0 B10R1.1 Br[Zn]Cc1ccc(Br)cc1 MC121353 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.1 C=COC1=CC=C(I)C=C1 MC103309 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.1 CC1=CC=C(CC#N)C=C1 CS21709 [0,0,0,0,0,0|1,0,1]=2 3 B10R1.1 CC1=CC=C(CCBr)C=C1 CS19977 [0,0,0,0,0,0|1,0,1]=2 4 B10R1.1 CC1=CC=C(CCN)C=C1 CS18979 [0,0,0,0,0,0|1,0,1]=2 5 B10R1.1 CC1=CC=C(CCO)C=C1 MC40744 [0,0,0,0,0,0|0,0,2]=2 6 B10R1.1 CC1=CC=C(CNN)C=C1 CS20201 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.1 CC1=NC=C(CC#N)C=N1 MC112067 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.1 CC1=NC=C(N=C=O)C=C1 MC106881 [0,0,0,0,0,0|2,0,1]=3 9 B10R1.1 CCCC1=CC=C(Br)C=C1 CS10896 [0,0,0,0,0,0|2,0,1]=3 10 B10R1.1 CCOC1=CC=C(Br)C=C1 MC446797 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.1 CCOC1=CC=C(I)C=C1 CS22907 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.1 CCOC1=CC=C(N)C=C1 CS11879 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.1 CNCC1=CC=C(Br)C=C1 CS19272 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.1 CNCC1=CC=C(C)C=C1 CS11795 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.1 CNCC1=CN=C(C)N=C1 CS15645 [0,0,0,0,0,0|4,0,0]=4 16 B10R1.1 CSCC1=NC=C(Br)C=C1 MC112104 [0,0,0,0,0,0|4,0,0]=4 17 B10R1.1 ClC1=CC=C(CCBr)C=C1 CS10835 [0,0,0,0,0,0|2,0,1]=3 18 B10R1.1 ClCCC1=CC=C(Cl)C=C1 MC433885 [0,0,0,0,0,0|2,0,1]=3 19 B10R1.1 FC1=CC=C(CCBr)C=C1 CS10866 [0,0,0,0,0,0|2,0,1]=3 20 B10R1.1 FC1=CC=C(N=C=S)C=C1 MC41072 [0,0,0,0,0,0|2,1,1]=4 21 B10R1.1 Fc1ccc(C[Zn]Cl)cc1 MC121346 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.1 N#CCC1=CC=C(Br)C=C1 CS20687 [0,0,0,0,0,0|2,0,1]=3 23 B10R1.1 N#CCC1=CC=C(Cl)C=C1 MC20790 [0,0,0,0,0,0|2,0,1]=3 24 B10R1.1 N#CCC1=CC=C(Cl)N=C1 CS19041 [0,0,0,0,0,0|3,0,1]=4 25 B10R1.1 N#CCC1=CC=C(F)C=C1 CS14479 [0,0,0,0,0,0|2,0,1]=3 26 B10R1.1 N#CCC1=CC=C(F)N=C1 MC429490 [0,0,0,0,0,0|3,0,1]=4 27 B10R1.1 N#CCC1=CC=C(I)C=C1 MC40782 [0,0,0,0,0,0|2,0,1]=3 28 B10R1.1 N#CCC1=CC=C(N)C=C1 MC40751 [0,0,0,0,0,0|2,0,1]=3 29 B10R1.1 N#CCC1=NC=C(Br)C=C1 CS19461 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.1 N#CCC1=NC=C(Cl)C=C1 CS15674 [0,0,0,0,0,0|3,0,1]=4 31 B10R1.1 NC1=CC=C(CCO)C=C1 CS13450 [0,0,0,0,0,0|1,0,2]=3 32 B10R1.1 NCCC1=CC=C(Br)C=C1 CS19296 [0,0,0,0,0,0|2,0,1]=3 33 B10R1.1 NCCC1=CC=C(Cl)C=C1 MC40975 [0,0,0,0,0,0|2,0,1]=3 34 B10R1.1 NCCC1=CC=C(F)C=C1 CS13766 [0,0,0,0,0,0|2,0,1]=3 35 B10R1.1 NCCC1=CC=C(N)C=C1 MC33045 [0,0,0,0,0,0|2,0,1]=3 36 B10R1.1 NCCC1=CC=C(O)C=C1 CS22315 [0,0,0,0,0,0|2,0,1]=3 37 B10R1.1 NCCC1=CNC(=O)C=C1 MC33499 [0,0,0,0,0,0|3,0,1]=4 38 B10R1.1 NNCC1=CC=C(F)C=C1 CS17057 [0,0,0,0,0,0|3,0,0]=3 39 B10R1.1 O=C=NC1=CC=C(Br)C=C1 MC41032 [0,0,0,0,0,0|2,0,1]=3 40 B10R1.1 O=C=NC1=CC=C(F)C=C1 MC33036 [0,0,0,0,0,0|2,0,1]=3 41 B10R1.1 O=CCC1=CC=C(Br)C=C1 CS18203 [0,0,0,0,0,0|1,0,0]=1 42 B10R1.1 O=CNC1=CC=C(Cl)C=C1 MC103067 [0,0,0,0,0,0|2,0,0]=2 43 B10R1.1 OC1=CC=C(N=C=S)C=C1 MC106291 [0,0,0,0,0,0|2,1,1]=4 44 B10R1.1 OCCC1=CC=C(Br)C=C1 CS14491 [0,0,0,0,0,0|1,0,2]=3 45 B10R1.1 OCCC1=CC=C(Cl)C=C1 CS22791 [0,0,0,0,0,0|1,0,2]=3 46 B10R1.1 OCCC1=CC=C(F)C=C1 MC33200 [0,0,0,0,0,0|1,0,2]=3 47 B10R1.1 OCCC1=CC=C(I)C=C1 CS12086 [0,0,0,0,0,0|1,0,2]=3 48 B10R1.1 OCCC1=CC=C(O)C=C1 CS20458 [0,0,0,0,0,0|1,0,2]=3 49 B10R1.1 OCCC1=NC=C(Br)C=C1 MC102395 [0,0,0,0,0,0|2,0,2]=4 50 B10R1.1 S=C=NC1=CC=C(Br)C=C1 MC41057 [0,0,0,0,0,0|2,1,1]=4 51 B10R1.1 S=C=NC1=CC=C(Cl)C=C1 MC41059 [0,0,0,0,0,0|2,1,1]=4 52 B9R1.1 BrCC1=CC=C(Br)C=C1 CS19166 [1,0,0,0,0,0|2,0,0]=3 53 B9R1.1 BrCC1=CC=C(I)C=C1 CS20172 [1,0,0,0,0,0|2,0,0]=3 54 B9R1.1 BrCC1=CN=C(Br)C=C1 MC430652 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.1 Br[Mg]c1ccc(Br)cc1 MC116037 [1,0,0,0,0,0|3,0,0]=4 56 B9R1.1 C#CC1=CC=C(Br)C=C1 MC440298 [1,0,0,0,0,0|1,0,2]=4 57 B9R1.1 C#CC1=CC=C(C)C=C1 CS21552 [1,0,0,0,0,0|0,0,2]=3 58 B9R1.1 C#CC1=CC=C(Cl)C=C1 MC440300 [1,0,0,0,0,0|1,0,2]=4 59 B9R1.1 C#CC1=CC=C(F)C=C1 MC429574 [1,0,0,0,0,0|1,0,2]=4 60 B9R1.1 C#CC1=CC=C(I)C=C1 MC443225 [1,0,0,0,0,0|1,0,2]=4 61 B9R1.1 C=CC1=CC=C(Br)C=C1 MC41562 [1,0,0,0,0,0|1,0,1]=3 62 B9R1.1 C=CC1=CC=C(F)C=C1 MC33131 [1,0,0,0,0,0|1,0,1]=3 63 B9R1.1 C=CC1=CN=C(Br)C=C1 MC442257 [1,0,0,0,0,0|2,0,1]=4 64 B9R1.1 C=CC1=NC=C(Br)C=C1 MC431908 [1,0,0,0,0,0|2,0,1]=4 65 B9R1.1 CC1=CC=C(C#N)C=C1 CS19807 [1,0,0,0,0,0|1,0,1]=3 66 B9R1.1 CC1=CC=C(C=O)C=C1 MC41128 [1,0,0,0,0,0|0,0,0]=1 67 B9R1.1 CC1=CC=C(CBr)C=C1 CS22969 [1,0,0,0,0,0|1,0,0]=2 68 B9R1.1 CC1=CC=C(CCl)C=C1 MC40603 [1,0,0,0,0,0|1,0,0]=2 69 B9R1.1 CC1=CC=C(CN)C=C1 CS22970 [1,0,0,0,0,0|1,0,0]=2 70 B9R1.1 CC1=CC=C(CN)N=N1 MC100078 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.1 CC1=CC=C(CO)C=C1 CS19704 [1,0,0,0,0,0|0,0,1]=2 72 B9R1.1 CC1=CC=C(CO)C=N1 MC21041 [1,0,0,0,0,0|1,0,1]=3 73 B9R1.1 CC1=CC=C(NN)C=C1 CS19576 [1,0,0,0,0,0|2,0,0]=3 74 B9R1.1 CC1=CN=C(C#N)C=C1 CS13787 [1,0,0,0,0,0|2,0,1]=4 75 B9R1.1 CC1=CN=C(C=O)C=C1 CS19088 [1,0,0,0,0,0|1,0,0]=2 76 B9R1.1 CC1=CN=C(C=O)C=N1 CS12781 [1,0,0,0,0,0|2,0,0]=3 77 B9R1.1 CC1=CN=C(C=O)N=C1 MC103803 [1,0,0,0,0,0|2,0,0]=3 78 B9R1.1 CC1=CN=C(CCl)C=C1 MC115829 [1,0,0,0,0,0|2,0,0]=3 79 B9R1.1 CC1=CN=C(CCl)C=N1 MC103599 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.1 CC1=CN=C(CCl)N=C1 CS15667 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.1 CC1=CN=C(CCl)N=C1 MC104693 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.1 CC1=CN=C(CN)C=C1 CS18319 [1,0,0,0,0,0|2,0,0]=3 83 B9R1.1 CC1=CN=C(CN)N=C1 MC103801 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.1 CC1=CN=C(CO)C=N1 CS12383 [1,0,0,0,0,0|2,0,1]=4 85 B9R1.1 CC1=CN=C(CO)N=C1 MC102095 [1,0,0,0,0,0|2,0,1]=4 86 B9R1.1 CC1=NC=C(C#N)C=C1 CS14144 [1,0,0,0,0,0|2,0,1]=4 87 B9R1.1 CC1=NC=C(C=O)C=C1 CS19116 [1,0,0,0,0,0|1,0,0]=2 88 B9R1.1 CC1=NC=C(C=O)C=N1 MC444194 [1,0,0,0,0,0|2,0,0]=3 89 B9R1.1 CC1=NC=C(CBr)C=N1 MC112066 [1,0,0,0,0,0|3,0,0]=4 90 B9R1.1 CC1=NC=C(CI)C=N1 MC116563 [1,0,0,0,0,0|3,0,0]=4 91 B9R1.1 CC1=NC=C(CN)C=N1 MC101949 [1,0,0,0,0,0|3,0,0]=4 92 B9R1.1 CC1=NC=C(CO)C=N1 CS13969 [1,0,0,0,0,0|2,0,1]=4 93 B9R1.1 CCC1=CC=C(Br)C=C1 CS10865 [1,0,0,0,0,0|1,0,1]=3 94 B9R1.1 CCC1=CC=C(F)C=C1 MC20965 [1,0,0,0,0,0|1,0,1]=3 95 B9R1.1 CCC1=CC=C(I)C=C1 MC20189 [1,0,0,0,0,0|1,0,1]=3 96 B9R1.1 CCC1=CC=C(N)C=C1 MC40912 [1,0,0,0,0,0|1,0,1]=3 97 B9R1.1 CCC1=CC=C(O)C=C1 MC20188 [1,0,0,0,0,0|1,0,1]=3 98 B9R1.1 CCC1=CN=C(Br)C=C1 CS13124 [1,0,0,0,0,0|2,0,1]=4 99 B9R1.1 CCC1=CN=C(C)C=C1 MC20566 [1,0,0,0,0,0|1,0,1]=3 100 B9R1.1 CCC1=NC=C(Br)C=C1 CS12376 [1,0,0,0,0,0|2,0,1]=4 101 B9R1.1 CN1C=CC(CN)=CN1 MC105291 [1,0,0,0,0,0|3,0,0]=4 102 B9R1.1 CNC1=CC=C(Cl)C=C1 MC40891 [1,0,0,0,0,0|2,0,1]=4 103 B9R1.1 CNC1=CC=C(F)C=C1 MC40919 [1,0,0,0,0,0|2,0,1]=4 104 B9R1.1 CNC1=CC=C(I)C=C1 CS22906 [1,0,0,0,0,0|2,0,1]=4 105 B9R1.1 COC1=CC=C(Br)C=C1 MC41310 [1,0,0,0,0,0|2,0,1]=4 106 B9R1.1 COC1=CC=C(Cl)C=C1 MC41327 [1,0,0,0,0,0|2,0,1]=4 107 B9R1.1 COC1=CC=C(F)C=C1 MC30345 [1,0,0,0,0,0|2,0,1]=4 108 B9R1.1 COC1=CC=C(I)C=C1 MC41342 [1,0,0,0,0,0|2,0,1]=4 109 B9R1.1 COC1=CC=C(N)C=C1 CS18580 [1,0,0,0,0,0|2,0,1]=4 110 B9R1.1 COC1=CC=C(O)C=C1 CS22939 [1,0,0,0,0,0|2,0,1]=4 111 B9R1.1 COC1=CC=C(S)C=C1 MC20380 [1,0,0,0,0,0|2,0,1]=4 112 B9R1.1 COC1=NC=C(C)C=C1 CS21644 [1,0,0,0,0,0|2,0,1]=4 113 B9R1.1 CSC1=CC=C(O)C=C1 MC20743 [1,0,0,0,0,0|2,0,1]=4 114 B9R1.1 ClC1=CC=C(CBr)C=C1 MC40527 [1,0,0,0,0,0|2,0,0]=3 115 B9R1.1 ClC1=CN=C(CBr)C=C1 CS16112 [1,0,0,0,0,0|3,0,0]=4 116 B9R1.1 ClC1=CN=C(CBr)C=C1 CS17526 [1,0,0,0,0,0|3,0,0]=4 117 B9R1.1 ClC1=NC=C(CBr)C=C1 MC430654 [1,0,0,0,0,0|3,0,0]=4 118 B9R1.1 ClCC1=CC=C(Br)C=C1 CS19167 [1,0,0,0,0,0|2,0,0]=3 119 B9R1.1 ClCC1=CC=C(Cl)C=C1 CS19806 [1,0,0,0,0,0|2,0,0]=3 120 B9R1.1 FC1=CC=C(CBr)C=C1 CS19071 [1,0,0,0,0,0|2,0,0]=3 121 B9R1.1 FC1=CC=C(CCl)C=C1 MC429572 [1,0,0,0,0,0|2,0,0]=3 122 B9R1.1 FC1=CN=C(CBr)C=C1 MC430066 [1,0,0,0,0,0|3,0,0]=4 123 B9R1.1 FC1=CN=C(CBr)C=C1 MC432544 [1,0,0,0,0,0|3,0,0]=4 124 B9R1.1 FC1=NC=C(CBr)C=C1 CS13268 [1,0,0,0,0,0|3,0,0]=4 125 B9R1.1 N#CC1=CC=C(Br)C=C1 CS19210 [1,0,0,0,0,0|2,0,1]=4 126 B9R1.1 N#CC1=CC=C(Cl)C=C1 CS19211 [1,0,0,0,0,0|2,0,1]=4 127 B9R1.1 N#CC1=CC=C(F)C=C1 CS18637 [1,0,0,0,0,0|2,0,1]=4 128 B9R1.1 N#CC1=CC=C(I)C=C1 CS22010 [1,0,0,0,0,0|2,0,1]=4 129 B9R1.1 N#CC1=CC=C(N)C=C1 CS13395 [1,0,0,0,0,0|2,0,1]=4 130 B9R1.1 N#CC1=CC=C(O)C=C1 CS15887 [1,0,0,0,0,0|2,0,1]=4 131 B9R1.1 NC1=CC=C(C=O)C=C1 MC20423 [1,0,0,0,0,0|1,0,0]=2 132 B9R1.1 NC1=CC=C(CO)C=C1 MC33175 [1,0,0,0,0,0|1,0,1]=3 133 B9R1.1 NC1=CC=C(CO)C=N1 MC425278 [1,0,0,0,0,0|2,0,1]=4 134 B9R1.1 NC1=CN=C(CO)C=C1 MC33467 [1,0,0,0,0,0|2,0,1]=4 135 B9R1.1 NC1=NC=C(C=O)C=N1 CS16976 [1,0,0,0,0,0|3,0,0]=4 136 B9R1.1 NC1=NC=C(C=O)C=N1 CS19828 [1,0,0,0,0,0|3,0,0]=4 137 B9R1.1 NCC1=CC=C(Br)C=C1 CS19587 [1,0,0,0,0,0|2,0,0]=3 138 B9R1.1 NCC1=CC=C(Br)N=C1 CS11090 [1,0,0,0,0,0|3,0,0]=4 139 B9R1.1 NCC1=CC=C(Cl)C=C1 MC33031 [1,0,0,0,0,0|2,0,0]=3 140 B9R1.1 NCC1=CC=C(Cl)N=C1 CS16390 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.1 NCC1=CC=C(F)C=C1 CS18721 [1,0,0,0,0,0|2,0,0]=3 142 B9R1.1 NCC1=CC=C(I)C=C1 MC40836 [1,0,0,0,0,0|2,0,0]=3 143 B9R1.1 NCC1=CC=C(I)C=C1 MC40837 [1,0,0,0,0,0|2,0,0]=3 144 B9R1.1 NCC1=CC=C(N)C=N1 CS10590 [1,0,0,0,0,0|3,0,0]=4 145 B9R1.1 NCC1=CC=C(O)C=C1 CS22886 [1,0,0,0,0,0|2,0,0]=3 146 B9R1.1 NCC1=CN=C(F)C=C1 MC104517 [1,0,0,0,0,0|3,0,0]=4 147 B9R1.1 NCC1=NC=C(F)C=C1 CS16554 [1,0,0,0,0,0|3,0,0]=4 148 B9R1.1 NCC1=NC=C(F)C=C1 MC430168 [1,0,0,0,0,0|3,0,0]=4 149 B9R1.1 NCC1=NC=C(F)C=C1 MC430169 [1,0,0,0,0,0|3,0,0]=4 150 B9R1.1 NNC1=CC=C(Br)C=C1 CS15342 [1,0,0,0,0,0|3,0,0]=4 151 B9R1.1 NNC1=CC=C(Cl)C=C1 CS13495 [1,0,0,0,0,0|3,0,0]=4 152 B9R1.1 NNC1=CC=C(Cl)C=C1 CS17312 [1,0,0,0,0,0|3,0,0]=4 153 B9R1.1 NNC1=CC=C(F)C=C1 CS22006 [1,0,0,0,0,0|3,0,0]=4 154 B9R1.1 NNC1=CC=C(N)C=C1 MC430700 [1,0,0,0,0,0|3,0,0]=4 155 B9R1.1 O=C1C=CC(CO)=CN1 CS19816 [1,0,0,0,0,0|2,0,1]=4 156 B9R1.1 O=CC1=CC=C(Br)C=C1 CS18612 [1,0,0,0,0,0|1,0,0]=2 157 B9R1.1 O=CC1=CC=C(Cl)C=C1 CS14843 [1,0,0,0,0,0|1,0,0]=2 158 B9R1.1 O=CC1=CC=C(Cl)N=N1 MC444424 [1,0,0,0,0,0|3,0,0]=4 159 B9R1.1 O=CC1=CC=C(F)C=C1 CS19072 [1,0,0,0,0,0|1,0,0]=2 160 B9R1.1 O=CC1=CC=C(I)C=C1 CS20133 [1,0,0,0,0,0|1,0,0]=2 161 B9R1.1 O=CC1=CC=C(O)C=C1 CS18686 [1,0,0,0,0,0|1,0,0]=2 162 B9R1.1 O=CC1=CN=C(Br)C=C1 CS13736 [1,0,0,0,0,0|2,0,0]=3 163 B9R1.1 O=CC1=CN=C(Cl)C=C1 CS13978 [1,0,0,0,0,0|2,0,0]=3 164 B9R1.1 O=CC1=CN=C(Cl)N=C1 CS12216 [1,0,0,0,0,0|3,0,0]=4 165 B9R1.1 O=CC1=CN=C(F)C=C1 CS19261 [1,0,0,0,0,0|2,0,0]=3 166 B9R1.1 O=CC1=CN=C(O)C=C1 CS13494 [1,0,0,0,0,0|2,0,0]=3 167 B9R1.1 O=CC1=NC=C(Br)C=C1 CS14127 [1,0,0,0,0,0|2,0,0]=3 168 B9R1.1 O=CC1=NC=C(Br)C=N1 MC113781 [1,0,0,0,0,0|3,0,0]=4 169 B9R1.1 O=CC1=NC=C(Cl)C=C1 CS18956 [1,0,0,0,0,0|2,0,0]=3 170 B9R1.1 O=CC1=NC=C(Cl)C=N1 MC104699 [1,0,0,0,0,0|3,0,0]=4 171 B9R1.1 O=CC1=NC=C(F)C=C1 CS20057 [1,0,0,0,0,0|2,0,0]=3 172 B9R1.1 O=CC1=NC=C(F)C=N1 MC103702 [1,0,0,0,0,0|3,0,0]=4 173 B9R1.1 O=CC1=NC=C(O)C=C1 CS12167 [1,0,0,0,0,0|2,0,0]=3 174 B9R1.1 OCC1=CC=C(Br)C=C1 CS19378 [1,0,0,0,0,0|1,0,1]=3 175 B9R1.1 OCC1=CC=C(Cl)C=C1 CS19353 [1,0,0,0,0,0|1,0,1]=3 176 B9R1.1 OCC1=CC=C(F)C=C1 MC40711 [1,0,0,0,0,0|1,0,1]=3 177 B9R1.1 OCC1=CC=C(F)N=C1 MC429931 [1,0,0,0,0,0|2,0,1]=4 178 B9R1.1 OCC1=CC=C(O)C=C1 CS19212 [1,0,0,0,0,0|1,0,1]=3 179 B9R1.1 OCC1=CN=C(Cl)C=C1 MC20657 [1,0,0,0,0,0|2,0,1]=4 180 B9R1.1 OCC1=NC=C(Br)C=C1 CS23005 [1,0,0,0,0,0|2,0,1]=4 181 B9R1.1 OCC1=NC=C(Cl)C=C1 CS21758 [1,0,0,0,0,0|2,0,1]=4 182 B9R1.1 OCC1=NC=C(F)C=C1 CS10382 [1,0,0,0,0,0|2,0,1]=4 183 B9R1.8 BrCCC1=CC=CC=C1 MC40571 [1,0,0,0,0,0|1,0,1]=3 184 B9R1.8 Br[Zn]Cc1ccccc1 MC121333 [1,0,0,0,0,0|2,0,0]=3 185 B9R1.8 CCCC1=CC=CN=C1 CS22402 [1,0,0,0,0,0|2,0,1]=4 186 B9R1.8 CCNC1=CC=CC=C1 MC40913 [1,0,0,0,0,0|2,0,1]=4 187 B9R1.8 CNCC1=CC=CC=C1 MC10559 [1,0,0,0,0,0|2,0,0]=3 188 B9R1.8 CNCC1=CC=CC=C1 MC20323 [1,0,0,0,0,0|2,0,0]=3 189 B9R1.8 CNCC1=CC=CC=C1 MC21006 [1,0,0,0,0,0|2,0,0]=3 190 B9R1.8 CNCC1=CC=CN=C1 CS18846 [1,0,0,0,0,0|3,0,0]=4 191 B9R1.8 COCC1=NC=CC=C1 CS20909 [1,0,0,0,0,0|3,0,0]=4 192 B9R1.8 ClCCC1=CC=CC=C1 MC40609 [1,0,0,0,0,0|1,0,1]=3 193 B9R1.8 ClCCC1=CC=NC=C1 CS17913 [1,0,0,0,0,0|2,0,1]=4 194 B9R1.8 FCCC1=CC=CC=C1 MC41557 [1,0,0,0,0,0|1,0,1]=3 195 B9R1.8 N#CCC1=CC=CN=C1 CS18407 [1,0,0,0,0,0|2,0,1]=4 196 B9R1.8 N#CCC1=CC=NC=C1 CS20239 [1,0,0,0,0,0|2,0,1]=4 197 B9R1.8 N#CCC1=NC=CC=C1 CS18926 [1,0,0,0,0,0|2,0,1]=4 198 B9R1.8 NCCC1=CC=CC=C1 MC40983 [1,0,0,0,0,0|1,0,1]=3 199 B9R1.8 NCCC1=CC=CN=C1 CS21892 [1,0,0,0,0,0|2,0,1]=4 200 B9R1.8 NCCC1=NC=CC=C1 CS14064 [1,0,0,0,0,0|2,0,1]=4 201 B9R1.8 NNCC1=CC=CC=C1 CS11006 [1,0,0,0,0,0|2,0,0]=3 202 B9R1.8 NNCC1=CC=CC=C1 CS12127 [1,0,0,0,0,0|2,0,0]=3 203 B9R1.8 NNCC1=CC=CN=C1 MC111189 [1,0,0,0,0,0|3,0,0]=4 204 B9R1.8 NNCC1=CC=CN=C1 MC111240 [1,0,0,0,0,0|3,0,0]=4 205 B9R1.8 NNCC1=CC=NC=C1 MC111241 [1,0,0,0,0,0|3,0,0]=4 206 B9R1.8 NNCC1=NC=CC=C1 MC111239 [1,0,0,0,0,0|3,0,0]=4 207 B9R1.8 NOCC1=CC=CC=C1 CS14063 [1,0,0,0,0,0|2,0,0]=3 208 B9R1.8 O=C=NC1=CC=CC=C1 MC41051 [1,0,0,0,0,0|1,0,1]=3 209 B9R1.8 O=CCC1=CC=CN=C1 MC106360 [1,0,0,0,0,0|1,0,0]=2 210 B9R1.8 O=CCC1=CC=NC=C1 MC106357 [1,0,0,0,0,0|1,0,0]=2 211 B9R1.8 O=CCC1=NC=CC=N1 MC105911 [1,0,0,0,0,0|2,0,0]=3 212 B9R1.8 O=CNC1=CC=CC=C1 MC40924 [1,0,0,0,0,0|1,0,0]=2 213 B9R1.8 O=COC1=CC=CC=C1 MC40136 [1,0,0,0,0,0|1,0,0]=2 214 B9R1.8 OCCC1=CC=CC=C1 MC40745 [1,0,0,0,0,0|0,0,2]=3 215 B9R1.8 ONCC1=CC=CC=C1 CS11753 [1,0,0,0,0,0|1,0,1]=3 216 B11R1.1 CC1=CC=C(\C=C\C=O)C=C1 CS16393 [0,1,0,0,0,0|0,0,1]=2 217 B11R1.1 CCOCC1=CC=C(O)C=C1 CS16541 [0,1,0,0,0,0|2,0,1]=4 218 B11R1.1 CNCCC1=CC=C(N)C=C1 MC40974 [0,1,0,0,0,0|2,0,1]=4 219 B11R1.1 CNCCC1=CC=C(O)C=C1 MC426074 [0,1,0,0,0,0|2,0,1]=4 220 B11R1.1 COCCC1=CC=C(O)C=C1 MC445496 [0,1,0,0,0,0|1,0,2]=4 221 B11R1.1 ClC1=CC=C(OCCBr)C=C1 MC20815 [0,1,0,0,0,0|2,0,1]=4 222 B11R1.1 FC1=CC=C(CCCBr)C=C1 MC113691 [0,1,0,0,0,0|2,0,1]=4 223 B11R1.1 FC1=CC=C(OCCBr)C=C1 MC41373 [0,1,0,0,0,0|2,0,1]=4 224 B11R1.1 N#CCOC1=CC=C(Cl)C=C1 MC33118 [0,1,0,0,0,0|2,0,1]=4 225 B11R1.1 N#C\C=C\C1=CC=C(F)C=C1 MC107446 [0,1,0,0,0,0|2,0,1]=4 226 B11R1.1 NCCOC1=CC=C(F)C=C1 MC40921 [0,1,0,0,0,0|2,0,1]=4 227 B11R1.1 NCCOC1=CC=C(I)C=C1 MC112558 [0,1,0,0,0,0|2,0,1]=4 228 B11R1.1 O=C=NCC1=CC=C(F)C=C1 MC433986 [0,1,0,0,0,0|1,0,1]=3 229 B11R1.1 O=C\C=C\C1=CC=C(F)C=C1 CS14013 [0,1,0,0,0,0|1,0,1]=3 230 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 MC10315 [0,1,0,0,0,0|1,0,0]=2 231 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 CS22844 [0,1,0,0,0,0|1,0,0]=2 232 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 MC428013 [0,1,0,0,0,0|1,0,0]=2 233 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 MC33116 [0,1,0,0,0,0|2,0,0]=3 234 B11R1.20 CC(=O)NC1=NC=C(Br)C=C1 CS19283 [0,1,0,0,0,0|3,0,0]=4 235 B11R1.20 CC(=O)OC1=CC=C(Br)C=C1 MC40002 [0,1,0,0,0,0|2,0,0]=3 236 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 MC20138 [0,1,0,0,0,0|2,0,0]=3 237 B11R1.20 CC(=O)OC1=CC=C(I)C=C1 MC103137 [0,1,0,0,0,0|2,0,0]=3 238 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 MC433485 [0,1,0,0,0,0|2,0,1]=4 239 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 CS21084 [0,1,0,0,0,0|0,0,0]=1 240 B11R1.20 CC1=CC=C(CC(=O)O)C=N1 MC429948 [0,1,0,0,0,0|1,0,0]=2 241 B11R1.20 CC1=CC=C(OC(F)F)C=C1 MC41389 [0,1,0,0,0,0|2,0,1]=4 242 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 CS14692 [0,1,0,0,0,0|1,0,0]=2 243 B11R1.20 FC(F)=CC1=CC=C(Br)C=C1 MC442082 [0,1,0,0,0,0|2,0,1]=4 244 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 CS21002 [0,1,0,0,0,0|1,0,0]=2 245 B11R1.20 NC1=CN=C(CC(=O)O)N=C1 MC444153 [0,1,0,0,0,0|3,0,0]=4 246 B11R1.20 O=C(Cl)Oc1ccc(Br)cc1 MC434070 [0,1,0,0,0,0|2,0,0]=3 247 B11R1.20 O=C(Cl)Oc1ccc(F)cc1 MC434069 [0,1,0,0,0,0|2,0,0]=3 248 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 CS20812 [0,1,0,0,0,0|1,0,0]=2 249 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 MC40158 [0,1,0,0,0,0|1,0,0]=2 250 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 CS10817 [0,1,0,0,0,0|1,0,0]=2 251 B11R1.20 O=C(O)CC1=CC=C(F)N=C1 MC429488 [0,1,0,0,0,0|2,0,0]=3 252 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 CS20852 [0,1,0,0,0,0|1,0,0]=2 253 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 MC40180 [0,1,0,0,0,0|1,0,0]=2 254 B11R1.20 O=C(O)CC1=CC=C(S)C=C1 MC40184 [0,1,0,0,0,0|1,0,0]=2 255 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 CS13319 [0,1,0,0,0,0|2,0,0]=3 256 B11R1.20 O=C(O)CC1=NC=C(Br)C=N1 CS12143 [0,1,0,0,0,0|3,0,0]=4 257 B11R1.20 O=C(O)CC1=NC=C(Cl)C=C1 CS14073 [0,1,0,0,0,0|2,0,0]=3 258 B11R1.20 O=C(O)CC1=NC=C(F)C=N1 CS14652 [0,1,0,0,0,0|3,0,0]=4 259 B11R1.22 CC(C#N)C1=CC=C(Br)C=C1 MC427374 [0,1,0,0,0,0|2,0,1]=4 260 B11R1.22 CC(CN)C1=CC=C(Br)C=C1 MC103018 [0,1,0,0,0,0|2,0,1]=4 261 B11R1.22 CC(CN)C1=CC=C(Br)C=C1 MC427281 [0,1,0,0,0,0|2,0,1]=4 262 B11R1.22 CC(CN)C1=CC=C(O)C=C1 MC116255 [0,1,0,0,0,0|2,0,1]=4 263 B11R1.22 CC(NN)C1=CC=C(Cl)C=C1 MC110625 [0,1,0,0,0,0|3,0,0]=4 264 B11R1.22 CCC(C)C1=CC=C(Br)C=C1 CS18281 [0,1,0,0,0,0|2,0,1]=4 265 B11R1.22 COC(=O)C1=CC=C(C)C=C1 MC40114 [0,1,0,0,0,0|2,0,1]=4 266 B11R1.22 FC1=CC=C(C(Br)CBr)C=C1 MC430994 [0,1,0,0,0,0|2,0,1]=4 267 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 MC431262 [0,1,0,0,0,0|2,0,1]=4 268 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 CS15989 [0,1,0,0,0,0|1,0,1]=3 269 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 MC427408 [0,1,0,0,0,0|1,0,1]=3 270 B11R1.22 O=CC(=O)C1=CC=C(Cl)C=C1 CS20192 [0,1,0,0,0,0|1,0,1]=3 271 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 CS18120 [0,1,0,0,0,0|1,0,1]=3 272 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 MC442284 [0,1,0,0,0,0|1,0,2]=4 273 B11R1.81 CC1=C(CC#N)C=CC(F)=C1 MC40777 [0,1,0,0,0,0|2,0,1]=4 274 B11R1.81 CC1=C(N=C=O)C=CC(Br)=C1 MC41033 [0,1,0,0,0,0|2,0,1]=4 275 B11R1.81 CC1=CC(Br)=C(CC#N)C=C1 MC106321 [0,1,0,0,0,0|1,0,1]=3 276 B11R1.81 CC1=CC(C)=C(N=C=S)C=C1 MC41068 [0,1,0,0,0,0|1,1,1]=4 277 B11R1.81 CC1=CC(F)=C(CC#N)C=C1 MC431014 [0,1,0,0,0,0|1,0,1]=3 278 B11R1.81 N#CCC1=C(Br)C=C(Br)C=C1 MC433948 [0,1,0,0,0,0|2,0,1]=4 279 B11R1.81 N#CCC1=C(Br)C=C(Cl)C=C1 MC40754 [0,1,0,0,0,0|2,0,1]=4 280 B11R1.81 N#CCC1=C(Br)C=C(F)C=C1 CS13698 [0,1,0,0,0,0|2,0,1]=4 281 B11R1.81 N#CCC1=C(Cl)C=C(Br)C=C1 MC107514 [0,1,0,0,0,0|2,0,1]=4 282 B11R1.81 N#CCC1=C(Cl)C=C(Cl)C=C1 CS15393 [0,1,0,0,0,0|2,0,1]=4 283 B11R1.81 N#CCC1=C(Cl)C=C(F)C=C1 CS20640 [0,1,0,0,0,0|2,0,1]=4 284 B11R1.81 N#CCC1=C(F)C=C(Br)C=C1 CS22644 [0,1,0,0,0,0|2,0,1]=4 285 B11R1.81 N#CCC1=C(F)C=C(Cl)C=C1 MC40764 [0,1,0,0,0,0|2,0,1]=4 286 B11R1.81 N#CCC1=C(F)C=C(F)C=C1 CS10683 [0,1,0,0,0,0|2,0,1]=4 287 B11R1.81 NCCC1=C(F)C=C(F)C=C1 MC40977 [0,1,0,0,0,0|2,0,1]=4 288 B11R1.81 O=C=NC1=C(F)C=C(F)C=C1 MC41039 [0,1,0,0,0,0|2,0,1]=4 289 B11R1.81 OCCC1=C(Cl)C=C(Cl)C=C1 MC40739 [0,1,0,0,0,0|1,0,2]=4 290 B11R1.83 CCC1=CN=C(CCO)C=C1 CS10373 [0,1,0,0,0,0|1,0,2]=4 291 B11R1.83 CCCC1=CC=C(C=O)C=C1 MC41132 [0,1,0,0,0,0|1,0,2]=4 292 B11R1.83 CCCC1=CC=C(CN)C=C1 CS10109 [0,1,0,0,0,0|1,0,1]=3 293 B11R1.83 CCOC1=CC=C(CN)C=C1 MC40825 [0,1,0,0,0,0|2,0,1]=4 294 B11R1.83 CCOC1=CC=C(CO)C=C1 CS22820 [0,1,0,0,0,0|2,0,1]=4 295 B11R1.83 CNCC1=CC=C(OC)C=C1 CS18429 [0,1,0,0,0,0|2,0,0]=3 296 B11R1.83 