0 B10R1.4 Br[Zn]Cc1ccccc1Br MC121351 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.4 CC1=C(CC#N)C=CC=C1 CS11825 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.4 CC1=CC=CN=C1CCN MC33439 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.4 CCCC1=CCCCC1=O MC106174 [0,0,0,0,0,0|0,0,4]=4 4 B10R1.4 CCOC1=C(Br)C=CC=C1 MC20149 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.4 CCOC1=C(Br)C=NC=C1 MC443330 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.4 CCOC1=C(N)C=CC=C1 CS11823 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.4 CCOC1=C(N)C=CN=C1 MC442472 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.4 CCOC1=C(O)C=CC=C1 MC41194 [0,0,0,0,0,0|1,0,0]=1 9 B10R1.4 CCOC1=CC=CN=C1C MC443397 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.4 CCOC1=CC=CN=C1O MC110935 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.4 CCOC1=CN=CN=C1N CS17842 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.4 CCOC1=NC=CN=C1N CS21230 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.4 CNCC1=C(F)C=CC=C1 MC40828 [0,0,0,0,0,0|2,0,0]=2 14 B10R1.4 COCC1=C(Br)C=CC=C1 MC41399 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.4 FC1=C(N=C=S)C=CC=C1 MC33126 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.4 Fc1ccccc1C[Zn]Cl MC121344 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.4 N#CCC1=C(Br)C=CC=C1 CS10707 [0,0,0,0,0,0|2,0,1]=3 18 B10R1.4 N#CCC1=C(Cl)C=CC=C1 CS21495 [0,0,0,0,0,0|2,0,1]=3 19 B10R1.4 N#CCC1=C(F)C=CC=C1 CS20772 [0,0,0,0,0,0|2,0,1]=3 20 B10R1.4 N#CCC1=C(I)C=CC=C1 MC40781 [0,0,0,0,0,0|2,0,1]=3 21 B10R1.4 N#CCC1=C(N)C=CC=C1 CS20914 [0,0,0,0,0,0|2,0,1]=3 22 B10R1.4 N#CCC1=CC=CN=C1Cl CS13165 [0,0,0,0,0,0|3,0,1]=4 23 B10R1.4 N#CCC1=CC=CN=C1F MC429651 [0,0,0,0,0,0|3,0,1]=4 24 B10R1.4 N#CCC1=NC=CC=C1F MC431782 [0,0,0,0,0,0|3,0,1]=4 25 B10R1.4 NCCC1=C(Br)C=CC=C1 CS15138 [0,0,0,0,0,0|2,0,0]=2 26 B10R1.4 NCCC1=C(F)C=CC=C1 CS14793 [0,0,0,0,0,0|2,0,0]=2 27 B10R1.4 NCCC1=C(N)C=CC=C1 CS15970 [0,0,0,0,0,0|2,0,0]=2 28 B10R1.4 NCCC1=NC=CC=C1Br MC104547 [0,0,0,0,0,0|3,0,0]=3 29 B10R1.4 NCCN1C=CC=CC1=O MC431465 [0,0,0,0,0,0|2,0,1]=3 30 B10R1.4 NNCC1=C(F)C=CC=C1 CS20134 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.4 NNCc1ccccc1F MC443842 [0,0,0,0,0,0|3,0,0]=3 32 B10R1.4 O=C=NC1=C(Br)C=CC=C1 MC41031 [0,0,0,0,0,0|3,0,1]=4 33 B10R1.4 O=C=NC1=C(F)C=CC=C1 MC429405 [0,0,0,0,0,0|3,0,1]=4 34 B10R1.4 O=CCC1=C(F)C=CC=C1 MC431003 [0,0,0,0,0,0|2,0,1]=3 35 B10R1.4 OC1=C(CCI)C=CC=C1 MC430321 [0,0,0,0,0,0|1,0,0]=1 36 B10R1.4 OCCC1=C(Br)C=CC=C1 CS21407 [0,0,0,0,0,0|2,0,0]=2 37 B10R1.4 OCCC1=C(Cl)C=CC=C1 MC40737 [0,0,0,0,0,0|2,0,0]=2 38 B10R1.4 OCCC1=C(F)C=CC=C1 MC33149 [0,0,0,0,0,0|2,0,0]=2 39 B10R1.4 O\N=C\C1=C(F)C=CC=C1 MC106948 [0,0,0,0,0,0|3,0,1]=4 40 B10R1.4 O\N=C\C1=C(F)C=CC=C1 MC433456 [0,0,0,0,0,0|3,0,1]=4 41 B9R1.8 BrCCC1=CC=CC=C1 MC40571 [1,0,0,0,0,0|1,0,0]=2 42 B9R1.8 Br[Zn]Cc1ccccc1 MC121333 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.8 CCCC1=CC=CN=C1 CS22402 [1,0,0,0,0,0|1,0,0]=2 44 B9R1.8 CCNC1=CC=CC=C1 MC40913 [1,0,0,0,0,0|1,0,0]=2 45 B9R1.8 CCOC1=NC=CC=C1 CS18732 [1,0,0,0,0,0|2,0,0]=3 46 B9R1.8 CCOC1=NC=CN=C1 CS21524 [1,0,0,0,0,0|3,0,0]=4 47 B9R1.8 CNCC1=CC=CC=C1 MC10559 [1,0,0,0,0,0|1,0,0]=2 48 B9R1.8 CNCC1=CC=CC=C1 MC20323 [1,0,0,0,0,0|1,0,0]=2 49 B9R1.8 CNCC1=CC=CC=C1 MC21006 [1,0,0,0,0,0|1,0,0]=2 50 B9R1.8 CNCC1=CC=CN=C1 CS18846 [1,0,0,0,0,0|2,0,0]=3 51 B9R1.8 CNCC1=CN=CN=C1 MC103834 [1,0,0,0,0,0|3,0,0]=4 52 B9R1.8 COCC1=NC=CC=C1 CS20909 [1,0,0,0,0,0|2,0,0]=3 53 B9R1.8 ClCCC1=CC=CC=C1 MC40609 [1,0,0,0,0,0|1,0,0]=2 54 B9R1.8 ClCCC1=CC=NC=C1 CS17913 [1,0,0,0,0,0|2,0,0]=3 55 B9R1.8 FCCC1=CC=CC=C1 MC41557 [1,0,0,0,0,0|1,0,0]=2 56 B9R1.8 N#CCC1=CC=CN=C1 CS18407 [1,0,0,0,0,0|2,0,1]=4 57 B9R1.8 N#CCC1=CC=NC=C1 CS20239 [1,0,0,0,0,0|2,0,1]=4 58 B9R1.8 N#CCC1=NC=CC=C1 CS18926 [1,0,0,0,0,0|2,0,1]=4 59 B9R1.8 NCCC1=CC=CC=C1 MC40983 [1,0,0,0,0,0|1,0,0]=2 60 B9R1.8 NCCC1=CC=CN=C1 CS21892 [1,0,0,0,0,0|2,0,0]=3 61 B9R1.8 NCCC1=NC=CC=C1 CS14064 [1,0,0,0,0,0|2,0,0]=3 62 B9R1.8 NCCC1=NC=NC=C1 MC104796 [1,0,0,0,0,0|3,0,0]=4 63 B9R1.8 NNCC1=CC=CC=C1 CS11006 [1,0,0,0,0,0|2,0,0]=3 64 B9R1.8 NNCC1=CC=CC=C1 CS12127 [1,0,0,0,0,0|2,0,0]=3 65 B9R1.8 NNCC1=CC=CN=C1 MC111189 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.8 NNCC1=CC=CN=C1 MC111240 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.8 NNCC1=CC=NC=C1 MC111241 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.8 NNCC1=NC=CC=C1 MC111239 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.8 NOCC1=CC=CC=C1 CS14063 [1,0,0,0,0,0|2,0,0]=3 70 B9R1.8 O=C=NC1=CC=CC=C1 MC41051 [1,0,0,0,0,0|2,0,1]=4 71 B9R1.8 O=CCC1=CC=CN=C1 MC106360 [1,0,0,0,0,0|2,0,1]=4 72 B9R1.8 O=CCC1=CC=NC=C1 MC106357 [1,0,0,0,0,0|2,0,1]=4 73 B9R1.8 O=CNC1=CC=CC=C1 MC40924 [1,0,0,0,0,0|2,0,1]=4 74 B9R1.8 O=COC1=CC=CC=C1 MC40136 [1,0,0,0,0,0|2,0,1]=4 75 B9R1.8 OCCC1=CC=CC=C1 MC40745 [1,0,0,0,0,0|1,0,0]=2 76 B9R1.8 OCCC1=CN=CN=C1 CS12401 [1,0,0,0,0,0|3,0,0]=4 77 B9R1.8 ONCC1=CC=CC=C1 CS11753 [1,0,0,0,0,0|2,0,0]=3 78 B9R1.15 BrCC1=C(Br)C=CC=C1 MC20808 [1,0,0,0,0,0|2,0,0]=3 79 B9R1.15 BrCC1=C(I)C=CC=C1 MC40561 [1,0,0,0,0,0|2,0,0]=3 80 B9R1.15 C#CC1=C(Cl)C=CC=C1 CS20629 [1,0,0,0,0,0|1,0,2]=4 81 B9R1.15 C#CC1=C(N)C=CC=C1 CS21537 [1,0,0,0,0,0|1,0,2]=4 82 B9R1.15 C#CC1=C(O)C=CC=C1 CS21538 [1,0,0,0,0,0|0,0,2]=3 83 B9R1.15 C#CC1=CC=CN=C1O MC102702 [1,0,0,0,0,0|1,0,2]=4 84 B9R1.15 C=CC1=C(Br)C=CC=C1 CS18853 [1,0,0,0,0,0|1,0,2]=4 85 B9R1.15 C=CC1=C(Cl)C=CC=C1 CS19873 [1,0,0,0,0,0|1,0,2]=4 86 B9R1.15 CC1=C(CBr)C=CC=C1 CS14791 [1,0,0,0,0,0|2,0,0]=3 87 B9R1.15 CC1=C(CBr)C=NC=C1 CS17496 [1,0,0,0,0,0|3,0,0]=4 88 B9R1.15 CC1=C(CCl)C=NC=C1 MC104833 [1,0,0,0,0,0|3,0,0]=4 89 B9R1.15 CC1=C(CN)C=CC=C1 MC33216 [1,0,0,0,0,0|2,0,0]=3 90 B9R1.15 CC1=C(CN)C=NC=C1 CS20204 [1,0,0,0,0,0|3,0,0]=4 91 B9R1.15 CC1=C(CO)C=NC=C1 MC443666 [1,0,0,0,0,0|3,0,0]=4 92 B9R1.15 CC1=C(NN)C=CC=C1 CS19575 [1,0,0,0,0,0|3,0,0]=4 93 B9R1.15 CC1=C(NN)C=CC=C1 MC20365 [1,0,0,0,0,0|3,0,0]=4 94 B9R1.15 CC1=CC=CC=C1C=O CS19114 [1,0,0,0,0,0|2,0,1]=4 95 B9R1.15 CC1=CC=CN=C1CCl CS15725 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.15 CC1=CC=CN=C1CO CS19225 [1,0,0,0,0,0|3,0,0]=4 97 B9R1.15 CC1=NC=CC=C1CCl MC104832 [1,0,0,0,0,0|3,0,0]=4 98 B9R1.15 CC1=NC=CC=C1CN MC102930 [1,0,0,0,0,0|3,0,0]=4 99 B9R1.15 CC1=NC=CC=C1CO CS20145 [1,0,0,0,0,0|3,0,0]=4 100 B9R1.15 CCC1=C(Br)C=CC=C1 CS20980 [1,0,0,0,0,0|1,0,0]=2 101 B9R1.15 CCC1=C(Br)C=CN=C1 MC427078 [1,0,0,0,0,0|2,0,0]=3 102 B9R1.15 CCC1=C(C)C=CC=C1 CS21536 [1,0,0,0,0,0|1,0,0]=2 103 B9R1.15 CCC1=C(N)C=CC=C1 MC40911 [1,0,0,0,0,0|1,0,0]=2 104 B9R1.15 CCC1=NC=CC=C1Br MC105746 [1,0,0,0,0,0|2,0,0]=3 105 B9R1.15 CCC1=NC=CN=C1Cl CS21430 [1,0,0,0,0,0|3,0,0]=4 106 B9R1.15 CCC1=NC=NC=C1F CS19573 [1,0,0,0,0,0|3,0,0]=4 107 B9R1.15 CNC1=C(Cl)C=CC=C1 MC40890 [1,0,0,0,0,0|2,0,0]=3 108 B9R1.15 CNC1=C(F)C=CC=C1 CS13895 [1,0,0,0,0,0|2,0,0]=3 109 B9R1.15 CNC1=C(N)C=NC=C1 MC10330 [1,0,0,0,0,0|3,0,0]=4 110 B9R1.15 CNC1=CC=CC=C1N CS22302 [1,0,0,0,0,0|2,0,0]=3 111 B9R1.15 CNC1=NC=CC=C1Br CS17281 [1,0,0,0,0,0|3,0,0]=4 112 B9R1.15 CNC1=NC=CC=C1Cl MC33482 [1,0,0,0,0,0|3,0,0]=4 113 B9R1.15 CNC1=NC=CC=C1N MC427393 [1,0,0,0,0,0|3,0,0]=4 114 B9R1.15 COC1=C(Br)C=CC=C1 CS19150 [1,0,0,0,0,0|2,0,0]=3 115 B9R1.15 COC1=C(Br)C=CN=C1 CS14715 [1,0,0,0,0,0|3,0,0]=4 116 B9R1.15 COC1=C(Br)C=NC=C1 CS18491 [1,0,0,0,0,0|3,0,0]=4 117 B9R1.15 COC1=C(C)C=CN=C1 MC443637 [1,0,0,0,0,0|3,0,0]=4 118 B9R1.15 COC1=C(C)C=NC=C1 MC33476 [1,0,0,0,0,0|3,0,0]=4 119 B9R1.15 COC1=C(Cl)C=CN=C1 MC442708 [1,0,0,0,0,0|3,0,0]=4 120 B9R1.15 COC1=C(F)C=CC=C1 CS19904 [1,0,0,0,0,0|2,0,0]=3 121 B9R1.15 COC1=C(F)C=NC=C1 CS16194 [1,0,0,0,0,0|3,0,0]=4 122 B9R1.15 COC1=C(I)C=CC=C1 MC41341 [1,0,0,0,0,0|2,0,0]=3 123 B9R1.15 COC1=C(I)C=CN=C1 MC106301 [1,0,0,0,0,0|3,0,0]=4 124 B9R1.15 COC1=C(I)C=NC=C1 CS18542 [1,0,0,0,0,0|3,0,0]=4 125 B9R1.15 COC1=C(N)C=CC=C1 CS11812 [1,0,0,0,0,0|2,0,0]=3 126 B9R1.15 COC1=C(N)C=CN=C1 CS22564 [1,0,0,0,0,0|3,0,0]=4 127 B9R1.15 COC1=C(N)C=NC=C1 CS18248 [1,0,0,0,0,0|3,0,0]=4 128 B9R1.15 COC1=C(O)C=CC=C1 MC41202 [1,0,0,0,0,0|1,0,0]=2 129 B9R1.15 COC1=C(O)C=CN=C1 MC443266 [1,0,0,0,0,0|2,0,0]=3 130 B9R1.15 COC1=CC=CN=C1Br CS19255 [1,0,0,0,0,0|3,0,0]=4 131 B9R1.15 COC1=CC=CN=C1Cl CS19305 [1,0,0,0,0,0|3,0,0]=4 132 B9R1.15 COC1=CC=CN=C1F CS13044 [1,0,0,0,0,0|3,0,0]=4 133 B9R1.15 COC1=CC=CN=C1N CS17216 [1,0,0,0,0,0|3,0,0]=4 134 B9R1.15 COC1=CN=CN=C1O MC432213 [1,0,0,0,0,0|3,0,0]=4 135 B9R1.15 COC1=NC=CC=C1Br CS19258 [1,0,0,0,0,0|3,0,0]=4 136 B9R1.15 COC1=NC=CC=C1C MC33438 [1,0,0,0,0,0|3,0,0]=4 137 B9R1.15 COC1=NC=CC=C1Cl CS18705 [1,0,0,0,0,0|3,0,0]=4 138 B9R1.15 COC1=NC=CC=C1F CS19564 [1,0,0,0,0,0|3,0,0]=4 139 B9R1.15 COC1=NC=CC=C1I CS13512 [1,0,0,0,0,0|3,0,0]=4 140 B9R1.15 COC1=NC=CC=C1N CS19526 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.15 CSC1=C(Br)C=CN=C1 MC430535 [1,0,0,0,0,0|3,0,0]=4 142 B9R1.15 CSC1=C(I)C=CC=C1 MC433405 [1,0,0,0,0,0|2,0,0]=3 143 B9R1.15 ClC1=C(CBr)C=CC=C1 CS19190 [1,0,0,0,0,0|2,0,0]=3 144 B9R1.15 ClC1=CC=CN=C1CBr MC116292 [1,0,0,0,0,0|3,0,0]=4 145 B9R1.15 ClCC1=C(Cl)C=CC=C1 CS19964 [1,0,0,0,0,0|2,0,0]=3 146 B9R1.15 ClCC1=CC=CC=C1Br MC30029 [1,0,0,0,0,0|2,0,0]=3 147 B9R1.15 FC1=C(CBr)C=CC=C1 CS21562 [1,0,0,0,0,0|2,0,0]=3 148 B9R1.15 FC1=C(CCl)C=CC=C1 MC40597 [1,0,0,0,0,0|2,0,0]=3 149 B9R1.15 FC1=CC=CN=C1CBr MC430869 [1,0,0,0,0,0|3,0,0]=4 150 B9R1.15 FC1=CC=CN=C1CCl MC425766 [1,0,0,0,0,0|3,0,0]=4 151 B9R1.15 FC1=NC=CC=C1CBr MC430634 [1,0,0,0,0,0|3,0,0]=4 152 B9R1.15 FC1=NC=CC=C1CCl MC429652 [1,0,0,0,0,0|3,0,0]=4 153 B9R1.15 N#CC1=C(Br)C=CC=C1 MC20182 [1,0,0,0,0,0|2,0,1]=4 154 B9R1.15 N#CC1=C(F)C=CC=C1 CS18285 [1,0,0,0,0,0|2,0,1]=4 155 B9R1.15 N#CC1=C(I)C=CC=C1 CS21883 [1,0,0,0,0,0|2,0,1]=4 156 B9R1.15 N#CC1=C(N)C=CC=C1 CS13393 [1,0,0,0,0,0|2,0,1]=4 157 B9R1.15 N#CC1=C(O)C=CC=C1 CS19191 [1,0,0,0,0,0|1,0,1]=3 