 B9R1.7 CCCN1C=CC(N)=N1 BB55-3923 [0,1,0,0,1,0|1,0,0]=3 158 B9R1.7 CN1C=CC(CCN)=N1 BB05-5003 [0,1,0,0,1,0|2,0,0]=4 159 B9R1.7 CNCC1=CC=C(Br)S1 BB31-7407 [0,1,0,0,1,0|2,0,0]=4 160 B9R1.7 CNCC1=NC(C)=CS1 BB55-8326 [0,1,0,0,1,0|2,0,0]=4 161 B9R1.7 CNCC1=NC=C(C)S1 BB55-8339 [0,1,0,0,1,0|2,0,0]=4 162 B9R1.7 CNCC1=NN(C)C=C1 BB05-1129 [0,1,0,0,1,0|2,0,0]=4 163 B9R1.7 COCC1=NNC(C)=C1 BB57-3755 [0,1,0,0,1,0|2,0,0]=4 164 B9R1.7 COCN1C=C(N)C=N1 BB05-1998 [0,1,0,0,1,0|2,0,0]=4 165 B9R1.7 NC1=CN(CCO)N=C1 BB05-4573 [0,1,0,0,1,0|2,0,0]=4 166 B9R1.7 NC1=NN(CCO)C=C1 BB05-4586 [0,1,0,0,1,0|2,0,0]=4 167 B9R1.7 NCCC1=CSC(N)=N1 BB57-2398 [0,1,0,0,1,0|2,0,0]=4 168 B9R1.7 NCCN1C=C(I)C=N1 BB54-5161 [0,1,0,0,1,0|2,0,0]=4 169 B9R1.7 OCCN1C=C(Br)C=N1 BB54-3612 [0,1,0,0,1,0|2,0,0]=4 170 B9R1.7 OCCN1C=C(Cl)C=N1 BB05-2451 [0,1,0,0,1,0|2,0,0]=4 171 B9R1.11 CC(CN)N1C=CC=N1 BB05-4111 [0,1,0,0,1,0|2,0,0]=4 172 B9R1.11 CC(CN)N1C=CC=N1 BB57-3091 [0,1,0,0,1,0|2,0,0]=4 173 B9R1.11 CCC(=O)C1=NC=CS1 BB55-8398 [0,1,0,0,1,0|1,0,1]=4 174 B9R1.11 CCC(N)C1=NC=CS1 BB55-8407 [0,1,0,0,1,0|1,0,0]=3 175 B9R1.12 BrCCCN1C=CC=N1 BB12-3122 [0,1,0,0,1,0|1,0,0]=3 176 B9R1.12 BrCCCN1C=CN=C1 BB57-3667 [0,1,0,0,1,0|2,0,0]=4 177 B9R1.12 CCCCN1C=CN=C1 BB12-1487 [0,1,0,0,1,0|2,0,0]=4 178 B9R1.12 CCNCC1=CC=CO1 BB01-4781 [0,1,0,0,1,0|1,0,0]=3 179 B9R1.12 CCNCC1=CSC=N1 BB12-3138 [0,1,0,0,1,0|1,0,0]=3 180 B9R1.12 CCNCC1=NC=CN1 BB55-8371 [0,1,0,0,1,0|1,0,0]=3 181 B9R1.12 CCNCC1=NC=CS1 BB55-8358 [0,1,0,0,1,0|1,0,0]=3 182 B9R1.12 CNCCC1=CC=CS1 BB55-8320 [0,1,0,0,1,0|1,0,0]=3 183 B9R1.12 CNCCC1=CNN=C1 BB01-4435 [0,1,0,0,1,0|2,0,0]=4 184 B9R1.12 ClCCCC1=CNN=C1 BB58-3085 [0,1,0,0,1,0|2,0,0]=4 185 B9R1.12 NCCCC1=CC=CO1 BB01-5828 [0,1,0,0,1,0|1,0,0]=3 186 B9R1.12 NCCCC1=CNN=C1 BB05-4888 [0,1,0,0,1,0|2,0,0]=4 187 B9R1.12 NCCCC1=CNN=C1 BB55-6199 [0,1,0,0,1,0|2,0,0]=4 