COC1=CC=C(CC#N)C=C1 CS13459 [0,1,0,0,0,0|1,0,1]=3 297 B11R1.83 COC1=CC=C(CNN)C=C1 CS20199 [0,1,0,0,0,0|2,0,0]=3 298 B11R1.83 COC1=CC=C(CNO)C=C1 MC106878 [0,1,0,0,0,0|1,0,1]=3 299 B11R1.83 COC1=CC=C(CON)C=C1 CS20566 [0,1,0,0,0,0|2,0,0]=3 300 B11R1.83 COC1=CC=C(N=C=O)C=C1 MC41047 [0,1,0,0,0,0|1,0,1]=3 301 B11R1.83 COC1=CC=C(\C=N\O)C=C1 MC427343 [0,1,0,0,0,0|1,0,2]=4 302 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 CS10928 [0,1,0,0,0,0|1,0,1]=3 303 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 CS10929 [0,1,0,0,0,0|1,0,1]=3 304 B11R1.83 N#CC1=CC=C(CCBr)C=C1 CS12532 [0,1,0,0,0,0|1,0,2]=4 305 B11R1.83 N#CC1=CC=C(CCN)C=C1 CS22808 [0,1,0,0,0,0|1,0,2]=4 306 B11R1.83 N#CC1=CC=C(CCO)C=C1 CS22434 [0,1,0,0,0,0|0,0,3]=4 307 B11R1.83 O=CC1=CC=C(CCCl)C=C1 MC106352 [0,1,0,0,0,0|1,0,2]=4 308 B11R1.83 O=CC1=CC=C(CCO)C=C1 CS16581 [0,1,0,0,0,0|0,0,3]=4 309 B11R1.192 CC1=C(C)C=C(N=C=S)C=C1 MC20511 [0,1,0,0,0,0|1,1,1]=4 310 B11R1.192 CC1=C(Cl)C=C(N=C=O)C=C1 MC41036 [0,1,0,0,0,0|1,0,1]=3 311 B11R1.192 CC1=C(Cl)C=CC(N=C=O)=C1 MC41037 [0,1,0,0,0,0|2,0,1]=4 312 B11R1.192 CC1=C(F)C=C(CC#N)C=C1 MC40776 [0,1,0,0,0,0|1,0,1]=3 313 B11R1.192 CC1=C(F)C=C(N=C=S)C=C1 MC103216 [0,1,0,0,0,0|1,1,1]=4 314 B11R1.192 CC1=C(F)C=CC(CC#N)=C1 MC40778 [0,1,0,0,0,0|2,0,1]=4 315 B11R1.192 CNCC1=CC(Cl)=C(Cl)C=C1 CS11711 [0,1,0,0,0,0|3,0,0]=4 316 B11R1.192 COCC1=CC(F)=C(Br)C=C1 MC33058 [0,1,0,0,0,0|3,0,0]=4 317 B11R1.192 N#CCC1=CC(Br)=C(F)C=C1 MC433936 [0,1,0,0,0,0|2,0,1]=4 318 B11R1.192 N#CCC1=CC(Cl)=C(Cl)C=C1 CS20633 [0,1,0,0,0,0|2,0,1]=4 319 B11R1.192 N#CCC1=CC(Cl)=C(F)C=C1 CS18657 [0,1,0,0,0,0|2,0,1]=4 320 B11R1.192 N#CCC1=CC(F)=C(Br)C=C1 CS15044 [0,1,0,0,0,0|2,0,1]=4 321 B11R1.192 N#CCC1=CC(F)=C(Cl)C=C1 MC433126 [0,1,0,0,0,0|2,0,1]=4 322 B11R1.192 N#CCC1=CC(F)=C(F)C=C1 MC30096 [0,1,0,0,0,0|2,0,1]=4 323 B11R1.192 N#CCC1=CC(F)=C(I)C=C1 MC113672 [0,1,0,0,0,0|2,0,1]=4 324 B11R1.192 NCCC1=CC(Cl)=C(Cl)C=C1 CS21933 [0,1,0,0,0,0|2,0,1]=4 325 B11R1.192 NCCC1=CC=C(O)C(O)=C1 CS15345 [0,1,0,0,0,0|2,0,1]=4 326 B11R1.192 O=C=NC1=CC(Cl)=C(F)C=C1 MC41035 [0,1,0,0,0,0|2,0,1]=4 327 B11R1.192 O=C=NC1=CC(F)=C(F)C=C1 MC41040 [0,1,0,0,0,0|2,0,1]=4 328 B11R1.192 O=C=NC1=CC(F)=C(I)C=C1 MC41041 [0,1,0,0,0,0|2,0,1]=4 329 B11R1.192 O=CCC1=CC(Br)=C(F)C=C1 MC430543 [0,1,0,0,0,0|1,0,0]=2 330 B11R1.192 O=CCC1=CC(F)=C(Br)C=C1 MC430272 [0,1,0,0,0,0|1,0,0]=2 331 B11R1.192 OCCC1=CC(Cl)=C(Cl)C=C1 CS21932 [0,1,0,0,0,0|1,0,2]=4 332 B11R1.192 OCCC1=CC(F)=C(F)C=C1 MC33101 [0,1,0,0,0,0|1,0,2]=4 333 B11R2.34 BrC1=CC=C(C2CC2)C=C1 CS22811 [0,0,0,1,0,0|2,0,1]=4 334 B11R2.34 CC1=CC=C(C2CO2)C=C1 MC112355 [0,0,0,1,0,0|0,0,2]=3 335 B11R2.34 NC1=CC=C(C2CC2)C=C1 CS17100 [0,0,0,1,0,0|2,0,1]=4 336 B11R2.36 BrC1=CC2=C(C=C1)CCO2 MC441170 [0,0,0,1,0,0|1,0,2]=4 337 B11R2.36 BrC1=CC2=C(C=C1)N=CO2 CS14721 [0,0,0,1,0,0|2,0,1]=4 338 B11R2.36 BrC1=CC2=C(C=C1)N=CS2 CS10619 [0,0,0,1,0,0|2,1,0]=4 339 B11R2.36 BrC1=CC2=C(C=C1)NC=N2 CS10238 [0,0,0,1,0,0|3,0,0]=4 340 B11R2.36 BrC1=CC2=C(C=C1)OC=C2 MC41758 [0,0,0,1,0,0|3,0,0]=4 341 B11R2.36 BrC1=CC2=C(C=C1)OC=N2 MC425733 [0,0,0,1,0,0|3,0,0]=4 342 B11R2.36 BrC1=CC2=C(C=C1)SC=C2 CS10670 [0,0,0,1,0,0|3,0,0]=4 343 B11R2.36 BrC1=CC2=C(C=C1)SC=C2 MC20420 [0,0,0,1,0,0|3,0,0]=4 344 B11R2.36 BrC1=CC2=C(C=C1)SC=N2 CS10299 [0,0,0,1,0,0|3,0,0]=4 345 B11R2.36 BrC1=CC2=C(C=CO2)C=C1 MC115957 [0,0,0,1,0,0|1,0,2]=4 346 B11R2.36 BrC1=CC2=C(C=CS2)C=C1 CS12830 [0,0,0,1,0,0|1,1,1]=4 347 B11R2.36 BrC1=CC=C2C=CNC2=C1 CS22089 [0,0,0,1,0,0|2,0,1]=4 348 B11R2.36 BrC1=CC=C2CCCC2=C1 MC443408 [0,0,0,1,0,0|2,0,1]=4 349 B11R2.36 BrC1=CC=C2CCNC2=C1 CS17623 [0,0,0,1,0,0|2,0,1]=4 350 B11R2.36 BrC1=CC=C2CNCC2=C1 CS14408 [0,0,0,1,0,0|3,0,0]=4 351 B11R2.36 BrC1=CC=C2CNCC2=C1 MC20658 [0,0,0,1,0,0|3,0,0]=4 352 B11R2.36 BrC1=CC=C2NC=CC2=C1 CS17784 [0,0,0,1,0,0|3,0,0]=4 353 B11R2.36 CC1=CC2=C(C=C1)OC=C2 MC441161 [0,0,0,1,0,0|2,0,0]=3 354 B11R2.36 CC1=CC2=C(C=C1)OC=N2 MC425792 [0,0,0,1,0,0|2,0,0]=3 355 B11R2.36 CC1=CC2=C(C=CS2)C=C1 MC441147 [0,0,0,1,0,0|0,1,1]=3 356 B11R2.36 CC1=CC=C2C=CCC2=C1 MC446782 [0,0,0,1,0,0|1,0,1]=3 357 B11R2.36 CC1=CC=C2C=CNC2=N1 CS10731 [0,0,0,1,0,0|2,0,1]=4 358 B11R2.36 CC1=CC=C2CCNC2=C1 MC106356 [0,0,0,1,0,0|1,0,1]=3 359 B11R2.36 CC1=CC=C2CNCC2=C1 MC431420 [0,0,0,1,0,0|2,0,0]=3 360 B11R2.36 CC1=CC=C2NC=CC2=C1 CS11033 [0,0,0,1,0,0|2,0,0]=3 361 B11R2.36 CC1=CC=C2NC=NC2=N1 MC105767 [0,0,0,1,0,0|3,0,0]=4 362 B11R2.36 CC1=CC=C2NN=CC2=C1 MC425397 [0,0,0,1,0,0|3,0,0]=4 363 B11R2.36 CC1=CN=C2NC=CC2=C1 CS10438 [0,0,0,1,0,0|3,0,0]=4 364 B11R2.36 CC1=NC=C2C=CNC2=C1 MC105009 [0,0,0,1,0,0|2,0,1]=4 365 B11R2.36 ClC1=CC2=C(C=C1)N=CN2 MC443515 [0,0,0,1,0,0|3,0,0]=4 366 B11R2.36 ClC1=CC2=C(C=C1)N=CO2 MC31093 [0,0,0,1,0,0|2,0,1]=4 367 B11R2.36 ClC1=CC2=C(C=C1)OC=C2 MC441158 [0,0,0,1,0,0|3,0,0]=4 368 B11R2.36 ClC1=CC2=C(C=C1)OC=N2 CS19972 [0,0,0,1,0,0|3,0,0]=4 369 B11R2.36 ClC1=CC2=C(C=C1)SC=C2 CS20641 [0,0,0,1,0,0|3,0,0]=4 370 B11R2.36 ClC1=CC2=C(C=C1)SC=N2 CS10346 [0,0,0,1,0,0|3,0,0]=4 371 B11R2.36 ClC1=CC2=C(C=CO2)C=C1 MC441280 [0,0,0,1,0,0|1,0,2]=4 372 B11R2.36 ClC1=CC2=C(C=CS2)C=C1 MC441268 [0,0,0,1,0,0|1,1,1]=4 373 B11R2.36 ClC1=CC=C2C=CNC2=C1 CS22097 [0,0,0,1,0,0|2,0,1]=4 374 B11R2.36 ClC1=CC=C2CCCC2=C1 MC106098 [0,0,0,1,0,0|2,0,1]=4 375 B11R2.36 ClC1=CC=C2CCNC2=C1 CS19407 [0,0,0,1,0,0|2,0,1]=4 376 B11R2.36 ClC1=CC=C2CNCC2=C1 CS15340 [0,0,0,1,0,0|3,0,0]=4 377 B11R2.36 ClC1=CC=C2CNCC2=C1 MC441088 [0,0,0,1,0,0|3,0,0]=4 378 B11R2.36 ClC1=CC=C2NC=CC2=C1 CS22049 [0,0,0,1,0,0|3,0,0]=4 379 B11R2.36 FC1=CC2=C(C=C1)CCO2 MC432264 [0,0,0,1,0,0|1,0,2]=4 380 B11R2.36 FC1=CC2=C(C=C1)N=CS2 MC31026 [0,0,0,1,0,0|2,1,0]=4 381 B11R2.36 FC1=CC2=C(C=C1)OC=C2 MC441159 [0,0,0,1,0,0|3,0,0]=4 382 B11R2.36 FC1=CC2=C(C=CS2)C=C1 MC113470 [0,0,0,1,0,0|1,1,1]=4 383 B11R2.36 FC1=CC=C2C=CNC2=C1 MC31140 [0,0,0,1,0,0|2,0,1]=4 384 B11R2.36 FC1=CC=C2CC=CC2=C1 MC446777 [0,0,0,1,0,0|2,0,0]=3 385 B11R2.36 FC1=CC=C2CCCC2=C1 CS16751 [0,0,0,1,0,0|2,0,1]=4 386 B11R2.36 FC1=CC=C2CCNC2=C1 MC443334 [0,0,0,1,0,0|2,0,1]=4 387 B11R2.36 FC1=CC=C2CNCC2=C1 CS15207 [0,0,0,1,0,0|3,0,0]=4 388 B11R2.36 FC1=CC=C2NC=CC2=C1 CS22058 [0,0,0,1,0,0|3,0,0]=4 389 B11R2.36 IC1=CC=C2C=CNC2=C1 CS13433 [0,0,0,1,0,0|2,0,1]=4 390 B11R2.36 NC1=CC2=C(C=C1)N=CN2 MC41743 [0,0,0,1,0,0|3,0,0]=4 391 B11R2.36 NC1=CC2=C(C=C1)N=CO2 CS20506 [0,0,0,1,0,0|2,0,1]=4 392 B11R2.36 NC1=CC2=C(C=C1)N=CS2 CS14835 [0,0,0,1,0,0|2,1,0]=4 393 B11R2.36 NC1=CC2=C(C=C1)OC=N2 MC443773 [0,0,0,1,0,0|3,0,0]=4 394 B11R2.36 NC1=CC2=C(C=C1)SC=N2 MC33012 [0,0,0,1,0,0|3,0,0]=4 395 B11R2.36 NC1=CC2=C(C=CS2)C=C1 MC443212 [0,0,0,1,0,0|1,1,1]=4 396 B11R2.36 NC1=CC=C2CCNC2=C1 MC425589 [0,0,0,1,0,0|2,0,1]=4 397 B11R2.36 NC1=CC=C2CN=NC2=C1 MC107021 [0,0,0,1,0,0|3,0,0]=4 398 B11R2.36 NC1=CC=C2CNCC2=C1 MC20849 [0,0,0,1,0,0|3,0,0]=4 399 B11R2.36 NC1=CC=C2CNCC2=C1 MC442457 [0,0,0,1,0,0|3,0,0]=4 400 B11R2.36 NC1=CC=C2COCC2=C1 CS20519 [0,0,0,1,0,0|3,0,0]=4 401 B11R2.36 NC1=CC=C2NC=CC2=C1 CS20917 [0,0,0,1,0,0|3,0,0]=4 402 B11R2.36 OC1=CC2=C(C=C1)CCO2 CS16031 [0,0,0,1,0,0|1,0,2]=4 403 B11R2.36 OC1=CC2=C(C=C1)N=CS2 CS10613 [0,0,0,1,0,0|2,1,0]=4 404 B11R2.36 OC1=CC2=C(C=C1)OC=C2 MC443249 [0,0,0,1,0,0|3,0,0]=4 405 B11R2.36 OC1=CC2=C(C=C1)SC=C2 MC111398 [0,0,0,1,0,0|3,0,0]=4 406 B11R2.36 OC1=CC2=C(C=C1)SC=N2 MC427507 [0,0,0,1,0,0|3,0,0]=4 407 B11R2.36 OC1=CC2=C(C=CO2)C=C1 CS20605 [0,0,0,1,0,0|1,0,2]=4 408 B11R2.36 OC1=CC2=C(C=CS2)C=C1 MC441864 [0,0,0,1,0,0|1,1,1]=4 409 B11R2.36 OC1=CC=C2NC=CC2=C1 CS20861 [0,0,0,1,0,0|3,0,0]=4 410 B9R1.7 CC1=CC=C(N=C=O)O1 MC106103 [0,0,0,0,1,0|2,0,1]=4 411 B9R1.7 O=CCC1=NC=C(Br)S1 MC104142 [0,0,0,0,1,0|3,0,0]=4 412 B8R1.2 BrCC1=CC=NC=C1 CS22459 [2,0,0,0,0,0|2,0,0]=4 413 B8R1.2 BrCC1=CC=NC=C1 MC111773 [2,0,0,0,0,0|2,0,0]=4 414 B8R1.2 C#CC1=CC=CC=C1 CS19127 [2,0,0,0,0,0|0,0,2]=4 415 B8R1.2 CCC1=CC=CC=C1 MC41556 [2,0,0,0,0,0|0,0,1]=3 416 B8R1.2 CCC1=CC=CN=C1 CS22277 [2,0,0,0,0,0|1,0,1]=4 417 B8R1.2 CNC1=CC=CC=C1 CS11792 [2,0,0,0,0,0|1,0,1]=4 418 B8R1.2 COC1=CC=CC=C1 MC41309 [2,0,0,0,0,0|1,0,1]=4 419 B8R1.2 CSC1=CC=CC=C1 MC439137 [2,0,0,0,0,0|1,0,1]=4 420 B8R1.2 ClCC1=CC=CN=C1 CS19291 [2,0,0,0,0,0|2,0,0]=4 421 B8R1.2 ClCC1=NC=CC=C1 CS19289 [2,0,0,0,0,0|2,0,0]=4 422 B8R1.2 ICC1=CC=CC=C1 CS11000 [2,0,0,0,0,0|1,0,0]=3 423 B8R1.2 ICC1=CC=CN=C1 MC430640 [2,0,0,0,0,0|2,0,0]=4 424 B8R1.2 I[Zn]c1ccccc1 MC121332 [2,0,0,0,0,0|2,0,0]=4 425 B8R1.2 N#CC1=CC=CC=C1 MC40623 [2,0,0,0,0,0|1,0,1]=4 426 B8R1.2 N#Cc1ccccc1 CS13696 [2,0,0,0,0,0|1,0,1]=4 427 B8R1.2 NCC1=CC=CC=C1 MC40797 [2,0,0,0,0,0|1,0,0]=3 428 B8R1.2 NCC1=CC=CN=C1 CS14226 [2,0,0,0,0,0|2,0,0]=4 429 B8R1.2 NCC1=CC=NC=C1 CS11906 [2,0,0,0,0,0|2,0,0]=4 430 B8R1.2 NCC1=CC=NC=C1 CS19023 [2,0,0,0,0,0|2,0,0]=4 431 B8R1.2 NNC1=CC=CC=C1 CS15210 [2,0,0,0,0,0|2,0,0]=4 432 B8R1.2 NNC1=CC=CC=C1 MC427075 [2,0,0,0,0,0|2,0,0]=4 433 B8R1.2 O=CC1=CC=CN=N1 MC121079 [2,0,0,0,0,0|2,0,0]=4 434 B8R1.2 O=CC1=CN=CC=C1 CS19090 [2,0,0,0,0,0|1,0,0]=3 435 B8R1.2 O=CC1=CN=CN=C1 CS19643 [2,0,0,0,0,0|2,0,0]=4 436 B8R1.2 O=CC1=CN=NC=C1 MC444362 [2,0,0,0,0,0|2,0,0]=4 437 B8R1.2 O=CC1=NC=CC=C1 CS18610 [2,0,0,0,0,0|1,0,0]=3 438 B8R1.2 O=CC1=NC=CC=N1 MC444571 [2,0,0,0,0,0|2,0,0]=4 439 B8R1.2 O=CC1=NC=CN=C1 CS18375 [2,0,0,0,0,0|2,0,0]=4 440 B8R1.2 O=NC1=CC=CC=C1 MC33163 [2,0,0,0,0,0|1,0,0]=3 441 B8R1.2 OCC1=CC=CC=C1 MC40684 [2,0,0,0,0,0|0,0,1]=3 442 B8R1.2 OCC1=CC=CN=C1 CS22409 [2,0,0,0,0,0|1,0,1]=4 443 B8R1.2 OCC1=CC=NC=C1 CS19163 [2,0,0,0,0,0|1,0,1]=4 444 B8R1.2 OCC1=NC=CC=C1 CS19164 [2,0,0,0,0,0|1,0,1]=4 445 B8R1.3 BrC1=CC=C(Br)C=C1 MC41477 [2,0,0,0,0,0|2,0,0]=4 