0 B9R1.8 BrCCC1=CC=CC=C1 MC40571 [0,0,0,0,0,0|1,0,0]=1 1 B9R1.8 Br[Zn]Cc1ccccc1 MC121333 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.8 CCCC1=CC=CN=C1 CS22402 [0,0,0,0,0,0|2,0,0]=2 3 B9R1.8 CCNC1=CC=CC=C1 MC40913 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.8 CCOC1=NC=CC=C1 CS18732 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.8 CCOC1=NC=CN=C1 CS21524 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.8 CNCC1=CC=CC=C1 MC10559 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.8 CNCC1=CC=CC=C1 MC20323 [0,0,0,0,0,0|2,0,0]=2 8 B9R1.8 CNCC1=CC=CC=C1 MC21006 [0,0,0,0,0,0|2,0,0]=2 9 B9R1.8 CNCC1=CC=CN=C1 CS18846 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.8 CNCC1=CN=CN=C1 MC103834 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.8 COCC1=NC=CC=C1 CS20909 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.8 ClCCC1=CC=CC=C1 MC40609 [0,0,0,0,0,0|1,0,0]=1 13 B9R1.8 ClCCC1=CC=NC=C1 CS17913 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.8 FCCC1=CC=CC=C1 MC41557 [0,0,0,0,0,0|1,0,0]=1 15 B9R1.8 N#CCC1=CC=CN=C1 CS18407 [0,0,0,0,0,0|1,0,2]=3 16 B9R1.8 N#CCC1=CC=CN=N1 MC102380 [0,0,0,0,0,0|2,0,2]=4 17 B9R1.8 N#CCC1=CC=NC=C1 CS20239 [0,0,0,0,0,0|1,0,2]=3 18 B9R1.8 N#CCC1=CN=CN=C1 MC102280 [0,0,0,0,0,0|2,0,2]=4 19 B9R1.8 N#CCC1=CN=NC=C1 MC121078 [0,0,0,0,0,0|2,0,2]=4 20 B9R1.8 N#CCC1=NC=CC=C1 CS18926 [0,0,0,0,0,0|1,0,2]=3 21 B9R1.8 N#CCC1=NC=CC=N1 MC444200 [0,0,0,0,0,0|2,0,2]=4 22 B9R1.8 N#CCC1=NC=NC=C1 MC101900 [0,0,0,0,0,0|2,0,2]=4 23 B9R1.8 NCCC1=CC=CC=C1 MC40983 [0,0,0,0,0,0|0,0,0]=0 24 B9R1.8 NCCC1=CC=CN=C1 CS21892 [0,0,0,0,0,0|1,0,0]=1 25 B9R1.8 NCCC1=NC=CC=C1 CS14064 [0,0,0,0,0,0|1,0,0]=1 26 B9R1.8 NCCC1=NC=NC=C1 MC104796 [0,0,0,0,0,0|2,0,0]=2 27 B9R1.8 NNCC1=CC=CC=C1 CS11006 [0,0,0,0,0,0|1,0,0]=1 28 B9R1.8 NNCC1=CC=CC=C1 CS12127 [0,0,0,0,0,0|1,0,0]=1 29 B9R1.8 NNCC1=CC=CN=C1 MC111189 [0,0,0,0,0,0|2,0,0]=2 30 B9R1.8 NNCC1=CC=CN=C1 MC111240 [0,0,0,0,0,0|2,0,0]=2 31 B9R1.8 NNCC1=CC=CN=N1 MC104509 [0,0,0,0,0,0|3,0,0]=3 32 B9R1.8 NNCC1=CC=NC=C1 MC111241 [0,0,0,0,0,0|2,0,0]=2 33 B9R1.8 NNCC1=CN=CN=C1 MC112988 [0,0,0,0,0,0|3,0,0]=3 34 B9R1.8 NNCC1=CN=NC=C1 MC103925 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.8 NNCC1=NC=CC=C1 MC111239 [0,0,0,0,0,0|2,0,0]=2 36 B9R1.8 NNCC1=NC=CC=N1 MC102372 [0,0,0,0,0,0|3,0,0]=3 37 B9R1.8 NNCC1=NC=CN=C1 MC105289 [0,0,0,0,0,0|3,0,0]=3 38 B9R1.8 NOCC1=CC=CC=C1 CS14063 [0,0,0,0,0,0|1,0,0]=1 39 B9R1.8 O=C=NC1=CC=CC=C1 MC41051 [0,0,0,0,0,0|2,0,1]=3 40 B9R1.8 O=CCC1=CC=CN=C1 MC106360 [0,0,0,0,0,0|2,0,1]=3 41 B9R1.8 O=CCC1=CC=NC=C1 MC106357 [0,0,0,0,0,0|2,0,1]=3 42 B9R1.8 O=CCC1=NC=CC=N1 MC105911 [0,0,0,0,0,0|3,0,1]=4 43 B9R1.8 O=CNC1=CC=CC=C1 MC40924 [0,0,0,0,0,0|2,0,1]=3 44 B9R1.8 O=COC1=CC=CC=C1 MC40136 [0,0,0,0,0,0|2,0,1]=3 45 B9R1.8 OCCC1=CC=CC=C1 MC40745 [0,0,0,0,0,0|1,0,0]=1 46 B9R1.8 OCCC1=CN=CN=C1 CS12401 [0,0,0,0,0,0|3,0,0]=3 47 B9R1.8 ONCC1=CC=CC=C1 CS11753 [0,0,0,0,0,0|2,0,0]=2 48 B9R1.8 S=C=NC1=CC=CN=C1 MC41635 [0,0,0,0,0,0|3,0,1]=4 49 B8R1.2 BrCC1=CC=CN=N1 CS15758 [1,0,0,0,0,0|3,0,0]=4 50 B8R1.2 BrCC1=CC=NC=C1 CS22459 [1,0,0,0,0,0|2,0,0]=3 51 B8R1.2 BrCC1=CC=NC=C1 MC111773 [1,0,0,0,0,0|2,0,0]=3 52 B8R1.2 BrCC1=CN=CN=C1 CS17938 [1,0,0,0,0,0|3,0,0]=4 53 B8R1.2 BrCC1=NC=CC=N1 MC110628 [1,0,0,0,0,0|3,0,0]=4 54 B8R1.2 BrCC1=NC=CN=C1 MC115921 [1,0,0,0,0,0|3,0,0]=4 55 B8R1.2 Br[Mg]c1cccnc1 MC121318 [1,0,0,0,0,0|3,0,0]=4 56 B8R1.2 Br[Zn]c1ccccn1 MC121328 [1,0,0,0,0,0|3,0,0]=4 57 B8R1.2 Br[Zn]c1cccnc1 MC121329 [1,0,0,0,0,0|3,0,0]=4 58 B8R1.2 C#CC1=CC=CC=C1 CS19127 [1,0,0,0,0,0|0,0,2]=3 59 B8R1.2 C#CC1=CC=NC=C1 CS22825 [1,0,0,0,0,0|1,0,2]=4 60 B8R1.2 C#CC1=NC=CC=C1 CS21539 [1,0,0,0,0,0|1,0,2]=4 61 B8R1.2 CCC1=CC=CC=C1 MC41556 [1,0,0,0,0,0|0,0,0]=1 62 B8R1.2 CCC1=CC=CN=C1 CS22277 [1,0,0,0,0,0|1,0,0]=2 63 B8R1.2 CCC1=NC=CN=C1 CS21534 [1,0,0,0,0,0|2,0,0]=3 64 B8R1.2 CNC1=CC=CC=C1 CS11792 [1,0,0,0,0,0|1,0,0]=2 65 B8R1.2 CNC1=CC=CN=C1 CS13856 [1,0,0,0,0,0|2,0,0]=3 66 B8R1.2 CNC1=CC=NC=C1 MC41620 [1,0,0,0,0,0|2,0,0]=3 67 B8R1.2 COC1=CC=CC=C1 MC41309 [1,0,0,0,0,0|1,0,0]=2 68 B8R1.2 COC1=CC=CN=C1 CS22348 [1,0,0,0,0,0|2,0,0]=3 69 B8R1.2 COC1=CC=CN=N1 CS22347 [1,0,0,0,0,0|3,0,0]=4 70 B8R1.2 COC1=CC=NC=C1 CS19206 [1,0,0,0,0,0|2,0,0]=3 71 B8R1.2 COC1=CN=CN=C1 MC428182 [1,0,0,0,0,0|3,0,0]=4 72 B8R1.2 COC1=CN=NC=C1 MC427243 [1,0,0,0,0,0|3,0,0]=4 73 B8R1.2 COC1=NC=CC=C1 CS18780 [1,0,0,0,0,0|2,0,0]=3 74 B8R1.2 COC1=NC=CN=C1 CS17887 [1,0,0,0,0,0|3,0,0]=4 75 B8R1.2 CSC1=CC=CC=C1 MC439137 [1,0,0,0,0,0|1,0,0]=2 76 B8R1.2 CSC1=NC=CC=C1 MC41628 [1,0,0,0,0,0|2,0,0]=3 77 B8R1.2 ClCC1=CC=CN=C1 CS19291 [1,0,0,0,0,0|2,0,0]=3 78 B8R1.2 ClCC1=CC=CN=N1 CS16004 [1,0,0,0,0,0|3,0,0]=4 79 B8R1.2 ClCC1=CC=CN=N1 MC112985 [1,0,0,0,0,0|3,0,0]=4 80 B8R1.2 ClCC1=CN=CN=C1 MC444367 [1,0,0,0,0,0|3,0,0]=4 81 B8R1.2 ClCC1=NC=CC=C1 CS19289 [1,0,0,0,0,0|2,0,0]=3 82 B8R1.2 ClCC1=NC=CC=N1 CS20902 [1,0,0,0,0,0|3,0,0]=4 83 B8R1.2 ClCC1=NC=CN=C1 MC444156 [1,0,0,0,0,0|3,0,0]=4 84 B8R1.2 ICC1=CC=CC=C1 CS11000 [1,0,0,0,0,0|1,0,0]=2 85 B8R1.2 ICC1=CC=CN=C1 MC430640 [1,0,0,0,0,0|2,0,0]=3 86 B8R1.2 I[Zn]c1ccccc1 MC121332 [1,0,0,0,0,0|2,0,0]=3 87 B8R1.2 N#CC1=CC=CC=C1 MC40623 [1,0,0,0,0,0|0,0,2]=3 88 B8R1.2 N#CC1=CC=NC=C1 MC427074 [1,0,0,0,0,0|1,0,2]=4 89 B8R1.2 N#CC1=CN=CC=C1 CS22263 [1,0,0,0,0,0|1,0,2]=4 90 B8R1.2 N#CC1=NC=CC=C1 CS19642 [1,0,0,0,0,0|1,0,2]=4 91 B8R1.2 N#Cc1ccccc1 CS13696 [1,0,0,0,0,0|0,0,2]=3 92 B8R1.2 NCC1=CC=CC=C1 MC40797 [1,0,0,0,0,0|0,0,0]=1 93 B8R1.2 NCC1=CC=CN=C1 CS14226 [1,0,0,0,0,0|1,0,0]=2 94 B8R1.2 NCC1=CC=CN=N1 MC444234 [1,0,0,0,0,0|2,0,0]=3 95 B8R1.2 NCC1=CC=NC=C1 CS11906 [1,0,0,0,0,0|1,0,0]=2 96 B8R1.2 NCC1=CC=NC=C1 CS19023 [1,0,0,0,0,0|1,0,0]=2 97 B8R1.2 NCC1=CN=CN=C1 MC444384 [1,0,0,0,0,0|2,0,0]=3 98 B8R1.2 NCC1=CN=NC=C1 CS15014 [1,0,0,0,0,0|2,0,0]=3 99 B8R1.2 NCC1=CN=NC=C1 CS15515 [1,0,0,0,0,0|2,0,0]=3 100 B8R1.2 NCC1=CN=NC=C1 MC444324 [1,0,0,0,0,0|2,0,0]=3 101 B8R1.2 NCC1=NC=CC=N1 CS21304 [1,0,0,0,0,0|2,0,0]=3 102 B8R1.2 NCC1=NC=CC=N1 MC425460 [1,0,0,0,0,0|2,0,0]=3 103 B8R1.2 NCC1=NC=CN=C1 CS19691 [1,0,0,0,0,0|2,0,0]=3 104 B8R1.2 NCC1=NC=CN=C1 CS20245 [1,0,0,0,0,0|2,0,0]=3 105 B8R1.2 NCC1=NC=NC=C1 MC444325 [1,0,0,0,0,0|2,0,0]=3 106 B8R1.2 NNC1=CC=CC=C1 CS15210 [1,0,0,0,0,0|1,0,0]=2 107 B8R1.2 NNC1=CC=CC=C1 MC427075 [1,0,0,0,0,0|1,0,0]=2 108 B8R1.2 NNC1=CC=CN=C1 CS15491 [1,0,0,0,0,0|2,0,0]=3 109 B8R1.2 NNC1=CC=CN=C1 CS22308 [1,0,0,0,0,0|2,0,0]=3 110 B8R1.2 NNC1=CC=NC=C1 MC20777 [1,0,0,0,0,0|2,0,0]=3 111 B8R1.2 NNC1=CN=CN=C1 MC104575 [1,0,0,0,0,0|3,0,0]=4 112 B8R1.2 NNC1=NC=CC=C1 CS15589 [1,0,0,0,0,0|2,0,0]=3 113 B8R1.2 NNC1=NC=CC=C1 CS21573 [1,0,0,0,0,0|2,0,0]=3 114 B8R1.2 NNC1=NC=CC=N1 MC425172 [1,0,0,0,0,0|3,0,0]=4 115 B8R1.2 NNC1=NC=CN=C1 MC444188 [1,0,0,0,0,0|3,0,0]=4 116 B8R1.2 O=CC1=CN=CC=C1 CS19090 [1,0,0,0,0,0|2,0,1]=4 117 B8R1.2 O=CC1=NC=CC=C1 CS18610 [1,0,0,0,0,0|2,0,1]=4 118 B8R1.2 O=NC1=CC=CC=C1 MC33163 [1,0,0,0,0,0|2,0,0]=3 119 B8R1.2 OCC1=CC=CC=C1 MC40684 [1,0,0,0,0,0|1,0,0]=2 120 B8R1.2 OCC1=CC=CN=C1 CS22409 [1,0,0,0,0,0|2,0,0]=3 121 B8R1.2 OCC1=CC=CN=N1 CS21870 [1,0,0,0,0,0|3,0,0]=4 122 B8R1.2 OCC1=CC=NC=C1 CS19163 [1,0,0,0,0,0|2,0,0]=3 123 B8R1.2 OCC1=CN=CN=C1 MC444370 [1,0,0,0,0,0|3,0,0]=4 124 B8R1.2 OCC1=CN=NC=C1 MC444363 [1,0,0,0,0,0|3,0,0]=4 125 B8R1.2 OCC1=NC=CC=C1 CS19164 [1,0,0,0,0,0|2,0,0]=3 126 B8R1.2 OCC1=NC=CC=N1 CS19924 [1,0,0,0,0,0|3,0,0]=4 127 B8R1.2 OCC1=NC=CN=C1 CS21749 [1,0,0,0,0,0|3,0,0]=4 128 B8R1.2 OCC1=NC=NC=C1 CS11915 [1,0,0,0,0,0|3,0,0]=4 129 B8R1.2 SCC1=NC=CN=C1 MC110936 [1,0,0,0,0,0|3,0,0]=4 130 B10R1.1 Br[Zn]Cc1ccc(Br)cc1 MC121353 [0,1,0,0,0,0|2,0,0]=3 131 B10R1.1 C=COC1=CC=C(I)C=C1 MC103309 [0,1,0,0,0,0|2,0,1]=4 132 B10R1.1 CC1=CC=C(CC#N)C=C1 CS21709 [0,1,0,0,0,0|0,0,2]=3 133 B10R1.1 CC1=CC=C(CCBr)C=C1 CS19977 [0,1,0,0,0,0|1,0,0]=2 134 B10R1.1 CC1=CC=C(CCN)C=C1 CS18979 [0,1,0,0,0,0|0,0,0]=1 135 B10R1.1 CC1=CC=C(CCO)C=C1 MC40744 [0,1,0,0,0,0|1,0,0]=2 136 B10R1.1 CC1=CC=C(CNN)C=C1 CS20201 [0,1,0,0,0,0|1,0,0]=2 137 B10R1.1 CCCC1=CC=C(Br)C=C1 CS10896 [0,1,0,0,0,0|1,0,0]=2 138 B10R1.1 CCOC1=CC=C(Br)C=C1 MC446797 [0,1,0,0,0,0|2,0,0]=3 139 B10R1.1 CCOC1=CC=C(I)C=C1 CS22907 [0,1,0,0,0,0|2,0,0]=3 140 B10R1.1 CCOC1=CC=C(N)C=C1 CS11879 [0,1,0,0,0,0|2,0,0]=3 141 B10R1.1 CCOC1=CN=C(N)C=C1 CS15063 [0,1,0,0,0,0|3,0,0]=4 142 B10R1.1 CCOC1=NC=C(Br)C=C1 CS22026 [0,1,0,0,0,0|3,0,0]=4 143 B10R1.1 CCOC1=NC=C(N)C=C1 CS14713 [0,1,0,0,0,0|3,0,0]=4 144 B10R1.1 CNCC1=CC=C(Br)C=C1 CS19272 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.1 CNCC1=CC=C(C)C=C1 CS11795 [0,1,0,0,0,0|2,0,0]=3 146 B10R1.1 CSCC1=NC=C(Br)C=C1 MC112104 [0,1,0,0,0,0|3,0,0]=4 147 B10R1.1 ClC1=CC=C(CCBr)C=C1 CS10835 [0,1,0,0,0,0|1,0,0]=2 148 B10R1.1 ClCCC1=CC=C(Cl)C=C1 MC433885 [0,1,0,0,0,0|1,0,0]=2 149 B10R1.1 FC1=CC=C(CCBr)C=C1 CS10866 [0,1,0,0,0,0|1,0,0]=2 150 B10R1.1 FC1=CC=C(N=C=S)C=C1 MC41072 [0,1,0,0,0,0|2,0,1]=4 151 B10R1.1 Fc1ccc(C[Zn]Cl)cc1 MC121346 [0,1,0,0,0,0|2,0,0]=3 152 B10R1.1 N#CCC1=CC=C(Br)C=C1 CS20687 [0,1,0,0,0,0|0,0,2]=3 153 B10R1.1 N#CCC1=CC=C(Cl)C=C1 MC20790 [0,1,0,0,0,0|0,0,2]=3 154 B10R1.1 N#CCC1=CC=C(Cl)N=C1 CS19041 [0,1,0,0,0,0|1,0,2]=4 155 B10R1.1 N#CCC1=CC=C(F)C=C1 CS14479 [0,1,0,0,0,0|0,0,2]=3 156 B10R1.1 N#CCC1=CC=C(F)N=C1 MC429490 [0,1,0,0,0,0|1,0,2]=4 157 B10R1.1 N#CCC1=CC=C(I)C=C1 MC40782 [0,1,0,0,0,0|0,0,2]=3 158 B10R1.1 N#CCC1=CC=C(N)C=C1 MC40751 [0,1,0,0,0,0|0,0,2]=3 159 B10R1.1 N#CCC1=NC=C(Br)C=C1 CS19461 [0,1,0,0,0,0|1,0,2]=4 160 B10R1.1 N#CCC1=NC=C(Cl)C=C1 CS15674 [0,1,0,0,0,0|1,0,2]=4 161 B10R1.1 NC1=CC=C(CCO)C=C1 CS13450 [0,1,0,0,0,0|1,0,0]=2 162 B10R1.1 NCCC1=CC=C(Br)C=C1 CS19296 [0,1,0,0,0,0|0,0,0]=1 163 B10R1.1 NCCC1=CC=C(Cl)C=C1 MC40975 [0,1,0,0,0,0|0,0,0]=1 164 B10R1.1 NCCC1=CC=C(F)C=C1 CS13766 [0,1,0,0,0,0|0,0,0]=1 165 B10R1.1 NCCC1=CC=C(N)C=C1 MC33045 [0,1,0,0,0,0|0,0,0]=1 166 B10R1.1 NCCC1=CC=C(O)C=C1 CS22315 [0,1,0,0,0,0|0,0,0]=1 167 B10R1.1 NCCC1=CNC(=O)C=C1 MC33499 [0,1,0,0,0,0|1,0,0]=2 168 B10R1.1 NNCC1=CC=C(F)C=C1 CS17057 [0,1,0,0,0,0|1,0,0]=2 169 B10R1.1 O=C=NC1=CC=C(Br)C=C1 MC41032 [0,1,0,0,0,0|2,0,1]=4 170 B10R1.1 O=C=NC1=CC=C(F)C=C1 MC33036 [0,1,0,0,0,0|2,0,1]=4 171 B10R1.1 O=CCC1=CC=C(Br)C=C1 CS18203 [0,1,0,0,0,0|1,0,1]=3 172 B10R1.1 O=CNC1=CC=C(Cl)C=C1 MC103067 [0,1,0,0,0,0|2,0,1]=4 173 B10R1.1 OC1=CC=C(N=C=S)C=C1 MC106291 [0,1,0,0,0,0|2,0,1]=4 174 B10R1.1 OCCC1=CC=C(Br)C=C1 CS14491 [0,1,0,0,0,0|1,0,0]=2 175 B10R1.1 OCCC1=CC=C(Cl)C=C1 CS22791 [0,1,0,0,0,0|1,0,0]=2 176 B10R1.1 OCCC1=CC=C(F)C=C1 MC33200 [0,1,0,0,0,0|1,0,0]=2 177 B10R1.1 OCCC1=CC=C(I)C=C1 CS12086 [0,1,0,0,0,0|1,0,0]=2 178 B10R1.1 OCCC1=CC=C(O)C=C1 CS20458 [0,1,0,0,0,0|1,0,0]=2 179 B10R1.1 OCCC1=NC=C(Br)C=C1 MC102395 [0,1,0,0,0,0|2,0,0]=3 180 B10R1.1 S=C=NC1=CC=C(Br)C=C1 MC41057 [0,1,0,0,0,0|2,0,1]=4 181 B10R1.1 S=C=NC1=CC=C(Cl)C=C1 MC41059 [0,1,0,0,0,0|2,0,1]=4 182 B10R1.4 Br[Zn]Cc1ccccc1Br MC121351 [0,1,0,0,0,0|2,0,0]=3 183 B10R1.4 CC1=C(CC#N)C=CC=C1 CS11825 [0,1,0,0,0,0|0,0,2]=3 184 B10R1.4 CC1=CC=CN=C1CCN MC33439 [0,1,0,0,0,0|1,0,0]=2 185 B10R1.4 CCOC1=C(Br)C=CC=C1 MC20149 [0,1,0,0,0,0|2,0,0]=3 186 B10R1.4 CCOC1=C(Br)C=NC=C1 MC443330 [0,1,0,0,0,0|3,0,0]=4 187 B10R1.4 CCOC1=C(N)C=CC=C1 CS11823 [0,1,0,0,0,0|2,0,0]=3 188 B10R1.4 CCOC1=C(N)C=CN=C1 MC442472 [0,1,0,0,0,0|3,0,0]=4 189 B10R1.4 CCOC1=C(O)C=CC=C1 MC41194 [0,1,0,0,0,0|2,0,0]=3 190 B10R1.4 CCOC1=CC=CN=C1C MC443397 [0,1,0,0,0,0|3,0,0]=4 191 B10R1.4 CCOC1=CC=CN=C1O MC110935 [0,1,0,0,0,0|3,0,0]=4 192 B10R1.4 CNCC1=C(F)C=CC=C1 MC40828 [0,1,0,0,0,0|2,0,0]=3 193 B10R1.4 COCC1=C(Br)C=CC=C1 MC41399 [0,1,0,0,0,0|2,0,0]=3 194 B10R1.4 FC1=C(N=C=S)C=CC=C1 MC33126 [0,1,0,0,0,0|2,0,1]=4 195 B10R1.4 Fc1ccccc1C[Zn]Cl MC121344 [0,1,0,0,0,0|2,0,0]=3 196 B10R1.4 N#CCC1=C(Br)C=CC=C1 CS10707 [0,1,0,0,0,0|0,0,2]=3 197 B10R1.4 N#CCC1=C(Cl)C=CC=C1 CS21495 [0,1,0,0,0,0|0,0,2]=3 198 B10R1.4 N#CCC1=C(F)C=CC=C1 CS20772 [0,1,0,0,0,0|0,0,2]=3 199 B10R1.4 N#CCC1=C(I)C=CC=C1 MC40781 [0,1,0,0,0,0|0,0,2]=3 200 B10R1.4 N#CCC1=C(N)C=CC=C1 CS20914 [0,1,0,0,0,0|0,0,2]=3 201 B10R1.4 N#CCC1=CC=CN=C1Cl CS13165 [0,1,0,0,0,0|1,0,2]=4 202 B10R1.4 N#CCC1=CC=CN=C1F MC429651 [0,1,0,0,0,0|1,0,2]=4 203 B10R1.4 N#CCC1=NC=CC=C1F MC431782 [0,1,0,0,0,0|1,0,2]=4 204 B10R1.4 NCCC1=C(Br)C=CC=C1 CS15138 [0,1,0,0,0,0|0,0,0]=1 205 B10R1.4 NCCC1=C(F)C=CC=C1 CS14793 [0,1,0,0,0,0|0,0,0]=1 206 B10R1.4 NCCC1=C(N)C=CC=C1 CS15970 [0,1,0,0,0,0|0,0,0]=1 207 B10R1.4 NCCC1=NC=CC=C1Br MC104547 [0,1,0,0,0,0|1,0,0]=2 208 B10R1.4 NCCN1C=CC=CC1=O MC431465 [0,1,0,0,0,0|1,0,0]=2 209 B10R1.4 NNCC1=C(F)C=CC=C1 CS20134 [0,1,0,0,0,0|1,0,0]=2 210 B10R1.4 NNCc1ccccc1F MC443842 [0,1,0,0,0,0|1,0,0]=2 211 B10R1.4 O=C=NC1=C(Br)C=CC=C1 MC41031 [0,1,0,0,0,0|2,0,1]=4 212 B10R1.4 O=C=NC1=C(F)C=CC=C1 MC429405 [0,1,0,0,0,0|2,0,1]=4 213 B10R1.4 O=CCC1=C(F)C=CC=C1 MC431003 [0,1,0,0,0,0|1,0,1]=3 214 B10R1.4 OC1=C(CCI)C=CC=C1 MC430321 [0,1,0,0,0,0|1,0,0]=2 215 B10R1.4 OCCC1=C(Br)C=CC=C1 CS21407 [0,1,0,0,0,0|1,0,0]=2 216 B10R1.4 OCCC1=C(Cl)C=CC=C1 MC40737 [0,1,0,0,0,0|1,0,0]=2 217 B10R1.4 OCCC1=C(F)C=CC=C1 MC33149 [0,1,0,0,0,0|1,0,0]=2 218 B10R1.4 O\N=C\C1=C(F)C=CC=C1 MC106948 [0,1,0,0,0,0|2,0,1]=4 219 B10R1.4 O\N=C\C1=C(F)C=CC=C1 MC433456 [0,1,0,0,0,0|2,0,1]=4 220 B10R1.10 Br[Zn]Cc1cccc(Br)c1 MC121352 [0,1,0,0,0,0|2,0,0]=3 221 B10R1.10 C=CCC1=CC=CC(O)=C1 MC425380 [0,1,0,0,0,0|1,0,1]=3 222 B10R1.10 CC1=CC(CC#N)=CC=C1 CS18941 [0,1,0,0,0,0|0,0,2]=3 223 B10R1.10 CC1=CC(CCO)=CC=C1 CS22372 [0,1,0,0,0,0|1,0,0]=2 224 B10R1.10 CCCc1cccc(F)c1 MC440476 [0,1,0,0,0,0|1,0,0]=2 225 B10R1.10 CCNC1=NC=CC(N)=C1 CS14774 [0,1,0,0,0,0|3,0,0]=4 226 B10R1.10 CCOC1=CC(Br)=NC=C1 MC430483 [0,1,0,0,0,0|3,0,0]=4 227 B10R1.10 CCOC1=CC(N)=NC=C1 MC20309 [0,1,0,0,0,0|3,0,0]=4 228 B10R1.10 CCOC1=CC=CC(N)=N1 MC33459 [0,1,0,0,0,0|3,0,0]=4 229 B10R1.10 CCOC1=CN=CC(Br)=C1 MC107004 [0,1,0,0,0,0|3,0,0]=4 230 B10R1.10 CCOC1=CN=CC(Cl)=C1 MC443271 [0,1,0,0,0,0|3,0,0]=4 231 B10R1.10 CCOC1=NC=CC(Cl)=C1 MC113277 [0,1,0,0,0,0|3,0,0]=4 232 B10R1.10 CNCC1=CC(F)=CN=C1 MC105914 [0,1,0,0,0,0|3,0,0]=4 233 B10R1.10 CNCC1=NC=CC(Cl)=C1 MC102697 [0,1,0,0,0,0|3,0,0]=4 234 B10R1.10 COCC1=CC(Cl)=NC=C1 MC425095 [0,1,0,0,0,0|3,0,0]=4 235 B10R1.10 FC1=CC(N=C=S)=CC=C1 MC33130 [0,1,0,0,0,0|2,0,1]=4 236 B10R1.10 FC1=CC=CC(CCBr)=C1 MC40572 [0,1,0,0,0,0|1,0,0]=2 237 B10R1.10 Fc1cccc(C[Zn]Cl)c1 MC121345 [0,1,0,0,0,0|2,0,0]=3 238 B10R1.10 N#CCC1=CC(Br)=CC=C1 CS18969 [0,1,0,0,0,0|0,0,2]=3 239 B10R1.10 N#CCC1=CC(Cl)=CC=C1 CS13745 [0,1,0,0,0,0|0,0,2]=3 240 B10R1.10 N#CCC1=CC(F)=CC=C1 MC20212 [0,1,0,0,0,0|0,0,2]=3 241 B10R1.10 N#CCC1=CC(F)=CN=C1 MC102190 [0,1,0,0,0,0|1,0,2]=4 242 B10R1.10 N#CCC1=CC(N)=CC=C1 MC433930 [0,1,0,0,0,0|0,0,2]=3 243 B10R1.10 N#CCC1=NC=CC(Br)=C1 CS17276 [0,1,0,0,0,0|1,0,2]=4 244 B10R1.10 NC1=CC=CC(CCO)=C1 CS22105 [0,1,0,0,0,0|1,0,0]=2 245 B10R1.10 NCCC1=CC(Br)=CC=C1 CS15159 [0,1,0,0,0,0|0,0,0]=1 246 B10R1.10 NCCC1=CC(F)=CC=C1 MC40979 [0,1,0,0,0,0|0,0,0]=1 247 B10R1.10 NNCC1=CC(O)=CC=C1 MC10382 [0,1,0,0,0,0|1,0,0]=2 248 B10R1.10 O=C=NC1=CC(F)=CC=C1 MC41043 [0,1,0,0,0,0|2,0,1]=4 249 B10R1.10 O=CCC1=CC(O)=CC=C1 MC106361 [0,1,0,0,0,0|1,0,1]=3 250 B10R1.10 OCCC1=CC(Br)=CC=C1 CS22186 [0,1,0,0,0,0|1,0,0]=2 251 B10R1.10 OCCC1=CC(Cl)=CC=C1 CS22241 [0,1,0,0,0,0|1,0,0]=2 252 B10R1.10 OCCC1=CC(F)=CC=C1 MC40743 [0,1,0,0,0,0|1,0,0]=2 253 B10R1.10 S=C=NC1=CC(I)=CC=C1 MC41073 [0,1,0,0,0,0|2,0,1]=4 254 B10R1.15 C#CC(O)C1=CC=NC=C1 CS16716 [0,1,0,0,0,0|2,0,1]=4 255 B10R1.15 C=C(C#N)C1=CC=CC=C1 MC106124 [0,1,0,0,0,0|0,0,3]=4 256 B10R1.15 C=C(CBr)C1=CC=CC=C1 CS20091 [0,1,0,0,0,0|1,0,1]=3 257 B10R1.15 C=CC(N)C1=CC=CC=C1 MC102512 [0,1,0,0,0,0|1,0,1]=3 258 B10R1.15 CC(CN)C1=CC=CC=C1 CS10909 [0,1,0,0,0,0|0,0,0]=1 259 B10R1.15 CC(CN)c1ccccc1 MC110750 [0,1,0,0,0,0|0,0,0]=1 260 B10R1.15 CC(NO)c1ccccc1 MC103844 [0,1,0,0,0,0|2,0,0]=3 261 B10R1.15 CC(NO)c1ccccc1 MC103845 [0,1,0,0,0,0|2,0,0]=3 262 B10R1.15 CCC(C)C1=CC=CC=C1 CS11947 [0,1,0,0,0,0|1,0,0]=2 263 B10R1.15 CCC(C)C1=CC=CC=C1 MC433489 [0,1,0,0,0,0|1,0,0]=2 264 B10R1.15 CCC(N)C1=CC=CC=C1 MC20337 [0,1,0,0,0,0|1,0,0]=2 265 B10R1.15 CCC(N)C1=NC=CN=C1 MC104764 [0,1,0,0,0,0|3,0,0]=4 266 B10R1.15 CN(C=O)C1=CC=CC=C1 CS11793 [0,1,0,0,0,0|2,0,1]=4 267 B10R1.15 COC(=O)C1=CC=CC=C1 MC40065 [0,1,0,0,0,0|2,0,1]=4 268 B10R1.15 FC(CBr)C1=CC=CC=C1 MC102769 [0,1,0,0,0,0|1,0,0]=2 269 B10R1.15 N#CC(N)C1=CC=CC=C1 MC31161 [0,1,0,0,0,0|0,0,2]=3 270 B10R1.15 NC(CO)C1=CC=CC=C1 CS10553 [0,1,0,0,0,0|1,0,0]=2 271 B10R1.15 NC(CO)C1=CC=CC=C1 CS10555 [0,1,0,0,0,0|1,0,0]=2 272 B10R1.15 NC(CO)C1=CC=CC=C1 CS15860 [0,1,0,0,0,0|1,0,0]=2 273 B10R1.15 NC(CO)C1=NC=CC=C1 MC111155 [0,1,0,0,0,0|2,0,0]=3 274 B10R1.15 NCC(=O)C1=CC=CC=C1 CS10874 [0,1,0,0,0,0|0,0,1]=2 275 B10R1.15 NCC(=O)C1=NC=CC=C1 MC33498 [0,1,0,0,0,0|1,0,1]=3 276 B10R1.15 NCC(O)C1=CC=CC=C1 CS20485 [0,1,0,0,0,0|0,0,0]=1 277 B10R1.15 NCC(O)C1=CC=CC=C1 MC444625 [0,1,0,0,0,0|0,0,0]=1 278 B10R1.15 NCC(O)C1=CC=CN=C1 MC103058 [0,1,0,0,0,0|1,0,0]=2 279 B10R1.15 NCC(O)C1=NC=CC=C1 MC33503 [0,1,0,0,0,0|1,0,0]=2 280 B10R1.15 NNC(=O)C1=CC=CC=C1 CS10971 [0,1,0,0,0,0|1,0,1]=3 281 B10R1.15 NNC(=O)C1=CN=CC=C1 CS19488 [0,1,0,0,0,0|2,0,1]=4 282 B10R1.15 NNC(=O)c1ccncc1 MC445177 [0,1,0,0,0,0|2,0,1]=4 283 B10R1.15 O=C(CBr)C1=CC=CC=C1 CS19274 [0,1,0,0,0,0|1,0,1]=3 284 B10R1.15 O=C(CBr)C1=CC=CN=C1 MC42216 [0,1,0,0,0,0|2,0,1]=4 285 B10R1.15 O=C(CBr)C1=CC=NC=C1 CS20175 [0,1,0,0,0,0|2,0,1]=4 286 B10R1.15 O=C(CCl)C1=CC=CC=C1 MC20159 [0,1,0,0,0,0|1,0,1]=3 287 B10R1.15 O=C(CI)C1=CC=CC=C1 MC433244 [0,1,0,0,0,0|1,0,1]=3 288 B10R1.15 OC(CBr)C1=CC=CC=C1 CS18840 [0,1,0,0,0,0|1,0,0]=2 289 B10R1.15 OC(CCl)C1=CC=CN=C1 MC103059 [0,1,0,0,0,0|2,0,0]=3 290 B10R1.15 OCC(F)C1=CC=CC=C1 MC430923 [0,1,0,0,0,0|1,0,0]=2 291 B10R1.17 BrCCOC1=CC=CC=C1 MC20150 [0,1,0,0,0,0|1,0,0]=2 292 B10R1.17 Br[Zn]CCc1ccccc1 MC121341 [0,1,0,0,0,0|1,0,0]=2 293 B10R1.17 CNCCC1=CC=CC=C1 MC446670 [0,1,0,0,0,0|0,0,0]=1 294 B10R1.17 ClCCOC1=CC=CC=C1 MC33174 [0,1,0,0,0,0|1,0,0]=2 295 B10R1.17 ClC\C=C\C1=CC=CC=C1 MC41818 [0,1,0,0,0,0|1,0,1]=3 296 B10R1.17 N#CC#CC1=CC=CC=C1 CS16032 [0,1,0,0,0,0|0,0,3]=4 297 B10R1.17 NCCCC1=CC=NC=C1 MC425564 [0,1,0,0,0,0|1,0,0]=2 298 B10R1.17 NCCNC1=NC=CC=C1 CS11746 [0,1,0,0,0,0|1,0,0]=2 299 B10R1.17 NCCOC1=CC=CC=C1 CS20484 [0,1,0,0,0,0|0,0,0]=1 300 B10R1.17 NCCOC1=CC=CN=C1 CS16368 [0,1,0,0,0,0|1,0,0]=2 301 B10R1.17 NOCCC1=CC=NC=C1 MC427573 [0,1,0,0,0,0|1,0,0]=2 302 B10R1.17 O=CC#CC1=CC=CC=C1 CS18196 [0,1,0,0,0,0|1,0,2]=4 303 B10R1.17 OCCCC1=CC=NC=C1 CS22019 [0,1,0,0,0,0|2,0,0]=3 304 B10R1.17 OCCOC1=CC=CC=C1 MC41398 [0,1,0,0,0,0|1,0,0]=2 305 B10R1.18 BrC(Br)=CC1=CC=CC=C1 CS16193 [0,1,0,0,0,0|1,0,2]=4 306 B10R1.18 CC(=O)CC1=CC=CN=C1 MC102696 [0,1,0,0,0,0|2,0,1]=4 307 B10R1.18 CC(=O)CC1=CC=NC=C1 CS20988 [0,1,0,0,0,0|2,0,1]=4 308 B10R1.18 CC(=O)CC1=NC=CC=C1 CS20802 [0,1,0,0,0,0|2,0,1]=4 309 B10R1.18 CC(=O)NC1=CC=CC=C1 MC34102 [0,1,0,0,0,0|2,0,1]=4 310 B10R1.18 CC(Br)CC1=CC=CC=C1 MC41813 [0,1,0,0,0,0|1,0,0]=2 311 B10R1.18 CC(C)NC1=CC=CC=C1 CS11787 [0,1,0,0,0,0|2,0,0]=3 312 B10R1.18 CC(C)OC1=CC=CC=C1 MC41360 [0,1,0,0,0,0|2,0,0]=3 313 B10R1.18 FC(F)OC1=CC=CC=C1 MC41385 [0,1,0,0,0,0|2,0,0]=3 314 B10R1.18 FC(F)OC1=NC=CC=C1 MC116213 [0,1,0,0,0,0|3,0,0]=4 315 B10R1.18 FC(F)SC1=CC=CC=C1 MC428027 [0,1,0,0,0,0|2,0,0]=3 316 B10R1.18 NC(=O)CC1=NC=CC=N1 CS17323 [0,1,0,0,0,0|2,0,1]=4 317 B10R1.18 NC(=O)NC1=CC=CC=C1 CS10533 [0,1,0,0,0,0|1,0,1]=3 318 B10R1.18 NC(=O)OC1=CC=CC=C1 MC428148 [0,1,0,0,0,0|1,0,1]=3 319 B10R1.18 NC(=S)NC1=NC=CC=C1 MC427166 [0,1,0,0,0,0|2,0,1]=4 320 B10R1.18 O=C(Cl)OC1=CC=CC=C1 CS18823 [0,1,0,0,0,0|2,0,1]=4 321 B10R1.18 O=C(O)CC1=CC=CN=C1 CS20325 [0,1,0,0,0,0|2,0,1]=4 322 B10R1.18 O=C(O)CC1=CC=NC=C1 CS20327 [0,1,0,0,0,0|2,0,1]=4 323 B10R1.18 O=C(O)CC1=CC=NC=C1 MC41632 [0,1,0,0,0,0|2,0,1]=4 324 B10R1.18 O=C(O)CC1=NC=CC=C1 MC41631 [0,1,0,0,0,0|2,0,1]=4 325 B10R1.18 O=C([O-])CC1=CC=CC=C1 MC34448 [0,1,0,0,0,0|1,0,1]=3 326 B8R0.4 CCC\C=C\C=C\CO CS17006 [0,0,1,0,0,0|2,0,1]=4 327 B10R2.6 C1=CC=C(C2CO2)C=C1 MC20326 [0,0,0,1,0,0|1,0,0]=2 328 B10R2.6 C1=CC=C(C2CO2)C=C1 MC445226 [0,0,0,1,0,0|1,0,0]=2 329 B10R2.7 C1=CC2=C(C=C1)CSC2 MC114506 [0,0,0,1,0,0|2,0,0]=3 330 B10R2.7 C1=CC2=C(C=C1)NC=N2 MC41756 [0,0,0,1,0,0|1,0,1]=3 331 B10R2.7 C1=CC2=C(C=C1)OC=N2 CS10994 [0,0,0,1,0,0|1,0,2]=4 332 B10R2.7 C1=CC2=C(C=C1)OCC2 CS20929 [0,0,0,1,0,0|1,0,0]=2 333 B10R2.7 C1=CC2=C(C=C1)OCO2 CS20505 [0,0,0,1,0,0|2,0,0]=3 334 B10R2.7 C1=CC2=C(C=C1)SC=C2 CS16362 [0,0,0,1,0,0|1,0,2]=4 335 B10R2.7 C1=CC2=C(C=C1)SC=N2 CS10992 [0,0,0,1,0,0|1,0,2]=4 336 B10R2.7 C1=CC2=C(C=CN2)C=N1 CS20237 [0,0,0,1,0,0|1,0,2]=4 337 B10R2.7 C1=CC2=C(C=N1)C=NN2 MC442794 [0,0,0,1,0,0|2,0,1]=4 338 B10R2.7 C1=CC2=C(C=N1)CNC2 MC425268 [0,0,0,1,0,0|3,0,0]=4 339 B10R2.7 C1=CC2=C(C=N1)CNC2 MC428164 [0,0,0,1,0,0|3,0,0]=4 340 B10R2.7 C1=CC2=C(C=N1)NC=N2 CS22307 [0,0,0,1,0,0|2,0,1]=4 341 B10R2.7 C1=CC2=CC=NC=C2N1 CS20238 [0,0,0,1,0,0|1,0,2]=4 342 B10R2.7 C1=CC2=NON=C2C=C1 CS10977 [0,0,0,1,0,0|2,0,1]=4 343 B10R2.7 C1=CC2=NSN=C2C=C1 CS22942 [0,0,0,1,0,0|2,0,1]=4 344 B10R2.7 C1=CC=C2CC=CC2=C1 MC20914 [0,0,0,1,0,0|1,0,1]=3 345 B10R2.7 C1=CC=C2CNCC2=C1 CS11516 [0,0,0,1,0,0|2,0,0]=3 346 B10R2.7 C1=CC=C2CNCC2=C1 MC442466 [0,0,0,1,0,0|2,0,0]=3 347 B10R2.7 C1=CC=C2NC=CC2=C1 CS11496 [0,0,0,1,0,0|0,0,2]=3 348 B10R2.7 C1=CC=C2NCCC2=C1 CS19084 [0,0,0,1,0,0|0,0,0]=1 349 B10R2.7 C1=CC=C2NN=CC2=C1 CS11488 [0,0,0,1,0,0|1,0,1]=3 350 B10R2.7 C1=CC=C2OC=CC2=C1 CS11169 [0,0,0,1,0,0|1,0,2]=4 351 B10R2.7 C1=CN=C2C=CNC2=C1 CS20236 [0,0,0,1,0,0|1,0,2]=4 352 B10R2.7 C1=CN=C2C=NNC2=C1 MC442331 [0,0,0,1,0,0|2,0,1]=4 353 B10R2.7 C1=CN=C2CCCC2=C1 CS14838 [0,0,0,1,0,0|2,0,0]=3 354 B10R2.7 C1=CN=C2CCNC2=C1 MC107728 [0,0,0,1,0,0|1,0,0]=2 355 B10R2.7 C1=CN=C2CNCC2=C1 CS15341 [0,0,0,1,0,0|3,0,0]=4 356 B10R2.7 C1=CN=C2N=CNC2=C1 CS14066 [0,0,0,1,0,0|2,0,1]=4 357 B10R2.7 C1=CN=C2NC=CC2=C1 CS10447 [0,0,0,1,0,0|1,0,2]=4 358 B10R2.7 C1=CN=C2NCCC2=C1 CS21039 [0,0,0,1,0,0|1,0,0]=2 359 B10R2.7 C1=CN=C2NN=CC2=C1 CS18202 [0,0,0,1,0,0|2,0,1]=4 360 B10R2.7 C1=CN=C2NN=NC2=C1 CS20695 [0,0,0,1,0,0|3,0,0]=4 361 B10R2.7 C1=CN=C2OCOC2=C1 MC111188 [0,0,0,1,0,0|3,0,0]=4 362 B10R2.7 C1=NC=C2N=NCC2=C1 CS18561 [0,0,0,1,0,0|2,0,1]=4 