0 B11R1.40 C=CC(=O)NC1=CC=CC=C1 SY052499 [0,0,0,0,0,0|2,0,1]=3 1 B11R1.40 C=CC(=O)OC1=CC=CC=C1 SY050025 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.40 COC(=O)CC1=CC=CN=C1 SY014800 [0,0,0,0,0,0|1,0,0]=1 3 B11R1.40 COC(=O)CC1=CC=CN=C1 SY033634 [0,0,0,0,0,0|1,0,0]=1 4 B11R1.40 COC(=O)CC1=CC=NC=C1 SY003565 [0,0,0,0,0,0|1,0,0]=1 5 B11R1.40 COC(=O)CC1=CC=NC=C1 SY007994 [0,0,0,0,0,0|1,0,0]=1 6 B11R1.40 COC(=O)CC1=NC=CC=C1 SY030291 [0,0,0,0,0,0|1,0,0]=1 7 B11R1.40 COC(=O)CC1=NC=CC=N1 SY005830 [0,0,0,0,0,0|2,0,0]=2 8 B11R1.40 COC(=O)C[N+]1=NC=CC=C1 SY286050 [0,0,0,0,0,0|2,0,0]=2 9 B11R1.40 N#CC(=O)CC1=CC=CC=C1 SY235509 [0,0,0,0,0,0|2,0,0]=2 10 B11R1.40 NC(CF)CC1=CC=CC=C1 SY045874 [0,0,0,0,0,0|3,0,1]=4 11 B11R1.40 NC(CO)CC1=CC=CC=C1 SY030554 [0,0,0,0,0,0|3,0,1]=4 12 B11R1.40 NNC(=O)CC1=CC=CC=C1 SY032275 [0,0,0,0,0,0|2,0,0]=2 13 B11R1.40 NNC(=O)OC1=CC=CC=C1 SY262826 [0,0,0,0,0,0|3,0,0]=3 14 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 SY013878 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.40 N[C@H](CF)CC1=CC=CC=C1 SY045873 [0,0,0,0,0,0|3,0,1]=4 16 B11R1.40 O=C(CBr)OC1=CC=CC=C1 SY036432 [0,0,0,0,0,0|3,0,0]=3 17 B11R1.40 O=C(CCl)NC1=CC=NC=C1 SY022530 [0,0,0,0,0,0|4,0,0]=4 18 B11R1.40 O=C(CCl)NC1=NC=CC=C1 SY022508 [0,0,0,0,0,0|4,0,0]=4 19 B11R1.40 O=C\C(Br)=C\C1=CC=CC=C1 SY048553 [0,0,0,0,0,0|3,0,1]=4 20 B11R1.40 ON=C(Cl)CC1=CC=CC=C1 SY039705 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.17 BrCCCC1=CC=CC=C1 SY046253 [1,0,0,0,0,0|2,0,1]=4 22 B10R1.17 C1=CC=CC=C1CCC#N SY246292 [1,0,0,0,0,0|2,0,1]=4 23 B10R1.17 C=COCC1=CC=CC=C1 SY097145 [1,0,0,0,0,0|2,0,1]=4 24 B10R1.17 CCC#CC1=CC=CC=C1 SY049474 [1,0,0,0,0,0|1,0,2]=4 25 B10R1.17 CCCC[N+]1=CC=CC=C1 SY023279 [1,0,0,0,0,0|2,0,1]=4 26 B10R1.17 CCCC[N+]1=CC=CC=C1 SY033834 [1,0,0,0,0,0|2,0,1]=4 27 B10R1.17 CCNCC1=CC=CN=C1 SY005910 [1,0,0,0,0,0|3,0,0]=4 28 B10R1.17 CCNCC1=CC=NC=C1 SY009304 [1,0,0,0,0,0|3,0,0]=4 29 B10R1.17 CCNCC1=NC=CC=C1 SY005911 [1,0,0,0,0,0|3,0,0]=4 30 B10R1.17 CNCCC1=CC=CC=C1 SY002512 [1,0,0,0,0,0|1,0,1]=3 31 B10R1.17 ClCCCC1=CC=CC=C1 