158 B9R1.15 N#CC1=CC=CN=C1O CS13920 [1,0,0,0,0,0|2,0,1]=4 159 B9R1.15 N#CC1=CN=CC=C1O MC106630 [1,0,0,0,0,0|2,0,1]=4 160 B9R1.15 N#CC1=NC=CC=C1O CS21861 [1,0,0,0,0,0|2,0,1]=4 161 B9R1.15 NC1=C(C=O)C=CC=C1 MC20756 [1,0,0,0,0,0|2,0,1]=4 162 B9R1.15 NC1=C(CO)C=CC=C1 CS19122 [1,0,0,0,0,0|2,0,0]=3 163 B9R1.15 NC1=NC=CC=C1CO CS13983 [1,0,0,0,0,0|3,0,0]=4 164 B9R1.15 NCC1=C(Br)C=CC=C1 CS19534 [1,0,0,0,0,0|2,0,0]=3 165 B9R1.15 NCC1=C(Br)C=NC=C1 CS17629 [1,0,0,0,0,0|3,0,0]=4 166 B9R1.15 NCC1=C(F)C=CC=C1 MC40826 [1,0,0,0,0,0|2,0,0]=3 167 B9R1.15 NCC1=C(F)C=NC=C1 MC116263 [1,0,0,0,0,0|3,0,0]=4 168 B9R1.15 NCC1=C(F)C=NC=C1 MC431082 [1,0,0,0,0,0|3,0,0]=4 169 B9R1.15 NCC1=C(N)C=CC=C1 MC40796 [1,0,0,0,0,0|2,0,0]=3 170 B9R1.15 NCC1=C(O)C=CC=C1 CS20889 [1,0,0,0,0,0|1,0,0]=2 171 B9R1.15 NCC1=NC=CC=C1Cl MC114379 [1,0,0,0,0,0|3,0,0]=4 172 B9R1.15 NCC1=NC=CC=C1F MC104008 [1,0,0,0,0,0|3,0,0]=4 173 B9R1.15 NCC1=NC=CC=C1O MC443567 [1,0,0,0,0,0|2,0,0]=3 174 B9R1.15 NNC1=C(Br)C=CC=C1 CS19466 [1,0,0,0,0,0|3,0,0]=4 175 B9R1.15 NNC1=C(Cl)C=CC=C1 CS19478 [1,0,0,0,0,0|3,0,0]=4 176 B9R1.15 NNC1=C(F)C=CC=C1 CS23033 [1,0,0,0,0,0|3,0,0]=4 177 B9R1.15 NNC1=C(F)C=CC=C1 MC33086 [1,0,0,0,0,0|3,0,0]=4 178 B9R1.15 O=CC1=C(Br)C=CC=C1 CS19251 [1,0,0,0,0,0|2,0,1]=4 179 B9R1.15 O=CC1=C(F)C=CC=C1 CS21560 [1,0,0,0,0,0|2,0,1]=4 180 B9R1.15 O=CC1=C(I)C=CC=C1 CS20131 [1,0,0,0,0,0|2,0,1]=4 181 B9R1.15 O=CC1=C(O)C=CC=C1 MC41121 [1,0,0,0,0,0|1,0,1]=3 182 B9R1.15 O=CC1=C(O)C=NC=C1 CS13859 [1,0,0,0,0,0|2,0,1]=4 183 B9R1.15 O=CC1=C(O)N=CC=C1 CS19011 [1,0,0,0,0,0|2,0,1]=4 184 B9R1.15 O=CC1=CN=CC=C1O CS15926 [1,0,0,0,0,0|2,0,1]=4 185 B9R1.15 O=CC1=NC=CC=C1O MC443215 [1,0,0,0,0,0|2,0,1]=4 186 B9R1.15 OCC1=C(Br)C=CC=C1 CS18828 [1,0,0,0,0,0|2,0,0]=3 187 B9R1.15 OCC1=C(Br)C=NC=C1 CS12881 [1,0,0,0,0,0|3,0,0]=4 188 B9R1.15 OCC1=C(Cl)C=CC=C1 CS21494 [1,0,0,0,0,0|2,0,0]=3 189 B9R1.15 OCC1=C(Cl)C=CN=C1 CS17105 [1,0,0,0,0,0|3,0,0]=4 190 B9R1.15 OCC1=C(F)C=CC=C1 MC33139 [1,0,0,0,0,0|2,0,0]=3 191 B9R1.15 OCC1=C(I)C=CC=C1 CS19102 [1,0,0,0,0,0|2,0,0]=3 192 B9R1.15 OCC1=C(O)C=CC=C1 CS16243 [1,0,0,0,0,0|1,0,0]=2 193 B9R1.15 OCC1=CC=CN=C1Cl CS14328 [1,0,0,0,0,0|3,0,0]=4 194 B9R1.15 OCC1=CC=CN=C1F CS18697 [1,0,0,0,0,0|3,0,0]=4 195 B9R1.15 OCC1=NC=CC=C1Br MC431297 [1,0,0,0,0,0|3,0,0]=4 196 B9R1.15 OCC1=NC=CC=C1Br MC431298 [1,0,0,0,0,0|3,0,0]=4 197 B9R1.15 OCC1=NC=CC=C1Cl CS17318 [1,0,0,0,0,0|3,0,0]=4 198 B9R1.15 OCC1=NC=CC=C1F MC430870 [1,0,0,0,0,0|3,0,0]=4 199 B9R1.15 OCC1=NC=CC=C1O MC20200 [1,0,0,0,0,0|2,0,0]=3 200 B11R1.13 CCNC1=C(N)C(Cl)=NC=C1 MC121212 [0,1,0,0,0,0|3,0,0]=4 201 B11R1.13 CCOc1cccc(F)c1F MC433141 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.13 CNCC1=C(Cl)C(Cl)=CC=C1 CS20112 [0,1,0,0,0,0|2,0,0]=3 203 B11R1.13 N#CCC1=C(Cl)C(Cl)=CC=C1 CS18973 [0,1,0,0,0,0|2,0,1]=4 204 B11R1.13 N#CCC1=C(F)C(Cl)=CC=C1 MC40762 [0,1,0,0,0,0|2,0,1]=4 205 B11R1.13 N#CCC1=C(F)C(F)=CC=C1 CS18734 [0,1,0,0,0,0|2,0,1]=4 206 B11R1.13 OCCC1=C(Cl)C(Cl)=CC=C1 MC40738 [0,1,0,0,0,0|2,0,0]=3 207 B11R1.17 C=CCCC1=C(Br)C=NC=C1 MC431688 [0,1,0,0,0,0|2,0,1]=4 208 B11R1.17 CC1=C(OCC#N)C=CC=C1 CS14720 [0,1,0,0,0,0|2,0,1]=4 209 B11R1.17 CCCOC1=C(O)C=CC=C1 MC20673 [0,1,0,0,0,0|0,0,0]=1 210 B11R1.17 O=CCCC1=C(Cl)C=CC=C1 MC106741 [0,1,0,0,0,0|1,0,1]=3 211 B11R1.41 CCOC1=C(C#N)C=CC=C1 MC33181 [0,1,0,0,0,0|2,0,0]=3 212 B11R1.41 CCOC1=C(OC)C=CC=C1 MC433385 [0,1,0,0,0,0|1,0,0]=2 213 B11R1.41 CCOC1=CC=NC=C1C=O MC443446 [0,1,0,0,0,0|2,0,1]=4 214 B11R1.41 COC1=C(CCO)C=CC=C1 CS15749 [0,1,0,0,0,0|1,0,0]=2 215 B11R1.41 N#CC1=C(CCO)C=CC=C1 MC100045 [0,1,0,0,0,0|2,0,0]=3 216 B11R1.41 N#CCC1=C(C#N)C=CC=C1 MC40767 [0,1,0,0,0,0|2,0,1]=4 217 B11R1.41 N#CCC1=C(CCl)C=CC=C1 MC40588 [0,1,0,0,0,0|2,0,1]=4 218 B11R1.41 O=CC1=C(CCBr)C=CC=C1 MC106620 [0,1,0,0,0,0|1,0,1]=3 219 B11R1.81 CC1=C(CC#N)C=CC(F)=C1 MC40777 [0,1,0,0,0,0|2,0,1]=4 220 B11R1.81 CC1=CC(Br)=C(CC#N)C=C1 MC106321 [0,1,0,0,0,0|2,0,1]=4 221 B11R1.81 CC1=CC(F)=C(CC#N)C=C1 MC431014 [0,1,0,0,0,0|2,0,1]=4 222 B11R1.81 CCOC1=C(C)N=C(N)C=C1 CS10572 [0,1,0,0,0,0|3,0,0]=4 223 B11R1.81 CCOC1=C(F)C=C(N)C=C1 MC112375 [0,1,0,0,0,0|2,0,0]=3 224 B11R1.81 CCOC1=C(F)C=C(N)C=N1 CS17642 [0,1,0,0,0,0|3,0,0]=4 225 B11R1.81 N#CCC1=C(Br)C=C(Br)C=C1 MC433948 [0,1,0,0,0,0|2,0,1]=4 226 B11R1.81 N#CCC1=C(Br)C=C(Cl)C=C1 MC40754 [0,1,0,0,0,0|2,0,1]=4 227 B11R1.81 N#CCC1=C(Br)C=C(F)C=C1 CS13698 [0,1,0,0,0,0|2,0,1]=4 228 B11R1.81 N#CCC1=C(Cl)C=C(Br)C=C1 MC107514 [0,1,0,0,0,0|2,0,1]=4 229 B11R1.81 N#CCC1=C(Cl)C=C(Cl)C=C1 CS15393 [0,1,0,0,0,0|2,0,1]=4 230 B11R1.81 N#CCC1=C(Cl)C=C(F)C=C1 CS20640 [0,1,0,0,0,0|2,0,1]=4 231 B11R1.81 N#CCC1=C(F)C=C(Br)C=C1 CS22644 [0,1,0,0,0,0|2,0,1]=4 232 B11R1.81 N#CCC1=C(F)C=C(Cl)C=C1 MC40764 [0,1,0,0,0,0|2,0,1]=4 233 B11R1.81 N#CCC1=C(F)C=C(F)C=C1 CS10683 [0,1,0,0,0,0|2,0,1]=4 234 B11R1.81 NCCC1=C(F)C=C(F)C=C1 MC40977 [0,1,0,0,0,0|2,0,0]=3 235 B11R1.81 OCCC1=C(Cl)C=C(Cl)C=C1 MC40739 [0,1,0,0,0,0|2,0,0]=3 236 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 MC10294 [0,1,0,0,0,0|1,0,1]=3 237 B11R1.86 CC(=O)CC1=C(F)C=CC=C1 MC10318 [0,1,0,0,0,0|1,0,1]=3 238 B11R1.86 CC(=O)NC1=C(Br)C=CC=C1 MC427446 [0,1,0,0,0,0|2,0,1]=4 239 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 CS21203 [0,1,0,0,0,0|1,0,1]=3 240 B11R1.86 CC(=O)NC1=NC=CC=C1O MC427313 [0,1,0,0,0,0|2,0,1]=4 241 B11R1.86 CC(=O)OC1=C(C)C=CC=C1 MC40007 [0,1,0,0,0,0|2,0,1]=4 242 B11R1.86 CC(=S)NC1=C(Br)C=CC=C1 MC427451 [0,1,0,0,0,0|2,0,1]=4 243 B11R1.86 CC(C)OC1=C(N)C=CC=C1 CS13469 [0,1,0,0,0,0|2,0,0]=3 244 B11R1.86 CC(C)OC1=NC=CC=C1Cl MC103348 [0,1,0,0,0,0|3,0,0]=4 245 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 CS21083 [0,1,0,0,0,0|2,0,1]=4 246 B11R1.86 FC(F)OC1=C(Br)C=CC=C1 MC41371 [0,1,0,0,0,0|3,0,0]=4 247 B11R1.86 FC(F)OC1=C(I)C=CC=C1 MC41387 [0,1,0,0,0,0|3,0,0]=4 248 B11R1.86 NC1=C(CC(=O)O)C=CC=C1 CS20995 [0,1,0,0,0,0|2,0,1]=4 249 B11R1.86 NC1=C(OC(F)F)C=CC=C1 MC40902 [0,1,0,0,0,0|3,0,0]=4 250 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 CS20809 [0,1,0,0,0,0|2,0,1]=4 251 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 CS20826 [0,1,0,0,0,0|2,0,1]=4 252 B11R1.86 O=C(O)CC1=C(F)C=CC=C1 MC429403 [0,1,0,0,0,0|2,0,1]=4 253 B11R1.86 O=C(O)CC1=C(I)C=CC=C1 CS20849 [0,1,0,0,0,0|2,0,1]=4 254 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 CS20941 [0,1,0,0,0,0|1,0,1]=3 255 B11R1.86 OC1=C(OC(F)F)C=CC=C1 MC431136 [0,1,0,0,0,0|2,0,0]=3 256 B11R1.182 CC1=C(CC#N)C=C(F)C=C1 CS19339 [0,1,0,0,0,0|2,0,1]=4 257 B11R1.182 CC1=CC(CC#N)=C(C)C=C1 CS21152 [0,1,0,0,0,0|2,0,1]=4 258 B11R1.182 CC1=CC(CCO)=C(C)C=C1 MC40742 [0,1,0,0,0,0|2,0,0]=3 259 B11R1.182 CCOC1=C(Br)C=CC(N)=C1 CS20424 [0,1,0,0,0,0|2,0,0]=3 260 B11R1.182 CCOC1=C(Br)N=CC(N)=C1 CS12418 [0,1,0,0,0,0|3,0,0]=4 261 B11R1.182 CCOC1=C(C)C=CC(N)=C1 MC111938 [0,1,0,0,0,0|2,0,0]=3 262 B11R1.182 CCOC1=C(Cl)C=CC(Br)=C1 MC41352 [0,1,0,0,0,0|2,0,0]=3 263 B11R1.182 CCOC1=C(F)C=CC(Cl)=C1 MC41354 [0,1,0,0,0,0|2,0,0]=3 264 B11R1.182 N#CCC1=C(Br)C=CC(Cl)=C1 MC433932 [0,1,0,0,0,0|2,0,1]=4 265 B11R1.182 N#CCC1=C(Cl)C=CC(Br)=C1 MC40755 [0,1,0,0,0,0|2,0,1]=4 266 B11R1.182 N#CCC1=C(Cl)C=CC(Cl)=C1 CS18974 [0,1,0,0,0,0|2,0,1]=4 267 B11R1.182 N#CCC1=C(Cl)C=CC(F)=C1 MC40761 [0,1,0,0,0,0|2,0,1]=4 268 B11R1.182 N#CCC1=C(F)C=CC(Br)=C1 CS16321 [0,1,0,0,0,0|2,0,1]=4 269 B11R1.182 N#CCC1=C(F)C=CC(Cl)=C1 MC40765 [0,1,0,0,0,0|2,0,1]=4 270 B11R1.182 N#CCC1=C(F)C=CC(F)=C1 MC40768 [0,1,0,0,0,0|2,0,1]=4 271 B11R1.182 NCCC1=C(Cl)C=CC(Cl)=C1 MC40976 [0,1,0,0,0,0|2,0,0]=3 272 B11R1.182 OCCC1=C(Cl)C=CC(Cl)=C1 MC40740 [0,1,0,0,0,0|2,0,0]=3 273 B11R1.222 CC(CO)C1=C(Cl)C=CC=C1 MC111290 [0,1,0,0,0,0|2,0,0]=3 274 B11R1.222 CCC(=O)C1=C(Cl)C=CC=C1 CS15813 [0,1,0,0,0,0|1,0,1]=3 275 B11R1.222 CCC(=O)C1=C(N)C=CC=C1 MC430440 [0,1,0,0,0,0|1,0,1]=3 276 B11R1.222 CCC(=O)C1=CC=CN=C1N MC429975 [0,1,0,0,0,0|2,0,1]=4 277 B11R1.222 CCC(C)C1=C(N)C=CC=C1 CS21765 [0,1,0,0,0,0|1,0,0]=2 278 B11R1.222 CCC(N)C1=C(C)C=CC=C1 CS14530 [0,1,0,0,0,0|1,0,0]=2 279 B11R1.222 CNC(=O)C1=C(N)C=CC=C1 CS20442 [0,1,0,0,0,0|2,0,1]=4 280 B11R1.222 CNC(=O)C1=C(S)C=CC=C1 MC42220 [0,1,0,0,0,0|1,1,1]=4 281 B11R1.222 COC(=O)C1=C(Br)C=CC=C1 MC20192 [0,1,0,0,0,0|2,0,1]=4 282 B11R1.222 COC(=O)C1=C(F)C=CC=C1 CS11605 [0,1,0,0,0,0|2,0,1]=4 283 B11R1.222 COC(=O)C1=C(I)C=CC=C1 CS15277 [0,1,0,0,0,0|2,0,1]=4 284 B11R1.222 COC(=O)C1=C(N)C=CC=C1 CS13618 [0,1,0,0,0,0|2,0,1]=4 285 B11R1.222 COC(=O)C1=C(O)C=NC=C1 CS11627 [0,1,0,0,0,0|2,0,1]=4 286 B11R1.222 COC(=O)C1=C(S)C=CC=C1 MC40110 [0,1,0,0,0,0|1,1,1]=4 287 B11R1.222 COC(=O)C1=NC=CC=C1O CS21936 [0,1,0,0,0,0|2,0,1]=4 288 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 CS15388 [0,1,0,0,0,0|2,0,1]=4 289 B11R1.222 NCC(O)C1=C(F)C=CC=C1 MC431432 [0,1,0,0,0,0|2,0,0]=3 290 B11R1.222 NCC(O)C1=C(I)C=CC=C1 CS17962 [0,1,0,0,0,0|2,0,0]=3 291 B11R1.222 O=C(CBr)C1=C(Cl)C=CC=C1 CS14555 [0,1,0,0,0,0|2,0,1]=4 292 B11R1.222 O=C(CBr)C1=C(O)C=CC=C1 MC41230 [0,1,0,0,0,0|1,0,1]=3 293 B11R1.222 O=C(NO)C1=C(O)C=CC=C1 CS11942 [0,1,0,0,0,0|2,0,1]=4 294 B11R1.605 N#CCC1=C(Br)C=CC=C1Br CS15982 [0,1,0,0,0,0|2,0,1]=4 295 B11R1.605 N#CCC1=C(Br)C=CC=C1Cl MC107158 [0,1,0,0,0,0|2,0,1]=4 296 B11R1.605 N#CCC1=C(Cl)C=CC=C1Cl CS10675 [0,1,0,0,0,0|2,0,1]=4 297 B11R1.605 N#CCC1=C(Cl)C=CC=C1F CS10682 [0,1,0,0,0,0|2,0,1]=4 298 B11R1.605 N#CCC1=C(F)C=CC=C1F CS10684 [0,1,0,0,0,0|2,0,1]=4 299 B11R1.605 OCCC1=C(Cl)C=CC=C1F MC40736 [0,1,0,0,0,0|2,0,0]=3 300 B11R2.10 BrC1=CC2=CC=CC=C2C1 CS21490 [0,0,0,1,0,0|2,0,1]=4 301 B11R2.10 BrC1=NC2=C(C=CC=C2)O1 MC442524 [0,0,0,1,0,0|2,0,1]=4 302 B11R2.10 CC1=CC2=CC=CC=C2C1 CS11052 [0,0,0,1,0,0|1,0,1]=3 303 B11R2.10 CC1=CC2=CC=CC=C2N1 CS18563 [0,0,0,1,0,0|1,0,2]=4 304 B11R2.10 CC1=NC2=C(C=CC=C2)N1 CS15288 [0,0,0,1,0,0|2,0,1]=4 305 B11R2.10 CC1=NC2=C(C=CC=C2)O1 MC31235 [0,0,0,1,0,0|1,0,1]=3 306 B11R2.10 CC1=NC2=C(C=CC=C2)S1 CS21687 [0,0,0,1,0,0|1,1,1]=4 307 B11R2.10 CC1=NC2=NC=CC=C2O1 MC445727 [0,0,0,1,0,0|2,0,1]=4 308 B11R2.10 CC1CC2=CC=CC=C2N1 MC105455 [0,0,0,1,0,0|1,0,0]=2 309 B11R2.10 CC1CC2=CC=CC=C2N1 MC445120 [0,0,0,1,0,0|1,0,0]=2 310 B11R2.10 ClC1=NC2=C(C=CC=C2)O1 MC31172 [0,0,0,1,0,0|2,0,1]=4 311 B11R2.10 NC1=NC2=C(C=CC=C2)O1 MC31149 [0,0,0,1,0,0|2,0,1]=4 312 B11R2.10 NC1CC2=CC=CC=C2C1 CS19882 [0,0,0,1,0,0|2,0,0]=3 313 B11R2.10 NN1CC2=CC=CC=C2C1 MC442461 [0,0,0,1,0,0|3,0,0]=4 314 B11R2.10 O=C1CC2=C(C=CC=C2)O1 MC20944 [0,0,0,1,0,0|1,0,1]=3 315 B11R2.10 O=C1CC2=CC=CC=C2C1 CS16080 [0,0,0,1,0,0|2,0,1]=4 316 B11R2.10 O=C1CC2=CC=CC=C2N1 CS15184 [0,0,0,1,0,0|2,0,1]=4 317 B11R2.10 O=C1CC2=NC=CC=C2O1 MC106428 [0,0,0,1,0,0|2,0,1]=4 318 B11R2.10 O=C1NC2=C(C=CC=C2)O1 CS15190 [0,0,0,1,0,0|2,0,1]=4 319 B11R2.10 O=C1OC2=C(C=CC=C2)O1 CS10973 [0,0,0,1,0,0|2,0,1]=4 320 B11R2.10 OC1CC2=CC=CC=C2C1 CS21608 [0,0,0,1,0,0|2,0,0]=3 321 B11R2.10 ON1CC2=CC=CC=C2C1 MC41790 [0,0,0,1,0,0|3,0,0]=4 322 B11R2.10 SC1=NC2=C(C=CC=C2)O1 MC20463 [0,0,0,1,0,0|2,0,1]=4 323 B11R2.20 C1=CC2=C(CCCC2)N=C1 CS13407 [0,0,0,1,0,0|2,0,0]=3 324 B11R2.20 C1=CC2=C(CCNC2)N=C1 CS14841 [0,0,0,1,0,0|3,0,0]=4 325 B11R2.20 C1=CC2=C(CNCC2)N=C1 MC104317 [0,0,0,1,0,0|3,0,0]=4 326 B11R2.20 C1=CC2=C(CNCC2)N=C1 MC431486 [0,0,0,1,0,0|3,0,0]=4 327 B11R2.20 C1=CC2=C(N=C1)NCCN2 CS12464 [0,0,0,1,0,0|3,0,0]=4 328 B11R2.20 C1=CC=C2CC=CCC2=C1 CS11050 [0,0,0,1,0,0|1,0,2]=4 329 B11R2.20 C1=CC=C2CNCCC2=C1 CS19412 [0,0,0,1,0,0|2,0,0]=3 330 B11R2.20 C1=CC=C2COCCC2=C1 CS19933 [0,0,0,1,0,0|2,0,0]=3 331 B11R2.20 C1=CC=C2NCCNC2=C1 CS19000 [0,0,0,1,0,0|2,0,0]=3 332 B11R2.20 C1=CN=C2NCCCC2=C1 CS20465 [0,0,0,1,0,0|2,0,0]=3 333 B11R2.20 C1=NC2=C(CCCC2)N=C1 CS14173 [0,0,0,1,0,0|3,0,0]=4 334 B11R2.20 C1=NC=C2CCCNC2=C1 MC105356 [0,0,0,1,0,0|2,0,0]=3 335 B11R2.20 C1=NC=C2CCNCC2=C1 CS15863 [0,0,0,1,0,0|3,0,0]=4 336 B11R2.20 C1=NC=C2CCNCC2=C1 MC115896 [0,0,0,1,0,0|3,0,0]=4 337 B11R2.20 C1=NC=C2CNCCC2=C1 CS17812 [0,0,0,1,0,0|3,0,0]=4 338 B11R2.20 C1=NC=C2CNCCC2=C1 MC113298 [0,0,0,1,0,0|3,0,0]=4 339 B11R2.55 BrC1=NC=CC=C1C2CC2 CS16928 [0,0,0,1,0,0|2,0,0]=3 340 B11R2.55 ClC1=C(C2CO2)C=CC=C1 MC427453 [0,0,0,1,0,0|2,0,0]=3 341 B11R2.55 ClC1=NC=CC=C1C2CC2 MC430628 [0,0,0,1,0,0|2,0,0]=3 342 B11R2.55 NC1=C(C2CC2)C=NC=C1 CS17282 [0,0,0,1,0,0|2,0,0]=3 343 B11R2.106 BrC1=C2CCCC2=CC=C1 CS16754 [0,0,0,1,0,0|1,0,0]=2 344 B11R2.106 BrC1=C2CCNC2=CC=C1 CS18513 [0,0,0,1,0,0|2,0,0]=3 345 B11R2.106 BrC1=C2CNCC2=CC=C1 CS22684 [0,0,0,1,0,0|2,0,0]=3 346 B11R2.106 BrC1=C2CNCC2=CC=C1 MC443236 [0,0,0,1,0,0|2,0,0]=3 347 B11R2.106 BrC1=CC=CC2=C1OCC2 CS12983 [0,0,0,1,0,0|2,0,0]=3 348 B11R2.106 BrC1=CC=CC2=C1OCO2 CS22623 [0,0,0,1,0,0|3,0,0]=4 349 B11R2.106 BrC1=CN=CC2=C1NCC2 MC102119 [0,0,0,1,0,0|3,0,0]=4 350 B11R2.106 CC1=C2CCNC2=CC=C1 MC425439 [0,0,0,1,0,0|2,0,0]=3 351 B11R2.106 CC1=C2CNCC2=CC=C1 CS17946 [0,0,0,1,0,0|2,0,0]=3 352 B11R2.106 CC1=C2NCCC2=CC=C1 CS18412 [0,0,0,1,0,0|2,0,0]=3 353 B11R2.106 ClC1=C2CCCC2=NC=C1 CS12915 [0,0,0,1,0,0|2,0,0]=3 354 B11R2.106 ClC1=C2CCNC2=CC=C1 CS10845 [0,0,0,1,0,0|2,0,0]=3 355 B11R2.106 ClC1=C2CNCC2=CC=C1 CS15338 [0,0,0,1,0,0|2,0,0]=3 356 B11R2.106 ClC1=NC=CC2=C1CCN2 MC104776 [0,0,0,1,0,0|3,0,0]=4 357 B11R2.106 FC1=C2CCNC2=CC=C1 MC433917 [0,0,0,1,0,0|2,0,0]=3 358 B11R2.106 FC1=C2CNCC2=CC=C1 MC430022 [0,0,0,1,0,0|2,0,0]=3 359 B11R2.106 IC1=C2CCNC2=CC=C1 MC113807 [0,0,0,1,0,0|2,0,0]=3 360 B11R2.106 IC1=CC=CC2=C1OCO2 CS12923 [0,0,0,1,0,0|3,0,0]=4 361 B11R2.106 NC1=C2CCCC2=NC=C1 MC115911 [0,0,0,1,0,0|2,0,0]=3 362 B11R2.106 NC1=C2CCOC2=CC=C1 CS21040 [0,0,0,1,0,0|2,0,0]=3 363 B11R2.106 NC1=CC=CC2=C1CCN2 CS11498 [0,0,0,1,0,0|2,0,0]=3 364 B11R2.106 NC1=CC=CC2=C1CNC2 MC442084 [0,0,0,1,0,0|2,0,0]=3 365 B11R2.106 O=C1C=CC=C2NCCN12 CS15111 [0,0,0,1,0,0|2,0,1]=4 366 B11R2.106 O=C1C=CC=C2NCCN12 CS17486 [0,0,0,1,0,0|2,0,1]=4 367 B11R2.106 OC1=C2C=COC2=CC=C1 MC441157 [0,0,0,1,0,0|1,0,2]=4 368 B11R2.106 OC1=C2C=NNC2=CC=C1 MC444351 [0,0,0,1,0,0|2,0,1]=4 369 B11R2.106 OC1=C2N=COC2=CC=C1 MC443775 [0,0,0,1,0,0|2,0,1]=4 370 B11R2.106 OC1=C2N=CSC2=CC=C1 CS22602 [0,0,0,1,0,0|2,0,1]=4 371 B11R2.106 OC1=C2NN=CC2=CC=C1 CS17029 [0,0,0,1,0,0|2,0,1]=4 372 B11R2.106 OC1=CC=CC2=C1C=CN2 CS10821 [0,0,0,1,0,0|1,0,2]=4 373 B11R2.106 OC1=CC=CC2=C1CCC2 CS22898 [0,0,0,1,0,0|0,0,0]=1 374 B11R2.106 OC1=CC=CC2=C1OC=C2 MC441279 [0,0,0,1,0,0|1,0,2]=4 375 B9R1.33 CN1C=CC=C1CCO MC106498 [0,0,0,0,1,0|3,0,0]=4 376 B8R0.4 CCC\C=C\C=C\CO CS17006 [1,0,1,0,0,0|0,0,1]=3 377 B8R1.2 BrCC1=CC=NC=C1 CS22459 [2,0,0,0,0,0|2,0,0]=4 378 B8R1.2 BrCC1=CC=NC=C1 MC111773 [2,0,0,0,0,0|2,0,0]=4 379 B8R1.2 C#CC1=CC=CC=C1 CS19127 [2,0,0,0,0,0|0,0,2]=4 380 B8R1.2 CCC1=CC=CC=C1 MC41556 [2,0,0,0,0,0|0,0,0]=2 381 B8R1.2 CCC1=CC=CN=C1 CS22277 [2,0,0,0,0,0|1,0,0]=3 382 B8R1.2 CCC1=NC=CN=C1 CS21534 [2,0,0,0,0,0|2,0,0]=4 383 B8R1.2 CNC1=CC=CC=C1 CS11792 [2,0,0,0,0,0|1,0,0]=3 384 B8R1.2 CNC1=CC=CN=C1 CS13856 [2,0,0,0,0,0|2,0,0]=4 385 B8R1.2 CNC1=CC=NC=C1 MC41620 [2,0,0,0,0,0|2,0,0]=4 386 B8R1.2 COC1=CC=CC=C1 MC41309 [2,0,0,0,0,0|1,0,0]=3 387 B8R1.2 COC1=CC=CN=C1 CS22348 [2,0,0,0,0,0|2,0,0]=4 388 B8R1.2 COC1=CC=NC=C1 CS19206 [2,0,0,0,0,0|2,0,0]=4 389 B8R1.2 COC1=NC=CC=C1 CS18780 [2,0,0,0,0,0|2,0,0]=4 390 B8R1.2 CSC1=CC=CC=C1 MC439137 [2,0,0,0,0,0|1,0,0]=3 391 B8R1.2 CSC1=NC=CC=C1 MC41628 [2,0,0,0,0,0|2,0,0]=4 392 B8R1.2 ClCC1=CC=CN=C1 CS19291 [2,0,0,0,0,0|2,0,0]=4 393 B8R1.2 ClCC1=NC=CC=C1 CS19289 [2,0,0,0,0,0|2,0,0]=4 394 B8R1.2 ICC1=CC=CC=C1 CS11000 [2,0,0,0,0,0|1,0,0]=3 395 B8R1.2 ICC1=CC=CN=C1 MC430640 [2,0,0,0,0,0|2,0,0]=4 396 B8R1.2 I[Zn]c1ccccc1 MC121332 [2,0,0,0,0,0|2,0,0]=4 397 B8R1.2 N#CC1=CC=CC=C1 MC40623 [2,0,0,0,0,0|1,0,1]=4 398 B8R1.2 N#Cc1ccccc1 CS13696 [2,0,0,0,0,0|1,0,1]=4 399 B8R1.2 NCC1=CC=CC=C1 MC40797 [2,0,0,0,0,0|1,0,0]=3 400 B8R1.2 NCC1=CC=CN=C1 CS14226 [2,0,0,0,0,0|2,0,0]=4 401 B8R1.2 NCC1=CC=NC=C1 CS11906 [2,0,0,0,0,0|2,0,0]=4 402 B8R1.2 NCC1=CC=NC=C1 CS19023 [2,0,0,0,0,0|2,0,0]=4 403 B8R1.2 NNC1=CC=CC=C1 CS15210 [2,0,0,0,0,0|2,0,0]=4 404 B8R1.2 NNC1=CC=CC=C1 MC427075 [2,0,0,0,0,0|2,0,0]=4 405 B8R1.2 O=NC1=CC=CC=C1 MC33163 [2,0,0,0,0,0|2,0,0]=4 406 B8R1.2 OCC1=CC=CC=C1 MC40684 [2,0,0,0,0,0|1,0,0]=3 407 B8R1.2 OCC1=CC=CN=C1 CS22409 [2,0,0,0,0,0|2,0,0]=4 408 B8R1.2 OCC1=CC=NC=C1 CS19163 [2,0,0,0,0,0|2,0,0]=4 409 B8R1.2 OCC1=NC=CC=C1 CS19164 [2,0,0,0,0,0|2,0,0]=4 410 B8R1.5 BrC1=C(Br)C=CC=C1 CS19765 [2,0,0,0,0,0|2,0,0]=4 411 B8R1.5 BrC1=C(I)C=CC=C1 CS19157 [2,0,0,0,0,0|2,0,0]=4 412 B8R1.5 CC1=C(Br)C=CC=C1 MC20187 [2,0,0,0,0,0|1,0,0]=3 413 B8R1.5 CC1=C(Br)C=CN=C1 CS13416 [2,0,0,0,0,0|2,0,0]=4 414 B8R1.5 CC1=C(Br)C=NC=C1 CS21916 [2,0,0,0,0,0|2,0,0]=4 415 B8R1.5 CC1=C(Cl)C=CC=C1 CS20009 [2,0,0,0,0,0|1,0,0]=3 416 B8R1.5 CC1=C(Cl)C=CN=C1 CS18038 [2,0,0,0,0,0|2,0,0]=4 417 B8R1.5 CC1=C(Cl)C=NC=C1 CS15751 [2,0,0,0,0,0|2,0,0]=4 418 B8R1.5 CC1=C(F)C=CC=C1 MC41519 [2,0,0,0,0,0|1,0,0]=3 419 B8R1.5 CC1=C(F)C=CN=C1 MC433051 [2,0,0,0,0,0|2,0,0]=4 420 B8R1.5 CC1=C(F)C=NC=C1 CS19332 [2,0,0,0,0,0|2,0,0]=4 421 B8R1.5 CC1=C(I)C=CC=C1 CS19198 [2,0,0,0,0,0|1,0,0]=3 422 B8R1.5 CC1=C(N)C=CN=C1 CS19521 [2,0,0,0,0,0|2,0,0]=4 423 B8R1.5 CC1=C(N)C=NC=C1 CS21907 [2,0,0,0,0,0|2,0,0]=4 424 B8R1.5 CC1=C(O)C=CN=C1 CS13965 [2,0,0,0,0,0|1,0,0]=3 425 B8R1.5 CC1=C(O)C=NC=C1 CS22316 [2,0,0,0,0,0|1,0,0]=3 426 B8R1.5 CC1=CC=CC=C1C MC41549 [2,0,0,0,0,0|1,0,0]=3 427 B8R1.5 CC1=CC=CC=C1N CS20592 [2,0,0,0,0,0|1,0,0]=3 428 B8R1.5 CC1=CC=CC=C1O CS11813 [2,0,0,0,0,0|0,0,0]=2 429 B8R1.5 CC1=CC=CN=C1Br CS23002 [2,0,0,0,0,0|2,0,0]=4 430 B8R1.5 CC1=CC=CN=C1C CS21050 [2,0,0,0,0,0|2,0,0]=4 431 B8R1.5 CC1=CC=CN=C1Cl CS13857 [2,0,0,0,0,0|2,0,0]=4 432 B8R1.5 CC1=CC=CN=C1F CS19328 [2,0,0,0,0,0|2,0,0]=4 433 B8R1.5 CC1=CC=CN=C1N CS13775 [2,0,0,0,0,0|2,0,0]=4 434 B8R1.5 CC1=CC=CN=C1O CS19498 [2,0,0,0,0,0|1,0,0]=3 435 B8R1.5 CC1=CN=CN=C1O CS10459 [2,0,0,0,0,0|2,0,0]=4 436 B8R1.5 CC1=NC=CC=C1Br MC20012 [2,0,0,0,0,0|2,0,0]=4 437 B8R1.5 CC1=NC=CC=C1Cl MC425470 [2,0,0,0,0,0|2,0,0]=4 438 B8R1.5 CC1=NC=CC=C1F CS19850 [2,0,0,0,0,0|2,0,0]=4 439 B8R1.5 CC1=NC=CC=C1N CS19518 [2,0,0,0,0,0|2,0,0]=4 440 B8R1.5 CC1=NC=CC=C1O MC20374 [2,0,0,0,0,0|1,0,0]=3 441 B8R1.5 CC1=NC=CN=C1O CS21577 [2,0,0,0,0,0|2,0,0]=4 442 B8R1.5 C[N+]1=C(Cl)C=CC=C1 CS19467 [2,0,0,0,0,0|2,0,0]=4 443 B8R1.5 ClC1=C(Br)C=CC=C1 CS21391 [2,0,0,0,0,0|2,0,0]=4 444 B8R1.5 ClC1=C(Cl)C=CC=C1 MC41478 [2,0,0,0,0,0|2,0,0]=4 445 B8R1.5 FC1=C(Br)C=CC=C1 CS19658 [2,0,0,0,0,0|2,0,0]=4 446 B8R1.5 FC1=C(Cl)C=CC=C1 MC429398 [2,0,0,0,0,0|2,0,0]=4 447 B8R1.5 FC1=C(F)C=CC=C1 CS20490 [2,0,0,0,0,0|2,0,0]=4 448 B8R1.5 FC1=C(I)C=CC=C1 MC429560 [2,0,0,0,0,0|2,0,0]=4 449 B8R1.5 FC1=C(S)C=CC=C1 MC429404 [2,0,0,0,0,0|1,1,0]=4 450 B8R1.5 IC1=C(I)C=CC=C1 MC41488 [2,0,0,0,0,0|2,0,0]=4 451 B8R1.5 NC1=C(Br)C=CC=C1 CS19197 [2,0,0,0,0,0|2,0,0]=4 452 B8R1.5 NC1=C(Cl)C=CC=C1 CS19766 [2,0,0,0,0,0|2,0,0]=4 453 B8R1.5 NC1=C(F)C=CC=C1 MC40915 [2,0,0,0,0,0|2,0,0]=4 454 B8R1.5 NC1=C(I)C=CC=C1 CS23020 [2,0,0,0,0,0|2,0,0]=4 455 B8R1.5 NC1=C(O)C=CC=C1 CS21309 [2,0,0,0,0,0|1,0,0]=3 456 B8R1.5 NC1=C(O)C=CN=C1 MC427456 [2,0,0,0,0,0|2,0,0]=4 457 B8R1.5 NC1=C(O)C=NC=C1 CS14741 [2,0,0,0,0,0|2,0,0]=4 458 B8R1.5 NC1=C(S)C=CC=C1 MC41400 [2,0,0,0,0,0|1,1,0]=4 459 B8R1.5 NC1=CC=CC=C1N CS11822 [2,0,0,0,0,0|2,0,0]=4 460 B8R1.5 NC1=NC=CC=C1O CS22765 [2,0,0,0,0,0|2,0,0]=4 461 B8R1.5 O=C1C=COC=C1O CS16007 [2,0,0,0,0,0|2,0,0]=4 462 B8R1.5 O=C1NC=CC=C1O CS22752 [2,0,0,0,0,0|2,0,0]=4 463 B8R1.5 O=C1OC=CC=C1O CS22311 [2,0,0,0,0,0|2,0,0]=4 464 B8R1.5 OC1=C(Br)C=CC=C1 CS19429 [2,0,0,0,0,0|1,0,0]=3 465 B8R1.5 OC1=C(Br)C=CN=C1 CS13781 [2,0,0,0,0,0|2,0,0]=4 466 B8R1.5 OC1=C(Br)C=NC=C1 CS14222 [2,0,0,0,0,0|2,0,0]=4 467 B8R1.5 OC1=C(Cl)C=CC=C1 MC41174 [2,0,0,0,0,0|1,0,0]=3 468 B8R1.5 OC1=C(Cl)C=CN=C1 CS16383 [2,0,0,0,0,0|2,0,0]=4 469 B8R1.5 OC1=C(Cl)C=NC=C1 CS16225 [2,0,0,0,0,0|2,0,0]=4 470 B8R1.5 OC1=C(F)C=CC=C1 MC20096 [2,0,0,0,0,0|1,0,0]=3 471 B8R1.5 OC1=C(F)C=NC=C1 CS22284 [2,0,0,0,0,0|2,0,0]=4 472 B8R1.5 