0 B11R1.83 CCC1=CN=C(CCO)C=C1 CS10373 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.83 CCCC1=CC=C(C=O)C=C1 MC41132 [0,0,0,0,0,0|2,0,2]=4 2 B11R1.83 CCCC1=CC=C(CN)C=C1 CS10109 [0,0,0,0,0,0|2,0,2]=4 3 B11R1.83 CNCC1=CC=C(OC)C=C1 CS18429 [0,0,0,0,0,0|1,0,1]=2 4 B11R1.83 COC1=CC=C(CC#N)C=C1 CS13459 [0,0,0,0,0,0|1,0,1]=2 5 B11R1.83 COC1=CC=C(CNN)C=C1 CS20199 [0,0,0,0,0,0|2,0,0]=2 6 B11R1.83 COC1=CC=C(CNO)C=C1 MC106878 [0,0,0,0,0,0|2,0,0]=2 7 B11R1.83 COC1=CC=C(CON)C=C1 CS20566 [0,0,0,0,0,0|2,0,0]=2 8 B11R1.83 COC1=CC=C(N=C=O)C=C1 MC41047 [0,0,0,0,0,0|2,0,1]=3 9 B11R1.83 COC1=CC=C(\C=N\O)C=C1 MC427343 [0,0,0,0,0,0|2,0,1]=3 10 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 CS10928 [0,0,0,0,0,0|0,0,2]=2 11 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 CS10929 [0,0,0,0,0,0|0,0,2]=2 12 B11R1.83 N#CC1=CC=C(CCBr)C=C1 CS12532 [0,0,0,0,0,0|3,0,1]=4 13 B11R1.83 N#CC1=CC=C(CCN)C=C1 CS22808 [0,0,0,0,0,0|3,0,1]=4 14 B11R1.83 N#CC1=CC=C(CCO)C=C1 CS22434 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.83 O=CC1=CC=C(CCCl)C=C1 MC106352 [0,0,0,0,0,0|3,0,1]=4 16 B11R1.83 O=CC1=CC=C(CCO)C=C1 CS16581 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.1 Br[Zn]Cc1ccc(Br)cc1 MC121353 [1,0,0,0,0,0|3,0,0]=4 18 B10R1.1 C=COC1=CC=C(I)C=C1 MC103309 [1,0,0,0,0,0|2,0,0]=3 19 B10R1.1 CC1=CC=C(CC#N)C=C1 CS21709 [1,0,0,0,0,0|1,0,1]=3 20 B10R1.1 CC1=CC=C(CCBr)C=C1 CS19977 [1,0,0,0,0,0|1,0,1]=3 21 B10R1.1 CC1=CC=C(CCN)C=C1 CS18979 [1,0,0,0,0,0|1,0,1]=3 22 B10R1.1 CC1=CC=C(CCO)C=C1 MC40744 [1,0,0,0,0,0|1,0,1]=3 23 B10R1.1 CC1=CC=C(CNN)C=C1 CS20201 [1,0,0,0,0,0|2,0,0]=3 24 B10R1.1 CCCC1=CC=C(Br)C=C1 CS10896 [1,0,0,0,0,0|1,0,2]=4 25 B10R1.1 CNCC1=CC=C(Br)C=C1 CS19272 [1,0,0,0,0,0|2,0,1]=4 26 B10R1.1 CNCC1=CC=C(C)C=C1 CS11795 [1,0,0,0,0,0|1,0,1]=3 27 B10R1.1 ClC1=CC=C(CCBr)C=C1 CS10835 [1,0,0,0,0,0|2,0,1]=4 28 B10R1.1 ClCCC1=CC=C(Cl)C=C1 MC433885 [1,0,0,0,0,0|2,0,1]=4 29 B10R1.1 FC1=CC=C(CCBr)C=C1 CS10866 [1,0,0,0,0,0|2,0,1]=4 30 B10R1.1 Fc1ccc(C[Zn]Cl)cc1 MC121346 [1,0,0,0,0,0|3,0,0]=4 31 B10R1.1 N#CCC1=CC=C(Br)C=C1 CS20687 [1,0,0,0,0,0|2,0,1]=4 32 B10R1.1 N#CCC1=CC=C(Cl)C=C1 MC20790 [1,0,0,0,0,0|2,0,1]=4 33 B10R1.1 N#CCC1=CC=C(F)C=C1 CS14479 [1,0,0,0,0,0|2,0,1]=4 34 B10R1.1 N#CCC1=CC=C(I)C=C1 MC40782 [1,0,0,0,0,0|2,0,1]=4 35 B10R1.1 N#CCC1=CC=C(N)C=C1 MC40751 [1,0,0,0,0,0|2,0,1]=4 36 B10R1.1 NC1=CC=C(CCO)C=C1 CS13450 [1,0,0,0,0,0|2,0,1]=4 37 B10R1.1 NCCC1=CC=C(Br)C=C1 CS19296 [1,0,0,0,0,0|2,0,1]=4 38 B10R1.1 NCCC1=CC=C(Cl)C=C1 MC40975 [1,0,0,0,0,0|2,0,1]=4 39 B10R1.1 NCCC1=CC=C(F)C=C1 CS13766 [1,0,0,0,0,0|2,0,1]=4 40 B10R1.1 NCCC1=CC=C(N)C=C1 MC33045 [1,0,0,0,0,0|2,0,1]=4 41 B10R1.1 NCCC1=CC=C(O)C=C1 CS22315 [1,0,0,0,0,0|1,0,1]=3 42 B10R1.1 NNCC1=CC=C(F)C=C1 CS17057 [1,0,0,0,0,0|3,0,0]=4 43 B10R1.1 O=CCC1=CC=C(Br)C=C1 CS18203 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.1 O=CNC1=CC=C(Cl)C=C1 MC103067 [1,0,0,0,0,0|3,0,0]=4 45 B10R1.1 OC1=CC=C(N=C=S)C=C1 MC106291 [1,0,0,0,0,0|2,0,1]=4 46 B10R1.1 OCCC1=CC=C(Br)C=C1 CS14491 [1,0,0,0,0,0|2,0,1]=4 47 B10R1.1 OCCC1=CC=C(Cl)C=C1 CS22791 [1,0,0,0,0,0|2,0,1]=4 48 B10R1.1 OCCC1=CC=C(F)C=C1 MC33200 [1,0,0,0,0,0|2,0,1]=4 49 B10R1.1 OCCC1=CC=C(I)C=C1 CS12086 [1,0,0,0,0,0|2,0,1]=4 50 B10R1.1 OCCC1=CC=C(O)C=C1 CS20458 [1,0,0,0,0,0|1,0,1]=3 51 B10R1.3 BrCC1=CC=C(CBr)C=C1 MC40512 [1,0,0,0,0,0|3,0,0]=4 52 B10R1.3 C#CC1=CC=C(C=O)C=C1 CS21472 [1,0,0,0,0,0|2,0,1]=4 53 B10R1.3 C#CC1=CC=C(CC)C=C1 CS11051 [1,0,0,0,0,0|1,0,2]=4 54 B10R1.3 C#CC1=CC=C(OC)C=C1 CS21617 [1,0,0,0,0,0|0,0,2]=3 55 B10R1.3 C#CC1=CN=C(OC)C=C1 MC427465 [1,0,0,0,0,0|1,0,2]=4 56 B10R1.3 C=CC1=NC=C(CC)C=C1 