446 B8R1.3 BrC1=CC=C(I)C=C1 CS22911 [2,0,0,0,0,0|2,0,0]=4 447 B8R1.3 CC1=CC=C(Br)C=C1 MC20922 [2,0,0,0,0,0|1,0,0]=3 448 B8R1.3 CC1=CC=C(C)C=C1 MC41551 [2,0,0,0,0,0|0,0,0]=2 449 B8R1.3 CC1=CC=C(F)C=C1 MC41520 [2,0,0,0,0,0|1,0,0]=3 450 B8R1.3 CC1=CC=C(I)C=C1 MC445763 [2,0,0,0,0,0|1,0,0]=3 451 B8R1.3 CC1=CC=C(N)C=C1 CS11898 [2,0,0,0,0,0|1,0,0]=3 452 B8R1.3 CC1=CC=C(N)C=N1 CS19519 [2,0,0,0,0,0|2,0,0]=4 453 B8R1.3 CC1=CC=C(O)C=C1 MC41204 [2,0,0,0,0,0|0,0,1]=3 454 B8R1.3 CC1=CC=C(O)C=N1 CS19501 [2,0,0,0,0,0|1,0,1]=4 455 B8R1.3 CC1=CC=C([S-])C=C1 MC112796 [2,0,0,0,0,0|0,1,0]=3 456 B8R1.3 CC1=CN=C(Br)C=C1 CS21837 [2,0,0,0,0,0|2,0,0]=4 457 B8R1.3 CC1=CN=C(C)C=C1 CS21154 [2,0,0,0,0,0|1,0,0]=3 458 B8R1.3 CC1=CN=C(Cl)C=C1 CS19287 [2,0,0,0,0,0|2,0,0]=4 459 B8R1.3 CC1=CN=C(F)C=C1 CS21872 [2,0,0,0,0,0|2,0,0]=4 460 B8R1.3 CC1=CN=C(N)C=C1 CS21820 [2,0,0,0,0,0|2,0,0]=4 461 B8R1.3 CC1=CN=C(O)C=C1 CS16275 [2,0,0,0,0,0|1,0,1]=4 462 B8R1.3 CC1=CNC(=O)C=C1 CS21591 [2,0,0,0,0,0|1,0,0]=3 463 B8R1.3 CC1=NC=C(Br)C=C1 CS22031 [2,0,0,0,0,0|2,0,0]=4 464 B8R1.3 CC1=NC=C(F)C=C1 MC433052 [2,0,0,0,0,0|2,0,0]=4 465 B8R1.3 CC1=NC=C(I)C=C1 MC20376 [2,0,0,0,0,0|2,0,0]=4 466 B8R1.3 CC1=NNC(=O)C=C1 CS19836 [2,0,0,0,0,0|2,0,0]=4 467 B8R1.3 ClC1=CC=C(Br)C=C1 CS22677 [2,0,0,0,0,0|2,0,0]=4 468 B8R1.3 ClC1=CC=C(I)C=C1 CS19235 [2,0,0,0,0,0|2,0,0]=4 469 B8R1.3 FC1=CC=C(Br)C=C1 MC20092 [2,0,0,0,0,0|2,0,0]=4 470 B8R1.3 FC1=CC=C(Cl)C=C1 CS20666 [2,0,0,0,0,0|2,0,0]=4 471 B8R1.3 FC1=CC=C(F)C=C1 MC41485 [2,0,0,0,0,0|2,0,0]=4 472 B8R1.3 FC1=CC=C(I)C=C1 CS22840 [2,0,0,0,0,0|2,0,0]=4 473 B8R1.3 FC1=CC=C(S)C=C1 MC20299 [2,0,0,0,0,0|1,1,0]=4 474 B8R1.3 IC1=CC=C(I)C=C1 CS19213 [2,0,0,0,0,0|2,0,0]=4 475 B8R1.3 NC1=CC=C(Br)C=C1 MC40858 [2,0,0,0,0,0|2,0,0]=4 476 B8R1.3 NC1=CC=C(Br)C=C1 MC40859 [2,0,0,0,0,0|2,0,0]=4 477 B8R1.3 NC1=CC=C(Cl)C=C1 CS18588 [2,0,0,0,0,0|2,0,0]=4 478 B8R1.3 NC1=CC=C(F)C=C1 CS19763 [2,0,0,0,0,0|2,0,0]=4 479 B8R1.3 NC1=CC=C(N)C=C1 CS18589 [2,0,0,0,0,0|2,0,0]=4 480 B8R1.3 NC1=CC=C(O)C=C1 MC41146 [2,0,0,0,0,0|1,0,1]=4 481 B8R1.3 NC1=CC=C(S)C=C1 MC20109 [2,0,0,0,0,0|1,1,0]=4 482 B8R1.3 NC1=CNC(=O)C=C1 CS15177 [2,0,0,0,0,0|2,0,0]=4 483 B8R1.3 O=C1C=CC(=O)C=C1 CS20528 [2,0,0,0,0,0|1,0,0]=3 484 B8R1.3 O=C1C=CC(O)=CN1 CS15928 [2,0,0,0,0,0|2,0,0]=4 485 B8R1.3 OC1=CC=C(Br)C=C1 MC41163 [2,0,0,0,0,0|1,0,1]=4 486 B8R1.3 OC1=CC=C(Cl)C=C1 CS22792 [2,0,0,0,0,0|1,0,1]=4 487 B8R1.3 OC1=CC=C(F)C=C1 MC41198 [2,0,0,0,0,0|1,0,1]=4 488 B8R1.3 OC1=CC=C(I)C=C1 MC20152 [2,0,0,0,0,0|1,0,1]=4 489 B8R1.3 OC1=CC=C(O)C=C1 MC41215 [2,0,0,0,0,0|1,0,1]=4 490 B8R1.3 SC1=CC=C(Br)C=C1 MC20198 [2,0,0,0,0,0|1,1,0]=4 491 B10R1.3 BrCC1=CC=C(CBr)C=C1 MC40512 [1,1,0,0,0,0|1,0,0]=3 492 B10R1.3 C#CC1=CC=C(C=O)C=C1 CS21472 [1,1,0,0,0,0|0,0,1]=3 493 B10R1.3 C#CC1=CC=C(CC)C=C1 CS11051 [1,1,0,0,0,0|0,0,2]=4 494 B10R1.3 C#CC1=CC=C(OC)C=C1 CS21617 [1,1,0,0,0,0|0,0,2]=4 495 B10R1.3 C=CC1=NC=C(CC)C=C1 MC111111 [1,1,0,0,0,0|1,0,1]=4 496 B10R1.3 CCC1=CC=C(CCl)C=C1 MC40596 [1,1,0,0,0,0|0,0,1]=3 497 B10R1.3 CCC1=CC=C(NN)C=C1 CS16126 [1,1,0,0,0,0|1,0,1]=4 498 B10R1.3 COC1=CC=C(C#N)C=C1 CS19381 [1,1,0,0,0,0|1,0,1]=4 499 B10R1.3 COC1=CC=C(C=O)C=C1 CS18687 [1,1,0,0,0,0|0,0,0]=2 500 B10R1.3 COC1=CC=C(CCl)C=C1 MC20866 [1,1,0,0,0,0|1,0,0]=3 501 B10R1.3 COC1=CC=C(CN)C=C1 CS18898 [1,1,0,0,0,0|1,0,0]=3 502 B10R1.3 COC1=CC=C(CN)C=N1 MC103395 [1,1,0,0,0,0|2,0,0]=4 503 B10R1.3 COC1=CC=C(CO)C=C1 CS22932 [1,1,0,0,0,0|0,0,1]=3 504 B10R1.3 COC1=CC=C(CO)C=N1 CS15243 [1,1,0,0,0,0|1,0,1]=4 505 B10R1.3 COC1=CC=C(NN)C=C1 CS19581 [1,1,0,0,0,0|2,0,0]=4 506 B10R1.3 COC1=CC=C(OC)C=C1 MC41357 [1,1,0,0,0,0|1,0,1]=4 507 B10R1.3 COC1=CN=C(C=O)C=C1 CS10425 [1,1,0,0,0,0|1,0,0]=3 508 B10R1.3 COC1=CN=C(C=O)N=C1 MC103831 [1,1,0,0,0,0|2,0,0]=4 509 B10R1.3 COC1=CN=C(CBr)C=C1 CS18482 [1,1,0,0,0,0|2,0,0]=4 510 B10R1.3 COC1=CN=C(CCl)C=C1 CS12684 [1,1,0,0,0,0|2,0,0]=4 511 B10R1.3 COC1=CN=C(CCl)C=C1 MC105068 [1,1,0,0,0,0|2,0,0]=4 512 B10R1.3 COC1=CN=C(CN)C=C1 MC431302 [1,1,0,0,0,0|2,0,0]=4 513 B10R1.3 COC1=CN=C(CO)C=C1 MC443535 [1,1,0,0,0,0|1,0,1]=4 514 B10R1.3 COC1=NC=C(C=O)C=C1 CS20322 [1,1,0,0,0,0|1,0,0]=3 515 B10R1.3 COC1=NC=C(C=O)C=N1 CS16257 [1,1,0,0,0,0|2,0,0]=4 516 B10R1.3 COC1=NC=C(CBr)C=C1 CS17111 [1,1,0,0,0,0|2,0,0]=4 517 B10R1.3 COC1=NC=C(CCl)C=C1 CS16575 [1,1,0,0,0,0|2,0,0]=4 518 B10R1.3 CSC1=CC=C(CN)C=C1 MC433900 [1,1,0,0,0,0|1,0,0]=3 519 B10R1.3 CSC1=NC=C(C=O)C=N1 MC443841 [1,1,0,0,0,0|2,0,0]=4 520 B10R1.3 N#CC1=CC=C(C=O)C=C1 CS13468 [1,1,0,0,0,0|0,0,1]=3 521 B10R1.3 N#CC1=CC=C(CBr)C=C1 CS18792 [1,1,0,0,0,0|1,0,1]=4 522 B10R1.3 N#CC1=CC=C(CCl)C=C1 CS17835 [1,1,0,0,0,0|1,0,1]=4 523 B10R1.3 N#CC1=CC=C(CN)C=C1 CS19851 [1,1,0,0,0,0|1,0,1]=4 524 B10R1.3 N#CC1=CC=C(CN)C=C1 MC40812 [1,1,0,0,0,0|1,0,1]=4 525 B10R1.3 N#CC1=CN=C(C=O)C=C1 CS12973 [1,1,0,0,0,0|1,0,1]=4 526 B10R1.3 N#CC1=NC=C(C=O)C=C1 CS13188 [1,1,0,0,0,0|1,0,1]=4 527 B10R1.3 NCC1=CC=C(CO)C=C1 CS18290 [1,1,0,0,0,0|0,0,1]=3 528 B10R1.3 O=CC1=CC=C(C=O)C=C1 CS11974 [1,1,0,0,0,0|0,0,1]=3 529 B10R1.3 O=CC1=CC=C(CBr)C=C1 MC41097 [1,1,0,0,0,0|0,0,0]=2 530 B10R1.3 O=CC1=CC=C(CO)C=C1 CS15415 [1,1,0,0,0,0|0,0,0]=2 531 B10R1.3 O=NC1=CC=C(N=O)C=C1 MC21148 [1,1,0,0,0,0|2,0,0]=4 532 B10R1.3 OCC1=CC=C(CBr)C=C1 CS20041 [1,1,0,0,0,0|0,0,1]=3 533 B10R1.3 OCC1=CC=C(CO)C=C1 CS20456 [1,1,0,0,0,0|0,0,1]=3 534 B10R1.13 C=C(C)C1=CC=C(O)C=C1 MC441020 [1,1,0,0,0,0|1,0,1]=4 535 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 CS19447 [1,1,0,0,0,0|1,0,0]=3 536 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 CS17999 [1,1,0,0,0,0|2,0,0]=4 537 B10R1.13 CC(=O)C1=CC=C(C)C=C1 CS13558 [1,1,0,0,0,0|0,0,0]=2 538 B10R1.13 CC(=O)C1=CC=C(C)N=N1 MC112296 [1,1,0,0,0,0|2,0,0]=4 539 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 CS20014 [1,1,0,0,0,0|1,0,0]=3 540 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 CS19687 [1,1,0,0,0,0|2,0,0]=4 541 B10R1.13 CC(=O)C1=CC=C(F)C=C1 CS14299 [1,1,0,0,0,0|1,0,0]=3 542 B10R1.13 CC(=O)C1=CC=C(F)N=C1 CS16982 [1,1,0,0,0,0|2,0,0]=4 543 B10R1.13 CC(=O)C1=CC=C(N)C=C1 MC20162 [1,1,0,0,0,0|1,0,0]=3 544 B10R1.13 CC(=O)C1=CC=C(O)C=C1 CS22884 [1,1,0,0,0,0|1,0,0]=3 545 B10R1.13 CC(=O)C1=CC=C(O)N=C1 CS12692 [1,1,0,0,0,0|2,0,0]=4 546 B10R1.13 CC(=O)C1=CN=C(C)C=C1 MC428167 [1,1,0,0,0,0|1,0,0]=3 547 B10R1.13 CC(=O)C1=CN=C(C)N=C1 MC444074 [1,1,0,0,0,0|2,0,0]=4 548 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 CS16977 [1,1,0,0,0,0|2,0,0]=4 549 B10R1.13 CC(=O)C1=NC=C(C)C=C1 MC443649 [1,1,0,0,0,0|1,0,0]=3 550 B10R1.13 CC(=O)C1=NC=C(C)N=C1 MC444078 [1,1,0,0,0,0|2,0,0]=4 551 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 CS16979 [1,1,0,0,0,0|2,0,0]=4 552 B10R1.13 CC(=O)C1=NC=C(F)C=C1 MC106404 [1,1,0,0,0,0|2,0,0]=4 553 B10R1.13 CC(=O)C1=NC=C(N)C=C1 MC442802 [1,1,0,0,0,0|2,0,0]=4 554 B10R1.13 CC(=O)c1ccc(I)cc1 MC433245 [1,1,0,0,0,0|1,0,0]=3 555 B10R1.13 CC(Br)C1=CC=C(F)C=C1 CS16140 [1,1,0,0,0,0|1,0,1]=4 556 B10R1.13 CC(C)C1=CC=C(Br)C=C1 CS19162 [1,1,0,0,0,0|1,0,1]=4 557 B10R1.13 CC(C)C1=CC=C(N)C=C1 CS22915 [1,1,0,0,0,0|1,0,1]=4 558 B10R1.13 CC(N)C1=CC=C(Br)C=C1 CS10540 [1,1,0,0,0,0|1,0,1]=4 559 B10R1.13 CC(N)C1=CC=C(Br)C=C1 CS20256 [1,1,0,0,0,0|1,0,1]=4 560 B10R1.13 CC(N)C1=CC=C(F)C=C1 CS19253 [1,1,0,0,0,0|1,0,1]=4 561 B10R1.13 CC(N)C1=CC=C(F)C=C1 MC40832 [1,1,0,0,0,0|1,0,1]=4 562 B10R1.13 CC(N)C1=CC=C(F)C=C1 MC429424 [1,1,0,0,0,0|1,0,1]=4 563 B10R1.13 CC(N)C1=CC=C(I)C=C1 MC113505 [1,1,0,0,0,0|1,0,1]=4 564 B10R1.13 CC(N)C1=CC=C(N)C=C1 CS22422 [1,1,0,0,0,0|1,0,1]=4 565 B10R1.13 CC(N)c1ccc(Cl)cc1 MC433903 [1,1,0,0,0,0|1,0,1]=4 566 B10R1.13 CC(O)C1=CC=C(F)C=C1 MC33129 [1,1,0,0,0,0|1,0,1]=4 567 B10R1.13 CC(O)C1=CC=C(N)C=C1 MC40728 [1,1,0,0,0,0|1,0,1]=4 568 B10R1.13 CC1=CC=C(B(O)O)C=C1 CS10128 [1,1,0,0,0,0|1,0,1]=4 569 B10R1.13 CC1=CC=C(C(=N)N)C=C1 CS20439 [1,1,0,0,0,0|1,0,0]=3 570 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 MC40494 [1,1,0,0,0,0|0,0,0]=2 571 B10R1.13 CC1=CC=C(C(=O)O)C=C1 MC40304 [1,1,0,0,0,0|0,0,0]=2 572 B10R1.13 CC1=CC=C(C(N)=O)C=C1 CS11895 [1,1,0,0,0,0|0,0,0]=2 573 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 CS11896 [1,1,0,0,0,0|1,0,0]=3 574 B10R1.13 CC1=CC=C(S(N)=O)C=C1 CS18822 [1,1,0,0,0,0|1,0,0]=3 575 B10R1.13 CC1=CN=C(C(=O)O)C=C1 CS10458 [1,1,0,0,0,0|1,0,0]=3 576 B10R1.13 CC1=CN=C(C(=O)O)C=C1 CS17310 [1,1,0,0,0,0|1,0,0]=3 577 B10R1.13 CC1=CN=C(C(=O)O)C=N1 CS19370 [1,1,0,0,0,0|2,0,0]=4 578 B10R1.13 CC1=CN=C(C(=O)O)N=C1 CS21764 [1,1,0,0,0,0|2,0,0]=4 579 B10R1.13 CC1=CN=C([N+](=O)[O-])C=C1 CS21713 [1,1,0,0,0,0|2,0,0]=4 580 B10R1.13 CC1=NC=C(C(=O)O)C=C1 CS20324 [1,1,0,0,0,0|1,0,0]=3 581 B10R1.13 CC1=NC=C(C(=O)O)C=N1 CS21698 [1,1,0,0,0,0|2,0,0]=4 582 B10R1.13 CC1=NC=C(C(N)=O)C=C1 CS18427 [1,1,0,0,0,0|1,0,0]=3 583 B10R1.13 CC1=NC=C([N+](=O)[O-])C=C1 CS19359 [1,1,0,0,0,0|2,0,0]=4 584 B10R1.13 Cc1ccc(C(C)C)cc1 MC444976 [1,1,0,0,0,0|0,0,1]=3 585 B10R1.13 FC(F)C1=CC=C(Br)C=C1 MC33151 [1,1,0,0,0,0|2,0,0]=4 586 B10R1.13 FC1=CC=C(C(Cl)Cl)C=C1 MC33143 [1,1,0,0,0,0|2,0,0]=4 587 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 MC21022 [1,1,0,0,0,0|2,0,0]=4 588 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 CS20283 [1,1,0,0,0,0|2,0,0]=4 589 B10R1.13 N=C(N)C1=CC=C(F)C=C1 CS18318 [1,1,0,0,0,0|2,0,0]=4 590 B10R1.13 N=C(N)C1=CC=C(N)C=C1 CS21974 [1,1,0,0,0,0|2,0,0]=4 591 B10R1.13 NC(=O)C1=CC=C(F)C=C1 CS10426 [1,1,0,0,0,0|1,0,0]=3 592 B10R1.13 NC(=O)C1=CN=C(N)C=C1 MC425266 [1,1,0,0,0,0|2,0,0]=4 593 B10R1.13 NC(=O)C1=CNC(=O)C=C1 MC427340 [1,1,0,0,0,0|2,0,0]=4 594 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 MC41603 [1,1,0,0,0,0|2,0,0]=4 