SY048978 [1,0,0,0,0,0|2,0,1]=4 32 B10R1.17 ClCOCC1=CC=CC=C1 SY003069 [1,0,0,0,0,0|3,0,0]=4 33 B10R1.17 ICCCC1=CC=CC=C1 SY249461 [1,0,0,0,0,0|2,0,1]=4 34 B10R1.17 N#C\C=C\C1=CC=CC=C1 SY014969 [1,0,0,0,0,0|2,0,1]=4 35 B10R1.17 NCCCC1=CC=CC=C1 SY049659 [1,0,0,0,0,0|2,0,1]=4 36 B10R1.17 NC\C=C\C1=CC=CC=C1 SY123671 [1,0,0,0,0,0|2,0,1]=4 37 B10R1.17 NNCCC1=CC=CC=C1 SY048081 [1,0,0,0,0,0|2,0,1]=4 38 B10R1.17 NOCCC1=CC=CC=C1 SY114401 [1,0,0,0,0,0|1,0,1]=3 39 B10R1.17 NOCCC1=CC=CC=C1 SY281546 [1,0,0,0,0,0|1,0,1]=3 40 B10R1.17 OCCCC1=CC=CC=C1 SY003672 [1,0,0,0,0,0|2,0,1]=4 41 B10R1.17 OC\C=C/C1=CC=CC=C1 SY129813 [1,0,0,0,0,0|2,0,1]=4 42 B10R1.18 BrC(Br)=CC1=CC=CC=C1 SY022051 [1,0,0,0,0,0|2,0,1]=4 43 B10R1.18 CC(=O)CC1=CC=NC=C1 SY002437 [1,0,0,0,0,0|1,0,0]=2 44 B10R1.18 CC(=O)CC1=CC=NC=C1 SY005221 [1,0,0,0,0,0|1,0,0]=2 45 B10R1.18 CC(=O)CC1=NC=CC=C1 SY002438 [1,0,0,0,0,0|1,0,0]=2 46 B10R1.18 CC(C)=CC1=CC=CC=C1 SY055240 [1,0,0,0,0,0|1,0,1]=3 47 B10R1.18 CC(C)CC1=CC=NC=C1 SY028398 [1,0,0,0,0,0|2,0,1]=4 48 B10R1.18 CC(O)CC1=CC=CC=C1 SY051093 [1,0,0,0,0,0|0,0,2]=3 49 B10R1.18 FC(F)CC1=CC=CC=C1 SY265774 [1,0,0,0,0,0|2,0,1]=4 50 B10R1.18 N=C(N)NC1=CC=CC=C1 SY059286 [1,0,0,0,0,0|3,0,0]=4 51 B10R1.18 NC(=O)CC1=CC=CC=C1 SY017094 [1,0,0,0,0,0|1,0,0]=2 52 B10R1.18 NC(=O)OC1=CC=CC=C1 SY109407 [1,0,0,0,0,0|2,0,0]=3 53 B10R1.18 O=C(O)CC1=CC=CN=C1 SY001707 [1,0,0,0,0,0|1,0,0]=2 54 B10R1.18 O=C(O)CC1=CC=NC=C1 SY003595 [1,0,0,0,0,0|1,0,0]=2 55 B10R1.18 O=C(O)CC1=CN=CN=C1 SY020567 [1,0,0,0,0,0|2,0,0]=3 56 B10R1.18 O=C(O)CC1=NC=CC=C1 SY003293 [1,0,0,0,0,0|1,0,0]=2 57 B10R1.18 O=C(O)CC1=NC=CC=N1 SY004102 [1,0,0,0,0,0|2,0,0]=3 58 B10R1.18 O=C(O)CC1=NC=CN=C1 SY034525 [1,0,0,0,0,0|2,0,0]=3 59 B12R1.32 CCOC(=O)CC1=CC=CN=C1 SY021549 [0,1,0,0,0,0|1,0,0]=2 60 B12R1.32 CCOC(=O)CC1=CC=NC=C1 SY011574 [0,1,0,0,0,0|1,0,0]=2 61 B12R1.32 CCOC(=O)CC1=NC=CC=C1 SY001136 [0,1,0,0,0,0|1,0,0]=2 62 B12R1.32 CCOC(=O)CC1=NC=CC=N1 SY007015 [0,1,0,0,0,0|2,0,0]=3 63 B12R1.32 CCOC(=O)CC1=NC=CN=C1 SY240706 [0,1,0,0,0,0|2,0,0]=3 64 B12R1.32 CN(CCCl)CC1=CC=CC=C1 SY011648 [0,1,0,0,0,0|3,0,0]=4 65 B12R1.32 CN(CCO)CC1=CC=CC=C1 SY025492 [0,1,0,0,0,0|3,0,0]=4 66 B12R1.32 COCC(=O)OC1=CC=CC=C1 SY261726 [0,1,0,0,0,0|1,0,0]=2 67 B12R1.32 N#CCC(=O)NC1=CC=CC=C1 SY043058 [0,1,0,0,0,0|2,0,1]=4 68 B12R1.34 CC(C(=O)NN)C1=CC=CC=C1 SY263061 [0,1,0,0,0,0|2,0,0]=3 69 B12R1.34 CCC(C)C(N)C1=CC=CC=C1 SY040748 [0,1,0,0,0,0|2,0,1]=4 70 B12R1.34 COC(=O)C(=O)C1=CC=CC=C1 SY014788 [0,1,0,0,0,0|0,0,1]=2 71 B12R1.34 COC(=O)C(N)C1=CC=CC=C1 SY113594 [0,1,0,0,0,0|0,0,0]=1 72 B12R1.34 COC(=O)C(N)C1=CC=NC=C1 SY023726 [0,1,0,0,0,0|1,0,0]=2 73 B12R1.34 COC(=O)C(N)C1=NC=CC=C1 SY033361 [0,1,0,0,0,0|1,0,0]=2 74 B12R1.34 COC(=O)[C@@H](O)C1=CC=CC=C1 SY003754 [0,1,0,0,0,0|0,0,0]=1 75 B12R1.34 COC(=O)[C@H](N)C1=CC=CC=C1 SY020988 [0,1,0,0,0,0|0,0,0]=1 76 B12R1.34 COC(=O)[C@H](O)C1=CC=CC=C1 SY003762 [0,1,0,0,0,0|0,0,0]=1 77 B12R1.34 CON(C)C(=O)C1=CC=CC=C1 SY052485 [0,1,0,0,0,0|2,0,1]=4 78 B12R1.34 NNC(=O)[C@H](O)C1=CC=CC=C1 SY017161 [0,1,0,0,0,0|2,0,0]=3 79 B12R1.43 C=C(C)C(=O)NC1=CC=CC=C1 SY051128 [0,1,0,0,0,0|2,0,0]=3 80 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O SY006039 [0,1,0,0,0,0|3,0,0]=4 81 B12R1.43 CC(N)C(=O)CC1=CC=CC=C1 SY147169 [0,1,0,0,0,0|1,0,0]=2 82 B12R1.49 C=CC(=O)NC1=CC=C(O)C=C1 SY288307 [0,1,0,0,0,0|2,0,1]=4 83 B12R1.49 CCC(=O)NC1=CC=C(O)C=C1 SY139358 [0,1,0,0,0,0|2,0,0]=3 84 B12R1.49 COC(=O)CC1=CC=C(Br)C=C1 SY021204 [0,1,0,0,0,0|0,0,0]=1 85 B12R1.49 COC(=O)CC1=CC=C(Br)N=C1 SY235517 [0,1,0,0,0,0|1,0,0]=2 86 B12R1.49 COC(=O)CC1=CC=C(C)C=C1 SY052935 [0,1,0,0,0,0|0,0,0]=1 87 B12R1.49 COC(=O)CC1=CC=C(Cl)C=C1 SY051360 [0,1,0,0,0,0|0,0,0]=1 88 B12R1.49 COC(=O)CC1=CC=C(Cl)N=C1 SY030613 [0,1,0,0,0,0|1,0,0]=2 89 B12R1.49 COC(=O)CC1=CC=C(F)C=C1 SY041951 [0,1,0,0,0,0|0,0,0]=1 90 B12R1.49 COC(=O)CC1=CC=C(I)C=C1 SY041745 [0,1,0,0,0,0|0,0,0]=1 91 B12R1.49 COC(=O)CC1=CC=C(N)C=C1 SY100571 [0,1,0,0,0,0|0,0,0]=1 92 B12R1.49 COC(=O)CC1=CC=C(N)N=C1 SY278591 [0,1,0,0,0,0|1,0,0]=2 93 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 SY001844 [0,1,0,0,0,0|0,0,0]=1 94 B12R1.49 COC(=O)CC1=NC=C(Br)C=C1 SY029783 [0,1,0,0,0,0|1,0,0]=2 