MC111111 [1,0,0,0,0,0|2,0,0]=3 57 B10R1.3 CCC1=CC=C(CCl)C=C1 MC40596 [1,0,0,0,0,0|2,0,0]=3 58 B10R1.3 CCC1=CC=C(NN)C=C1 CS16126 [1,0,0,0,0,0|2,0,1]=4 59 B10R1.3 COC1=CC=C(C#N)C=C1 CS19381 [1,0,0,0,0,0|1,0,1]=3 60 B10R1.3 COC1=CC=C(C=O)C=C1 CS18687 [1,0,0,0,0,0|1,0,0]=2 61 B10R1.3 COC1=CC=C(CCl)C=C1 MC20866 [1,0,0,0,0,0|1,0,0]=2 62 B10R1.3 COC1=CC=C(CN)C=C1 CS18898 [1,0,0,0,0,0|1,0,0]=2 63 B10R1.3 COC1=CC=C(CN)C=N1 MC103395 [1,0,0,0,0,0|2,0,0]=3 64 B10R1.3 COC1=CC=C(CO)C=C1 CS22932 [1,0,0,0,0,0|1,0,0]=2 65 B10R1.3 COC1=CC=C(CO)C=N1 CS15243 [1,0,0,0,0,0|2,0,0]=3 66 B10R1.3 COC1=CC=C(NN)C=C1 CS19581 [1,0,0,0,0,0|2,0,0]=3 67 B10R1.3 COC1=CC=C(OC)C=C1 MC41357 [1,0,0,0,0,0|1,0,1]=3 68 B10R1.3 COC1=CN=C(C=O)C=C1 CS10425 [1,0,0,0,0,0|2,0,0]=3 69 B10R1.3 COC1=CN=C(C=O)N=C1 MC103831 [1,0,0,0,0,0|3,0,0]=4 70 B10R1.3 COC1=CN=C(CBr)C=C1 CS18482 [1,0,0,0,0,0|2,0,0]=3 71 B10R1.3 COC1=CN=C(CCl)C=C1 CS12684 [1,0,0,0,0,0|2,0,0]=3 72 B10R1.3 COC1=CN=C(CCl)C=C1 MC105068 [1,0,0,0,0,0|2,0,0]=3 73 B10R1.3 COC1=CN=C(CN)C=C1 MC431302 [1,0,0,0,0,0|2,0,0]=3 74 B10R1.3 COC1=CN=C(CO)C=C1 MC443535 [1,0,0,0,0,0|2,0,0]=3 75 B10R1.3 COC1=NC=C(C=O)C=C1 CS20322 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.3 COC1=NC=C(C=O)C=N1 CS16257 [1,0,0,0,0,0|3,0,0]=4 77 B10R1.3 COC1=NC=C(CBr)C=C1 CS17111 [1,0,0,0,0,0|2,0,0]=3 78 B10R1.3 COC1=NC=C(CCl)C=C1 CS16575 [1,0,0,0,0,0|2,0,0]=3 79 B10R1.3 COC1=NC=C(CN)C=N1 CS16815 [1,0,0,0,0,0|3,0,0]=4 80 B10R1.3 COC1=NC=C(NN)C=C1 CS16925 [1,0,0,0,0,0|3,0,0]=4 81 B10R1.3 COc1ccc([Mg]Br)cn1 MC116057 [1,0,0,0,0,0|3,0,0]=4 82 B10R1.3 CSC1=CC=C(CN)C=C1 MC433900 [1,0,0,0,0,0|1,1,0]=3 83 B10R1.3 N#CC1=CC=C(C=O)C=C1 CS13468 [1,0,0,0,0,0|3,0,0]=4 84 B10R1.3 N#CC1=CC=C(CBr)C=C1 CS18792 [1,0,0,0,0,0|3,0,0]=4 85 B10R1.3 N#CC1=CC=C(CCl)C=C1 CS17835 [1,0,0,0,0,0|3,0,0]=4 86 B10R1.3 N#CC1=CC=C(CN)C=C1 CS19851 [1,0,0,0,0,0|3,0,0]=4 87 B10R1.3 N#CC1=CC=C(CN)C=C1 MC40812 [1,0,0,0,0,0|3,0,0]=4 88 B10R1.3 NCC1=CC=C(CO)C=C1 CS18290 [1,0,0,0,0,0|3,0,0]=4 89 B10R1.3 O=CC1=CC=C(C=O)C=C1 CS11974 [1,0,0,0,0,0|3,0,0]=4 90 B10R1.3 O=CC1=CC=C(CBr)C=C1 MC41097 [1,0,0,0,0,0|3,0,0]=4 91 B10R1.3 O=CC1=CC=C(CO)C=C1 CS15415 [1,0,0,0,0,0|3,0,0]=4 92 B10R1.3 OCC1=CC=C(CBr)C=C1 CS20041 [1,0,0,0,0,0|3,0,0]=4 93 B10R1.3 OCC1=CC=C(CO)C=C1 CS20456 [1,0,0,0,0,0|3,0,0]=4 94 B12R1.4 CCC1=CC=C(CC(C)=O)C=C1 MC20892 [0,1,0,0,0,0|1,0,1]=3 95 B12R1.4 COC1=CC=C(CC(=O)O)C=C1 CS13446 [0,1,0,0,0,0|1,0,0]=2 96 B12R1.4 COC1=CC=C(CC(C)=O)C=C1 CS11110 [0,1,0,0,0,0|0,0,1]=2 97 B12R1.4 COC1=CC=C(NC(C)=O)C=C1 MC427407 [0,1,0,0,0,0|1,0,1]=3 98 B12R1.4 COC1=CC=C(NC(C)=S)C=C1 MC427413 [0,1,0,0,0,0|1,0,1]=3 99 B12R1.4 COC1=CC=C(OC(=O)Cl)C=C1 MC40014 [0,1,0,0,0,0|2,0,0]=3 100 B12R1.4 N#CC1=CC=C(CC(=O)O)C=C1 CS18357 [0,1,0,0,0,0|3,0,0]=4 101 B12R1.4 NCC1=CC=C(CC(=O)O)C=C1 CS16100 [0,1,0,0,0,0|3,0,0]=4 102 B12R1.4 NCC1=CC=C(CC(=O)O)C=C1 MC40138 [0,1,0,0,0,0|3,0,0]=4 103 B12R1.4 O=C(O)CC1=CC=C(CBr)C=C1 MC40152 [0,1,0,0,0,0|3,0,0]=4 104 B12R1.4 O=CC1=CC=C(CC(=O)O)C=C1 MC431953 [0,1,0,0,0,0|3,0,0]=4 105 B12R1.5 COC(=O)C1=CC=C(OC)C=C1 CS18683 [0,1,0,0,0,0|1,0,2]=4 106 B12R1.5 COC1=CC=C(C(=O)CCl)C=C1 MC41239 [0,1,0,0,0,0|1,0,2]=4 107 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 CS21179 [0,1,0,0,0,0|1,0,2]=4 108 B12R1.5 COC1=CC=C(C(O)CN)C=C1 MC431260 [0,1,0,0,0,0|1,0,1]=3 109 B12R1.71 CCC#CC1=CC=C(OC)C=C1 MC103263 [0,1,0,0,0,0|0,0,3]=4 110 B12R1.113 CC(=O)C1=CC=C(CCBr)C=C1 CS10009 [0,1,0,0,0,0|2,0,1]=4 111 B12R1.113 CN(C)C1=CC=C(CCO)C=C1 CS22462 [0,1,0,0,0,0|2,0,1]=4 112 B12R1.114 COC1=CC(Cl)=C(CC#N)C=C1 MC20596 [0,1,0,0,0,0|1,0,1]=3 113 B12R1.114 COC1=CN=C(CC#N)C(Cl)=C1 