0 B12R2.18 BrC1=C(Br)C2=C(C=CC=C2)S1 HR153185 [0,0,0,0,0,0|2,1,0]=3 1 B12R2.18 CC1=C(Br)C2=C(C=CC=C2)S1 HR147338 [0,0,0,0,0,0|1,1,0]=2 2 B12R2.18 CC1=C(Br)N2C=CC=CC2=N1 HR110399 [0,0,0,0,0,0|3,0,0]=3 3 B12R2.18 CC1=C(C)C2=C(C=CC=C2)O1 HR100052 [0,0,0,0,0,0|0,0,0]=0 4 B12R2.18 CC1=C(C)C2=CC=CC=C2N1 HR129420 [0,0,0,0,0,0|1,0,0]=1 5 B12R2.18 CC1=C(C)C2=CC=CN=C2N1 HR150112 [0,0,0,0,0,0|2,0,0]=2 6 B12R2.18 CC1=C(Cl)C2=CC=CN=C2N1 HR150092 [0,0,0,0,0,0|3,0,0]=3 7 B12R2.18 CC1=C(N)N2C=CC=CC2=N1 HR103483 [0,0,0,0,0,0|3,0,0]=3 8 B12R2.18 CC1=CC2=CC=CC=C2N1C HR129172 [0,0,0,0,0,0|2,0,0]=2 9 B12R2.18 CC1=NC2=C(C=CC=C2)N1C HR156442 [0,0,0,0,0,0|2,0,0]=2 10 B12R2.18 CC1C(=O)NC2=CC=CC=C21 HR111811 [0,0,0,0,0,0|2,0,1]=3 11 B12R2.18 CC1CC2=CC=CC=C2C1=O HR122000 [0,0,0,0,0,0|2,0,1]=3 12 B12R2.18 CC1CC2=CC=CC=C2N1N HR143837 [0,0,0,0,0,0|3,0,1]=4 13 B12R2.18 CC1Cc2ccccc2N1N HR131491 [0,0,0,0,0,0|3,0,1]=4 14 B12R2.18 CN1C(=O)CC2=CC=CC=C21 HR144814 [0,0,0,0,0,0|3,0,0]=3 15 B12R2.18 CN1C(Cl)=NC2=C1C=CC=C2 HR114736 [0,0,0,0,0,0|3,0,0]=3 16 B12R2.18 CN1NC2=CC=CC=C2C1=O HR31920 [0,0,0,0,0,0|3,0,0]=3 17 B12R2.18 ClC1=C(Cl)C2=CC=CC=C2N1 HR122052 [0,0,0,0,0,0|3,0,0]=3 18 B12R2.18 O=C1C2=CC=CC=C2CC1Br HR138045 [0,0,0,0,0,0|3,0,1]=4 19 B12R2.18 O=C1NC2=CC=CC=C2C1=O HR126240 [0,0,0,0,0,0|3,0,0]=3 20 B12R2.18 O=C1NC2=NC=CC=C2C1=O HR106691 [0,0,0,0,0,0|4,0,0]=4 21 B12R2.18 OC1=NN2C=CC=CC2=C1Br HR115573 [0,0,0,0,0,0|4,0,0]=4 22 B11R2.1 BrC1=C2C=CC=CN2N=C1 HR146815 [1,0,0,0,0,0|3,0,0]=4 23 B11R2.1 BrC1=CN=C2C=CC=CN12 HR32319 [1,0,0,0,0,0|3,0,0]=4 24 B11R2.1 BrC1=CNC2=C1C=NC=C2 HR104788 [1,0,0,0,0,0|3,0,0]=4 25 B11R2.1 BrC1=CNC2=CC=CN=C12 HR105104 [1,0,0,0,0,0|3,0,0]=4 26 B11R2.1 BrC1=CNC2=CN=CC=C12 HR104400 [1,0,0,0,0,0|3,0,0]=4 27 B11R2.1 BrC1=CNC2=NC=CC=C12 HR135776 [1,0,0,0,0,0|3,0,0]=4 28 B11R2.1 BrC1=COC2=C1C=CC=C2 HR30485 [1,0,0,0,0,0|1,0,0]=2 29 B11R2.1 BrC1=CSC2=C1C=CC=C2 HR128386 [1,0,0,0,0,0|1,1,0]=3 30 B11R2.1 BrC1=CSC2=C1C=NC=C2 HR118769 [1,0,0,0,0,0|2,1,0]=4 31 B11R2.1 BrC1=CSC2=CN=CC=C12 HR118429 [1,0,0,0,0,0|2,1,0]=4 32 B11R2.1 BrC1=NNC2=CC=CC=C21 HR31827 [1,0,0,0,0,0|3,0,0]=4 33 B11R2.1 CC1=CNC2=C1C=NC=C2 HR34019 [1,0,0,0,0,0|2,0,0]=3 34 B11R2.1 CC1=CNC2=CC=CC=C12 HR135810 [1,0,0,0,0,0|1,0,0]=2 35 B11R2.1 CC1=CNC2=NC=CC=C12 HR112651 [1,0,0,0,0,0|2,0,0]=3 36 B11R2.1 CC1=COC2=C1C=CC=C2 HR102411 [1,0,0,0,0,0|0,0,0]=1 37 B11R2.1 CC1=COC2=NC=CC=C12 HR120579 [1,0,0,0,0,0|1,0,0]=2 38 B11R2.1 CC1=CSC2=C1C=CC=C2 HR105620 [1,0,0,0,0,0|0,1,0]=2 39 B11R2.1 CC1=NNC2=C1C=NC=C2 HR30830 [1,0,0,0,0,0|3,0,0]=4 40 B11R2.1 CC1=NNC2=CC=CC=C21 HR30505 [1,0,0,0,0,0|2,0,0]=3 41 B11R2.1 CC1=NNC2=CC=CN=C21 HR32007 [1,0,0,0,0,0|3,0,0]=4 42 B11R2.1 CC1=NNC2=CN=CC=C21 HR32011 [1,0,0,0,0,0|3,0,0]=4 43 B11R2.1 CC1=NNC2=NC=CC=C12 HR30809 [1,0,0,0,0,0|3,0,0]=4 44 B11R2.1 CN1C=CC2=CC=CC=C21 HR136081 [1,0,0,0,0,0|2,0,0]=3 45 B11R2.1 CN1C=CC2=CC=CN=C21 HR147170 [1,0,0,0,0,0|3,0,0]=4 46 B11R2.1 CN1C=NC2=C1C=CC=C2 HR142304 [1,0,0,0,0,0|2,0,0]=3 47 B11R2.1 CN1C=NC2=NC=CC=C21 HR148545 [1,0,0,0,0,0|3,0,0]=4 48 B11R2.1 CN1N=CC2=CC=CC=C21 HR142400 [1,0,0,0,0,0|3,0,0]=4 49 B11R2.1 CN1N=NC2=C1C=CC=C2 HR143832 [1,0,0,0,0,0|3,0,0]=4 50 B11R2.1 ClC1=C2C=CC=CC2=NN1 HR114315 [1,0,0,0,0,0|3,0,0]=4 51 B11R2.1 ClC1=CNC2=C1C=NC=C2 HR121443 [1,0,0,0,0,0|3,0,0]=4 52 B11R2.1 ClC1=CNC2=CC=CC=C12 HR116332 [1,0,0,0,0,0|2,0,0]=3 53 B11R2.1 ClC1=CNC2=NC=CC=C12 HR106889 [1,0,0,0,0,0|3,0,0]=4 54 B11R2.1 ClC1=NOC2=C1C=CC=C2 HR31888 [1,0,0,0,0,0|2,0,0]=3 55 B11R2.1 ClC1=NSC2=C1C=CC=C2 HR124694 [1,0,0,0,0,0|2,1,0]=4 56 B11R2.1 FC1=C2C=CC=CC2=NN1 HR113997 [1,0,0,0,0,0|3,0,0]=4 57 B11R2.1 IC1=CN=C2C=CC=CN12 HR107558 [1,0,0,0,0,0|3,0,0]=4 58 B11R2.1 IC1=CNC2=C1C=NC=C2 HR143283 [1,0,0,0,0,0|3,0,0]=4 59 B11R2.1 IC1=CNC2=CC=CC=C12 HR117539 [1,0,0,0,0,0|2,0,0]=3 60 B11R2.1 IC1=CNC2=CC=CN=C12 HR110389 [1,0,0,0,0,0|3,0,0]=4 61 B11R2.1 IC1=CNC2=NC=CC=C12 HR136045 [1,0,0,0,0,0|3,0,0]=4 62 B11R2.1 IC1=NNC2=CC=CC=C21 HR113363 [1,0,0,0,0,0|3,0,0]=4 63 B11R2.1 NC1=C2C=CC=CN2N=C1 HR116569 [1,0,0,0,0,0|3,0,0]=4 64 B11R2.1 NC1=CN=C2C=CC=CN12 HR111353 [1,0,0,0,0,0|3,0,0]=4 65 B11R2.1 NC1=CNC2=NC=CC=C12 HR150074 [1,0,0,0,0,0|3,0,0]=4 66 B11R2.1 NC1=CSC2=C1C=CC=C2 HR148471 [1,0,0,0,0,0|1,1,0]=3 67 B11R2.1 NC1=CSC2=CC=CN=C12 HR117173 [1,0,0,0,0,0|2,1,0]=4 68 B11R2.1 NC1=CSC2=NC=CC=C12 HR117801 [1,0,0,0,0,0|2,1,0]=4 69 B11R2.1 NC1=NNC2=CC=CC=C21 HR132317 [1,0,0,0,0,0|3,0,0]=4 70 B11R2.1 NC1=NNC2=CC=CC=C21 HR30306 [1,0,0,0,0,0|3,0,0]=4 71 B11R2.1 NC1=NOC2=C1C=CC=C2 HR103109 [1,0,0,0,0,0|2,0,0]=3 72 B11R2.1 NC1=NOC2=CC=CN=C21 HR148158 [1,0,0,0,0,0|3,0,0]=4 73 B11R2.1 NC1=NSC2=C1C=CC=C2 HR129891 [1,0,0,0,0,0|2,1,0]=4 74 B11R2.1 NN1C=CC2=CC=CC=C21 HR125653 [1,0,0,0,0,0|3,0,0]=4 75 B11R2.1 NN1C=NC2=C1C=CC=C2 HR108834 [1,0,0,0,0,0|3,0,0]=4 76 B11R2.1 O=C1CCC2=CC=CC=C12 HR123123 [1,0,0,0,0,0|2,0,1]=4 77 B11R2.1 O=C1COC2=C1C=CC=C2 HR144627 [1,0,0,0,0,0|1,0,1]=3 78 B11R2.1 O=C1COC2=CN=CC=C12 HR115944 [1,0,0,0,0,0|2,0,1]=4 79 B11R2.1 O=C1COC2=NC=CC=C12 HR30726 [1,0,0,0,0,0|2,0,1]=4 80 B11R2.1 O=C1COc2ccccc21 HR123845 [1,0,0,0,0,0|1,0,1]=3 81 B11R2.1 O=C1CSC2=C1C=CC=C2 HR147144 [1,0,0,0,0,0|1,1,1]=4 82 B11R2.1 O=C1NCC2=CC=CC=C12 HR30555 [1,0,0,0,0,0|3,0,0]=4 83 B11R2.1 O=C1NNC2=CC=CC=C12 HR30556 [1,0,0,0,0,0|3,0,0]=4 84 B11R2.1 O=C1NSC2=C1C=CC=C2 HR134421 [1,0,0,0,0,0|2,1,0]=4 85 B11R2.1 O=C1OCC2=C1C=CC=C2 HR124467 [1,0,0,0,0,0|3,0,0]=4 86 B11R2.1 O=S1C=CC2=C1C=CC=C2 HR124927 [1,0,0,0,0,0|3,0,0]=4 87 B11R2.1 OC1=CSC2=C1C=CC=C2 HR124656 [1,0,0,0,0,0|1,1,0]=3 88 B11R2.1 OC1=NNC2=CC=CC=C21 HR120308 [1,0,0,0,0,0|3,0,0]=4 89 B11R2.1 OC1=NOC2=C1C=CC=C2 HR31889 [1,0,0,0,0,0|2,0,0]=3 90 B11R2.10 BrC1=CC2=C(C=CC=C2)S1 HR114585 [1,0,0,0,0,0|1,1,0]=3 91 B11R2.10 BrC1=CC2=CC=CC=C2C1 HR136265 [1,0,0,0,0,0|2,0,0]=3 92 B11R2.10 BrC1=CC2=CC=CC=C2N1 HR144441 [1,0,0,0,0,0|2,0,0]=3 93 B11R2.10 BrC1=CC2=CC=NC=C2S1 HR109620 [1,0,0,0,0,0|2,1,0]=4 94 B11R2.10 BrC1=CC2=NC=CC=C2S1 HR117090 [1,0,0,0,0,0|2,1,0]=4 95 B11R2.10 BrC1=CN2C=CC=CC2=N1 HR120244 [1,0,0,0,0,0|3,0,0]=4 96 B11R2.10 BrC1=NC2=C(C=CC=C2)N1 HR112864 [1,0,0,0,0,0|3,0,0]=4 97 B11R2.10 BrC1=NC2=C(C=CC=C2)O1 HR32327 [1,0,0,0,0,0|2,0,0]=3 98 B11R2.10 BrC1=NC2=C(C=CC=C2)S1 HR125650 [1,0,0,0,0,0|2,1,0]=4 99 B11R2.10 CC1=CC2=C(C=CC=C2)O1 HR110370 [1,0,0,0,0,0|0,0,0]=1 100 B11R2.10 CC1=CC2=C(C=CC=C2)S1 HR112383 [1,0,0,0,0,0|0,1,0]=2 101 B11R2.10 CC1=CC2=CC=CC=C2C1 HR5381 [1,0,0,0,0,0|1,0,0]=2 102 B11R2.10 CC1=CC2=CC=CC=C2N1 HR7504 [1,0,0,0,0,0|1,0,0]=2 103 B11R2.10 CC1=CC2=CC=CN=C2N1 HR107726 [1,0,0,0,0,0|2,0,0]=3 104 B11R2.10 CC1=CC2=NC=CC=C2N1 HR113231 [1,0,0,0,0,0|2,0,0]=3 105 B11R2.10 CC1=CN2C=CC=CC2=N1 HR30366 [1,0,0,0,0,0|2,0,0]=3 106 B11R2.10 CC1=NC2=C(C=CC=C2)N1 HR129453 [1,0,0,0,0,0|2,0,0]=3 107 B11R2.10 CC1=NC2=C(C=CC=C2)O1 HR129200 [1,0,0,0,0,0|1,0,0]=2 108 B11R2.10 CC1=NC2=C(C=CC=C2)S1 HR129712 [1,0,0,0,0,0|1,1,0]=3 109 B11R2.10 CC1=NC2=C(C=CC=C2)[Se]1 HR126032 [1,0,0,0,0,0|1,1,0]=3 110 B11R2.10 CC1=NC2=NC=CC=C2O1 HR147291 [1,0,0,0,0,0|2,0,0]=3 111 B11R2.10 CC1=NN2C=CC=NC2=C1 HR148931 [1,0,0,0,0,0|3,0,0]=4 112 B11R2.10 CC1CC2=C(C=CC=C2)O1 HR103036 [1,0,0,0,0,0|0,0,2]=3 113 B11R2.10 CC1CC2=CC=CC=C2N1 HR100587 [1,0,0,0,0,0|1,0,2]=4 114 B11R2.10 CN1C=C2C=CC=CC2=N1 HR106462 [1,0,0,0,0,0|2,0,0]=3 115 B11R2.10 ClB1Oc2ccccc2O1 HR101041 [1,0,0,0,0,0|3,0,0]=4 116 B11R2.10 ClC1=NC2=C(C=CC=C2)N1 HR7598 [1,0,0,0,0,0|3,0,0]=4 117 B11R2.10 ClC1=NC2=C(C=CC=C2)O1 HR137239 [1,0,0,0,0,0|2,0,0]=3 118 B11R2.10 ClC1=NC2=C(C=CC=C2)S1 HR127542 [1,0,0,0,0,0|2,1,0]=4 119 B11R2.10 ClC1=NC2=C(C=NC=C2)O1 HR118143 [1,0,0,0,0,0|3,0,0]=4 120 B11R2.10 ClC1=NC2=CC=CN=C2O1 HR32333 [1,0,0,0,0,0|3,0,0]=4 121 B11R2.10 ClC1=NN2C=CC=CC2=C1 HR113611 [1,0,0,0,0,0|3,0,0]=4 122 B11R2.10 FC1=NC2=C(C=CC=C2)N1 HR109417 [1,0,0,0,0,0|3,0,0]=4 123 B11R2.10 IC1=CC2=C(C=CN=C2)N1 HR119868 [1,0,0,0,0,0|3,0,0]=4 124 B11R2.10 IC1=NC2=C(C=CC=C2)S1 HR147801 [1,0,0,0,0,0|2,1,0]=4 125 B11R2.10 NC1=CC2=C(C=CC=C2)S1 HR148251 [1,0,0,0,0,0|1,1,0]=3 126 B11R2.10 NC1=CN2C=CC=CC2=N1 HR106605 [1,0,0,0,0,0|3,0,0]=4 127 B11R2.10 NC1=NC2=C(C=CC=C2)N1 HR137781 [1,0,0,0,0,0|3,0,0]=4 128 B11R2.10 NC1=NC2=C(C=CC=C2)O1 HR105090 [1,0,0,0,0,0|2,0,0]=3 129 B11R2.10 NC1=NC2=C(C=CC=C2)S1 HR100010 [1,0,0,0,0,0|2,1,0]=4 130 B11R2.10 NC1=NC2=C(C=CN=C2)O1 HR32330 [1,0,0,0,0,0|3,0,0]=4 131 B11R2.10 NC1=NC2=C(C=NC=C2)O1 HR33356 [1,0,0,0,0,0|3,0,0]=4 132 B11R2.10 NC1=NC2=CC=CN=C2O1 HR32332 [1,0,0,0,0,0|3,0,0]=4 133 B11R2.10 O=C1C=C2C=CC=CN2N1 HR115261 [1,0,0,0,0,0|3,0,0]=4 134 B11R2.10 O=C1CC2=CC=CC=C2C1 HR132361 [1,0,0,0,0,0|2,0,1]=4 135 B11R2.10 O=C1CC2=CC=CC=C2N1 HR131240 [1,0,0,0,0,0|2,0,1]=4 136 B11R2.10 O=C1CC2=CC=CC=C2O1 HR107478 [1,0,0,0,0,0|1,0,1]=3 137 B11R2.10 O=C1N=C2C=CC=CC2=N1 HR115512 [1,0,0,0,0,0|3,0,0]=4 138 B11R2.10 O=C1NC2=C(C=CC=C2)O1 HR126250 [1,0,0,0,0,0|2,0,0]=3 139 B11R2.10 O=C1NC2=NC=CC=C2O1 HR128757 [1,0,0,0,0,0|3,0,0]=4 140 B11R2.10 OC1=CN2C=CC=CC2=N1 HR110660 [1,0,0,0,0,0|3,0,0]=4 141 B11R2.10 OC1=NC2=C(C=CC=C2)N1 HR135442 [1,0,0,0,0,0|3,0,0]=4 142 B11R2.10 OC1=NC2=C(C=CC=C2)S1 HR119918 [1,0,0,0,0,0|2,1,0]=4 143 B11R2.10 S=C1NC2=C(C=CC=C2)[Se]1 HR107802 [1,0,0,0,0,0|2,1,0]=4 144 B11R2.10 SC1=NC2=C(C=CC=C2)N1 HR133946 [1,0,0,0,0,0|3,0,0]=4 145 B11R2.10 SC1=NC2=C(C=CC=C2)O1 HR8630 [1,0,0,0,0,0|2,0,0]=3 146 B11R2.10 SC1=NC2=C(C=CC=C2)S1 HR127607 [1,0,0,0,0,0|2,1,0]=4 147 B11R2.10 SC1=NC2=C(C=CC=C2)S1 HR134216 [1,0,0,0,0,0|2,1,0]=4 148 B13R2.45 CC1=C(C#N)SC2=C1C=CC=C2 HR121903 [0,1,0,0,0,0|0,1,1]=3 149 B13R2.45 CCC1=C(C)C2=C(C=CC=C2)O1 HR117128 [0,1,0,0,0,0|0,0,0]=1 150 B13R2.45 CN1C(C=O)=NC2=C1C=CC=C2 HR114989 [0,1,0,0,0,0|2,0,1]=4 151 B13R2.45 CN1C(CCl)=NC2=C1C=CC=C2 HR115507 [0,1,0,0,0,0|2,0,0]=3 152 B13R2.45 CN1C(CN)=NC2=C1C=CC=C2 HR104030 [0,1,0,0,0,0|2,0,0]=3 153 B13R2.45 CN1C2=C(C=CC=C2)S\C1=N/N HR110311 [0,1,0,0,0,0|2,1,0]=4 154 B13R2.45 CN1C2=C(C=CC=C2)S\C1=N/N HR121232 [0,1,0,0,0,0|2,1,0]=4 155 B13R2.45 O=CC1=C(Br)C2=C(C=CC=C2)S1 HR112282 [0,1,0,0,0,0|1,1,1]=4 156 B13R2.45 O=CC1=C(Cl)C2=C(C=CC=C2)S1 HR141712 [0,1,0,0,0,0|1,1,1]=4 157 B13R2.135 CC1=C(C#N)C2=CC=CC=C2N1 HR119382 [0,1,0,0,0,0|1,0,1]=3 158 B13R2.135 CC1=C(C=O)C2=CC=CC=C2N1 HR133141 [0,1,0,0,0,0|1,0,1]=3 159 B13R2.135 CC1=C(C=O)C2=CC=CN=C2N1 HR149963 [0,1,0,0,0,0|2,0,1]=4 160 B13R2.135 CC1=C(C=O)N2C=CC=CC2=N1 HR30365 [0,1,0,0,0,0|2,0,1]=4 161 B13R2.135 CC1=NC2=C(C=CC=C2)N1CF HR116543 [0,1,0,0,0,0|2,0,0]=3 162 B13R2.135 CC1=NC2=C(C=CC=C2)N1CO HR116863 [0,1,0,0,0,0|2,0,0]=3 163 B13R2.135 CCN1C(C)=CC2=CC=CC=C21 HR137325 [0,1,0,0,0,0|2,0,0]=3 164 B13R2.135 CCN1C(C)=NC2=C1C=CC=C2 HR142379 [0,1,0,0,0,0|2,0,0]=3 165 B13R2.135 CN1N=C2C=CC=CC2=C1C=O HR107878 [0,1,0,0,0,0|2,0,1]=4 166 B13R2.135 COC1=C(C)NC2=NC=CC=C21 HR150091 [0,1,0,0,0,0|2,0,0]=3 167 B13R2.135 O=CC1=C(Br)SC2=C1C=CC=C2 HR33609 [0,1,0,0,0,0|1,1,1]=4 168 B13R2.135 O=CC1=C(Cl)NC2=CC=CC=C21 HR138612 [0,1,0,0,0,0|2,0,1]=4 169 B13R2.359 CC1(C)C(=O)NC2=CC=CC=C21 HR111494 [0,1,0,0,0,0|2,0,1]=4 170 B13R2.359 CC1=Nc2ccccc2C1(C)C HR136007 [0,1,0,0,0,0|1,0,1]=3 171 B13R2.3028 CC1=C(C)C2=CC(Br)=CC=C2N1 HR107420 [0,1,0,0,0,0|1,0,0]=2 172 B13R2.3028 CC1=C(C)C2=CC(F)=CC=C2N1 HR117755 [0,1,0,0,0,0|1,0,0]=2 173 B13R2.3028 CC1=C(C)N2C=C(Br)C=CC2=N1 HR30367 [0,1,0,0,0,0|2,0,0]=3 174 B13R2.3028 CC1=CC=C2NC(=O)C(=O)C2=C1 HR136341 [0,1,0,0,0,0|3,0,0]=4 175 B13R2.3028 CC1CC2=CC=C(Br)C=C2C1=O HR112170 [0,1,0,0,0,0|2,0,1]=4 176 B13R2.3028 CC1CC2=CC=C(F)C=C2C1=O HR123281 [0,1,0,0,0,0|2,0,1]=4 177 B13R2.3028 CN1C(Cl)=NC2=C1C=C(F)C=C2 HR150416 [0,1,0,0,0,0|3,0,0]=4 178 B13R2.3028 NC1=CC=C2NC(=O)C(=O)C2=C1 HR112073 [0,1,0,0,0,0|3,0,0]=4 179 B13R2.3028 O=C1NC2=CC=C(Br)C=C2C1=O HR132374 [0,1,0,0,0,0|3,0,0]=4 180 B13R2.3028 O=C1NC2=CC=C(Cl)C=C2C1=O HR126468 [0,1,0,0,0,0|3,0,0]=4 181 B13R2.3028 O=C1NC2=CC=C(F)C=C2C1=O HR1685 [0,1,0,0,0,0|3,0,0]=4 182 B13R2.3028 O=C1NC2=CC=C(I)C=C2C1=O HR128391 [0,1,0,0,0,0|3,0,0]=4 183 B13R2.3028 O=C1NC2=CC=C(O)C=C2C1=O HR112387 [0,1,0,0,0,0|3,0,0]=4 184 B13R2.3085 CN1C(=O)C(=O)C2=CC=CC=C21 HR144312 [0,1,0,0,0,0|3,0,0]=4 185 B13R2.3085 CN1C(=O)C2=CC=CC=C2C1=O HR128127 [0,1,0,0,0,0|3,0,0]=4 186 B13R2.3085 CN1C(=O)N(C)C2=C1C=CC=C2 HR105604 [0,1,0,0,0,0|3,0,0]=4 187 B13R2.4825 CC1=C2NC(=O)C(=O)C2=CC=C1 HR103250 [0,1,0,0,0,0|3,0,0]=4 188 B13R2.4825 CC1CC2=C(Br)C=CC=C2C1=O HR110906 [0,1,0,0,0,0|2,0,1]=4 189 B13R2.4825 CC1CC2=C(Cl)C=CC=C2C1=O HR111226 [0,1,0,0,0,0|2,0,1]=4 190 B13R2.4825 CC1CC2=C(F)C=CC=C2C1=O HR111853 [0,1,0,0,0,0|2,0,1]=4 191 B13R2.4825 CN1CC2=C(Br)C=CC=C2C1=O HR108622 [0,1,0,0,0,0|3,0,0]=4 192 B13R2.4825 O=C1NC2=C(Br)C=CC=C2C1=O HR134168 [0,1,0,0,0,0|3,0,0]=4 193 B13R2.4825 O=C1NC2=C(Cl)C=CC=C2C1=O HR140068 [0,1,0,0,0,0|3,0,0]=4 194 B13R2.4825 O=C1NC2=C(F)C=CC=C2C1=O HR146632 [0,1,0,0,0,0|3,0,0]=4 195 B13R2.4825 O=C1NC2=C(I)C=CC=C2C1=O HR121836 [0,1,0,0,0,0|3,0,0]=4 196 B13R2.4856 CC1=C(C)C2=C(N=CN=C2Cl)S1 HR120443 [0,1,0,0,0,0|2,1,0]=4 197 B13R2.4856 CC1=C(C)C2=C(N=CNC2=O)S1 HR121071 [0,1,0,0,0,0|2,1,0]=4 198 B13R2.4856 CC1=C2C(=O)C(=O)NC2=CC=C1 HR112705 [0,1,0,0,0,0|3,0,0]=4 199 B13R2.4856 CC1CC2=CC=CC(Br)=C2C1=O HR113417 [0,1,0,0,0,0|2,0,1]=4 200 B13R2.4856 CC1CC2=CC=CC(Cl)=C2C1=O HR114056 [0,1,0,0,0,0|2,0,1]=4 201 B13R2.4856 O=C1NC2=CC=CC(Br)=C2C1=O HR132126 [0,1,0,0,0,0|3,0,0]=4 202 B13R2.4856 O=C1NC2=CC=CC(Cl)=C2C1=O HR135168 [0,1,0,0,0,0|3,0,0]=4 203 B13R2.4856 O=C1NC2=CC=CC(F)=C2C1=O HR108727 [0,1,0,0,0,0|3,0,0]=4 204 B13R2.4856 O=C1NC2=CC=CC(I)=C2C1=O HR110054 [0,1,0,0,0,0|3,0,0]=4 205 B13R2.5190 CC1=C2C=CC(N)=CC2=NN1C HR102807 [0,1,0,0,0,0|2,0,0]=3 206 B13R2.5190 CC1=C2C=CC(N)=CC2=NN1C HR110237 [0,1,0,0,0,0|2,0,0]=3 207 B13R2.5190 CC1=CC=C2C(=O)C(=O)NC2=C1 HR110323 [0,1,0,0,0,0|3,0,0]=4 208 B13R2.5190 CC1=NC2=C(C=CC(Cl)=C2)N1C HR113636 [0,1,0,0,0,0|2,0,0]=3 209 B13R2.5190 CC1CC2=CC(Br)=CC=C2C1=O HR111536 [0,1,0,0,0,0|2,0,1]=4 210 B13R2.5190 CC1CC2=CC(Cl)=CC=C2C1=O HR113739 [0,1,0,0,0,0|2,0,1]=4 211 B13R2.5190 CC1CC2=CC(F)=CC=C2C1=O HR134868 [0,1,0,0,0,0|2,0,1]=4 212 B13R2.5190 CN1C(Cl)=NC2=C1C=CC(F)=C2 HR150404 [0,1,0,0,0,0|3,0,0]=4 213 B13R2.5190 CN1CC2=CC(Br)=CC=C2C1=O HR109245 [0,1,0,0,0,0|3,0,0]=4 214 B13R2.5190 O=C1NC2=CC(Br)=CC=C2C1=O HR135698 [0,1,0,0,0,0|3,0,0]=4 215 B13R2.5190 O=C1NC2=CC(Cl)=CC=C2C1=O HR129434 [0,1,0,0,0,0|3,0,0]=4 216 B13R2.5190 O=C1NC2=CC(Cl)=CC=C2C1=O HR135431 [0,1,0,0,0,0|3,0,0]=4 217 B13R2.5190 O=C1NC2=CC(F)=CC=C2C1=O HR109041 [0,1,0,0,0,0|3,0,0]=4 218 B13R2.5190 O=C1NC2=CC(I)=CC=C2C1=O HR109739 [0,1,0,0,0,0|3,0,0]=4 219 B13R2.5190 O=C1NC2=CC(O)=CC=C2C1=O HR110178 [0,1,0,0,0,0|3,0,0]=4 220 B11R1.36 BrC(Br)=C(Br)C1=CC=CC=C1 HR122543 [0,0,1,0,0,0|3,0,0]=4 221 B11R1.36 C=C(B(O)O)C1=CC=CC=C1 HR118220 [0,0,1,0,0,0|2,0,1]=4 222 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 HR127990 [0,0,1,0,0,0|1,0,1]=3 223 B11R1.36 C=C(C(C)=O)C1=CC=CC=C1 HR118801 [0,0,1,0,0,0|0,0,2]=3 224 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 HR134536 [0,0,1,0,0,0|1,0,1]=3 225 B11R1.36 CC(=O)C(N)c1ccccc1 HR107181 [0,0,1,0,0,0|1,0,2]=4 226 B11R1.36 CC(=O)C(O)c1ccccc1 HR100300 [0,0,1,0,0,0|1,0,2]=4 227 B11R1.36 CC(=O)N(Cl)C1=CC=CC=C1 HR101523 [0,0,1,0,0,0|2,0,1]=4 228 B11R1.36 CC(Br)C(=O)C1=CC=CC=C1 