95 B12R1.49 O=C(CCl)NC1=CC=C(Cl)C=C1 SY081416 [0,1,0,0,0,0|3,0,0]=4 96 B12R1.50 COC(=O)CC1=CC(Br)=CC=C1 SY004524 [0,1,0,0,0,0|0,0,0]=1 97 B12R1.50 COC(=O)CC1=CC(Br)=NC=C1 SY030795 [0,1,0,0,0,0|1,0,0]=2 98 B12R1.50 COC(=O)CC1=CC=CC(Cl)=C1 SY053038 [0,1,0,0,0,0|0,0,0]=1 99 B12R1.50 COC(=O)CC1=CC=CC(F)=C1 SY051263 [0,1,0,0,0,0|0,0,0]=1 100 B12R1.50 COC(=O)CC1=CC=CC(N)=C1 SY005119 [0,1,0,0,0,0|0,0,0]=1 101 B12R1.50 COC(=O)CC1=CC=CC(O)=C1 SY023952 [0,1,0,0,0,0|0,0,0]=1 102 B12R1.118 CN[C@H](CO)CC1=CC=CC=C1 SY033679 [0,1,0,0,0,0|1,0,2]=4 103 B12R1.371 COC(=O)CC1=C(O)C=CC=C1 SY032006 [0,1,0,0,0,0|0,0,0]=1 104 B12R1.371 COC(=O)CC1=CC=CC=C1Br SY023296 [0,1,0,0,0,0|0,0,0]=1 105 B12R1.371 COC(=O)CC1=CC=CC=C1C SY106492 [0,1,0,0,0,0|0,0,0]=1 106 B12R1.371 COC(=O)CC1=CC=CC=C1Cl SY021282 [0,1,0,0,0,0|0,0,0]=1 107 B12R1.371 COC(=O)CC1=CC=CC=C1F SY258978 [0,1,0,0,0,0|0,0,0]=1 108 B12R1.371 COC(=O)CC1=CC=CC=C1I SY311934 [0,1,0,0,0,0|0,0,0]=1 109 B12R2.18 CC1=CC2=C(C=CC=C2)N1C SY004658 [0,0,0,1,0,0|2,0,1]=4 110 B12R2.18 CN1C(=O)CC2=C1C=CC=C2 SY042826 [0,0,0,1,0,0|1,0,0]=2 111 B12R2.18 CN1C(=O)NC2=CC=CC=C21 SY045893 [0,0,0,1,0,0|2,0,0]=3 112 B12R2.18 CN1C(Br)=CC2=C1C=CC=C2 SY247582 [0,0,0,1,0,0|2,0,1]=4 113 B12R2.18 O=C1CC2=C(C=CC=C2)C1=O SY016747 [0,0,0,1,0,0|2,0,0]=3 114 B12R2.18 O=C1NC2=CC=CC=C2C1=O SY005277 [0,0,0,1,0,0|3,0,0]=4 115 B12R2.18 O=C1OC2=CC=CC=C2C1=O SY023499 [0,0,0,1,0,0|3,0,0]=4 116 B12R2.24 BrC1CCC2=C(C=CC=C2)C1 SY297477 [0,0,0,1,0,0|2,0,1]=4 117 B12R2.24 NC1CCC2=C(C=CC=C2)C1 SY031850 [0,0,0,1,0,0|2,0,1]=4 118 B12R2.24 N[C@@H]1CCC2=C(C=CC=C2)C1 SY118721 [0,0,0,1,0,0|2,0,1]=4 119 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 SY036247 [0,0,0,1,0,0|0,0,0]=1 120 B12R2.24 O=C1CCC2=CC=NC=C2N1 SY249512 [0,0,0,1,0,0|3,0,0]=4 121 B12R2.24 O=C1CNC2=C(C=CC=C2)C1 SY292612 [0,0,0,1,0,0|2,0,0]=3 122 B12R2.24 O=C1CNC2=C(C=CC=C2)N1 SY018411 [0,0,0,1,0,0|3,0,0]=4 123 B12R2.24 O=C1CNC2=CC=CC=C2O1 SY292600 [0,0,0,1,0,0|3,0,0]=4 124 B12R2.24 O=C1COC2=C(C=CC=C2)N1 SY007578 [0,0,0,1,0,0|3,0,0]=4 125 B12R2.24 O=C1CSC2=C(C=CC=C2)C1 