MC432448 [0,1,0,0,0,0|2,0,1]=4 114 B12R1.116 CCOC1=CC=C(CC#N)C=C1 MC433951 [0,1,0,0,0,0|1,0,1]=3 115 B12R1.116 COCC1=CC=C(COC)C=C1 MC444622 [0,1,0,0,0,0|1,0,1]=3 116 B12R1.288 COC1=C(C)C=C(CCN)C=N1 MC111257 [0,1,0,0,0,0|2,0,1]=4 117 B12R1.288 COC1=C(F)C=C(CC#N)C=C1 CS14302 [0,1,0,0,0,0|1,0,1]=3 118 B12R1.288 COC1=C(O)C=C(CCN)C=C1 MC20884 [0,1,0,0,0,0|1,0,1]=3 119 B12R2.44 COC1=CC2=C(C=C1)N=CN2 MC425785 [0,0,0,1,0,0|2,0,0]=3 120 B12R2.44 COC1=CC2=C(C=C1)N=CS2 CS10718 [0,0,0,1,0,0|2,0,0]=3 121 B12R2.44 COC1=CC2=C(C=C1)ON=C2 CS10418 [0,0,0,1,0,0|2,0,0]=3 122 B12R2.44 COC1=CC2=C(C=C1)SC=C2 MC111400 [0,0,0,1,0,0|1,0,0]=2 123 B12R2.44 COC1=CC2=C(C=CO2)C=C1 CS16497 [0,0,0,1,0,0|1,0,1]=3 124 B12R2.44 COC1=CC2=C(C=CS2)C=C1 CS16120 [0,0,0,1,0,0|1,0,1]=3 125 B12R2.44 COC1=CC=C2C=CNC2=C1 MC20057 [0,0,0,1,0,0|1,0,1]=3 126 B12R2.44 COC1=CC=C2C=NNC2=C1 MC425259 [0,0,0,1,0,0|2,0,1]=4 127 B12R2.44 COC1=CC=C2CCNC2=C1 MC20447 [0,0,0,1,0,0|1,0,1]=3 128 B12R2.44 COC1=CC=C2CNCC2=C1 CS12707 [0,0,0,1,0,0|1,0,1]=3 129 B12R2.44 COC1=CC=C2CNCC2=C1 MC100224 [0,0,0,1,0,0|1,0,1]=3 130 B12R2.44 COC1=CC=C2NC=CC2=C1 CS22068 [0,0,0,1,0,0|1,0,0]=2 131 B12R2.44 COC1=CC=C2NC=CC2=N1 CS18048 [0,0,0,1,0,0|2,0,0]=3 132 B12R2.44 COC1=CC=C2NCCC2=C1 CS17324 [0,0,0,1,0,0|1,0,2]=4 133 B12R2.44 COC1=CC=C2NN=CC2=C1 MC425643 [0,0,0,1,0,0|2,0,0]=3 134 B12R2.44 COC1=CC=C2NN=CC2=N1 MC104480 [0,0,0,1,0,0|3,0,0]=4 135 B12R2.44 COC1=CN2C=CN=C2C=C1 CS16254 [0,0,0,1,0,0|2,0,0]=3 136 B12R2.44 COC1=CN=C2C=CNC2=C1 MC105229 [0,0,0,1,0,0|2,0,1]=4 137 B12R2.44 COC1=CN=C2NC=CC2=C1 MC425416 [0,0,0,1,0,0|2,0,0]=3 138 B12R2.44 COC1=NC=C2NC=CC2=C1 MC428300 [0,0,0,1,0,0|2,0,0]=3 139 B12R2.44 COC1=NC=C2NN=CC2=C1 MC441196 [0,0,0,1,0,0|3,0,0]=4 140 B12R2.44 CSC1=CC=C2NC=CC2=C1 MC106667 [0,0,0,1,0,0|1,1,0]=3 141 B12R2.44 N#CC1=CC2=C(C=C1)OC=C2 CS20604 [0,0,0,1,0,0|3,0,0]=4 142 B12R2.44 N#CC1=CC=C2NC=CC2=C1 MC41769 [0,0,0,1,0,0|3,0,0]=4 143 B12R2.44 NCC1=CC=C2NC=CC2=C1 MC425742 [0,0,0,1,0,0|3,0,0]=4 144 B12R2.44 O=CC1=CC2=C(C=C1)OC=C2 CS21474 [0,0,0,1,0,0|3,0,0]=4 145 B12R2.44 O=CC1=CC=C2NC=CC2=C1 CS21526 [0,0,0,1,0,0|3,0,0]=4 146 B9R1.1 BrCC1=CC=C(Br)C=C1 CS19166 [2,0,0,0,0,0|2,0,0]=4 147 B9R1.1 BrCC1=CC=C(I)C=C1 CS20172 [2,0,0,0,0,0|2,0,0]=4 148 B9R1.1 C#CC1=CC=C(C)C=C1 CS21552 [2,0,0,0,0,0|0,0,2]=4 149 B9R1.1 C=CC1=CC=C(Br)C=C1 MC41562 [2,0,0,0,0,0|1,0,0]=3 150 B9R1.1 C=CC1=CC=C(F)C=C1 MC33131 [2,0,0,0,0,0|1,0,0]=3 151 B9R1.1 C=CC1=CN=C(Br)C=C1 MC442257 [2,0,0,0,0,0|2,0,0]=4 152 B9R1.1 C=CC1=NC=C(Br)C=C1 MC431908 [2,0,0,0,0,0|2,0,0]=4 153 B9R1.1 CC1=CC=C(C#N)C=C1 CS19807 [2,0,0,0,0,0|1,0,1]=4 154 B9R1.1 CC1=CC=C(C=O)C=C1 MC41128 [2,0,0,0,0,0|1,0,0]=3 155 B9R1.1 CC1=CC=C(CBr)C=C1 CS22969 [2,0,0,0,0,0|1,0,0]=3 156 B9R1.1 CC1=CC=C(CCl)C=C1 MC40603 [2,0,0,0,0,0|1,0,0]=3 157 B9R1.1 CC1=CC=C(CN)C=C1 CS22970 [2,0,0,0,0,0|1,0,0]=3 158 B9R1.1 CC1=CC=C(CO)C=C1 CS19704 [2,0,0,0,0,0|1,0,0]=3 159 B9R1.1 CC1=CC=C(CO)C=N1 MC21041 [2,0,0,0,0,0|2,0,0]=4 160 B9R1.1 CC1=CC=C(NN)C=C1 CS19576 [2,0,0,0,0,0|2,0,0]=4 161 B9R1.1 CC1=CN=C(C=O)C=C1 CS19088 [2,0,0,0,0,0|2,0,0]=4 162 B9R1.1 CC1=CN=C(CCl)C=C1 MC115829 [2,0,0,0,0,0|2,0,0]=4 163 B9R1.1 CC1=CN=C(CN)C=C1 CS18319 [2,0,0,0,0,0|2,0,0]=4 164 B9R1.1 CC1=NC=C(C=O)C=C1 CS19116 [2,0,0,0,0,0|2,0,0]=4 165 B9R1.1 CCC1=CC=C(Br)C=C1 CS10865 [2,0,0,0,0,0|1,0,1]=4 166 B9R1.1 CCC1=CC=C(F)C=C1 MC20965 [2,0,0,0,0,0|1,0,1]=4 167 B9R1.1 CCC1=CC=C(I)C=C1 MC20189 [2,0,0,0,0,0|1,0,1]=4 168 B9R1.1 CCC1=CC=C(N)C=C1 MC40912 [2,0,0,0,0,0|1,0,1]=4 169 B9R1.1 CCC1=CC=C(O)C=C1 MC20188 [2,0,0,0,0,0|0,0,1]=3 170 B9R1.1 CCC1=CN=C(C)C=C1 MC20566 [2,0,0,0,0,0|1,0,1]=4 