595 B10R1.13 NC(=O)C1=NC=C(Cl)C=C1 MC33351 [1,1,0,0,0,0|2,0,0]=4 596 B10R1.13 NC(=O)C1=NC=C(F)C=C1 CS16336 [1,1,0,0,0,0|2,0,0]=4 597 B10R1.13 NC(=O)C1=NC=C(N)C=C1 CS10223 [1,1,0,0,0,0|2,0,0]=4 598 B10R1.13 NC(=S)C1=CC=C(O)C=C1 CS20343 [1,1,0,0,0,0|1,1,0]=4 599 B10R1.13 NC1=CC=C(C(=O)O)C=C1 MC40224 [1,1,0,0,0,0|1,0,0]=3 600 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 CS22580 [1,1,0,0,0,0|1,0,0]=3 601 B10R1.13 NC1=CC=C(C(F)F)C=C1 CS17592 [1,1,0,0,0,0|2,0,0]=4 602 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 MC40934 [1,1,0,0,0,0|2,0,0]=4 603 B10R1.13 NC1=CN=C(C(=O)O)C=C1 CS19367 [1,1,0,0,0,0|2,0,0]=4 604 B10R1.13 NC1=NC=C(C(=O)O)C=C1 CS19354 [1,1,0,0,0,0|2,0,0]=4 605 B10R1.13 O=C(Cl)C1=CC=C(Br)C=C1 MC40440 [1,1,0,0,0,0|1,0,0]=3 606 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 MC40474 [1,1,0,0,0,0|1,0,0]=3 607 B10R1.13 O=C(Cl)C1=CC=C(I)C=C1 MC433701 [1,1,0,0,0,0|1,0,0]=3 608 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 CS20082 [1,1,0,0,0,0|1,0,0]=3 609 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 CS15821 [1,1,0,0,0,0|1,0,0]=3 610 B10R1.13 O=C(O)C1=CC=C(F)C=C1 MC40280 [1,1,0,0,0,0|1,0,0]=3 611 B10R1.13 O=C(O)C1=CC=C(I)C=C1 CS20135 [1,1,0,0,0,0|1,0,0]=3 612 B10R1.13 O=C(O)C1=CC=C(O)C=C1 CS22885 [1,1,0,0,0,0|1,0,0]=3 613 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 CS22092 [1,1,0,0,0,0|2,0,0]=4 614 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 CS22101 [1,1,0,0,0,0|2,0,0]=4 615 B10R1.13 O=C(O)C1=CN=C(F)C=C1 CS18891 [1,1,0,0,0,0|2,0,0]=4 616 B10R1.13 O=C(O)C1=CN=C(O)C=C1 CS19189 [1,1,0,0,0,0|2,0,0]=4 617 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 CS22033 [1,1,0,0,0,0|2,0,0]=4 618 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 CS19376 [1,1,0,0,0,0|2,0,0]=4 619 B10R1.13 O=C(O)C1=NC=C(F)C=C1 CS10387 [1,1,0,0,0,0|2,0,0]=4 620 B10R1.13 O=C(O)C1=NC=C(I)C=C1 CS10412 [1,1,0,0,0,0|2,0,0]=4 621 B10R1.13 O=C(O)C1=NC=C(O)C=C1 CS22997 [1,1,0,0,0,0|2,0,0]=4 622 B10R1.13 O=C([O-])C1=CC=C(Br)C=C1 MC40334 [1,1,0,0,0,0|1,0,0]=3 623 B10R1.13 O=C([O-])C1=CC=C(Cl)C=C1 MC40337 [1,1,0,0,0,0|1,0,0]=3 624 B10R1.13 O=C([O-])C1=CC=C(F)C=C1 MC40351 [1,1,0,0,0,0|1,0,0]=3 625 B10R1.13 O=[N+]([O-])C1=CC=C(Br)C=C1 CS18786 [1,1,0,0,0,0|2,0,0]=4 626 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 CS22843 [1,1,0,0,0,0|2,0,0]=4 627 B10R1.13 O=[N+]([O-])C1=CC=C(I)C=C1 CS19234 [1,1,0,0,0,0|2,0,0]=4 628 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 MC41207 [1,1,0,0,0,0|2,0,0]=4 629 B10R1.13 O=[N+]([O-])c1ccc(Cl)cc1 MC41577 [1,1,0,0,0,0|2,0,0]=4 630 B10R1.13 OC1=CC=C(C(F)F)C=C1 CS15692 [1,1,0,0,0,0|2,0,0]=4 631 B10R1.25 CC1=C(C=O)C=CC(Br)=C1 CS22653 [1,1,0,0,0,0|1,0,0]=3 632 B10R1.25 CC1=C(C=O)C=CC(Br)=N1 MC443390 [1,1,0,0,0,0|2,0,0]=4 633 B10R1.25 CC1=C(C=O)C=CC(Cl)=C1 CS20823 [1,1,0,0,0,0|1,0,0]=3 634 B10R1.25 CC1=C(C=O)C=CC(F)=C1 CS10809 [1,1,0,0,0,0|1,0,0]=3 635 B10R1.25 CC1=C(C=O)C=CC(N)=N1 MC430302 [1,1,0,0,0,0|2,0,0]=4 636 B10R1.25 CC1=C(C=O)C=CC(O)=C1 CS20933 [1,1,0,0,0,0|1,0,0]=3 637 B10R1.25 CC1=C(CCl)C=CC(Br)=C1 MC107510 [1,1,0,0,0,0|2,0,0]=4 638 B10R1.25 CC1=C(CN)C=CC(Br)=C1 MC20891 [1,1,0,0,0,0|2,0,0]=4 639 B10R1.25 CC1=C(CN)C=CC(F)=C1 MC40830 [1,1,0,0,0,0|2,0,0]=4 640 B10R1.25 CC1=C(CN)C=CC(O)=C1 MC442240 [1,1,0,0,0,0|2,0,0]=4 641 B10R1.25 CC1=C(CO)C=CC(Br)=C1 MC433849 [1,1,0,0,0,0|1,0,1]=4 642 B10R1.25 CC1=CC(Br)=C(C#N)C=C1 CS21363 [1,1,0,0,0,0|1,0,1]=4 643 B10R1.25 CC1=CC(Br)=C(C=O)C=C1 CS20803 [1,1,0,0,0,0|0,0,0]=2 644 B10R1.25 CC1=CC(Br)=C(CN)C=C1 MC112223 [1,1,0,0,0,0|1,0,0]=3 645 B10R1.25 CC1=CC(Br)=CN=C1C=O MC428377 [1,1,0,0,0,0|2,0,0]=4 646 B10R1.25 CC1=CC(C)=C(C#N)C=C1 MC40652 [1,1,0,0,0,0|1,0,1]=4 647 B10R1.25 CC1=CC(C)=C(C=O)C=C1 CS21114 [1,1,0,0,0,0|0,0,0]=2 648 B10R1.25 CC1=CC(C)=C(CBr)C=C1 CS21116 [1,1,0,0,0,0|1,0,0]=3 649 B10R1.25 CC1=CC(C)=C(CCl)C=C1 MC40593 [1,1,0,0,0,0|1,0,0]=3 650 B10R1.25 CC1=CC(C)=C(NN)C=C1 CS20500 [1,1,0,0,0,0|2,0,0]=4 651 B10R1.25 CC1=CC(Cl)=C(C#N)C=C1 CS21450 [1,1,0,0,0,0|1,0,1]=4 652 B10R1.25 CC1=CC(Cl)=C(C=O)C=C1 CS21448 [1,1,0,0,0,0|0,0,0]=2 653 B10R1.25 CC1=CC(Cl)=C(NN)C=C1 CS20405 [1,1,0,0,0,0|2,0,0]=4 654 B10R1.25 CC1=CC(Cl)=C(NN)C=C1 MC433989 [1,1,0,0,0,0|2,0,0]=4 655 B10R1.25 CC1=CC(F)=C(C#N)C=C1 CS10736 [1,1,0,0,0,0|1,0,1]=4 656 B10R1.25 CC1=CC(F)=C(C=O)C=C1 MC41116 [1,1,0,0,0,0|0,0,0]=2 657 B10R1.25 CC1=CC(N)=C(C#N)C=C1 CS20911 [1,1,0,0,0,0|1,0,1]=4 658 B10R1.25 CC1=CC(N)=C(CO)C=C1 CS21019 [1,1,0,0,0,0|0,0,1]=3 659 B10R1.25 CC1=CC(O)=C(C#N)C=C1 CS21585 [1,1,0,0,0,0|1,0,1]=4 660 B10R1.25 CC1=CC(O)=C(C=O)C=C1 MC33188 [1,1,0,0,0,0|0,0,0]=2 661 B10R1.25 CC1=CC=C(C=O)C(Br)=N1 MC111591 [1,1,0,0,0,0|1,0,0]=3 662 B10R1.25 CC1=CC=C(CO)C(N)=N1 MC432551 [1,1,0,0,0,0|1,0,1]=4 663 B10R1.25 CC1=CN=C(CBr)C(C)=C1 CS18481 [1,1,0,0,0,0|2,0,0]=4 664 B10R1.25 CC1=CN=C(CCl)C(C)=C1 CS16524 [1,1,0,0,0,0|2,0,0]=4 665 B10R1.25 CC1=CN=C(CN)C(C)=C1 MC116261 [1,1,0,0,0,0|2,0,0]=4 666 B10R1.25 CC1=CN=C(CO)C(C)=C1 CS16432 [1,1,0,0,0,0|1,0,1]=4 667 B10R1.25 CCC1=C(Br)C=C(N)C=C1 MC33284 [1,1,0,0,0,0|1,0,1]=4 668 B10R1.25 CCC1=C(Cl)C=C(N)C=C1 MC442501 [1,1,0,0,0,0|1,0,1]=4 669 B10R1.25 CCC1=C(N)C=C(F)C=C1 MC40914 [1,1,0,0,0,0|1,0,1]=4 670 B10R1.25 COC1=C(Cl)C=C(C)C=C1 MC442301 [1,1,0,0,0,0|1,0,1]=4 671 B10R1.25 COC1=C(N)C=C(C)C=C1 CS13548 [1,1,0,0,0,0|1,0,1]=4 672 B10R1.25 COC1=C(O)C=C(C)C=C1 MC442401 [1,1,0,0,0,0|1,0,1]=4 673 B10R1.25 Cc1cc(N)c(CCl)cn1 MC102821 [1,1,0,0,0,0|2,0,0]=4 674 B10R1.25 ClC1=C(CBr)C=CC(Br)=C1 CS15047 [1,1,0,0,0,0|2,0,0]=4 675 B10R1.25 ClC1=CC(Br)=C(CBr)C=C1 MC40516 [1,1,0,0,0,0|2,0,0]=4 676 B10R1.25 ClC1=CC(Cl)=C(CBr)C=C1 CS21097 [1,1,0,0,0,0|2,0,0]=4 677 B10R1.25 ClCC1=C(Cl)C=C(Cl)C=C1 CS19427 [1,1,0,0,0,0|2,0,0]=4 678 B10R1.25 FC1=C(CBr)C=CC(Br)=C1 MC40521 [1,1,0,0,0,0|2,0,0]=4 679 B10R1.25 FC1=CC(Br)=C(CBr)C=C1 CS20064 [1,1,0,0,0,0|2,0,0]=4 680 B10R1.25 FC1=CC(Cl)=C(CBr)C=C1 MC40529 [1,1,0,0,0,0|2,0,0]=4 681 B10R1.25 FC1=CC(Cl)=C(CCl)C=C1 MC40583 [1,1,0,0,0,0|2,0,0]=4 682 B10R1.25 FC1=CC(F)=C(CBr)C=C1 MC40543 [1,1,0,0,0,0|2,0,0]=4 683 B10R1.25 FC1=CC(F)=C(CCl)C=C1 MC40591 [1,1,0,0,0,0|2,0,0]=4 684 B10R1.25 NC1=C(C=O)C=CC(Br)=C1 CS21241 [1,1,0,0,0,0|1,0,0]=3 685 B10R1.25 NC1=C(C=O)C=CC(Cl)=C1 CS17491 [1,1,0,0,0,0|1,0,0]=3 686 B10R1.25 NC1=C(C=O)C=CC(F)=C1 MC30207 [1,1,0,0,0,0|1,0,0]=3 687 B10R1.25 NC1=C(C=O)C=NC(Cl)=C1 MC432605 [1,1,0,0,0,0|2,0,0]=4 688 B10R1.25 NC1=C(CF)C=CC(F)=C1 MC431124 [1,1,0,0,0,0|2,0,0]=4 689 B10R1.25 NC1=CC(Br)=CN=C1C=O MC103515 [1,1,0,0,0,0|2,0,0]=4 690 B10R1.25 NCC1=C(Cl)C=C(Cl)C=C1 MC40814 [1,1,0,0,0,0|2,0,0]=4 691 B10R1.25 NCC1=C(Cl)C=C(F)C=C1 MC40806 [1,1,0,0,0,0|2,0,0]=4 692 B10R1.25 NCC1=C(F)C=C(Br)C=C1 MC40800 [1,1,0,0,0,0|2,0,0]=4 693 B10R1.25 NCC1=C(F)C=C(Cl)C=C1 MC30230 [1,1,0,0,0,0|2,0,0]=4 694 B10R1.25 NCC1=C(F)C=C(F)C=C1 CS10473 [1,1,0,0,0,0|2,0,0]=4 695 B10R1.25 O=CC1=C(Br)C=C(Br)C=C1 CS16310 [1,1,0,0,0,0|1,0,0]=3 696 B10R1.25 O=CC1=C(Br)C=C(Cl)C=C1 CS15142 [1,1,0,0,0,0|1,0,0]=3 697 B10R1.25 O=CC1=C(Br)C=C(F)C=C1 CS10226 [1,1,0,0,0,0|1,0,0]=3 698 B10R1.25 O=CC1=C(Br)C=C(I)C=C1 CS19853 [1,1,0,0,0,0|1,0,0]=3 699 B10R1.25 O=CC1=C(Br)C=C(O)C=C1 CS16052 [1,1,0,0,0,0|1,0,0]=3 700 B10R1.25 O=CC1=C(Br)N=C(Br)C=C1 MC442210 [1,1,0,0,0,0|2,0,0]=4 701 B10R1.25 O=CC1=C(Cl)C=C(Br)C=C1 CS18762 [1,1,0,0,0,0|1,0,0]=3 702 B10R1.25 O=CC1=C(Cl)C=C(Cl)C=C1 MC33212 [1,1,0,0,0,0|1,0,0]=3 703 B10R1.25 O=CC1=C(Cl)C=C(F)C=C1 CS10260 [1,1,0,0,0,0|1,0,0]=3 704 B10R1.25 O=CC1=C(Cl)C=C(O)C=C1 CS10340 [1,1,0,0,0,0|1,0,0]=3 705 B10R1.25 O=CC1=C(Cl)N=C(Br)C=C1 MC432616 [1,1,0,0,0,0|2,0,0]=4 706 B10R1.25 O=CC1=C(Cl)N=C(F)C=C1 MC431503 [1,1,0,0,0,0|2,0,0]=4 707 B10R1.25 O=CC1=C(F)C=C(Br)C=C1 CS10231 [1,1,0,0,0,0|1,0,0]=3 708 B10R1.25 O=CC1=C(F)C=C(Cl)C=C1 MC20030 [1,1,0,0,0,0|1,0,0]=3 709 B10R1.25 O=CC1=C(F)C=C(F)C=C1 CS18760 [1,1,0,0,0,0|1,0,0]=3 710 B10R1.25 O=CC1=C(F)C=C(I)C=C1 CS10293 [1,1,0,0,0,0|1,0,0]=3 711 B10R1.25 O=CC1=C(F)C=C(O)C=C1 CS10365 [1,1,0,0,0,0|1,0,0]=3 712 B10R1.25 O=CC1=C(F)N=C(Cl)C=C1 MC429309 [1,1,0,0,0,0|2,0,0]=4 713 B10R1.25 O=CC1=C(F)N=C(F)C=C1 MC431754 [1,1,0,0,0,0|2,0,0]=4 714 B10R1.25 O=CC1=C(I)C=C(O)C=C1 CS16844 [1,1,0,0,0,0|1,0,0]=3 715 B10R1.25 O=CC1=C(O)C=C(Br)C=C1 CS20081 [1,1,0,0,0,0|1,0,0]=3 716 B10R1.25 O=CC1=C(O)C=C(Cl)C=C1 CS20105 [1,1,0,0,0,0|1,0,0]=3 717 B10R1.25 O=CC1=C(O)C=C(F)C=C1 CS20130 [1,1,0,0,0,0|1,0,0]=3 718 B10R1.25 O=CC1=C(O)C=C(I)C=C1 MC425567 [1,1,0,0,0,0|1,0,0]=3 719 B10R1.25 O=CC1=C(O)C=C(O)C=C1 CS19428 [1,1,0,0,0,0|1,0,0]=3 720 B10R1.25 O=CC1=CC=C(Cl)N=C1Cl CS19136 [1,1,0,0,0,0|2,0,0]=4 721 B10R1.25 O=CC1=CN=C(Br)C=C1Cl MC33235 [1,1,0,0,0,0|2,0,0]=4 722 B10R1.25 O=CC1=CN=C(Cl)C=C1Cl CS16011 [1,1,0,0,0,0|2,0,0]=4 723 B10R1.25 O=CC1=CN=C(F)C=C1Cl MC429245 [1,1,0,0,0,0|2,0,0]=4 724 B10R1.25 O=CC1=CN=C(F)C=C1F MC429333 [1,1,0,0,0,0|2,0,0]=4 725 B10R1.25 O=CC1=NC=C(Br)C=C1F MC104000 [1,1,0,0,0,0|2,0,0]=4 726 B10R1.25 O=CC1=NC=C(Cl)C=C1Cl CS12974 [1,1,0,0,0,0|2,0,0]=4 727 B10R1.25 O=CC1=NC=C(Cl)C=C1F MC431745 [1,1,0,0,0,0|2,0,0]=4 728 B10R1.25 O=CC1=NC=C(F)C=C1Br MC432007 [1,1,0,0,0,0|2,0,0]=4 729 B10R1.25 O=CC1=NC=C(F)C=C1F MC431534 [1,1,0,0,0,0|2,0,0]=4 730 B10R1.25 OCC1=C(Br)C=C(Br)C=C1 CS21073 [1,1,0,0,0,0|1,0,1]=4 731 B10R1.25 OCC1=C(Cl)C=C(Br)C=C1 MC427221 [1,1,0,0,0,0|1,0,1]=4 732 B10R1.25 OCC1=C(F)C=C(Cl)C=C1 MC40693 [1,1,0,0,0,0|1,0,1]=4 733 B10R1.25 OCC1=C(F)C=C(F)C=C1 MC33159 [1,1,0,0,0,0|1,0,1]=4 734 B10R1.25 OCC1=C(F)C=C(O)C=C1 CS13215 [1,1,0,0,0,0|1,0,1]=4 735 B10R1.25 OCC1=C(O)C=C(Br)C=C1 CS10248 [1,1,0,0,0,0|1,0,1]=4 736 B10R1.176 