OC1=C(I)C=CC=C1 MC20193 [2,0,0,0,0,0|1,0,0]=3 473 B8R1.5 OC1=C(I)C=CN=C1 CS12130 [2,0,0,0,0,0|2,0,0]=4 474 B8R1.5 OC1=C(I)C=NC=C1 MC425611 [2,0,0,0,0,0|2,0,0]=4 475 B8R1.5 OC1=CC=CC=C1O CS11109 [2,0,0,0,0,0|1,0,0]=3 476 B8R1.5 OC1=CC=CN=C1Br CS17449 [2,0,0,0,0,0|2,0,0]=4 477 B8R1.5 OC1=CC=CN=C1Cl CS17508 [2,0,0,0,0,0|2,0,0]=4 478 B8R1.5 OC1=CC=CN=C1F CS13836 [2,0,0,0,0,0|2,0,0]=4 479 B8R1.5 OC1=CC=CN=C1I CS14294 [2,0,0,0,0,0|2,0,0]=4 480 B8R1.5 OC1=NC=CC=C1Br CS18703 [2,0,0,0,0,0|2,0,0]=4 481 B8R1.5 SC1=C(I)C=CC=C1 MC41410 [2,0,0,0,0,0|1,1,0]=4 482 B8R1.5 [O-][N+]1=C(O)C=CC=C1 CS21603 [2,0,0,0,0,0|2,0,0]=4 483 B10R1.1 Br[Zn]Cc1ccc(Br)cc1 MC121353 [1,1,0,0,0,0|2,0,0]=4 484 B10R1.1 CC1=CC=C(CC#N)C=C1 CS21709 [1,1,0,0,0,0|1,0,1]=4 485 B10R1.1 CC1=CC=C(CCBr)C=C1 CS19977 [1,1,0,0,0,0|1,0,0]=3 486 B10R1.1 CC1=CC=C(CCN)C=C1 CS18979 [1,1,0,0,0,0|1,0,0]=3 487 B10R1.1 CC1=CC=C(CCO)C=C1 MC40744 [1,1,0,0,0,0|1,0,0]=3 488 B10R1.1 CC1=CC=C(CNN)C=C1 CS20201 [1,1,0,0,0,0|2,0,0]=4 489 B10R1.1 CCCC1=CC=C(Br)C=C1 CS10896 [1,1,0,0,0,0|0,0,0]=2 490 B10R1.1 CCOC1=CC=C(Br)C=C1 MC446797 [1,1,0,0,0,0|1,0,0]=3 491 B10R1.1 CCOC1=CC=C(I)C=C1 CS22907 [1,1,0,0,0,0|1,0,0]=3 492 B10R1.1 CCOC1=CC=C(N)C=C1 CS11879 [1,1,0,0,0,0|1,0,0]=3 493 B10R1.1 CCOC1=CN=C(N)C=C1 CS15063 [1,1,0,0,0,0|2,0,0]=4 494 B10R1.1 CCOC1=NC=C(Br)C=C1 CS22026 [1,1,0,0,0,0|2,0,0]=4 495 B10R1.1 CCOC1=NC=C(N)C=C1 CS14713 [1,1,0,0,0,0|2,0,0]=4 496 B10R1.1 CNCC1=CC=C(Br)C=C1 CS19272 [1,1,0,0,0,0|1,0,0]=3 497 B10R1.1 CNCC1=CC=C(C)C=C1 CS11795 [1,1,0,0,0,0|1,0,0]=3 498 B10R1.1 CSCC1=NC=C(Br)C=C1 MC112104 [1,1,0,0,0,0|2,0,0]=4 499 B10R1.1 ClC1=CC=C(CCBr)C=C1 CS10835 [1,1,0,0,0,0|1,0,0]=3 500 B10R1.1 ClCCC1=CC=C(Cl)C=C1 MC433885 [1,1,0,0,0,0|1,0,0]=3 501 B10R1.1 FC1=CC=C(CCBr)C=C1 CS10866 [1,1,0,0,0,0|1,0,0]=3 502 B10R1.1 Fc1ccc(C[Zn]Cl)cc1 MC121346 [1,1,0,0,0,0|2,0,0]=4 503 B10R1.1 N#CCC1=CC=C(Br)C=C1 CS20687 [1,1,0,0,0,0|1,0,1]=4 504 B10R1.1 N#CCC1=CC=C(Cl)C=C1 MC20790 [1,1,0,0,0,0|1,0,1]=4 505 B10R1.1 N#CCC1=CC=C(F)C=C1 CS14479 [1,1,0,0,0,0|1,0,1]=4 506 B10R1.1 N#CCC1=CC=C(I)C=C1 MC40782 [1,1,0,0,0,0|1,0,1]=4 507 B10R1.1 N#CCC1=CC=C(N)C=C1 MC40751 [1,1,0,0,0,0|1,0,1]=4 508 B10R1.1 NC1=CC=C(CCO)C=C1 CS13450 [1,1,0,0,0,0|1,0,0]=3 509 B10R1.1 NCCC1=CC=C(Br)C=C1 CS19296 [1,1,0,0,0,0|1,0,0]=3 510 B10R1.1 NCCC1=CC=C(Cl)C=C1 MC40975 [1,1,0,0,0,0|1,0,0]=3 511 B10R1.1 NCCC1=CC=C(F)C=C1 CS13766 [1,1,0,0,0,0|1,0,0]=3 512 B10R1.1 NCCC1=CC=C(N)C=C1 MC33045 [1,1,0,0,0,0|1,0,0]=3 513 B10R1.1 NCCC1=CC=C(O)C=C1 CS22315 [1,1,0,0,0,0|1,0,0]=3 514 B10R1.1 NCCC1=CNC(=O)C=C1 MC33499 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.1 NNCC1=CC=C(F)C=C1 CS17057 [1,1,0,0,0,0|2,0,0]=4 516 B10R1.1 O=CCC1=CC=C(Br)C=C1 CS18203 [1,1,0,0,0,0|1,0,1]=4 517 B10R1.1 OCCC1=CC=C(Br)C=C1 CS14491 [1,1,0,0,0,0|1,0,0]=3 518 B10R1.1 OCCC1=CC=C(Cl)C=C1 CS22791 [1,1,0,0,0,0|1,0,0]=3 519 B10R1.1 OCCC1=CC=C(F)C=C1 MC33200 [1,1,0,0,0,0|1,0,0]=3 520 B10R1.1 OCCC1=CC=C(I)C=C1 CS12086 [1,1,0,0,0,0|1,0,0]=3 521 B10R1.1 OCCC1=CC=C(O)C=C1 CS20458 [1,1,0,0,0,0|1,0,0]=3 522 B10R1.1 OCCC1=NC=C(Br)C=C1 MC102395 [1,1,0,0,0,0|2,0,0]=4 523 B10R1.10 Br[Zn]Cc1cccc(Br)c1 MC121352 [1,1,0,0,0,0|2,0,0]=4 524 B10R1.10 C=CCC1=CC=CC(O)=C1 MC425380 [1,1,0,0,0,0|0,0,2]=4 525 B10R1.10 CC1=CC(CC#N)=CC=C1 CS18941 [1,1,0,0,0,0|1,0,1]=4 526 B10R1.10 CC1=CC(CCO)=CC=C1 CS22372 [1,1,0,0,0,0|1,0,0]=3 527 B10R1.10 CCCc1cccc(F)c1 MC440476 [1,1,0,0,0,0|0,0,0]=2 528 B10R1.10 CCNC1=NC=CC(N)=C1 CS14774 [1,1,0,0,0,0|2,0,0]=4 529 B10R1.10 CCOC1=CC(Br)=NC=C1 MC430483 [1,1,0,0,0,0|2,0,0]=4 530 B10R1.10 CCOC1=CC(N)=NC=C1 MC20309 [1,1,0,0,0,0|2,0,0]=4 531 B10R1.10 CCOC1=CC=CC(N)=N1 MC33459 [1,1,0,0,0,0|2,0,0]=4 532 B10R1.10 CCOC1=CN=CC(Br)=C1 MC107004 [1,1,0,0,0,0|2,0,0]=4 533 B10R1.10 CCOC1=CN=CC(Cl)=C1 MC443271 [1,1,0,0,0,0|2,0,0]=4 534 B10R1.10 CCOC1=NC=CC(Cl)=C1 MC113277 [1,1,0,0,0,0|2,0,0]=4 535 B10R1.10 CNCC1=CC(F)=CN=C1 MC105914 [1,1,0,0,0,0|2,0,0]=4 536 B10R1.10 CNCC1=NC=CC(Cl)=C1 MC102697 [1,1,0,0,0,0|2,0,0]=4 537 B10R1.10 COCC1=CC(Cl)=NC=C1 MC425095 [1,1,0,0,0,0|2,0,0]=4 538 B10R1.10 FC1=CC=CC(CCBr)=C1 MC40572 [1,1,0,0,0,0|1,0,0]=3 539 B10R1.10 Fc1cccc(C[Zn]Cl)c1 MC121345 [1,1,0,0,0,0|2,0,0]=4 540 B10R1.10 N#CCC1=CC(Br)=CC=C1 CS18969 [1,1,0,0,0,0|1,0,1]=4 541 B10R1.10 N#CCC1=CC(Cl)=CC=C1 CS13745 [1,1,0,0,0,0|1,0,1]=4 542 B10R1.10 N#CCC1=CC(F)=CC=C1 MC20212 [1,1,0,0,0,0|1,0,1]=4 543 B10R1.10 N#CCC1=CC(N)=CC=C1 MC433930 [1,1,0,0,0,0|1,0,1]=4 544 B10R1.10 NC1=CC=CC(CCO)=C1 CS22105 [1,1,0,0,0,0|1,0,0]=3 545 B10R1.10 NCCC1=CC(Br)=CC=C1 CS15159 [1,1,0,0,0,0|1,0,0]=3 546 B10R1.10 NCCC1=CC(F)=CC=C1 MC40979 [1,1,0,0,0,0|1,0,0]=3 547 B10R1.10 NNCC1=CC(O)=CC=C1 MC10382 [1,1,0,0,0,0|2,0,0]=4 548 B10R1.10 O=CCC1=CC(O)=CC=C1 MC106361 [1,1,0,0,0,0|1,0,1]=4 549 B10R1.10 OCCC1=CC(Br)=CC=C1 CS22186 [1,1,0,0,0,0|1,0,0]=3 550 B10R1.10 OCCC1=CC(Cl)=CC=C1 CS22241 [1,1,0,0,0,0|1,0,0]=3 551 B10R1.10 OCCC1=CC(F)=CC=C1 MC40743 [1,1,0,0,0,0|1,0,0]=3 552 B10R1.15 C=C(CBr)C1=CC=CC=C1 CS20091 [1,1,0,0,0,0|1,0,1]=4 553 B10R1.15 C=CC(N)C1=CC=CC=C1 MC102512 [1,1,0,0,0,0|0,0,2]=4 554 B10R1.15 CC(CN)C1=CC=CC=C1 CS10909 [1,1,0,0,0,0|1,0,0]=3 555 B10R1.15 CC(CN)c1ccccc1 MC110750 [1,1,0,0,0,0|1,0,0]=3 556 B10R1.15 CC(NO)c1ccccc1 MC103844 [1,1,0,0,0,0|2,0,0]=4 557 B10R1.15 CC(NO)c1ccccc1 MC103845 [1,1,0,0,0,0|2,0,0]=4 558 B10R1.15 CCC(C)C1=CC=CC=C1 CS11947 [1,1,0,0,0,0|0,0,0]=2 559 B10R1.15 CCC(C)C1=CC=CC=C1 MC433489 [1,1,0,0,0,0|0,0,0]=2 560 B10R1.15 CCC(N)C1=CC=CC=C1 MC20337 [1,1,0,0,0,0|0,0,0]=2 561 B10R1.15 CCC(N)C1=NC=CN=C1 MC104764 [1,1,0,0,0,0|2,0,0]=4 562 B10R1.15 COC(=O)C1=CC=CC=C1 MC40065 [1,1,0,0,0,0|1,0,1]=4 563 B10R1.15 FC(CBr)C1=CC=CC=C1 MC102769 [1,1,0,0,0,0|1,0,0]=3 564 B10R1.15 N#CC(N)C1=CC=CC=C1 MC31161 [1,1,0,0,0,0|1,0,1]=4 565 B10R1.15 NC(CO)C1=CC=CC=C1 CS10553 [1,1,0,0,0,0|1,0,0]=3 566 B10R1.15 NC(CO)C1=CC=CC=C1 CS10555 [1,1,0,0,0,0|1,0,0]=3 567 B10R1.15 NC(CO)C1=CC=CC=C1 CS15860 [1,1,0,0,0,0|1,0,0]=3 568 B10R1.15 NC(CO)C1=NC=CC=C1 MC111155 [1,1,0,0,0,0|2,0,0]=4 569 B10R1.15 NCC(=O)C1=CC=CC=C1 CS10874 [1,1,0,0,0,0|1,0,1]=4 570 B10R1.15 NCC(O)C1=CC=CC=C1 CS20485 [1,1,0,0,0,0|1,0,0]=3 571 B10R1.15 NCC(O)C1=CC=CC=C1 MC444625 [1,1,0,0,0,0|1,0,0]=3 572 B10R1.15 NCC(O)C1=CC=CN=C1 MC103058 [1,1,0,0,0,0|2,0,0]=4 573 B10R1.15 NCC(O)C1=NC=CC=C1 MC33503 [1,1,0,0,0,0|2,0,0]=4 574 B10R1.15 O=C(CBr)C1=CC=CC=C1 CS19274 [1,1,0,0,0,0|1,0,1]=4 575 B10R1.15 O=C(CCl)C1=CC=CC=C1 MC20159 [1,1,0,0,0,0|1,0,1]=4 576 B10R1.15 O=C(CI)C1=CC=CC=C1 MC433244 [1,1,0,0,0,0|1,0,1]=4 577 B10R1.15 OC(CBr)C1=CC=CC=C1 CS18840 [1,1,0,0,0,0|1,0,0]=3 578 B10R1.15 OC(CCl)C1=CC=CN=C1 MC103059 [1,1,0,0,0,0|2,0,0]=4 579 B10R1.15 OCC(F)C1=CC=CC=C1 MC430923 [1,1,0,0,0,0|1,0,0]=3 580 B10R1.17 BrCCOC1=CC=CC=C1 MC20150 [1,1,0,0,0,0|1,0,0]=3 581 B10R1.17 Br[Zn]CCc1ccccc1 MC121341 [1,1,0,0,0,0|1,0,0]=3 582 B10R1.17 CNCCC1=CC=CC=C1 MC446670 [1,1,0,0,0,0|0,0,0]=2 583 B10R1.17 ClCCOC1=CC=CC=C1 MC33174 [1,1,0,0,0,0|1,0,0]=3 584 B10R1.17 ClC\C=C\C1=CC=CC=C1 MC41818 [1,1,0,0,0,0|0,0,2]=4 585 B10R1.17 NCCCC1=CC=NC=C1 MC425564 [1,1,0,0,0,0|1,0,0]=3 586 B10R1.17 NCCNC1=NC=CC=C1 CS11746 [1,1,0,0,0,0|2,0,0]=4 587 B10R1.17 NCCOC1=CC=CC=C1 CS20484 [1,1,0,0,0,0|1,0,0]=3 588 B10R1.17 NCCOC1=CC=CN=C1 CS16368 [1,1,0,0,0,0|2,0,0]=4 589 B10R1.17 NOCCC1=CC=NC=C1 MC427573 [1,1,0,0,0,0|2,0,0]=4 590 B10R1.17 OCCCC1=CC=NC=C1 CS22019 [1,1,0,0,0,0|1,0,0]=3 591 B10R1.17 OCCOC1=CC=CC=C1 MC41398 [1,1,0,0,0,0|1,0,0]=3 592 B10R1.18 CC(=O)CC1=CC=CN=C1 MC102696 [1,1,0,0,0,0|1,0,1]=4 593 B10R1.18 CC(=O)CC1=CC=NC=C1 CS20988 [1,1,0,0,0,0|1,0,1]=4 594 B10R1.18 CC(=O)CC1=NC=CC=C1 CS20802 [1,1,0,0,0,0|1,0,1]=4 595 B10R1.18 CC(=O)NC1=CC=CC=C1 MC34102 [1,1,0,0,0,0|1,0,1]=4 596 B10R1.18 CC(Br)CC1=CC=CC=C1 MC41813 [1,1,0,0,0,0|0,0,0]=2 597 B10R1.18 CC(C)NC1=CC=CC=C1 CS11787 [1,1,0,0,0,0|1,0,0]=3 598 B10R1.18 CC(C)OC1=CC=CC=C1 MC41360 [1,1,0,0,0,0|1,0,0]=3 599 B10R1.18 FC(F)OC1=CC=CC=C1 MC41385 [1,1,0,0,0,0|2,0,0]=4 600 B10R1.18 FC(F)SC1=CC=CC=C1 MC428027 [1,1,0,0,0,0|2,0,0]=4 601 B10R1.18 O=C([O-])CC1=CC=CC=C1 MC34448 [1,1,0,0,0,0|1,0,1]=4 602 B10R1.2 CC1=C(CO)C=CC=C1Br MC40689 [1,1,0,0,0,0|2,0,0]=4 603 B10R1.2 CC1=C(O)C=CC=C1CO MC425562 [1,1,0,0,0,0|2,0,0]=4 604 B10R1.2 CC1=CC=CC(C=O)=C1O CS20930 [1,1,0,0,0,0|1,0,1]=4 605 B10R1.2 CC1=CC=CC(CBr)=C1C CS10894 [1,1,0,0,0,0|2,0,0]=4 606 B10R1.2 CC1=CC=CC(CN)=C1C MC40822 [1,1,0,0,0,0|2,0,0]=4 607 B10R1.2 CC1=CC=CC(CO)=C1C CS20113 [1,1,0,0,0,0|2,0,0]=4 608 B10R1.2 CCC1=C(O)C(F)=CC=C1 MC431776 [1,1,0,0,0,0|0,0,0]=2 609 B10R1.2 CCC1=C(O)C(O)=CC=C1 MC442025 [1,1,0,0,0,0|0,0,0]=2 610 B10R1.2 CCC1=CC=CC(Br)=C1O MC442827 [1,1,0,0,0,0|0,0,0]=2 611 B10R1.2 CCC1=CC=CC(Cl)=C1N MC443589 [1,1,0,0,0,0|1,0,0]=3 612 B10R1.2 CCC1=CC=CC(Cl)=C1O MC441042 [1,1,0,0,0,0|0,0,0]=2 613 B10R1.2 CCC1=CC=CC(O)=C1F MC442498 [1,1,0,0,0,0|1,0,0]=3 614 B10R1.2 COC1=C(Br)C(Cl)=CC=C1 MC41311 [1,1,0,0,0,0|2,0,0]=4 615 B10R1.2 COC1=C(Br)C(F)=CC=C1 MC429428 [1,1,0,0,0,0|2,0,0]=4 616 B10R1.2 COC1=C(Br)C(I)=CC=C1 MC41319 [1,1,0,0,0,0|2,0,0]=4 617 B10R1.2 COC1=C(C)C(C)=CC=C1 MC20206 [1,1,0,0,0,0|2,0,0]=4 618 B10R1.2 COC1=C(C)C(Cl)=CC=C1 MC20115 [1,1,0,0,0,0|2,0,0]=4 619 B10R1.2 COC1=C(F)C(Br)=CC=C1 MC20208 [1,1,0,0,0,0|2,0,0]=4 620 B10R1.2 COC1=C(I)C(F)=CC=C1 MC433387 [1,1,0,0,0,0|2,0,0]=4 621 B10R1.2 COC1=C(I)C(N)=CC=C1 MC433348 [1,1,0,0,0,0|2,0,0]=4 622 B10R1.2 COC1=C(N)C(C)=CC=C1 MC427399 [1,1,0,0,0,0|2,0,0]=4 623 B10R1.2 COC1=C(N)C(N)=CC=C1 CS12559 [1,1,0,0,0,0|2,0,0]=4 624 B10R1.2 COC1=CC=CC(Br)=C1C MC442371 [1,1,0,0,0,0|2,0,0]=4 625 B10R1.2 COC1=CC=CC(Br)=C1I CS14393 [1,1,0,0,0,0|2,0,0]=4 626 B10R1.2 COC1=CC=CC(Br)=C1O MC442834 [1,1,0,0,0,0|1,0,0]=3 627 B10R1.2 COC1=CC=CC(Cl)=C1N CS16113 [1,1,0,0,0,0|2,0,0]=4 628 B10R1.2 COC1=CC=CC(Cl)=C1O MC441233 [1,1,0,0,0,0|1,0,0]=3 629 B10R1.2 COC1=CC=CC(F)=C1F CS21031 [1,1,0,0,0,0|2,0,0]=4 630 B10R1.2 COC1=CC=CC(F)=C1N CS21557 [1,1,0,0,0,0|2,0,0]=4 631 B10R1.2 COC1=CC=CC(F)=C1O MC433388 [1,1,0,0,0,0|1,0,0]=3 632 B10R1.2 COC1=CC=CC(I)=C1C MC442370 [1,1,0,0,0,0|2,0,0]=4 633 B10R1.2 COC1=CC=CC(N)=C1Br CS21335 [1,1,0,0,0,0|2,0,0]=4 634 B10R1.2 COC1=CC=CC(N)=C1C CS10556 [1,1,0,0,0,0|2,0,0]=4 635 B10R1.2 COC1=CC=CC(N)=C1Cl CS18618 [1,1,0,0,0,0|2,0,0]=4 636 B10R1.2 COC1=CC=CC(N)=C1Cl MC428124 [1,1,0,0,0,0|2,0,0]=4 637 B10R1.2 COC1=CC=CC(N)=C1F CS12736 [1,1,0,0,0,0|2,0,0]=4 638 B10R1.2 COC1=CC=CC(N)=C1O CS17187 [1,1,0,0,0,0|1,0,0]=3 639 B10R1.2 COC1=CC=CC(N)=C1O MC121305 [1,1,0,0,0,0|1,0,0]=3 640 B10R1.2 COC1=CC=CC(O)=C1Br MC443182 [1,1,0,0,0,0|2,0,0]=4 641 B10R1.2 COC1=CC=CC(O)=C1Cl CS21434 [1,1,0,0,0,0|2,0,0]=4 642 B10R1.2 COC1=CC=CC(O)=C1F MC442393 [1,1,0,0,0,0|2,0,0]=4 643 B10R1.2 COC1=CC=CC(O)=C1I MC111957 [1,1,0,0,0,0|2,0,0]=4 644 B10R1.2 COC1=CC=CC(O)=C1N CS16742 [1,1,0,0,0,0|2,0,0]=4 645 B10R1.2 CSC1=C(C)C(Cl)=CC=C1 MC20573 [1,1,0,0,0,0|2,0,0]=4 646 B10R1.2 ClC1=CC=CC(CBr)=C1Cl CS19151 [1,1,0,0,0,0|2,0,0]=4 647 B10R1.2 FC1=C(CBr)C=CC=C1Br MC433846 [1,1,0,0,0,0|2,0,0]=4 648 B10R1.2 FC1=C(CBr)C=CC=C1Cl CS19361 [1,1,0,0,0,0|2,0,0]=4 649 B10R1.2 FC1=CC=CC(CBr)=C1Br MC433843 [1,1,0,0,0,0|2,0,0]=4 650 B10R1.2 FC1=CC=CC(CBr)=C1Cl CS19380 [1,1,0,0,0,0|2,0,0]=4 651 B10R1.2 FC1=CC=CC(CBr)=C1F CS18619 [1,1,0,0,0,0|2,0,0]=4 652 B10R1.2 N#CC1=C(O)C(Br)=CC=C1 MC442373 [1,1,0,0,0,0|1,0,1]=4 653 B10R1.2 N#CC1=C(O)C(Cl)=CC=C1 MC441234 [1,1,0,0,0,0|1,0,1]=4 654 B10R1.2 N#CC1=C(O)C(F)=CC=C1 MC40658 [1,1,0,0,0,0|1,0,1]=4 655 B10R1.2 N#CC1=C(O)C(N)=CC=C1 MC442219 [1,1,0,0,0,0|1,0,1]=4 656 B10R1.2 N#CC1=C(O)C(O)=CC=C1 MC441227 [1,1,0,0,0,0|1,0,1]=4 657 B10R1.2 NC1=C(CO)C=CC=C1Cl CS14362 [1,1,0,0,0,0|2,0,0]=4 658 B10R1.2 NC1=CC=CC(CO)=C1F CS12522 [1,1,0,0,0,0|2,0,0]=4 659 B10R1.2 NCC1=C(Cl)C(Cl)=CC=C1 MC40813 [1,1,0,0,0,0|2,0,0]=4 660 B10R1.2 NCC1=C(Cl)C(F)=CC=C1 MC33193 [1,1,0,0,0,0|2,0,0]=4 661 B10R1.2 NCC1=C(F)C(Br)=CC=C1 MC113463 [1,1,0,0,0,0|2,0,0]=4 662 B10R1.2 NCC1=C(F)C(Cl)=CC=C1 MC33194 [1,1,0,0,0,0|2,0,0]=4 663 B10R1.2 NCC1=C(F)C(F)=CC=C1 MC40816 [1,1,0,0,0,0|2,0,0]=4 664 B10R1.2 O=CC1=C(O)C(Br)=CC=C1 CS20079 [1,1,0,0,0,0|1,0,1]=4 665 B10R1.2 O=CC1=C(O)C(Cl)=CC=C1 MC20676 [1,1,0,0,0,0|1,0,1]=4 666 B10R1.2 O=CC1=C(O)C(F)=CC=C1 CS20128 [1,1,0,0,0,0|1,0,1]=4 667 B10R1.2 O=CC1=C(O)C(I)=CC=C1 MC442738 [1,1,0,0,0,0|1,0,1]=4 668 B10R1.2 O=CC1=C(O)C(O)=CC=C1 CS21044 [1,1,0,0,0,0|1,0,1]=4 669 B10R1.2 OCC1=C(Br)C(Cl)=CC=C1 MC442478 [1,1,0,0,0,0|2,0,0]=4 670 B10R1.2 OCC1=C(Br)C(F)=CC=C1 MC433844 [1,1,0,0,0,0|2,0,0]=4 671 B10R1.2 OCC1=C(Cl)C(Cl)=CC=C1 MC40699 [1,1,0,0,0,0|2,0,0]=4 672 B10R1.2 OCC1=C(F)C(Br)=CC=C1 MC31105 [1,1,0,0,0,0|2,0,0]=4 673 B10R1.2 OCC1=C(F)C(F)=CC=C1 MC433152 [1,1,0,0,0,0|2,0,0]=4 674 B10R1.20 BrCC1=C(CBr)C=CC=C1 MC20537 [1,1,0,0,0,0|2,0,0]=4 675 B10R1.20 C#CC1=C(OC)C=CC=C1 CS21618 [1,1,0,0,0,0|0,0,2]=4 676 B10R1.20 CCC1=C(C#N)C=CC=C1 MC40655 [1,1,0,0,0,0|1,0,0]=3 677 B10R1.20 CCC1=C(C#N)C=CN=C1 MC427151 [1,1,0,0,0,0|2,0,0]=4 678 B10R1.20 CCC1=C(C=O)C=CC=C1 MC20141 [1,1,0,0,0,0|0,0,1]=3 679 B10R1.20 CCC1=C(NN)C=CC=C1 CS15134 [1,1,0,0,0,0|1,0,0]=3 680 B10R1.20 CNC1=C(C=O)C=CC=C1 CS17054 [1,1,0,0,0,0|1,0,1]=4 681 B10R1.20 CNC1=NC=CC=C1CO CS10541 [1,1,0,0,0,0|2,0,0]=4 682 B10R1.20 COC1=C(C#N)C=CC=C1 CS19247 [1,1,0,0,0,0|1,0,1]=4 683 B10R1.20 COC1=C(CCl)C=CC=C1 MC20247 [1,1,0,0,0,0|1,0,0]=3 684 B10R1.20 COC1=C(CN)C=CC=C1 CS15681 [1,1,0,0,0,0|1,0,0]=3 685 B10R1.20 COC1=C(NN)C=CC=C1 CS19579 [1,1,0,0,0,0|2,0,0]=4 686 B10R1.20 COC1=C(NN)C=CC=C1 MC433991 [1,1,0,0,0,0|2,0,0]=4 687 B10R1.20 COC1=C(OC)C=CC=C1 CS12067 [1,1,0,0,0,0|1,0,0]=3 688 B10R1.20 COC1=CC=CN=C1CBr CS13321 [1,1,0,0,0,0|2,0,0]=4 689 B10R1.20 COC1=CC=CN=C1CN CS18076 [1,1,0,0,0,0|2,0,0]=4 690 B10R1.20 COC1=CC=CN=C1CN MC431773 [1,1,0,0,0,0|2,0,0]=4 691 B10R1.20 COC1=CC=CN=C1OC CS14783 [1,1,0,0,0,0|2,0,0]=4 692 B10R1.20 COC1=NC=CC=C1CCl CS16832 [1,1,0,0,0,0|2,0,0]=4 693 B10R1.20 COC1=NC=CC=C1CN CS14780 [1,1,0,0,0,0|2,0,0]=4 694 B10R1.20 COC1=NC=CC=C1CN CS17327 [1,1,0,0,0,0|2,0,0]=4 695 B10R1.20 COC1=NC=CC=C1CO CS13650 [1,1,0,0,0,0|2,0,0]=4 696 B10R1.20 N#CC1=C(CBr)C=CC=C1 CS18879 [1,1,0,0,0,0|2,0,0]=4 697 B10R1.20 N#CC1=C(CCl)C=CC=C1 CS18396 [1,1,0,0,0,0|2,0,0]=4 698 B10R1.20 N#CC1=C(CN)C=CC=C1 CS15557 [1,1,0,0,0,0|2,0,0]=4 699 B10R1.20 N#CC1=C(CO)C=CC=C1 MC40696 [1,1,0,0,0,0|1,0,1]=4 700 B10R1.20 NCC1=C(CO)C=CC=C1 CS13269 [1,1,0,0,0,0|1,0,0]=3 701 B10R1.20 NCC1=NC=CC=C1CO MC33469 [1,1,0,0,0,0|2,0,0]=4 702 B10R1.20 OCC1=C(CBr)C=CC=C1 CS17090 [1,1,0,0,0,0|1,0,0]=3 703 B10R1.20 OCC1=CC=CC=C1CO MC433840 [1,1,0,0,0,0|1,0,0]=3 704 B10R1.20 OCC1=CC=CN=C1CO MC41610 [1,1,0,0,0,0|2,0,0]=4 705 B10R1.25 CC1=C(CCl)C=CC(Br)=C1 MC107510 [1,1,0,0,0,0|2,0,0]=4 706 B10R1.25 CC1=C(CN)C=CC(Br)=C1 MC20891 [1,1,0,0,0,0|2,0,0]=4 707 B10R1.25 CC1=C(CN)C=CC(F)=C1 MC40830 [1,1,0,0,0,0|2,0,0]=4 708 B10R1.25 CC1=C(CN)C=CC(O)=C1 MC442240 [1,1,0,0,0,0|2,0,0]=4 709 B10R1.25 CC1=C(CO)C=CC(Br)=C1 MC433849 [1,1,0,0,0,0|2,0,0]=4 710 B10R1.25 CC1=CC(Br)=C(CN)C=C1 MC112223 [1,1,0,0,0,0|2,0,0]=4 711 B10R1.25 CC1=CC(C)=C(CBr)C=C1 CS21116 [1,1,0,0,0,0|2,0,0]=4 712 B10R1.25 CC1=CC(C)=C(CCl)C=C1 MC40593 [1,1,0,0,0,0|2,0,0]=4 713 B10R1.25 CC1=CC(N)=C(CO)C=C1 CS21019 [1,1,0,0,0,0|2,0,0]=4 714 B10R1.25 CC1=CC(O)=C(C#N)C=C1 CS21585 [1,1,0,0,0,0|1,0,1]=4 715 B10R1.25 CC1=CC(O)=C(C=O)C=C1 MC33188 [1,1,0,0,0,0|1,0,1]=4 716 B10R1.25 CCC1=C(Br)C=C(N)C=C1 MC33284 [1,1,0,0,0,0|1,0,0]=3 717 B10R1.25 CCC1=C(Cl)C=C(N)C=C1 MC442501 [1,1,0,0,0,0|1,0,0]=3 718 B10R1.25 CCC1=C(N)C=C(F)C=C1 MC40914 [1,1,0,0,0,0|1,0,0]=3 719 B10R1.25 CCC1=NC=C(Br)C=C1N MC103443 [1,1,0,0,0,0|2,0,0]=4 720 B10R1.25 CCN1C=CC(Br)=CC1=O MC105073 [1,1,0,0,0,0|1,0,1]=4 721 B10R1.25 CNC1=CC=C(Br)C=C1N MC443280 [1,1,0,0,0,0|2,0,0]=4 722 B10R1.25 COC1=C(Br)C=C(Cl)C=C1 CS20168 [1,1,0,0,0,0|2,0,0]=4 723 B10R1.25 COC1=C(Br)C=C(F)C=C1 MC30075 [1,1,0,0,0,0|2,0,0]=4 724 B10R1.25 COC1=C(Br)C=C(I)C=C1 MC41320 [1,1,0,0,0,0|2,0,0]=4 725 B10R1.25 COC1=C(Br)C=C(N)C=C1 MC20804 [1,1,0,0,0,0|2,0,0]=4 726 B10R1.25 COC1=C(Br)C=C(O)C=C1 CS18795 [1,1,0,0,0,0|2,0,0]=4 727 B10R1.25 COC1=C(C)C=C(Br)C=C1 CS22652 [1,1,0,0,0,0|2,0,0]=4 728 B10R1.25 COC1=C(C)C=C(I)C=C1 MC41343 [1,1,0,0,0,0|2,0,0]=4 729 B10R1.25 COC1=C(C)C=C(N)C=C1 CS18714 [1,1,0,0,0,0|2,0,0]=4 730 B10R1.25 COC1=C(C)C=C(O)C=C1 MC442018 [1,1,0,0,0,0|2,0,0]=4 731 B10R1.25 COC1=C(Cl)C=C(C)C=C1 MC442301 [1,1,0,0,0,0|2,0,0]=4 732 B10R1.25 COC1=C(Cl)C=C(F)C=C1 MC30033 [1,1,0,0,0,0|2,0,0]=4 733 B10R1.25 COC1=C(Cl)C=C(N)C=C1 CS14858 [1,1,0,0,0,0|2,0,0]=4 734 B10R1.25 COC1=C(Cl)C=C(O)C=C1 MC442396 [1,1,0,0,0,0|2,0,0]=4 735 B10R1.25 COC1=C(F)C=C(Br)C=C1 MC30240 [1,1,0,0,0,0|2,0,0]=4 736 B10R1.25 COC1=C(F)C=C(I)C=C1 MC425677 [1,1,0,0,0,0|2,0,0]=4 737 B10R1.25 COC1=C(F)C=C(N)C=C1 CS10515 [1,1,0,0,0,0|2,0,0]=4 738 B10R1.25 COC1=C(F)C=C(O)C=C1 CS22287 [1,1,0,0,0,0|2,0,0]=4 739 B10R1.25 COC1=C(I)C=C(Br)C=C1 CS17024 [1,1,0,0,0,0|2,0,0]=4 740 B10R1.25 COC1=C(I)C=C(Cl)C=C1 MC41330 [1,1,0,0,0,0|2,0,0]=4 741 B10R1.25 COC1=C(I)C=C(N)C=C1 CS18915 [1,1,0,0,0,0|2,0,0]=4 742 B10R1.25 COC1=C(I)C=C(N)C=C1 CS19301 [1,1,0,0,0,0|2,0,0]=4 743 B10R1.25 COC1=C(N)C=C(Br)C=C1 CS10268 [1,1,0,0,0,0|2,0,0]=4 744 B10R1.25 COC1=C(N)C=C(C)C=C1 CS13548 [1,1,0,0,0,0|2,0,0]=4 745 B10R1.25 COC1=C(N)C=C(F)C=C1 MC30206 [1,1,0,0,0,0|2,0,0]=4 746 B10R1.25 COC1=C(N)C=C(I)C=C1 MC428313 [1,1,0,0,0,0|2,0,0]=4 747 B10R1.25 COC1=C(N)C=C(N)C=C1 CS21066 [1,1,0,0,0,0|2,0,0]=4 748 B10R1.25 COC1=C(O)C=C(C)C=C1 MC442401 [1,1,0,0,0,0|1,0,0]=3 749 B10R1.25 COC1=C(O)C=C(Cl)C=C1 MC442017 [1,1,0,0,0,0|1,0,0]=3 750 B10R1.25 COC1=C(O)C=C(F)C=C1 CS15779 [1,1,0,0,0,0|1,0,0]=3 751 B10R1.25 COC1=NC=C(F)C=C1O MC431711 [1,1,0,0,0,0|2,0,0]=4 752 B10R1.25 CSC1=C(Br)C=C(Cl)C=C1 MC428294 [1,1,0,0,0,0|2,0,0]=4 753 B10R1.25 CSC1=C(C)C=C(O)C=C1 MC20571 [1,1,0,0,0,0|2,0,0]=4 754 B10R1.25 CSC1=C(F)C=C(F)C=C1 MC430845 [1,1,0,0,0,0|2,0,0]=4 755 B10R1.25 CSC1=C(F)C=C(O)C=C1 MC431554 [1,1,0,0,0,0|2,0,0]=4 756 B10R1.25 ClC1=C(CBr)C=CC(Br)=C1 CS15047 [1,1,0,0,0,0|2,0,0]=4 757 B10R1.25 ClC1=CC(Br)=C(CBr)C=C1 MC40516 [1,1,0,0,0,0|2,0,0]=4 758 B10R1.25 ClC1=CC(Cl)=C(CBr)C=C1 CS21097 [1,1,0,0,0,0|2,0,0]=4 759 B10R1.25 ClCC1=C(Cl)C=C(Cl)C=C1 CS19427 [1,1,0,0,0,0|2,0,0]=4 760 B10R1.25 FC1=C(CBr)C=CC(Br)=C1 MC40521 [1,1,0,0,0,0|2,0,0]=4 761 B10R1.25 FC1=CC(Br)=C(CBr)C=C1 CS20064 [1,1,0,0,0,0|2,0,0]=4 762 B10R1.25 FC1=CC(Cl)=C(CBr)C=C1 MC40529 [1,1,0,0,0,0|2,0,0]=4 763 B10R1.25 FC1=CC(Cl)=C(CCl)C=C1 MC40583 [1,1,0,0,0,0|2,0,0]=4 764 B10R1.25 FC1=CC(F)=C(CBr)C=C1 MC40543 [1,1,0,0,0,0|2,0,0]=4 765 B10R1.25 FC1=CC(F)=C(CCl)C=C1 MC40591 [1,1,0,0,0,0|2,0,0]=4 766 B10R1.25 N#CC1=C(O)C=C(Br)C=C1 CS22646 [1,1,0,0,0,0|1,0,1]=4 767 B10R1.25 N#CC1=C(O)C=C(Cl)C=C1 CS14584 [1,1,0,0,0,0|1,0,1]=4 768 B10R1.25 N#CC1=C(O)C=C(N)C=C1 MC442238 [1,1,0,0,0,0|1,0,1]=4 769 B10R1.25 N#CC1=C(O)C=C(O)C=C1 MC10369 [1,1,0,0,0,0|1,0,1]=4 770 B10R1.25 NC1=C(CF)C=CC(F)=C1 MC431124 [1,1,0,0,0,0|2,0,0]=4 771 B10R1.25 NCC1=C(Cl)C=C(Cl)C=C1 MC40814 [1,1,0,0,0,0|2,0,0]=4 772 B10R1.25 NCC1=C(Cl)C=C(F)C=C1 MC40806 [1,1,0,0,0,0|2,0,0]=4 773 B10R1.25 NCC1=C(F)C=C(Br)C=C1 MC40800 [1,1,0,0,0,0|2,0,0]=4 774 B10R1.25 NCC1=C(F)C=C(Cl)C=C1 MC30230 [1,1,0,0,0,0|2,0,0]=4 775 B10R1.25 NCC1=C(F)C=C(F)C=C1 CS10473 [1,1,0,0,0,0|2,0,0]=4 776 B10R1.25 O=CC1=C(O)C=C(Br)C=C1 CS20081 [1,1,0,0,0,0|1,0,1]=4 777 B10R1.25 O=CC1=C(O)C=C(Cl)C=C1 CS20105 [1,1,0,0,0,0|1,0,1]=4 778 B10R1.25 O=CC1=C(O)C=C(F)C=C1 CS20130 [1,1,0,0,0,0|1,0,1]=4 779 B10R1.25 O=CC1=C(O)C=C(I)C=C1 MC425567 [1,1,0,0,0,0|1,0,1]=4 780 B10R1.25 O=CC1=C(O)C=C(O)C=C1 CS19428 [1,1,0,0,0,0|1,0,1]=4 781 B10R1.25 OCC1=C(Br)C=C(Br)C=C1 CS21073 [1,1,0,0,0,0|2,0,0]=4 782 B10R1.25 OCC1=C(Cl)C=C(Br)C=C1 MC427221 [1,1,0,0,0,0|2,0,0]=4 783 B10R1.25 OCC1=C(F)C=C(Cl)C=C1 MC40693 [1,1,0,0,0,0|2,0,0]=4 784 B10R1.25 OCC1=C(F)C=C(F)C=C1 MC33159 [1,1,0,0,0,0|2,0,0]=4 785 B10R1.25 OCC1=C(F)C=C(O)C=C1 CS13215 [1,1,0,0,0,0|2,0,0]=4 786 B10R1.25 OCC1=C(O)C=C(Br)C=C1 CS10248 [1,1,0,0,0,0|1,0,0]=3 787 B10R1.30 CC1=C(CBr)C=C(F)C=C1 MC40554 [1,1,0,0,0,0|2,0,0]=4 788 B10R1.30 CC1=C(CO)C=C(I)C=C1 MC425423 [1,1,0,0,0,0|2,0,0]=4 789 B10R1.30 CC1=CC(C#N)=C(O)C=C1 MC442255 [1,1,0,0,0,0|1,0,1]=4 790 B10R1.30 CC1=CC(C=O)=C(O)C=C1 MC33170 [1,1,0,0,0,0|1,0,1]=4 791 B10R1.30 CC1=CC(CCl)=C(C)C=C1 MC40594 [1,1,0,0,0,0|2,0,0]=4 792 B10R1.30 CC1=CC(CN)=C(C)C=C1 MC20405 [1,1,0,0,0,0|2,0,0]=4 793 B10R1.30 CC1=CC(CN)=C(O)C=C1 MC431862 [1,1,0,0,0,0|1,0,0]=3 794 B10R1.30 CCC1=C(Br)C=CC(I)=C1 MC428380 [1,1,0,0,0,0|1,0,0]=3 795 B10R1.30 CCC1=C(Cl)C=CC(O)=C1 MC20088 [1,1,0,0,0,0|1,0,0]=3 796 B10R1.30 CCC1=C(F)C=CC(Br)=C1 MC41552 [1,1,0,0,0,0|1,0,0]=3 797 B10R1.30 CCC1=C(F)C=CC(O)=C1 MC442497 [1,1,0,0,0,0|1,0,0]=3 798 B10R1.30 CCC1=C(N)C=CC(Br)=C1 MC30325 [1,1,0,0,0,0|1,0,0]=3 799 B10R1.30 CCC1=C(N)C=CC(Br)=C1 MC30326 [1,1,0,0,0,0|1,0,0]=3 800 B10R1.30 CCC1=C(N)C=CC(Cl)=C1 MC30090 [1,1,0,0,0,0|1,0,0]=3 801 B10R1.30 CCC1=NC(C)=CC=C1O CS13984 [1,1,0,0,0,0|1,0,0]=3 802 B10R1.30 CCC1=NC(C)=CC=C1O MC41617 [1,1,0,0,0,0|1,0,0]=3 803 B10R1.30 CCC1=NC(Cl)=CC=C1N MC431979 [1,1,0,0,0,0|2,0,0]=4 804 B10R1.30 CCN1C=C(Br)C=CC1=O MC111722 [1,1,0,0,0,0|1,0,1]=4 805 B10R1.30 CNC1=C(I)C=CC(F)=C1 MC430179 [1,1,0,0,0,0|2,0,0]=4 806 B10R1.30 CNC1=CC(Br)=CC=C1N CS13254 [1,1,0,0,0,0|2,0,0]=4 807 B10R1.30 COC1=C(Br)C=CC(Br)=C1 CS12737 [1,1,0,0,0,0|2,0,0]=4 808 B10R1.30 COC1=C(Br)C=CC(C)=C1 MC20209 [1,1,0,0,0,0|2,0,0]=4 809 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 CS21371 [1,1,0,0,0,0|2,0,0]=4 810 B10R1.30 COC1=C(Br)C=CC(F)=C1 CS10394 [1,1,0,0,0,0|2,0,0]=4 811 B10R1.30 COC1=C(Br)C=CC(I)=C1 MC33199 [1,1,0,0,0,0|2,0,0]=4 812 B10R1.30 COC1=C(Br)C=CC(N)=C1 CS18102 [1,1,0,0,0,0|2,0,0]=4 813 B10R1.30 COC1=C(Br)C=CC(O)=C1 MC443538 [1,1,0,0,0,0|2,0,0]=4 814 B10R1.30 COC1=C(C)C=CC(Cl)=C1 MC33132 [1,1,0,0,0,0|2,0,0]=4 815 B10R1.30 COC1=C(C)C=CC(N)=C1 MC40926 [1,1,0,0,0,0|2,0,0]=4 816 B10R1.30 COC1=C(Cl)C=CC(Br)=C1 MC33062 [1,1,0,0,0,0|2,0,0]=4 817 B10R1.30 COC1=C(Cl)C=CC(Cl)=C1 MC33073 [1,1,0,0,0,0|2,0,0]=4 818 B10R1.30 COC1=C(Cl)C=CC(F)=C1 MC41328 [1,1,0,0,0,0|2,0,0]=4 819 B10R1.30 COC1=C(Cl)C=CC(I)=C1 MC20290 [1,1,0,0,0,0|2,0,0]=4 820 B10R1.30 COC1=C(Cl)C=CC(N)=C1 CS22759 [1,1,0,0,0,0|2,0,0]=4 821 B10R1.30 COC1=C(Cl)C=CC(O)=C1 MC441231 [1,1,0,0,0,0|2,0,0]=4 822 B10R1.30 COC1=C(F)C=CC(Br)=C1 CS19804 [1,1,0,0,0,0|2,0,0]=4 823 B10R1.30 COC1=C(F)C=CC(F)=C1 MC41336 [1,1,0,0,0,0|2,0,0]=4 824 B10R1.30 COC1=C(F)C=CC(N)=C1 CS10516 [1,1,0,0,0,0|2,0,0]=4 825 B10R1.30 COC1=C(F)C=CC(O)=C1 CS16180 [1,1,0,0,0,0|2,0,0]=4 826 B10R1.30 COC1=C(I)C=CC(Br)=C1 MC41321 [1,1,0,0,0,0|2,0,0]=4 827 B10R1.30 COC1=C(I)C=CC(Cl)=C1 MC20291 [1,1,0,0,0,0|2,0,0]=4 828 B10R1.30 COC1=C(I)C=CC(F)=C1 MC41340 [1,1,0,0,0,0|2,0,0]=4 829 B10R1.30 COC1=C(I)C=CC(I)=C1 MC442228 [1,1,0,0,0,0|2,0,0]=4 830 B10R1.30 COC1=C(N)C=CC(Br)=C1 CS19178 [1,1,0,0,0,0|2,0,0]=4 831 B10R1.30 COC1=C(N)C=CC(Cl)=C1 MC30210 [1,1,0,0,0,0|2,0,0]=4 832 B10R1.30 COC1=C(N)C=CC(F)=C1 CS12096 [1,1,0,0,0,0|2,0,0]=4 833 B10R1.30 COC1=C(N)C=CC(F)=C1 MC40917 [1,1,0,0,0,0|2,0,0]=4 834 B10R1.30 COC1=C(N)C=CC(I)=C1 MC21014 [1,1,0,0,0,0|2,0,0]=4 835 B10R1.30 COC1=C(N)C=CC(N)=C1 CS21132 [1,1,0,0,0,0|2,0,0]=4 836 B10R1.30 COC1=C(O)C=CC(Br)=C1 CS22682 [1,1,0,0,0,0|1,0,0]=3 837 B10R1.30 COC1=C(O)C=CC(C)=C1 CS16322 [1,1,0,0,0,0|1,0,0]=3 838 B10R1.30 COC1=C(O)C=CC(Cl)=C1 MC41171 [1,1,0,0,0,0|1,0,0]=3 839 B10R1.30 COC1=C(O)C=CC(F)=C1 MC41195 [1,1,0,0,0,0|1,0,0]=3 840 B10R1.30 COC1=C(O)C=CC(I)=C1 MC41200 [1,1,0,0,0,0|1,0,0]=3 841 B10R1.30 COC1=C(O)C=CC(N)=C1 MC41143 [1,1,0,0,0,0|1,0,0]=3 842 B10R1.30 COC1=C(O)C=CC(N)=C1 MC442300 [1,1,0,0,0,0|1,0,0]=3 843 B10R1.30 COC1=C(O)C=CC(O)=C1 MC33205 [1,1,0,0,0,0|1,0,0]=3 844 B10R1.30 COC1=C(O)C=NC(Br)=C1 MC429892 [1,1,0,0,0,0|2,0,0]=4 845 B10R1.30 ClC1=C(CBr)C=C(I)C=C1 MC433851 [1,1,0,0,0,0|2,0,0]=4 846 B10R1.30 ClC1=CC(CBr)=C(Cl)C=C1 MC40541 [1,1,0,0,0,0|2,0,0]=4 847 B10R1.30 ClCC1=C(Cl)C=CC(Br)=C1 CS16839 [1,1,0,0,0,0|2,0,0]=4 848 B10R1.30 ClCC1=C(Cl)C=CC(Cl)=C1 MC40589 [1,1,0,0,0,0|2,0,0]=4 849 B10R1.30 ClCC1=C(Cl)C=CC(I)=C1 MC433852 [1,1,0,0,0,0|2,0,0]=4 850 B10R1.30 FC1=C(CBr)C=C(Br)C=C1 MC40523 [1,1,0,0,0,0|2,0,0]=4 851 B10R1.30 FC1=C(CBr)C=C(Cl)C=C1 MC40532 [1,1,0,0,0,0|2,0,0]=4 852 B10R1.30 FC1=CC(CBr)=C(Br)C=C1 MC20074 [1,1,0,0,0,0|2,0,0]=4 853 B10R1.30 FC1=CC(CBr)=C(Cl)C=C1 MC40530 [1,1,0,0,0,0|2,0,0]=4 854 B10R1.30 FC1=CC(CBr)=C(F)C=C1 MC40544 [1,1,0,0,0,0|2,0,0]=4 855 B10R1.30 FC1=CC(CCl)=C(Br)C=C1 MC433845 [1,1,0,0,0,0|2,0,0]=4 856 B10R1.30 FC1=CC(CCl)=C(F)C=C1 MC40592 [1,1,0,0,0,0|2,0,0]=4 857 B10R1.30 N#CC1=C(O)C=CC(Br)=C1 CS10240 [1,1,0,0,0,0|1,0,1]=4 858 B10R1.30 N#CC1=C(O)C=CC(Cl)=C1 MC30046 [1,1,0,0,0,0|1,0,1]=4 859 B10R1.30 N#CC1=C(O)C=CC(N)=C1 CS10205 [1,1,0,0,0,0|1,0,1]=4 860 B10R1.30 NC1=C(CO)C=C(Br)C=C1 CS20119 [1,1,0,0,0,0|2,0,0]=4 861 B10R1.30 NC1=C(CO)C=C(Cl)C=C1 MC40682 [1,1,0,0,0,0|2,0,0]=4 862 B10R1.30 NC1=CC(CO)=C(Cl)C=C1 MC433837 [1,1,0,0,0,0|2,0,0]=4 863 B10R1.30 NC1=CC(CO)=C(F)C=C1 MC40683 [1,1,0,0,0,0|2,0,0]=4 864 B10R1.30 NCC1=C(Br)C=CC(F)=C1 MC33198 [1,1,0,0,0,0|2,0,0]=4 865 B10R1.30 NCC1=C(Cl)C=CC(Br)=C1 CS12614 [1,1,0,0,0,0|2,0,0]=4 866 B10R1.30 NCC1=C(Cl)C=CC(Cl)=C1 MC40815 [1,1,0,0,0,0|2,0,0]=4 867 B10R1.30 NCC1=C(Cl)C=CC(F)=C1 MC40807 [1,1,0,0,0,0|2,0,0]=4 868 B10R1.30 NCC1=C(F)C=CC(Br)=C1 MC40801 [1,1,0,0,0,0|2,0,0]=4 869 B10R1.30 NCC1=C(F)C=CC(Br)=C1 MC40802 [1,1,0,0,0,0|2,0,0]=4 870 B10R1.30 NCC1=C(F)C=CC(Cl)=C1 CS20282 [1,1,0,0,0,0|2,0,0]=4 871 B10R1.30 NCC1=C(F)C=CC(F)=C1 MC33210 [1,1,0,0,0,0|2,0,0]=4 872 B10R1.30 NCC1=C(N)C=CC(Br)=C1 CS17921 [1,1,0,0,0,0|2,0,0]=4 873 B10R1.30 NCC1=C(O)C=CC(Br)=C1 CS18138 [1,1,0,0,0,0|1,0,0]=3 874 B10R1.30 O=CC1=C(O)C=CC(Cl)=C1 CS20107 [1,1,0,0,0,0|1,0,1]=4 875 B10R1.30 O=CC1=C(O)C=CC(F)=C1 CS10369 [1,1,0,0,0,0|1,0,1]=4 876 B10R1.30 O=CC1=C(O)C=CC(I)=C1 CS20136 [1,1,0,0,0,0|1,0,1]=4 877 B10R1.30 O=CC1=C(O)C=CC(O)=C1 MC20094 [1,1,0,0,0,0|1,0,1]=4 878 B10R1.30 O=CC1=CC(Br)=CC=C1O CS20084 [1,1,0,0,0,0|1,0,1]=4 879 B10R1.30 OCC1=C(Br)C=CC(Cl)=C1 MC40685 [1,1,0,0,0,0|2,0,0]=4 880 B10R1.30 OCC1=C(Br)C=CC(F)=C1 CS13914 [1,1,0,0,0,0|2,0,0]=4 881 B10R1.30 OCC1=C(Br)C=CC(I)=C1 MC433848 [1,1,0,0,0,0|2,0,0]=4 882 B10R1.30 OCC1=C(Cl)C=CC(Br)=C1 MC433841 [1,1,0,0,0,0|2,0,0]=4 883 B10R1.30 OCC1=C(Cl)C=CC(F)=C1 CS21464 [1,1,0,0,0,0|2,0,0]=4 884 B10R1.30 OCC1=C(F)C=CC(F)=C1 MC40701 [1,1,0,0,0,0|2,0,0]=4 885 B10R1.30 OCC1=CC(Br)=CC=C1O CS20280 [1,1,0,0,0,0|1,0,0]=3 886 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 CS18866 [1,1,0,0,0,0|1,0,1]=4 887 B10R1.61 CC(=O)C1=C(C)C=CC=C1 CS19710 [1,1,0,0,0,0|1,0,1]=4 888 B10R1.61 CC(=O)C1=C(Cl)C=CC=C1 MC41234 [1,1,0,0,0,0|1,0,1]=4 889 B10R1.61 CC(=O)C1=C(F)C=CC=C1 CS15490 [1,1,0,0,0,0|1,0,1]=4 890 B10R1.61 CC(=O)C1=C(N)C=CC=C1 CS19948 [1,1,0,0,0,0|1,0,1]=4 891 B10R1.61 CC(=O)C1=C(O)C=CC=C1 CS15026 [1,1,0,0,0,0|0,0,1]=3 892 B10R1.61 CC(=O)C1=C(O)C=NC=C1 MC427306 [1,1,0,0,0,0|1,0,1]=4 893 B10R1.61 CC(=O)C1=CC=CN=C1O MC427454 [1,1,0,0,0,0|1,0,1]=4 894 B10R1.61 CC(=O)C1=NC=CC=C1O CS14450 [1,1,0,0,0,0|1,0,1]=4 895 B10R1.61 CC(C)C1=C(Br)C=CC=C1 CS19988 [1,1,0,0,0,0|1,0,0]=3 896 B10R1.61 CC(C)C1=NC=CC=C1Br MC441304 [1,1,0,0,0,0|2,0,0]=4 897 B10R1.61 CC(C)C1=NC=CC=C1N MC445692 [1,1,0,0,0,0|2,0,0]=4 898 B10R1.61 CC(N)C1=C(Br)C=CC=C1 CS20301 [1,1,0,0,0,0|1,0,0]=3 899 B10R1.61 CC(N)C1=C(F)C=CC=C1 CS20318 [1,1,0,0,0,0|1,0,0]=3 900 B10R1.61 CC(N)C1=C(F)C=CC=C1 MC429423 [1,1,0,0,0,0|1,0,0]=3 901 B10R1.61 CC(N)C1=NC=CC=C1F MC430350 [1,1,0,0,0,0|2,0,0]=4 902 B10R1.61 CC(O)C1=C(Cl)C=CC=C1 CS13547 [1,1,0,0,0,0|1,0,0]=3 903 B10R1.61 CC(O)C1=C(F)C=CC=C1 CS15513 [1,1,0,0,0,0|1,0,0]=3 904 B10R1.61 CC(O)C1=C(F)C=CC=C1 MC33138 [1,1,0,0,0,0|1,0,0]=3 905 B10R1.61 CN(C)C1=C(Br)C=CC=C1 MC20183 [1,1,0,0,0,0|2,0,0]=4 906 B10R1.61 CN(C)C1=C(Cl)C=CC=C1 MC20288 [1,1,0,0,0,0|2,0,0]=4 907 B10R1.61 CN(C)C1=C(F)C=CC=C1 MC20285 [1,1,0,0,0,0|2,0,0]=4 908 B10R1.61 CN(C)C1=C(O)C=CC=C1 CS14782 [1,1,0,0,0,0|1,0,0]=3 909 B10R1.61 CN(C)C1=CC=CC=C1N CS14204 [1,1,0,0,0,0|2,0,0]=4 910 B10R1.61 Cc1ccccc1C(C)Br MC106119 [1,1,0,0,0,0|1,0,0]=3 911 B10R1.61 NC(=O)C1=C(O)C=CC=C1 CS11941 [1,1,0,0,0,0|1,0,1]=4 912 B10R1.61 NC1=C(C(F)F)C=CC=C1 MC429268 [1,1,0,0,0,0|2,0,0]=4 913 B10R1.61 O=C(O)C1=C(O)C=CC=C1 MC40289 [1,1,0,0,0,0|1,0,1]=4 914 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=C1 CS21724 [1,1,0,0,0,0|2,0,0]=4 915 B10R1.61 OB(O)C1=C(O)C=CC=C1 CS21880 [1,1,0,0,0,0|2,0,0]=4 916 B10R1.245 BrCC1=C(Br)C=CC=C1Br MC100300 [1,1,0,0,0,0|2,0,0]=4 917 B10R1.245 CC1=CC=CC(C)=C1CBr MC40551 [1,1,0,0,0,0|2,0,0]=4 918 B10R1.245 CC1=CC=CC(C)=C1CCl MC20793 [1,1,0,0,0,0|2,0,0]=4 919 B10R1.245 CC1=CC=CC(C)=C1CN CS21184 [1,1,0,0,0,0|2,0,0]=4 920 B10R1.245 CC1=CC=CC(C)=C1CO CS10906 [1,1,0,0,0,0|2,0,0]=4 921 B10R1.245 CC1=CC=CC(O)=C1C#N CS21595 [1,1,0,0,0,0|1,0,1]=4 922 B10R1.245 CC1=CC=CC(O)=C1C=O MC442494 [1,1,0,0,0,0|1,0,1]=4 923 B10R1.245 CCC1=C(Br)C=NC=C1F MC425558 [1,1,0,0,0,0|2,0,0]=4 924 B10R1.245 CCC1=C(O)C=CC=C1N MC442227 [1,1,0,0,0,0|0,0,0]=2 925 B10R1.245 CNC1=C(F)C=CC=C1F MC430506 [1,1,0,0,0,0|2,0,0]=4 926 B10R1.245 COC1=C(Br)C=CC=C1Br CS21160 [1,1,0,0,0,0|2,0,0]=4 927 B10R1.245 COC1=C(Br)C=CC=C1Cl MC41312 [1,1,0,0,0,0|2,0,0]=4 928 B10R1.245 COC1=C(Br)C=CC=C1F MC30007 [1,1,0,0,0,0|2,0,0]=4 929 B10R1.245 COC1=C(Cl)C=CC=C1Cl MC41334 [1,1,0,0,0,0|2,0,0]=4 930 B10R1.245 COC1=C(Cl)C=CC=C1F CS12979 [1,1,0,0,0,0|2,0,0]=4 931 B10R1.245 COC1=C(F)C=CC=C1F MC30190 [1,1,0,0,0,0|2,0,0]=4 932 B10R1.245 COC1=C(F)C=CC=C1I MC20137 [1,1,0,0,0,0|2,0,0]=4 933 B10R1.245 COC1=C(N)C=CC=C1Cl MC442093 [1,1,0,0,0,0|2,0,0]=4 934 B10R1.245 COC1=C(N)C=CC=C1F MC20133 [1,1,0,0,0,0|2,0,0]=4 935 B10R1.245 COC1=C(O)C=CC=C1Br MC441228 [1,1,0,0,0,0|1,0,0]=3 936 B10R1.245 COC1=C(O)C=CC=C1Cl MC441015 [1,1,0,0,0,0|1,0,0]=3 937 B10R1.245 COC1=C(O)C=CC=C1F MC442390 [1,1,0,0,0,0|1,0,0]=3 938 B10R1.245 CSC1=C(O)C=CC=C1Br MC442206 [1,1,0,0,0,0|1,0,0]=3 939 B10R1.245 ClC1=CC=CC(Cl)=C1CBr MC40542 [1,1,0,0,0,0|2,0,0]=4 940 B10R1.245 FC1=CC=CC(Cl)=C1CBr MC33185 [1,1,0,0,0,0|2,0,0]=4 941 B10R1.245 FC1=CC=CC(F)=C1CBr MC40545 [1,1,0,0,0,0|2,0,0]=4 942 B10R1.245 FC1=CC=CC(F)=C1CCl CS19270 [1,1,0,0,0,0|2,0,0]=4 943 B10R1.245 N#CC1=C(Cl)C=CC=C1O MC433752 [1,1,0,0,0,0|1,0,1]=4 944 B10R1.245 N#CC1=C(F)C=CC=C1O MC40657 [1,1,0,0,0,0|1,0,1]=4 945 B10R1.245 N#Cc1c(O)cccc1Br MC433746 [1,1,0,0,0,0|1,0,1]=4 946 B10R1.245 NC1=C(CO)C(F)=CC=C1 MC429339 [1,1,0,0,0,0|2,0,0]=4 947 B10R1.245 NCC1=C(Br)C=CC=C1Br CS18032 [1,1,0,0,0,0|2,0,0]=4 948 B10R1.245 NCC1=C(Cl)C=CC=C1Cl MC33180 [1,1,0,0,0,0|2,0,0]=4 949 B10R1.245 NCC1=C(Cl)C=CC=C1F MC40808 [1,1,0,0,0,0|2,0,0]=4 950 B10R1.245 NCC1=C(F)C=CC=C1F CS10475 [1,1,0,0,0,0|2,0,0]=4 951 B10R1.245 O=CC1=C(Br)C=CC=C1O CS21383 [1,1,0,0,0,0|1,0,1]=4 952 B10R1.245 O=CC1=C(Cl)C=CC=C1O CS20108 [1,1,0,0,0,0|1,0,1]=4 953 B10R1.245 O=CC1=C(F)C=CC=C1O CS20127 [1,1,0,0,0,0|1,0,1]=4 954 B10R1.245 OCC1=C(Cl)C=CC=C1Cl MC33052 [1,1,0,0,0,0|2,0,0]=4 955 B10R1.245 OCC1=C(F)C=CC=C1F CS10419 [1,1,0,0,0,0|2,0,0]=4 956 B10R1.245 OCC1=C(F)C=CC=C1I MC433861 [1,1,0,0,0,0|2,0,0]=4 957 B12R1.24 CCC(=O)C1=C(Br)C(F)=CC=C1 MC443267 [0,2,0,0,0,0|1,0,1]=4 958 B12R1.24 COC(=O)C1=C(O)C(Br)=CC=C1 CS17379 [0,2,0,0,0,0|1,0,1]=4 959 B12R1.24 COC(=O)C1=C(O)C(Cl)=CC=C1 CS12991 [0,2,0,0,0,0|1,0,1]=4 960 B12R1.24 COC(=O)C1=C(O)C(F)=CC=C1 MC433675 [0,2,0,0,0,0|1,0,1]=4 961 B12R1.25 COCOC1=CC=CC(Br)=C1O MC442836 [0,2,0,0,0,0|1,0,0]=3 962 B12R1.224 CC(C)OC1=CC=CC(Br)=C1O MC442835 [0,2,0,0,0,0|1,0,0]=3 963 B12R1.280 C=CCC1=C(O)C(OC)=CC=C1 MC112509 [0,2,0,0,0,0|0,0,2]=4 964 B12R1.544 CCNC1=CC=C(Br)C(C)=C1N MC111670 [0,2,0,0,0,0|2,0,0]=4 965 B12R1.544 CCOC1=C(F)C(Cl)=C(Br)C=C1 MC430614 [0,2,0,0,0,0|2,0,0]=4 966 B12R1.544 CCOC1=C(F)C(F)=C(Br)C=C1 MC440475 [0,2,0,0,0,0|2,0,0]=4 967 B12R1.544 CCOC1=C(F)C(F)=C(O)C=C1 MC440469 [0,2,0,0,0,0|2,0,0]=4 968 B12R1.69 BrCCOC1=C(Br)C=C(Br)C=C1 MC425135 [0,2,0,0,0,0|2,0,0]=4 969 B12R1.69 CCCCC1=C(O)C=C(O)C=C1 MC443141 [0,2,0,0,0,0|0,0,0]=2 970 B12R1.69 COCOC1=C(F)C=C(F)C=C1 MC106527 [0,2,0,0,0,0|2,0,0]=4 971 B12R1.69 NC1=CC(N)=C(OCCO)C=C1 CS17227 [0,2,0,0,0,0|2,0,0]=4 972 B12R1.121 COC1=C(OCC=O)C=CC=C1 MC112452 [0,2,0,0,0,0|1,0,1]=4 973 B12R1.121 COC1=C(OCCN)C=CC=C1 CS21224 [0,2,0,0,0,0|1,0,0]=3 974 B12R1.125 O=C(O)CCC1=C(Br)C=CC=C1 CS21656 [0,2,0,0,0,0|1,0,1]=4 975 B12R1.267 BrCCCOC1=C(Br)C=CC=C1 MC425134 [0,2,0,0,0,0|1,0,0]=3 976 B12R1.267 NCCCOC1=C(F)C=CC=C1 MC431473 [0,2,0,0,0,0|1,0,0]=3 977 B12R1.308 CCCC(=O)C1=C(N)C=CC=C1 MC430441 [0,2,0,0,0,0|1,0,0]=3 978 B12R1.308 CCOC(=O)C1=C(Br)C=CC=C1 MC20191 [0,2,0,0,0,0|1,0,1]=4 979 B12R1.308 CCOC(=O)C1=C(C)C=CC=C1 MC40044 [0,2,0,0,0,0|1,0,1]=4 980 B12R1.308 CCOC(=O)C1=C(F)C=CC=C1 CS11340 [0,2,0,0,0,0|1,0,1]=4 981 B12R1.308 CCOC(=O)C1=C(O)C=NC=C1 MC100279 [0,2,0,0,0,0|1,0,1]=4 982 B12R1.308 CCOC(=O)C1=CC=CC=C1O MC34575 [0,2,0,0,0,0|0,0,1]=3 983 B12R1.308 O=C(CCCl)C1=C(Cl)C=CC=C1 MC429389 [0,2,0,0,0,0|1,0,1]=4 984 B12R1.371 COC(=O)CC1=C(Br)C=CC=C1 CS11591 [0,2,0,0,0,0|1,0,1]=4 985 B12R1.371 COC(=O)CC1=C(Cl)C=CC=C1 CS21677 [0,2,0,0,0,0|1,0,1]=4 986 B12R1.371 COC(=O)CC1=C(N)C=CC=C1 CS11582 [0,2,0,0,0,0|1,0,1]=4 987 B12R1.371 COC(=O)CC1=C(O)C=CC=C1 CS20138 [0,2,0,0,0,0|0,0,1]=3 988 B12R1.374 BrCCOC1=C(Br)C=CC(Br)=C1 MC106792 [0,2,0,0,0,0|2,0,0]=4 989 B12R1.75 COC1=C(CC(=O)O)C=CC=C1 CS16300 [0,2,0,0,0,0|1,0,1]=4 990 B12R1.75 COC1=C(OC(C)=O)C=CC=C1 MC40006 [0,2,0,0,0,0|1,0,1]=4 991 B12R1.75 OCC1=C(OC(F)F)C=CC=C1 MC40702 [0,2,0,0,0,0|2,0,0]=4 992 B12R1.77 COC1=C(C(=O)CBr)C=CC=C1 CS11020 [0,2,0,0,0,0|1,0,1]=4 993 B12R1.112 COC1=C(CC#N)C=CC(Br)=C1 MC40760 [0,2,0,0,0,0|1,0,1]=4 994 B12R1.112 COC1=C(CC#N)C=CC(Cl)=C1 MC40766 [0,2,0,0,0,0|1,0,1]=4 995 B12R1.112 COC1=C(CC#N)C=CC(F)=C1 MC40774 [0,2,0,0,0,0|1,0,1]=4 996 B12R1.169 CCOC1=C(N=C=S)C=CC=C1 MC41070 [0,2,0,0,0,0|1,1,0]=4 997 B12R1.268 COC1=C(CC#N)C=C(Br)C=C1 CS10269 [0,2,0,0,0,0|1,0,1]=4 998 B12R1.268 COC1=C(CC#N)C=C(Cl)C=C1 CS20218 [0,2,0,0,0,0|1,0,1]=4 999 B12R1.283 CCOC1=C(C(=O)O)C=CC=C1 CS13616 [0,2,0,0,0,0|1,0,0]=3 1000 B12R1.283 CCOC1=C([N+](=O)[O-])C=CC=C1 MC41361 [0,2,0,0,0,0|1,0,1]=4 1001 B12R1.283 CCOC1=CC=CN=C1C(=O)O MC41614 [0,2,0,0,0,0|2,0,0]=4 1002 B12R1.283 CCOC1=NC=CC=C1B(O)O MC20278 [0,2,0,0,0,0|2,0,0]=4 1003 B12R1.283 CCSC1=C(B(O)O)C=CC=C1 MC442917 [0,2,0,0,0,0|1,0,0]=3 1004 B12R1.283 CCSC1=C(C(=O)O)C=CN=C1 MC107905 [0,2,0,0,0,0|2,0,0]=4 1005 B12R1.283 N#CCC1=C(B(O)O)C=CC=C1 MC442864 [0,2,0,0,0,0|1,0,1]=4 1006 B12R1.283 O=[N+]([O-])C1=C(CCO)C=CC=C1 MC10134 [0,2,0,0,0,0|1,0,1]=4 1007 B12R1.1112 C=CC1=CC=CC(Br)=C1OCC MC112461 [0,2,0,0,0,0|2,0,0]=4 1008 B12R1.1112 CCOC1=C(C=O)C=CC=C1Br MC103354 [0,2,0,0,0,0|1,0,1]=4 1009 B12R1.1112 COC1=CC=CC(F)=C1CC#N MC40773 [0,2,0,0,0,0|1,0,1]=4 1010 B12R1.233 CC(=O)NC1=C(O)C=C(F)C=C1 MC427191 [0,2,0,0,0,0|1,0,1]=4 1011 B12R1.233 CC(C)OC1=C(Cl)C=C(Br)C=C1 MC443492 [0,2,0,0,0,0|2,0,0]=4 1012 B12R1.233 CC(C)OC1=C(F)C=C(N)C=C1 MC112377 [0,2,0,0,0,0|2,0,0]=4 1013 B12R1.233 O=C(O)CC1=C(O)C=C(F)C=C1 MC429494 [0,2,0,0,0,0|1,0,1]=4 1014 B12R1.1095 CC1=CC(C)=C(CCO)C(C)=C1 CS21631 [0,2,0,0,0,0|2,0,0]=4 1015 B12R1.1123 OCCC1=C(F)C=C(F)C(F)=C1 MC433889 [0,2,0,0,0,0|2,0,0]=4 1016 B12R1.1703 CCC(=O)C1=C(F)C=C(Br)C=C1 MC442253 [0,2,0,0,0,0|1,0,1]=4 1017 B12R1.1703 COC(=O)C1=C(O)C=C(F)C=C1 MC433676 [0,2,0,0,0,0|1,0,1]=4 1018 B12R1.1703 COC(=O)C1=C(O)C=C(N)C=C1 CS21027 [0,2,0,0,0,0|1,0,1]=4 1019 B12R1.1703 COC(=O)C1=C(O)C=C(O)C=C1 CS11594 [0,2,0,0,0,0|1,0,1]=4 1020 B12R1.1703 COC(=O)C1=CC=C(Cl)C=C1O CS11643 [0,2,0,0,0,0|1,0,1]=4 1021 B12R1.1703 O=C(CF)C1=C(O)C=C(Br)C=C1 MC433215 [0,2,0,0,0,0|1,0,1]=4 1022 B12R1.124 CC(=O)C(Br)C1=C(F)C=CC=C1 MC432040 [0,2,0,0,0,0|1,0,1]=4 1023 B12R1.127 CC(=O)NC1=C(O)C=CC(Br)=C1 MC427097 [0,2,0,0,0,0|1,0,1]=4 1024 B12R1.127 O=C(O)CC1=C(O)C=CC(Br)=C1 MC40147 [0,2,0,0,0,0|1,0,1]=4 1025 B12R1.151 CC(C)(N)CC1=C(Br)C=CC=C1 MC443554 [0,2,0,0,0,0|1,0,0]=3 1026 B12R1.151 OC1=C(OC(F)(F)F)C=CC=C1 CS14151 [0,2,0,0,0,0|2,0,0]=4 1027 B12R1.270 C=CC1=CC(OCC)=C(Cl)C=C1 MC112465 [0,2,0,0,0,0|2,0,0]=4 1028 B12R1.270 C=CCC1=C(O)C=CC(C#N)=C1 MC111280 [0,2,0,0,0,0|0,0,2]=4 1029 B12R1.270 CCOC1=C(Cl)C=CC(C=O)=C1 MC112464 [0,2,0,0,0,0|2,0,0]=4 1030 B12R1.270 CCOC1=C(O)C=CC(C=O)=C1 MC41114 [0,2,0,0,0,0|1,0,0]=3 1031 B12R1.354 CCC(=O)C1=C(N)C=CC(Br)=C1 MC443456 [0,2,0,0,0,0|1,0,1]=4 1032 B12R1.354 CCC(=O)C1=C(O)C=CC(F)=C1 MC41283 [0,2,0,0,0,0|0,0,1]=3 1033 B12R1.354 CCC(N)C1=C(F)C=CC(F)=C1 MC107000 [0,2,0,0,0,0|1,0,0]=3 1034 B12R1.354 COC(=O)C1=C(O)C=CC(Br)=C1 CS11656 [0,2,0,0,0,0|1,0,1]=4 1035 B12R1.354 COC(=O)C1=C(O)C=CC(Cl)=C1 MC427365 [0,2,0,0,0,0|1,0,1]=4 1036 B12R1.354 COC(=O)C1=C(O)C=CC(O)=C1 CS20958 [0,2,0,0,0,0|1,0,1]=4 1037 B12R1.243 COC(OC)C1=C(I)C=CC=C1 MC20293 [0,2,0,0,0,0|2,0,0]=4 1038 B12R1.3441 COC(=O)C1=C(F)C=CC=C1O MC433674 [0,2,0,0,0,0|1,0,1]=4 1039 B12R1.3441 COC(=O)C1=C(N)C=CC=C1O CS15549 [0,2,0,0,0,0|1,0,1]=4 1040 B10R1.11 CCOC(=O)C1=CC=CO1 MC10319 [0,0,1,1,0,0|2,0,0]=4 1041 B10R2.6 C1=CC=C(C2CO2)C=C1 MC20326 [1,0,0,1,0,0|1,0,0]=3 1042 B10R2.6 C1=CC=C(C2CO2)C=C1 MC445226 [1,0,0,1,0,0|1,0,0]=3 1043 B10R2.7 C1=CC2=C(C=C1)CSC2 MC114506 [1,0,0,1,0,0|1,0,0]=3 1044 B10R2.7 C1=CC2=C(C=C1)OCC2 CS20929 [1,0,0,1,0,0|1,0,0]=3 1045 B10R2.7 C1=CC2=C(C=C1)OCO2 CS20505 [1,0,0,1,0,0|2,0,0]=4 1046 B10R2.7 C1=CC2=C(C=N1)CNC2 MC425268 [1,0,0,1,0,0|2,0,0]=4 1047 B10R2.7 C1=CC2=C(C=N1)CNC2 MC428164 [1,0,0,1,0,0|2,0,0]=4 1048 B10R2.7 C1=CC=C2CC=CC2=C1 MC20914 [1,0,0,1,0,0|0,0,2]=4 1049 B10R2.7 C1=CC=C2CNCC2=C1 CS11516 [1,0,0,1,0,0|1,0,0]=3 1050 B10R2.7 C1=CC=C2CNCC2=C1 MC442466 [1,0,0,1,0,0|1,0,0]=3 1051 B10R2.7 C1=CC=C2NCCC2=C1 CS19084 [1,0,0,1,0,0|1,0,0]=3 1052 B10R2.7 C1=CN=C2CCCC2=C1 CS14838 [1,0,0,1,0,0|1,0,0]=3 1053 B10R2.7 C1=CN=C2CCNC2=C1 MC107728 [1,0,0,1,0,0|2,0,0]=4 1054 B10R2.7 C1=CN=C2CNCC2=C1 CS15341 [1,0,0,1,0,0|2,0,0]=4 1055 B10R2.7 C1=CN=C2NCCC2=C1 CS21039 [1,0,0,1,0,0|2,0,0]=4 1056 B10R2.7 c1cc2c(cn1)CNC2 MC113094 [1,0,0,1,0,0|2,0,0]=4 1057 B12R2.82 FC1=C2CCNC2=CC=C1Br CS17575 [0,1,0,1,0,0|2,0,0]=4 1058 B12R2.202 CC1=NC2=C(C=CC=C2Br)O1 MC442517 [0,1,0,1,0,0|1,0,1]=4 1059 B12R2.202 CC1=NC2=C(O1)C(Br)=CC=C2 CS12799 [0,1,0,1,0,0|1,0,1]=4 1060 B12R2.202 O=C1CC2=CC=CC(Cl)=C2C1 CS22741 [0,1,0,1,0,0|1,0,1]=4 1061 B12R2.1081 BrC1=C2CCCNC2=CC=C1 CS18620 [0,1,0,1,0,0|1,0,0]=3 1062 B12R2.1081 BrC1=C2CCCNC2=CC=C1 MC441076 [0,1,0,1,0,0|1,0,0]=3 1063 B12R2.1081 BrC1=C2CCCNC2=CN=C1 MC20924 [0,1,0,1,0,0|2,0,0]=4 1064 B12R2.1081 BrC1=C2CCNCC2=CC=C1 CS19342 [0,1,0,1,0,0|1,0,0]=3 1065 B12R2.1081 BrC1=C2CNCCC2=CC=C1 CS12481 [0,1,0,1,0,0|1,0,0]=3 1066 B12R2.1081 BrC1=C2CNCCC2=CC=C1 CS15449 [0,1,0,1,0,0|1,0,0]=3 1067 B12R2.1081 CC1CCNC2=CC=CC=C21 CS17518 [0,1,0,1,0,0|1,0,0]=3 1068 B12R2.1081 CC1CNCC2=CC=CC=C21 CS17240 [0,1,0,1,0,0|2,0,0]=4 1069 B12R2.1081 CC1NCCC2=CC=CC=C21 CS12178 [0,1,0,1,0,0|2,0,0]=4 1070 B12R2.1081 CC1NCCC2=CC=CC=C21 CS15270 [0,1,0,1,0,0|2,0,0]=4 1071 B12R2.1081 CN1CCNC2=CC=CC=C21 CS19012 [0,1,0,1,0,0|2,0,0]=4 1072 B12R2.1081 ClC1=C2CCCNC2=CC=C1 CS19411 [0,1,0,1,0,0|1,0,0]=3 1073 B12R2.1081 ClC1=C2CNCCC2=CC=C1 CS17691 [0,1,0,1,0,0|1,0,0]=3 1074 B12R2.1081 ClC1=C2NCCCC2=CC=C1 MC441108 [0,1,0,1,0,0|1,0,0]=3 1075 B12R2.1081 ClC1=CC=NC2=C1CCCC2 CS16900 [0,1,0,1,0,0|2,0,0]=4 1076 B12R2.1081 FC1=C2CCCNC2=CC=C1 MC100194 [0,1,0,1,0,0|1,0,0]=3 1077 B12R2.1081 FC1=C2CCCNC2=CC=C1 MC430214 [0,1,0,1,0,0|1,0,0]=3 1078 B12R2.1081 FC1=C2CCNCC2=CC=C1 CS19337 [0,1,0,1,0,0|1,0,0]=3 1079 B12R2.1081 FC1=C2CCNCC2=CC=C1 MC431444 [0,1,0,1,0,0|1,0,0]=3 1080 B12R2.1081 FC1=CC=CC2=C1CC=CO2 MC41786 [0,1,0,1,0,0|0,0,2]=4 1081 B12R2.1081 