188 B9R1.12 NCCCC1=NC=CN1 BB57-3660 [0,1,0,0,1,0|1,0,0]=3 189 B9R1.12 NCCCN1C=CC=N1 BB56-2920 [0,1,0,0,1,0|1,0,0]=3 190 B9R1.12 NCCCN1C=CN=C1 BB05-2317 [0,1,0,0,1,0|2,0,0]=4 191 B9R1.12 NCCCN1C=NC=N1 BB12-1299 [0,1,0,0,1,0|2,0,0]=4 192 B9R1.12 OCCCC1=CNN=C1 BB05-4880 [0,1,0,0,1,0|2,0,0]=4 193 B9R1.12 OCCCC1=CNN=C1 BB57-2164 [0,1,0,0,1,0|2,0,0]=4 194 B9R1.13 CC(=O)CC1=CC=CS1 BB12-3710 [0,1,0,0,1,0|1,0,1]=4 195 B9R1.13 CC(=O)CN1C=CC=N1 BB54-2703 [0,1,0,0,1,0|1,0,1]=4 196 B9R1.13 CC(C)CC1=NC=CN1 BB12-2831 [0,1,0,0,1,0|1,0,0]=3 197 B9R1.13 CC(N)CC1=CC=CO1 BB01-4437 [0,1,0,0,1,0|1,0,0]=3 198 B9R1.13 CC(N)CC1=CC=CO1 BB05-3274 [0,1,0,0,1,0|1,0,0]=3 199 B9R1.13 CC(N)CN1C=CC=N1 BB57-3060 [0,1,0,0,1,0|1,0,0]=3 200 B9R1.13 CC(N)CN1C=CN=C1 BB54-1957 [0,1,0,0,1,0|2,0,0]=4 201 B9R1.13 CC(N)CN1C=NC=N1 BB54-3086 [0,1,0,0,1,0|2,0,0]=4 202 B9R1.13 CN(C)CC1=CC=CN1 BB12-1785 [0,1,0,0,1,0|1,0,1]=4 203 B9R1.33 CC1=C(CCN)N=CN1 BB58-3453 [0,1,0,0,1,0|2,0,0]=4 204 B9R1.33 CC1=CC=NN1CCN BB05-2435 [0,1,0,0,1,0|2,0,0]=4 205 B9R1.33 CCCN1N=CC=C1Br BB58-1975 [0,1,0,0,1,0|1,0,0]=3 206 B9R1.33 CCCN1N=CC=C1C BB58-2011 [0,1,0,0,1,0|1,0,0]=3 207 B9R1.33 CN1C=CC=C1CCO BB90-0117 [0,1,0,0,1,0|1,0,1]=4 208 B9R1.33 CN1C=CN=C1CCN BB57-1489 [0,1,0,0,1,0|2,0,0]=4 209 B9R1.33 CNCC1=CC=CN1C BB55-8233 [0,1,0,0,1,0|1,0,1]=4 210 B11R1.1 BrCCOC1=CC=C(Br)C=C1 BB17-1661 [0,2,0,0,0,0|2,0,0]=4 211 B11R1.1 CC1=CC=C(CCCN)C=C1 BB58-0569 [0,2,0,0,0,0|1,0,0]=3 212 B11R1.1 CC1=CC=C(CCCO)C=C1 BB32-2521 [0,2,0,0,0,0|1,0,0]=3 213 B11R1.1 CC1=CC=C(NCCO)C=C1 BB17-0653 [0,2,0,0,0,0|2,0,0]=4 214 B11R1.1 CC1=CC=C(OCCN)C=C1 BB54-2444 [0,2,0,0,0,0|2,0,0]=4 215 B11R1.1 CC1=CC=C(SCCN)C=C1 BB53-1425 [0,2,0,0,0,0|2,0,0]=4 216 B11R1.1 ClC1=CC=C(OCCBr)C=C1 BB17-1649 [0,2,0,0,0,0|2,0,0]=4 217 B11R1.1 NC1=CC=C(OCCO)C=C1 BB58-1793 [0,2,0,0,0,0|2,0,0]=4 218 B11R1.1 