363 B10R2.7 C1=NC=C2NN=CC2=C1 CS17034 [0,0,0,1,0,0|2,0,1]=4 364 B10R2.7 c1cc2c(cn1)CNC2 MC113094 [0,0,0,1,0,0|3,0,0]=4 365 B8R1.8 CCCC1=NC=CN1 CS14621 [0,0,0,0,1,0|3,0,0]=4 366 B8R1.8 ClCCC1=CNN=C1 MC20761 [0,0,0,0,1,0|3,0,0]=4 367 B8R1.8 N#CCC1=CC=CS1 CS22998 [0,0,0,0,1,0|1,0,2]=4 368 B8R1.8 N#CCC1=CSC=C1 CS13644 [0,0,0,0,1,0|1,0,2]=4 369 B8R1.8 NCCC1=CNC=N1 CS18264 [0,0,0,0,1,0|2,0,0]=3 370 B8R1.8 NCCC1=CSC=C1 CS22098 [0,0,0,0,1,0|1,0,0]=2 371 B8R1.8 NCCC1=NC=NN1 MC431308 [0,0,0,0,1,0|3,0,0]=4 372 B8R1.8 NCCC1=NC=NN1 MC431309 [0,0,0,0,1,0|3,0,0]=4 373 B8R1.8 NCCC1=NN=CS1 MC103870 [0,0,0,0,1,0|3,0,0]=4 374 B8R1.8 NCCC1=NN=CS1 MC104483 [0,0,0,0,1,0|3,0,0]=4 375 B8R1.8 NCCC1=NOC=N1 MC107767 [0,0,0,0,1,0|3,0,0]=4 376 B8R1.8 NNCC1=CC=CS1 MC104512 [0,0,0,0,1,0|2,0,0]=3 377 B8R1.8 NNCC1=CSC=C1 MC104511 [0,0,0,0,1,0|2,0,0]=3 378 B8R1.8 O=CCC1=CC=CS1 CS17423 [0,0,0,0,1,0|2,0,1]=4 379 B8R1.8 OCCC1=CC=CS1 CS14939 [0,0,0,0,1,0|2,0,0]=3 380 B8R1.8 OCCC1=CNC=N1 CS18186 [0,0,0,0,1,0|3,0,0]=4 381 B8R1.8 OCCC1=CNN=C1 CS18073 [0,0,0,0,1,0|3,0,0]=4 382 B8R1.8 OCCC1=CSC=C1 CS20858 [0,0,0,0,1,0|2,0,0]=3 383 B8R1.8 OCCC1=NC=CN1 MC431716 [0,0,0,0,1,0|3,0,0]=4 384 B8R1.8 OCCN1C=CN=C1 CS18191 [0,0,0,0,1,0|3,0,0]=4 385 B7R1.3 BrC1=CC=CC=C1 MC41456 [2,0,0,0,0,0|1,0,0]=3 386 B7R1.3 BrC1=CC=CN=C1 CS19218 [2,0,0,0,0,0|2,0,0]=4 387 B7R1.3 BrC1=CC=NC=C1 CS13376 [2,0,0,0,0,0|2,0,0]=4 388 B7R1.3 BrC1=NC=CC=C1 CS17815 [2,0,0,0,0,0|2,0,0]=4 389 B7R1.3 CC1=CC=CN=C1 MC107850 [2,0,0,0,0,0|1,0,0]=3 390 B7R1.3 CC1=CC=CN=N1 CS22374 [2,0,0,0,0,0|2,0,0]=4 391 B7R1.3 CC1=CC=NC=C1 MC31239 [2,0,0,0,0,0|1,0,0]=3 392 B7R1.3 CC1=CC=NC=C1 MC41625 [2,0,0,0,0,0|1,0,0]=3 393 B7R1.3 CC1=CN=CN=C1 CS18851 [2,0,0,0,0,0|2,0,0]=4 394 B7R1.3 CC1=CN=NC=C1 CS22983 [2,0,0,0,0,0|2,0,0]=4 395 B7R1.3 CC1=NC=CC=C1 MC41623 [2,0,0,0,0,0|1,0,0]=3 396 B7R1.3 CC1=NC=NC=C1 CS19795 [2,0,0,0,0,0|2,0,0]=4 397 B7R1.3 C[N+]1=CC=CC=C1 CS17683 [2,0,0,0,0,0|1,0,0]=3 398 B7R1.3 ClC1=CC=CC=C1 MC41469 [2,0,0,0,0,0|1,0,0]=3 399 B7R1.3 ClC1=CC=NC=C1 CS13378 [2,0,0,0,0,0|2,0,0]=4 400 B7R1.3 ClC1=NC=CC=C1 MC20672 [2,0,0,0,0,0|2,0,0]=4 401 B7R1.3 FC1=CC=CC=C1 MC41489 [2,0,0,0,0,0|1,0,0]=3 402 B7R1.3 FC1=CC=CN=C1 MC20006 [2,0,0,0,0,0|2,0,0]=4 403 B7R1.3 FC1=CC=NC=C1 MC429573 [2,0,0,0,0,0|2,0,0]=4 404 B7R1.3 FC1=CC=NC=C1 MC433050 [2,0,0,0,0,0|2,0,0]=4 405 B7R1.3 FC1=NC=CC=C1 MC20005 [2,0,0,0,0,0|2,0,0]=4 406 B7R1.3 F[N+]1=CC=CC=C1 MC426120 [2,0,0,0,0,0|2,0,0]=4 407 B7R1.3 F[N+]1=CC=CC=C1 MC429468 [2,0,0,0,0,0|2,0,0]=4 408 B7R1.3 IC1=CC=CC=C1 CS19958 [2,0,0,0,0,0|1,0,0]=3 409 B7R1.3 IC1=NC=CC=C1 CS14565 [2,0,0,0,0,0|2,0,0]=4 410 B7R1.3 NC1=CC=CC=C1 MC40851 [2,0,0,0,0,0|0,0,0]=2 411 B7R1.3 NC1=CC=CN=C1 CS19073 [2,0,0,0,0,0|1,0,0]=3 412 B7R1.3 NC1=CC=CN=N1 CS18539 [2,0,0,0,0,0|2,0,0]=4 413 B7R1.3 NC1=CC=CN=N1 CS19775 [2,0,0,0,0,0|2,0,0]=4 414 B7R1.3 NC1=CC=NC=C1 MC20017 [2,0,0,0,0,0|1,0,0]=3 415 B7R1.3 NC1=CN=CN=C1 CS18383 [2,0,0,0,0,0|2,0,0]=4 416 B7R1.3 NC1=CN=NC=C1 CS18154 [2,0,0,0,0,0|2,0,0]=4 417 B7R1.3 NC1=NC=CC=C1 MC41600 [2,0,0,0,0,0|1,0,0]=3 418 B7R1.3 NC1=NC=CC=N1 CS13370 [2,0,0,0,0,0|2,0,0]=4 419 B7R1.3 NC1=NC=CN=C1 CS16102 [2,0,0,0,0,0|2,0,0]=4 420 B7R1.3 NC1=NC=NC=C1 CS19707 [2,0,0,0,0,0|2,0,0]=4 421 B7R1.3 O=C1C=CC=CN1 CS18724 [2,0,0,0,0,0|2,0,0]=4 422 B7R1.3 OC1=CC=CC=C1 MC41210 [2,0,0,0,0,0|1,0,0]=3 423 B7R1.3 OC1=CC=CN=C1 CS17813 [2,0,0,0,0,0|2,0,0]=4 424 B7R1.3 OC1=CC=NC=C1 CS19216 [2,0,0,0,0,0|2,0,0]=4 425 B7R1.3 OC1=NC=CC=C1 CS21602 [2,0,0,0,0,0|2,0,0]=4 426 B7R1.3 PC1=CC=CC=C1 MC444841 [2,0,0,0,0,0|0,1,0]=3 427 B7R1.3 [S-]C1=CC=CC=C1 MC41417 [2,0,0,0,0,0|1,0,0]=3 428 B9R1.1 BrCC1=CC=C(Br)C=C1 CS19166 [1,1,0,0,0,0|1,0,0]=3 429 B9R1.1 BrCC1=CC=C(I)C=C1 CS20172 [1,1,0,0,0,0|1,0,0]=3 430 B9R1.1 BrCC1=CN=C(Br)C=C1 MC430652 [1,1,0,0,0,0|2,0,0]=4 431 B9R1.1 Br[Mg]c1ccc(Br)cc1 MC116037 [1,1,0,0,0,0|2,0,0]=4 432 B9R1.1 C#CC1=CC=C(Br)C=C1 MC440298 [1,1,0,0,0,0|0,0,2]=4 433 B9R1.1 C#CC1=CC=C(C)C=C1 CS21552 [1,1,0,0,0,0|0,0,2]=4 434 B9R1.1 C#CC1=CC=C(Cl)C=C1 MC440300 [1,1,0,0,0,0|0,0,2]=4 435 B9R1.1 C#CC1=CC=C(F)C=C1 MC429574 [1,1,0,0,0,0|0,0,2]=4 436 B9R1.1 C#CC1=CC=C(I)C=C1 MC443225 [1,1,0,0,0,0|0,0,2]=4 437 B9R1.1 C=CC1=CC=C(Br)C=C1 MC41562 [1,1,0,0,0,0|0,0,2]=4 438 B9R1.1 C=CC1=CC=C(F)C=C1 MC33131 [1,1,0,0,0,0|0,0,2]=4 439 B9R1.1 CC1=CC=C(C#N)C=C1 CS19807 [1,1,0,0,0,0|0,0,2]=4 440 B9R1.1 CC1=CC=C(C=O)C=C1 MC41128 [1,1,0,0,0,0|1,0,1]=4 441 B9R1.1 CC1=CC=C(CBr)C=C1 CS22969 [1,1,0,0,0,0|1,0,0]=3 442 B9R1.1 CC1=CC=C(CCl)C=C1 MC40603 [1,1,0,0,0,0|1,0,0]=3 443 B9R1.1 CC1=CC=C(CN)C=C1 CS22970 [1,1,0,0,0,0|0,0,0]=2 444 B9R1.1 CC1=CC=C(CN)N=N1 MC100078 [1,1,0,0,0,0|2,0,0]=4 445 B9R1.1 CC1=CC=C(CO)C=C1 CS19704 [1,1,0,0,0,0|1,0,0]=3 446 B9R1.1 CC1=CC=C(CO)C=N1 MC21041 [1,1,0,0,0,0|2,0,0]=4 447 B9R1.1 CC1=CC=C(NN)C=C1 CS19576 [1,1,0,0,0,0|1,0,0]=3 448 B9R1.1 CC1=CN=C(CCl)C=C1 MC115829 [1,1,0,0,0,0|2,0,0]=4 449 B9R1.1 CC1=CN=C(CN)C=C1 CS18319 [1,1,0,0,0,0|1,0,0]=3 450 B9R1.1 CC1=CN=C(CN)N=C1 MC103801 [1,1,0,0,0,0|2,0,0]=4 451 B9R1.1 CC1=NC=C(CN)C=N1 MC101949 [1,1,0,0,0,0|2,0,0]=4 452 B9R1.1 CCC1=CC=C(Br)C=C1 CS10865 [1,1,0,0,0,0|0,0,0]=2 453 B9R1.1 CCC1=CC=C(F)C=C1 MC20965 [1,1,0,0,0,0|0,0,0]=2 454 B9R1.1 CCC1=CC=C(I)C=C1 MC20189 [1,1,0,0,0,0|0,0,0]=2 455 B9R1.1 CCC1=CC=C(N)C=C1 MC40912 [1,1,0,0,0,0|0,0,0]=2 456 B9R1.1 CCC1=CC=C(O)C=C1 MC20188 [1,1,0,0,0,0|0,0,0]=2 457 B9R1.1 CCC1=CN=C(Br)C=C1 CS13124 [1,1,0,0,0,0|1,0,0]=3 458 B9R1.1 CCC1=CN=C(Br)C=N1 MC443464 [1,1,0,0,0,0|2,0,0]=4 459 B9R1.1 CCC1=CN=C(C)C=C1 MC20566 [1,1,0,0,0,0|1,0,0]=3 460 B9R1.1 CCC1=CN=C(Cl)N=C1 MC444395 [1,1,0,0,0,0|2,0,0]=4 461 B9R1.1 CCC1=CN=C(N)N=C1 CS14255 [1,1,0,0,0,0|2,0,0]=4 462 B9R1.1 CCC1=NC=C(Br)C=C1 CS12376 [1,1,0,0,0,0|1,0,0]=3 463 B9R1.1 CCC1=NC=C(Br)C=N1 CS13125 [1,1,0,0,0,0|2,0,0]=4 464 B9R1.1 CCC1=NC=C(N)C=N1 MC444378 [1,1,0,0,0,0|2,0,0]=4 465 B9R1.1 CN1C=CC(CN)=CN1 MC105291 [1,1,0,0,0,0|2,0,0]=4 466 B9R1.1 CNC1=CC=C(Cl)C=C1 MC40891 [1,1,0,0,0,0|1,0,0]=3 467 B9R1.1 CNC1=CC=C(F)C=C1 MC40919 [1,1,0,0,0,0|1,0,0]=3 468 B9R1.1 CNC1=CC=C(I)C=C1 CS22906 [1,1,0,0,0,0|1,0,0]=3 469 B9R1.1 CNC1=NC=C(Br)C=C1 CS10304 [1,1,0,0,0,0|2,0,0]=4 470 B9R1.1 CNC1=NC=C(N)C=C1 MC33484 [1,1,0,0,0,0|2,0,0]=4 471 B9R1.1 COC1=CC=C(Br)C=C1 MC41310 [1,1,0,0,0,0|1,0,0]=3 472 B9R1.1 COC1=CC=C(Cl)C=C1 MC41327 [1,1,0,0,0,0|1,0,0]=3 473 B9R1.1 COC1=CC=C(F)C=C1 MC30345 [1,1,0,0,0,0|1,0,0]=3 474 B9R1.1 COC1=CC=C(I)C=C1 MC41342 [1,1,0,0,0,0|1,0,0]=3 475 B9R1.1 COC1=CC=C(N)C=C1 CS18580 [1,1,0,0,0,0|1,0,0]=3 476 B9R1.1 COC1=CC=C(N)C=N1 CS19527 [1,1,0,0,0,0|2,0,0]=4 477 B9R1.1 COC1=CC=C(O)C=C1 CS22939 [1,1,0,0,0,0|1,0,0]=3 478 B9R1.1 COC1=CC=C(O)C=N1 CS19503 [1,1,0,0,0,0|2,0,0]=4 479 B9R1.1 COC1=CC=C(S)C=C1 MC20380 [1,1,0,0,0,0|1,0,0]=3 480 B9R1.1 COC1=CC=[N+]([O-])C=C1 CS18613 [1,1,0,0,0,0|2,0,0]=4 481 B9R1.1 COC1=CN=C(Br)C=C1 CS13470 [1,1,0,0,0,0|2,0,0]=4 482 B9R1.1 COC1=CN=C(F)C=C1 MC442697 [1,1,0,0,0,0|2,0,0]=4 483 B9R1.1 COC1=CN=C(N)C=C1 CS17791 [1,1,0,0,0,0|2,0,0]=4 484 B9R1.1 COC1=NC=C(Br)C=C1 CS22030 [1,1,0,0,0,0|2,0,0]=4 485 B9R1.1 COC1=NC=C(C)C=C1 CS21644 [1,1,0,0,0,0|2,0,0]=4 486 B9R1.1 COC1=NC=C(Cl)C=C1 CS17976 [1,1,0,0,0,0|2,0,0]=4 487 B9R1.1 COC1=NC=C(F)C=C1 MC20598 [1,1,0,0,0,0|2,0,0]=4 488 B9R1.1 COC1=NC=C(I)C=C1 CS21641 [1,1,0,0,0,0|2,0,0]=4 489 B9R1.1 COC1=NC=C(N)C=C1 MC33494 [1,1,0,0,0,0|2,0,0]=4 490 B9R1.1 CSC1=CC=C(O)C=C1 MC20743 [1,1,0,0,0,0|1,0,0]=3 491 B9R1.1 CSC1=CN=C(Br)C=C1 MC430574 [1,1,0,0,0,0|2,0,0]=4 492 B9R1.1 ClC1=CC=C(CBr)C=C1 MC40527 [1,1,0,0,0,0|1,0,0]=3 493 B9R1.1 ClC1=CN=C(CBr)C=C1 CS16112 [1,1,0,0,0,0|2,0,0]=4 494 B9R1.1 ClC1=CN=C(CBr)C=C1 CS17526 [1,1,0,0,0,0|2,0,0]=4 495 B9R1.1 ClC1=NC=C(CBr)C=C1 MC430654 [1,1,0,0,0,0|2,0,0]=4 496 B9R1.1 ClCC1=CC=C(Br)C=C1 CS19167 [1,1,0,0,0,0|1,0,0]=3 497 B9R1.1 ClCC1=CC=C(Cl)C=C1 CS19806 [1,1,0,0,0,0|1,0,0]=3 498 B9R1.1 FC1=CC=C(CBr)C=C1 CS19071 [1,1,0,0,0,0|1,0,0]=3 499 B9R1.1 FC1=CC=C(CCl)C=C1 MC429572 [1,1,0,0,0,0|1,0,0]=3 500 B9R1.1 FC1=CN=C(CBr)C=C1 MC430066 [1,1,0,0,0,0|2,0,0]=4 501 B9R1.1 FC1=CN=C(CBr)C=C1 MC432544 [1,1,0,0,0,0|2,0,0]=4 502 B9R1.1 FC1=NC=C(CBr)C=C1 CS13268 [1,1,0,0,0,0|2,0,0]=4 503 B9R1.1 N#CC1=CC=C(Br)C=C1 CS19210 [1,1,0,0,0,0|0,0,2]=4 504 B9R1.1 N#CC1=CC=C(Cl)C=C1 CS19211 [1,1,0,0,0,0|0,0,2]=4 505 B9R1.1 N#CC1=CC=C(F)C=C1 CS18637 [1,1,0,0,0,0|0,0,2]=4 506 B9R1.1 N#CC1=CC=C(I)C=C1 CS22010 [1,1,0,0,0,0|0,0,2]=4 507 B9R1.1 N#CC1=CC=C(N)C=C1 CS13395 [1,1,0,0,0,0|0,0,2]=4 508 B9R1.1 N#CC1=CC=C(O)C=C1 CS15887 [1,1,0,0,0,0|0,0,2]=4 509 B9R1.1 NC1=CC=C(C=O)C=C1 MC20423 [1,1,0,0,0,0|1,0,1]=4 510 B9R1.1 NC1=CC=C(CO)C=C1 MC33175 [1,1,0,0,0,0|1,0,0]=3 511 B9R1.1 NC1=CC=C(CO)C=N1 MC425278 [1,1,0,0,0,0|2,0,0]=4 512 B9R1.1 NC1=CN=C(CO)C=C1 MC33467 [1,1,0,0,0,0|2,0,0]=4 513 B9R1.1 NCC1=CC=C(Br)C=C1 CS19587 [1,1,0,0,0,0|0,0,0]=2 514 B9R1.1 NCC1=CC=C(Br)N=C1 CS11090 [1,1,0,0,0,0|1,0,0]=3 515 B9R1.1 NCC1=CC=C(Cl)C=C1 MC33031 [1,1,0,0,0,0|0,0,0]=2 516 B9R1.1 NCC1=CC=C(Cl)N=C1 CS16390 [1,1,0,0,0,0|1,0,0]=3 517 B9R1.1 NCC1=CC=C(Cl)N=N1 MC105810 [1,1,0,0,0,0|2,0,0]=4 518 B9R1.1 NCC1=CC=C(F)C=C1 CS18721 [1,1,0,0,0,0|0,0,0]=2 519 B9R1.1 NCC1=CC=C(I)C=C1 MC40836 [1,1,0,0,0,0|0,0,0]=2 520 B9R1.1 NCC1=CC=C(I)C=C1 MC40837 [1,1,0,0,0,0|0,0,0]=2 521 B9R1.1 NCC1=CC=C(N)C=N1 CS10590 [1,1,0,0,0,0|1,0,0]=3 522 B9R1.1 NCC1=CC=C(O)C=C1 CS22886 [1,1,0,0,0,0|0,0,0]=2 523 B9R1.1 NCC1=CN=C(Cl)N=C1 MC102397 [1,1,0,0,0,0|2,0,0]=4 524 B9R1.1 NCC1=CN=C(F)C=C1 MC104517 [1,1,0,0,0,0|1,0,0]=3 525 B9R1.1 NCC1=NC=C(Br)C=N1 MC102033 [1,1,0,0,0,0|2,0,0]=4 526 B9R1.1 NCC1=NC=C(F)C=C1 CS16554 [1,1,0,0,0,0|1,0,0]=3 527 B9R1.1 NCC1=NC=C(F)C=C1 MC430168 [1,1,0,0,0,0|1,0,0]=3 528 B9R1.1 NCC1=NC=C(F)C=C1 MC430169 [1,1,0,0,0,0|1,0,0]=3 529 B9R1.1 NCC1=NC=C(F)C=N1 MC104531 [1,1,0,0,0,0|2,0,0]=4 530 B9R1.1 NNC1=CC=C(Br)C=C1 CS15342 [1,1,0,0,0,0|1,0,0]=3 531 B9R1.1 NNC1=CC=C(Cl)C=C1 CS13495 [1,1,0,0,0,0|1,0,0]=3 532 B9R1.1 NNC1=CC=C(Cl)C=C1 CS17312 [1,1,0,0,0,0|1,0,0]=3 533 B9R1.1 NNC1=CC=C(F)C=C1 CS22006 [1,1,0,0,0,0|1,0,0]=3 534 B9R1.1 NNC1=CC=C(F)N=C1 MC102980 [1,1,0,0,0,0|2,0,0]=4 535 B9R1.1 NNC1=CC=C(N)C=C1 MC430700 [1,1,0,0,0,0|1,0,0]=3 536 B9R1.1 NNC1=NC=C(Br)C=C1 CS19995 [1,1,0,0,0,0|2,0,0]=4 537 B9R1.1 NNC1=NC=C(Cl)C=C1 CS20219 [1,1,0,0,0,0|2,0,0]=4 538 B9R1.1 NNC1=NC=C(F)C=C1 CS17301 [1,1,0,0,0,0|2,0,0]=4 539 B9R1.1 NNC1=NC=C(I)C=C1 MC432010 [1,1,0,0,0,0|2,0,0]=4 540 B9R1.1 O=C1C=CC(CO)=CN1 CS19816 [1,1,0,0,0,0|2,0,0]=4 541 B9R1.1 O=CC1=CC=C(Br)C=C1 CS18612 [1,1,0,0,0,0|1,0,1]=4 542 B9R1.1 O=CC1=CC=C(Cl)C=C1 CS14843 [1,1,0,0,0,0|1,0,1]=4 543 B9R1.1 O=CC1=CC=C(F)C=C1 CS19072 [1,1,0,0,0,0|1,0,1]=4 544 B9R1.1 O=CC1=CC=C(I)C=C1 CS20133 [1,1,0,0,0,0|1,0,1]=4 545 B9R1.1 O=CC1=CC=C(O)C=C1 CS18686 [1,1,0,0,0,0|1,0,1]=4 546 B9R1.1 OCC1=CC=C(Br)C=C1 CS19378 [1,1,0,0,0,0|1,0,0]=3 547 B9R1.1 OCC1=CC=C(Cl)C=C1 CS19353 [1,1,0,0,0,0|1,0,0]=3 548 B9R1.1 OCC1=CC=C(F)C=C1 MC40711 [1,1,0,0,0,0|1,0,0]=3 549 B9R1.1 OCC1=CC=C(F)N=C1 MC429931 [1,1,0,0,0,0|2,0,0]=4 550 B9R1.1 OCC1=CC=C(O)C=C1 CS19212 [1,1,0,0,0,0|1,0,0]=3 551 B9R1.1 OCC1=CN=C(Cl)C=C1 MC20657 [1,1,0,0,0,0|2,0,0]=4 552 B9R1.1 OCC1=NC=C(Br)C=C1 CS23005 [1,1,0,0,0,0|2,0,0]=4 553 B9R1.1 OCC1=NC=C(Cl)C=C1 CS21758 [1,1,0,0,0,0|2,0,0]=4 554 B9R1.1 OCC1=NC=C(F)C=C1 CS10382 [1,1,0,0,0,0|2,0,0]=4 555 B9R1.2 BrCC1=CC(I)=CC=C1 MC40562 [1,1,0,0,0,0|1,0,0]=3 556 B9R1.2 BrCC1=CC=CC(Br)=C1 CS19344 [1,1,0,0,0,0|1,0,0]=3 557 B9R1.2 BrCC1=CC=CC(Br)=N1 MC425531 [1,1,0,0,0,0|2,0,0]=4 558 B9R1.2 Br[Mg]c1cccc(Br)c1 MC116039 [1,1,0,0,0,0|2,0,0]=4 559 B9R1.2 C#CC1=CC(F)=CC=C1 CS20642 [1,1,0,0,0,0|0,0,2]=4 560 B9R1.2 C#CC1=CC=CC(Br)=C1 MC440366 [1,1,0,0,0,0|0,0,2]=4 561 B9R1.2 C#CC1=CC=CC(N)=C1 CS10819 [1,1,0,0,0,0|0,0,2]=4 562 B9R1.2 C#CC1=CC=CC(O)=C1 CS22325 [1,1,0,0,0,0|0,0,2]=4 563 B9R1.2 C=NC1=CC(C)=CC=C1 MC111025 [1,1,0,0,0,0|1,0,1]=4 564 B9R1.2 CC1=CC(CCl)=NC=C1 CS15442 [1,1,0,0,0,0|2,0,0]=4 565 B9R1.2 CC1=CC(CN)=CC=C1 CS19644 [1,1,0,0,0,0|0,0,0]=2 566 B9R1.2 CC1=CC(CO)=NC=C1 CS11126 [1,1,0,0,0,0|2,0,0]=4 567 B9R1.2 CC1=CC(NN)=CC=C1 CS19574 [1,1,0,0,0,0|1,0,0]=3 568 B9R1.2 CC1=CC(NN)=NC=C1 CS13399 [1,1,0,0,0,0|2,0,0]=4 569 B9R1.2 CC1=CC=CC(C#N)=C1 CS19778 [1,1,0,0,0,0|0,0,2]=4 570 B9R1.2 CC1=CC=CC(C=O)=C1 MC41127 [1,1,0,0,0,0|1,0,1]=4 571 B9R1.2 CC1=CC=CC(CBr)=N1 MC41602 [1,1,0,0,0,0|2,0,0]=4 572 B9R1.2 CC1=CC=CC(CCl)=C1 MC40602 [1,1,0,0,0,0|1,0,0]=3 573 B9R1.2 CC1=CC=CC(CF)=C1 MC433869 [1,1,0,0,0,0|1,0,0]=3 574 B9R1.2 CC1=CC=CC(CN)=N1 CS18414 [1,1,0,0,0,0|1,0,0]=3 575 B9R1.2 CC1=CC=CC(CO)=N1 MC20920 [1,1,0,0,0,0|2,0,0]=4 576 B9R1.2 CC1=CC=CC(NN)=N1 MC429683 [1,1,0,0,0,0|2,0,0]=4 577 B9R1.2 CC1=CN=CC(CCl)=C1 CS14445 [1,1,0,0,0,0|2,0,0]=4 578 B9R1.2 CC1=CN=NC(CN)=C1 MC104119 [1,1,0,0,0,0|2,0,0]=4 579 B9R1.2 CC1=NC(CN)=NC=C1 MC431122 [1,1,0,0,0,0|2,0,0]=4 580 B9R1.2 CC1=NC=CC(CN)=C1 MC443686 [1,1,0,0,0,0|1,0,0]=3 581 B9R1.2 CCC1=CC(=O)N=CN1 MC106508 [1,1,0,0,0,0|2,0,0]=4 582 B9R1.2 CCC1=CC(Cl)=NC=N1 MC106509 [1,1,0,0,0,0|2,0,0]=4 583 B9R1.2 CCC1=CC=CC(Br)=C1 MC30292 [1,1,0,0,0,0|0,0,0]=2 584 B9R1.2 CCC1=CC=CC(Br)=N1 CS15322 [1,1,0,0,0,0|1,0,0]=3 585 B9R1.2 CCC1=CC=CC(C)=C1 MC425590 [1,1,0,0,0,0|0,0,0]=2 586 B9R1.2 CCC1=CC=CC(N)=C1 MC433319 [1,1,0,0,0,0|0,0,0]=2 587 B9R1.2 CCC1=CC=C[N+]([O-])=C1 MC427174 [1,1,0,0,0,0|1,0,0]=3 588 B9R1.2 CCC1=CN=CC(Br)=C1 CS11907 [1,1,0,0,0,0|1,0,0]=3 589 B9R1.2 CCC1=NC=CC(N)=C1 MC105214 [1,1,0,0,0,0|1,0,0]=3 590 B9R1.2 CNC1=CC(Br)=CC=C1 CS22185 [1,1,0,0,0,0|1,0,0]=3 591 B9R1.2 CNC1=CC(Br)=CC=C1 MC40876 [1,1,0,0,0,0|1,0,0]=3 592 B9R1.2 CNC1=CC(Br)=CN=C1 MC443556 [1,1,0,0,0,0|2,0,0]=4 593 B9R1.2 CNC1=CC(Br)=NC=C1 MC442736 [1,1,0,0,0,0|2,0,0]=4 594 B9R1.2 CNC1=CC(Cl)=CC=C1 MC20486 [1,1,0,0,0,0|1,0,0]=3 595 B9R1.2 CNC1=CC(N)=CC=C1 CS16640 [1,1,0,0,0,0|1,0,0]=3 596 B9R1.2 CNC1=CC=CC(O)=C1 MC442233 [1,1,0,0,0,0|1,0,0]=3 597 B9R1.2 CNC1=NC=CC(Br)=C1 MC33481 [1,1,0,0,0,0|2,0,0]=4 598 B9R1.2 CNC1=NC=CC(Cl)=C1 MC430266 [1,1,0,0,0,0|2,0,0]=4 599 B9R1.2 CNC1=NC=CC(N)=C1 CS16967 [1,1,0,0,0,0|2,0,0]=4 600 B9R1.2 COC1=CC(=O)NC=C1 CS12334 [1,1,0,0,0,0|2,0,0]=4 601 B9R1.2 COC1=CC(Br)=NC=C1 CS16230 [1,1,0,0,0,0|2,0,0]=4 602 B9R1.2 COC1=CC(Cl)=NC=C1 CS19311 [1,1,0,0,0,0|2,0,0]=4 603 B9R1.2 COC1=CC(F)=NC=C1 CS14826 [1,1,0,0,0,0|2,0,0]=4 604 B9R1.2 COC1=CC(N)=NC=C1 CS19522 [1,1,0,0,0,0|2,0,0]=4 605 B9R1.2 COC1=CC=CC(Br)=N1 CS14301 [1,1,0,0,0,0|2,0,0]=4 606 B9R1.2 COC1=CC=CC(Cl)=C1 CS19894 [1,1,0,0,0,0|1,0,0]=3 607 B9R1.2 COC1=CC=CC(Cl)=N1 CS13826 [1,1,0,0,0,0|2,0,0]=4 608 B9R1.2 COC1=CC=CC(F)=C1 CS19929 [1,1,0,0,0,0|1,0,0]=3 609 B9R1.2 COC1=CC=CC(F)=N1 CS13652 [1,1,0,0,0,0|2,0,0]=4 610 B9R1.2 COC1=CC=CC(I)=N1 CS18075 [1,1,0,0,0,0|2,0,0]=4 611 B9R1.2 COC1=CC=CC(N)=C1 CS19943 [1,1,0,0,0,0|1,0,0]=3 612 B9R1.2 COC1=CC=CC(N)=N1 CS13845 [1,1,0,0,0,0|2,0,0]=4 613 B9R1.2 COC1=CC=CC(O)=C1 CS18747 [1,1,0,0,0,0|1,0,0]=3 614 B9R1.2 COC1=CC=CC(O)=N1 MC428307 [1,1,0,0,0,0|2,0,0]=4 615 B9R1.2 COC1=CC=C[N+]([O-])=C1 CS22349 [1,1,0,0,0,0|2,0,0]=4 616 B9R1.2 COC1=CN=CC(Br)=C1 MC427397 [1,1,0,0,0,0|2,0,0]=4 617 B9R1.2 COC1=CN=CC(N)=C1 CS19973 [1,1,0,0,0,0|2,0,0]=4 618 B9R1.2 COC1=CN=CC(O)=C1 CS17819 [1,1,0,0,0,0|2,0,0]=4 619 B9R1.2 COC1=NC(C)=CC=C1 CS15396 [1,1,0,0,0,0|2,0,0]=4 620 B9R1.2 COC1=NC=CC(Br)=C1 CS22650 [1,1,0,0,0,0|2,0,0]=4 621 B9R1.2 COC1=NC=CC(C)=C1 CS21637 [1,1,0,0,0,0|2,0,0]=4 622 B9R1.2 COC1=NC=CC(Cl)=C1 CS19313 [1,1,0,0,0,0|2,0,0]=4 623 B9R1.2 COC1=NC=CC(F)=C1 CS11908 [1,1,0,0,0,0|2,0,0]=4 624 B9R1.2 COC1=NC=CC(I)=C1 CS19594 [1,1,0,0,0,0|2,0,0]=4 625 B9R1.2 COC1=NC=CC(N)=C1 CS19525 [1,1,0,0,0,0|2,0,0]=4 626 B9R1.2 COC1=NC=CC(O)=C1 MC115931 [1,1,0,0,0,0|2,0,0]=4 627 B9R1.2 CSC1=CC(N)=CC=C1 MC20570 [1,1,0,0,0,0|1,0,0]=3 628 B9R1.2 CSC1=CC=CC(Br)=N1 MC442232 [1,1,0,0,0,0|2,0,0]=4 629 B9R1.2 CSC1=NC=CC(Cl)=C1 CS12493 [1,1,0,0,0,0|2,0,0]=4 630 B9R1.2 ClC1=CC(CBr)=NC=C1 MC111259 [1,1,0,0,0,0|2,0,0]=4 631 B9R1.2 ClC1=CC=CC(CBr)=C1 CS22235 [1,1,0,0,0,0|1,0,0]=3 632 B9R1.2 ClC1=CN=CC(CBr)=C1 MC107431 [1,1,0,0,0,0|2,0,0]=4 633 B9R1.2 ClCC1=CC(Br)=CC=C1 MC40579 [1,1,0,0,0,0|1,0,0]=3 634 B9R1.2 ClCC1=CC(Cl)=CC=C1 MC40582 [1,1,0,0,0,0|1,0,0]=3 635 B9R1.2 ClCC1=CC=CC(Br)=N1 MC425483 [1,1,0,0,0,0|2,0,0]=4 636 B9R1.2 ClCC1=CN=CC(Br)=C1 MC425679 [1,1,0,0,0,0|2,0,0]=4 637 B9R1.2 FC1=CC=CC(CBr)=C1 MC40552 [1,1,0,0,0,0|1,0,0]=3 638 B9R1.2 FC1=CC=CC(CCl)=C1 CS19068 [1,1,0,0,0,0|1,0,0]=3 639 B9R1.2 FCC1=CC=CC(F)=C1 MC433530 [1,1,0,0,0,0|1,0,0]=3 640 B9R1.2 N#CC1=CC(Br)=CC=C1 CS19865 [1,1,0,0,0,0|0,0,2]=4 641 B9R1.2 N#CC1=CC(Cl)=CC=C1 CS19319 [1,1,0,0,0,0|0,0,2]=4 642 B9R1.2 N#CC1=CC(F)=CC=C1 MC20044 [1,1,0,0,0,0|0,0,2]=4 643 B9R1.2 N#CC1=CC(I)=CC=C1 MC33186 [1,1,0,0,0,0|0,0,2]=4 644 B9R1.2 N#CC1=CC(N)=CC=C1 CS13394 [1,1,0,0,0,0|0,0,2]=4 645 B9R1.2 N#CC1=CC(O)=CC=C1 CS19377 [1,1,0,0,0,0|0,0,2]=4 646 B9R1.2 NC1=CC(CO)=NC=C1 MC33483 [1,1,0,0,0,0|2,0,0]=4 647 B9R1.2 NC1=CC=CC(CO)=C1 CS18821 [1,1,0,0,0,0|1,0,0]=3 648 B9R1.2 NC1=CC=CC(CO)=N1 CS16612 [1,1,0,0,0,0|2,0,0]=4 649 B9R1.2 NC1=CN=CC(CO)=C1 CS22079 [1,1,0,0,0,0|2,0,0]=4 650 B9R1.2 NC1=NC=CC(CCl)=C1 MC431205 [1,1,0,0,0,0|2,0,0]=4 651 B9R1.2 NC1=NC=CC(CO)=C1 CS17807 [1,1,0,0,0,0|2,0,0]=4 652 B9R1.2 NCC1=CC(=O)N=CN1 MC112983 [1,1,0,0,0,0|2,0,0]=4 653 B9R1.2 NCC1=CC(Br)=CC=C1 CS19652 [1,1,0,0,0,0|0,0,0]=2 654 B9R1.2 NCC1=CC(Br)=CC=C1 MC40798 [1,1,0,0,0,0|0,0,0]=2 655 B9R1.2 NCC1=CC(Br)=CN=C1 MC106753 [1,1,0,0,0,0|1,0,0]=3 656 B9R1.2 NCC1=CC(Br)=NC=C1 CS17247 [1,1,0,0,0,0|1,0,0]=3 657 B9R1.2 NCC1=CC(Cl)=CC=C1 MC33134 [1,1,0,0,0,0|0,0,0]=2 658 B9R1.2 NCC1=CC(Cl)=NC=C1 CS16037 [1,1,0,0,0,0|1,0,0]=3 659 B9R1.2 NCC1=CC(F)=CC=C1 MC33025 [1,1,0,0,0,0|0,0,0]=2 660 B9R1.2 NCC1=CC(F)=CN=C1 MC431591 [1,1,0,0,0,0|1,0,0]=3 661 B9R1.2 NCC1=CC(F)=NC=C1 MC116260 [1,1,0,0,0,0|1,0,0]=3 662 B9R1.2 NCC1=CC(I)=CC=C1 CS22330 [1,1,0,0,0,0|0,0,0]=2 663 B9R1.2 NCC1=CC(N)=NC=C1 CS17453 [1,1,0,0,0,0|1,0,0]=3 664 B9R1.2 NCC1=CC(N)=NC=N1 MC113023 [1,1,0,0,0,0|2,0,0]=4 665 B9R1.2 NCC1=CC(N)=NC=N1 MC115658 [1,1,0,0,0,0|2,0,0]=4 666 B9R1.2 NCC1=CN=CC(N)=C1 MC33458 [1,1,0,0,0,0|1,0,0]=3 667 B9R1.2 NCC1=NC(Br)=CC=C1 CS10635 [1,1,0,0,0,0|1,0,0]=3 668 B9R1.2 NCC1=NC(Br)=CC=C1 MC425058 [1,1,0,0,0,0|1,0,0]=3 669 B9R1.2 NCC1=NC(Cl)=CN=C1 MC106438 [1,1,0,0,0,0|2,0,0]=4 670 B9R1.2 NCC1=NC(Cl)=CN=C1 MC111184 [1,1,0,0,0,0|2,0,0]=4 671 B9R1.2 NCC1=NC(F)=CC=C1 CS13193 [1,1,0,0,0,0|1,0,0]=3 672 B9R1.2 NCC1=NC(O)=NC=C1 MC104065 [1,1,0,0,0,0|2,0,0]=4 673 B9R1.2 NCC1=NC=CC(Br)=C1 CS12824 [1,1,0,0,0,0|1,0,0]=3 674 B9R1.2 NCC1=NC=CC(Br)=C1 CS15559 [1,1,0,0,0,0|1,0,0]=3 675 B9R1.2 NCC1=NC=CC(Cl)=C1 MC113773 [1,1,0,0,0,0|1,0,0]=3 676 B9R1.2 NCC1=NC=NC(Cl)=C1 MC113046 [1,1,0,0,0,0|2,0,0]=4 677 B9R1.2 NNC1=CC(Br)=CC=C1 CS19465 [1,1,0,0,0,0|1,0,0]=3 678 B9R1.2 NNC1=CC(Cl)=CC=C1 CS19479 [1,1,0,0,0,0|1,0,0]=3 679 B9R1.2 NNC1=CC(Cl)=NC=C1 CS15665 [1,1,0,0,0,0|2,0,0]=4 680 B9R1.2 NNC1=CC(F)=CC=C1 CS19485 [1,1,0,0,0,0|1,0,0]=3 681 B9R1.2 NNC1=CC=CC(Cl)=N1 CS21479 [1,1,0,0,0,0|2,0,0]=4 682 B9R1.2 NNC1=NC=CC(F)=C1 MC115508 [1,1,0,0,0,0|2,0,0]=4 683 B9R1.2 O=CC1=CC(Br)=CC=C1 CS18958 [1,1,0,0,0,0|1,0,1]=4 684 B9R1.2 O=CC1=CC(Cl)=CC=C1 MC20579 [1,1,0,0,0,0|1,0,1]=4 685 B9R1.2 O=CC1=CC(F)=CC=C1 CS22298 [1,1,0,0,0,0|1,0,1]=4 686 B9R1.2 O=CC1=CC(I)=CC=C1 CS20132 [1,1,0,0,0,0|1,0,1]=4 687 B9R1.2 O=CC1=CC(O)=CC=C1 MC20422 [1,1,0,0,0,0|1,0,1]=4 688 B9R1.2 OC1=CC(CBr)=CC=C1 MC425573 [1,1,0,0,0,0|1,0,0]=3 689 B9R1.2 OCC1=CC(Br)=CN=C1 CS18272 [1,1,0,0,0,0|2,0,0]=4 690 B9R1.2 OCC1=CC(Br)=NC=C1 CS19256 [1,1,0,0,0,0|2,0,0]=4 691 B9R1.2 OCC1=CC(F)=CC=C1 CS19069 [1,1,0,0,0,0|1,0,0]=3 692 B9R1.2 OCC1=CC(F)=CN=C1 MC430713 [1,1,0,0,0,0|2,0,0]=4 693 B9R1.2 OCC1=CC(F)=NC=C1 CS21547 [1,1,0,0,0,0|2,0,0]=4 694 B9R1.2 OCC1=CC(O)=CC=C1 MC40720 [1,1,0,0,0,0|1,0,0]=3 695 B9R1.2 OCC1=NC(Br)=CC=C1 CS23004 [1,1,0,0,0,0|2,0,0]=4 696 B9R1.2 OCC1=NC(Cl)=CC=C1 CS10667 [1,1,0,0,0,0|2,0,0]=4 697 B9R1.2 OCC1=NC(Cl)=CC=C1 CS19907 [1,1,0,0,0,0|2,0,0]=4 698 B9R1.2 OCC1=NC(F)=CC=C1 MC430488 [1,1,0,0,0,0|2,0,0]=4 699 B9R1.2 OCC1=NC=CC(Br)=C1 CS18696 [1,1,0,0,0,0|2,0,0]=4 700 B9R1.2 OCC1=NC=CC(Cl)=C1 MC20517 [1,1,0,0,0,0|2,0,0]=4 701 B9R1.2 OCC1=NC=CC(O)=C1 CS17612 [1,1,0,0,0,0|2,0,0]=4 702 B9R1.6 C=C(C)C1=CC=NC=C1 MC111872 [1,1,0,0,0,0|1,0,1]=4 703 B9R1.6 C=C(F)C1=CC=CC=C1 MC102770 [1,1,0,0,0,0|0,0,2]=4 704 B9R1.6 CC(=O)C1=CC=CC=C1 MC41221 [1,1,0,0,0,0|0,0,1]=3 705 B9R1.6 CC(=O)C1=CC=CN=C1 CS18256 [1,1,0,0,0,0|1,0,1]=4 706 B9R1.6 CC(=O)C1=CC=NC=C1 CS22535 [1,1,0,0,0,0|1,0,1]=4 707 B9R1.6 CC(=O)C1=NC=CC=C1 CS18611 [1,1,0,0,0,0|1,0,1]=4 708 B9R1.6 CC(Br)C1=CC=CC=C1 MC40570 [1,1,0,0,0,0|0,0,0]=2 709 B9R1.6 CC(C)C1=NC=CC=C1 CS21621 [1,1,0,0,0,0|1,0,0]=3 710 B9R1.6 CC(N)C1=CC=CC=C1 CS10551 [1,1,0,0,0,0|0,0,0]=2 711 B9R1.6 CC(N)C1=CC=CC=C1 MC20344 [1,1,0,0,0,0|0,0,0]=2 712 B9R1.6 CC(N)C1=CN=CN=C1 MC102354 [1,1,0,0,0,0|2,0,0]=4 713 B9R1.6 CC(N)C1=CN=CN=C1 MC104062 [1,1,0,0,0,0|2,0,0]=4 714 B9R1.6 CC(N)C1=CN=CN=C1 MC105298 [1,1,0,0,0,0|2,0,0]=4 715 B9R1.6 CC(N)C1=CN=NC=C1 MC103837 [1,1,0,0,0,0|2,0,0]=4 716 B9R1.6 CC(N)C1=NC=CC=C1 CS15370 [1,1,0,0,0,0|1,0,0]=3 717 B9R1.6 CC(N)C1=NC=CC=C1 CS20271 [1,1,0,0,0,0|1,0,0]=3 718 B9R1.6 CC(N)C1=NC=CC=N1 MC431305 [1,1,0,0,0,0|2,0,0]=4 719 B9R1.6 CC(N)C1=NC=CN=C1 CS12997 [1,1,0,0,0,0|2,0,0]=4 720 B9R1.6 CC(N)C1=NC=NC=C1 MC103926 [1,1,0,0,0,0|2,0,0]=4 721 B9R1.6 CC(O)C1=CC=CC=C1 MC20383 [1,1,0,0,0,0|0,0,0]=2 722 B9R1.6 CC(O)C1=NC=CC=C1 CS20801 [1,1,0,0,0,0|1,0,0]=3 723 B9R1.6 CC(O)C1=NC=CC=C1 MC20310 [1,1,0,0,0,0|1,0,0]=3 724 B9R1.6 CN(C)C1=CC=CC=C1 MC40906 [1,1,0,0,0,0|1,0,0]=3 725 B9R1.6 CN(C)C1=CC=NC=C1 CS13386 [1,1,0,0,0,0|2,0,0]=4 726 B9R1.6 C[PH](=O)C1=CC=CC=C1 CS16386 [1,1,0,0,0,0|1,0,0]=3 727 B9R1.6 ClC(Cl)C1=CC=CC=C1 MC40608 [1,1,0,0,0,0|1,0,0]=3 728 B9R1.6 FC(F)C1=CC=CC=C1 MC41442 [1,1,0,0,0,0|1,0,0]=3 729 B9R1.6 FC(F)C1=CC=CN=C1 MC429164 [1,1,0,0,0,0|2,0,0]=4 730 B9R1.6 FC(F)C1=CC=NC=C1 MC429159 [1,1,0,0,0,0|2,0,0]=4 731 B9R1.6 FC(F)C1=NC=CC=C1 MC429160 [1,1,0,0,0,0|2,0,0]=4 732 B9R1.6 N=C(N)C1=CC=CC=C1 CS14830 [1,1,0,0,0,0|0,0,1]=3 733 B9R1.6 N=C(N)C1=CN=CC=C1 CS19487 [1,1,0,0,0,0|1,0,1]=4 734 B9R1.6 N=C(N)C1=NC=CC=C1 CS19100 [1,1,0,0,0,0|1,0,1]=4 735 B9R1.6 NC(=O)C1=CC=CC=C1 CS10962 [1,1,0,0,0,0|0,0,1]=3 736 B9R1.6 NC(=O)C1=CC=NC=C1 CS13721 [1,1,0,0,0,0|1,0,1]=4 737 B9R1.6 NC(=O)C1=NC=CC=C1 CS11910 [1,1,0,0,0,0|1,0,1]=4 738 B9R1.6 NC(=S)C1=CC=CC=C1 MC20863 [1,1,0,0,0,0|0,0,1]=3 739 B9R1.6 O=C(Cl)C1=CC=CC=C1 MC40435 [1,1,0,0,0,0|1,0,1]=4 740 B9R1.6 O=C(O)C1=CC=CC=C1 MC40233 [1,1,0,0,0,0|1,0,1]=4 741 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 MC41586 [1,1,0,0,0,0|2,0,0]=4 742 B9R1.6 OB(O)C1=CC=CC=C1 CS19450 [1,1,0,0,0,0|2,0,0]=4 743 B9R1.15 BrCC1=C(Br)C=CC=C1 MC20808 [1,1,0,0,0,0|1,0,0]=3 744 B9R1.15 BrCC1=C(I)C=CC=C1 MC40561 [1,1,0,0,0,0|1,0,0]=3 745 B9R1.15 C#CC1=C(Cl)C=CC=C1 CS20629 [1,1,0,0,0,0|0,0,2]=4 746 B9R1.15 C#CC1=C(N)C=CC=C1 CS21537 [1,1,0,0,0,0|0,0,2]=4 747 B9R1.15 C#CC1=C(O)C=CC=C1 CS21538 [1,1,0,0,0,0|0,0,2]=4 748 B9R1.15 C=CC1=C(Br)C=CC=C1 CS18853 [1,1,0,0,0,0|0,0,2]=4 749 B9R1.15 C=CC1=C(Cl)C=CC=C1 CS19873 [1,1,0,0,0,0|0,0,2]=4 750 B9R1.15 CC1=C(CBr)C=CC=C1 CS14791 [1,1,0,0,0,0|1,0,0]=3 751 B9R1.15 CC1=C(CBr)C=NC=C1 CS17496 [1,1,0,0,0,0|2,0,0]=4 752 B9R1.15 CC1=C(CCl)C=NC=C1 MC104833 [1,1,0,0,0,0|2,0,0]=4 753 B9R1.15 CC1=C(CN)C=CC=C1 MC33216 [1,1,0,0,0,0|0,0,0]=2 754 B9R1.15 CC1=C(CN)C=NC=C1 CS20204 [1,1,0,0,0,0|1,0,0]=3 755 B9R1.15 CC1=C(CO)C=NC=C1 MC443666 [1,1,0,0,0,0|2,0,0]=4 756 B9R1.15 CC1=C(NN)C=CC=C1 CS19575 [1,1,0,0,0,0|1,0,0]=3 757 B9R1.15 CC1=C(NN)C=CC=C1 MC20365 [1,1,0,0,0,0|1,0,0]=3 758 B9R1.15 CC1=CC=CC=C1C=O CS19114 [1,1,0,0,0,0|1,0,1]=4 759 B9R1.15 CC1=CC=CN=C1CCl CS15725 [1,1,0,0,0,0|2,0,0]=4 760 B9R1.15 CC1=CC=CN=C1CO CS19225 [1,1,0,0,0,0|2,0,0]=4 761 B9R1.15 CC1=CN=NC=C1CN MC104847 [1,1,0,0,0,0|2,0,0]=4 762 B9R1.15 CC1=NC=CC=C1CCl MC104832 [1,1,0,0,0,0|2,0,0]=4 763 B9R1.15 CC1=NC=CC=C1CN MC102930 [1,1,0,0,0,0|1,0,0]=3 764 B9R1.15 CC1=NC=CC=C1CO CS20145 [1,1,0,0,0,0|2,0,0]=4 765 B9R1.15 CC1=NC=CN=C1CN MC103464 [1,1,0,0,0,0|2,0,0]=4 766 B9R1.15 CCC1=C(Br)C=CC=C1 CS20980 [1,1,0,0,0,0|0,0,0]=2 767 B9R1.15 CCC1=C(Br)C=CN=C1 MC427078 [1,1,0,0,0,0|1,0,0]=3 768 B9R1.15 CCC1=C(C)C=CC=C1 CS21536 [1,1,0,0,0,0|0,0,0]=2 769 B9R1.15 CCC1=C(N)C=CC=C1 MC40911 [1,1,0,0,0,0|0,0,0]=2 770 B9R1.15 CCC1=NC=CC=C1Br MC105746 [1,1,0,0,0,0|1,0,0]=3 771 B9R1.15 CCC1=NC=CN=C1Cl CS21430 [1,1,0,0,0,0|2,0,0]=4 772 B9R1.15 CCC1=NC=NC=C1F CS19573 [1,1,0,0,0,0|2,0,0]=4 773 B9R1.15 CNC1=C(Cl)C=CC=C1 MC40890 [1,1,0,0,0,0|1,0,0]=3 774 B9R1.15 CNC1=C(F)C=CC=C1 CS13895 [1,1,0,0,0,0|1,0,0]=3 775 B9R1.15 CNC1=C(N)C=NC=C1 MC10330 [1,1,0,0,0,0|2,0,0]=4 776 B9R1.15 CNC1=CC=CC=C1N CS22302 [1,1,0,0,0,0|1,0,0]=3 777 B9R1.15 CNC1=NC=CC=C1Br CS17281 [1,1,0,0,0,0|2,0,0]=4 778 B9R1.15 CNC1=NC=CC=C1Cl MC33482 [1,1,0,0,0,0|2,0,0]=4 779 B9R1.15 CNC1=NC=CC=C1N MC427393 [1,1,0,0,0,0|2,0,0]=4 780 B9R1.15 COC1=C(Br)C=CC=C1 CS19150 [1,1,0,0,0,0|1,0,0]=3 781 B9R1.15 COC1=C(Br)C=CN=C1 CS14715 [1,1,0,0,0,0|2,0,0]=4 782 B9R1.15 COC1=C(Br)C=NC=C1 CS18491 [1,1,0,0,0,0|2,0,0]=4 783 B9R1.15 COC1=C(C)C=CN=C1 MC443637 [1,1,0,0,0,0|2,0,0]=4 784 B9R1.15 COC1=C(C)C=NC=C1 MC33476 [1,1,0,0,0,0|2,0,0]=4 785 B9R1.15 COC1=C(Cl)C=CN=C1 MC442708 [1,1,0,0,0,0|2,0,0]=4 786 B9R1.15 COC1=C(F)C=CC=C1 CS19904 [1,1,0,0,0,0|1,0,0]=3 787 B9R1.15 COC1=C(F)C=NC=C1 CS16194 [1,1,0,0,0,0|2,0,0]=4 788 B9R1.15 COC1=C(I)C=CC=C1 MC41341 [1,1,0,0,0,0|1,0,0]=3 789 B9R1.15 COC1=C(I)C=CN=C1 MC106301 [1,1,0,0,0,0|2,0,0]=4 790 B9R1.15 COC1=C(I)C=NC=C1 CS18542 [1,1,0,0,0,0|2,0,0]=4 791 B9R1.15 COC1=C(N)C=CC=C1 CS11812 [1,1,0,0,0,0|1,0,0]=3 792 B9R1.15 COC1=C(N)C=CN=C1 CS22564 [1,1,0,0,0,0|2,0,0]=4 793 B9R1.15 COC1=C(N)C=NC=C1 CS18248 [1,1,0,0,0,0|2,0,0]=4 794 B9R1.15 COC1=C(O)C=CC=C1 MC41202 [1,1,0,0,0,0|1,0,0]=3 795 B9R1.15 COC1=C(O)C=CN=C1 MC443266 [1,1,0,0,0,0|2,0,0]=4 796 B9R1.15 COC1=CC=CN=C1Br CS19255 [1,1,0,0,0,0|2,0,0]=4 797 B9R1.15 COC1=CC=CN=C1Cl CS19305 [1,1,0,0,0,0|2,0,0]=4 798 B9R1.15 COC1=CC=CN=C1F CS13044 [1,1,0,0,0,0|2,0,0]=4 799 B9R1.15 COC1=CC=CN=C1N CS17216 [1,1,0,0,0,0|2,0,0]=4 800 B9R1.15 COC1=NC=CC=C1Br CS19258 [1,1,0,0,0,0|2,0,0]=4 801 B9R1.15 COC1=NC=CC=C1C MC33438 [1,1,0,0,0,0|2,0,0]=4 802 B9R1.15 COC1=NC=CC=C1Cl CS18705 [1,1,0,0,0,0|2,0,0]=4 803 B9R1.15 COC1=NC=CC=C1F CS19564 [1,1,0,0,0,0|2,0,0]=4 804 B9R1.15 COC1=NC=CC=C1I CS13512 [1,1,0,0,0,0|2,0,0]=4 805 B9R1.15 COC1=NC=CC=C1N CS19526 [1,1,0,0,0,0|2,0,0]=4 806 B9R1.15 CSC1=C(Br)C=CN=C1 MC430535 [1,1,0,0,0,0|2,0,0]=4 807 B9R1.15 CSC1=C(I)C=CC=C1 MC433405 [1,1,0,0,0,0|1,0,0]=3 808 B9R1.15 ClC1=C(CBr)C=CC=C1 CS19190 [1,1,0,0,0,0|1,0,0]=3 809 B9R1.15 ClC1=CC=CN=C1CBr MC116292 [1,1,0,0,0,0|2,0,0]=4 810 B9R1.15 ClCC1=C(Cl)C=CC=C1 CS19964 [1,1,0,0,0,0|1,0,0]=3 811 B9R1.15 ClCC1=CC=CC=C1Br MC30029 [1,1,0,0,0,0|1,0,0]=3 812 B9R1.15 FC1=C(CBr)C=CC=C1 CS21562 [1,1,0,0,0,0|1,0,0]=3 813 B9R1.15 FC1=C(CCl)C=CC=C1 MC40597 [1,1,0,0,0,0|1,0,0]=3 814 B9R1.15 FC1=CC=CN=C1CBr MC430869 [1,1,0,0,0,0|2,0,0]=4 815 B9R1.15 FC1=CC=CN=C1CCl MC425766 [1,1,0,0,0,0|2,0,0]=4 816 B9R1.15 FC1=NC=CC=C1CBr MC430634 [1,1,0,0,0,0|2,0,0]=4 817 B9R1.15 FC1=NC=CC=C1CCl MC429652 [1,1,0,0,0,0|2,0,0]=4 818 B9R1.15 N#CC1=C(Br)C=CC=C1 MC20182 [1,1,0,0,0,0|0,0,2]=4 819 B9R1.15 N#CC1=C(F)C=CC=C1 CS18285 [1,1,0,0,0,0|0,0,2]=4 820 B9R1.15 N#CC1=C(I)C=CC=C1 CS21883 [1,1,0,0,0,0|0,0,2]=4 821 B9R1.15 N#CC1=C(N)C=CC=C1 CS13393 [1,1,0,0,0,0|0,0,2]=4 822 B9R1.15 N#CC1=C(O)C=CC=C1 CS19191 [1,1,0,0,0,0|0,0,2]=4 823 B9R1.15 NC1=C(C=O)C=CC=C1 MC20756 [1,1,0,0,0,0|1,0,1]=4 824 B9R1.15 NC1=C(CO)C=CC=C1 CS19122 [1,1,0,0,0,0|1,0,0]=3 825 B9R1.15 NC1=NC=CC=C1CO CS13983 [1,1,0,0,0,0|2,0,0]=4 826 B9R1.15 NCC1=C(Br)C=CC=C1 CS19534 [1,1,0,0,0,0|0,0,0]=2 827 B9R1.15 NCC1=C(Br)C=NC=C1 CS17629 [1,1,0,0,0,0|1,0,0]=3 828 B9R1.15 NCC1=C(F)C=CC=C1 MC40826 [1,1,0,0,0,0|0,0,0]=2 829 B9R1.15 NCC1=C(F)C=NC=C1 MC116263 [1,1,0,0,0,0|1,0,0]=3 830 B9R1.15 NCC1=C(F)C=NC=C1 MC431082 [1,1,0,0,0,0|1,0,0]=3 831 B9R1.15 NCC1=C(N)C=CC=C1 MC40796 [1,1,0,0,0,0|0,0,0]=2 832 B9R1.15 NCC1=C(O)C=CC=C1 CS20889 [1,1,0,0,0,0|0,0,0]=2 833 B9R1.15 NCC1=CC=NNC1=O MC104734 [1,1,0,0,0,0|2,0,0]=4 834 B9R1.15 NCC1=NC=CC=C1Cl MC114379 [1,1,0,0,0,0|1,0,0]=3 835 B9R1.15 NCC1=NC=CC=C1F MC104008 [1,1,0,0,0,0|1,0,0]=3 836 B9R1.15 NCC1=NC=CC=C1O MC443567 [1,1,0,0,0,0|1,0,0]=3 837 B9R1.15 NCC1=NC=CN=C1Cl CS14522 [1,1,0,0,0,0|2,0,0]=4 838 B9R1.15 NCC1=NC=CN=C1Cl CS14728 [1,1,0,0,0,0|2,0,0]=4 839 B9R1.15 NNC1=C(Br)C=CC=C1 CS19466 [1,1,0,0,0,0|1,0,0]=3 840 B9R1.15 NNC1=C(Cl)C=CC=C1 CS19478 [1,1,0,0,0,0|1,0,0]=3 841 B9R1.15 NNC1=C(F)C=CC=C1 CS23033 [1,1,0,0,0,0|1,0,0]=3 842 B9R1.15 NNC1=C(F)C=CC=C1 MC33086 [1,1,0,0,0,0|1,0,0]=3 843 B9R1.15 NNC1=NC=CC=C1Cl CS20171 [1,1,0,0,0,0|2,0,0]=4 844 B9R1.15 O=CC1=C(Br)C=CC=C1 CS19251 [1,1,0,0,0,0|1,0,1]=4 845 B9R1.15 O=CC1=C(F)C=CC=C1 CS21560 [1,1,0,0,0,0|1,0,1]=4 846 B9R1.15 O=CC1=C(I)C=CC=C1 CS20131 [1,1,0,0,0,0|1,0,1]=4 847 B9R1.15 O=CC1=C(O)C=CC=C1 MC41121 [1,1,0,0,0,0|1,0,1]=4 848 B9R1.15 OCC1=C(Br)C=CC=C1 CS18828 [1,1,0,0,0,0|1,0,0]=3 849 B9R1.15 OCC1=C(Br)C=NC=C1 CS12881 [1,1,0,0,0,0|2,0,0]=4 850 B9R1.15 OCC1=C(Cl)C=CC=C1 CS21494 [1,1,0,0,0,0|1,0,0]=3 851 B9R1.15 OCC1=C(Cl)C=CN=C1 CS17105 [1,1,0,0,0,0|2,0,0]=4 852 B9R1.15 OCC1=C(F)C=CC=C1 MC33139 [1,1,0,0,0,0|1,0,0]=3 853 B9R1.15 OCC1=C(I)C=CC=C1 CS19102 [1,1,0,0,0,0|1,0,0]=3 854 B9R1.15 OCC1=C(O)C=CC=C1 CS16243 [1,1,0,0,0,0|1,0,0]=3 855 B9R1.15 OCC1=CC=CN=C1Cl CS14328 [1,1,0,0,0,0|2,0,0]=4 856 B9R1.15 OCC1=CC=CN=C1F CS18697 [1,1,0,0,0,0|2,0,0]=4 857 B9R1.15 OCC1=NC=CC=C1Br MC431297 [1,1,0,0,0,0|2,0,0]=4 858 B9R1.15 OCC1=NC=CC=C1Br MC431298 [1,1,0,0,0,0|2,0,0]=4 859 B9R1.15 OCC1=NC=CC=C1Cl CS17318 [1,1,0,0,0,0|2,0,0]=4 860 B9R1.15 OCC1=NC=CC=C1F MC430870 [1,1,0,0,0,0|2,0,0]=4 861 B9R1.15 OCC1=NC=CC=C1O MC20200 [1,1,0,0,0,0|2,0,0]=4 862 B9R1.7 NCCC1=CC=C(Br)S1 MC114876 [0,1,0,0,1,0|1,0,0]=3 863 B9R1.7 NCCC1=CN=C(O)S1 MC110548 [0,1,0,0,1,0|2,0,0]=4 864 B9R1.7 NCCC1=CN=C(O)S1 MC429101 [0,1,0,0,1,0|2,0,0]=4 865 B9R1.7 NNCC1=CC=C(Cl)S1 MC104513 [0,1,0,0,1,0|2,0,0]=4 866 B9R1.7 NNCC1=CSC(Cl)=C1 MC104510 [0,1,0,0,1,0|2,0,0]=4 867 B9R1.12 CCCCC1C=CC=C1 MC114482 [0,1,0,0,1,0|1,0,1]=4 868 B9R1.12 CCOCC1=CC=CO1 CS17009 [0,1,0,0,1,0|2,0,0]=4 869 B9R1.13 CC(N)CC1=CC=CO1 MC431346 [0,1,0,0,1,0|1,0,0]=3 870 B9R1.33 CN1C=CC=C1CCO MC106498 [0,1,0,0,1,0|2,0,0]=4 871 B11R1.1 CCOCC1=CC=C(O)C=C1 CS16541 [0,2,0,0,0,0|1,0,0]=3 872 B11R1.1 CNCCC1=CC=C(N)C=C1 MC40974 [0,2,0,0,0,0|0,0,0]=2 873 B11R1.1 CNCCC1=CC=C(O)C=C1 MC426074 [0,2,0,0,0,0|0,0,0]=2 874 B11R1.1 CNCCC1=NC=C(F)C=C1 MC431885 [0,2,0,0,0,0|1,0,0]=3 875 B11R1.1 COCCC1=CC=C(O)C=C1 MC445496 [0,2,0,0,0,0|1,0,0]=3 876 B11R1.1 ClC1=CC=C(OCCBr)C=C1 MC20815 [0,2,0,0,0,0|1,0,0]=3 877 B11R1.1 FC1=CC=C(CCCBr)C=C1 MC113691 [0,2,0,0,0,0|1,0,0]=3 878 B11R1.1 FC1=CC=C(OCCBr)C=C1 MC41373 [0,2,0,0,0,0|1,0,0]=3 879 B11R1.1 N#CCOC1=CC=C(Cl)C=C1 MC33118 [0,2,0,0,0,0|0,0,2]=4 880 B11R1.1 NCCOC1=CC=C(F)C=C1 MC40921 [0,2,0,0,0,0|0,0,0]=2 881 B11R1.1 NCCOC1=CC=C(I)C=C1 MC112558 [0,2,0,0,0,0|0,0,0]=2 882 B11R1.1 O=C=NCC1=CC=C(F)C=C1 MC433986 [0,2,0,0,0,0|1,0,1]=4 883 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 MC10315 [0,2,0,0,0,0|1,0,1]=4 884 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 CS22844 [0,2,0,0,0,0|1,0,1]=4 885 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 MC433485 [0,2,0,0,0,0|1,0,0]=3 886 B11R1.20 CC(C)NC1=CC=C(Br)C=C1 MC443740 [0,2,0,0,0,0|2,0,0]=4 887 B11R1.20 CC(C)NC1=CC=C(F)C=C1 CS22842 [0,2,0,0,0,0|2,0,0]=4 888 B11R1.20 CC(C)OC1=CC=C(N)C=C1 CS10912 [0,2,0,0,0,0|2,0,0]=4 889 B11R1.20 CC(C)OC1=CC=C(O)C=C1 MC443483 [0,2,0,0,0,0|2,0,0]=4 890 B11R1.20 CC(C)SC1=CC=C(O)C=C1 MC112512 [0,2,0,0,0,0|2,0,0]=4 891 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 CS21084 [0,2,0,0,0,0|1,0,1]=4 892 B11R1.20 CC1=CC=C(OC(F)F)C=C1 MC41389 [0,2,0,0,0,0|2,0,0]=4 893 B11R1.20 FC(F)OC1=CC=C(Cl)C=C1 MC41382 [0,2,0,0,0,0|2,0,0]=4 894 B11R1.20 FC(F)OC1=CC=C(I)C=C1 MC41388 [0,2,0,0,0,0|2,0,0]=4 895 B11R1.20 FC(F)Oc1ccc(Br)cc1 CS19168 [0,2,0,0,0,0|2,0,0]=4 896 B11R1.20 FC1=CC=C(OC(F)F)C=C1 MC431385 [0,2,0,0,0,0|2,0,0]=4 897 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 CS21002 [0,2,0,0,0,0|1,0,1]=4 898 B11R1.20 NC1=CC=C(OC(F)F)C=C1 CS13962 [0,2,0,0,0,0|2,0,0]=4 899 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 CS20812 [0,2,0,0,0,0|1,0,1]=4 900 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 MC40158 [0,2,0,0,0,0|1,0,1]=4 901 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 CS10817 [0,2,0,0,0,0|1,0,1]=4 902 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 CS20852 [0,2,0,0,0,0|1,0,1]=4 903 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 MC40180 [0,2,0,0,0,0|1,0,1]=4 904 B11R1.20 O=C(O)CC1=CC=C(S)C=C1 MC40184 [0,2,0,0,0,0|1,0,1]=4 905 B11R1.20 OC1=CC=C(OC(F)F)C=C1 MC41182 [0,2,0,0,0,0|2,0,0]=4 906 B11R1.22 CC(C#N)C1=CC=C(Br)C=C1 MC427374 [0,2,0,0,0,0|0,0,2]=4 907 B11R1.22 CC(CN)C1=CC=C(Br)C=C1 MC103018 [0,2,0,0,0,0|0,0,0]=2 908 B11R1.22 CC(CN)C1=CC=C(Br)C=C1 MC427281 [0,2,0,0,0,0|0,0,0]=2 909 B11R1.22 CC(CN)C1=CC=C(O)C=C1 MC116255 [0,2,0,0,0,0|0,0,0]=2 910 B11R1.22 CC(NN)C1=CC=C(Cl)C=C1 MC110625 [0,2,0,0,0,0|1,0,0]=3 911 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 