FC1=CC=CC2=C1NCCO2 MC443372 [0,1,0,1,0,0|1,0,0]=3 1082 B12R2.1081 NC1=CC=CC2=C1NCCO2 MC111436 [0,1,0,1,0,0|1,0,0]=3 1083 B12R2.1081 NC1=CC=CC2=C1OCCO2 MC430590 [0,1,0,1,0,0|1,0,0]=3 1084 B12R2.1081 NC1CCCC2=C1C=CC=N2 MC103512 [0,1,0,1,0,0|2,0,0]=4 1085 B12R2.1081 NC1CCCC2=C1N=CC=C2 CS18224 [0,1,0,1,0,0|2,0,0]=4 1086 B12R2.1081 NC1CCCC2=CC=CC=C21 CS13980 [0,1,0,1,0,0|1,0,0]=3 1087 B12R2.1081 NC1CCOC2=CC=CC=C21 CS18355 [0,1,0,1,0,0|0,0,0]=2 1088 B12R2.1081 NC1COCC2=CC=CC=C21 MC100130 [0,1,0,1,0,0|2,0,0]=4 1089 B12R2.1081 O=C1C=CC=C2NCCCN12 MC442326 [0,1,0,1,0,0|1,0,1]=4 1090 B12R2.1081 O=C1CCCC2=C1C=CC=N2 CS18351 [0,1,0,1,0,0|1,0,1]=4 1091 B12R2.1081 O=C1CCCC2=C1C=CN=C2 CS16479 [0,1,0,1,0,0|1,0,1]=4 1092 B12R2.1081 O=C1CCCC2=C1C=NC=C2 CS18873 [0,1,0,1,0,0|1,0,1]=4 1093 B12R2.1081 O=C1CCCC2=C1N=CC=C2 CS15049 [0,1,0,1,0,0|1,0,1]=4 1094 B12R2.1081 O=C1CCCC2=CC=CC=C12 CS14809 [0,1,0,1,0,0|0,0,1]=3 1095 B12R2.1081 O=C1CCNC2=CC=CC=C12 CS15321 [0,1,0,1,0,0|1,0,1]=4 1096 B12R2.1081 O=C1CCNC2=CC=CC=C12 MC441207 [0,1,0,1,0,0|1,0,1]=4 1097 B12R2.1081 O=C1CCOC2=CC=CC=C12 CS22800 [0,1,0,1,0,0|0,0,1]=3 1098 B12R2.1081 O=C1COCC2=C1C=CC=C2 MC41773 [0,1,0,1,0,0|1,0,1]=4 1099 B12R2.1081 O=C1NC=CC2=C1CCNC2 MC100148 [0,1,0,1,0,0|1,0,1]=4 1100 B12R2.1081 O=C1NCCC2=CC=CC=C12 CS17872 [0,1,0,1,0,0|1,0,1]=4 1101 B12R2.1081 O=C1OCCC2=CC=CC=C12 CS12987 [0,1,0,1,0,0|1,0,1]=4 1102 B12R2.1081 OC1=C2CNCCC2=CC=C1 MC105733 [0,1,0,1,0,0|0,0,0]=2 1103 B12R2.1081 OC1=C2NCCCC2=CC=C1 CS19254 [0,1,0,1,0,0|0,0,0]=2 1104 B12R2.1081 OC1=CC=CC2=C1CCNC2 MC425651 [0,1,0,1,0,0|0,0,0]=2 1105 B12R2.1081 OC1=CC=CC2=C1OCCN2 MC441075 [0,1,0,1,0,0|1,0,0]=3 1106 B12R2.1081 OC1=CC=CC2=C1OCCO2 CS12196 [0,1,0,1,0,0|1,0,0]=3 1107 B12R2.1081 OC1CCCC2=C1N=CC=C2 CS18737 [0,1,0,1,0,0|1,0,0]=3 1108 B12R2.1081 OC1CNCC2=CC=CC=C21 MC111757 [0,1,0,1,0,0|1,0,0]=3 1109 B12R2.24 BrC1=CC2=C(C=C1)NCCO2 CS10787 [0,1,0,1,0,0|1,0,0]=3 1110 B12R2.24 BrC1=CC2=C(C=C1)NCCO2 CS15185 [0,1,0,1,0,0|1,0,0]=3 1111 B12R2.24 BrC1=CC2=C(C=C1)OCCN2 CS15468 [0,1,0,1,0,0|1,0,0]=3 1112 B12R2.24 BrC1=CC2=C(C=C1)OCCO2 CS10776 [0,1,0,1,0,0|1,0,0]=3 1113 B12R2.24 BrC1=CC2=C(N=C1)NCCO2 MC443542 [0,1,0,1,0,0|2,0,0]=4 1114 B12R2.24 BrC1=CC=C2CCCCC2=C1 CS16753 [0,1,0,1,0,0|1,0,0]=3 1115 B12R2.24 BrC1=CC=C2CCCNC2=C1 CS18621 [0,1,0,1,0,0|1,0,0]=3 1116 B12R2.24 BrC1=CC=C2CCCOC2=C1 MC443258 [0,1,0,1,0,0|0,0,0]=2 1117 B12R2.24 BrC1=CC=C2CCNCC2=C1 CS19606 [0,1,0,1,0,0|2,0,0]=4 1118 B12R2.24 BrC1=CC=C2CCOCC2=C1 CS16547 [0,1,0,1,0,0|2,0,0]=4 1119 B12R2.24 BrC1=CC=C2CNCCC2=C1 CS10618 [0,1,0,1,0,0|2,0,0]=4 1120 B12R2.24 BrC1=CC=C2CNCCC2=C1 CS17620 [0,1,0,1,0,0|2,0,0]=4 1121 B12R2.24 BrC1=CC=C2COCCC2=C1 MC441107 [0,1,0,1,0,0|2,0,0]=4 1122 B12R2.24 BrC1=CC=C2NCCCC2=C1 CS19737 [0,1,0,1,0,0|1,0,0]=3 1123 B12R2.24 BrC1=CC=C2OCCCC2=C1 CS19916 [0,1,0,1,0,0|0,0,0]=2 1124 B12R2.24 BrC1=NC2=C(C=C1)OCCN2 MC115915 [0,1,0,1,0,0|2,0,0]=4 1125 B12R2.24 CC1=CC=C2CCCCC2=C1 CS10746 [0,1,0,1,0,0|1,0,0]=3 1126 B12R2.24 CC1=CC=C2CCNCC2=C1 CS18155 [0,1,0,1,0,0|2,0,0]=4 1127 B12R2.24 CC1=CC=C2CNCCC2=C1 MC431469 [0,1,0,1,0,0|2,0,0]=4 1128 B12R2.24 CC1CNC2=CC=CC=C2C1 MC33343 [0,1,0,1,0,0|1,0,0]=3 1129 B12R2.24 CN1CCC2=CC=CC=C2C1 CS16157 [0,1,0,1,0,0|1,0,0]=3 1130 B12R2.24 ClC1=CC2=C(C=C1)NCCO2 MC443200 [0,1,0,1,0,0|1,0,0]=3 1131 B12R2.24 ClC1=CC2=C(C=C1)OCCN2 MC441073 [0,1,0,1,0,0|1,0,0]=3 1132 B12R2.24 ClC1=CC=C2CCCNC2=C1 MC443569 [0,1,0,1,0,0|1,0,0]=3 1133 B12R2.24 ClC1=CC=C2CCCNC2=N1 MC443151 [0,1,0,1,0,0|2,0,0]=4 1134 B12R2.24 ClC1=CC=C2NCCCC2=C1 CS14585 [0,1,0,1,0,0|1,0,0]=3 1135 B12R2.24 ClC1=NC2=C(C=C1)CCCC2 CS16899 [0,1,0,1,0,0|2,0,0]=4 1136 B12R2.24 FC1=CC=C2CNCCC2=C1 MC106618 [0,1,0,1,0,0|2,0,0]=4 1137 B12R2.24 FC1=CC=C2NCCCC2=C1 MC441111 [0,1,0,1,0,0|1,0,0]=3 1138 B12R2.24 IC1=CC=C2OCCCC2=C1 MC425133 [0,1,0,1,0,0|0,0,0]=2 1139 B12R2.24 NC1=CC2=C(C=C1)NCCO2 MC442710 [0,1,0,1,0,0|1,0,0]=3 1140 B12R2.24 NC1=CC=C2CCNCC2=C1 MC443158 [0,1,0,1,0,0|2,0,0]=4 1141 B12R2.24 NC1CCC2=CC=CC=C2C1 CS18799 [0,1,0,1,0,0|1,0,0]=3 1142 B12R2.24 NC1CCC2=CC=CC=C2C1 MC106682 [0,1,0,1,0,0|1,0,0]=3 1143 B12R2.24 NC1CCC2=CC=CC=C2C1 MC106683 [0,1,0,1,0,0|1,0,0]=3 1144 B12R2.24 NN1CCC2=CC=CC=C2C1 MC442441 [0,1,0,1,0,0|2,0,0]=4 1145 B12R2.24 O=C1CCC2=C(C=CC=C2)C1 MC440135 [0,1,0,1,0,0|1,0,1]=4 1146 B12R2.24 O=C1CCC2=CC=CC=C2N1 CS11038 [0,1,0,1,0,0|1,0,1]=4 1147 B12R2.24 O=C1CCc2ccccc2O1 MC41795 [0,1,0,1,0,0|0,0,1]=3 1148 B12R2.24 O=C1COC2=C(C=CC=C2)N1 CS21568 [0,1,0,1,0,0|1,0,1]=4 1149 B12R2.24 O=C1CSC2=CC=CC=C2C1 MC107174 [0,1,0,1,0,0|0,1,1]=4 1150 B12R2.24 OC1=CC2=C(C=C1)CCCC2 CS13514 [0,1,0,1,0,0|1,0,0]=3 1151 B12R2.24 OC1=CC2=C(C=C1)NCCO2 MC442455 [0,1,0,1,0,0|1,0,0]=3 1152 B12R2.24 OC1=CC2=C(C=C1)OCCO2 MC429083 [0,1,0,1,0,0|1,0,0]=3 1153 B12R2.24 OC1=CC=C2CCCNC2=C1 CS10898 [0,1,0,1,0,0|1,0,0]=3 1154 B12R2.24 OC1=CC=C2CCNCC2=C1 CS17696 [0,1,0,1,0,0|2,0,0]=4 1155 B12R2.24 OC1=CC=C2CNCCC2=C1 CS18391 [0,1,0,1,0,0|2,0,0]=4 1156 B12R2.24 OC1=CC=C2NCCCC2=C1 CS18990 [0,1,0,1,0,0|1,0,0]=3 1157 B12R2.24 OC1=CN=C2OCCCC2=C1 MC116110 [0,1,0,1,0,0|1,0,0]=3 1158 B12R2.32 BrCC1=NC2=C(C=CC=C2)O1 CS12836 [0,1,0,1,0,0|1,0,1]=4 1159 B12R2.32 CCC1=NC2=C(C=CC=C2)N1 CS18815 [0,1,0,1,0,0|1,0,1]=4 1160 B12R2.32 CSC1=NC2=C(C=CC=C2)O1 MC31049 [0,1,0,1,0,0|1,0,1]=4 1161 B12R2.32 ClCC1=NC2=C(C=CC=C2)O1 MC442523 [0,1,0,1,0,0|1,0,1]=4 1162 B12R2.32 NCC1=CC2=C(C=CC=C2)O1 MC111185 [0,1,0,1,0,0|0,0,2]=4 1163 B12R2.32 OCC1CC2=C(C=CC=C2)O1 CS21037 [0,1,0,1,0,0|0,0,0]=2 1164 B12R2.32 OCC1CC2=CC=CC=C2N1 MC105284 [0,1,0,1,0,0|1,0,0]=3 1165 B12R2.196 CC1=C2CCC(=O)C2=CC=C1 CS14012 [0,1,0,1,0,0|1,0,1]=4 1166 B12R2.196 CN1C=CC2=C1C=CC=C2O CS13327 [0,1,0,1,0,0|0,0,2]=4 1167 B12R2.196 CN1N=CC2=C1C=CC=C2O MC441199 [0,1,0,1,0,0|1,0,1]=4 1168 B12R2.196 NC1=C2CCC(=O)C2=CC=C1 MC446724 [0,1,0,1,0,0|1,0,1]=4 1169 B12R2.196 NC1CCC2=C(Br)C=CC=C21 CS14533 [0,1,0,1,0,0|1,0,0]=3 1170 B12R2.196 NC1CCC2=C(Br)C=CC=C21 CS14534 [0,1,0,1,0,0|1,0,0]=3 1171 B12R2.196 NC1CCC2=C(F)C=CC=C21 CS18746 [0,1,0,1,0,0|1,0,0]=3 1172 B12R2.196 O=C1CCC2=C(Br)C=CC=C12 CS10966 [0,1,0,1,0,0|1,0,1]=4 1173 B12R2.196 O=C1CCC2=C(Cl)C=CC=C12 CS18751 [0,1,0,1,0,0|1,0,1]=4 1174 B12R2.196 O=C1CCC2=C(F)C=CC=C12 MC442503 [0,1,0,1,0,0|1,0,1]=4 1175 B12R2.196 O=C1CCC2=C(O)C=CC=C12 CS19922 [0,1,0,1,0,0|0,0,1]=3 1176 B12R2.196 O=C1NCC2=C(O)C=CC=C12 CS14659 [0,1,0,1,0,0|1,0,1]=4 1177 B12R2.196 OC1CCC2=C(Cl)C=CN=C21 CS12906 [0,1,0,1,0,0|2,0,0]=4 1178 B12R2.225 NC1=CC=CN=C1NC2CC2 MC106346 [0,1,0,1,0,0|2,0,0]=4 1179 B12R2.1 CNC1CCC2=CC=CC=C21 MC431440 [0,1,0,1,0,0|2,0,0]=4 1180 B12R2.18 CC1CC2=CC=CC=C2C1=O MC446688 [0,1,0,1,0,0|0,0,1]=3 1181 B12R2.18 NC1C2=CC=CC=C2CC1O CS13576 [0,1,0,1,0,0|2,0,0]=4 1182 B12R2.18 NC1C2=CC=CC=C2CC1O MC20312 [0,1,0,1,0,0|2,0,0]=4 1183 B12R2.18 NC1CC2=CC=CC=C2C1O MC446701 [0,1,0,1,0,0|1,0,0]=3 1184 B12R2.315 COC1=C2CNCC2=CC=C1 CS17395 [0,1,0,1,0,0|1,0,0]=3 1185 B12R2.315 COC1=C2CNCC2=CC=C1 MC107634 [0,1,0,1,0,0|1,0,0]=3 1186 B12R2.315 N#CC1=CC=CC2=C1CCN2 CS17741 [0,1,0,1,0,0|2,0,0]=4 1187 B12R2.315 N#CC1=CC=CC2=C1CNC2 MC106582 [0,1,0,1,0,0|2,0,0]=4 1188 B12R2.315 NCC1=C2NCCC2=CC=C1 MC107112 [0,1,0,1,0,0|2,0,0]=4 1189 B12R2.315 O=CC1=CC=CC2=C1OCC2 MC442782 [0,1,0,1,0,0|1,0,1]=4 1190 B12R2.315 OCC1=C2CCNC2=CC=C1 CS13211 [0,1,0,1,0,0|1,0,0]=3 1191 B12R2.2048 NCC1=C(C2CC2)C=CC=C1 CS15686 [0,1,0,1,0,0|1,0,0]=3 1192 B12R2.2048 OCC1=C(C2CC2)C=CC=C1 CS16040 [0,1,0,1,0,0|0,0,0]=2 1193 B12R2.246 ClC1=CC(Cl)=C2CCCC2=N1 CS16898 [0,1,0,1,0,0|2,0,0]=4 1194 B12R2.246 ClC1=CC(Cl)=C2CCCC2=N1 MC100188 [0,1,0,1,0,0|2,0,0]=4 1195 B12R2.246 FC1=C2CNCC2=CC(Br)=C1 CS17973 [0,1,0,1,0,0|2,0,0]=4 1196 B12R2.246 FC1=C2CNCC2=CC(Br)=C1 CS18118 [0,1,0,1,0,0|2,0,0]=4 1197 B12R2.246 FC1=CC2=C(OCC2)C(F)=C1 MC100001 [0,1,0,1,0,0|2,0,0]=4 1198 B12R2.246 O=C1C=C(O)C2=C(CCC2)N1 CS20545 [0,1,0,1,0,0|1,0,0]=3 1199 B12R2.606 CC1=CC2=C(C=C(O)C=C2)O1 MC111383 [0,1,0,1,0,0|0,0,2]=4 1200 B12R2.606 CC1=CC2=C(C=C1)OC(C)=N2 CS11036 [0,1,0,1,0,0|1,0,1]=4 1201 B12R2.606 CC1=CC2=C(C=CC(Br)=C2)O1 MC441288 [0,1,0,1,0,0|0,0,2]=4 1202 B12R2.606 CC1=NC2=C(C=C(Br)C=C2)O1 CS10632 [0,1,0,1,0,0|1,0,1]=4 1203 B12R2.606 CC1=NC2=C(C=C(Cl)C=C2)O1 MC442522 [0,1,0,1,0,0|1,0,1]=4 1204 B12R2.606 CC1=NC2=C(C=C(O)C=C2)O1 MC427398 [0,1,0,1,0,0|1,0,1]=4 1205 B12R2.606 CC1=NC2=C(C=CC(Br)=C2)O1 MC442516 [0,1,0,1,0,0|1,0,1]=4 1206 B12R2.606 CC1=NC2=C(C=CC(Cl)=C2)O1 MC20465 [0,1,0,1,0,0|1,0,1]=4 1207 B12R2.606 CC1=NC2=C(C=CC(O)=C2)O1 CS16740 [0,1,0,1,0,0|1,0,1]=4 1208 B12R2.606 NC1CC2=CC=C(Br)C=C2C1 CS18236 [0,1,0,1,0,0|2,0,0]=4 1209 B12R2.606 NC1CC2=CC=C(Br)C=C2C1 MC102510 [0,1,0,1,0,0|2,0,0]=4 1210 B12R2.606 NC1CC2=CC=C(Br)C=C2C1 MC102511 [0,1,0,1,0,0|2,0,0]=4 1211 B12R2.606 NC1CC2=CC=C(I)C=C2C1 CS17420 [0,1,0,1,0,0|2,0,0]=4 1212 B12R2.606 NC1CC2=CC=C(I)C=C2C1 MC21023 [0,1,0,1,0,0|2,0,0]=4 1213 B12R2.606 OC1CC2=CC=C(Br)C=C2C1 CS12609 [0,1,0,1,0,0|2,0,0]=4 1214 B12R2.1317 OC1=CC(Cl)=C(C2CC2)N=C1 MC111389 [0,1,0,1,0,0|2,0,0]=4 1215 B12R2.95 CC1(C)OC2=C(C=CC=C2)O1 CS17049 [0,1,0,1,0,0|1,0,0]=3 1216 B12R2.95 ClC1(Cl)OC2=C(C=CC=C2)O1 MC41771 [0,1,0,1,0,0|2,0,0]=4 1217 B12R2.95 FC1(F)OC2=C(C=CC=C2)O1 CS20973 [0,1,0,1,0,0|2,0,0]=4 1218 B12R2.88 NC1(C2=C(Cl)C=CC=C2)CC1 MC115575 [0,1,0,1,0,0|1,0,0]=3 1219 B12R2.88 NC1(C2=C(F)C=CC=C2)CC1 MC443454 [0,1,0,1,0,0|1,0,0]=3 1220 B12R2.203 O=C1CCC2=CC=CC(Br)=C12 MC106557 [0,1,0,1,0,0|1,0,1]=4 1221 B12R2.203 O=C1CCC2=CC=CC(Cl)=C12 MC429388 [0,1,0,1,0,0|1,0,1]=4 1222 B12R2.203 O=C1CCC2=CC=CC(F)=C12 CS15500 [0,1,0,1,0,0|1,0,1]=4 1223 B12R2.203 O=C1CCC2=CC=CC(I)=C12 MC113777 [0,1,0,1,0,0|1,0,1]=4 1224 B12R2.203 O=C1CCC2=CC=CC(O)=C12 CS12591 [0,1,0,1,0,0|0,0,1]=3 1225 B8R1.8 CCCC1=NC=CN1 CS14621 [1,0,0,0,1,0|2,0,0]=4 1226 B8R1.8 NCCC1=CSC=C1 CS22098 [1,0,0,0,1,0|2,0,0]=4 1227 B8R1.8 OCCC1=CC=CS1 CS14939 [1,0,0,0,1,0|2,0,0]=4 1228 B8R1.8 OCCC1=CSC=C1 CS20858 [1,0,0,0,1,0|2,0,0]=4