HR33887 [0,0,1,0,0,0|2,0,1]=4 229 B11R1.36 CC(C(=O)Cl)C1=CC=CC=C1 HR119666 [0,0,1,0,0,0|1,0,2]=4 230 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 HR131467 [0,0,1,0,0,0|1,0,1]=3 231 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 HR136928 [0,0,1,0,0,0|1,0,1]=3 232 B11R1.36 CC(C(=O)O)c1ccccc1 HR6079 [0,0,1,0,0,0|1,0,1]=3 233 B11R1.36 CC(C)C(=O)C1=CC=CC=C1 HR125557 [0,0,1,0,0,0|2,0,1]=4 234 B11R1.36 CC(Cl)C(=O)C1=CC=CC=C1 HR144028 [0,0,1,0,0,0|2,0,1]=4 235 B11R1.36 CC(F)C(=O)c1ccccc1 HR141801 [0,0,1,0,0,0|2,0,1]=4 236 B11R1.36 CC(O)C(=O)C1=CC=CC=C1 HR141694 [0,0,1,0,0,0|1,0,1]=3 237 B11R1.36 CC(O)C(N)C1=CC=CC=C1 HR103561 [0,0,1,0,0,0|1,0,2]=4 238 B11R1.36 CN(C)C(=O)C1=CC=CC=C1 HR141486 [0,0,1,0,0,0|3,0,0]=4 239 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 HR122845 [0,0,1,0,0,0|2,0,1]=4 240 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 HR126179 [0,0,1,0,0,0|2,0,1]=4 241 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 HR127777 [0,0,1,0,0,0|2,0,1]=4 242 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 HR147603 [0,0,1,0,0,0|2,0,1]=4 243 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 HR131693 [0,0,1,0,0,0|2,0,0]=3 244 B11R1.36 O=C(O)C(Br)C1=CC=CC=C1 HR127939 [0,0,1,0,0,0|2,0,1]=4 245 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 HR129834 [0,0,1,0,0,0|2,0,1]=4 246 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 HR131808 [0,0,1,0,0,0|2,0,1]=4 247 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 HR132071 [0,0,1,0,0,0|2,0,1]=4 248 B11R1.40 C=CC(=O)OC1=CC=CC=C1 HR117635 [0,0,1,0,0,0|1,0,1]=3 249 B11R1.40 CCC(=O)CC1=CC=CC=C1 HR130193 [0,0,1,0,0,0|2,0,1]=4 250 B11R1.40 CCC(C)CC1=CC=CC=C1 HR111099 [0,0,1,0,0,0|1,0,2]=4 251 B11R1.40 CNC(=S)NC1=CC=CC=C1 HR141136 [0,0,1,0,0,0|3,0,0]=4 252 B11R1.40 COC(=O)CC1=CC=CC=C1 HR126774 [0,0,1,0,0,0|3,0,0]=4 253 B11R1.40 C\C(C=O)=C\C1=CC=CC=C1 HR137989 [0,0,1,0,0,0|2,0,0]=3 254 B11R1.40 O=C(CBr)OC1=CC=CC=C1 HR138448 [0,0,1,0,0,0|2,0,1]=4 255 B11R1.41 CCOC1=C(C#N)C=CC=C1 HR126920 [0,0,1,0,0,0|1,0,2]=4 256 B11R1.41 CCOC1=C(C=O)C=CC=C1 HR142460 [0,0,1,0,0,0|1,0,1]=3 257 B11R1.41 CCOC1=C(CCl)C=CC=C1 HR121176 [0,0,1,0,0,0|1,0,2]=4 258 B11R1.41 CCOC1=C(CN)C=CC=C1 HR115396 [0,0,1,0,0,0|1,0,2]=4 259 B11R1.41 CCOC1=CC=NC=C1C=O HR33604 [0,0,1,0,0,0|2,0,1]=4 260 B11R1.41 CCOC1=NC=CC=C1C=O HR152456 [0,0,1,0,0,0|2,0,1]=4 261 B11R1.41 CNCC1=C(OC)C=CC=C1 HR144722 [0,0,1,0,0,0|3,0,0]=4 262 B11R1.41 O=CNC1=C(C=O)C=CC=C1 HR100254 [0,0,1,0,0,0|3,0,0]=4 263 B11R1.222 CCC(=O)C1=C(C)C=CC=C1 HR102662 [0,0,1,0,0,0|2,0,1]=4 264 B11R1.222 CCC(=O)C1=C(Cl)C=CC=C1 HR102022 [0,0,1,0,0,0|2,0,1]=4 265 B11R1.222 CCC(=O)C1=C(F)C=CC=C1 HR123619 [0,0,1,0,0,0|2,0,1]=4 266 B11R1.222 CCC(=O)C1=C(O)C=CC=C1 HR132318 [0,0,1,0,0,0|1,0,1]=3 267 B11R1.222 CCC(C)C1=C(O)C=CC=C1 HR135290 [0,0,1,0,0,0|0,0,2]=3 268 B11R1.222 CNC(=O)C1=C(N)C=CC=C1 HR120290 [0,0,1,0,0,0|3,0,0]=4 269 B11R1.222 CNC(=O)C1=C(S)C=CC=C1 HR143082 [0,0,1,0,0,0|2,1,0]=4 270 B11R1.222 CNC(C)C1=C(Cl)C=CC=C1 HR114032 [0,0,1,0,0,0|2,0,1]=4 271 B11R1.222 COC(=O)C1=C(Br)C=CC=C1 HR3956 [0,0,1,0,0,0|3,0,0]=4 272 B11R1.222 COC(=O)C1=C(Cl)C=CC=C1 HR131154 [0,0,1,0,0,0|3,0,0]=4 273 B11R1.222 COC(=O)C1=C(F)C=CC=C1 HR123467 [0,0,1,0,0,0|3,0,0]=4 274 B11R1.222 COC(=O)C1=C(I)C=CC=C1 HR138423 [0,0,1,0,0,0|3,0,0]=4 275 B11R1.222 COC(=O)C1=C(O)C=NC=C1 HR144250 [0,0,1,0,0,0|3,0,0]=4 276 B11R1.222 COC(=O)C1=CC=CC=C1C HR136739 [0,0,1,0,0,0|3,0,0]=4 277 B11R1.222 COC(=O)C1=CC=CC=C1N HR136079 [0,0,1,0,0,0|3,0,0]=4 278 B11R1.222 COC(=O)C1=CC=CC=C1O HR123095 [0,0,1,0,0,0|2,0,0]=3 279 B11R1.222 COC(=O)C1=CC=CC=C1O HR131277 [0,0,1,0,0,0|2,0,0]=3 280 B11R1.222 COC(=O)C1=CC=CC=C1S HR101714 [0,0,1,0,0,0|2,1,0]=4 281 B11R1.222 COC(=O)C1=CN=CC=C1O HR107792 [0,0,1,0,0,0|3,0,0]=4 282 B11R1.222 COC(=O)C1=NC=CC=C1O HR138652 [0,0,1,0,0,0|3,0,0]=4 283 B11R1.222 NNC(=O)C1=CC=CC=C1O HR137584 [0,0,1,0,0,0|3,0,0]=4 284 B11R1.222 O=C(CBr)C1=C(O)C=CC=C1 HR119979 [0,0,1,0,0,0|2,0,1]=4 285 B11R1.222 O=C(NO)C1=CC=CC=C1O HR124345 [0,0,1,0,0,0|3,0,0]=4 286 B13R2.32 BrC1=C(Br)C2=CC=CC=C2C=C1 HR121445 [0,0,0,0,0,1|3,0,0]=4 287 B13R2.32 CC1=C(Br)C2=CC=CC=C2C=C1 HR139559 [0,0,0,0,0,1|2,0,0]=3 288 B13R2.32 CC1=C(Cl)C2=CC=CC=C2N=C1 HR119128 [0,0,0,0,0,1|2,0,0]=3 289 B13R2.32 CC1=C(N)N=CC2=CC=CC=C21 HR111065 [0,0,0,0,0,1|2,0,0]=3 290 B13R2.32 CC1=C(O)C=NC2=CC=CC=C21 HR146470 [0,0,0,0,0,1|2,0,0]=3 291 B13R2.32 CC1=C2N=CC=CC2=CC=C1Br HR144484 [0,0,0,0,0,1|3,0,0]=4 292 B13R2.32 CC1=C2N=CC=CC2=CC=C1Cl HR103001 [0,0,0,0,0,1|3,0,0]=4 293 B13R2.32 CC1=CC=C2C=NC=CC2=C1Br HR104274 [0,0,0,0,0,1|3,0,0]=4 294 B13R2.32 CN1C(=O)COC2=C1C=CC=C2 HR106219 [0,0,0,0,0,1|2,0,0]=3 295 B13R2.32 ClC1=C(Br)C=NC2=CC=CC=C21 HR102834 [0,0,0,0,0,1|3,0,0]=4 296 B13R2.32 ClC1=C(I)C=NC2=CC=CC=C21 HR107036 [0,0,0,0,0,1|3,0,0]=4 297 B13R2.32 FC1=C(Br)C=CC2=CC=CC=C21 HR106551 [0,0,0,0,0,1|3,0,0]=4 298 B13R2.32 NC1=C(Br)C2=CC=CC=C2C=C1 HR33510 [0,0,0,0,0,1|3,0,0]=4 299 B13R2.32 NC1=C(Br)C2=CC=CC=C2C=N1 HR32235 [0,0,0,0,0,1|3,0,0]=4 300 B13R2.32 NC1=C(Br)C=NC2=CC=CC=C21 HR142978 [0,0,0,0,0,1|3,0,0]=4 301 B13R2.32 NC1=C(Br)N=CC2=CC=CC=C21 HR147851 [0,0,0,0,0,1|3,0,0]=4 302 B13R2.32 NC1=C(Cl)C2=CC=CC=C2N=C1 HR155152 [0,0,0,0,0,1|3,0,0]=4 303 B13R2.32 NC1=C(Cl)N=CC2=CC=CC=C21 HR148078 [0,0,0,0,0,1|3,0,0]=4 304 B13R2.32 NC1=C(N)C2=CC=CC=C2N=C1 HR155043 [0,0,0,0,0,1|3,0,0]=4 305 B13R2.32 NC1=C(O)C=CC2=CC=CC=C21 HR100471 [0,0,0,0,0,1|3,0,0]=4 306 B13R2.32 NC1=C(O)C=CC2=CC=CC=C21 HR142557 [0,0,0,0,0,1|3,0,0]=4 307 B13R2.32 O=C1C=CC2=CC=CC=C2C1=O HR103457 [0,0,0,0,0,1|3,0,0]=4 308 B13R2.32 OC1=C(Br)C2=CC=CC=C2C=C1 HR106332 [0,0,0,0,0,1|3,0,0]=4 309 B13R2.32 OC1=C(Br)C=CC2=CC=CC=C21 HR33196 [0,0,0,0,0,1|3,0,0]=4 310 B13R2.32 OC1=C(Cl)C2=CC=CC=C2C=C1 HR106017 [0,0,0,0,0,1|3,0,0]=4 311 B13R2.32 OC1=C(I)C2=CC=CC=C2C=C1 HR107159 [0,0,0,0,0,1|3,0,0]=4 312 B13R2.328 BrC1=CC2=CC=CC=C2C(Br)=C1 HR121126 [0,0,0,0,0,1|3,0,0]=4 313 B13R2.328 BrC1=CC2=CC=CC=C2C(Br)=N1 HR147808 [0,0,0,0,0,1|3,0,0]=4 314 B13R2.328 BrC1=NC2=CC=CC=C2C(Br)=N1 HR106783 [0,0,0,0,0,1|3,0,0]=4 315 B13R2.328 CC1=C2N=CC=CC2=CC(Br)=C1 HR105777 [0,0,0,0,0,1|3,0,0]=4 316 B13R2.328 CC1=C2N=CC=CC2=CC(Cl)=C1 HR143606 [0,0,0,0,0,1|3,0,0]=4 317 B13R2.328 CC1=C2N=CC=CC2=CC(F)=C1 HR155100 [0,0,0,0,0,1|3,0,0]=4 318 B13R2.328 CC1=CC(=O)NC2=CC=CC=C12 HR140324 [0,0,0,0,0,1|2,0,0]=3 319 B13R2.328 CC1=CC(Br)=C2N=CC=CC2=C1 HR144194 [0,0,0,0,0,1|3,0,0]=4 320 B13R2.328 CC1=CC(Br)=CC2=CC=CC=C12 HR121259 [0,0,0,0,0,1|2,0,0]=3 321 B13R2.328 CC1=CC(Br)=NC2=CC=CC=C12 HR120986 [0,0,0,0,0,1|2,0,0]=3 322 B13R2.328 CC1=CC(C)=NC2=CC=CC=C12 HR122267 [0,0,0,0,0,1|1,0,0]=2 323 B13R2.328 CC1=CC(Cl)=C2N=CC=CC2=C1 HR143800 [0,0,0,0,0,1|3,0,0]=4 324 B13R2.328 CC1=CC(Cl)=NC2=CC=CC=C12 HR114558 [0,0,0,0,0,1|2,0,0]=3 325 B13R2.328 CC1=CC(O)=NC2=CC=CC=C12 HR146529 [0,0,0,0,0,1|2,0,0]=3 326 B13R2.328 CC1=CC2=CC=CC=C2C(Cl)=N1 HR155161 [0,0,0,0,0,1|2,0,0]=3 327 B13R2.328 CC1=CC2=CC=CC=C2C(O)=N1 HR32190 [0,0,0,0,0,1|2,0,0]=3 328 B13R2.328 CC1=CC2=CC=CC=C2[N+]([O-])=C1 HR102732 [0,0,0,0,0,1|3,0,0]=4 329 B13R2.328 CC1=NC(Cl)=NC2=CC=CC=C21 HR118906 [0,0,0,0,0,1|2,0,0]=3 330 B13R2.328 CC1=NC(N)=NC2=CC=CC=C21 HR118592 [0,0,0,0,0,1|2,0,0]=3 331 B13R2.328 CC1=NC2=C(C=NC=C2)C(=O)O1 HR117869 [0,0,0,0,0,1|3,0,0]=4 332 B13R2.328 CC1=NC2=CC=CC=C2C(Br)=C1 HR117200 [0,0,0,0,0,1|2,0,0]=3 333 B13R2.328 CC1=NC2=CC=CC=C2C(Cl)=C1 HR131465 [0,0,0,0,0,1|2,0,0]=3 334 B13R2.328 CC1=NC2=CC=CC=C2C(Cl)=N1 HR142299 [0,0,0,0,0,1|2,0,0]=3 335 B13R2.328 CC1=NC2=CC=CC=C2C(N)=C1 HR132862 [0,0,0,0,0,1|2,0,0]=3 