SY033162 [0,0,0,1,0,0|2,0,0]=3 126 B12R2.24 O=C1NC2=C(C=CN=C2)CO1 SY129221 [0,0,0,1,0,0|2,0,0]=3 127 B12R2.24 O=C1NC2=C(C=NC=C2)CO1 SY129222 [0,0,0,1,0,0|2,0,0]=3 128 B12R2.24 O=C1NC2=CC=CC=C2CO1 SY129148 [0,0,0,1,0,0|1,0,0]=2 129 B12R2.24 O=C1NC2=NC=CC=C2CO1 SY129220 [0,0,0,1,0,0|2,0,0]=3 130 B12R2.24 OC1CC2=C(C=CC=C2)CO1 SY293993 [0,0,0,1,0,0|0,0,2]=3 131 B12R2.24 OC1CCC2=C(C=CC=C2)C1 SY056861 [0,0,0,1,0,0|1,0,2]=4 132 B12R2.27 CNC1CC1C2=CC=CC=C2 SY262087 [0,0,0,1,0,0|2,0,1]=4 133 B12R2.32 CCC1=CC2=CC=CC=C2O1 SY067362 [0,0,0,1,0,0|1,0,2]=4 134 B12R2.32 CCC1=NC2=CC=CC=C2N1 SY015992 [0,0,0,1,0,0|3,0,0]=4 135 B12R2.32 CSC1=NC2=CC=CC=C2S1 SY037966 [0,0,0,1,0,0|1,2,0]=4 136 B10R1.15 CCC(=O)C1=CC=CC=N1 SY005362 [0,0,0,0,1,0|2,0,0]=3 137 B10R1.15 CCC(O)C1=CC=CC=C1 SY020321 [0,0,0,0,1,0|1,0,2]=4 138 B10R1.15 CCN(C)C1=CC=CC=C1 SY032004 [0,0,0,0,1,0|3,0,0]=4 139 B10R1.15 CNC(=O)C1=CC=CC=C1 SY037937 [0,0,0,0,1,0|1,0,0]=2 140 B10R1.15 COC(=O)C1=CN=CC=N1 SY006191 [0,0,0,0,1,0|2,0,0]=3 141 B10R1.15 COC(=O)C1=CN=CN=C1 SY096988 [0,0,0,0,1,0|2,0,0]=3 142 B10R1.15 COC(=O)C1=CN=NC=C1 SY004472 [0,0,0,0,1,0|2,0,0]=3 143 B10R1.15 COC(=O)C1=NC=CC=C1 SY005022 [0,0,0,0,1,0|1,0,0]=2 144 B10R1.15 COC(=O)C1=NC=CC=N1 SY006773 [0,0,0,0,1,0|2,0,0]=3 145 B10R1.15 COC(=O)C1=NC=NC=C1 SY019964 [0,0,0,0,1,0|2,0,0]=3 146 B10R1.15 COS(=O)C1=CC=CC=C1 SY050665 [0,0,0,0,1,0|1,0,0]=2 147 B10R1.15 C\C(=N\O)C1=CC=CC=C1 SY057978 [0,0,0,0,1,0|3,0,0]=4 148 B10R1.15 NC(=NO)C1=CC=CC=C1 SY057185 [0,0,0,0,1,0|3,0,0]=4 149 B10R1.15 NCC(=O)C1=CC=CC=C1 SY007242 [0,0,0,0,1,0|2,0,0]=3 150 B10R1.15 NNC(=O)C1=CC=NC=C1 SY010614 [0,0,0,0,1,0|3,0,0]=4 151 B10R1.15 NNC(=O)C1=CN=CC=C1 SY033050 [0,0,0,0,1,0|3,0,0]=4 152 B10R1.15 NNC(=O)C1=NC=CC=C1 SY021575 [0,0,0,0,1,0|3,0,0]=4 153 B10R1.15 O=C(CBr)C1=CC=CN=C1 SY023116 [0,0,0,0,1,0|3,0,0]=4 154 B10R1.15 O=C(CBr)C1=NC=CC=C1 SY007962 [0,0,0,0,1,0|3,0,0]=4 155 B10R1.15 O=C(CBr)C1=NC=CC=C1 SY226653 [0,0,0,0,1,0|3,0,0]=4 156 B10R1.15 O=C(CCl)C1=CC=NC=C1 SY011676 [0,0,0,0,1,0|3,0,0]=4 157 B10R1.15 O=C(CO)C1=CC=CC=C1 SY014756 [0,0,0,0,1,0|2,0,0]=3 158 B10R1.15 O=C(CO)C1=CC=CN=C1 SY131032 [0,0,0,0,1,0|3,0,0]=4 159 B10R1.15 O=C(CO)C1=CC=NC=C1 SY131033 [0,0,0,0,1,0|3,0,0]=4 160 B10R1.15 O=C(CO)C1=NC=CC=C1 SY131031 [0,0,0,0,1,0|3,0,0]=4 161 B10R1.15 O=CC(=O)C1=CC=CC=C1 SY047494 [0,0,0,0,1,0|2,0,0]=3 162 B10R1.27 COC(=O)CC1=CC=CS1 SY233030 [0,0,0,0,1,0|1,0,0]=2 163 B10R1.27 COC(=O)CN1C=CN=C1 SY005431 [0,0,0,0,1,0|2,0,0]=3 164 B10R1.27 COC(=O)CN1C=CN=N1 SY059677 [0,0,0,0,1,0|3,0,0]=4 165 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 SY004327 [0,0,0,0,0,1|1,0,1]=3 166 B12R1.27 COC(=O)C#CC1=CC=CN=C1 SY022413 [0,0,0,0,0,1|1,0,1]=3 167 B12R1.27 COC(=O)C#CC1=CC=NC=C1 SY022412 [0,0,0,0,0,1|1,0,1]=3 168 B12R1.27 COC(=O)C#CC1=NC=CC=C1 SY022414 [0,0,0,0,0,1|1,0,1]=3 169 B12R1.27 COC(=O)CCC1=CC=CC=C1 SY017877 [0,0,0,0,0,1|0,0,0]=1 170 B12R1.27 COC(=O)CCC1=CC=NC=C1 SY022395 [0,0,0,0,0,1|1,0,0]=2 171 B12R1.27 COC(=O)CCC1=NC=CC=C1 SY022458 [0,0,0,0,0,1|1,0,0]=2 172 B12R1.27 COC(=O)COC1=CC=CC=C1 SY037886 [0,0,0,0,0,1|0,0,0]=1 173 B12R1.27 NCC(=O)OCC1=CC=CC=C1 SY021003 [0,0,0,0,0,1|2,0,0]=3 174 B12R1.27 NCC(=O)OCC1=CC=CC=C1 SY038933 [0,0,0,0,0,1|2,0,0]=3 175 B12R1.27 NNC(=O)OCC1=CC=CC=C1 SY017007 [0,0,0,0,0,1|2,0,0]=3 176 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 SY002918 [0,0,0,0,0,1|2,0,0]=3 177 B12R1.27 O=C(CO)OCC1=CC=CC=C1 SY115712 [0,0,0,0,0,1|2,0,0]=3 178 B12R1.27 O=C(NO)OCC1=CC=CC=C1 SY024162 [0,0,0,0,0,1|2,0,0]=3 179 B9R1.8 CC#CC1=CC=CC=C1 SY048557 [2,0,0,0,0,0|0,0,2]=4 180 B9R1.8 CCCC1=NC=CC=C1 SY035538 [2,0,0,0,0,0|1,0,1]=4 181 B9R1.8 CNCC1=CC=CN=C1 SY002368 [2,0,0,0,0,0|2,0,0]=4 182 B9R1.8 CNCC1=CC=NC=C1 SY002386 [2,0,0,0,0,0|2,0,0]=4 183 B9R1.8 CNCC1=NC=CC=C1 SY003781 [2,0,0,0,0,0|2,0,0]=4 184 B9R1.8 COCC1=CC=CC=C1 SY049310 [2,0,0,0,0,0|0,0,0]=2 185 B9R1.8 NNCC1=CC=CC=C1 SY004756 [2,0,0,0,0,0|2,0,0]=4 186 B9R1.8 NNCC1=CC=CC=C1 SY004764 [2,0,0,0,0,0|2,0,0]=4 187 B9R1.8 NOCC1=CC=CC=C1 SY005671 [2,0,0,0,0,0|1,0,0]=3 188 B9R1.8 NOCC1=CC=CC=C1 SY018100 [2,0,0,0,0,0|1,0,0]=3 189 B9R1.8 NOCC1=CC=CN=C1 SY029692 [2,0,0,0,0,0|2,0,0]=4 190 