NCCCC1=CC=C(Cl)C=C1 BB54-2040 [0,2,0,0,0,0|1,0,0]=3 219 B11R1.1 NCCCC1=CC=C(F)C=C1 BB58-0570 [0,2,0,0,0,0|1,0,0]=3 220 B11R1.1 NCCOC1=CC=C(Cl)C=C1 BB57-6657 [0,2,0,0,0,0|2,0,0]=4 221 B11R1.1 NCCOC1=CC=C(F)C=C1 BB54-2456 [0,2,0,0,0,0|2,0,0]=4 222 B11R1.1 NCCOC1=CC=C(N)C=C1 BB53-1635 [0,2,0,0,0,0|2,0,0]=4 223 B11R1.1 NCCSC1=CC=C(Cl)C=C1 BB56-2705 [0,2,0,0,0,0|2,0,0]=4 224 B11R1.1 OCCNC1=CC=C(Cl)C=C1 BB17-0633 [0,2,0,0,0,0|2,0,0]=4 225 B11R1.20 CN(C)CC1=CC=C(Br)C=C1 BB58-0485 [0,2,0,0,0,0|2,0,0]=4 226 B11R1.22 CC1=CC=C(C(N)CO)C=C1 BB56-2094 [0,2,0,0,0,0|2,0,0]=4 227 B11R1.22 CC1=CC=C([C@H](N)CO)C=C1 BB32-1985 [0,2,0,0,0,0|2,0,0]=4 228 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 BB17-2353 [0,2,0,0,0,0|1,0,1]=4 229 B11R1.22 CCC(N)C1=CC=C(Cl)C=C1 BB55-1641 [0,2,0,0,0,0|1,0,0]=3 230 B11R1.22 CCN(C)C1=CC=C(N)C=C1 BB32-1137 [0,2,0,0,0,0|2,0,0]=4 231 B11R1.22 CNC(C)C1=CC=C(F)C=C1 BB12-1331 [0,2,0,0,0,0|2,0,0]=4 232 B11R1.22 COC(=O)C1=CC=C(O)C=N1 BB56-2624 [0,2,0,0,0,0|1,0,1]=4 233 B11R1.22 COC(=O)C1=NC=C(N)C=C1 BB31-1465 [0,2,0,0,0,0|1,0,1]=4 234 B11R1.22 NC(CO)C1=CC=C(Br)C=C1 BB56-2167 [0,2,0,0,0,0|2,0,0]=4 235 B11R1.22 NC(CO)C1=CC=C(Cl)C=C1 BB56-2226 [0,2,0,0,0,0|2,0,0]=4 236 B11R1.22 NC(CO)C1=CC=C(F)C=C1 BB12-1444 [0,2,0,0,0,0|2,0,0]=4 237 B11R1.22 NCC(O)C1=CC=C(O)C=C1 BB57-6723 [0,2,0,0,0,0|2,0,0]=4 238 B11R1.81 CCNC1=CC=C(F)C=C1Cl BB01-7294 [0,2,0,0,0,0|2,0,0]=4 239 B11R1.81 CCOC1=C(N)C=C(C)C=C1 BB17-1893 [0,2,0,0,0,0|2,0,0]=4 240 B11R1.81 CCOC1=C(N)C=C(Cl)C=C1 BB17-1894 [0,2,0,0,0,0|2,0,0]=4 241 B11R1.81 CCOC1=CC=C(F)C=C1N BB05-4827 [0,2,0,0,0,0|2,0,0]=4 242 B11R1.81 CCSC1=C(N)C=C(Cl)C=C1 BB54-1777 [0,2,0,0,0,0|2,0,0]=4 243 B11R1.83 CCNC1=CC=C(CC)C=C1 BB01-8199 [0,2,0,0,0,0|2,0,0]=4 244 B11R1.83 CNCC1=CC=C(CN)C=C1 BB32-1980 [0,2,0,0,0,0|2,0,0]=4 245 B11R1.83 [C-]#[N+]C1=CC=C(OCC)C=C1 