336 B13R2.328 CC1=NC2=CC=CC=C2C(O)=C1 HR118025 [0,0,0,0,0,1|2,0,0]=3 337 B13R2.328 Cc1nc(C)c2ccccc2n1 HR148586 [0,0,0,0,0,1|1,0,0]=2 338 B13R2.328 ClC1=CC(Br)=NC2=CC=CC=C12 HR121309 [0,0,0,0,0,1|3,0,0]=4 339 B13R2.328 ClC1=CC(Cl)=NC2=CC=CC=C12 HR114264 [0,0,0,0,0,1|3,0,0]=4 340 B13R2.328 ClC1=CC2=CC=CC=C2C(Cl)=N1 HR131247 [0,0,0,0,0,1|3,0,0]=4 341 B13R2.328 ClC1=NC2=CC=CC=C2C(Cl)=N1 HR124063 [0,0,0,0,0,1|3,0,0]=4 342 B13R2.328 FC1=CC(Br)=CC2=CC=CC=C12 HR106243 [0,0,0,0,0,1|3,0,0]=4 343 B13R2.328 NC1=CC(=O)NC2=CC=CC=C12 HR147412 [0,0,0,0,0,1|3,0,0]=4 344 B13R2.328 NC1=CC(Br)=NC2=CC=CC=C12 HR31907 [0,0,0,0,0,1|3,0,0]=4 345 B13R2.328 NC1=CC2=CC=CC=C2C(Br)=N1 HR100743 [0,0,0,0,0,1|3,0,0]=4 346 B13R2.328 NC1=NC(Cl)=NC2=CC=CC=C21 HR118590 [0,0,0,0,0,1|3,0,0]=4 347 B13R2.328 NC1=NC2=CC=CC=C2C(Br)=C1 HR30343 [0,0,0,0,0,1|3,0,0]=4 348 B13R2.328 NC1=NC2=CC=CC=C2C(Cl)=C1 HR32277 [0,0,0,0,0,1|3,0,0]=4 349 B13R2.328 NC1=NC2=CC=CC=C2C(N)=N1 HR125920 [0,0,0,0,0,1|3,0,0]=4 350 B13R2.328 NC1=NC2=CC=CC=C2C(O)=C1 HR32273 [0,0,0,0,0,1|3,0,0]=4 351 B13R2.328 NC1=NC2=CC=CC=C2C(O)=N1 HR32279 [0,0,0,0,0,1|3,0,0]=4 352 B13R2.328 O=C1C=C(Br)C2=CC=CC=C2N1 HR110574 [0,0,0,0,0,1|3,0,0]=4 353 B13R2.328 O=C1C=C(O)C2=CC=CC=C2N1 HR130257 [0,0,0,0,0,1|3,0,0]=4 354 B13R2.328 O=C1C=C(O)C2=CC=CC=C2O1 TEJB02204 [0,0,0,0,0,1|2,0,0]=3 355 B13R2.328 O=C1CC2=CC=CC=C2C(=O)N1 HR110073 [0,0,0,0,0,1|3,0,0]=4 356 B13R2.328 O=C1CC2=CC=CC=C2C(=O)O1 HR108671 [0,0,0,0,0,1|3,0,0]=4 357 B13R2.328 O=C1NC(=O)C2=C(C=CC=C2)O1 HR115010 [0,0,0,0,0,1|2,0,0]=3 358 B13R2.328 O=C1NC2=C(C=CC=C2)C(=O)O1 HR136649 [0,0,0,0,0,1|3,0,0]=4 359 B13R2.328 O=C1O[Bi](O)Oc2ccccc21 HR132912 [0,0,0,0,0,1|3,0,0]=4 360 B13R2.328 OC1=CC(Cl)=NC2=CC=CC=C12 HR147272 [0,0,0,0,0,1|3,0,0]=4 361 B13R2.328 OC1=CC(O)=NC2=CC=CC=C12 HR107416 [0,0,0,0,0,1|3,0,0]=4 362 B13R2.328 OC1=CC2=CC=CC=C2C(O)=C1 HR105700 [0,0,0,0,0,1|3,0,0]=4 363 B13R2.328 Oc1nc(O)c2ccccc2n1 HR126968 [0,0,0,0,0,1|3,0,0]=4 364 B13R2.369 BrC1=CC2=CC=CC=C2C=C1Br HR119870 [0,0,0,0,0,1|3,0,0]=4 365 B13R2.369 BrC1=CC2=CC=CC=C2N=C1Br HR114487 [0,0,0,0,0,1|3,0,0]=4 366 B13R2.369 BrC1=CC2=CC=CC=C2N=C1I HR153219 [0,0,0,0,0,1|3,0,0]=4 367 B13R2.369 CC1=C(Br)C=C2C=CC=NC2=C1 HR144289 [0,0,0,0,0,1|3,0,0]=4 368 B13R2.369 CC1=C(C)C=C2N=CC=NC2=C1 HR142734 [0,0,0,0,0,1|3,0,0]=4 369 B13R2.369 CC1=C(Cl)C=C2C=CC=NC2=C1 HR143512 [0,0,0,0,0,1|3,0,0]=4 370 B13R2.369 CC1=C(Cl)C=C2N=CC=CC2=C1 HR154964 [0,0,0,0,0,1|3,0,0]=4 371 B13R2.369 CC1=C(F)C=C2C=NC=CC2=C1 HR104907 [0,0,0,0,0,1|3,0,0]=4 372 B13R2.369 CC1=C(O)C=C2C=CC=NC2=C1 HR33575 [0,0,0,0,0,1|3,0,0]=4 373 B13R2.369 CC1=CC2=CC=CC=C2C=C1C HR142272 [0,0,0,0,0,1|1,0,0]=2 374 B13R2.369 CC1=CC2=CC=CC=C2N=C1Br HR121617 [0,0,0,0,0,1|2,0,0]=3 375 B13R2.369 CC1=CC2=CC=CC=C2N=C1Cl HR132030 [0,0,0,0,0,1|2,0,0]=3 376 B13R2.369 CC1=NC2=CC=CC=C2C=C1Cl HR146442 [0,0,0,0,0,1|2,0,0]=3 377 B13R2.369 CC1=NC2=CC=CC=C2C=C1N HR147334 [0,0,0,0,0,1|2,0,0]=3 378 B13R2.369 CC1=NC2=CC=CC=C2C=C1O HR146469 [0,0,0,0,0,1|2,0,0]=3 379 B13R2.369 CC1=NC2=CC=CC=C2N=C1C HR142855 [0,0,0,0,0,1|1,0,0]=2 380 B13R2.369 CC1=NC2=CC=CC=C2N=C1Cl HR111852 [0,0,0,0,0,1|2,0,0]=3 381 B13R2.369 CC1OC2=C(C=CC=C2)NC1=O HR146367 [0,0,0,0,0,1|1,0,1]=3 382 B13R2.369 ClC1=NC2=CC=CC=C2C=C1Br HR111522 [0,0,0,0,0,1|3,0,0]=4 383 B13R2.369 ClC1=NC2=CC=CC=C2C=C1I HR106905 [0,0,0,0,0,1|3,0,0]=4 384 B13R2.369 ClC1=NC2=CC=CC=C2N=C1Cl HR131951 [0,0,0,0,0,1|3,0,0]=4 385 B13R2.369 NC1=CC2=CC=CC=C2C=C1N HR140719 [0,0,0,0,0,1|3,0,0]=4 386 B13R2.369 NC1=CC2=CC=CC=C2OC1=O HR102651 [0,0,0,0,0,1|2,0,0]=3 387 B13R2.369 NC1=NC2=CC=CC=C2N=C1Cl HR117504 [0,0,0,0,0,1|3,0,0]=4 388 B13R2.369 O=C1NC2=CC=CC=C2C=C1Br HR109223 [0,0,0,0,0,1|3,0,0]=4 389 B13R2.369 OC1=CC2=CC=CC=C2C=C1O HR136367 [0,0,0,0,0,1|3,0,0]=4 390 B13R2.369 OC1=CC2=CC=CC=C2N=C1Br HR155169 [0,0,0,0,0,1|3,0,0]=4 391 B13R2.369 OC1=NC2=CC=CC=C2N=C1O HR131559 [0,0,0,0,0,1|3,0,0]=4 392 B10R1.15 C=CC(=O)C1=CC=CC=C1 HR110349 [1,0,1,0,0,0|1,0,1]=4 393 B10R1.15 CC(C=O)C1=CC=CC=C1 HR143142 [1,0,1,0,0,0|0,0,2]=4 394 B10R1.15 CC(CO)C1=CC=CC=C1 HR140328 [1,0,1,0,0,0|0,0,2]=4 395 B10R1.15 CCN(C)C1=CC=CC=C1 HR129175 [1,0,1,0,0,0|1,0,1]=4 396 B10R1.15 CN(C=O)C1=CC=CC=C1 HR123710 [1,0,1,0,0,0|1,0,1]=4 397 B10R1.15 CNC(=O)C1=CC=CC=C1 HR142749 [1,0,1,0,0,0|2,0,0]=4 398 B10R1.15 CNC(C)C1=CC=CC=C1 HR114656 [1,0,1,0,0,0|1,0,1]=4 399 B10R1.15 CNC(C)C1=CC=CC=C1 HR120386 [1,0,1,0,0,0|1,0,1]=4 400 B10R1.15 C\C(=N/O)C1=CC=CN=C1 HR118849 [1,0,1,0,0,0|2,0,0]=4 401 B10R1.15 C\C(=N\O)C1=CC=CC=C1 HR142652 [1,0,1,0,0,0|1,0,0]=3 402 B10R1.15 N\C(=N/O)C1=CC=CC=C1 HR121947 [1,0,1,0,0,0|2,0,0]=4 403 B10R1.15 O=C(CO)C1=CC=CC=C1 HR130474 [1,0,1,0,0,0|1,0,1]=4 404 B10R1.15 O=C(NO)C1=CC=CC=C1 HR107221 [1,0,1,0,0,0|2,0,0]=4 405 B10R1.15 O=CC(=O)C1=CC=CC=C1 HR101665 [1,0,1,0,0,0|1,0,1]=4 406 B10R1.15 O\N=C(\Cl)C1=CC=CC=C1 HR139027 [1,0,1,0,0,0|2,0,0]=4 407 B10R1.18 C=C(C)CC1=CC=CC=C1 HR102748 [1,0,1,0,0,0|1,0,0]=3 408 B10R1.18 CC(=O)OC1=CC=CC=C1 HR100385 [1,0,1,0,0,0|1,0,0]=3 409 B10R1.18 CC(=O)SC1=CC=CC=C1 HR139271 [1,0,1,0,0,0|1,0,1]=4 410 B10R1.18 CC(C)NC1=CC=CC=C1 HR128968 [1,0,1,0,0,0|1,0,1]=4 411 B10R1.18 CC(C)OC1=CC=CC=C1 HR137017 [1,0,1,0,0,0|0,0,1]=3 412 B10R1.18 CC(C)OC1=NC=CC=C1 HR152560 [1,0,1,0,0,0|1,0,1]=4 413 B10R1.18 CC(O)CC1=CC=CC=C1 HR126017 [1,0,1,0,0,0|0,0,2]=4 414 B10R1.18 CC(O)CC1=CC=CC=C1 HR141229 [1,0,1,0,0,0|0,0,2]=4 415 B10R1.18 C[Si](C)CC1=CC=CC=C1 HR116399 [1,0,1,0,0,0|1,1,0]=4 416 B10R1.18 O=C(Cl)OC1=CC=CC=C1 TOSA04608 [1,0,1,0,0,0|2,0,0]=4 417 B10R1.18 O=C(O)CC1=CC=CC=C1 ORJL013 [1,0,1,0,0,0|1,0,1]=4 418 B10R1.18 O=C(O)CC1=CC=CC=C1 ORJL01304 [1,0,1,0,0,0|1,0,1]=4 419 B10R1.18 S=C(Cl)Oc1ccccc1 HR130199 [1,0,1,0,0,0|2,0,0]=4 420 B10R1.17 C=CCOC1=CC=CC=C1 HR135359 [1,0,1,0,0,0|0,0,2]=4 421 B10R1.17 CCCOC1=CC=CC=C1 HR112246 [1,0,1,0,0,0|0,0,2]=4 422 B10R1.17 O=C\C=C\C1=CC=CC=C1 HR100316 [1,0,1,0,0,0|2,0,0]=4 423 B10R1.17 O=C\C=C\C1=CC=CC=C1 HR133706 [1,0,1,0,0,0|2,0,0]=4 424 B10R1.4 C=CCC1=C(O)C=CC=C1 HR126976 [1,0,1,0,0,0|0,0,2]=4 425 B10R1.4 CCNC1=CC=CC=C1C HR132311 [1,0,1,0,0,0|1,0,1]=4 426 B10R1.4 CCOC1=C(Br)C=CC=C1 HR3136 [1,0,1,0,0,0|1,0,1]=4 427 B10R1.4 CCOC1=C(Cl)C=CC=C1 HR143151 [1,0,1,0,0,0|1,0,1]=4 428 B10R1.4 CCOC1=C(F)C=CC=C1 HR153838 [1,0,1,0,0,0|1,0,1]=4 429 B10R1.4 CCOC1=C(O)C=CC=C1 HR134039 [1,0,1,0,0,0|1,0,1]=4 430 B10R1.4 CCOC1=CC=CN=C1C HR33539 [1,0,1,0,0,0|1,0,1]=4 431 B10R1.4 O\N=C\C1=CC=CC=C1O HR104932 [1,0,1,0,0,0|2,0,0]=4 432 B10R1.20 C#Cc1ccccc1OC HR116652 [1,0,1,0,0,0|0,0,2]=4 433 B10R1.20 CCC1=C(C=O)C=CC=C1 HR3074 [1,0,1,0,0,0|1,0,1]=4 434 B10R1.20 COC1=C(C#N)C=CC=C1 HR137785 [1,0,1,0,0,0|1,0,1]=4 435 B10R1.20 COC1=C(C=O)C=CC=C1 HR138920 [1,0,1,0,0,0|1,0,0]=3 436 B10R1.20 COC1=C(C=O)C=CN=C1 HR32565 [1,0,1,0,0,0|2,0,0]=4 437 B10R1.20 COC1=C(CBr)C=CC=C1 HR103693 [1,0,1,0,0,0|1,0,1]=4 438 B10R1.20 COC1=C(CCl)C=CC=C1 HR4651 [1,0,1,0,0,0|1,0,1]=4 439 B10R1.20 COC1=C(CN)C=CC=C1 HR123771 [1,0,1,0,0,0|1,0,1]=4 440 B10R1.20 COC1=C(CO)C=CC=C1 HR138804 [1,0,1,0,0,0|1,0,1]=4 441 B10R1.20 COC1=C(NN)C=CC=C1 HR118707 [1,0,1,0,0,0|2,0,0]=4 442 B10R1.20 COC1=C(OC)C=CC=C1 IVSA07604 [1,0,1,0,0,0|1,0,0]=3 443 B10R1.20 COC1=C(SC)C=CC=C1 HR140362 [1,0,1,0,0,0|1,0,0]=3 444 B10R1.20 COC1=C([Mg]Br)C=CC=C1 HR110211 [1,0,1,0,0,0|2,0,0]=4 445 B10R1.20 COC1=CC=CN=C1C=O HR109982 [1,0,1,0,0,0|2,0,0]=4 446 B10R1.20 COC1=CC=CN=C1OC HR126661 [1,0,1,0,0,0|2,0,0]=4 447 B10R1.20 COC1=CC=NC=C1C=O HR32629 [1,0,1,0,0,0|2,0,0]=4 448 B10R1.20 COC1=NC=CC=C1C=O HR138590 [1,0,1,0,0,0|2,0,0]=4 449 B10R1.20 CSC1=C(C=O)C=CC=C1 HR100305 [1,0,1,0,0,0|1,1,0]=4 