CS22698 [0,2,0,0,0,0|1,0,1]=4 912 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 CS22795 [0,2,0,0,0,0|1,0,1]=4 913 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 CS22846 [0,2,0,0,0,0|1,0,1]=4 914 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 CS15690 [0,2,0,0,0,0|1,0,1]=4 915 B11R1.22 CCC(C)C1=CC=C(Br)C=C1 CS18281 [0,2,0,0,0,0|1,0,0]=3 916 B11R1.22 FC1=CC=C(C(Br)CBr)C=C1 MC430994 [0,2,0,0,0,0|1,0,0]=3 917 B11R1.22 NC(CO)C1=NC=C(F)C=C1 MC114776 [0,2,0,0,0,0|2,0,0]=4 918 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 CS10839 [0,2,0,0,0,0|0,0,1]=3 919 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 CS20894 [0,2,0,0,0,0|0,0,1]=3 920 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 MC431262 [0,2,0,0,0,0|0,0,0]=2 921 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 MC33165 [0,2,0,0,0,0|1,0,1]=4 922 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 MC20179 [0,2,0,0,0,0|1,0,1]=4 923 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 MC41002 [0,2,0,0,0,0|1,0,1]=4 924 B11R1.22 NNC(=O)C1=CC=C(I)C=C1 MC41004 [0,2,0,0,0,0|1,0,1]=4 925 B11R1.22 NNC(=O)C1=CC=C(O)C=C1 MC41003 [0,2,0,0,0,0|1,0,1]=4 926 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 CS19445 [0,2,0,0,0,0|1,0,1]=4 927 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 MC433210 [0,2,0,0,0,0|1,0,1]=4 928 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 CS20678 [0,2,0,0,0,0|1,0,1]=4 929 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 CS10771 [0,2,0,0,0,0|1,0,1]=4 930 B11R1.22 O=C(CCl)C1=CC=C(Br)C=C1 CS14324 [0,2,0,0,0,0|1,0,1]=4 931 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 MC41236 [0,2,0,0,0,0|1,0,1]=4 932 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 MC442284 [0,2,0,0,0,0|1,0,0]=3 933 B11R1.81 CC1=C(CC#N)C=CC(F)=C1 MC40777 [0,2,0,0,0,0|0,0,2]=4 934 B11R1.81 CC1=CC(Br)=C(CC#N)C=C1 MC106321 [0,2,0,0,0,0|0,0,2]=4 935 B11R1.81 CC1=CC(F)=C(CC#N)C=C1 MC431014 [0,2,0,0,0,0|0,0,2]=4 936 B11R1.81 CCOC1=C(F)C=C(N)C=C1 MC112375 [0,2,0,0,0,0|2,0,0]=4 937 B11R1.81 N#CCC1=C(Br)C=C(Br)C=C1 MC433948 [0,2,0,0,0,0|0,0,2]=4 938 B11R1.81 N#CCC1=C(Br)C=C(Cl)C=C1 MC40754 [0,2,0,0,0,0|0,0,2]=4 939 B11R1.81 N#CCC1=C(Br)C=C(F)C=C1 CS13698 [0,2,0,0,0,0|0,0,2]=4 940 B11R1.81 N#CCC1=C(Cl)C=C(Br)C=C1 MC107514 [0,2,0,0,0,0|0,0,2]=4 941 B11R1.81 N#CCC1=C(Cl)C=C(Cl)C=C1 CS15393 [0,2,0,0,0,0|0,0,2]=4 942 B11R1.81 N#CCC1=C(Cl)C=C(F)C=C1 CS20640 [0,2,0,0,0,0|0,0,2]=4 943 B11R1.81 N#CCC1=C(F)C=C(Br)C=C1 CS22644 [0,2,0,0,0,0|0,0,2]=4 944 B11R1.81 N#CCC1=C(F)C=C(Cl)C=C1 MC40764 [0,2,0,0,0,0|0,0,2]=4 945 B11R1.81 N#CCC1=C(F)C=C(F)C=C1 CS10683 [0,2,0,0,0,0|0,0,2]=4 946 B11R1.81 NCCC1=C(F)C=C(F)C=C1 MC40977 [0,2,0,0,0,0|0,0,0]=2 947 B11R1.81 OCCC1=C(Cl)C=C(Cl)C=C1 MC40739 [0,2,0,0,0,0|1,0,0]=3 948 B11R1.83 C#CC1=CC=C(OCC)C=C1 CS11063 [0,2,0,0,0,0|2,0,0]=4 949 B11R1.83 CCC1=CN=C(CCO)C=C1 CS10373 [0,2,0,0,0,0|2,0,0]=4 950 B11R1.83 CCCC1=CC=C(C=O)C=C1 MC41132 [0,2,0,0,0,0|1,0,0]=3 951 B11R1.83 CCCC1=CC=C(CN)C=C1 CS10109 [0,2,0,0,0,0|1,0,0]=3 952 B11R1.83 CCOC1=CC=C(C=O)C=C1 CS22818 [0,2,0,0,0,0|2,0,0]=4 953 B11R1.83 CCOC1=CC=C(CN)C=C1 MC40825 [0,2,0,0,0,0|2,0,0]=4 954 B11R1.83 CCOC1=CC=C(CO)C=C1 CS22820 [0,2,0,0,0,0|2,0,0]=4 955 B11R1.83 CNCC1=CC=C(OC)C=C1 CS18429 [0,2,0,0,0,0|2,0,0]=4 956 B11R1.83 COC1=CC=C(CC#N)C=C1 CS13459 [0,2,0,0,0,0|0,0,2]=4 957 B11R1.83 COC1=CC=C(CNN)C=C1 CS20199 [0,2,0,0,0,0|1,0,0]=3 958 B11R1.83 COC1=CC=C(CNO)C=C1 MC106878 [0,2,0,0,0,0|2,0,0]=4 959 B11R1.83 COC1=CC=C(CON)C=C1 CS20566 [0,2,0,0,0,0|1,0,0]=3 960 B11R1.83 N#CC1=CC=C(CCBr)C=C1 CS12532 [0,2,0,0,0,0|1,0,0]=3 961 B11R1.83 N#CC1=CC=C(CCN)C=C1 CS22808 [0,2,0,0,0,0|0,0,0]=2 962 B11R1.83 N#CC1=CC=C(CCO)C=C1 CS22434 [0,2,0,0,0,0|1,0,0]=3 963 B11R1.83 O=CC1=CC=C(CCCl)C=C1 MC106352 [0,2,0,0,0,0|1,0,0]=3 964 B11R1.83 O=CC1=CC=C(CCO)C=C1 CS16581 [0,2,0,0,0,0|1,0,0]=3 965 B11R1.192 CC1=C(F)C=C(CC#N)C=C1 MC40776 [0,2,0,0,0,0|0,0,2]=4 966 B11R1.192 CC1=C(F)C=CC(CC#N)=C1 MC40778 [0,2,0,0,0,0|0,0,2]=4 967 B11R1.192 CCOC1=CC(Cl)=C(Br)C=C1 CS16022 [0,2,0,0,0,0|2,0,0]=4 968 B11R1.192 CCOC1=CC=C(N)C(N)=C1 MC433374 [0,2,0,0,0,0|2,0,0]=4 969 B11R1.192 CNCC1=CC(Cl)=C(Cl)C=C1 CS11711 [0,2,0,0,0,0|2,0,0]=4 970 B11R1.192 COCC1=CC(F)=C(Br)C=C1 MC33058 [0,2,0,0,0,0|2,0,0]=4 971 B11R1.192 N#CCC1=CC(Br)=C(F)C=C1 MC433936 [0,2,0,0,0,0|0,0,2]=4 972 B11R1.192 N#CCC1=CC(Cl)=C(Cl)C=C1 CS20633 [0,2,0,0,0,0|0,0,2]=4 973 B11R1.192 N#CCC1=CC(Cl)=C(F)C=C1 CS18657 [0,2,0,0,0,0|0,0,2]=4 974 B11R1.192 N#CCC1=CC(F)=C(Br)C=C1 CS15044 [0,2,0,0,0,0|0,0,2]=4 975 B11R1.192 N#CCC1=CC(F)=C(Cl)C=C1 MC433126 [0,2,0,0,0,0|0,0,2]=4 976 B11R1.192 N#CCC1=CC(F)=C(F)C=C1 MC30096 [0,2,0,0,0,0|0,0,2]=4 977 B11R1.192 N#CCC1=CC(F)=C(I)C=C1 MC113672 [0,2,0,0,0,0|0,0,2]=4 978 B11R1.192 NCCC1=CC(Cl)=C(Cl)C=C1 CS21933 [0,2,0,0,0,0|0,0,0]=2 979 B11R1.192 NCCC1=CC=C(O)C(O)=C1 CS15345 [0,2,0,0,0,0|0,0,0]=2 980 B11R1.192 O=CCC1=CC(Br)=C(F)C=C1 MC430543 [0,2,0,0,0,0|1,0,1]=4 981 B11R1.192 O=CCC1=CC(F)=C(Br)C=C1 MC430272 [0,2,0,0,0,0|1,0,1]=4 982 B11R1.192 OCCC1=CC(Cl)=C(Cl)C=C1 CS21932 [0,2,0,0,0,0|1,0,0]=3 983 B11R1.192 OCCC1=CC(F)=C(F)C=C1 MC33101 [0,2,0,0,0,0|1,0,0]=3 984 B11R1.13 CCOc1cccc(F)c1F MC433141 [0,2,0,0,0,0|2,0,0]=4 985 B11R1.13 CNCC1=C(Cl)C(Cl)=CC=C1 CS20112 [0,2,0,0,0,0|2,0,0]=4 986 B11R1.13 N#CCC1=C(Cl)C(Cl)=CC=C1 CS18973 [0,2,0,0,0,0|0,0,2]=4 987 B11R1.13 N#CCC1=C(F)C(Cl)=CC=C1 MC40762 [0,2,0,0,0,0|0,0,2]=4 988 B11R1.13 N#CCC1=C(F)C(F)=CC=C1 CS18734 [0,2,0,0,0,0|0,0,2]=4 989 B11R1.13 OCCC1=C(Cl)C(Cl)=CC=C1 MC40738 [0,2,0,0,0,0|1,0,0]=3 990 B11R1.17 C=CCCC1=C(Br)C=NC=C1 MC431688 [0,2,0,0,0,0|2,0,0]=4 991 B11R1.17 CC1=C(OCC#N)C=CC=C1 CS14720 [0,2,0,0,0,0|0,0,2]=4 992 B11R1.17 CCCOC1=C(O)C=CC=C1 MC20673 [0,2,0,0,0,0|1,0,0]=3 993 B11R1.17 O=CCCC1=C(Cl)C=CC=C1 MC106741 [0,2,0,0,0,0|1,0,0]=3 994 B11R1.41 CCOC1=C(C#N)C=CC=C1 MC33181 [0,2,0,0,0,0|2,0,0]=4 995 B11R1.41 CCOC1=C(OC)C=CC=C1 MC433385 [0,2,0,0,0,0|2,0,0]=4 996 B11R1.41 COC1=C(CCO)C=CC=C1 CS15749 [0,2,0,0,0,0|1,0,0]=3 997 B11R1.41 N#CC1=C(CCO)C=CC=C1 MC100045 [0,2,0,0,0,0|1,0,0]=3 998 B11R1.41 N#CCC1=C(C#N)C=CC=C1 MC40767 [0,2,0,0,0,0|0,0,2]=4 999 B11R1.41 N#CCC1=C(CCl)C=CC=C1 MC40588 [0,2,0,0,0,0|0,0,2]=4 1000 B11R1.41 O=CC1=C(CCBr)C=CC=C1 MC106620 [0,2,0,0,0,0|1,0,0]=3 1001 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 MC10294 [0,2,0,0,0,0|1,0,1]=4 1002 B11R1.86 CC(=O)CC1=C(F)C=CC=C1 MC10318 [0,2,0,0,0,0|1,0,1]=4 1003 B11R1.86 CC(C)OC1=C(N)C=CC=C1 CS13469 [0,2,0,0,0,0|2,0,0]=4 1004 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 CS21083 [0,2,0,0,0,0|1,0,1]=4 1005 B11R1.86 FC(F)OC1=C(Br)C=CC=C1 MC41371 [0,2,0,0,0,0|2,0,0]=4 1006 B11R1.86 FC(F)OC1=C(I)C=CC=C1 MC41387 [0,2,0,0,0,0|2,0,0]=4 1007 B11R1.86 NC(=S)NC1=C(Br)C=CC=C1 MC427415 [0,2,0,0,0,0|1,0,1]=4 1008 B11R1.86 NC(=S)NC1=C(F)C=CC=C1 MC33179 [0,2,0,0,0,0|1,0,1]=4 1009 B11R1.86 NC1=C(CC(=O)O)C=CC=C1 CS20995 [0,2,0,0,0,0|1,0,1]=4 1010 B11R1.86 NC1=C(OC(F)F)C=CC=C1 MC40902 [0,2,0,0,0,0|2,0,0]=4 1011 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 CS20809 [0,2,0,0,0,0|1,0,1]=4 1012 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 CS20826 [0,2,0,0,0,0|1,0,1]=4 1013 B11R1.86 O=C(O)CC1=C(F)C=CC=C1 MC429403 [0,2,0,0,0,0|1,0,1]=4 1014 B11R1.86 O=C(O)CC1=C(I)C=CC=C1 CS20849 [0,2,0,0,0,0|1,0,1]=4 1015 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 CS20941 [0,2,0,0,0,0|1,0,1]=4 1016 B11R1.86 OC1=C(OC(F)F)C=CC=C1 MC431136 [0,2,0,0,0,0|2,0,0]=4 1017 B11R1.182 CC1=C(CC#N)C=C(F)C=C1 CS19339 [0,2,0,0,0,0|0,0,2]=4 1018 B11R1.182 CC1=CC(CC#N)=C(C)C=C1 CS21152 [0,2,0,0,0,0|0,0,2]=4 1019 B11R1.182 CC1=CC(CCO)=C(C)C=C1 MC40742 [0,2,0,0,0,0|1,0,0]=3 1020 B11R1.182 CCOC1=C(Br)C=CC(N)=C1 CS20424 [0,2,0,0,0,0|2,0,0]=4 1021 B11R1.182 CCOC1=C(C)C=CC(N)=C1 MC111938 [0,2,0,0,0,0|2,0,0]=4 1022 B11R1.182 CCOC1=C(Cl)C=CC(Br)=C1 MC41352 [0,2,0,0,0,0|2,0,0]=4 1023 B11R1.182 CCOC1=C(F)C=CC(Cl)=C1 MC41354 [0,2,0,0,0,0|2,0,0]=4 1024 B11R1.182 N#CCC1=C(Br)C=CC(Cl)=C1 MC433932 [0,2,0,0,0,0|0,0,2]=4 1025 B11R1.182 N#CCC1=C(Cl)C=CC(Br)=C1 MC40755 [0,2,0,0,0,0|0,0,2]=4 1026 B11R1.182 N#CCC1=C(Cl)C=CC(Cl)=C1 CS18974 [0,2,0,0,0,0|0,0,2]=4 1027 B11R1.182 N#CCC1=C(Cl)C=CC(F)=C1 MC40761 [0,2,0,0,0,0|0,0,2]=4 1028 B11R1.182 N#CCC1=C(F)C=CC(Br)=C1 CS16321 [0,2,0,0,0,0|0,0,2]=4 1029 B11R1.182 N#CCC1=C(F)C=CC(Cl)=C1 MC40765 [0,2,0,0,0,0|0,0,2]=4 1030 B11R1.182 N#CCC1=C(F)C=CC(F)=C1 MC40768 [0,2,0,0,0,0|0,0,2]=4 1031 B11R1.182 NCCC1=C(Cl)C=CC(Cl)=C1 MC40976 [0,2,0,0,0,0|0,0,0]=2 1032 B11R1.182 OCCC1=C(Cl)C=CC(Cl)=C1 MC40740 [0,2,0,0,0,0|1,0,0]=3 1033 B11R1.222 CC(CO)C1=C(Cl)C=CC=C1 MC111290 [0,2,0,0,0,0|1,0,0]=3 1034 B11R1.222 CCC(=O)C1=C(Cl)C=CC=C1 CS15813 [0,2,0,0,0,0|1,0,1]=4 1035 B11R1.222 CCC(=O)C1=C(N)C=CC=C1 MC430440 [0,2,0,0,0,0|1,0,1]=4 1036 B11R1.222 CCC(C)C1=C(N)C=CC=C1 CS21765 [0,2,0,0,0,0|1,0,0]=3 1037 B11R1.222 CCC(N)C1=C(C)C=CC=C1 CS14530 [0,2,0,0,0,0|1,0,0]=3 1038 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 CS15388 [0,2,0,0,0,0|0,0,1]=3 1039 B11R1.222 NCC(O)C1=C(F)C=CC=C1 MC431432 [0,2,0,0,0,0|0,0,0]=2 1040 B11R1.222 NCC(O)C1=C(I)C=CC=C1 CS17962 [0,2,0,0,0,0|0,0,0]=2 1041 B11R1.222 NNC(=O)C1=C(F)C=CC=C1 MC429401 [0,2,0,0,0,0|1,0,1]=4 1042 B11R1.222 O=C(CBr)C1=C(Cl)C=CC=C1 CS14555 [0,2,0,0,0,0|1,0,1]=4 1043 B11R1.222 O=C(CBr)C1=C(O)C=CC=C1 MC41230 [0,2,0,0,0,0|1,0,1]=4 1044 B11R1.605 N#CCC1=C(Br)C=CC=C1Br CS15982 [0,2,0,0,0,0|0,0,2]=4 1045 B11R1.605 N#CCC1=C(Br)C=CC=C1Cl MC107158 [0,2,0,0,0,0|0,0,2]=4 1046 B11R1.605 N#CCC1=C(Cl)C=CC=C1Cl CS10675 [0,2,0,0,0,0|0,0,2]=4 1047 B11R1.605 N#CCC1=C(Cl)C=CC=C1F CS10682 [0,2,0,0,0,0|0,0,2]=4 1048 B11R1.605 N#CCC1=C(F)C=CC=C1F CS10684 [0,2,0,0,0,0|0,0,2]=4 1049 B11R1.605 OCCC1=C(Cl)C=CC=C1F MC40736 [0,2,0,0,0,0|1,0,0]=3 1050 B11R1.23 CCC(=O)C1=CC(Br)=CC=C1 MC41278 [0,2,0,0,0,0|1,0,1]=4 1051 B11R1.23 CCC(=O)C1=CC(Cl)=CC=C1 MC41280 [0,2,0,0,0,0|1,0,1]=4 1052 B11R1.23 CCC(=O)C1=CC(F)=CC=C1 MC41284 [0,2,0,0,0,0|1,0,1]=4 1053 B11R1.23 CCC(=O)C1=CC(N)=CC=C1 MC433258 [0,2,0,0,0,0|1,0,1]=4 1054 B11R1.23 CCC(N)C1=CC(Br)=CN=C1 MC112156 [0,2,0,0,0,0|2,0,0]=4 1055 B11R1.23 NC(CO)C1=CC(I)=CC=C1 MC103511 [0,2,0,0,0,0|1,0,0]=3 1056 B11R1.23 NCC(O)C1=CC(Br)=CC=C1 MC111476 [0,2,0,0,0,0|0,0,0]=2 1057 B11R1.23 NNC(=O)C1=CC(F)=CC=C1 MC429588 [0,2,0,0,0,0|1,0,1]=4 1058 B11R1.23 O=C(CBr)C1=CC(Br)=CC=C1 MC41245 [0,2,0,0,0,0|1,0,1]=4 1059 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 CS19056 [0,2,0,0,0,0|1,0,1]=4 1060 B11R1.23 O=C(CBr)C1=CC(F)=CC=C1 CS15383 [0,2,0,0,0,0|1,0,1]=4 1061 B11R1.23 O=C(CBr)C1=CC(O)=CC=C1 MC433217 [0,2,0,0,0,0|1,0,1]=4 1062 B11R1.23 O=C(CCl)C1=CC(Cl)=CC=C1 MC20163 [0,2,0,0,0,0|1,0,1]=4 1063 B11R1.23 OC(CBr)C1=CC(Br)=CC=C1 MC111475 [0,2,0,0,0,0|1,0,0]=3 1064 B11R1.24 CCCOC1=NC=CC(Br)=C1 MC430459 [0,2,0,0,0,0|2,0,0]=4 1065 B11R1.24 ClC1=CC=CC(OCCBr)=C1 MC433477 [0,2,0,0,0,0|1,0,0]=3 1066 B11R1.24 FC1=CC=CC(CN=C=S)=C1 MC41079 [0,2,0,0,0,0|1,0,1]=4 1067 B11R1.34 C#CCC1=CC(F)=CC(F)=C1 MC431174 [0,2,0,0,0,0|1,0,1]=4 1068 B11R1.34 N#CCC1=CC(Br)=CC(Br)=C1 