171 B9R1.1 CNC1=CC=C(Cl)C=C1 MC40891 [2,0,0,0,0,0|2,0,0]=4 172 B9R1.1 CNC1=CC=C(F)C=C1 MC40919 [2,0,0,0,0,0|2,0,0]=4 173 B9R1.1 CNC1=CC=C(I)C=C1 CS22906 [2,0,0,0,0,0|2,0,0]=4 174 B9R1.1 COC1=CC=C(Br)C=C1 MC41310 [2,0,0,0,0,0|1,0,0]=3 175 B9R1.1 COC1=CC=C(Cl)C=C1 MC41327 [2,0,0,0,0,0|1,0,0]=3 176 B9R1.1 COC1=CC=C(F)C=C1 MC30345 [2,0,0,0,0,0|1,0,0]=3 177 B9R1.1 COC1=CC=C(I)C=C1 MC41342 [2,0,0,0,0,0|1,0,0]=3 178 B9R1.1 COC1=CC=C(N)C=C1 CS18580 [2,0,0,0,0,0|1,0,0]=3 179 B9R1.1 COC1=CC=C(N)C=N1 CS19527 [2,0,0,0,0,0|2,0,0]=4 180 B9R1.1 COC1=CC=C(O)C=C1 CS22939 [2,0,0,0,0,0|1,0,0]=3 181 B9R1.1 COC1=CC=C(O)C=N1 CS19503 [2,0,0,0,0,0|2,0,0]=4 182 B9R1.1 COC1=CC=C(S)C=C1 MC20380 [2,0,0,0,0,0|1,0,0]=3 183 B9R1.1 COC1=CC=[N+]([O-])C=C1 CS18613 [2,0,0,0,0,0|2,0,0]=4 184 B9R1.1 COC1=CN=C(Br)C=C1 CS13470 [2,0,0,0,0,0|2,0,0]=4 185 B9R1.1 COC1=CN=C(F)C=C1 MC442697 [2,0,0,0,0,0|2,0,0]=4 186 B9R1.1 COC1=CN=C(N)C=C1 CS17791 [2,0,0,0,0,0|2,0,0]=4 187 B9R1.1 COC1=NC=C(Br)C=C1 CS22030 [2,0,0,0,0,0|2,0,0]=4 188 B9R1.1 COC1=NC=C(C)C=C1 CS21644 [2,0,0,0,0,0|1,0,0]=3 189 B9R1.1 COC1=NC=C(Cl)C=C1 CS17976 [2,0,0,0,0,0|2,0,0]=4 190 B9R1.1 COC1=NC=C(F)C=C1 MC20598 [2,0,0,0,0,0|2,0,0]=4 191 B9R1.1 COC1=NC=C(I)C=C1 CS21641 [2,0,0,0,0,0|2,0,0]=4 192 B9R1.1 COC1=NC=C(N)C=C1 MC33494 [2,0,0,0,0,0|2,0,0]=4 193 B9R1.1 CSC1=CC=C(O)C=C1 MC20743 [2,0,0,0,0,0|1,0,1]=4 194 B9R1.1 ClC1=CC=C(CBr)C=C1 MC40527 [2,0,0,0,0,0|2,0,0]=4 195 B9R1.1 ClCC1=CC=C(Br)C=C1 CS19167 [2,0,0,0,0,0|2,0,0]=4 196 B9R1.1 ClCC1=CC=C(Cl)C=C1 CS19806 [2,0,0,0,0,0|2,0,0]=4 197 B9R1.1 FC1=CC=C(CBr)C=C1 CS19071 [2,0,0,0,0,0|2,0,0]=4 198 B9R1.1 FC1=CC=C(CCl)C=C1 MC429572 [2,0,0,0,0,0|2,0,0]=4 199 B9R1.1 N#CC1=CC=C(O)C=C1 CS15887 [2,0,0,0,0,0|1,0,1]=4 200 B9R1.1 NC1=CC=C(C=O)C=C1 MC20423 [2,0,0,0,0,0|2,0,0]=4 201 B9R1.1 NC1=CC=C(CO)C=C1 MC33175 [2,0,0,0,0,0|2,0,0]=4 202 B9R1.1 NCC1=CC=C(Br)C=C1 CS19587 [2,0,0,0,0,0|2,0,0]=4 203 B9R1.1 NCC1=CC=C(Cl)C=C1 MC33031 [2,0,0,0,0,0|2,0,0]=4 204 B9R1.1 NCC1=CC=C(F)C=C1 CS18721 [2,0,0,0,0,0|2,0,0]=4 205 B9R1.1 NCC1=CC=C(I)C=C1 MC40836 [2,0,0,0,0,0|2,0,0]=4 206 B9R1.1 NCC1=CC=C(I)C=C1 MC40837 [2,0,0,0,0,0|2,0,0]=4 207 B9R1.1 NCC1=CC=C(O)C=C1 CS22886 [2,0,0,0,0,0|1,0,0]=3 208 B9R1.1 O=CC1=CC=C(Br)C=C1 CS18612 [2,0,0,0,0,0|2,0,0]=4 209 B9R1.1 O=CC1=CC=C(Cl)C=C1 CS14843 [2,0,0,0,0,0|2,0,0]=4 210 B9R1.1 O=CC1=CC=C(F)C=C1 CS19072 [2,0,0,0,0,0|2,0,0]=4 211 B9R1.1 O=CC1=CC=C(I)C=C1 CS20133 [2,0,0,0,0,0|2,0,0]=4 212 B9R1.1 O=CC1=CC=C(O)C=C1 CS18686 [2,0,0,0,0,0|1,0,0]=3 213 B9R1.1 O=CC1=CN=C(O)C=C1 CS13494 [2,0,0,0,0,0|2,0,0]=4 214 B9R1.1 O=CC1=NC=C(O)C=C1 CS12167 [2,0,0,0,0,0|2,0,0]=4 215 B9R1.1 OCC1=CC=C(Br)C=C1 CS19378 [2,0,0,0,0,0|2,0,0]=4 216 B9R1.1 OCC1=CC=C(Cl)C=C1 CS19353 [2,0,0,0,0,0|2,0,0]=4 217 B9R1.1 OCC1=CC=C(F)C=C1 MC40711 [2,0,0,0,0,0|2,0,0]=4 218 B9R1.1 OCC1=CC=C(O)C=C1 CS19212 [2,0,0,0,0,0|1,0,0]=3 219 B9R1.8 BrCCC1=CC=CC=C1 MC40571 [2,0,0,0,0,0|1,0,1]=4 220 B9R1.8 Br[Zn]Cc1ccccc1 MC121333 [2,0,0,0,0,0|2,0,0]=4 221 B9R1.8 CNCC1=CC=CC=C1 MC10559 [2,0,0,0,0,0|1,0,1]=4 222 B9R1.8 CNCC1=CC=CC=C1 MC20323 [2,0,0,0,0,0|1,0,1]=4 223 B9R1.8 CNCC1=CC=CC=C1 MC21006 [2,0,0,0,0,0|1,0,1]=4 224 B9R1.8 ClCCC1=CC=CC=C1 MC40609 [2,0,0,0,0,0|1,0,1]=4 225 B9R1.8 FCCC1=CC=CC=C1 MC41557 [2,0,0,0,0,0|1,0,1]=4 226 B9R1.8 NCCC1=CC=CC=C1 MC40983 [2,0,0,0,0,0|1,0,1]=4 227 B9R1.8 NNCC1=CC=CC=C1 CS11006 [2,0,0,0,0,0|2,0,0]=4 228 B9R1.8 NNCC1=CC=CC=C1 CS12127 [2,0,0,0,0,0|2,0,0]=4 229 B9R1.8 NOCC1=CC=CC=C1 CS14063 [2,0,0,0,0,0|2,0,0]=4 230 B9R1.8 O=CCC1=CC=CN=C1 MC106360 [2,0,0,0,0,0|2,0,0]=4 231 B9R1.8 O=CCC1=CC=NC=C1 MC106357 [2,0,0,0,0,0|2,0,0]=4 232 