450 B10R1.20 O=CC1=CC=CC=C1C=O HR135204 [1,0,1,0,0,0|2,0,0]=4 451 B10R1.61 CC(=O)C1=C(Cl)C=CC=C1 HR126524 [1,0,1,0,0,0|2,0,0]=4 452 B10R1.61 CC(=O)C1=C(F)C=CC=C1 HR127569 [1,0,1,0,0,0|2,0,0]=4 453 B10R1.61 CC(=O)C1=C(I)C=CC=C1 HR141132 [1,0,1,0,0,0|2,0,0]=4 454 B10R1.61 CC(=O)C1=C(O)C=CC=C1 HR100975 [1,0,1,0,0,0|1,0,0]=3 455 B10R1.61 CC(=O)C1=NC=CC=C1O HR105092 [1,0,1,0,0,0|2,0,0]=4 456 B10R1.61 CC(=O)c1ccccc1C HR134249 [1,0,1,0,0,0|2,0,0]=4 457 B10R1.61 CC(=O)c1ccccc1N HR124033 [1,0,1,0,0,0|2,0,0]=4 458 B10R1.61 CC(C)C1=C(Br)C=CC=C1 HR131947 [1,0,1,0,0,0|1,0,1]=4 459 B10R1.61 CC(C)C1=C(I)C=CC=C1 HR121483 [1,0,1,0,0,0|1,0,1]=4 460 B10R1.61 CC(C)C1=C(N)C=CC=C1 HR134764 [1,0,1,0,0,0|1,0,1]=4 461 B10R1.61 CC(C)C1=C(O)C=CC=C1 HR154250 [1,0,1,0,0,0|0,0,1]=3 462 B10R1.61 CC(C)C1=C(S)C=CC=C1 HR101470 [1,0,1,0,0,0|0,1,1]=4 463 B10R1.61 CC1=CC=CC=C1N(C)C HR127212 [1,0,1,0,0,0|2,0,0]=4 464 B10R1.61 CN(C)C1=C(Br)C=CC=C1 HR102758 [1,0,1,0,0,0|2,0,0]=4 465 B10R1.61 CN(C)C1=C(Cl)C=CC=C1 HR5269 [1,0,1,0,0,0|2,0,0]=4 466 B10R1.61 CN(C)C1=C(F)C=CC=C1 HR5243 [1,0,1,0,0,0|2,0,0]=4 467 B10R1.61 CN(C)C1=C(N)C=CC=C1 HR108369 [1,0,1,0,0,0|2,0,0]=4 468 B10R1.61 NC(=O)C1=CC=CC=C1O HR125402 [1,0,1,0,0,0|2,0,0]=4 469 B10R1.61 O=C(Cl)C1=C(O)C=CC=C1 HR123739 [1,0,1,0,0,0|2,0,0]=4 470 B10R1.61 O=C(O)C1=CC=CC=C1O HR100716 [1,0,1,0,0,0|2,0,0]=4 471 B10R1.61 O=C(O)C1=CC=CC=C1O HR125538 [1,0,1,0,0,0|2,0,0]=4 472 B10R1.61 O=C(O)C1=CC=CC=C1O HR125657 [1,0,1,0,0,0|2,0,0]=4 473 B10R1.61 O=C([O-])C1=C(O)C=CC=C1 HR105411 [1,0,1,0,0,0|2,0,0]=4 474 B10R1.61 O=C([O-])C1=CC=CC=C1O HR132880 [1,0,1,0,0,0|2,0,0]=4 475 B10R1.61 O=C([O-])C1=CC=CC=C1O HR133063 [1,0,1,0,0,0|2,0,0]=4 476 B10R1.61 O=C([O-])C1=CC=CC=C1O HR140036 [1,0,1,0,0,0|2,0,0]=4 477 B10R1.61 O=C([O-])C1=CC=CC=C1O HR140181 [1,0,1,0,0,0|2,0,0]=4 478 B10R1.61 O=C([O-])C1=CC=CC=C1O HR143915 [1,0,1,0,0,0|2,0,0]=4 479 B10R1.61 O=C([O-])c1ccccc1O HR133808 [1,0,1,0,0,0|2,0,0]=4 480 B10R1.61 O=C([O-])c1ccccc1O HR143157 [1,0,1,0,0,0|2,0,0]=4 481 B10R1.61 OC1=CC=CC=C1C(=S)S HR143624 [1,0,1,0,0,0|2,0,0]=4 482 B10R2.7 B1Oc2ccccc2O1 HR136518 [2,0,0,0,0,0|2,0,0]=4 483 B10R2.7 C1=CC2=C(C=C1)NC=N2 HR138078 [2,0,0,0,0,0|2,0,0]=4 484 B10R2.7 C1=CC2=C(C=C1)OC=N2 HR129960 [2,0,0,0,0,0|1,0,0]=3 485 B10R2.7 C1=CC2=C(C=C1)OCC2 HR135384 [2,0,0,0,0,0|0,0,2]=4 486 B10R2.7 C1=CC2=C(C=C1)OCO2 HR2537 [2,0,0,0,0,0|1,0,1]=4 487 B10R2.7 C1=CC2=C(C=C1)SC=C2 HR13545 [2,0,0,0,0,0|0,1,0]=3 488 B10R2.7 C1=CC2=C(C=C1)SC=N2 HR138741 [2,0,0,0,0,0|1,1,0]=4 489 B10R2.7 C1=CC2=C(C=CS2)C=N1 HR30741 [2,0,0,0,0,0|1,1,0]=4 490 B10R2.7 C1=CC2=CC=CN2C=C1 HR30562 [2,0,0,0,0,0|2,0,0]=4 491 B10R2.7 C1=CC2=CC=NC=C2N1 HR150062 [2,0,0,0,0,0|2,0,0]=4 492 B10R2.7 C1=CC2=CC=NC=C2N1 HR30088 [2,0,0,0,0,0|2,0,0]=4 493 B10R2.7 C1=CC2=CC=NC=C2S1 HR30736 [2,0,0,0,0,0|1,1,0]=4 494 B10R2.7 C1=CC2=CC=NN2C=C1 HR105656 [2,0,0,0,0,0|2,0,0]=4 495 B10R2.7 C1=CC2=CN=CC=C2N1 HR7676 [2,0,0,0,0,0|2,0,0]=4 496 B10R2.7 C1=CC2=NC=CN2C=C1 HR104442 [2,0,0,0,0,0|2,0,0]=4 497 B10R2.7 C1=CC=C2CC=CC2=C1 HR133696 [2,0,0,0,0,0|1,0,0]=3 498 B10R2.7 C1=CC=C2NC=CC2=C1 DISA00101 [2,0,0,0,0,0|1,0,0]=3 499 B10R2.7 C1=CC=C2NN=CC2=C1 HR121830 [2,0,0,0,0,0|2,0,0]=4 500 B10R2.7 C1=CN=C2C=CNC2=C1 HR30086 [2,0,0,0,0,0|2,0,0]=4 501 B10R2.7 C1=CN=C2C=COC2=C1 HR106087 [2,0,0,0,0,0|1,0,0]=3 502 B10R2.7 C1=CN=C2C=CSC2=C1 HR148516 [2,0,0,0,0,0|1,1,0]=4 503 B10R2.7 C1=CN=C2NC=CC2=C1 HR7679 [2,0,0,0,0,0|2,0,0]=4 504 B10R2.7 C1=CN=C2SC=CC2=C1 HR30727 [2,0,0,0,0,0|1,1,0]=4 505 B10R2.7 c1ccc2occc2c1 HR147599 [2,0,0,0,0,0|0,0,0]=2 506 B12R1.20 CC(=O)C(=O)C1=CC=C(Cl)C=C1 HR106867 [0,1,1,0,0,0|1,0,1]=4 507 B12R1.20 CC(=O)N(C)C1=CC=C(N)C=C1 HR138672 [0,1,1,0,0,0|1,0,1]=4 508 B12R1.20 CC(C(=O)O)C1=CC=C(Cl)C=C1 HR123608 [0,1,1,0,0,0|1,0,1]=4 509 B12R1.20 CC(C(=O)O)C1=CC=C(F)C=C1 HR147875 [0,1,1,0,0,0|1,0,1]=4 510 B12R1.20 CC1=CC=C(C(C)C(=O)O)C=C1 HR124512 [0,1,1,0,0,0|1,0,1]=4 511 B12R1.34 CN(C(=O)CBr)C1=CC=CC=C1 HR108422 [0,1,1,0,0,0|1,0,1]=4 512 B12R1.34 COC(=O)C(=O)C1=CC=CC=C1 HR137616 [0,1,1,0,0,0|1,0,1]=4 513 B12R1.34 CON(C)C(=O)C1=CC=CC=C1 HR121091 [0,1,1,0,0,0|2,0,0]=4 514 B12R1.34 C\C(=N/O)C(=O)C1=CC=CC=C1 HR132645 [0,1,1,0,0,0|1,0,0]=3 515 B12R1.225 CC(C(=O)O)C1=CC(Br)=CC=C1 HR114229 [0,1,1,0,0,0|1,0,1]=4 516 B12R1.225 CC(C(=O)O)C1=CC(Cl)=CC=C1 HR140447 [0,1,1,0,0,0|1,0,1]=4 517 B12R1.225 CC(O)C(=O)C1=CC(Cl)=CC=C1 HR100189 [0,1,1,0,0,0|1,0,1]=4 518 B12R1.225 CC1=CC(C(C)C(=O)O)=CC=C1 HR32700 [0,1,1,0,0,0|1,0,1]=4 519 B12R1.253 CC(C)(C(=O)O)C1=CC=CC=C1 HR128135 [0,1,1,0,0,0|1,0,1]=4 520 B12R1.478 CCC(C(=O)O)C1=CC=CC=C1 HR124335 [0,1,1,0,0,0|1,0,1]=4 521 B12R1.478 CCC(C(=O)O)c1ccccc1 HR144000 [0,1,1,0,0,0|1,0,1]=4 522 B12R1.478 COC(C(=O)O)c1ccccc1 HR110570 [0,1,1,0,0,0|1,0,1]=4 523 B12R1.478 COC(C(=O)O)c1ccccc1 HR143455 [0,1,1,0,0,0|1,0,1]=4 524 B12R1.564 CC(C)(O)C(=O)C1=CC=CC=C1 HR137062 [0,1,1,0,0,0|1,0,1]=4 525 B12R1.32 CCCC(=O)OC1=CC=CC=C1 HR119436 [0,1,1,0,0,0|1,0,1]=4 526 B12R1.32 CCCC(=O)OC1=CC=CC=C1 HR134591 [0,1,1,0,0,0|1,0,1]=4 527 B12R1.43 C=C(C)C(=O)OC1=CC=CC=C1 HR138708 [0,1,1,0,0,0|1,0,0]=3 528 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O HR104381 [0,1,1,0,0,0|1,0,1]=4 529 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O HR125623 [0,1,1,0,0,0|1,0,1]=4 530 B12R1.43 C\C(=C\C1=CC=CC=C1)C(=O)O HR137111 [0,1,1,0,0,0|2,0,0]=4 531 B12R1.50 CNC(=O)Oc1cccc(C)c1 HR124916 [0,1,1,0,0,0|2,0,0]=4 532 B12R1.75 CC(C)OC1=C(C=O)C=CC=C1 HR108932 [0,1,1,0,0,0|1,0,1]=4 533 B12R1.75 COC1=C(CC(C)=O)C=CC=C1 HR135071 [0,1,1,0,0,0|2,0,0]=4 534 B12R1.75 COC1=C(OC(=O)Cl)C=CC=C1 HR101165 [0,1,1,0,0,0|2,0,0]=4 535 B12R1.75 COC1=C(OC(C)=O)C=CC=C1 HR100888 [0,1,1,0,0,0|1,0,0]=3 536 B12R1.75 COC1=CC=CC=C1OC(=O)O HR133590 [0,1,1,0,0,0|2,0,0]=4 537 B12R1.75 CSc1ccccc1NC(C)=O HR109602 [0,1,1,0,0,0|2,0,0]=4 538 B12R1.112 CCOC1=C(C=O)C=C(Br)C=C1 HR109305 [0,1,1,0,0,0|1,0,1]=4 539 B12R1.112 CCOC1=C(C=O)C=C(C)C=C1 HR155911 [0,1,1,0,0,0|1,0,1]=4 540 B12R1.112 CCOC1=C(C=O)C=C(Cl)C=C1 HR154490 [0,1,1,0,0,0|1,0,1]=4 541 B12R1.121 C=CCOC1=C(C=O)C=CC=C1 HR141119 [0,1,1,0,0,0|1,0,1]=4 542 B12R1.121 COC1=C(OCCN)C=CC=C1 HR128978 [0,1,1,0,0,0|1,0,1]=4 543 B12R1.121 COC1=C(OCCN)C=CC=C1 HR129242 [0,1,1,0,0,0|1,0,1]=4 544 B12R1.121 COCOC1=C(OC)C=CC=C1 HR155304 [0,1,1,0,0,0|1,0,1]=4 545 B12R1.169 CCOC1=C(OCC)C=CC=C1 HR122356 [0,1,1,0,0,0|0,0,2]=4 546 B12R1.268 CCOC1=C(C=O)C=CC(C)=C1 HR156500 [0,1,1,0,0,0|1,0,1]=4 547 B12R1.283 CCOC1=C(C(=N)N)C=CC=C1 HR127699 [0,1,1,0,0,0|1,0,1]=4 548 B12R1.283 CCOC1=C(C(=O)Cl)C=CC=C1 HR134203 [0,1,1,0,0,0|1,0,1]=4 549 B12R1.283 CCOC1=C(C(=O)O)C=CC=C1 HR133665 [0,1,1,0,0,0|1,0,1]=4 550 B12R1.283 CCOC1=C(C(N)=O)C=CC=C1 HR132647 [0,1,1,0,0,0|1,0,1]=4 551 B12R1.24 COC(=O)C1=C(O)C(C)=CC=C1 HR135951 [0,1,1,0,0,0|2,0,0]=4 552 B12R1.24 COC(=O)C1=C(O)C(Cl)=CC=C1 HR148300 [0,1,1,0,0,0|2,0,0]=4 553 B12R1.24 COC(=O)C1=C(O)C(N)=CC=C1 HR117273 [0,1,1,0,0,0|2,0,0]=4 554 B12R1.24 COC(=O)C1=C(O)C(O)=CC=C1 HR143534 [0,1,1,0,0,0|2,0,0]=4 555 B12R1.195 CCC(C)(C)C1=C(O)C=CC=C1 HR118263 [0,1,1,0,0,0|0,0,2]=4 556 B12R1.308 CCCC(=O)c1ccccc1O HR131433 [0,1,1,0,0,0|1,0,1]=4 557 B12R1.308 CCOC(=O)C1=C(O)C=CC=C1 HR133809 [0,1,1,0,0,0|1,0,1]=4 558 B12R1.308 O=C(NCO)C1=C(O)C=CC=C1 HR110287 [0,1,1,0,0,0|2,0,0]=4 559 B12R1.354 COC(=O)C1=C(O)C=CC(Br)=C1 ELXM02406 [0,1,1,0,0,0|2,0,0]=4 560 B12R1.354 COC(=O)C1=C(O)C=CC(Cl)=C1 HR125728 [0,1,1,0,0,0|2,0,0]=4 561 B12R1.354 COC(=O)C1=C(O)C=CC(O)=C1 HR125415 [0,1,1,0,0,0|2,0,0]=4 562 B12R1.354 COC(=O)C1=CC(C)=CC=C1O HR129827 [0,1,1,0,0,0|2,0,0]=4 563 B12R1.354 COC(=O)C1=CC(I)=CC=C1O