BB56-1768 [0,2,0,0,0,0|2,0,0]=4 246 B11R1.192 CCNC1=CC(C)=C(C)C=C1 BB01-5258 [0,2,0,0,0,0|2,0,0]=4 247 B11R1.192 CCOC1=CC(N)=C(N)C=C1 BB58-0445 [0,2,0,0,0,0|2,0,0]=4 248 B11R1.192 CCOC1=CC=C(N)C(F)=C1 BB57-4850 [0,2,0,0,0,0|2,0,0]=4 249 B11R1.13 CCOC1=CC=CC(F)=C1Br BB31-2088 [0,2,0,0,0,0|2,0,0]=4 250 B11R1.17 CC1=C(OCCN)C=CC=C1 BB54-2356 [0,2,0,0,0,0|2,0,0]=4 251 B11R1.17 ClC1=C(OCCBr)C=CC=C1 BB17-1653 [0,2,0,0,0,0|2,0,0]=4 252 B11R1.17 NC1=CC=CC=C1OCCO BB05-3292 [0,2,0,0,0,0|2,0,0]=4 253 B11R1.17 NCCCC1=C(Cl)C=CC=C1 BB58-0571 [0,2,0,0,0,0|1,0,0]=3 254 B11R1.17 NCCCN1C=CC=CC1=O BB57-6517 [0,2,0,0,0,0|2,0,0]=4 255 B11R1.17 NCCOC1=C(F)C=CC=C1 BB55-4836 [0,2,0,0,0,0|2,0,0]=4 256 B11R1.17 NCCOC1=CC=CC=C1Cl BB55-4833 [0,2,0,0,0,0|2,0,0]=4 257 B11R1.41 CCNC1=NC=CC=C1CN BB58-5359 [0,2,0,0,0,0|1,0,0]=3 258 B11R1.41 CCOC1=C(NC)C=CC=C1 BB01-7289 [0,2,0,0,0,0|2,0,0]=4 259 B11R1.41 CCOC1=CC=CC=C1NN BB01-6125 [0,2,0,0,0,0|2,0,0]=4 260 B11R1.41 CCOC1=CC=CC=C1NN BB56-0057 [0,2,0,0,0,0|2,0,0]=4 261 B11R1.86 CC(C)NC1=C(N)C=CC=C1 BB32-3847 [0,2,0,0,0,0|2,0,0]=4 262 B11R1.86 CC(C)OC1=CC=CC=C1N BB57-2916 [0,2,0,0,0,0|2,0,0]=4 263 B11R1.86 CC1=CC=CN=C1CC(C)O BB55-7546 [0,2,0,0,0,0|0,0,0]=2 264 B11R1.86 CN(C)CC1=C(Br)C=CC=C1 BB58-0486 [0,2,0,0,0,0|2,0,0]=4 265 B11R1.182 CCNC1=C(F)C=NC(Cl)=N1 BB12-1228 [0,2,0,0,0,0|2,0,0]=4 266 B11R1.182 CCNC1=C(O)C=CC(C)=C1 BB57-5463 [0,2,0,0,0,0|2,0,0]=4 267 B11R1.182 CCNC1=CC(C)=CC=C1C BB01-7293 [0,2,0,0,0,0|2,0,0]=4 268 B11R1.222 CCC(N)C1=CC=CC=C1C BB58-0612 [0,2,0,0,0,0|1,0,0]=3 269 B11R1.222 COC(=O)C1=NC=CC=C1O BB17-0205 [0,2,0,0,0,0|1,0,1]=4 270 B11R1.222 NC(CO)C1=CC=CC=C1F BB56-2224 [0,2,0,0,0,0|2,0,0]=4 271 B11R1.222 NCC(O)C1=C(F)C=CC=C1 BB31-5644 [0,2,0,0,0,0|2,0,0]=4 272 B11R1.605 CC1=CC=CC(C)=C1CCN BB58-3404 [0,2,0,0,0,0|2,0,0]=4 273 B11R1.605 CCNC1=C(C)C=CC=C1C BB01-8195 [0,2,0,0,0,0|2,0,0]=4 274 B11R1.605 FC1=CC=CC(F)=C1CCBr BB31-1480 [0,2,0,0,0,0|2,0,0]=4 275 B11R1.605 NC1=C(CCO)C(Cl)=CC=C1 BB55-4852 [0,2,0,0,0,0|2,0,0]=4 276 B11R1.23 CCC(N)C1=CC(Cl)=CC=C1 BB55-1640 [0,2,0,0,0,0|1,0,0]=3 277 B11R1.23 CNC(=O)C1=NC(Cl)=CC=C1 BB57-3764 [0,2,0,0,0,0|1,0,1]=4 278 B11R1.23 COC(=O)C1=NC=CC(O)=C1 BB32-2632 [0,2,0,0,0,0|1,0,1]=4 279 B11R1.23 NCC(O)C1=CC=CC(Br)=C1 BB32-1599 [0,2,0,0,0,0|2,0,0]=4 280 B11R1.24 CC1=CC=CC(CCCN)=C1 BB58-0568 [0,2,0,0,0,0|1,0,0]=3 281 B11R1.24 CC1=CC=CC(CCCO)=C1 BB31-8239 [0,2,0,0,0,0|1,0,0]=3 282 B11R1.24 CC1=CC=CC(OCCBr)=C1 BB17-1659 [0,2,0,0,0,0|2,0,0]=4 283 B11R1.24 CC1=CC=CC(OCCN)=C1 BB54-2355 [0,2,0,0,0,0|2,0,0]=4 284 B11R1.24 CCCOC1=CC=NC(S)=N1 BB53-1607 [0,2,0,0,0,0|1,0,0]=3 285 B11R1.24 CCNCC1=NC(C)=NC=C1 BB55-8309 [0,2,0,0,0,0|1,0,0]=3 286 B11R1.24 ClC1=CC=CC(CCCBr)=C1 BB31-7544 [0,2,0,0,0,0|1,0,0]=3 287 B11R1.24 N#CCCC1=CC=CC(Br)=C1 BB32-1657 [0,2,0,0,0,0|1,0,1]=4 288 B11R1.24 NC1=CC=CC(C\C=N\O)=N1 BB55-5137 [0,2,0,0,0,0|1,0,1]=4 289 B11R1.24 NCCOC1=CC(Br)=CC=C1 BB58-0114 [0,2,0,0,0,0|2,0,0]=4 290 B11R1.24 NCCOC1=CC(Cl)=CC=C1 BB55-4884 [0,2,0,0,0,0|2,0,0]=4 291 B11R1.24 NCCOC1=CC(F)=CC=C1 BB58-0106 [0,2,0,0,0,0|2,0,0]=4 292 B11R1.34 CCCC1=CC(=O)NC(=S)N1 BB77-0020 [0,2,0,0,0,0|1,0,1]=4 293 B11R1.34 CCCC1=NC(C)=CC(O)=N1 BB10-0632 [0,2,0,0,0,0|1,0,0]=3 294 B11R1.34 CCNC1=CC(Cl)=NC(N)=N1 BB57-4201 [0,2,0,0,0,0|2,0,0]=4 295 B11R1.34 COCC1=CC(O)=NC(N)=N1 BB10-0638 [0,2,0,0,0,0|2,0,0]=4 296 B11R1.34 COCC1=NC(N)=NC(C)=C1 BB52-7107 [0,2,0,0,0,0|2,0,0]=4 297 B11R1.157 CC1=CC(CC(C)O)=NC=C1 BB55-7545 [0,2,0,0,0,0|0,0,0]=2 298 B11R1.157 CC1=CC=CC(CC(C)O)=N1 BB55-6191 [0,2,0,0,0,0|0,0,0]=2 299 B11R1.157 CN(C)CC1=CC(S)=CC=C1 BB55-8423 [0,2,0,0,0,0|2,0,0]=4 300 B11R1.189 CCCC1=NC=CC(C#N)=C1 BB57-4915 [0,2,0,0,0,0|0,0,0]=2 301 B11R1.189 