B9R1.8 O=CNC1=CC=CC=C1 MC40924 [2,0,0,0,0,0|2,0,0]=4 233 B9R1.8 O=COC1=CC=CC=C1 MC40136 [2,0,0,0,0,0|2,0,0]=4 234 B9R1.8 OCCC1=CC=CC=C1 MC40745 [2,0,0,0,0,0|1,0,1]=4 235 B9R1.8 ONCC1=CC=CC=C1 CS11753 [2,0,0,0,0,0|2,0,0]=4 236 B11R1.1 CC1=CC=C(\C=C\C=O)C=C1 CS16393 [1,1,0,0,0,0|0,0,1]=3 237 B11R1.1 CCOCC1=CC=C(O)C=C1 CS16541 [1,1,0,0,0,0|0,0,2]=4 238 B11R1.1 CNCCC1=CC=C(O)C=C1 MC426074 [1,1,0,0,0,0|0,0,2]=4 239 B11R1.1 COCCC1=CC=C(O)C=C1 MC445496 [1,1,0,0,0,0|0,0,2]=4 240 B11R1.1 O=C\C=C\C1=CC=C(F)C=C1 CS14013 [1,1,0,0,0,0|1,0,1]=4 241 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 MC10315 [1,1,0,0,0,0|1,0,1]=4 242 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 CS22844 [1,1,0,0,0,0|1,0,1]=4 243 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 MC428013 [1,1,0,0,0,0|1,0,1]=4 244 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 CS21084 [1,1,0,0,0,0|1,0,0]=3 245 B11R1.20 CC1=CC=C(CC(=O)O)C=N1 MC429948 [1,1,0,0,0,0|2,0,0]=4 246 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 CS14692 [1,1,0,0,0,0|2,0,0]=4 247 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 CS21002 [1,1,0,0,0,0|2,0,0]=4 248 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 CS20812 [1,1,0,0,0,0|2,0,0]=4 249 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 MC40158 [1,1,0,0,0,0|2,0,0]=4 250 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 CS10817 [1,1,0,0,0,0|2,0,0]=4 251 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 CS20852 [1,1,0,0,0,0|2,0,0]=4 252 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 MC40180 [1,1,0,0,0,0|1,0,0]=3 253 B11R1.20 O=C(O)CC1=CC=C(S)C=C1 MC40184 [1,1,0,0,0,0|1,1,0]=4 254 B11R1.22 CC(CN)C1=CC=C(O)C=C1 MC116255 [1,1,0,0,0,0|1,0,1]=4 255 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 CS18120 [1,1,0,0,0,0|1,0,1]=4 256 B11R1.81 CC1=CC(Br)=C(CC#N)C=C1 MC106321 [1,1,0,0,0,0|1,0,1]=4 257 B11R1.81 CC1=CC(F)=C(CC#N)C=C1 MC431014 [1,1,0,0,0,0|1,0,1]=4 258 B11R1.192 CC1=C(F)C=C(CC#N)C=C1 MC40776 [1,1,0,0,0,0|1,0,1]=4 259 B11R1.192 NCCC1=CC=C(O)C(O)=C1 CS15345 [1,1,0,0,0,0|1,0,1]=4 260 B11R1.192 O=CCC1=CC(Br)=C(F)C=C1 MC430543 [1,1,0,0,0,0|2,0,0]=4 261 B11R1.192 O=CCC1=CC(F)=C(Br)C=C1 MC430272 [1,1,0,0,0,0|2,0,0]=4 262 B11R1.3 C(C)(N)C1=CC=C(OC)C=C1 MC20521 [1,1,0,0,0,0|0,0,1]=3 263 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 MC20903 [1,1,0,0,0,0|0,0,0]=2 264 B11R1.3 C=CC1=CC=C(C(=O)O)C=C1 MC425378 [1,1,0,0,0,0|2,0,0]=4 265 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 CS12193 [1,1,0,0,0,0|2,0,0]=4 266 B11R1.3 CC(C)C1=CC=C(CBr)C=C1 CS14001 [1,1,0,0,0,0|2,0,0]=4 267 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 CS13406 [1,1,0,0,0,0|2,0,0]=4 268 B11R1.3 CN(C)C1=CC=C(C=O)C=C1 CS13401 [1,1,0,0,0,0|2,0,0]=4 269 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 MC20232 [1,1,0,0,0,0|2,0,0]=4 270 B11R1.3 COC1=CC=C(B(O)O)C=C1 CS10530 [1,1,0,0,0,0|2,0,0]=4 271 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 MC20515 [1,1,0,0,0,0|1,0,0]=3 272 B11R1.3 COC1=CC=C(C(C)=O)C=C1 MC41262 [1,1,0,0,0,0|0,0,1]=3 273 B11R1.3 COC1=CC=C(C(C)=O)C=N1 CS20044 [1,1,0,0,0,0|1,0,1]=4 274 B11R1.3 COC1=CC=C(C(C)C)C=C1 MC41346 [1,1,0,0,0,0|0,0,1]=3 275 B11R1.3 COC1=CC=C(C(C)N)C=C1 CS13954 [1,1,0,0,0,0|0,0,1]=3 276 B11R1.3 COC1=CC=C(N(C)C)C=C1 MC20811 [1,1,0,0,0,0|1,0,1]=4 277 B11R1.3 COC1=CN=C(C(=O)O)C=C1 CS18937 [1,1,0,0,0,0|2,0,0]=4 278 B11R1.3 COC1=CN=C(C(C)=O)C=C1 MC105069 [1,1,0,0,0,0|1,0,1]=4 279 B11R1.3 COC1=NC=C(C(=O)O)C=C1 CS10490 [1,1,0,0,0,0|2,0,0]=4 280 B11R1.279 C#CC1=C(C)C=C(OC)C=C1 MC430204 [1,1,0,0,0,0|0,0,2]=4 281 B11R1.279 CNC1=CC=C(OC)C=C1N MC107631 [1,1,0,0,0,0|1,0,1]=4 282 B11R1.279 COC1=C(Br)C=C(C#N)C=C1 MC30286 [1,1,0,0,0,0|1,0,1]=4 283 B11R1.279 COC1=C(Br)C=C(C=O)C=C1 MC30287 [1,1,0,0,0,0|1,0,0]=3 284 B11R1.279 COC1=C(C)C=C(C#N)C=C1 MC30267 [1,1,0,0,0,0|1,0,1]=4 285 B11R1.279 COC1=C(C)C=C(C=O)C=C1 CS10892 [1,1,0,0,0,0|1,0,0]=3 286 B11R1.279 COC1=C(Cl)C=C(C#N)C=C1 MC433757 [1,1,0,0,0,0|1,0,1]=4 287 B11R1.279 COC1=C(Cl)C=C(C=O)C=C1 MC41105 [1,1,0,0,0,0|1,0,0]=3 288 B11R1.279 COC1=C(Cl)C=C(CBr)C=C1 CS22687 [1,1,0,0,0,0|1,0,0]=3 289 B11R1.279 COC1=C(Cl)C=C(CN)C=C1 CS20430 [1,1,0,0,0,0|1,0,0]=3 290 B11R1.279 COC1=C(Cl)C=C(CO)C=N1 MC431971 [1,1,0,0,0,0|2,0,0]=4 291 B11R1.279 COC1=C(F)C=C(C#N)C=C1 MC433110 [1,1,0,0,0,0|1,0,1]=4 292 B11R1.279 COC1=C(F)C=C(C=O)C=C1 MC30257 [1,1,0,0,0,0|1,0,0]=3 293 B11R1.279 COC1=C(F)C=C(CBr)C=C1 MC40553 [1,1,0,0,0,0|1,0,0]=3 294 B11R1.279 COC1=C(F)C=C(CCl)C=C1 MC40599 [1,1,0,0,0,0|1,0,0]=3 295 B11R1.279 COC1=C(F)C=C(CN)C=C1 MC40827 [1,1,0,0,0,0|1,0,0]=3 296 B11R1.279 COC1=C(N)C=C(C#N)C=C1 MC30250 [1,1,0,0,0,0|1,0,1]=4 297 B11R1.279 COC1=C(N)C=C(C=O)C=C1 CS22069 [1,1,0,0,0,0|1,0,0]=3 298 B11R1.279 COC1=C(O)C=C(C#N)C=C1 CS14799 [1,1,0,0,0,0|1,0,1]=4 299 B11R1.279 COC1=C(O)C=C(C=O)C=C1 CS15324 [1,1,0,0,0,0|1,0,0]=3 300 B11R1.279 COC1=C(O)C=C(CO)C=C1 CS22314 [1,1,0,0,0,0|1,0,0]=3 301 B11R1.279 COC1=CC(Br)=C(C#N)C=C1 CS13234 [1,1,0,0,0,0|1,0,1]=4 302 B11R1.279 COC1=CC(Br)=C(C=O)C=C1 MC41095 [1,1,0,0,0,0|1,0,0]=3 303 B11R1.279 COC1=CC(C)=C(C=O)C=C1 MC41126 [1,1,0,0,0,0|1,0,0]=3 304 B11R1.279 COC1=CC(Cl)=C(C#N)C=C1 CS21446 [1,1,0,0,0,0|1,0,1]=4 305 B11R1.279 COC1=CC(Cl)=C(C=O)C=C1 CS14902 [1,1,0,0,0,0|1,0,0]=3 306 B11R1.279 COC1=CC(Cl)=C(C=O)C=N1 MC431794 [1,1,0,0,0,0|2,0,0]=4 307 B11R1.279 COC1=CC(Cl)=C(NN)C=C1 MC103360 [1,1,0,0,0,0|2,0,0]=4 308 B11R1.279 COC1=CC(F)=C(C#N)C=C1 CS10749 [1,1,0,0,0,0|1,0,1]=4 309 B11R1.279 COC1=CC(F)=C(C=O)C=C1 CS10812 [1,1,0,0,0,0|1,0,0]=3 310 B11R1.279 COC1=CC(F)=C(CCl)C=C1 MC433862 [1,1,0,0,0,0|1,0,0]=3 311 B11R1.279 COC1=CC(F)=C(CO)C=C1 MC425568 [1,1,0,0,0,0|1,0,0]=3 312 B11R1.279 COC1=CC(F)=C(NN)C=C1 CS15976 [1,1,0,0,0,0|2,0,0]=4 313 B11R1.279 COC1=CC(F)=C(OC)C=C1 CS20541 [1,1,0,0,0,0|1,0,1]=4 314 B11R1.279 COC1=CC(I)=C(C#N)C=C1 MC442269 [1,1,0,0,0,0|1,0,1]=4 315 B11R1.279 COC1=CC(N)=C(C#N)C=C1 CS17220 [1,1,0,0,0,0|1,0,1]=4 316 B11R1.279 COC1=CC(N)=C(OC)C=C1 CS21148 [1,1,0,0,0,0|1,0,1]=4 317 B11R1.279 COC1=CC(O)=C(C#N)C=C1 CS14796 [1,1,0,0,0,0|1,0,1]=4 318 B11R1.279 COC1=CC(O)=C(C=O)C=C1 CS20937 [1,1,0,0,0,0|1,0,0]=3 319 B11R1.279 COC1=CC(O)=C(OC)C=C1 CS21149 [1,1,0,0,0,0|1,0,1]=4 320 B11R1.279 COC1=CN=C(CN)C(F)=C1 MC431985 [1,1,0,0,0,0|2,0,0]=4 321 B11R1.279 COC1=CN=C(CO)C(F)=C1 MC115823 [1,1,0,0,0,0|2,0,0]=4 322 B11R1.279 COC1=NC(Br)=C(C=O)C=C1 MC431994 [1,1,0,0,0,0|2,0,0]=4 323 B11R1.279 COC1=NC(Cl)=C(C=O)C=C1 MC430651 [1,1,0,0,0,0|2,0,0]=4 324 B11R1.279 COC1=NC(F)=C(C=O)C=C1 MC441123 [1,1,0,0,0,0|2,0,0]=4 325 B11R1.279 COC1=NC=C(C=O)C=C1Br MC430406 [1,1,0,0,0,0|2,0,0]=4 326 B11R1.279 COC1=NC=C(C=O)C=C1F MC115933 [1,1,0,0,0,0|2,0,0]=4 327 B11R1.279 COC1=NC=C(CBr)C=C1F MC432190 [1,1,0,0,0,0|2,0,0]=4 328 B11R1.279 CSC1=C(C)C=C(CN)C=C1 MC112204 [1,1,0,0,0,0|1,1,0]=4 329 B13R1.4 COC1=CC=C(CC(C)(C)N)C=C1 MC445286 [0,2,0,0,0,0|0,0,2]=4 330 B13R1.35 COC1=C(Br)C=C(CC(=O)O)C=C1 MC40149 [0,2,0,0,0,0|1,0,0]=3 331 B13R1.35 COC1=C(C)C=C(CC(=O)O)C=C1 CS11122 [0,2,0,0,0,0|1,0,0]=3 332 B13R1.35 COC1=C(F)C=C(CC(=O)O)C=C1 MC40168 [0,2,0,0,0,0|1,0,0]=3 333 B13R1.35 COC1=C(F)C=C(NC(C)=O)C=C1 MC106799 [0,2,0,0,0,0|1,0,1]=4 334 B13R1.36 COC1=CC=C(C(=O)C(C)=O)C=C1 CS18460 [0,2,0,0,0,0|0,0,2]=4 335 B13R1.36 