HR121630 [0,1,1,0,0,0|2,0,0]=4 564 B12R1.1703 CCC(=O)C1=C(O)C=C(O)C=C1 HR119761 [0,1,1,0,0,0|1,0,1]=4 565 B12R1.1703 COC(=O)C1=C(O)C=C(F)C=C1 HR113165 [0,1,1,0,0,0|2,0,0]=4 566 B12R1.1703 COC(=O)C1=C(O)C=C(N)C=C1 HR134223 [0,1,1,0,0,0|2,0,0]=4 567 B12R1.1703 COC(=O)C1=C(O)C=C(O)C=C1 HR128923 [0,1,1,0,0,0|2,0,0]=4 568 B12R1.1703 COC(=O)C1=CC=C(C)C=C1O HR135901 [0,1,1,0,0,0|2,0,0]=4 569 B12R1.3441 COC(=O)C1=C(Cl)C=CC=C1O HR154062 [0,1,1,0,0,0|2,0,0]=4 570 B12R2.1 C#CC1=CNC2=CC=CC=C12 HR113688 [1,1,0,0,0,0|1,0,1]=4 571 B12R2.1 CCC1=C2C=CC=CC2=NN1 HR121575 [1,1,0,0,0,0|2,0,0]=4 572 B12R2.1 CCC1=CNC2=CC=CC=C12 HR104764 [1,1,0,0,0,0|1,0,0]=3 573 B12R2.1 CCN1C=CC2=CC=CC=C21 HR119451 [1,1,0,0,0,0|2,0,0]=4 574 B12R2.1 CCN1C=NC2=C1C=CC=C2 HR109955 [1,1,0,0,0,0|2,0,0]=4 575 B12R2.1 ClCC1=C2C=CC=CC2=NN1 HR121450 [1,1,0,0,0,0|2,0,0]=4 576 B12R2.1 N#CC1=CNC2=CC=CC=C12 HR124931 [1,1,0,0,0,0|1,0,1]=4 577 B12R2.1 N#CC1=CSC2=C1C=CC=C2 HR105920 [1,1,0,0,0,0|0,1,1]=4 578 B12R2.1 NCC1=C2C=CC=CC2=NN1 HR113411 [1,1,0,0,0,0|2,0,0]=4 579 B12R2.1 NCC1=CNC2=CC=CC=C12 HR141131 [1,1,0,0,0,0|1,0,0]=3 580 B12R2.1 NCC1=CSC2=C1C=CC=C2 HR119643 [1,1,0,0,0,0|0,1,0]=3 581 B12R2.1 NCc1csc2ccccc12 HR106980 [1,1,0,0,0,0|0,1,0]=3 582 B12R2.1 O=CC1=CNC2=CC=CC=C12 HR125204 [1,1,0,0,0,0|1,0,1]=4 583 B12R2.1 O=CC1=COC2=NC=CC=C12 HR120258 [1,1,0,0,0,0|1,0,1]=4 584 B12R2.1 O=CC1=CSC2=C1C=CC=C2 HR33608 [1,1,0,0,0,0|0,1,1]=4 585 B12R2.1 OCC1=CN=C2C=CC=CN12 HR105977 [1,1,0,0,0,0|2,0,0]=4 586 B12R2.1 OCC1=CNC2=CC=CC=C12 HR124661 [1,1,0,0,0,0|1,0,0]=3 587 B12R2.1 OCC1=CSC2=C1C=CC=C2 HR113021 [1,1,0,0,0,0|0,1,0]=3 588 B12R2.1 OCC1=NNC2=CC=CC=C21 HR107015 [1,1,0,0,0,0|2,0,0]=4 589 B12R2.132 BrC1=CC2=C(C=C1)OC=C2Br HR101865 [1,1,0,0,0,0|1,0,0]=3 590 B12R2.132 CC1=C2C=C(Cl)C=CC2=NO1 HR32737 [1,1,0,0,0,0|2,0,0]=4 591 B12R2.132 CC1=CC2=C(C=C1)SC=C2C HR141084 [1,1,0,0,0,0|0,1,0]=3 592 B12R2.132 CC1=CC=C2NC=C(Br)C2=C1 HR121989 [1,1,0,0,0,0|2,0,0]=4 593 B12R2.132 CC1=CN=C2C=CC(Cl)=CN12 HR112611 [1,1,0,0,0,0|2,0,0]=4 594 B12R2.132 CC1=CNC2=CC=C(Br)C=C12 HR106393 [1,1,0,0,0,0|1,0,0]=3 595 B12R2.132 CC1=CNC2=CC=C(F)C=C12 HR118842 [1,1,0,0,0,0|1,0,0]=3 596 B12R2.132 CC1=CNC2=CC=C(O)N=C12 HR122068 [1,1,0,0,0,0|2,0,0]=4 597 B12R2.132 CC1=COC2=C1C=C(Br)C=C2 HR30696 [1,1,0,0,0,0|0,0,0]=2 598 B12R2.132 CC1=COC2=C1C=C(F)C=C2 HR150421 [1,1,0,0,0,0|0,0,0]=2 599 B12R2.132 CC1=CSC2=C1C=C(Br)C=C2 HR30672 [1,1,0,0,0,0|0,1,0]=3 600 B12R2.132 CC1=CSC2=C1C=C(Cl)C=C2 HR31390 [1,1,0,0,0,0|0,1,0]=3 601 B12R2.132 CC1=CSC2=C1C=C(F)C=C2 HR31391 [1,1,0,0,0,0|0,1,0]=3 602 B12R2.132 CC1=NNC2=CC=C(Br)C=C21 HR7815 [1,1,0,0,0,0|2,0,0]=4 603 B12R2.132 CC1=NNC2=CC=C(Cl)C=C21 HR30767 [1,1,0,0,0,0|2,0,0]=4 604 B12R2.132 CC1=NNC2=CC=C(F)C=C21 HR30514 [1,1,0,0,0,0|2,0,0]=4 605 B12R2.132 CC1=NNC2=CC=C(I)C=C21 HR30512 [1,1,0,0,0,0|2,0,0]=4 606 B12R2.132 CC1=NNC2=CC=C(N)C=C21 HR7825 [1,1,0,0,0,0|2,0,0]=4 607 B12R2.132 CC1=NNC2=CC=C(O)C=C21 HR30774 [1,1,0,0,0,0|2,0,0]=4 608 B12R2.132 CC1=NOC2=C1C=C(O)C=C2 HR116039 [1,1,0,0,0,0|1,0,0]=3 609 B12R2.132 ClC1=CC=C2NC=C(Br)C2=C1 HR8326 [1,1,0,0,0,0|2,0,0]=4 610 B12R2.132 NC1=CNC2=CC=C(Br)C=C12 HR115931 [1,1,0,0,0,0|2,0,0]=4 611 B12R2.132 NC1=CNC2=CC=C(Br)C=C12 HR9446 [1,1,0,0,0,0|2,0,0]=4 612 B12R2.132 NC1=NOC2=C1C=C(Br)C=C2 HR146881 [1,1,0,0,0,0|2,0,0]=4 613 B12R2.132 NC1=NOC2=C1C=C(F)C=C2 HR107116 [1,1,0,0,0,0|2,0,0]=4 614 B12R2.132 O=C1COC2=C1C=C(Br)C=C2 HR105683 [1,1,0,0,0,0|1,0,1]=4 615 B12R2.132 O=C1COC2=C1C=C(Cl)C=C2 HR109616 [1,1,0,0,0,0|1,0,1]=4 616 B12R2.196 CC1=CNC2=[N+]([O-])C=CC=C12 HR116216 [1,1,0,0,0,0|2,0,0]=4 617 B12R2.196 CC1=COC2=C1C=CC=C2Br HR30688 [1,1,0,0,0,0|0,0,0]=2 618 B12R2.196 CC1=CSC2=C1C=CC=C2Br HR31393 [1,1,0,0,0,0|0,1,0]=3 619 B12R2.196 CC1=CSC2=C1C=CC=C2Cl HR141513 [1,1,0,0,0,0|0,1,0]=3 620 B12R2.196 CC1=NNC2=C(Br)C=CC=C12 HR30509 [1,1,0,0,0,0|2,0,0]=4 621 B12R2.196 CC1=NNC2=C(F)C=CC=C12 HR30506 [1,1,0,0,0,0|2,0,0]=4 622 B12R2.196 CC1=NNC2=C(N)C=CC=C12 HR31294 [1,1,0,0,0,0|2,0,0]=4 623 B12R2.196 CC1=NNC2=C(O)C=CC=C12 HR147036 [1,1,0,0,0,0|2,0,0]=4 624 B12R2.196 CN1C=CC2=C(Br)C=CC=C21 HR139113 [1,1,0,0,0,0|2,0,0]=4 625 B12R2.196 CN1C=CC2=C1C=CC=C2O HR148416 [1,1,0,0,0,0|2,0,0]=4 626 B12R2.196 O=C1COC2=C1C=CC=C2Br HR147564 [1,1,0,0,0,0|1,0,1]=4 627 B12R2.203 CC1=CN=C2C=CC=C(Br)N12 HR143852 [1,1,0,0,0,0|2,0,0]=4 628 B12R2.203 CC1=CNC2=CC=CC(Br)=C12 HR139201 [1,1,0,0,0,0|1,0,0]=3 629 B12R2.203 CC1=CNC2=NC=CC(Cl)=C12 HR148250 [1,1,0,0,0,0|2,0,0]=4 630 B12R2.203 CC1=CSC2=C1C(Br)=CC=C2 HR30673 [1,1,0,0,0,0|0,1,0]=3 631 B12R2.203 CC1=CSC2=C1C(Cl)=CC=C2 HR31392 [1,1,0,0,0,0|0,1,0]=3 632 B12R2.203 CC1=NNC2=C1C(N)=CC=C2 HR30536 [1,1,0,0,0,0|2,0,0]=4 633 B12R2.203 CC1=NNC2=C1C(O)=CC=C2 HR30768 [1,1,0,0,0,0|2,0,0]=4 634 B12R2.203 CC1=NNC2=CC=CC(Br)=C21 HR30508 [1,1,0,0,0,0|2,0,0]=4 635 B12R2.203 CC1=NNC2=CC=CC(Cl)=C21 HR30769 [1,1,0,0,0,0|2,0,0]=4 636 B12R2.203 CC1=NNC2=CC=CC(F)=C21 HR30513 [1,1,0,0,0,0|2,0,0]=4 637 B12R2.203 NC1=NOC2=C1C(Br)=CC=C2 HR148496 [1,1,0,0,0,0|2,0,0]=4 638 B12R2.612 BrC1=CC2=C(C=C1)C(Br)=CS2 HR155320 [1,1,0,0,0,0|1,1,0]=4 639 B12R2.612 CC1=C2C=CC(=O)C=C2ON1 HR120331 [1,1,0,0,0,0|1,0,0]=3 640 B12R2.612 CC1=CC2=NNC(C)=C2C=C1 HR102979 [1,1,0,0,0,0|2,0,0]=4 641 B12R2.612 CC1=CC=C2C(Br)=CNC2=C1 HR102449 [1,1,0,0,0,0|2,0,0]=4 642 B12R2.612 CC1=COC2=C1C=CC(Br)=C2 HR30695 [1,1,0,0,0,0|0,0,0]=2 643 B12R2.612 CC1=CSC2=C1C=CC(Br)=C2 HR30666 [1,1,0,0,0,0|0,1,0]=3 644 B12R2.612 CC1=CSC2=C1C=CC(Cl)=C2 HR31389 [1,1,0,0,0,0|0,1,0]=3 645 B12R2.612 CC1=NNC2=CC(Br)=CC=C21 HR30507 [1,1,0,0,0,0|2,0,0]=4 646 B12R2.612 CC1=NNC2=CC(Cl)=CC=C21 HR30762 [1,1,0,0,0,0|2,0,0]=4 647 B12R2.612 CC1=NNC2=CC(F)=CC=C21 HR30515 [1,1,0,0,0,0|2,0,0]=4 648 B12R2.612 CC1=NNC2=CC(I)=CC=C21 HR30761 [1,1,0,0,0,0|2,0,0]=4 649 B12R2.612 CC1=NNC2=CC(N)=CC=C21 HR30764 [1,1,0,0,0,0|2,0,0]=4 650 B12R2.612 CC1=NNC2=CC(O)=CC=C21 HR30766 [1,1,0,0,0,0|2,0,0]=4 651 B12R2.612 CC1=NOC2=C1C=CC(Cl)=C2 HR118570 [1,1,0,0,0,0|1,0,0]=3 652 B12R2.612 CN1C=CC2=CC(Br)=CC=C21 HR118531 [1,1,0,0,0,0|2,0,0]=4 653 B12R2.612 CN1C=CC2=CC(N)=CC=C21 HR140939 [1,1,0,0,0,0|2,0,0]=4 654 B12R2.612 CN1C=NC2=C1C=CC(Br)=C2 HR31852 [1,1,0,0,0,0|2,0,0]=4 655 B12R2.612 CN1C=NC2=C1C=CC(N)=C2 HR106200 [1,1,0,0,0,0|2,0,0]=4 656 B12R2.612 ClC1=NOC2=C1C=CC(Br)=C2 HR31880 [1,1,0,0,0,0|2,0,0]=4 657 B12R2.612 NC1=NOC2=C1C=CC(Br)=C2 HR113440 [1,1,0,0,0,0|2,0,0]=4 658 B12R2.612 NC1=NOC2=C1C=CC(F)=C2 HR147920 [1,1,0,0,0,0|2,0,0]=4 659 B12R2.612 O=C1COC2=C1C=CC(Br)=C2 HR107089 [1,1,0,0,0,0|1,0,1]=4 660 B12R2.612 O=C1COC2=C1C=CC(Cl)=C2 HR112216 [1,1,0,0,0,0|1,0,1]=4 661 B12R2.612 O=C1COC2=C1C=CC(O)=C2 HR30479 [1,1,0,0,0,0|1,0,1]=4 662 B12R2.612 OC1=NOC2=C1C=CC(Cl)=C2 HR11268 [1,1,0,0,0,0|2,0,0]=4 663 B12R2.2028 CC1=CN(C)C2=NC=CC=C12 HR150041 [1,1,0,0,0,0|2,0,0]=4 664 B12R2.2028 CN1C=C(Br)C2=CC=CC=C21 HR30357 [1,1,0,0,0,0|2,0,0]=4 665 B12R2.2403 CC1(C)C=CC2=CC=CC=C21 HR121264 [1,1,0,0,0,0|1,0,1]=4 666 B12R2.32 BrCC1=NC2=C(C=CC=C2)O1 HR148249 [1,1,0,0,0,0|1,0,0]=3 667 B12R2.32 BrCC1=NC2=C(C=CC=C2)S1 HR107414 [1,1,0,0,0,0|1,1,0]=4 668 B12R2.32 CCC1=CC2=C(C=CC=C2)O1 HR138004 [1,1,0,0,0,0|0,0,0]=2 669 B12R2.32 CCC1=CC2=CC=CC=C2N1 HR109310 [1,1,0,0,0,0|1,0,0]=3 670 B12R2.32 CCC1=NC2=C(C=CC=C2)N1 HR102583 [1,1,0,0,0,0|2,0,0]=4 671 B12R2.32 CSC1=CN2C=CC=CC2=C1 HR32055 [1,1,0,0,0,0|2,0,0]=4 672 B12R2.32 CSC1=NC2=C(C=CC=C2)O1 HR139781 [1,1,0,0,0,0|1,0,0]=3 673 B12R2.32 CSC1=NC2=C(C=CC=C2)S1 HR124456 [1,1,0,0,0,0|1,1,0]=4 674 B12R2.32 CSC1=NC2=NC=CC=C2O1 HR111499 [1,1,0,0,0,0|2,0,0]=4 675 B12R2.32 ClCC1=CN2C=CC=CC2=N1 HR114191 [1,1,0,0,0,0|2,0,0]=4 676 B12R2.32 ClCC1=NC2=C(C=CC=C2)N1 HR127014 [1,1,0,0,0,0|2,0,0]=4 677 B12R2.32 ClCC1=NC2=C(C=CC=C2)O1 HR32326 [1,1,0,0,0,0|1,0,0]=3 678 B12R2.32 ClCC1=NC2=C(C=CC=C2)S1 HR129468 [1,1,0,0,0,0|1,1,0]=4 679 B12R2.32 ClCC1=NC2=CC=CN=C2O1 HR33983 [1,1,0,0,0,0|2,0,0]=4 680 B12R2.32 ClCC1=NC2=NC=CC=C2O1 HR110863 [1,1,0,0,0,0|2,0,0]=4 681 B12R2.32 N#CC1=CC2=C(C=CC=C2)O1 HR147279 [1,1,0,0,0,0|0,0,1]=3 682 B12R2.32 N#CC1=CC2=C(C=CC=C2)S1 HR124017 [1,1,0,0,0,0|0,1,1]=4 683 B12R2.32 N#CC1=CC2=CC=CC=C2N1 HR111454 [1,1,0,0,0,0|1,0,1]=4 684 B12R2.32 NCC1=CC2=CC=CC=C2N1 HR106843 [1,1,0,0,0,0|1,0,0]=3 685 B12R2.32 NCC1=NC2=C(C=CC=C2)N1 HR116253 [1,1,0,0,0,0|2,0,0]=4 686 B12R2.32 NCC1=NC2=C(C=CC=C2)N1 HR146894 [1,1,0,0,0,0|2,0,0]=4 687 B12R2.32 NCC1=NC2=C(C=CC=C2)N1 HR147195 [1,1,0,0,0,0|2,0,0]=4 688 B12R2.32 NCC1=NC2=C(C=CC=C2)O1 HR119659 [1,1,0,0,0,0|1,0,0]=3 689 B12R2.32 O=CC1=CC2=C(C=CC=C2)O1 HR103989 [1,1,0,0,0,0|0,0,1]=3 690 B12R2.32 O=CC1=CC2=C(C=CC=C2)S1 HR117351 [1,1,0,0,0,0|0,1,1]=4 691 B12R2.32 O=CC1=CC2=CC=CC=C2N1 HR108877 [1,1,0,0,0,0|1,0,1]=4 692 B12R2.32 OCC1=CC2=C(C=CC=C2)S1 HR109171 [1,1,0,0,0,0|0,1,0]=3 693 B12R2.32 OCC1=CC2=CC=CC=C2C1 HR115476 [1,1,0,0,0,0|1,0,0]=3 694 B12R2.32 OCC1=CC2=CC=CC=C2N1 HR147165 [1,1,0,0,0,0|1,0,0]=3 695 B12R2.32 OCC1=CN2C=CC=CC2=N1 HR102090 [1,1,0,0,0,0|2,0,0]=4 696 B12R2.32 OCC1=NC2=C(C=CC=C2)N1 HR123022 [1,1,0,0,0,0|2,0,0]=4 697 B12R2.32 OCC1=NC2=C(C=CC=C2)O1 HR148532 [1,1,0,0,0,0|1,0,0]=3 698 B12R2.32 OCC1=NN2C=CC=CC2=C1 HR119402 [1,1,0,0,0,0|2,0,0]=4 699 B12R2.32 SCC1=NC2=C(C=CC=C2)N1 HR141716 [1,1,0,0,0,0|2,0,0]=4 700 B12R2.202 CC1=CC2=C(Br)C=CC=C2N1 HR106596 [1,1,0,0,0,0|1,0,0]=3 701 B12R2.202 CC1=CC2=C(Br)C=CN=C2N1 HR147930 [1,1,0,0,0,0|2,0,0]=4 702 B12R2.202 CC1=CC2=C(C=CN=C2Cl)N1 HR102527 [1,1,0,0,0,0|2,0,0]=4 703 B12R2.202 CC1=CC2=C(C=CNC2=O)S1 HR107686 [1,1,0,0,0,0|1,1,0]=4 704 B12R2.202 CC1=CC2=C(F)C=CC=C2N1 HR117022 [1,1,0,0,0,0|1,0,0]=3 705 B12R2.202 CC1=CC2=C(F)C=CN=C2N1 HR150009 [1,1,0,0,0,0|2,0,0]=4 706 B12R2.202 CC1=CC2=C(O)C=CC=C2N1 HR135762 [1,1,0,0,0,0|1,0,0]=3 707 B12R2.202 CC1=CC2=CC=NC(N)=C2N1 HR117661 [1,1,0,0,0,0|2,0,0]=4 708 B12R2.202 CC1=CC=CC2=C1N=C(C)S2 HR122005 [1,1,0,0,0,0|1,1,0]=4 709 B12R2.202 CC1=CN2C(Br)=CC=CC2=N1 HR30361 [1,1,0,0,0,0|2,0,0]=4 710 B12R2.202 CC1=CN2C(Cl)=CC=CC2=N1 HR111032 [1,1,0,0,0,0|2,0,0]=4 711 B12R2.202 CC1=CN2C=CC=C(N)C2=N1 HR103445 [1,1,0,0,0,0|2,0,0]=4 712 B12R2.202 CC1=CN2C=CC=C(N)C2=N1 HR147831 [1,1,0,0,0,0|2,0,0]=4 713 B12R2.202 CC1=CN2C=CC=C(O)C2=N1 HR103126 [1,1,0,0,0,0|2,0,0]=4 714 B12R2.202 CC1=NC2=C(C=CC=C2Br)N1 HR105430 [1,1,0,0,0,0|2,0,0]=4 715 B12R2.202 CC1=NC2=C(C=CC=C2Br)O1 HR32310 [1,1,0,0,0,0|1,0,0]=3 716 B12R2.202 CC1=NC2=C(O1)C(Br)=CC=C2 HR32311 [1,1,0,0,0,0|1,0,0]=3 717 B12R2.202 CN1C=C2C(Br)=CC=CC2=N1 HR112332 [1,1,0,0,0,0|2,0,0]=4 718 B12R2.202 CN1C=C2C(N)=CC=CC2=N1 HR147830 [1,1,0,0,0,0|2,0,0]=4 719 B12R2.202 CN1C=C2C=CC=C(Br)C2=N1 HR120218 [1,1,0,0,0,0|2,0,0]=4 720 B12R2.202 CN1C=C2C=CC=C(N)C2=N1 HR116891 [1,1,0,0,0,0|2,0,0]=4 721 B12R2.202 FC1=CC=CC2=C1N=C(Cl)O2 HR150577 [1,1,0,0,0,0|2,0,0]=4 722 B12R2.202 FC1=CC=CC2=C1OC(Cl)=N2 HR150475 [1,1,0,0,0,0|2,0,0]=4 723 B12R2.202 NC1=CC=CC2=C1OC(=O)N2 HR146401 [1,1,0,0,0,0|2,0,0]=4 724 B12R2.202 O=C1NC2=C(O1)C(Br)=CC=C2 HR146466 [1,1,0,0,0,0|2,0,0]=4 725 B12R2.606 CC1=CC2=C(C=C1)N=C(C)S2 HR120302 [1,1,0,0,0,0|1,1,0]=4 726 B12R2.606 CC1=CC2=C(C=C1)OC(C)=N2 HR128522 [1,1,0,0,0,0|1,0,0]=3 727 B12R2.606 CC1=CC2=C(C=C1)OC(N)=N2 HR111080 [1,1,0,0,0,0|2,0,0]=4 728 B12R2.606 CC1=CC2=C(C=C1)SC(C)=N2 HR123305 [1,1,0,0,0,0|1,1,0]=4 729 B12R2.606 CC1=CC2=C(C=CC(Br)=C2)O1 HR30687 [1,1,0,0,0,0|0,0,0]=2 730 B12R2.606 CC1=CC2=C(C=CC(O)=C2)O1 HR116354 [1,1,0,0,0,0|0,0,0]=2 731 B12R2.606 CC1=CC2=CC(Br)=CC=C2N1 HR118045 [1,1,0,0,0,0|1,0,0]=3 732 B12R2.606 CC1=CC2=CC(Br)=CN=C2N1 HR107152 [1,1,0,0,0,0|2,0,0]=4 733 B12R2.606 CC1=CC2=CC(Cl)=CC=C2N1 HR143821 [1,1,0,0,0,0|1,0,0]=3 734 B12R2.606 CC1=CC2=CC(Cl)=CN=C2N1 HR150090 [1,1,0,0,0,0|2,0,0]=4 735 B12R2.606 CC1=CC2=CC(F)=CC=C2N1 HR2158 [1,1,0,0,0,0|1,0,0]=3 736 B12R2.606 CC1=CC2=CC(F)=CN=C2N1 HR150089 [1,1,0,0,0,0|2,0,0]=4 737 B12R2.606 CC1=CC2=CC(N)=CC=C2N1 HR141033 [1,1,0,0,0,0|1,0,0]=3 738 B12R2.606 CC1=CC2=CC(N)=CN=C2N1 HR149931 [1,1,0,0,0,0|2,0,0]=4 739 B12R2.606 CC1=CC2=CC(O)=CC=C2N1 HR112883 [1,1,0,0,0,0|1,0,0]=3 740 B12R2.606 CC1=CC2=CC(S)=CC=C2N1 HR112574 [1,1,0,0,0,0|1,0,0]=3 741 B12R2.606 CC1=CC2=CC=C(Br)C=C2N1 HR112285 [1,1,0,0,0,0|1,0,0]=3 742 B12R2.606 CC1=CC2=CC=C(Cl)C=C2N1 HR148234 [1,1,0,0,0,0|1,0,0]=3 743 B12R2.606 CC1=CC2=CC=C(F)C=C2N1 HR143945 [1,1,0,0,0,0|1,0,0]=3 744 B12R2.606 CC1=CC2=CC=C(O)C=C2N1 HR102720 [1,1,0,0,0,0|1,0,0]=3 745 B12R2.606 CC1=CC2=NC=C(Br)C=C2N1 HR103155 [1,1,0,0,0,0|2,0,0]=4 746 B12R2.606 CC1=CC2=NC=C(Cl)C=C2N1 HR118601 [1,1,0,0,0,0|2,0,0]=4 747 B12R2.606 CC1=CC=C2NC(C)=CC2=C1 HR127570 [1,1,0,0,0,0|1,0,0]=3 748 B12R2.606 CC1=CN2C=C(I)C=CC2=N1 HR112295 [1,1,0,0,0,0|2,0,0]=4 749 B12R2.606 CC1=NC2=C(C=C(Br)C=C2)N1 HR118522 [1,1,0,0,0,0|2,0,0]=4 750 B12R2.606 CC1=NC2=C(C=C(Br)C=C2)S1 HR128659 [1,1,0,0,0,0|1,1,0]=4 751 B12R2.606 CC1=NC2=C(C=C(Cl)C=C2)N1 HR136782 [1,1,0,0,0,0|2,0,0]=4 752 B12R2.606 CC1=NC2=C(C=C(Cl)C=C2)O1 HR32323 [1,1,0,0,0,0|1,0,0]=3 753 B12R2.606 CC1=NC2=C(C=C(Cl)C=C2)S1 HR120938 [1,1,0,0,0,0|1,1,0]=4 754 B12R2.606 CC1=NC2=C(C=C(F)C=C2)S1 HR120625 [1,1,0,0,0,0|1,1,0]=4 755 B12R2.606 CC1=NC2=C(C=C(I)C=C2)N1 HR114976 [1,1,0,0,0,0|2,0,0]=4 756 B12R2.606 CC1=NC2=C(C=C(N)C=C2)N1 HR32321 [1,1,0,0,0,0|2,0,0]=4 757 B12R2.606 CC1=NC2=C(C=C(N)C=C2)O1 HR116255 [1,1,0,0,0,0|1,0,0]=3 758 B12R2.606 CC1=NC2=C(C=C(N)C=C2)S1 HR110799 [1,1,0,0,0,0|1,1,0]=4 759 B12R2.606 CC1=NC2=C(C=C(O)C=C2)O1 HR33681 [1,1,0,0,0,0|1,0,0]=3 760 B12R2.606 CC1=NC2=C(C=C(O)C=C2)S1 HR139875 [1,1,0,0,0,0|1,1,0]=4 761 B12R2.606 CC1=NC2=C(C=CC(Br)=C2)O1 HR32309 [1,1,0,0,0,0|1,0,0]=3 762 B12R2.606 CC1=NC2=C(C=CC(Br)=C2)S1 HR128395 [1,1,0,0,0,0|1,1,0]=4 763 B12R2.606 CC1=NC2=C(C=CC(Cl)=C2)O1 HR32324 [1,1,0,0,0,0|1,0,0]=3 764 B12R2.606 CC1=NC2=C(C=CC(Cl)=C2)S1 HR131847 [1,1,0,0,0,0|1,1,0]=4 765 B12R2.606 CC1=NC2=C(C=CC(F)=C2)N1 HR112203 [1,1,0,0,0,0|2,0,0]=4 766 B12R2.606 CC1=NC2=C(C=CC(N)=C2)S1 HR141816 [1,1,0,0,0,0|1,1,0]=4 767 B12R2.606 CC1=NC2=C(C=CC(O)=C2)O1 HR32635 [1,1,0,0,0,0|1,0,0]=3 768 B12R2.606 CC1=NC2=CC(Br)=CN=C2O1 HR32331 [1,1,0,0,0,0|2,0,0]=4 769 B12R2.606 CC1=NC2=NC=C(Br)C=C2O1 HR148433 [1,1,0,0,0,0|2,0,0]=4 770 B12R2.606 CN1C=C2C=C(Br)C=CC2=N1 HR114231 [1,1,0,0,0,0|2,0,0]=4 771 B12R2.606 CN1C=C2C=CC(Br)=CC2=N1 HR147917 [1,1,0,0,0,0|2,0,0]=4 772 B12R2.606 CN1C=C2C=CC(N)=CC2=N1 HR117213 [1,1,0,0,0,0|2,0,0]=4 773 B12R2.606 ClC1=CC2=C(C=C1)N=C(Cl)O2 HR133078 [1,1,0,0,0,0|2,0,0]=4 774 B12R2.606 ClC1=CC2=C(C=C1)OC(Cl)=N2 HR132249 [1,1,0,0,0,0|2,0,0]=4 775 B12R2.606 FC1=CC2=C(C=C1)N=C(Cl)O2 HR150474 [1,1,0,0,0,0|2,0,0]=4 776 B12R2.606 FC1=CC2=C(C=C1)OC(Cl)=N2 HR110316 [1,1,0,0,0,0|2,0,0]=4 777 B12R2.606 NC1=CC2=C(C=C1)OC(=O)C2 HR119959 [1,1,0,0,0,0|1,0,1]=4 778 B12R2.606 NC1=NC2=C(C=C(Br)C=C2)O1 HR33231 [1,1,0,0,0,0|2,0,0]=4 779 B12R2.606 NC1=NC2=C(C=C(Cl)C=C2)O1 HR102663 [1,1,0,0,0,0|2,0,0]=4 780 B12R2.606 NC1=NC2=C(C=CC(Br)=C2)O1 HR30372 [1,1,0,0,0,0|2,0,0]=4 781 B12R2.606 NC1=NC2=C(C=CC(Cl)=C2)O1 HR102973 [1,1,0,0,0,0|2,0,0]=4 782 B12R2.606 NC1=NC2=C(C=CC(F)=C2)O1 HR102340 [1,1,0,0,0,0|2,0,0]=4 783 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)O1 HR146343 [1,1,0,0,0,0|1,0,1]=4 784 B12R2.606 O=C1CC2=C(C=CC(O)=C2)O1 HR107063 [1,1,0,0,0,0|1,0,1]=4 785 B12R2.606 O=C1NC2=C(C=C(Cl)C=C2)O1 