C=CC1=CC(F)=C(F)C=C1 CS19052 [1,1,0,0,0,0|1,0,1]=4 737 B10R1.176 CC1=C(Br)C=C(C#N)C=C1 MC40627 [1,1,0,0,0,0|1,0,1]=4 738 B10R1.176 CC1=C(Br)C=C(C=O)C=C1 MC41096 [1,1,0,0,0,0|0,0,0]=2 739 B10R1.176 CC1=C(Br)C=C(C=O)C=N1 MC431775 [1,1,0,0,0,0|1,0,0]=3 740 B10R1.176 CC1=C(Br)C=C(CBr)C=C1 CS16721 [1,1,0,0,0,0|1,0,0]=3 741 B10R1.176 CC1=C(Br)C=C(CO)C=C1 MC33229 [1,1,0,0,0,0|0,0,1]=3 742 B10R1.176 CC1=C(Br)C=CC(C=O)=C1 CS22664 [1,1,0,0,0,0|1,0,0]=3 743 B10R1.176 CC1=C(Br)C=CC(CO)=C1 MC111151 [1,1,0,0,0,0|1,0,1]=4 744 B10R1.176 CC1=C(C)C=C(C#N)C=C1 MC40653 [1,1,0,0,0,0|1,0,1]=4 745 B10R1.176 CC1=C(C)C=C(C=O)C=C1 MC33166 [1,1,0,0,0,0|0,0,0]=2 746 B10R1.176 CC1=C(C)C=C(CBr)C=C1 CS14390 [1,1,0,0,0,0|1,0,0]=3 747 B10R1.176 CC1=C(C)C=C(CN)C=C1 MC40823 [1,1,0,0,0,0|1,0,0]=3 748 B10R1.176 CC1=C(C)C=C(CO)C=C1 MC40706 [1,1,0,0,0,0|0,0,1]=3 749 B10R1.176 CC1=C(C)C=C(NN)C=C1 CS20502 [1,1,0,0,0,0|2,0,0]=4 750 B10R1.176 CC1=C(Cl)C=C(C=O)C=C1 MC433130 [1,1,0,0,0,0|0,0,0]=2 751 B10R1.176 CC1=C(Cl)C=C(CN)C=C1 MC433895 [1,1,0,0,0,0|1,0,0]=3 752 B10R1.176 CC1=C(Cl)C=CC(C=O)=C1 MC433419 [1,1,0,0,0,0|1,0,0]=3 753 B10R1.176 CC1=C(F)C=C(C#N)C=C1 CS21928 [1,1,0,0,0,0|1,0,1]=4 754 B10R1.176 CC1=C(F)C=C(C=O)C=C1 MC33065 [1,1,0,0,0,0|0,0,0]=2 755 B10R1.176 CC1=C(F)C=C(NN)C=C1 CS22289 [1,1,0,0,0,0|2,0,0]=4 756 B10R1.176 CC1=C(F)C=CC(C=O)=C1 MC41117 [1,1,0,0,0,0|1,0,0]=3 757 B10R1.176 CC1=C(F)C=CC(C=O)=N1 CS12797 [1,1,0,0,0,0|2,0,0]=4 758 B10R1.176 CC1=C(F)C=CC(CN)=C1 MC40831 [1,1,0,0,0,0|2,0,0]=4 759 B10R1.176 CC1=C(N)C=C(C#N)C=C1 CS15246 [1,1,0,0,0,0|1,0,1]=4 760 B10R1.176 CC1=C(O)C=C(C#N)C=C1 CS10986 [1,1,0,0,0,0|1,0,1]=4 761 B10R1.176 CC1=C(O)C=C(C=O)C=C1 MC41122 [1,1,0,0,0,0|0,0,0]=2 762 B10R1.176 CC1=C(O)C=CC(C=O)=C1 CS20934 [1,1,0,0,0,0|1,0,0]=3 763 B10R1.176 CC1=C(O)C=CC(CN)=C1 MC445599 [1,1,0,0,0,0|2,0,0]=4 764 B10R1.176 CC1=CC(C=O)=CN=C1O MC442266 [1,1,0,0,0,0|2,0,0]=4 765 B10R1.176 CC1=CN=C(C=O)C=C1Br MC102712 [1,1,0,0,0,0|1,0,0]=3 766 B10R1.176 CC1=CN=C(CO)C=C1Br MC106975 [1,1,0,0,0,0|1,0,1]=4 767 B10R1.176 CC1=NC=C(C=O)C=C1F MC431247 [1,1,0,0,0,0|1,0,0]=3 768 B10R1.176 CC1=NC=C(C=O)C=C1O MC430648 [1,1,0,0,0,0|1,0,0]=3 769 B10R1.176 CCC1=CC(N)=C(O)C=C1 MC442496 [1,1,0,0,0,0|1,0,1]=4 770 B10R1.176 CCC1=CC(O)=C(Cl)C=C1 MC432619 [1,1,0,0,0,0|1,0,1]=4 771 B10R1.176 CCC1=CC(O)=C(N)C=C1 CS16266 [1,1,0,0,0,0|1,0,1]=4 772 B10R1.176 CCC1=CC=C(O)C(O)=C1 MC441226 [1,1,0,0,0,0|1,0,1]=4 773 B10R1.176 CN1C=CC(CN)=CC1=O MC103393 [1,1,0,0,0,0|2,0,0]=4 774 B10R1.176 CN1N=CC(C=O)=CC1=O MC111762 [1,1,0,0,0,0|2,0,0]=4 775 B10R1.176 COC1=CC(Br)=C(C)C=C1 CS16376 [1,1,0,0,0,0|1,0,1]=4 776 B10R1.176 COC1=CC(Cl)=C(C)C=C1 MC41331 [1,1,0,0,0,0|1,0,1]=4 777 B10R1.176 COC1=CC(F)=C(C)C=C1 CS10872 [1,1,0,0,0,0|1,0,1]=4 778 B10R1.176 COC1=CC(N)=C(C)C=C1 CS14868 [1,1,0,0,0,0|1,0,1]=4 779 B10R1.176 ClC1=C(Br)C=CC(CBr)=C1 MC40517 [1,1,0,0,0,0|2,0,0]=4 780 B10R1.176 ClC1=C(Cl)C=C(CBr)C=C1 CS18826 [1,1,0,0,0,0|2,0,0]=4 781 B10R1.176 ClCC1=CC(Cl)=C(Cl)C=C1 MC40590 [1,1,0,0,0,0|2,0,0]=4 782 B10R1.176 Cn1ccc(C=O)cc1=O MC103763 [1,1,0,0,0,0|1,0,0]=3 783 B10R1.176 FC1=C(Br)C=C(CBr)C=C1 MC40520 [1,1,0,0,0,0|2,0,0]=4 784 B10R1.176 FC1=C(Br)C=CC(CBr)=C1 MC40522 [1,1,0,0,0,0|2,0,0]=4 785 B10R1.176 FC1=C(Cl)C=C(CBr)C=C1 MC20082 [1,1,0,0,0,0|2,0,0]=4 786 B10R1.176 FC1=C(Cl)C=C(CCl)C=C1 MC40584 [1,1,0,0,0,0|2,0,0]=4 787 B10R1.176 FC1=C(Cl)C=CC(CBr)=C1 CS19666 [1,1,0,0,0,0|2,0,0]=4 788 B10R1.176 FC1=C(Cl)C=CC(CCl)=C1 MC40585 [1,1,0,0,0,0|2,0,0]=4 789 B10R1.176 FC1=C(F)C=C(CBr)C=C1 MC40546 [1,1,0,0,0,0|2,0,0]=4 790 B10R1.176 FC1=C(F)C=C(CCl)C=C1 MC433089 [1,1,0,0,0,0|2,0,0]=4 791 B10R1.176 NC1=NC=C(C=O)C=C1Br MC432272 [1,1,0,0,0,0|2,0,0]=4 792 B10R1.176 NCC1=CC(Br)=C(F)C=C1 MC40799 [1,1,0,0,0,0|2,0,0]=4 793 B10R1.176 NCC1=CC(Cl)=C(Cl)C=C1 MC433898 [1,1,0,0,0,0|2,0,0]=4 794 B10R1.176 NCC1=CC(Cl)=C(F)C=C1 MC30276 [1,1,0,0,0,0|2,0,0]=4 795 B10R1.176 NCC1=CC(F)=C(Br)C=C1 MC425051 [1,1,0,0,0,0|2,0,0]=4 796 B10R1.176 NCC1=CC(F)=C(Cl)C=C1 MC33195 [1,1,0,0,0,0|2,0,0]=4 797 B10R1.176 NCC1=CC(F)=C(F)C=C1 MC33192 [1,1,0,0,0,0|2,0,0]=4 798 B10R1.176 NCC1=CC(O)=C(O)C=C1 MC425646 [1,1,0,0,0,0|2,0,0]=4 799 B10R1.176 O=CC1=CC(Br)=C(Br)C=C1 MC430425 [1,1,0,0,0,0|1,0,0]=3 800 B10R1.176 O=CC1=CC(Br)=C(Cl)C=C1 CS12700 [1,1,0,0,0,0|1,0,0]=3 801 B10R1.176 O=CC1=CC(Br)=C(F)C=C1 CS10229 [1,1,0,0,0,0|1,0,0]=3 802 B10R1.176 O=CC1=CC(Br)=C(O)C=C1 MC20184 [1,1,0,0,0,0|1,0,0]=3 803 B10R1.176 O=CC1=CC(Cl)=C(Br)C=C1 CS12259 [1,1,0,0,0,0|1,0,0]=3 804 B10R1.176 O=CC1=CC(Cl)=C(Cl)C=C1 CS19889 [1,1,0,0,0,0|1,0,0]=3 805 B10R1.176 O=CC1=CC(Cl)=C(F)C=C1 MC20026 [1,1,0,0,0,0|1,0,0]=3 806 B10R1.176 O=CC1=CC(F)=C(Br)C=C1 CS10232 [1,1,0,0,0,0|1,0,0]=3 807 B10R1.176 O=CC1=CC(F)=C(Cl)C=C1 CS10264 [1,1,0,0,0,0|1,0,0]=3 808 B10R1.176 O=CC1=CC(F)=C(F)C=C1 CS14168 [1,1,0,0,0,0|1,0,0]=3 809 B10R1.176 O=CC1=CC(F)=C(I)C=C1 CS10296 [1,1,0,0,0,0|1,0,0]=3 810 B10R1.176 O=CC1=CC(F)=C(O)C=C1 CS10367 [1,1,0,0,0,0|1,0,0]=3 811 B10R1.176 O=CC1=CC(I)=C(Br)C=C1 MC431061 [1,1,0,0,0,0|1,0,0]=3 812 B10R1.176 O=CC1=CC(I)=C(Cl)C=C1 MC441220 [1,1,0,0,0,0|1,0,0]=3 813 B10R1.176 O=CC1=CC(I)=C(F)C=C1 MC20286 [1,1,0,0,0,0|1,0,0]=3 814 B10R1.176 O=CC1=CC(I)=C(I)C=C1 MC431060 [1,1,0,0,0,0|1,0,0]=3 815 B10R1.176 O=CC1=CC(I)=C(O)C=C1 MC429971 [1,1,0,0,0,0|1,0,0]=3 816 B10R1.176 O=CC1=CC(O)=C(Br)C=C1 MC41092 [1,1,0,0,0,0|1,0,0]=3 817 B10R1.176 O=CC1=CC(O)=C(Cl)C=C1 CS15259 [1,1,0,0,0,0|1,0,0]=3 818 B10R1.176 O=CC1=CC(O)=C(F)C=C1 MC41115 [1,1,0,0,0,0|1,0,0]=3 819 B10R1.176 O=CC1=CC(O)=C(O)C=C1 CS18720 [1,1,0,0,0,0|1,0,0]=3 820 B10R1.176 O=CC1=CN=C(Br)C(F)=C1 CS18127 [1,1,0,0,0,0|2,0,0]=4 821 B10R1.176 O=CC1=CN=C(Cl)C(Cl)=C1 MC33386 [1,1,0,0,0,0|2,0,0]=4 822 B10R1.176 O=CC1=CNC(=O)C(Br)=C1 MC430621 [1,1,0,0,0,0|2,0,0]=4 823 B10R1.176 O=CC1=CNC(=O)C(Cl)=C1 MC430658 [1,1,0,0,0,0|2,0,0]=4 824 B10R1.176 OCC1=CC(Br)=C(Cl)C=C1 MC40686 [1,1,0,0,0,0|1,0,1]=4 825 B10R1.176 OCC1=CC(Br)=C(O)C=C1 CS21356 [1,1,0,0,0,0|1,0,1]=4 826 B10R1.176 OCC1=CC(Cl)=C(Cl)C=C1 CS18809 [1,1,0,0,0,0|1,0,1]=4 827 B10R1.176 OCC1=CC(Cl)=C(F)C=C1 MC30274 [1,1,0,0,0,0|1,0,1]=4 828 B10R1.176 OCC1=CC(F)=C(Br)C=C1 CS20190 [1,1,0,0,0,0|1,0,1]=4 829 B10R1.176 OCC1=CC(F)=C(Cl)C=C1 MC40694 [1,1,0,0,0,0|1,0,1]=4 830 B10R1.176 OCC1=CC(F)=C(F)C=C1 CS19362 [1,1,0,0,0,0|1,0,1]=4 831 B10R1.176 OCC1=CC(O)=C(Br)C=C1 CS16027 [1,1,0,0,0,0|1,0,1]=4 832 B10R1.176 OCC1=CC(O)=C(I)C=C1 MC33283 [1,1,0,0,0,0|1,0,1]=4 833 B10R1.4 Br[Zn]Cc1ccccc1Br MC121351 [1,1,0,0,0,0|2,0,0]=4 834 B10R1.4 CC1=C(CC#N)C=CC=C1 CS11825 [1,1,0,0,0,0|1,0,1]=4 835 B10R1.4 CNCC1=C(F)C=CC=C1 MC40828 [1,1,0,0,0,0|2,0,0]=4 836 B10R1.4 COCC1=C(Br)C=CC=C1 MC41399 [1,1,0,0,0,0|2,0,0]=4 837 B10R1.4 Fc1ccccc1C[Zn]Cl MC121344 [1,1,0,0,0,0|2,0,0]=4 838 B10R1.4 N#CCC1=C(Br)C=CC=C1 CS10707 [1,1,0,0,0,0|1,0,1]=4 839 B10R1.4 N#CCC1=C(Cl)C=CC=C1 CS21495 [1,1,0,0,0,0|1,0,1]=4 840 B10R1.4 N#CCC1=C(F)C=CC=C1 CS20772 [1,1,0,0,0,0|1,0,1]=4 841 B10R1.4 N#CCC1=C(I)C=CC=C1 MC40781 [1,1,0,0,0,0|1,0,1]=4 842 B10R1.4 N#CCC1=C(N)C=CC=C1 CS20914 [1,1,0,0,0,0|1,0,1]=4 843 B10R1.4 NCCC1=C(Br)C=CC=C1 CS15138 [1,1,0,0,0,0|1,0,1]=4 844 B10R1.4 NCCC1=C(F)C=CC=C1 CS14793 [1,1,0,0,0,0|1,0,1]=4 845 B10R1.4 NCCC1=C(N)C=CC=C1 CS15970 [1,1,0,0,0,0|1,0,1]=4 846 B10R1.4 NNCC1=C(F)C=CC=C1 CS20134 [1,1,0,0,0,0|2,0,0]=4 847 B10R1.4 NNCc1ccccc1F MC443842 [1,1,0,0,0,0|2,0,0]=4 848 B10R1.4 O=C=NC1=C(Br)C=CC=C1 MC41031 [1,1,0,0,0,0|1,0,1]=4 849 B10R1.4 O=C=NC1=C(F)C=CC=C1 MC429405 [1,1,0,0,0,0|1,0,1]=4 850 B10R1.4 O=CCC1=C(F)C=CC=C1 MC431003 [1,1,0,0,0,0|0,0,0]=2 851 B10R1.4 OC1=C(CCI)C=CC=C1 MC430321 [1,1,0,0,0,0|1,0,1]=4 852 B10R1.4 OCCC1=C(Br)C=CC=C1 CS21407 [1,1,0,0,0,0|0,0,2]=4 853 B10R1.4 OCCC1=C(Cl)C=CC=C1 MC40737 [1,1,0,0,0,0|0,0,2]=4 854 B10R1.4 OCCC1=C(F)C=CC=C1 MC33149 [1,1,0,0,0,0|0,0,2]=4 855 B10R1.10 Br[Zn]Cc1cccc(Br)c1 MC121352 [1,1,0,0,0,0|2,0,0]=4 856 B10R1.10 C=CCC1=CC=CC(O)=C1 MC425380 [1,1,0,0,0,0|1,0,0]=3 857 B10R1.10 CC1=CC(CC#N)=CC=C1 CS18941 [1,1,0,0,0,0|1,0,1]=4 858 B10R1.10 CC1=CC(CCO)=CC=C1 CS22372 [1,1,0,0,0,0|0,0,2]=4 859 B10R1.10 CCCc1cccc(F)c1 MC440476 [1,1,0,0,0,0|1,0,1]=4 860 B10R1.10 FC1=CC=CC(CCBr)=C1 MC40572 [1,1,0,0,0,0|1,0,1]=4 861 B10R1.10 Fc1cccc(C[Zn]Cl)c1 MC121345 [1,1,0,0,0,0|2,0,0]=4 862 B10R1.10 N#CCC1=CC(Br)=CC=C1 CS18969 [1,1,0,0,0,0|1,0,1]=4 863 B10R1.10 N#CCC1=CC(Cl)=CC=C1 CS13745 [1,1,0,0,0,0|1,0,1]=4 864 B10R1.10 N#CCC1=CC(F)=CC=C1 MC20212 [1,1,0,0,0,0|1,0,1]=4 865 B10R1.10 N#CCC1=CC(N)=CC=C1 MC433930 [1,1,0,0,0,0|1,0,1]=4 866 B10R1.10 NC1=CC=CC(CCO)=C1 CS22105 [1,1,0,0,0,0|0,0,2]=4 867 B10R1.10 NCCC1=CC(Br)=CC=C1 CS15159 [1,1,0,0,0,0|1,0,1]=4 868 B10R1.10 NCCC1=CC(F)=CC=C1 MC40979 [1,1,0,0,0,0|1,0,1]=4 869 B10R1.10 NNCC1=CC(O)=CC=C1 MC10382 [1,1,0,0,0,0|2,0,0]=4 870 B10R1.10 O=C=NC1=CC(F)=CC=C1 MC41043 [1,1,0,0,0,0|1,0,1]=4 871 B10R1.10 O=CCC1=CC(O)=CC=C1 MC106361 [1,1,0,0,0,0|0,0,0]=2 872 B10R1.10 OCCC1=CC(Br)=CC=C1 CS22186 [1,1,0,0,0,0|0,0,2]=4 873 B10R1.10 OCCC1=CC(Cl)=CC=C1 CS22241 [1,1,0,0,0,0|0,0,2]=4 874 B10R1.10 OCCC1=CC(F)=CC=C1 MC40743 [1,1,0,0,0,0|0,0,2]=4 875 B10R1.15 C=CC(N)C1=CC=CC=C1 MC102512 [1,1,0,0,0,0|1,0,0]=3 876 B10R1.15 CC(CN)C1=CC=CC=C1 CS10909 [1,1,0,0,0,0|1,0,1]=4 877 B10R1.15 CC(CN)c1ccccc1 MC110750 [1,1,0,0,0,0|1,0,1]=4 878 B10R1.15 CC(NO)c1ccccc1 MC103844 [1,1,0,0,0,0|1,0,1]=4 879 B10R1.15 CC(NO)c1ccccc1 MC103845 [1,1,0,0,0,0|1,0,1]=4 880 B10R1.15 CCC(C)C1=CC=CC=C1 CS11947 [1,1,0,0,0,0|1,0,1]=4 881 B10R1.15 CCC(C)C1=CC=CC=C1 MC433489 [1,1,0,0,0,0|1,0,1]=4 882 B10R1.15 CCC(N)C1=CC=CC=C1 MC20337 [1,1,0,0,0,0|1,0,1]=4 