MC106589 [0,2,0,0,0,0|0,0,2]=4 1069 B11R1.34 N#CCC1=CC(Br)=CC(Cl)=C1 MC433933 [0,2,0,0,0,0|0,0,2]=4 1070 B11R1.34 N#CCC1=CC(Br)=CC(F)=C1 MC40757 [0,2,0,0,0,0|0,0,2]=4 1071 B11R1.34 N#CCC1=CC(Cl)=CC(Cl)=C1 CS20845 [0,2,0,0,0,0|0,0,2]=4 1072 B11R1.34 N#CCC1=CC(Cl)=CC(F)=C1 MC40763 [0,2,0,0,0,0|0,0,2]=4 1073 B11R1.34 N#CCC1=CC(F)=CC(F)=C1 CS20643 [0,2,0,0,0,0|0,0,2]=4 1074 B11R1.34 NCCC1=CC(Cl)=CC(Cl)=C1 CS16793 [0,2,0,0,0,0|0,0,0]=2 1075 B11R1.34 OCCC1=CC(Cl)=CC(Cl)=C1 MC40741 [0,2,0,0,0,0|1,0,0]=3 1076 B11R1.157 CC(=O)CC1=CC(Br)=CC=C1 CS22187 [0,2,0,0,0,0|1,0,1]=4 1077 B11R1.157 CC(C)CC1=CC=CC(Br)=C1 MC443308 [0,2,0,0,0,0|1,0,0]=3 1078 B11R1.157 CC(C)OC1=CC=CC(O)=C1 MC112598 [0,2,0,0,0,0|2,0,0]=4 1079 B11R1.157 CN(C)CC1=CC=CC(O)=C1 MC425485 [0,2,0,0,0,0|2,0,0]=4 1080 B11R1.157 Cc1cccc(CC(=O)O)c1 MC433961 [0,2,0,0,0,0|1,0,1]=4 1081 B11R1.157 FC(F)OC1=CC(Br)=CC=C1 MC41372 [0,2,0,0,0,0|2,0,0]=4 1082 B11R1.157 NC(=S)NC1=CC(Br)=CC=C1 MC427249 [0,2,0,0,0,0|1,0,1]=4 1083 B11R1.157 NC1=CC(OC(F)F)=CC=C1 CS13961 [0,2,0,0,0,0|2,0,0]=4 1084 B11R1.157 NC1=CC(SC(F)F)=CC=C1 MC430927 [0,2,0,0,0,0|2,0,0]=4 1085 B11R1.157 NC1=CC=CC(CC(=O)O)=C1 CS21911 [0,2,0,0,0,0|1,0,1]=4 1086 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 CS10775 [0,2,0,0,0,0|1,0,1]=4 1087 B11R1.157 O=C(O)CC1=CC(Cl)=CC=C1 CS21923 [0,2,0,0,0,0|1,0,1]=4 1088 B11R1.157 O=C(O)CC1=CC(F)=CC=C1 MC40173 [0,2,0,0,0,0|1,0,1]=4 1089 B11R1.157 O=C(O)CC1=CC(I)=CC=C1 CS20851 [0,2,0,0,0,0|1,0,1]=4 1090 B11R1.157 O=C(O)CC1=CC(O)=CC=C1 CS20944 [0,2,0,0,0,0|1,0,1]=4 1091 B11R1.157 OC1=CC(OC(F)F)=CC=C1 MC431656 [0,2,0,0,0,0|2,0,0]=4 1092 B11R1.189 C=CCC1=CC=CC(OC)=C1 MC425775 [0,2,0,0,0,0|1,0,1]=4 1093 B11R1.189 CCOC1=CC=CC(C=O)=C1 MC433437 [0,2,0,0,0,0|2,0,0]=4 1094 B11R1.189 COC1=CC=CC(CC#N)=C1 CS11040 [0,2,0,0,0,0|0,0,2]=4 1095 B11R1.189 COC1=CC=CC(CCN)=C1 CS13916 [0,2,0,0,0,0|0,0,0]=2 1096 B11R1.189 COC1=CC=CC(CCO)=C1 CS22342 [0,2,0,0,0,0|1,0,0]=3 1097 B11R1.189 COCC1=CC=CC(C#N)=C1 CS18233 [0,2,0,0,0,0|2,0,0]=4 1098 B11R1.189 COCC1=CC=CC(CN)=C1 CS15687 [0,2,0,0,0,0|2,0,0]=4 1099 B11R1.189 N#CC1=CC(CCO)=CC=C1 MC431317 [0,2,0,0,0,0|1,0,0]=3 1100 B11R1.189 N#CC1=CC(CCO)=NC=C1 MC103750 [0,2,0,0,0,0|2,0,0]=4 1101 B11R1.189 NCC1=CC=CC(CCO)=C1 CS17053 [0,2,0,0,0,0|1,0,0]=3 1102 B11R1.7 C#CC(C)(O)C1=CC=CC=C1 MC425780 [0,2,0,0,0,0|1,0,1]=4 1103 B11R1.7 CC(Br)(CBr)C1=CC=NC=C1 MC111871 [0,2,0,0,0,0|2,0,0]=4 1104 B11R1.7 FC(F)(CBr)C1=CC=CC=C1 MC106429 [0,2,0,0,0,0|1,0,0]=3 1105 B11R1.7 NCC(F)(F)C1=NC=CC=C1 MC104009 [0,2,0,0,0,0|1,0,0]=3 1106 B11R1.7 OCC(F)(F)C1=CC=CC=C1 MC430789 [0,2,0,0,0,0|1,0,0]=3 1107 B11R1.12 CCP(CC)c1ccccc1 MC444851 [0,2,0,0,0,0|2,0,0]=4 1108 B11R1.12 CNC(CO)C1=CC=CC=C1 CS17955 [0,2,0,0,0,0|1,0,0]=3 1109 B11R1.12 COC(OC)c1ccccc1 CS10959 [0,2,0,0,0,0|2,0,0]=4 1110 B11R1.12 NCC(CO)C1=CC=CC=C1 MC105854 [0,2,0,0,0,0|0,0,0]=2 1111 B11R1.12 NCC(CO)C1=CC=CC=C1 MC105855 [0,2,0,0,0,0|0,0,0]=2 1112 B11R1.12 OCC(CO)C1=CC=CC=C1 CS21198 [0,2,0,0,0,0|1,0,0]=3 1113 B11R1.16 CC(N=C=O)C1=CC=CC=C1 MC20438 [0,2,0,0,0,0|1,0,1]=4 1114 B11R1.16 CCCC(=O)C1=CC=CN=C1 MC443690 [0,2,0,0,0,0|2,0,0]=4 1115 B11R1.16 CN(CCN)C1=CC=CC=C1 CS11704 [0,2,0,0,0,0|0,0,0]=2 1116 B11R1.16 CNCC(C)C1=CC=CC=C1 MC446681 [0,2,0,0,0,0|0,0,0]=2 1117 B11R1.16 CNCC(O)C1=CC=CC=C1 MC446674 [0,2,0,0,0,0|0,0,0]=2 1118 B11R1.16 N#CCC(=O)C1=CC=CC=C1 CS10995 [0,2,0,0,0,0|0,0,2]=4 1119 B11R1.16 NC(CCO)C1=CC=CC=C1 CS18735 [0,2,0,0,0,0|1,0,0]=3 1120 B11R1.16 NC(CCO)C1=CC=CC=C1 CS21217 [0,2,0,0,0,0|1,0,0]=3 1121 B11R1.16 O=C(CCCl)C1=CC=CC=C1 MC41279 [0,2,0,0,0,0|1,0,0]=3 1122 B11R1.16 OC(CCCl)C1=CC=CC=C1 CS10897 [0,2,0,0,0,0|1,0,0]=3 1123 B11R1.16 OC(CCCl)C1=CC=CC=C1 CS22197 [0,2,0,0,0,0|1,0,0]=3 1124 B11R1.16 OC(CCCl)C1=CC=CC=C1 MC20313 [0,2,0,0,0,0|1,0,0]=3 1125 B11R1.36 CC(Br)C(=O)C1=CC=CC=C1 MC443670 [0,2,0,0,0,0|1,0,1]=4 1126 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 CS10890 [0,2,0,0,0,0|1,0,1]=4 1127 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 CS14544 [0,2,0,0,0,0|1,0,1]=4 1128 B11R1.36 CN(C(N)=S)C1=CC=CC=C1 MC427369 [0,2,0,0,0,0|1,0,1]=4 1129 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 CS15488 [0,2,0,0,0,0|0,0,1]=3 1130 B11R1.36 NC(=O)C(N)c1ccccc1 MC438104 [0,2,0,0,0,0|0,0,1]=3 1131 B11R1.36 NC(C(=O)Cl)C1=CC=CC=C1 CS15858 [0,2,0,0,0,0|1,0,1]=4 1132 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 CS11192 [0,2,0,0,0,0|1,0,1]=4 1133 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 CS14083 [0,2,0,0,0,0|1,0,1]=4 1134 B11R1.36 NC(C(=O)O)c1ccccc1 MC438102 [0,2,0,0,0,0|1,0,1]=4 1135 B11R1.36 NC(C(=O)O)c1ccccc1 MC438103 [0,2,0,0,0,0|1,0,1]=4 1136 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 CS10861 [0,2,0,0,0,0|1,0,1]=4 1137 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 CS10862 [0,2,0,0,0,0|1,0,1]=4 1138 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 CS15279 [0,2,0,0,0,0|1,0,1]=4 1139 B11R1.28 BrCCCOC1=CC=CC=C1 CS15031 [0,2,0,0,0,0|1,0,0]=3 1140 B11R1.28 BrCCOCC1=CC=CC=C1 CS10998 [0,2,0,0,0,0|1,0,0]=3 1141 B11R1.28 C=CCOCC1=CC=CC=C1 MC425090 [0,2,0,0,0,0|1,0,0]=3 1142 B11R1.28 CNCCCC1=CC=CC=C1 MC425598 [0,2,0,0,0,0|0,0,0]=2 1143 B11R1.28 CNCCCC1=NC=CC=C1 MC430496 [0,2,0,0,0,0|1,0,0]=3 1144 B11R1.28 Cl[Zn]C\C=C\c1ccccc1 MC116079 [0,2,0,0,0,0|1,0,1]=4 1145 B11R1.28 N#CCNCC1=CC=CC=C1 MC442440 [0,2,0,0,0,0|0,0,1]=3 1146 B11R1.28 NCCOCC1=CC=CC=C1 CS20892 [0,2,0,0,0,0|0,0,0]=2 1147 B11R1.28 O=CCOCC1=CC=CC=C1 MC429084 [0,2,0,0,0,0|1,0,0]=3 1148 B11R1.28 OCCC#CC1=CC=NC=C1 MC425717 [0,2,0,0,0,0|2,0,0]=4 1149 B11R1.28 OCCCCC1=CC=CC=C1 CS11170 [0,2,0,0,0,0|1,0,0]=3 1150 B11R1.28 OCCCCC1=CC=NC=C1 CS13477 [0,2,0,0,0,0|2,0,0]=4 1151 B11R1.28 OCCOCC1=CC=CC=C1 MC20071 [0,2,0,0,0,0|1,0,0]=3 1152 B11R1.40 C#CC(O)CC1=CC=CC=C1 MC425691 [0,2,0,0,0,0|1,0,0]=3 1153 B11R1.40 CC(C#N)NC1=CC=CC=C1 MC428132 [0,2,0,0,0,0|0,0,2]=4 1154 B11R1.40 CCC(=O)CC1=CC=CC=C1 MC41289 [0,2,0,0,0,0|1,0,0]=3 1155 B11R1.40 NC(CO)CC1=CC=CC=C1 CS21216 [0,2,0,0,0,0|0,0,0]=2 1156 B11R1.40 NC(CO)CC1=CC=CC=C1 MC425862 [0,2,0,0,0,0|0,0,0]=2 1157 B11R1.40 NNC(=O)CC1=CC=NC=C1 CS21751 [0,2,0,0,0,0|1,0,1]=4 1158 B11R1.40 O=C(CO)CC1=CC=CC=C1 MC107738 [0,2,0,0,0,0|1,0,0]=3 1159 B11R1.91 CC(=O)COC1=CC=CC=C1 MC433248 [0,2,0,0,0,0|1,0,1]=4 1160 B11R1.91 CN(C)CCC1=CC=CC=C1 MC446671 [0,2,0,0,0,0|0,0,0]=2 1161 B11R1.91 NC(=O)OCC1=CC=CC=C1 MC428066 [0,2,0,0,0,0|0,0,1]=3 1162 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 CS21725 [0,2,0,0,0,0|0,0,2]=4 1163 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 MC42251 [0,2,0,0,0,0|1,0,1]=4 1164 B11R1.91 O=C(O)CNc1ccccc1 MC439073 [0,2,0,0,0,0|1,0,1]=4 1165 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 CS20444 [0,2,0,0,0,0|0,0,1]=3 1166 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 CS11014 [0,2,0,0,0,0|2,0,0]=4 1167 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 MC20424 [0,2,0,0,0,0|2,0,0]=4 1168 B11R1.509 FC(F)(F)OC1=CC=CC=C1 MC41392 [0,2,0,0,0,0|2,0,0]=4 1169 B11R1.509 FC(F)(F)SC1=CC=CC=C1 MC41394 [0,2,0,0,0,0|2,0,0]=4 1170 B11R1.509 NS(=O)(=O)CC1=CC=CC=C1 CS20418 [0,2,0,0,0,0|1,0,0]=3 1171 B11R1.509 O=S(=O)(Cl)CC1=CC=CC=C1 CS20295 [0,2,0,0,0,0|2,0,0]=4 1172 B11R1.509 O=S(=O)(F)CC1=CC=CC=C1 MC428333 [0,2,0,0,0,0|2,0,0]=4 1173 B9R2.50 C1=CC=C2CCC2=C1 CS19267 [1,0,0,1,0,0|0,0,0]=2 1174 B11R2.34 BrC1=CC=C(C2CC2)C=C1 CS22811 [0,1,0,1,0,0|1,0,0]=3 1175 B11R2.34 BrC1=NC=C(C2CC2)C=C1 MC442244 [0,1,0,1,0,0|2,0,0]=4 1176 B11R2.34 CC1=CC=C(C2CO2)C=C1 MC112355 [0,1,0,1,0,0|1,0,0]=3 1177 B11R2.34 NC1=CC=C(C2CC2)C=C1 CS17100 [0,1,0,1,0,0|1,0,0]=3 1178 B11R2.36 BrC1=CC2=C(C=C1)CCO2 MC441170 [0,1,0,1,0,0|1,0,0]=3 1179 B11R2.36 BrC1=CC2=C(C=C1)NC=N2 CS10238 [0,1,0,1,0,0|1,0,1]=4 1180 B11R2.36 BrC1=CC2=C(C=C1)OCC2 MC20389 [0,1,0,1,0,0|1,0,0]=3 1181 B11R2.36 BrC1=CC=C2C=CNC2=C1 CS22089 [0,1,0,1,0,0|0,0,2]=4 1182 B11R2.36 BrC1=CC=C2C=NNC2=C1 CS18484 [0,1,0,1,0,0|1,0,1]=4 1183 B11R2.36 BrC1=CC=C2CCCC2=C1 MC443408 [0,1,0,1,0,0|1,0,0]=3 1184 B11R2.36 BrC1=CC=C2CCNC2=C1 CS17623 [0,1,0,1,0,0|0,0,0]=2 1185 B11R2.36 BrC1=CC=C2CNCC2=C1 CS14408 [0,1,0,1,0,0|2,0,0]=4 1186 B11R2.36 BrC1=CC=C2CNCC2=C1 MC20658 [0,1,0,1,0,0|2,0,0]=4 1187 B11R2.36 BrC1=CC=C2NC=CC2=C1 CS17784 [0,1,0,1,0,0|0,0,2]=4 1188 B11R2.36 BrC1=CC=C2NCCC2=C1 CS10836 [0,1,0,1,0,0|0,0,0]=2 1189 B11R2.36 BrC1=CC=C2NN=CC2=C1 CS15506 [0,1,0,1,0,0|1,0,1]=4 1190 B11R2.36 BrC1=CN=C2CCCC2=C1 CS22164 [0,1,0,1,0,0|2,0,0]=4 1191 B11R2.36 BrC1=CN=C2NCCC2=C1 CS18623 [0,1,0,1,0,0|1,0,0]=3 1192 B11R2.36 Brc1ccc2c(c1)OCO2 CS19789 [0,1,0,1,0,0|2,0,0]=4 1193 B11R2.36 CC1=CC=C2C=CCC2=C1 MC446782 [0,1,0,1,0,0|1,0,1]=4 1194 B11R2.36 CC1=CC=C2CCNC2=C1 MC106356 [0,1,0,1,0,0|0,0,0]=2 1195 B11R2.36 CC1=CC=C2CNCC2=C1 MC431420 [0,1,0,1,0,0|2,0,0]=4 1196 B11R2.36 CC1=CC=C2NC=CC2=C1 CS11033 [0,1,0,1,0,0|0,0,2]=4 1197 B11R2.36 CC1=CC=C2NN=CC2=C1 MC425397 [0,1,0,1,0,0|1,0,1]=4 1198 B11R2.36 ClC1=CC2=C(C=C1)N=CN2 MC443515 [0,1,0,1,0,0|1,0,1]=4 1199 B11R2.36 ClC1=CC2=C(C=N1)CCN2 CS14935 [0,1,0,1,0,0|1,0,0]=3 1200 B11R2.36 ClC1=CC=C2C=CNC2=C1 CS22097 [0,1,0,1,0,0|0,0,2]=4 1201 B11R2.36 ClC1=CC=C2C=NNC2=C1 CS18428 [0,1,0,1,0,0|1,0,1]=4 1202 B11R2.36 ClC1=CC=C2CCCC2=C1 MC106098 [0,1,0,1,0,0|1,0,0]=3 1203 B11R2.36 ClC1=CC=C2CCNC2=C1 CS19407 [0,1,0,1,0,0|0,0,0]=2 1204 B11R2.36 ClC1=CC=C2CNCC2=C1 CS15340 [0,1,0,1,0,0|2,0,0]=4 1205 B11R2.36 ClC1=CC=C2CNCC2=C1 MC441088 [0,1,0,1,0,0|2,0,0]=4 1206 B11R2.36 ClC1=CC=C2NC=CC2=C1 CS22049 [0,1,0,1,0,0|0,0,2]=4 1207 B11R2.36 ClC1=CC=C2NCCC2=C1 MC20079 [0,1,0,1,0,0|0,0,0]=2 1208 B11R2.36 ClC1=CC=C2NN=CC2=C1 CS10312 [0,1,0,1,0,0|1,0,1]=4 1209 B11R2.36 FC1=CC2=C(C=C1)CCO2 MC432264 [0,1,0,1,0,0|1,0,0]=3 1210 B11R2.36 FC1=CC=C2C=CNC2=C1 MC31140 [0,1,0,1,0,0|0,0,2]=4 1211 B11R2.36 FC1=CC=C2C=NNC2=C1 CS18253 [0,1,0,1,0,0|1,0,1]=4 1212 B11R2.36 FC1=CC=C2CC=CC2=C1 MC446777 [0,1,0,1,0,0|1,0,1]=4 1213 B11R2.36 FC1=CC=C2CCCC2=C1 CS16751 [0,1,0,1,0,0|1,0,0]=3 1214 B11R2.36 FC1=CC=C2CCNC2=C1 MC443334 [0,1,0,1,0,0|0,0,0]=2 1215 B11R2.36 FC1=CC=C2CNCC2=C1 CS15207 [0,1,0,1,0,0|2,0,0]=4 1216 B11R2.36 FC1=CC=C2NC=CC2=C1 CS22058 [0,1,0,1,0,0|0,0,2]=4 1217 B11R2.36 FC1=CC=C2NN=CC2=C1 CS18254 [0,1,0,1,0,0|1,0,1]=4 1218 B11R2.36 IC1=CC2=C(C=C1)OCC2 MC442476 [0,1,0,1,0,0|1,0,0]=3 1219 B11R2.36 IC1=CC2=C(C=C1)OCO2 MC442800 [0,1,0,1,0,0|2,0,0]=4 1220 B11R2.36 IC1=CC=C2C=CNC2=C1 CS13433 [0,1,0,1,0,0|0,0,2]=4 1221 B11R2.36 IC1=CC=C2C=NNC2=C1 MC20851 [0,1,0,1,0,0|1,0,1]=4 1222 B11R2.36 IC1=CC=C2NN=CC2=C1 CS10408 [0,1,0,1,0,0|1,0,1]=4 1223 B11R2.36 NC1=CC2=C(C=C1)N=CN2 MC41743 [0,1,0,1,0,0|1,0,1]=4 1224 B11R2.36 NC1=CC2=C(C=C1)OCC2 MC442475 [0,1,0,1,0,0|1,0,0]=3 1225 B11R2.36 NC1=CC2=C(C=C1)OCO2 CS20315 [0,1,0,1,0,0|2,0,0]=4 1226 B11R2.36 NC1=CC=C2C=NNC2=C1 CS15642 [0,1,0,1,0,0|1,0,1]=4 1227 B11R2.36 NC1=CC=C2CCNC2=C1 MC425589 [0,1,0,1,0,0|0,0,0]=2 1228 B11R2.36 NC1=CC=C2CN=NC2=C1 MC107021 [0,1,0,1,0,0|1,0,1]=4 1229 B11R2.36 NC1=CC=C2CNCC2=C1 MC20849 [0,1,0,1,0,0|2,0,0]=4 1230 B11R2.36 NC1=CC=C2CNCC2=C1 MC442457 [0,1,0,1,0,0|2,0,0]=4 1231 B11R2.36 NC1=CC=C2COCC2=C1 CS20519 [0,1,0,1,0,0|2,0,0]=4 1232 B11R2.36 NC1=CC=C2NC=CC2=C1 CS20917 [0,1,0,1,0,0|0,0,2]=4 1233 B11R2.36 NC1=CC=C2NN=CC2=C1 MC444376 [0,1,0,1,0,0|1,0,1]=4 1234 B11R2.36 NC1=CN=C2CCCC2=C1 MC100354 [0,1,0,1,0,0|2,0,0]=4 1235 B11R2.36 OC1=CC2=C(C=C1)CCO2 CS16031 [0,1,0,1,0,0|1,0,0]=3 1236 B11R2.36 OC1=CC=C2C=NNC2=C1 CS20712 [0,1,0,1,0,0|1,0,1]=4 1237 B11R2.36 OC1=CC=C2NC=CC2=C1 CS20861 [0,1,0,1,0,0|0,0,2]=4 1238 B11R2.36 OC1=CC=C2NCCC2=C1 CS21042 [0,1,0,1,0,0|0,0,0]=2 1239 B11R2.36 OC1=CC=C2NN=CC2=C1 CS20711 [0,1,0,1,0,0|1,0,1]=4 1240 B11R2.10 BrC1=CC2=CC=CC=C2C1 CS21490 [0,1,0,1,0,0|1,0,1]=4 1241 B11R2.10 BrC1=NC2=C(C=CC=C2)N1 CS21331 [0,1,0,1,0,0|1,0,1]=4 1242 B11R2.10 CC1=CC2=CC=CC=C2C1 CS11052 [0,1,0,1,0,0|1,0,1]=4 1243 B11R2.10 CC1=CC2=CC=CC=C2N1 CS18563 [0,1,0,1,0,0|0,0,2]=4 1244 B11R2.10 CC1=NC2=C(C=CC=C2)N1 CS15288 [0,1,0,1,0,0|1,0,1]=4 1245 B11R2.10 CC1CC2=CC=CC=C2N1 MC105455 [0,1,0,1,0,0|0,0,0]=2 1246 B11R2.10 CC1CC2=CC=CC=C2N1 MC445120 [0,1,0,1,0,0|0,0,0]=2 1247 B11R2.10 ClC1=CC2=CC=CC=C2N1 MC444183 [0,1,0,1,0,0|0,0,2]=4 1248 B11R2.10 ClC1=NC2=C(C=CC=C2)N1 CS21427 [0,1,0,1,0,0|1,0,1]=4 1249 B11R2.10 NC1=CC2=C(C=CC=C2)S1 CS12846 [0,1,0,1,0,0|0,0,2]=4 1250 B11R2.10 NC1=NC2=C(C=CC=C2)N1 CS16315 [0,1,0,1,0,0|1,0,1]=4 1251 B11R2.10 NC1=NC2=C(C=CC=C2)O1 MC31149 [0,1,0,1,0,0|1,0,1]=4 1252 B11R2.10 NC1=NC2=C(C=CC=C2)S1 MC41744 [0,1,0,1,0,0|1,0,1]=4 1253 B11R2.10 NC1CC2=CC=CC=C2C1 CS19882 [0,1,0,1,0,0|0,0,0]=2 1254 B11R2.10 NN1CC2=CC=CC=C2C1 MC442461 [0,1,0,1,0,0|1,0,0]=3 1255 B11R2.10 O=C1CC2=C(C=CC=C2)O1 MC20944 [0,1,0,1,0,0|1,0,1]=4 1256 B11R2.10 O=C1CC2=CC=CC=C2C1 CS16080 [0,1,0,1,0,0|1,0,1]=4 1257 B11R2.10 O=C1CC2=CC=CC=C2N1 CS15184 [0,1,0,1,0,0|0,0,1]=3 1258 B11R2.10 O=C1CC2=CC=NC=C2N1 MC100071 [0,1,0,1,0,0|1,0,1]=4 1259 B11R2.10 O=C1NC2=C(C=CC=C2)O1 CS15190 [0,1,0,1,0,0|1,0,1]=4 1260 B11R2.10 OC1=NC2=C(C=CC=C2)N1 CS20242 [0,1,0,1,0,0|1,0,1]=4 1261 B11R2.10 OC1CC2=CC=CC=C2C1 CS21608 [0,1,0,1,0,0|1,0,0]=3 1262 B11R2.10 ON1CC2=CC=CC=C2C1 MC41790 [0,1,0,1,0,0|2,0,0]=4 1263 B11R2.10 SC1=NC2=C(C=CC=C2)N1 MC20678 [0,1,0,1,0,0|1,0,1]=4 1264 B11R2.20 C1=CC2=C(CCCC2)N=C1 CS13407 [0,1,0,1,0,0|2,0,0]=4 1265 B11R2.20 C1=CC2=C(CCNC2)N=C1 CS14841 [0,1,0,1,0,0|1,0,0]=3 1266 B11R2.20 C1=CC2=C(CNCC2)N=C1 MC104317 [0,1,0,1,0,0|1,0,0]=3 1267 B11R2.20 C1=CC2=C(CNCC2)N=C1 MC431486 [0,1,0,1,0,0|1,0,0]=3 1268 B11R2.20 C1=CC2=C(N=C1)NCCN2 CS12464 [0,1,0,1,0,0|1,0,0]=3 1269 B11R2.20 C1=CC=C2CC=CCC2=C1 CS11050 [0,1,0,1,0,0|1,0,1]=4 1270 B11R2.20 C1=CC=C2CNCCC2=C1 CS19412 [0,1,0,1,0,0|0,0,0]=2 1271 B11R2.20 C1=CC=C2COCCC2=C1 CS19933 [0,1,0,1,0,0|1,0,0]=3 1272 B11R2.20 C1=CC=C2NCCNC2=C1 CS19000 [0,1,0,1,0,0|0,0,0]=2 1273 B11R2.20 C1=CN=C2NCCCC2=C1 CS20465 [0,1,0,1,0,0|1,0,0]=3 1274 B11R2.20 C1=NC=C2CCCNC2=C1 MC105356 [0,1,0,1,0,0|1,0,0]=3 1275 B11R2.20 C1=NC=C2CCNCC2=C1 CS15863 [0,1,0,1,0,0|1,0,0]=3 1276 B11R2.20 C1=NC=C2CCNCC2=C1 MC115896 [0,1,0,1,0,0|1,0,0]=3 1277 B11R2.20 C1=NC=C2CNCCC2=C1 CS17812 [0,1,0,1,0,0|1,0,0]=3 1278 B11R2.20 C1=NC=C2CNCCC2=C1 MC113298 [0,1,0,1,0,0|1,0,0]=3 1279 B11R2.20 C1=NC=NC2=C1CCNC2 MC103871 [0,1,0,1,0,0|2,0,0]=4 1280 B11R2.20 C1=NC=NC2=C1CNCC2 CS11914 [0,1,0,1,0,0|2,0,0]=4 1281 B11R2.20 C1=NC=NC2=C1CNCC2 CS15273 [0,1,0,1,0,0|2,0,0]=4 1282 B11R2.55 BrC1=NC=CC=C1C2CC2 CS16928 [0,1,0,1,0,0|2,0,0]=4 1283 B11R2.55 ClC1=C(C2CO2)C=CC=C1 MC427453 [0,1,0,1,0,0|1,0,0]=3 1284 B11R2.55 ClC1=NC=CC=C1C2CC2 MC430628 [0,1,0,1,0,0|2,0,0]=4 1285 B11R2.55 NC1=C(C2CC2)C=NC=C1 CS17282 [0,1,0,1,0,0|2,0,0]=4 1286 B11R2.106 BrC1=C2C=CNC2=CC=C1 CS20686 [0,1,0,1,0,0|0,0,2]=4 1287 B11R2.106 BrC1=C2C=NNC2=CC=C1 CS18090 [0,1,0,1,0,0|1,0,1]=4 1288 B11R2.106 BrC1=C2CCCC2=CC=C1 CS16754 [0,1,0,1,0,0|1,0,0]=3 1289 B11R2.106 BrC1=C2CCNC2=CC=C1 CS18513 [0,1,0,1,0,0|0,0,0]=2 1290 B11R2.106 BrC1=C2CNCC2=CC=C1 CS22684 [0,1,0,1,0,0|2,0,0]=4 1291 B11R2.106 BrC1=C2CNCC2=CC=C1 MC443236 [0,1,0,1,0,0|2,0,0]=4 1292 B11R2.106 BrC1=C2NC=CC2=CC=C1 CS10709 [0,1,0,1,0,0|0,0,2]=4 1293 B11R2.106 BrC1=C2NN=CC2=CC=C1 MC444453 [0,1,0,1,0,0|1,0,1]=4 1294 B11R2.106 BrC1=CC=CC2=C1N=CN2 CS12099 [0,1,0,1,0,0|1,0,1]=4 1295 B11R2.106 BrC1=CC=CC2=C1OCC2 CS12983 [0,1,0,1,0,0|1,0,0]=3 1296 B11R2.106 BrC1=CC=CC2=C1OCO2 CS22623 [0,1,0,1,0,0|2,0,0]=4 1297 B11R2.106 BrC1=CN=CC2=C1NCC2 MC102119 [0,1,0,1,0,0|1,0,0]=3 1298 B11R2.106 CC1=C2C=CNC2=CC=C1 CS21706 [0,1,0,1,0,0|0,0,2]=4 1299 B11R2.106 CC1=C2C=NNC2=CC=C1 CS22943 [0,1,0,1,0,0|1,0,1]=4 1300 B11R2.106 CC1=C2CCNC2=CC=C1 MC425439 [0,1,0,1,0,0|0,0,0]=2 1301 B11R2.106 CC1=C2CNCC2=CC=C1 CS17946 [0,1,0,1,0,0|2,0,0]=4 1302 B11R2.106 CC1=C2NC=CC2=CC=C1 CS11034 [0,1,0,1,0,0|0,0,2]=4 1303 B11R2.106 CC1=C2NCCC2=CC=C1 CS18412 [0,1,0,1,0,0|0,0,0]=2 1304 B11R2.106 CC1=C2NN=CC2=CC=C1 CS10824 [0,1,0,1,0,0|1,0,1]=4 1305 B11R2.106 CC1=CC=CC2=C1NC=N2 MC106503 [0,1,0,1,0,0|1,0,1]=4 1306 B11R2.106 ClC1=C2C=CNC2=CC=C1 CS10725 [0,1,0,1,0,0|0,0,2]=4 1307 B11R2.106 ClC1=C2C=NNC2=CC=C1 CS22715 [0,1,0,1,0,0|1,0,1]=4 1308 B11R2.106 ClC1=C2CCCC2=NC=C1 CS12915 [0,1,0,1,0,0|2,0,0]=4 1309 B11R2.106 ClC1=C2CCNC2=CC=C1 CS10845 [0,1,0,1,0,0|0,0,0]=2 1310 B11R2.106 ClC1=C2CNCC2=CC=C1 CS15338 [0,1,0,1,0,0|2,0,0]=4 1311 B11R2.106 ClC1=C2NC=CC2=CC=C1 CS14936 [0,1,0,1,0,0|0,0,2]=4 1312 B11R2.106 ClC1=C2NN=CC2=CC=C1 MC444455 [0,1,0,1,0,0|1,0,1]=4 1313 B11R2.106 ClC1=NC=CC2=C1CCN2 MC104776 [0,1,0,1,0,0|1,0,0]=3 1314 B11R2.106 ClC1=NC=NC2=C1CCN2 CS12360 [0,1,0,1,0,0|2,0,0]=4 1315 B11R2.106 FC1=C2C=CNC2=CC=C1 CS10745 [0,1,0,1,0,0|0,0,2]=4 1316 B11R2.106 FC1=C2C=NNC2=CC=C1 MC425694 [0,1,0,1,0,0|1,0,1]=4 1317 B11R2.106 FC1=C2CCNC2=CC=C1 MC433917 [0,1,0,1,0,0|0,0,0]=2 1318 B11R2.106 FC1=C2CNCC2=CC=C1 MC430022 [0,1,0,1,0,0|2,0,0]=4 1319 B11R2.106 FC1=C2NC=CC2=CC=C1 CS10747 [0,1,0,1,0,0|0,0,2]=4 1320 B11R2.106 FC1=C2NN=CC2=CC=C1 CS10814 [0,1,0,1,0,0|1,0,1]=4 1321 B11R2.106 FC1=CC=CC2=C1N=CN2 MC445693 [0,1,0,1,0,0|1,0,1]=4 1322 B11R2.106 IC1=C2C=NNC2=CC=C1 MC444353 [0,1,0,1,0,0|1,0,1]=4 1323 B11R2.106 IC1=C2CCNC2=CC=C1 MC113807 [0,1,0,1,0,0|0,0,0]=2 1324 B11R2.106 IC1=CC=CC2=C1NC=N2 MC427402 [0,1,0,1,0,0|1,0,1]=4 1325 B11R2.106 IC1=CC=CC2=C1OCO2 CS12923 [0,1,0,1,0,0|2,0,0]=4 1326 B11R2.106 NC1=C2C=CNC2=CC=C1 CS20916 [0,1,0,1,0,0|0,0,2]=4 1327 B11R2.106 NC1=C2CCCC2=NC=C1 MC115911 [0,1,0,1,0,0|2,0,0]=4 1328 B11R2.106 NC1=C2CCOC2=CC=C1 CS21040 [0,1,0,1,0,0|1,0,0]=3 1329 B11R2.106 NC1=C2NC=CC2=CC=C1 CS10501 [0,1,0,1,0,0|0,0,2]=4 1330 B11R2.106 NC1=C2NN=CC2=CC=C1 MC444437 [0,1,0,1,0,0|1,0,1]=4 1331 B11R2.106 NC1=CC=CC2=C1C=NN2 CS20710 [0,1,0,1,0,0|1,0,1]=4 1332 B11R2.106 NC1=CC=CC2=C1CCN2 CS11498 [0,1,0,1,0,0|0,0,0]=2 1333 B11R2.106 NC1=CC=CC2=C1CNC2 MC442084 [0,1,0,1,0,0|2,0,0]=4 1334 B11R2.106 NC1=CC=CC2=C1NC=N2 MC20436 [0,1,0,1,0,0|1,0,1]=4 1335 B11R2.106 O=C1C=CC=C2NCCN12 CS15111 [0,1,0,1,0,0|1,0,0]=3 1336 B11R2.106 O=C1C=CC=C2NCCN12 CS17486 [0,1,0,1,0,0|1,0,0]=3 1337 B11R2.106 OC1=C2C=NNC2=CC=C1 MC444351 [0,1,0,1,0,0|1,0,1]=4 1338 B11R2.106 OC1=C2NN=CC2=CC=C1 CS17029 [0,1,0,1,0,0|1,0,1]=4 1339 B11R2.106 OC1=CC=CC2=C1C=CN2 CS10821 [0,1,0,1,0,0|0,0,2]=4 1340 B11R2.106 OC1=CC=CC2=C1CCC2 CS22898 [0,1,0,1,0,0|1,0,0]=3 1341 B11R2.35 BrC1=CC(C2CC2)=CN=C1 MC442247 [0,1,0,1,0,0|2,0,0]=4 1342 B11R2.35 BrC1=CC=CC(C2CO2)=C1 MC111470 [0,1,0,1,0,0|1,0,0]=3 1343 B11R2.35 BrC1=NC(C2CC2)=CC=C1 MC442245 [0,1,0,1,0,0|2,0,0]=4 1344 B11R2.35 ClC1=CC=CC(C2CO2)=C1 MC42002 [0,1,0,1,0,0|1,0,0]=3 1345 B11R2.1 BrC1=NNC2=CC=CC=C21 MC442207 [0,1,0,1,0,0|1,0,1]=4 1346 B11R2.1 CC1=CCC2=CC=CC=C12 MC106180 [0,1,0,1,0,0|1,0,1]=4 1347 B11R2.1 CC1=CNC2=CC=CC=C12 CS11030 [0,1,0,1,0,0|0,0,2]=4 1348 B11R2.1 CC1=NNC2=CC=CC=C21 CS17372 [0,1,0,1,0,0|1,0,1]=4 1349 B11R2.1 CN1C=CC2=CC=CC=C21 CS11026 [0,1,0,1,0,0|0,0,2]=4 1350 B11R2.1 ClC1=CNC2=CC=CC=C12 MC427199 [0,1,0,1,0,0|0,0,2]=4 1351 B11R2.1 NC1=CSC2=C1C=CC=C2 CS13998 [0,1,0,1,0,0|0,0,2]=4 1352 B11R2.1 NC1=NNC2=CC=CC=C21 CS20708 [0,1,0,1,0,0|1,0,1]=4 1353 B11R2.1 NC1=NOC2=C1C=CC=C2 CS20240 [0,1,0,1,0,0|1,0,1]=4 1354 B11R2.1 NC1=NSC2=C1C=CC=C2 CS13975 [0,1,0,1,0,0|1,0,1]=4 1355 B11R2.1 NC1CCC2=CC=CC=C21 CS16005 [0,1,0,1,0,0|0,0,0]=2 1356 B11R2.1 NC1CCC2=CC=CC=C21 CS19275 [0,1,0,1,0,0|0,0,0]=2 1357 B11R2.1 NC1CCC2=CC=CC=C21 CS19803 [0,1,0,1,0,0|0,0,0]=2 1358 B11R2.1 NC1CCC2=CC=CC=C21 CS20307 [0,1,0,1,0,0|0,0,0]=2 1359 B11R2.1 NC1CCC2=CC=CC=C21 MC425841 [0,1,0,1,0,0|0,0,0]=2 1360 B11R2.1 NC1COC2=NC=CC=C21 MC443539 [0,1,0,1,0,0|1,0,0]=3 1361 B11R2.1 NN1C=CC2=CC=CC=C21 CS19942 [0,1,0,1,0,0|0,0,2]=4 1362 B11R2.1 O=C1CCC2=CC=CC=C12 CS18668 [0,1,0,1,0,0|1,0,0]=3 1363 B11R2.1 O=C1CCC2=CC=CN=C12 CS10816 [0,1,0,1,0,0|2,0,0]=4 1364 B11R2.1 O=C1CCC2=NC=CC=C12 CS18212 [0,1,0,1,0,0|2,0,0]=4 1365 B11R2.1 O=C1COC2=C1C=CC=C2 CS20787 [0,1,0,1,0,0|1,0,1]=4 1366 B11R2.1 O=C1CSC2=C1C=CC=C2 CS20606 [0,1,0,1,0,0|1,0,1]=4 1367 B11R2.1 O=C1NCC2=CC=CC=C12 CS11515 [0,1,0,1,0,0|1,0,1]=4 1368 B11R2.1 O=C1NNC2=CC=CC=C12 MC441212 [0,1,0,1,0,0|1,0,1]=4 1369 B11R2.1 O=C1OCC2=CC=CC=C12 CS11853 [0,1,0,1,0,0|1,0,1]=4 1370 B11R2.1 OC1CCC2=CC=CN=C21 CS10573 [0,1,0,1,0,0|2,0,0]=4 1371 B11R2.1 ON1N=NC2=C1C=CC=C2 CS19338 [0,1,0,1,0,0|2,0,0]=4 1372 B11R2.1 ON1N=NC2=C1C=CC=C2 CS22993 [0,1,0,1,0,0|2,0,0]=4 1373 B11R2.4 NC1CC1C2=CC=CC=C2 MC100890 [0,1,0,1,0,0|0,0,0]=2 1374 B11R2.4 NC1CC1C2=CC=CC=C2 MC106461 [0,1,0,1,0,0|0,0,0]=2 1375 B11R2.40 BrC1(C2=NC=CC=C2)CC1 MC431657 [0,1,0,1,0,0|2,0,0]=4 1376 B11R2.40 NC1(C2=CC=CC=C2)CC1 MC425296 [0,1,0,1,0,0|1,0,0]=3 1377 B11R2.40 NC1(C2=NC=CC=C2)CC1 MC115574 [0,1,0,1,0,0|2,0,0]=4 1378 B11R2.239 C1=CC(C2CNC2)=NC=N1 MC116097 [0,1,0,1,0,0|2,0,0]=4 1379 B11R2.238 C1=CC=C(CC2CN2)C=C1 CS19482 [0,1,0,1,0,0|0,0,0]=2 1380 B11R2.238 C1=CC=C(SC2CC2)C=C1 MC20576 [0,1,0,1,0,0|1,0,0]=3 1381 B7R1.1 BrCC1=CC=CS1 MC111260 [1,0,0,0,1,0|2,0,0]=4 1382 B7R1.1 BrCC1=COC=C1 MC111404 [1,0,0,0,1,0|2,0,0]=4 1383 B7R1.1 CCC1=NC=CN1 CS21533 [1,0,0,0,1,0|2,0,0]=4 1384 B7R1.1 CCN1C=CC=N1 CS20681 [1,0,0,0,1,0|2,0,0]=4 1385 B7R1.1 COC1=CSC=C1 CS22351 [1,0,0,0,1,0|2,0,0]=4 1386 B7R1.1 ClCC1=CC=CO1 CS13429 [1,0,0,0,1,0|2,0,0]=4 1387 B7R1.1 NCC1=CC=CN1 CS14874 [1,0,0,0,1,0|1,0,0]=3 1388 B7R1.1 NCC1=CC=CO1 MC41689 [1,0,0,0,1,0|1,0,0]=3 1389 B7R1.1 NCC1=CC=CS1 CS22783 [1,0,0,0,1,0|1,0,0]=3 1390 B7R1.1 NCC1=CN=CO1 CS17502 [1,0,0,0,1,0|2,0,0]=4 1391 B7R1.1 NCC1=CN=CO1 CS18508 [1,0,0,0,1,0|2,0,0]=4 1392 B7R1.1 NCC1=CN=CO1 MC104477 [1,0,0,0,1,0|2,0,0]=4 1393 B7R1.1 NCC1=CNC=N1 CS15263 [1,0,0,0,1,0|2,0,0]=4 1394 B7R1.1 NCC1=CNC=N1 CS16828 [1,0,0,0,1,0|2,0,0]=4 1395 B7R1.1 NCC1=CON=C1 MC104809 [1,0,0,0,1,0|2,0,0]=4 1396 B7R1.1 NCC1=CON=C1 MC114871 [1,0,0,0,1,0|2,0,0]=4 1397 B7R1.1 NCC1=CSC=C1 CS22417 [1,0,0,0,1,0|1,0,0]=3 1398 B7R1.1 NCC1=CSC=N1 MC116268 [1,0,0,0,1,0|2,0,0]=4 1399 B7R1.1 NCC1=NC=CS1 MC444202 [1,0,0,0,1,0|2,0,0]=4 1400 B7R1.1 NCC1=NNC=C1 CS15493 [1,0,0,0,1,0|2,0,0]=4 1401 B7R1.1 NCC1=NSC=C1 MC105065 [1,0,0,0,1,0|2,0,0]=4 1402 B7R1.1 NCc1cocn1 MC102412 [1,0,0,0,1,0|2,0,0]=4 1403 B7R1.1 OCC1=CC=CO1 MC41687 [1,0,0,0,1,0|2,0,0]=4 1404 B7R1.1 OCC1=COC=C1 CS22303 [1,0,0,0,1,0|2,0,0]=4 1405 B7R1.1 OCC1=CSC=C1 CS18039 [1,0,0,0,1,0|2,0,0]=4