HR129367 [1,1,0,0,0,0|2,0,0]=4 786 B12R2.606 O=C1NC2=C(C=CC(Br)=C2)O1 HR33516 [1,1,0,0,0,0|2,0,0]=4 787 B12R2.606 O=C1OC2=C(C=C(O)C=C2)S1 HR142496 [1,1,0,0,0,0|2,0,0]=4 788 B12R2.606 O=c1oc2cc(O)ccc2s1 HR111617 [1,1,0,0,0,0|2,0,0]=4 789 B12R2.606 S=C1NC2=C(C=C(Br)C=C2)O1 HR104218 [1,1,0,0,0,0|2,0,0]=4 790 B12R2.606 S=C1NC2=C(C=C(Cl)C=C2)O1 HR117059 [1,1,0,0,0,0|2,0,0]=4 791 B12R2.606 S=C1NC2=C(C=CC(Cl)=C2)O1 HR103912 [1,1,0,0,0,0|2,0,0]=4 792 B14R2.92 BrCC1=C(Br)C2=CC=CC=C2C=C1 HR118481 [0,1,0,0,0,1|2,0,0]=4 793 B14R2.92 COC1=C(Br)C2=CC=CC=C2C=C1 HR105705 [0,1,0,0,0,1|2,0,0]=4 794 B14R2.92 COC1=C(I)C2=CC=CC=C2C=C1 HR118169 [0,1,0,0,0,1|2,0,0]=4 795 B14R2.92 O=CC1=COC2=CC=CC=C2C1=O HR114295 [0,1,0,0,0,1|1,0,1]=4 796 B14R2.203 COC1=C(Br)C=CC2=CC=CC=C21 HR119362 [0,1,0,0,0,1|2,0,0]=4 797 B14R2.203 Cc1ccc2ccccc2c1[Mg]Br HR112420 [0,1,0,0,0,1|2,0,0]=4 798 B14R2.7724 Cc1cc(O)c2ccccc2c1O HR144590 [0,1,0,0,0,1|2,0,0]=4 799 B14R2.7724 O=C1OC(Cl)=C(Cl)C2=CC=CC=C12 HR109703 [0,1,0,0,0,1|2,0,0]=4 800 B14R2.1019 CC1=NC(CCl)=NC2=CC=CC=C21 HR110766 [0,1,0,0,0,1|1,0,0]=3 801 B14R2.1019 CCC1=NC2=CC=CC=C2C(=O)N1 HR107757 [0,1,0,0,0,1|2,0,0]=4 802 B14R2.1146 COC1=CC(=O)NC2=CC=CC=C21 HR112654 [0,1,0,0,0,1|2,0,0]=4 803 B14R2.1146 COC1=CC(C)=NC2=CC=CC=C21 HR142056 [0,1,0,0,0,1|1,0,0]=3 804 B14R2.1146 COC1=CC(C)=NC2=CC=CC=C21 HR154992 [0,1,0,0,0,1|1,0,0]=3 805 B14R2.1146 Cc1cc(NN)c2ccccc2n1 HR114967 [0,1,0,0,0,1|2,0,0]=4 806 B14R2.1146 O=C1C=C(CBr)C2=CC=CC=C2N1 HR147422 [0,1,0,0,0,1|2,0,0]=4 807 B14R2.8045 CC1=CC(=O)C2=CC=CC(Cl)=C2N1 HR155139 [0,1,0,0,0,1|2,0,0]=4 808 B14R2.8045 CC1=CC(C)=NC2=C(O)C=CC=C12 HR132473 [0,1,0,0,0,1|1,0,0]=3 809 B14R2.8045 CC1=CC(Cl)=NC2=C(C)C=CC=C12 HR106527 [0,1,0,0,0,1|2,0,0]=4 810 B14R2.8045 CC1=NC2=C(Br)C=CC=C2C(Cl)=C1 HR100258 [0,1,0,0,0,1|2,0,0]=4 811 B14R2.8045 CC1=NC2=C(C)C=CC=C2C(Br)=C1 HR155067 [0,1,0,0,0,1|2,0,0]=4 812 B14R2.8045 CC1=NC2=C(C)C=CC=C2C(Cl)=C1 HR144092 [0,1,0,0,0,1|2,0,0]=4 813 B14R2.8045 CC1=NC2=C(C)C=CC=C2C(O)=C1 HR155034 [0,1,0,0,0,1|2,0,0]=4 814 B14R2.8045 CC1=NC2=C(C)C=CC=C2C(O)=C1 HR155035 [0,1,0,0,0,1|2,0,0]=4 815 B14R2.8045 CC1=NC2=C(F)C=CC=C2C(Cl)=C1 HR155058 [0,1,0,0,0,1|2,0,0]=4 816 B14R2.8045 CC1=NC2=C(O)C=CC=C2C(Cl)=C1 HR113907 [0,1,0,0,0,1|2,0,0]=4 817 B14R2.8235 CC1=CC(=O)NC2=CC=C(Cl)C=C12 HR148453 [0,1,0,0,0,1|2,0,0]=4 818 B14R2.8235 CC1=CC(C)=C2N=C(Cl)C=CC2=C1 HR155038 [0,1,0,0,0,1|2,0,0]=4 819 B14R2.8235 CC1=CC(C)=C2NC(=O)C=CC2=C1 HR155090 [0,1,0,0,0,1|2,0,0]=4 820 B14R2.8235 CC1=CC(Cl)=NC2=CC=C(Br)C=C12 HR148384 [0,1,0,0,0,1|2,0,0]=4 821 B14R2.8235 CC1=CC=C2NC(C)=CC(=O)C2=C1 HR102773 [0,1,0,0,0,1|2,0,0]=4 822 B14R2.8235 CC1=CC=C2NC(C)=NC(=O)C2=C1 HR128709 [0,1,0,0,0,1|2,0,0]=4 823 B14R2.8235 CC1=NC2=CC=C(Br)C=C2C(=O)N1 HR142877 [0,1,0,0,0,1|2,0,0]=4 824 B14R2.8235 CC1=NC2=CC=C(Br)C=C2C(Cl)=N1 HR147536 [0,1,0,0,0,1|2,0,0]=4 825 B14R2.8235 CC1=NC2=CC=C(Br)C=C2C(O)=C1 HR113824 [0,1,0,0,0,1|2,0,0]=4 826 B14R2.8235 CC1=NC2=CC=C(Cl)C=C2C(=O)N1 HR147506 [0,1,0,0,0,1|2,0,0]=4 827 B14R2.8235 CC1=NC2=CC=C(Cl)C=C2C(Cl)=C1 HR155047 [0,1,0,0,0,1|2,0,0]=4 828 B14R2.8235 CC1=NC2=CC=C(Cl)C=C2C(O)=C1 HR155106 [0,1,0,0,0,1|2,0,0]=4 829 B14R2.8235 CC1=NC2=CC=C(F)C=C2C(Br)=C1 HR155068 [0,1,0,0,0,1|2,0,0]=4 830 B14R2.8235 CC1=NC2=CC=C(F)C=C2C(Cl)=C1 HR155054 [0,1,0,0,0,1|2,0,0]=4 831 B14R2.8235 CC1=NC2=CC=C(N)C=C2C(N)=C1 HR112969 [0,1,0,0,0,1|2,0,0]=4 832 B14R2.8235 O=C1C=C(O)C2=CC(Cl)=CC=C2O1 HR103563 [0,1,0,0,0,1|2,0,0]=4 833 B14R2.8235 O=C1NC(=O)C2=C(C=CC(F)=C2)O1 HR130856 [0,1,0,0,0,1|2,0,0]=4 834 B14R2.29365 CC1=CC(=O)C2=CC=C(F)C=C2N1 HR155117 [0,1,0,0,0,1|2,0,0]=4 835 B14R2.29365 CC1=CC(=O)OC2=CC(S)=CC=C12 HR33224 [0,1,0,0,0,1|1,0,0]=3 836 B14R2.29365 CC1=CC(Cl)=NC2=CC(N)=CC=C12 HR104588 [0,1,0,0,0,1|2,0,0]=4 837 B14R2.29365 CC1=NC2=CC(Br)=CC=C2C(Cl)=C1 HR108669 [0,1,0,0,0,1|2,0,0]=4 838 B14R2.29365 CC1=NC2=CC(Cl)=CC=C2C(Cl)=C1 HR140699 [0,1,0,0,0,1|2,0,0]=4 839 B14R2.29365 CC1=NC2=CC(F)=CC=C2C(Cl)=C1 HR155056 [0,1,0,0,0,1|2,0,0]=4 840 B14R2.29365 Cc1cc(=O)oc2cc(N)ccc12 HR131409 [0,1,0,0,0,1|1,0,0]=3 841 B14R2.29365 Cc1cc(=O)oc2cc(O)ccc12 HR124659 [0,1,0,0,0,1|1,0,0]=3 842 B14R2.29496 CC1=CC(C)(C)NC2=CC=CC=C12 HR142071 [0,1,0,0,0,1|1,0,1]=4 843 B14R2.1128 COC1=NC2=CC=CC=C2N=C1Cl HR146590 [0,1,0,0,0,1|2,0,0]=4 844 B14R2.1128 ClCC1=CC2=CC=CC=C2N=C1Cl HR116691 [0,1,0,0,0,1|2,0,0]=4 845 B14R2.1128 N#CC1=CC2=CC=CC=C2OC1=O HR143132 [0,1,0,0,0,1|1,0,1]=4 846 B14R2.8239 CC1=NC2=CC=C(F)C=C2N=C1C HR109824 [0,1,0,0,0,1|1,0,0]=3 847 B14R2.8239 CC1=NC2=CC=C(N)C=C2N=C1C HR109187 [0,1,0,0,0,1|1,0,0]=3 848 B14R2.44 CN1C(CC#N)=NC2=C1C=CC=C2 HR120326 [0,2,0,0,0,0|2,0,0]=4 849 B14R2.450 CC1=C(C(=O)O)OC2=C1C=CC=C2 HR108974 [0,2,0,0,0,0|0,0,1]=3 850 B14R2.450 CC1=C(C(=O)O)SC2=C1C=CC=C2 HR144577 [0,2,0,0,0,0|0,1,1]=4 851 B14R2.1129 CCC1=C(C#N)C2=C(C=CC=C2)O1 HR121845 [0,2,0,0,0,0|0,0,1]=3 852 B14R2.1129 CCC1=C(C=O)C2=C(C=CC=C2)O1 HR120589 [0,2,0,0,0,0|0,0,1]=3 853 B14R2.517 CC1=C(CCN)C2=CC=CC=C2N1 HR133130 [0,2,0,0,0,0|1,0,0]=3 854 B14R2.517 CC1=C(CCN)C2=CC=CN=C2N1 HR150044 [0,2,0,0,0,0|2,0,0]=4 855 B14R2.517 CO\C=C1\C(=O)OC2=C1C=CC=C2 HR117702 [0,2,0,0,0,0|1,0,0]=3 856 B14R2.642 CC(=O)C1=C(C)N=C2C=CC=CN21 HR146642 [0,2,0,0,0,0|2,0,0]=4 857 B14R2.642 CC(=O)N1C(=O)OC2=C1C=CC=C2 HR123931 [0,2,0,0,0,0|2,0,0]=4 858 B14R2.4507 CC1=CC=C2N=C(C)C(C)(C)C2=C1 HR139247 [0,2,0,0,0,0|1,0,1]=4 859 B14R2.4507 CC1=NC2=CC=C(Cl)C=C2C1(C)C HR143260 [0,2,0,0,0,0|1,0,1]=4 860 B14R2.57380 CC1=[N+](C)C2=CC=CC=C2C1(C)C HR129520 [0,2,0,0,0,0|1,0,1]=4 861 B14R2.9184 CC1=C(C)N2C=C(Br)C=C(Br)C2=N1 HR32317 [0,2,0,0,0,0|2,0,0]=4 862 B14R2.1815 CC1=C(C)N2C=CC(C=O)=CC2=N1 HR30364 [0,2,0,0,0,0|2,0,0]=4 863 B12R2.24 CC1=CC2=CC=CC=C2N=C1 HR136520 [0,0,1,1,0,0|2,0,0]=4 864 B12R2.24 CC1=NC2=CC=CC=C2C=C1 HR5809 [0,0,1,1,0,0|1,0,1]=4 865 B12R2.24 CC1=NC2=CC=CC=C2N=C1 HR125046 [0,0,1,1,0,0|2,0,0]=4 866 B12R2.24 Cc1ccc2ccccc2n1 HR100422 [0,0,1,1,0,0|1,0,1]=4 867 B12R2.24 O=C1C=CC2=C(C=CC=C2)O1 HR141776 [0,0,1,1,0,0|1,0,1]=4 868 B12R2.24 O=C1C=CC2=CC=CC=C2O1 HR132377 [0,0,1,1,0,0|1,0,1]=4 869 B12R2.24 O=C1CCC2=CC=CC=C2O1 HR127620 [0,0,1,1,0,0|1,0,1]=4 870 B12R2.315 O=CC1=CC=CC2=C1OC=C2 HR111112 [0,0,1,1,0,0|1,0,1]=4 871 B12R2.315 O=CC1=CC=CC2=C1OCC2 HR32686 [0,0,1,1,0,0|1,0,1]=4 872 B12R2.1081 CC1=CC=NC2=CC=CC=C12 HR146663 [0,0,1,1,0,0|1,0,1]=4 873 B12R2.1081 CC1=NC=CC2=CC=CC=C21 HR146527 [0,0,1,1,0,0|2,0,0]=4 874 B12R2.1081 O=C1C=COC2=CC=CC=C12 HR102011 [0,0,1,1,0,0|1,0,1]=4 875 B12R2.1081 O=C1CCOC2=CC=CC=C12 HR126217 [0,0,1,1,0,0|1,0,1]=4 876 B12R2.100 CC1=C(C)N=C2NC=CC2=C1 HR150141 [0,0,1,1,0,0|2,0,0]=4 877 B14R3.49 C1=CC2=C(C=C1)C3=C(CCC3)N2 HR142443 [0,1,0,1,0,0|1,0,0]=3 878 B10R2.320 O=C1CC2=CC=CC=C12 HR134489 [1,0,0,0,1,0|1,0,1]=4 879 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 HR134134 [0,0,1,0,0,1|1,0,1]=4 880 B12R1.107 CC(=O)OC(C)C1=CC=CC=C1 HR138447 [0,0,1,0,0,1|0,0,2]=4 881 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 HR100565 [0,0,1,0,0,1|1,0,1]=4 882 B12R1.107 C\C(=C/C(=O)O)C1=CC=CC=C1 HR119163 [0,0,1,0,0,1|1,0,0]=3 883 B12R1.107 O=C(O)CC(=O)C1=CC=CC=C1 HR114800 [0,0,1,0,0,1|2,0,0]=4 884 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 HR128829 [0,0,1,0,0,1|1,0,1]=4 885 B12R1.27 CCC(=O)OCC1=CC=CC=C1 HR128344 [0,0,1,0,0,1|1,0,1]=4 886 B12R1.27 COC(=O)COC1=CC=CC=C1 HR128210 [0,0,1,0,0,1|2,0,0]=4 887 B12R2.246 CC1=CC(C)=C2NC=CC2=C1 HR122064 [0,0,0,0,1,1|2,0,0]=4 888 B12R2.246 CC1=NC(C)=C2NC=CC2=C1 HR109124 [0,0,0,0,1,1|2,0,0]=4 889 B14R2.287 CC1=NCC(=O)NC2=C1C=CC=C2 HR146361 [0,0,0,0,0,2|2,0,0]=4