COC1=CC=C(C(C)C(=O)O)C=C1 MC106807 [0,2,0,0,0,0|1,0,0]=3 336 B13R1.36 COC1=CC=C(C(O)C(=O)O)C=C1 CS14677 [0,2,0,0,0,0|1,0,0]=3 337 B13R1.36 COC1=CC=C(C(O)C(=O)O)C=C1 CS20288 [0,2,0,0,0,0|1,0,0]=3 338 B13R1.36 COC1=CC=C(C(O)C(C)C)C=C1 MC33344 [0,2,0,0,0,0|0,0,2]=4 339 B13R1.142 CCCC1=CC=C(CC(=O)O)C=C1 MC40189 [0,2,0,0,0,0|2,0,0]=4 340 B13R1.142 N#CCC1=CC=C(OC(F)F)C=C1 MC40770 [0,2,0,0,0,0|1,0,1]=4 341 B13R1.653 COC1=CC(Br)=C(CC(=O)O)C=C1 MC40148 [0,2,0,0,0,0|1,0,0]=3 342 B13R1.653 COC1=CC(Cl)=C(CC(=O)O)C=C1 MC20587 [0,2,0,0,0,0|1,0,0]=3 343 B13R1.653 COC1=CC(Cl)=C(CC(C)=O)C=C1 MC110578 [0,2,0,0,0,0|0,0,1]=3 344 B13R1.653 COC1=CC(F)=C(CC(=O)O)C=C1 CS16204 [0,2,0,0,0,0|1,0,0]=3 345 B13R1.39 COC1=CC=C(C(CN)CO)C=C1 MC105885 [0,2,0,0,0,0|1,0,1]=4 346 B13R1.39 COC1=CC=C(C(CN)CO)C=C1 MC105886 [0,2,0,0,0,0|1,0,1]=4 347 B13R1.139 COC(=O)C1=CC=C(CC#N)C=C1 CS11360 [0,2,0,0,0,0|1,0,1]=4 348 B13R1.139 COC(=O)C1=CC=C(CC=O)C=C1 MC106359 [0,2,0,0,0,0|1,0,0]=3 349 B13R1.139 COC(=O)C1=CC=C(CCBr)C=C1 MC40068 [0,2,0,0,0,0|1,0,1]=4 350 B13R1.139 COC(=O)C1=CC=C(CCN)C=C1 MC106653 [0,2,0,0,0,0|1,0,1]=4 351 B13R1.3088 CCC(N)C1=CC(Br)=C(OC)C=C1 MC112070 [0,2,0,0,0,0|0,0,2]=4 352 B13R1.3 COC1=CC=C(\C=C\C(=O)O)C=C1 MC21104 [0,2,0,0,0,0|0,0,1]=3 353 B13R1.74 C=CCOC1=CC=C(B(O)O)C=C1 MC441539 [0,2,0,0,0,0|2,0,0]=4 354 B13R1.74 CN(C)C1=CC=C(\C=C\C=O)C=C1 MC20077 [0,2,0,0,0,0|1,0,1]=4 355 B13R1.371 COC1=CC=C(CCCCN)C=C1 MC10363 [0,2,0,0,0,0|0,0,2]=4 356 B13R1.371 COC1=CC=C(CCCCO)C=C1 CS14733 [0,2,0,0,0,0|0,0,2]=4 357 B13R1.577 COC1=C(N)C=C(NCCO)C=C1 CS10919 [0,2,0,0,0,0|1,0,1]=4 358 B13R1.1249 CNCC1=C(OC)C=C(OC)C=C1 CS11703 [0,2,0,0,0,0|1,0,1]=4 359 B13R1.386 COC1=C(OC)C=C(CC#N)C=C1 CS16297 [0,2,0,0,0,0|1,0,1]=4 360 B13R1.386 COC1=C(OC)C=C(CC=O)C=C1 CS20165 [0,2,0,0,0,0|1,0,0]=3 361 B13R1.386 COC1=C(OC)C=C(CCO)C=C1 MC10303 [0,2,0,0,0,0|1,0,1]=4 362 B11R2.34 CC1=CC=C(C2CO2)C=C1 MC112355 [1,0,0,1,0,0|1,0,1]=4 363 B11R2.36 BrC1=CC2=C(C=C1)OC=C2 MC41758 [1,0,0,1,0,0|2,0,0]=4 364 B11R2.36 BrC1=CC2=C(C=C1)SC=C2 CS10670 [1,0,0,1,0,0|2,0,0]=4 365 B11R2.36 BrC1=CC2=C(C=C1)SC=C2 MC20420 [1,0,0,1,0,0|2,0,0]=4 366 B11R2.36 BrC1=CC=C2NC=CC2=C1 CS17784 [1,0,0,1,0,0|2,0,0]=4 367 B11R2.36 CC1=CC2=C(C=C1)OC=C2 MC441161 [1,0,0,1,0,0|1,0,0]=3 368 B11R2.36 CC1=CC2=C(C=C1)OC=N2 MC425792 [1,0,0,1,0,0|2,0,0]=4 369 B11R2.36 CC1=CC2=C(C=CS2)C=C1 MC441147 [1,0,0,1,0,0|1,0,1]=4 370 B11R2.36 CC1=CC=C2C=CCC2=C1 MC446782 [1,0,0,1,0,0|0,0,2]=4 371 B11R2.36 CC1=CC=C2CCNC2=C1 MC106356 [1,0,0,1,0,0|1,0,1]=4 372 B11R2.36 CC1=CC=C2CNCC2=C1 MC431420 [1,0,0,1,0,0|1,0,1]=4 373 B11R2.36 CC1=CC=C2NC=CC2=C1 CS11033 [1,0,0,1,0,0|1,0,0]=3 374 B11R2.36 CC1=CC=C2NN=CC2=C1 MC425397 [1,0,0,1,0,0|2,0,0]=4 375 B11R2.36 CC1=CN=C2NC=CC2=C1 CS10438 [1,0,0,1,0,0|2,0,0]=4 376 B11R2.36 ClC1=CC2=C(C=C1)OC=C2 MC441158 [1,0,0,1,0,0|2,0,0]=4 377 B11R2.36 ClC1=CC2=C(C=C1)SC=C2 CS20641 [1,0,0,1,0,0|2,0,0]=4 378 B11R2.36 ClC1=CC=C2NC=CC2=C1 CS22049 [1,0,0,1,0,0|2,0,0]=4 379 B11R2.36 FC1=CC2=C(C=C1)OC=C2 MC441159 [1,0,0,1,0,0|2,0,0]=4 380 B11R2.36 FC1=CC=C2CC=CC2=C1 MC446777 [1,0,0,1,0,0|1,0,0]=3 381 B11R2.36 FC1=CC=C2NC=CC2=C1 CS22058 [1,0,0,1,0,0|2,0,0]=4 382 B11R2.36 NC1=CC=C2NC=CC2=C1 CS20917 [1,0,0,1,0,0|2,0,0]=4 383 B11R2.36 OC1=CC2=C(C=C1)CCO2 CS16031 [1,0,0,1,0,0|1,0,1]=4 384 B11R2.36 OC1=CC2=C(C=C1)N=CS2 CS10613 [1,0,0,1,0,0|2,0,0]=4 385 B11R2.36 OC1=CC2=C(C=C1)OC=C2 MC443249 [1,0,0,1,0,0|1,0,0]=3 386 B11R2.36 OC1=CC2=C(C=C1)SC=C2 MC111398 [1,0,0,1,0,0|1,0,0]=3 387 B11R2.36 OC1=CC2=C(C=C1)SC=N2 MC427507 [1,0,0,1,0,0|2,0,0]=4 388 B11R2.36 OC1=CC2=C(C=CO2)C=C1 CS20605 [1,0,0,1,0,0|1,0,1]=4 