883 B10R1.15 CN(C=O)C1=CC=CC=C1 CS11793 [1,1,0,0,0,0|1,0,0]=3 884 B10R1.15 FC(CBr)C1=CC=CC=C1 MC102769 [1,1,0,0,0,0|1,0,1]=4 885 B10R1.15 N#CC(N)C1=CC=CC=C1 MC31161 [1,1,0,0,0,0|1,0,1]=4 886 B10R1.15 NC(CO)C1=CC=CC=C1 CS10553 [1,1,0,0,0,0|0,0,2]=4 887 B10R1.15 NC(CO)C1=CC=CC=C1 CS10555 [1,1,0,0,0,0|0,0,2]=4 888 B10R1.15 NC(CO)C1=CC=CC=C1 CS15860 [1,1,0,0,0,0|0,0,2]=4 889 B10R1.15 NCC(O)C1=CC=CC=C1 CS20485 [1,1,0,0,0,0|1,0,1]=4 890 B10R1.15 NCC(O)C1=CC=CC=C1 MC444625 [1,1,0,0,0,0|1,0,1]=4 891 B10R1.15 OC(CBr)C1=CC=CC=C1 CS18840 [1,1,0,0,0,0|1,0,1]=4 892 B10R1.15 OCC(F)C1=CC=CC=C1 MC430923 [1,1,0,0,0,0|0,0,2]=4 893 B10R1.17 BrCCOC1=CC=CC=C1 MC20150 [1,1,0,0,0,0|1,0,1]=4 894 B10R1.17 Br[Zn]CCc1ccccc1 MC121341 [1,1,0,0,0,0|1,0,1]=4 895 B10R1.17 CNCCC1=CC=CC=C1 MC446670 [1,1,0,0,0,0|1,0,1]=4 896 B10R1.17 ClCCOC1=CC=CC=C1 MC33174 [1,1,0,0,0,0|1,0,1]=4 897 B10R1.17 ClC\C=C\C1=CC=CC=C1 MC41818 [1,1,0,0,0,0|1,0,1]=4 898 B10R1.17 NCCOC1=CC=CC=C1 CS20484 [1,1,0,0,0,0|1,0,1]=4 899 B10R1.17 O=CC#CC1=CC=CC=C1 CS18196 [1,1,0,0,0,0|0,0,1]=3 900 B10R1.17 OCCOC1=CC=CC=C1 MC41398 [1,1,0,0,0,0|0,0,2]=4 901 B10R1.18 BrC(Br)=CC1=CC=CC=C1 CS16193 [1,1,0,0,0,0|1,0,1]=4 902 B10R1.18 CC(=O)CC1=CC=CN=C1 MC102696 [1,1,0,0,0,0|1,0,0]=3 903 B10R1.18 CC(=O)CC1=CC=NC=C1 CS20988 [1,1,0,0,0,0|1,0,0]=3 904 B10R1.18 CC(=O)CC1=NC=CC=C1 CS20802 [1,1,0,0,0,0|1,0,0]=3 905 B10R1.18 CC(=O)CC1=NC=CC=N1 MC429990 [1,1,0,0,0,0|2,0,0]=4 906 B10R1.18 CC(=O)NC1=CC=CC=C1 MC34102 [1,1,0,0,0,0|1,0,0]=3 907 B10R1.18 CC(Br)CC1=CC=CC=C1 MC41813 [1,1,0,0,0,0|1,0,1]=4 908 B10R1.18 NC(=O)CC1=NC=CC=N1 CS17323 [1,1,0,0,0,0|2,0,0]=4 909 B10R1.18 NC(=O)NC1=CC=CC=C1 CS10533 [1,1,0,0,0,0|1,0,0]=3 910 B10R1.18 NC(=O)OC1=CC=CC=C1 MC428148 [1,1,0,0,0,0|1,0,0]=3 911 B10R1.18 O=C(Cl)OC1=CC=CC=C1 CS18823 [1,1,0,0,0,0|1,0,0]=3 912 B10R1.18 O=C(O)CC1=CC=CN=C1 CS20325 [1,1,0,0,0,0|1,0,0]=3 913 B10R1.18 O=C(O)CC1=CC=CN=N1 MC103920 [1,1,0,0,0,0|2,0,0]=4 914 B10R1.18 O=C(O)CC1=CC=NC=C1 CS20327 [1,1,0,0,0,0|1,0,0]=3 915 B10R1.18 O=C(O)CC1=CC=NC=C1 MC41632 [1,1,0,0,0,0|1,0,0]=3 916 B10R1.18 O=C(O)CC1=CN=CN=C1 CS10494 [1,1,0,0,0,0|2,0,0]=4 917 B10R1.18 O=C(O)CC1=CN=NC=C1 MC103838 [1,1,0,0,0,0|2,0,0]=4 918 B10R1.18 O=C(O)CC1=NC=CC=C1 MC41631 [1,1,0,0,0,0|1,0,0]=3 919 B10R1.18 O=C(O)CC1=NC=CC=N1 MC102381 [1,1,0,0,0,0|2,0,0]=4 920 B10R1.18 O=C(O)CC1=NC=NC=C1 MC113226 [1,1,0,0,0,0|2,0,0]=4 921 B10R1.18 O=C([O-])CC1=CC=CC=C1 MC34448 [1,1,0,0,0,0|0,0,0]=2 922 B10R1.18 O=C([O-])CC1=CN=NC=C1 MC103839 [1,1,0,0,0,0|2,0,0]=4 923 B10R1.16 CC1=CC=C(\C=C\C=O)O1 CS17008 [0,1,0,0,1,0|1,0,1]=4 924 B10R1.54 CN1C=NC(CC(=O)O)=C1 CS16463 [0,1,0,0,1,0|2,0,0]=4 925 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 CS14964 [0,2,0,0,0,0|1,0,0]=3 926 B12R1.21 CC(=O)\C=C\C1=CC=C(Br)C=C1 MC431712 [0,2,0,0,0,0|1,0,1]=4 927 B12R1.21 CC(=O)\C=C\C1=CC=C(Cl)C=C1 MC41308 [0,2,0,0,0,0|1,0,1]=4 928 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 MC40217 [0,2,0,0,0,0|0,0,1]=3 929 B12R1.21 NC(=[NH2+])SCC1=CC=C(F)C=C1 MC112601 [0,2,0,0,0,0|2,0,0]=4 930 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 CS21832 [0,2,0,0,0,0|1,0,0]=3 931 B12R1.21 NC1=CC=C(CCC(=O)O)C=N1 CS15944 [0,2,0,0,0,0|2,0,0]=4 932 B12R1.21 NC1=CC=C(CCC(=O)O)C=N1 CS17825 [0,2,0,0,0,0|2,0,0]=4 933 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 CS21674 [0,2,0,0,0,0|1,0,0]=3 934 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 CS19854 [0,2,0,0,0,0|1,0,0]=3 935 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 CS21107 [0,2,0,0,0,0|1,0,0]=3 936 B12R1.21 O=C(O)CSC1=CC=C(F)C=C1 MC41825 [0,2,0,0,0,0|1,0,0]=3 937 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 CS21504 [0,2,0,0,0,0|1,0,1]=4 938 B12R1.21 O=C(O)\C=C\C1=CC=C(F)C=C1 MC429571 [0,2,0,0,0,0|1,0,1]=4 939 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 CS15820 [0,2,0,0,0,0|1,0,1]=4 940 B12R1.21 O=[N+]([O-])\C=C\C1=CC=C(F)C=C1 MC41593 [0,2,0,0,0,0|1,0,1]=4 941 B12R1.21 O=[N+]([O-])\C=C\C1=CC=C(O)C=C1 CS22887 [0,2,0,0,0,0|1,0,1]=4 942 B12R1.49 COC(=O)CC1=CC=C(Br)C=C1 MC33263 [0,2,0,0,0,0|1,0,0]=3 943 B12R1.49 COC(=O)CC1=CC=C(C)C=C1 MC40116 [0,2,0,0,0,0|0,0,0]=2 944 B12R1.49 COC(=O)CC1=CC=C(Cl)C=C1 MC40088 [0,2,0,0,0,0|1,0,0]=3 945 B12R1.49 COC(=O)CC1=CC=C(F)N=C1 MC429489 [0,2,0,0,0,0|2,0,0]=4 946 B12R1.49 COC(=O)CC1=CC=C(N)N=C1 MC431366 [0,2,0,0,0,0|2,0,0]=4 947 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 CS21113 [0,2,0,0,0,0|1,0,0]=3 948 B12R1.49 NNC(=O)CC1=CC=C(Cl)N=C1 MC430435 [0,2,0,0,0,0|2,0,0]=4 949 B12R1.385 CC1=C(O)C=C(NCCO)C=C1 CS21891 [0,2,0,0,0,0|0,0,2]=4 950 B12R1.4 CC(=O)NC1=CC=C(C#N)C=C1 CS22530 [0,2,0,0,0,0|1,0,1]=4 951 B12R1.4 CC(=O)OC1=CC=C(C=O)C=C1 MC40005 [0,2,0,0,0,0|1,0,1]=4 952 B12R1.4 CCC1=CC=C(CC(C)=O)C=C1 MC20892 [0,2,0,0,0,0|0,0,0]=2 953 B12R1.4 COC1=CC=C(CC(=O)O)C=C1 CS13446 [0,2,0,0,0,0|0,0,0]=2 954 B12R1.4 COC1=CC=C(CC(C)=O)C=C1 CS11110 [0,2,0,0,0,0|0,0,0]=2 955 B12R1.4 COC1=CC=C(NC(C)=O)C=C1 MC427407 [0,2,0,0,0,0|1,0,0]=3 956 B12R1.4 COC1=CC=C(NC(C)=S)C=C1 MC427413 [0,2,0,0,0,0|1,1,0]=4 957 B12R1.4 COC1=CC=C(OC(=O)Cl)C=C1 MC40014 [0,2,0,0,0,0|1,0,0]=3 958 B12R1.4 N#CC1=CC=C(CC(=O)O)C=C1 CS18357 [0,2,0,0,0,0|0,0,1]=3 959 B12R1.4 NCC1=CC=C(CC(=O)O)C=C1 CS16100 [0,2,0,0,0,0|0,0,0]=2 960 B12R1.4 NCC1=CC=C(CC(=O)O)C=C1 MC40138 [0,2,0,0,0,0|0,0,0]=2 961 B12R1.4 O=C(O)CC1=CC=C(CBr)C=C1 MC40152 [0,2,0,0,0,0|0,0,0]=2 962 B12R1.4 O=CC1=CC=C(CC(=O)O)C=C1 MC431953 [0,2,0,0,0,0|0,0,1]=3 963 B12R1.19 CC(=O)Nc1ccc(C)c(C)c1 MC40962 [0,2,0,0,0,0|1,0,0]=3 964 B12R1.19 CC(=O)Nc1ccc(F)c(F)c1 MC40961 [0,2,0,0,0,0|2,0,0]=4 965 B12R1.19 CC(=O)OC1=CC(C)=C(Cl)C=C1 MC40003 [0,2,0,0,0,0|2,0,0]=4 966 B12R1.19 CC1=C(Br)C=CC(CC(=O)O)=C1 MC40151 [0,2,0,0,0,0|1,0,0]=3 967 B12R1.19 CC1=C(C)C=C(CC(=O)O)C=C1 MC21107 [0,2,0,0,0,0|0,0,0]=2 968 B12R1.19 CC1=C(C)C=C(CC(=O)O)C=C1 MC433950 [0,2,0,0,0,0|0,0,0]=2 969 B12R1.19 CC1=C(F)C=CC([ClH]C(=O)[O-])=C1 MC30266 [0,2,0,0,0,0|2,0,0]=4 970 B12R1.19 NC(=O)NC1=CC(Cl)=C(Cl)C=C1 CS20402 [0,2,0,0,0,0|2,0,0]=4 971 B12R1.19 O=C(O)CC1=CC(Br)=C(F)C=C1 CS18834 [0,2,0,0,0,0|1,0,0]=3 972 B12R1.19 O=C(O)CC1=CC(Br)=C(O)C=C1 MC40146 [0,2,0,0,0,0|1,0,0]=3 973 B12R1.19 O=C(O)CC1=CC(Cl)=C(Cl)C=C1 CS20693 [0,2,0,0,0,0|1,0,0]=3 974 B12R1.19 O=C(O)CC1=CC(Cl)=C(F)C=C1 CS10724 [0,2,0,0,0,0|1,0,0]=3 975 B12R1.19 O=C(O)CC1=CC(F)=C(Br)C=C1 CS12651 [0,2,0,0,0,0|1,0,0]=3 976 B12R1.19 O=C(O)CC1=CC(F)=C(Cl)C=C1 CS22756 [0,2,0,0,0,0|1,0,0]=3 977 B12R1.19 O=C(O)CC1=CC(F)=C(F)C=C1 MC40163 [0,2,0,0,0,0|1,0,0]=3 978 B12R1.19 O=C(O)CC1=CC(F)=C(O)C=C1 MC40167 [0,2,0,0,0,0|1,0,0]=3 979 B12R1.19 O=C(O)CC1=CC(O)=C(O)C=C1 CS20953 [0,2,0,0,0,0|1,0,0]=3 980 B12R1.20 CC(C(=O)O)C1=CC=C(F)C=C1 CS12331 [0,2,0,0,0,0|1,0,0]=3 981 B12R1.20 NC(C(=O)O)C1=CC=C(Br)C=C1 CS20887 [0,2,0,0,0,0|1,0,0]=3 982 B12R1.20 NC(C(=O)O)C1=CC=C(Cl)C=C1 CS10846 [0,2,0,0,0,0|1,0,0]=3 983 B12R1.20 NC(C(=O)O)C1=CC=C(Cl)C=C1 CS15576 [0,2,0,0,0,0|1,0,0]=3 984 B12R1.20 NC(C(=O)O)C1=CC=C(Cl)C=C1 CS19207 [0,2,0,0,0,0|1,0,0]=3 985 B12R1.20 NC(C(=O)O)C1=CC=C(F)C=C1 MC20331 [0,2,0,0,0,0|1,0,0]=3 986 B12R1.20 NC(C(=O)O)C1=CC=C(F)C=C1 MC429561 [0,2,0,0,0,0|1,0,0]=3 987 B12R1.20 NC(C(=O)O)C1=CC=C(F)C=C1 MC429563 [0,2,0,0,0,0|1,0,0]=3 988 B12R1.20 NC(C(=O)O)C1=CC=C(O)C=C1 CS21023 [0,2,0,0,0,0|1,0,0]=3 989 B12R1.20 O=C(O)C(=O)C1=CC=C(Cl)C=C1 CS15974 [0,2,0,0,0,0|1,0,1]=4 990 B12R1.20 O=C(O)C(Br)C1=CC=C(Cl)C=C1 MC40142 [0,2,0,0,0,0|1,0,0]=3 991 B12R1.20 O=C(O)C(O)C1=CC=C(Br)C=C1 MC115598 [0,2,0,0,0,0|1,0,0]=3 992 B12R1.20 O=C(O)C(O)C1=CC=C(Cl)C=C1 CS20354 [0,2,0,0,0,0|1,0,0]=3 993 B12R1.20 O=C(O)C(O)C1=CC=C(Cl)C=C1 MC40159 [0,2,0,0,0,0|1,0,0]=3 994 B12R1.20 O=C(O)C(O)c1ccc(Br)cc1 MC115599 [0,2,0,0,0,0|1,0,0]=3 995 B12R1.106 CC1=CC=C(CS(=O)(=O)Cl)C=C1 MC20307 [0,2,0,0,0,0|1,0,0]=3 996 B12R1.106 NC1=CC=C(CP(=O)(O)O)C=C1 MC10777 [0,2,0,0,0,0|2,0,0]=4 997 B12R1.106 O=S(=O)(Cl)CC1=CC=C(F)C=C1 MC429576 [0,2,0,0,0,0|2,0,0]=4 998 B12R1.233 CC(=O)NC1=C(Cl)C=C(F)C=C1 MC33128 [0,2,0,0,0,0|2,0,0]=4 999 B12R1.233 CC(=O)NC1=C(O)C=C(F)C=C1 MC427191 [0,2,0,0,0,0|2,0,0]=4 1000 B12R1.233 CC(=O)Nc1ccc(Cl)cc1F MC40956 [0,2,0,0,0,0|2,0,0]=4 1001 B12R1.233 CC1=C(CC(=O)O)C=CC(Br)=C1 MC107511 [0,2,0,0,0,0|1,0,0]=3 1002 B12R1.233 CC1=CC(Br)=C(CC(=O)O)C=C1 MC106320 [0,2,0,0,0,0|0,0,0]=2 1003 B12R1.233 CC1=CC(F)=C(CC(=O)O)C=C1 CS12730 [0,2,0,0,0,0|0,0,0]=2 1004 B12R1.233 CC1=CC=C(CC(=O)O)C(=O)N1 MC430198 [0,2,0,0,0,0|1,0,0]=3 1005 B12R1.233 NC1=C(CC(=O)O)C=CC(F)=C1 MC429495 [0,2,0,0,0,0|1,0,0]=3 1006 B12R1.233 NC1=CC(F)=C(CC(=O)O)C=C1 MC433931 [0,2,0,0,0,0|1,0,0]=3 1007 B12R1.233 O=C(O)CC1=C(Br)C=C(Cl)C=C1 CS19112 [0,2,0,0,0,0|1,0,0]=3 1008 B12R1.233 O=C(O)CC1=C(Br)C=C(F)C=C1 CS15278 [0,2,0,0,0,0|1,0,0]=3 1009 B12R1.233 O=C(O)CC1=C(Cl)C=C(Br)C=C1 CS16319 [0,2,0,0,0,0|1,0,0]=3 1010 B12R1.233 O=C(O)CC1=C(Cl)C=C(Cl)C=C1 CS10717 [0,2,0,0,0,0|1,0,0]=3 1011 B12R1.233 O=C(O)CC1=C(Cl)C=C(F)C=C1 CS20709 [0,2,0,0,0,0|1,0,0]=3 1012 B12R1.233 O=C(O)CC1=C(F)C=C(Br)C=C1 CS19772 [0,2,0,0,0,0|1,0,0]=3 1013 B12R1.233 O=C(O)CC1=C(F)C=C(Cl)C=C1 MC40156 [0,2,0,0,0,0|1,0,0]=3 1014 B12R1.233 O=C(O)CC1=C(F)C=C(F)C=C1 MC10349 [0,2,0,0,0,0|1,0,0]=3 1015 B12R1.233 O=C(O)CC1=C(I)C=C(F)C=C1 MC432599 [0,2,0,0,0,0|1,0,0]=3 1016 B12R1.233 O=C(O)CC1=C(O)C=C(F)C=C1 MC429494 [0,2,0,0,0,0|1,0,0]=3 1017 B12R1.5 COC1=CC=C(C(O)CN)C=C1 MC431260 [0,2,0,0,0,0|1,0,1]=4 1018 B12R1.12 CC1=CC=C(C(CN)CO)C=C1 MC105877 [0,2,0,0,0,0|0,0,2]=4 1019 B12R1.12 CC1=CC=C(C(CN)CO)C=C1 MC105878 [0,2,0,0,0,0|0,0,2]=4 1020 B12R1.114 COC1=CC(Cl)=C(CC#N)C=C1 MC20596 [0,2,0,0,0,0|1,0,1]=4 1021 