CCNC1=CC=CC(OC)=C1 BB32-1922 [0,2,0,0,0,0|2,0,0]=4 302 B11R1.189 COC1=CC=CC(CCN)=C1 BB12-0768 [0,2,0,0,0,0|2,0,0]=4 303 B11R1.7 C#CC(C)(O)C1=NC=CC=C1 BB54-3046 [0,2,0,0,0,0|0,0,2]=4 304 B11R1.7 CC(C)(CN)C1=CC=CC=C1 BB32-0942 [0,2,0,0,0,0|2,0,0]=4 305 B11R1.16 CN(CCN)C1=CC=CC=C1 BB56-2834 [0,2,0,0,0,0|2,0,0]=4 306 B11R1.16 CNCC(O)C1=CC=CC=C1 BB12-2195 [0,2,0,0,0,0|1,0,0]=3 307 B11R1.16 OC(CCCl)C1=CC=CC=C1 BB12-1401 [0,2,0,0,0,0|1,0,0]=3 308 B11R1.36 CC(C)C(N)C1=CC=CC=C1 BB58-0614 [0,2,0,0,0,0|1,0,0]=3 309 B11R1.28 C=CCCNC1=CC=CC=C1 BB58-4953 [0,2,0,0,0,0|1,0,1]=4 310 B11R1.28 C=CCNCC1=CC=CC=C1 BB20-4594 [0,2,0,0,0,0|1,0,1]=4 311 B11R1.28 N#CCCCC1=NC=CC=C1 BB54-3757 [0,2,0,0,0,0|0,0,0]=2 312 B11R1.28 NCCCCC1=NC=CC=C1 BB54-4080 [0,2,0,0,0,0|0,0,0]=2 313 B11R1.28 NCCOCC1=CC=CC=C1 BB55-4803 [0,2,0,0,0,0|1,0,0]=3 314 B11R1.28 NCCSCC1=CC=CC=C1 BB53-1385 [0,2,0,0,0,0|1,0,0]=3 315 B11R1.28 OCCNCC1=CC=CC=C1 BB17-0809 [0,2,0,0,0,0|1,0,0]=3 316 B11R1.28 S=C=NCCC1=CC=CC=C1 BB54-2698 [0,2,0,0,0,0|1,0,1]=4 317 B11R1.40 CCC(N)CC1=CC=CC=C1 BB17-0798 [0,2,0,0,0,0|1,0,0]=3 318 B11R1.40 CNC(C)CC1=NC=CN=C1 BB55-6192 [0,2,0,0,0,0|1,0,0]=3 319 B11R1.40 NC(CO)CC1=CC=CC=C1 BB01-6619 [0,2,0,0,0,0|1,0,0]=3 320 B11R1.40 NNC(=O)CC1=NC=CC=C1 BB12-2162 [0,2,0,0,0,0|1,0,1]=4 321 B11R1.91 CC(N)COC1=CC=CC=C1 BB58-0599 [0,2,0,0,0,0|1,0,0]=3 322 B11R1.91 CC(N)\C=C\C1=CC=CC=C1 BB12-1707 [0,2,0,0,0,0|1,0,1]=4 323 B11R1.91 N=C(N)CCC1=CC=CC=C1 BB57-1742 [0,2,0,0,0,0|1,0,1]=4 324 B11R1.91 NC(=S)CCC1=NC=CC=C1 BB54-4361 [0,2,0,0,0,0|0,0,1]=3 325 B11R1.91 O=C(Cl)CSC1=NC=CC=C1 BB12-3011 [0,2,0,0,0,0|1,0,1]=4 326 B11R1.91 O=C(O)CCC1=NC=CN=C1 BB58-4745 [0,2,0,0,0,0|1,0,1]=4 327 B11R1.91 O=C(O)CSC1=NC=CC=C1 BB05-0492 [0,2,0,0,0,0|1,0,1]=4 328 B9R2.2 C1=NC(C2CC2)=NN1 BB12-3428 [0,0,0,1,1,0|2,0,0]=4 329 B9R2.2 C1=NNC(C2CC2)=C1 BB57-2116 [0,0,0,1,1,0|1,0,1]=4 330 B9R2.3 C1=C2CCCC2=NN1 BB12-4185 [0,0,0,1,1,0|1,0,0]=3 331 B9R2.3 C1=CN2CCC[N+]2=C1 BB57-2249 [0,0,0,1,1,0|1,0,1]=4 332 B9R2.3 C1=NC2=C(CCC2)N1 BB58-0897 [0,0,0,1,1,0|1,0,0]=3 333 B9R2.3 C1=NNC2=C1CCC2 BB54-4738 [0,0,0,1,1,0|1,0,1]=4 334 B11R2.34 NC1=CC=C(C2CC2)C=C1 BB31-8016 [0,1,0,1,0,0|1,0,0]=3 335 B11R2.36 BrC1=CC2=C(C=C1)CCO2 BB31-4067 [0,1,0,1,0,0|2,0,0]=4 336 B11R2.36 NC1=CC=C2CCNC2=C1 BB55-7558 [0,1,0,1,0,0|2,0,0]=4 337 B11R2.36 NC1=CC=C2COCC2=C1 BB01-4521 [0,1,0,1,0,0|2,0,0]=4 338 B11R2.36 O=C1C=C2CCCC2=NN1 BB58-1619 [0,1,0,1,0,0|1,0,0]=3 339 B11R2.10 CC1=NC2=CC=CN=C2N1 BB12-2830 [0,1,0,1,0,0|1,0,1]=4 340 B11R2.20 C1=CC2=C(C=N1)CNCC2 BB32-2671 [0,1,0,1,0,0|2,0,0]=4 341 B11R2.55 ClC1=C(C2CO2)C=CC=C1 BB32-3052 [0,1,0,1,0,0|2,0,0]=4 342 B11R2.106 ClC1=NC=NC2=C1CCC2 BB57-1749 [0,1,0,1,0,0|1,0,0]=3 343 B11R2.106 O=C1N=CC=C2CCCN12 BB57-4140 [0,1,0,1,0,0|1,0,1]=4 344 B11R2.35 BrC1=CC(C2CO2)=CC=C1 BB31-1898 [0,1,0,1,0,0|2,0,0]=4 345 B11R2.35 FC1=CC(C2CO2)=CC=C1 BB32-0819 [0,1,0,1,0,0|2,0,0]=4 346 B11R2.35 NC1=NC(C2CC2)=NC=C1 BB32-1132 [0,1,0,1,0,0|1,0,0]=3 347 B11R2.238 C1=CC=C(NC2CC2)C=C1 BB32-1778 [0,1,0,1,0,0|1,0,0]=3 348 B7R1.1 CCC1=CNN=C1 BB12-3535 [1,0,0,0,1,0|2,0,0]=4 349 B7R1.1 CCC1=NNC=C1 BB12-3522 [1,0,0,0,1,0|1,0,0]=3 350 B7R1.1 CCC1=NNC=N1 BB12-3398 [1,0,0,0,1,0|2,0,0]=4 351 B7R1.1 ClCC1=NC=CS1 BB55-8274 [1,0,0,0,1,0|2,0,0]=4 352 B7R1.1 ClCC1=NOC=C1 BB54-1831 [1,0,0,0,1,0|2,0,0]=4 353 B7R1.1 NCC1=CSC=C1 BB55-8318 [1,0,0,0,1,0|2,0,0]=4 354 B7R1.1 NCC1=CSC=N1 BB57-0139 [1,0,0,0,1,0|2,0,0]=4 355 B7R1.1 NCC1=NC=CN1 BB12-2726 [1,0,0,0,1,0|2,0,0]=4 356 B7R1.1 NCC1=NC=CS1 BB55-3479 [1,0,0,0,1,0|2,0,0]=4 357 B7R1.1 NCC1=NNC=C1 BB05-1327 [1,0,0,0,1,0|2,0,0]=4 358 B7R1.1 OCC1=COC=C1 BB12-2281 [1,0,0,0,1,0|2,0,0]=4 359 B7R1.1 OCC1=NNC=C1 BB05-4918 [1,0,0,0,1,0|2,0,0]=4