389 B11R2.36 OC1=CC2=C(C=CS2)C=C1 MC441864 [1,0,0,1,0,0|1,0,1]=4 390 B11R2.36 OC1=CC=C2NC=CC2=C1 CS20861 [1,0,0,1,0,0|1,0,0]=3 391 B11R2.36 OC1=CC=C2NC=CC2=N1 CS12531 [1,0,0,1,0,0|2,0,0]=4 392 B11R2.36 OC1=CC=C2NN=CC2=C1 CS20711 [1,0,0,1,0,0|2,0,0]=4 393 B11R2.36 OC1=CN=C2NC=CC2=C1 CS18571 [1,0,0,1,0,0|2,0,0]=4 394 B13R2.2121 COC1=CC2=C(C=C1)N=C(Br)S2 CS14096 [0,1,0,1,0,0|2,0,0]=4 395 B13R2.2121 COC1=CC2=C(C=C1)N=C(C)N2 MC425727 [0,1,0,1,0,0|1,0,1]=4 396 B13R2.2121 COC1=CC2=C(C=C1)N=C(C)O2 CS10723 [0,1,0,1,0,0|1,0,1]=4 397 B13R2.2121 COC1=CC2=C(C=C1)N=C(C)S2 CS10722 [0,1,0,1,0,0|1,0,1]=4 398 B13R2.2121 COC1=CC2=C(C=C1)N=C(Cl)S2 CS20737 [0,1,0,1,0,0|2,0,0]=4 399 B13R2.2121 COC1=CC2=C(C=C1)N=C(N)S2 CS20926 [0,1,0,1,0,0|2,0,0]=4 400 B13R2.2121 COC1=CC2=C(C=C1)N=C(S)N2 MC426122 [0,1,0,1,0,0|2,0,0]=4 401 B13R2.2121 COC1=CC2=C(C=C1)NC(=O)S2 MC31142 [0,1,0,1,0,0|2,0,0]=4 402 B13R2.2121 COC1=CC2=C(C=C1)NC(=S)S2 MC31086 [0,1,0,1,0,0|2,0,0]=4 403 B13R2.2121 COC1=CC2=C(C=C1)SC(=O)N2 CS16845 [0,1,0,1,0,0|2,0,0]=4 404 B13R2.2121 COC1=CC2=C(C=C1)SC(Cl)=N2 CS12902 [0,1,0,1,0,0|2,0,0]=4 405 B13R2.2121 COC1=CC=C2CC(=O)NC2=C1 CS15903 [0,1,0,1,0,0|1,0,0]=3 406 B13R2.2121 COC1=CC=C2NC(C)=CC2=C1 MC10333 [0,1,0,1,0,0|1,0,0]=3 407 B13R2.2130 COC1=CC2=C(C=C1)C(C)=CO2 MC446648 [0,1,0,1,0,0|1,0,1]=4 408 B13R2.2130 COC1=CC2=C(C=C1)N(C)C=N2 MC33417 [0,1,0,1,0,0|2,0,0]=4 409 B13R2.2130 COC1=CC=C2C(=C1)CCC2N CS17884 [0,1,0,1,0,0|0,0,2]=4 410 B13R2.57 COC1=CC2=CC=CC=C2C=C1 MC10259 [0,1,0,1,0,0|0,0,1]=3 411 B13R2.57 COC1=CC2=CC=CC=C2N=C1 CS13082 [0,1,0,1,0,0|1,0,1]=4 412 B13R2.57 COC1=CC=C2C=CC=NC2=C1 CS12595 [0,1,0,1,0,0|0,0,1]=3 413 B13R2.57 COC1=CC=C2C=NC=CC2=C1 CS18348 [0,1,0,1,0,0|0,0,1]=3 414 B13R2.57 COC1=CC=C2CCCNC2=C1 CS18836 [0,1,0,1,0,0|0,0,2]=4 415 B13R2.57 COC1=CC=C2CNCCC2=C1 CS18370 [0,1,0,1,0,0|0,0,2]=4 416 B13R2.57 COC1=CC=C2N=CC=CC2=C1 CS22118 [0,1,0,1,0,0|0,0,1]=3 417 B13R2.669 COC1=CC=C2CCC(=O)C2=C1 CS10008 [0,1,0,1,0,0|0,0,1]=3 418 B13R2.669 COC1=CC=C2CCC(N)C2=C1 MC104167 [0,1,0,1,0,0|0,0,2]=4 419 B13R2.669 COC1=CC=C2CCC(N)C2=C1 MC105333 [0,1,0,1,0,0|0,0,2]=4 420 B13R2.669 COC1=CC=C2NC=C(C)C2=N1 MC105799 [0,1,0,1,0,0|2,0,0]=4 421 B13R2.669 COC1=CC=C2NN=C(I)C2=C1 MC425561 [0,1,0,1,0,0|2,0,0]=4 422 B13R2.669 COC1=CN=C2NC=C(Br)C2=C1 MC107258 [0,1,0,1,0,0|2,0,0]=4 423 B13R2.669 COC1=CN=C2NC=C(I)C2=C1 MC425631 [0,1,0,1,0,0|2,0,0]=4 424 B13R2.430 CC(=O)C1=CC=C2NC=CC2=C1 CS19941 [0,1,0,1,0,0|2,0,0]=4 425 B13R2.654 COC1=CC(Br)=C2NN=CC2=C1 MC111113 [0,1,0,1,0,0|2,0,0]=4 426 B13R2.654 COC1=CC(C)=C2C=CNC2=C1 CS16807 [0,1,0,1,0,0|1,0,1]=4 427 B13R2.654 COC1=CC(Cl)=C2C=CNC2=C1 MC443547 [0,1,0,1,0,0|1,0,1]=4 428 B13R2.654 COC1=CC2=C(NC=N2)C(Br)=C1 MC107550 [0,1,0,1,0,0|2,0,0]=4 429 B13R2.654 COC1=CC2=C(OC=C2)C(Br)=C1 MC441154 [0,1,0,1,0,0|1,0,0]=3 430 B13R2.449 CCOC1=CC=C2NN=CC2=C1 MC107024 [0,1,0,1,0,0|2,0,0]=4 431 B13R2.449 N#CCC1=CC2=C(C=C1)OCO2 MC40784 [0,1,0,1,0,0|1,0,1]=4 432 B13R2.449 NCCC1=CC=C2NC=CC2=C1 CS16534 [0,1,0,1,0,0|2,0,0]=4 433 B13R2.84 COC1=CC=C2NC=CC2=C1Br MC443548 [0,1,0,1,0,0|1,0,0]=3 434 B13R2.84 COC1=CC=C2NC=CC2=C1C MC111281 [0,1,0,1,0,0|1,0,0]=3 435 B13R2.84 COC1=CC=C2NC=CC2=C1F MC432494 [0,1,0,1,0,0|1,0,0]=3 436 B13R2.84 COC1=CN=C2NC=CC2=C1Br MC104170 [0,1,0,1,0,0|2,0,0]=4 437 B13R2.84 COC1=CN=C2NC=CC2=C1I MC104169 [0,1,0,1,0,0|2,0,0]=4 438 B13R2.599 COC1=C(Br)C=C2NC=CC2=C1 CS15247 [0,1,0,1,0,0|1,0,0]=3 439 B13R2.599 COC1=C(Br)C=C2NN=CC2=C1 MC444417 [0,1,0,1,0,0|2,0,0]=4 440 B13R2.599 COC1=C(F)C=C2NC=CC2=C1 MC115997 [0,1,0,1,0,0|1,0,0]=3 441 B13R2.599 COC1=CC2=C(C=C1Br)N=CN2 CS16251 [0,1,0,1,0,0|2,0,0]=4