B12R1.1095 CC1=CC(C)=C(CCO)C(C)=C1 CS21631 [0,2,0,0,0,0|0,0,2]=4 1022 B12R1.1095 CC1=CC(Cl)=C(CC#N)C(Cl)=C1 MC109972 [0,2,0,0,0,0|1,0,1]=4 1023 B12R1.1095 CC1=CC(F)=C(CC#N)C(F)=C1 MC110327 [0,2,0,0,0,0|1,0,1]=4 1024 B12R1.1095 CC1=NC(Cl)=C(CC=O)C(Cl)=N1 CS16347 [0,2,0,0,0,0|2,0,0]=4 1025 B12R1.1095 O=COC1=C(Cl)C=C(Cl)C=C1Cl MC40133 [0,2,0,0,0,0|2,0,0]=4 1026 B12R1.113 CC(=O)C1=CC=C(CCBr)C=C1 CS10009 [0,2,0,0,0,0|1,0,1]=4 1027 B12R1.113 CC(=O)C1=CC=C(N=C=O)C=C1 MC41029 [0,2,0,0,0,0|1,0,1]=4 1028 B12R1.113 CN(C)C1=CC=C(CCO)C=C1 CS22462 [0,2,0,0,0,0|0,0,2]=4 1029 B12R1.116 CCOC1=CC=C(CC#N)C=C1 MC433951 [0,2,0,0,0,0|1,0,1]=4 1030 B12R1.116 COCC1=CC=C(COC)C=C1 MC444622 [0,2,0,0,0,0|2,0,0]=4 1031 B12R1.288 COC1=C(F)C=C(CC#N)C=C1 CS14302 [0,2,0,0,0,0|1,0,1]=4 1032 B12R1.288 COC1=C(O)C=C(CCN)C=C1 MC20884 [0,2,0,0,0,0|1,0,1]=4 1033 B12R1.44 CC1=C(Cl)C=C(CC#N)C=C1Cl MC109975 [0,2,0,0,0,0|1,0,1]=4 1034 B12R1.286 COC1=C(C)C=CC(CC#N)=C1 CS22339 [0,2,0,0,0,0|1,0,1]=4 1035 B10R1.2 CC1=CC=CC(C=O)=C1C CS10889 [0,0,1,1,0,0|0,0,2]=4 1036 B10R1.2 CC1=CC=CC(C=O)=C1Cl MC33173 [0,0,1,1,0,0|1,0,1]=4 1037 B10R1.2 CC1=CC=CC(C=O)=C1F MC20031 [0,0,1,1,0,0|1,0,1]=4 1038 B10R1.2 CC1=CC=CC(C=O)=C1O CS20930 [0,0,1,1,0,0|1,0,1]=4 1039 B10R1.30 CC1=CC(C=O)=C(Br)C=C1 CS13222 [0,0,1,1,0,0|1,0,1]=4 1040 B10R1.30 CC1=CC(C=O)=C(F)C=C1 CS10804 [0,0,1,1,0,0|1,0,1]=4 1041 B10R1.30 CC1=CC(C=O)=C(O)C=C1 MC33170 [0,0,1,1,0,0|1,0,1]=4 1042 B10R2.6 C1=CC=C(C2CO2)C=C1 MC20326 [1,0,0,1,0,0|0,0,2]=4 1043 B10R2.6 C1=CC=C(C2CO2)C=C1 MC445226 [1,0,0,1,0,0|0,0,2]=4 1044 B10R2.7 C1=CC2=C(C=C1)CSC2 MC114506 [1,0,0,1,0,0|2,0,0]=4 1045 B10R2.7 C1=CC2=C(C=C1)NC=N2 MC41756 [1,0,0,1,0,0|2,0,0]=4 1046 B10R2.7 C1=CC2=C(C=C1)OC=N2 CS10994 [1,0,0,1,0,0|1,0,1]=4 1047 B10R2.7 C1=CC2=C(C=C1)OCC2 CS20929 [1,0,0,1,0,0|0,0,2]=4 1048 B10R2.7 C1=CC2=C(C=C1)SC=C2 CS16362 [1,0,0,1,0,0|0,1,1]=4 1049 B10R2.7 C1=CC2=C(C=C1)SC=N2 CS10992 [1,0,0,1,0,0|1,1,0]=4 1050 B10R2.7 C1=CC=C2CC=CC2=C1 MC20914 [1,0,0,1,0,0|1,0,0]=3 1051 B10R2.7 C1=CC=C2CNCC2=C1 CS11516 [1,0,0,1,0,0|2,0,0]=4 1052 B10R2.7 C1=CC=C2CNCC2=C1 MC442466 [1,0,0,1,0,0|2,0,0]=4 1053 B10R2.7 C1=CC=C2NC=CC2=C1 CS11496 [1,0,0,1,0,0|1,0,1]=4 1054 B10R2.7 C1=CC=C2NCCC2=C1 CS19084 [1,0,0,1,0,0|1,0,1]=4 1055 B10R2.7 C1=CC=C2OC=CC2=C1 CS11169 [1,0,0,1,0,0|0,0,2]=4 1056 B12R2.24 CC1=CC=C2C=CC=NC2=C1 MC20324 [0,1,0,1,0,0|1,0,1]=4 1057 B12R2.24 CC1=CC=C2C=NC=CC2=C1 CS10742 [0,1,0,1,0,0|1,0,1]=4 1058 B12R2.24 CC1=CC=C2CCCCC2=C1 CS10746 [0,1,0,1,0,0|1,0,1]=4 1059 B12R2.24 CC1=CC=C2CCNCC2=C1 CS18155 [0,1,0,1,0,0|1,0,1]=4 1060 B12R2.24 CC1=CC=C2CNCCC2=C1 MC431469 [0,1,0,1,0,0|1,0,1]=4 1061 B12R2.24 CC1=CC=C2N=CC=CC2=C1 CS10066 [0,1,0,1,0,0|1,0,1]=4 1062 B12R2.24 CC1=CC=C2N=CC=NC2=C1 CS15412 [0,1,0,1,0,0|1,0,1]=4 1063 B12R2.132 CC1=CC2=C(C=C1)N=CN2C CS17127 [0,1,0,1,0,0|2,0,0]=4 1064 B12R2.132 CC1=CC2=C(C=C1)ON=C2N CS16622 [0,1,0,1,0,0|2,0,0]=4 1065 B12R2.132 CC1=CC=C2CCC(=O)C2=C1 MC446759 [0,1,0,1,0,0|0,0,0]=2 1066 B12R2.132 CC1=NC=C2OCC(=O)C2=C1 MC102724 [0,1,0,1,0,0|1,0,0]=3 1067 B12R2.132 NC1=CC=C2CCC(=O)C2=C1 MC446750 [0,1,0,1,0,0|1,0,0]=3 1068 B12R2.132 O=C1CCC2=CC=C(Br)C=C12 CS18733 [0,1,0,1,0,0|1,0,0]=3 1069 B12R2.132 O=C1CCC2=CC=C(Cl)C=C12 CS13722 [0,1,0,1,0,0|1,0,0]=3 1070 B12R2.132 O=C1CCC2=CC=C(F)C=C12 MC429567 [0,1,0,1,0,0|1,0,0]=3 1071 B12R2.132 O=C1CCC2=CC=C(I)C=C12 CS19840 [0,1,0,1,0,0|1,0,0]=3 1072 B12R2.132 O=C1CCC2=CC=C(O)C=C12 CS15371 [0,1,0,1,0,0|1,0,0]=3 1073 B12R2.132 O=C1COC2=C1C=C(Br)C=C2 CS18239 [0,1,0,1,0,0|1,0,0]=3 1074 B12R2.132 O=C1COC2=C1C=C(Cl)C=C2 MC428126 [0,1,0,1,0,0|1,0,0]=3 1075 B12R2.132 O=C1COC2=C1C=C(F)C=C2 MC113784 [0,1,0,1,0,0|1,0,0]=3 1076 B12R2.132 O=C1COC2=C1C=C(I)C=C2 MC100482 [0,1,0,1,0,0|1,0,0]=3 1077 B12R2.132 O=C1NCC2=CC=C(Br)C=C12 CS14261 [0,1,0,1,0,0|1,0,0]=3 1078 B12R2.132 O=C1NCC2=NC=C(Br)C=C12 CS17280 [0,1,0,1,0,0|2,0,0]=4 1079 B12R2.132 O=C1NOC2=C1C=C(Br)C=C2 CS15251 [0,1,0,1,0,0|2,0,0]=4 1080 B12R2.132 O=C1NOC2=C1C=C(Cl)C=C2 MC427277 [0,1,0,1,0,0|2,0,0]=4 1081 B12R2.132 O=C1NOC2=C1C=C(F)C=C2 CS16834 [0,1,0,1,0,0|2,0,0]=4 1082 B12R2.132 O=C1OCC2=CC=C(Br)C=C12 CS12535 [0,1,0,1,0,0|1,0,0]=3 1083 B12R2.606 CC1=CC2=C(C=C1)N=C(C)N2 MC425571 [0,1,0,1,0,0|2,0,0]=4 1084 B12R2.606 CC1=CC2=C(C=C1)N=C(S)S2 MC31092 [0,1,0,1,0,0|1,1,0]=4 1085 B12R2.606 CC1=CC2=C(C=C1)OC(C)=N2 CS11036 [0,1,0,1,0,0|2,0,0]=4 1086 B12R2.606 CC1=CC2=C(C=C1)SC(N)=N2 CS10859 [0,1,0,1,0,0|2,0,0]=4 1087 B12R2.606 CC1=CC=C2C=C(C)NC2=C1 CS15359 [0,1,0,1,0,0|1,0,1]=4 1088 B12R2.606 CC1=CC=C2CC(=O)NC2=C1 CS10744 [0,1,0,1,0,0|0,0,0]=2 1089 B12R2.606 CC1=CC=C2NC(=O)CC2=C1 CS15472 [0,1,0,1,0,0|1,0,0]=3 1090 B12R2.606 CC1=CC=C2NC(C)=CC2=C1 CS10011 [0,1,0,1,0,0|2,0,0]=4 1091 B12R2.606 NC1=CC2=C(C=C1)NC(=O)N2 CS10376 [0,1,0,1,0,0|2,0,0]=4 1092 B12R2.606 NC1=CC2=C(C=C1)OC(=O)N2 MC111395 [0,1,0,1,0,0|2,0,0]=4 1093 B12R2.606 NC1=CC=C2CC(=O)NC2=C1 CS21571 [0,1,0,1,0,0|1,0,0]=3 1094 B12R2.606 NC1=CC=C2NC(=O)CC2=C1 MC427120 [0,1,0,1,0,0|2,0,0]=4 1095 B12R2.606 NC1=CC=C2NC(=O)CC2=C1 MC446685 [0,1,0,1,0,0|2,0,0]=4 1096 B12R2.606 O=C1CC2=CC(Br)=CC=C2N1 CS22042 [0,1,0,1,0,0|2,0,0]=4 1097 B12R2.606 O=C1CC2=CC(Cl)=CC=C2N1 CS22052 [0,1,0,1,0,0|2,0,0]=4 1098 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 CS22061 [0,1,0,1,0,0|2,0,0]=4 1099 B12R2.606 O=C1CC2=CC=C(Br)C=C2N1 CS20688 [0,1,0,1,0,0|1,0,0]=3 1100 B12R2.606 O=C1CC2=CC=C(Cl)C=C2N1 CS22102 [0,1,0,1,0,0|1,0,0]=3 1101 B12R2.606 O=C1CC2=CC=C(F)C=C2N1 CS22112 [0,1,0,1,0,0|1,0,0]=3 1102 B12R2.606 O=C1CC2=NC=C(Br)C=C2N1 MC113015 [0,1,0,1,0,0|2,0,0]=4 1103 B12R2.606 O=C1CC2=NC=C(Cl)C=C2N1 MC113035 [0,1,0,1,0,0|2,0,0]=4 1104 B12R2.606 O=C1CC2=NC=C(F)C=C2N1 MC111563 [0,1,0,1,0,0|2,0,0]=4 1105 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)N1 CS18286 [0,1,0,1,0,0|2,0,0]=4 1106 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)O1 CS13902 [0,1,0,1,0,0|2,0,0]=4 1107 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)S1 CS15336 [0,1,0,1,0,0|2,0,0]=4 1108 B12R2.606 O=C1NC2=C(C=C(Cl)C=C2)N1 CS10315 [0,1,0,1,0,0|2,0,0]=4 1109 B12R2.606 O=C1NC2=C(C=C(Cl)C=C2)S1 MC31174 [0,1,0,1,0,0|2,0,0]=4 1110 B12R2.606 O=C1NC2=C(C=C(F)C=C2)N1 MC425675 [0,1,0,1,0,0|2,0,0]=4 1111 B12R2.606 O=C1NC2=C(C=C(F)C=C2)S1 MC31175 [0,1,0,1,0,0|2,0,0]=4 1112 B12R2.606 O=C1NC2=C(C=C(I)C=C2)N1 MC101888 [0,1,0,1,0,0|2,0,0]=4 1113 B12R2.606 O=C1NC2=C(C=CC(Br)=C2)O1 MC443377 [0,1,0,1,0,0|2,0,0]=4 1114 B12R2.246 CC1=CC2=C(OC=C2)C(Br)=C1 MC441295 [0,1,0,1,0,0|2,0,0]=4 1115 B12R2.44 BrCC1=CC2=C(C=C1)SC=N2 MC431373 [0,1,0,1,0,0|2,0,0]=4 1116 B12R2.44 COC1=CC2=C(C=C1)N=CN2 MC425785 [0,1,0,1,0,0|2,0,0]=4 1117 B12R2.44 COC1=CC2=C(C=C1)N=CS2 CS10718 [0,1,0,1,0,0|1,1,0]=4 1118 B12R2.44 COC1=CC2=C(C=C1)SC=C2 MC111400 [0,1,0,1,0,0|2,0,0]=4 1119 B12R2.44 COC1=CC2=C(C=CO2)C=C1 CS16497 [0,1,0,1,0,0|0,0,2]=4 1120 B12R2.44 COC1=CC2=C(C=CS2)C=C1 CS16120 [0,1,0,1,0,0|0,1,1]=4 1121 B12R2.44 COC1=CC=C2C=CNC2=C1 MC20057 [0,1,0,1,0,0|1,0,1]=4 1122 B12R2.44 COC1=CC=C2CCNC2=C1 MC20447 [0,1,0,1,0,0|1,0,1]=4 1123 B12R2.44 COC1=CC=C2CNCC2=C1 CS12707 [0,1,0,1,0,0|2,0,0]=4 1124 B12R2.44 COC1=CC=C2CNCC2=C1 MC100224 [0,1,0,1,0,0|2,0,0]=4 1125 B12R2.44 COC1=CC=C2NC=CC2=C1 CS22068 [0,1,0,1,0,0|2,0,0]=4 1126 B12R2.44 CSC1=CC=C2NC=CC2=C1 MC106667 [0,1,0,1,0,0|2,0,0]=4 1127 B12R2.44 NCC1=CC2=C(C=CS2)C=C1 MC107109 [0,1,0,1,0,0|0,1,1]=4 1128 B12R2.44 NCC1=CC=C2NC=CC2=C1 MC425742 [0,1,0,1,0,0|2,0,0]=4 1129 B12R2.44 OCC1=CC2=C(C=C1)CCO2 MC442824 [0,1,0,1,0,0|0,0,2]=4 1130 B12R2.44 OCC1=CC2=C(C=C1)N=CS2 MC427238 [0,1,0,1,0,0|1,1,0]=4 1131 B12R2.82 CC1=C(Br)C2=C(C=C1)NC=N2 MC430306 [0,1,0,1,0,0|2,0,0]=4 1132 B12R2.82 CC1=C(Cl)C2=C(C=C1)NC=N2 MC430305 [0,1,0,1,0,0|2,0,0]=4 1133 B12R2.82 CC1=C(F)C2=C(C=C1)NC=N2 MC430311 [0,1,0,1,0,0|2,0,0]=4 1134 B12R2.82 CC1=CC=C2NC=CC2=C1Br CS16082 [0,1,0,1,0,0|2,0,0]=4 1135 B12R2.82 CC1=CC=C2NC=CC2=C1F MC432493 [0,1,0,1,0,0|2,0,0]=4 1136 B12R2.100 CC1=C(Br)C=C2C=CNC2=C1 MC107268 [0,1,0,1,0,0|1,0,1]=4 1137 B12R2.100 CC1=C(Br)C=C2NC=CC2=C1 CS10653 [0,1,0,1,0,0|2,0,0]=4 1138 B12R2.100 CC1=C(Cl)C=C2C=CNC2=C1 CS10342 [0,1,0,1,0,0|1,0,1]=4 1139 B12R2.100 CC1=CC2=C(C=C1Br)N=CN2 MC33449 [0,1,0,1,0,0|2,0,0]=4 1140 B12R2.100 CC1=CC2=C(C=C1C)NC=N2 MC20410 [0,1,0,1,0,0|2,0,0]=4 1141 B8R1.1 CC1=CC(C=O)=CS1 MC443650 [1,0,0,0,1,0|1,0,0]=3 1142 B8R1.1 CC1=CC=C(C=O)N1 CS10436 [1,0,0,0,1,0|1,0,0]=3 1143 B8R1.1 CC1=CC=C(C=O)S1 MC20284 [1,0,0,0,1,0|1,0,0]=3 1144 B8R1.1 CC1=CN=C(C=O)S1 MC425517 [1,0,0,0,1,0|2,0,0]=4 1145 B8R1.1 CC1=COC(C=O)=C1 MC104341 [1,0,0,0,1,0|1,0,0]=3 1146 B8R1.1 CC1=COC(C=O)=N1 MC104070 [1,0,0,0,1,0|2,0,0]=4 1147 B8R1.1 CC1=COC(CN)=C1 MC105034 [1,0,0,0,1,0|2,0,0]=4 1148 B8R1.1 CC1=CSC(C=O)=N1 MC431095 [1,0,0,0,1,0|2,0,0]=4 1149 B8R1.1 CC1=NC=C(C=O)S1 MC21171 [1,0,0,0,1,0|2,0,0]=4 1150 B8R1.1 CC1=NSC(C=O)=C1 MC116147 [1,0,0,0,1,0|2,0,0]=4 1151 B8R1.1 CN1C=C(C=O)C=N1 CS18189 [1,0,0,0,1,0|2,0,0]=4 1152 B8R1.1 CN1C=CC(C=O)=N1 CS18204 [1,0,0,0,1,0|2,0,0]=4 1153 B8R1.1 O=CC1=CC(Br)=CN1 CS14432 [1,0,0,0,1,0|2,0,0]=4 1154 B8R1.1 O=CC1=CC(Br)=CO1 CS22678 [1,0,0,0,1,0|2,0,0]=4 1155 B8R1.1 O=CC1=CC(Br)=CS1 CS22689 [1,0,0,0,1,0|2,0,0]=4 1156 B8R1.1 O=CC1=CC(Cl)=CN1 MC104758 [1,0,0,0,1,0|2,0,0]=4 1157 B8R1.1 O=CC1=CC(F)=CS1 MC114664 [1,0,0,0,1,0|2,0,0]=4 1158 B8R1.1 O=CC1=CC(I)=CS1 CS16582 [1,0,0,0,1,0|2,0,0]=4 1159 B8R1.1 O=CC1=CC=C(Br)S1 CS18323 [1,0,0,0,1,0|2,0,0]=4 1160 B8R1.1 O=CC1=CC=C(I)O1 MC430408 [1,0,0,0,1,0|2,0,0]=4 1161 B8R1.1 O=CC1=CSC(Br)=C1 MC103292 [1,0,0,0,1,0|2,0,0]=4 1162 B8R1.8 O=CCC1=CC=CS1 CS17423 [1,0,0,0,1,0|1,0,0]=3