B9R1.8 NOCC1=CC=CN=C1 SY281597 [2,0,0,0,0,0|2,0,0]=4 191 B9R1.8 NOCC1=CC=NC=C1 SY281602 [2,0,0,0,0,0|2,0,0]=4 192 B9R1.8 NOCC1=CC=NC=C1 SY281603 [2,0,0,0,0,0|2,0,0]=4 193 B9R1.8 NOCC1=NC=CC=C1 SY281576 [2,0,0,0,0,0|2,0,0]=4 194 B9R1.8 NOCC1=NC=CC=C1 SY281577 [2,0,0,0,0,0|2,0,0]=4 195 B9R1.8 O=CNC1=CC=CC=C1 SY011224 [2,0,0,0,0,0|1,0,0]=3 196 B9R1.8 O=COC1=CC=CC=C1 SY106351 [2,0,0,0,0,0|1,0,0]=3 197 B9R1.8 OCCC1=CC=CN=C1 SY004170 [2,0,0,0,0,0|1,0,1]=4 198 B9R1.8 OCCC1=CC=NC=C1 SY001138 [2,0,0,0,0,0|1,0,1]=4 199 B9R1.8 ONCC1=CC=CC=C1 SY019534 [2,0,0,0,0,0|1,0,0]=3 200 B9R1.8 ONCC1=CC=CC=C1 SY024088 [2,0,0,0,0,0|1,0,0]=3 201 B9R1.8 O\N=C\C1=CC=CC=C1 SY112944 [2,0,0,0,0,0|1,0,1]=4 202 B9R1.8 SCCC1=CC=CC=C1 SY039368 [2,0,0,0,0,0|0,1,1]=4 203 B11R1.1 CCCCC1=CC=C(Br)C=C1 SY013489 [1,1,0,0,0,0|1,0,1]=4 204 B11R1.1 CCCCC1=CC=C(I)C=C1 SY029294 [1,1,0,0,0,0|1,0,1]=4 205 B11R1.1 CCNCC1=CC=C(Br)C=C1 SY002622 [1,1,0,0,0,0|2,0,0]=4 206 B11R1.1 CCNCC1=CC=C(C)C=C1 SY045939 [1,1,0,0,0,0|2,0,0]=4 207 B11R1.1 CCNCC1=CC=C(Cl)C=C1 SY002523 [1,1,0,0,0,0|2,0,0]=4 208 B11R1.1 CCNCC1=CC=C(F)C=C1 SY002625 [1,1,0,0,0,0|2,0,0]=4 209 B11R1.1 CCNCC1=CC=C(N)C=C1 SY003699 [1,1,0,0,0,0|2,0,0]=4 210 B11R1.1 CCNCC1=CC=C(O)C=C1 SY018668 [1,1,0,0,0,0|2,0,0]=4 211 B11R1.1 CNCCC1=CC=C(Cl)C=C1 SY002514 [1,1,0,0,0,0|1,0,1]=4 212 B11R1.1 COCOC1=CC=C(Br)C=C1 SY013180 [1,1,0,0,0,0|1,0,1]=4 213 B11R1.1 NOCCC1=CC=C(Cl)C=C1 SY281852 [1,1,0,0,0,0|1,0,1]=4 214 B11R1.1 NOCCC1=CC=C(Cl)C=C1 SY281853 [1,1,0,0,0,0|1,0,1]=4 215 B11R1.1 NOCCC1=CC=C(F)C=C1 SY281706 [1,1,0,0,0,0|1,0,1]=4 216 B11R1.1 NOCCC1=CC=C(F)C=C1 SY281707 [1,1,0,0,0,0|1,0,1]=4 217 B11R1.16 COC[C@@H](N)C1=CC=CC=C1 SY025161 [1,1,0,0,0,0|0,0,1]=3 218 B11R1.16 COC[C@H](N)C1=CC=CC=C1 SY039587 [1,1,0,0,0,0|0,0,1]=3 219 B11R1.17 CCNCC1=CC=CC=C1O SY018670 [1,1,0,0,0,0|2,0,0]=4 220 B11R1.17 CNCCC1=CC=CC=C1F SY002937 [1,1,0,0,0,0|1,0,1]=4 221 B11R1.24 CCNCC1=CC=CC(Br)=C1 SY002525 [1,1,0,0,0,0|2,0,0]=4 222 B11R1.24 CCNCC1=CC=CC(Cl)=C1 SY045903 [1,1,0,0,0,0|2,0,0]=4 223 B11R1.24 CCNCC1=CC=CC(F)=C1 SY002642 [1,1,0,0,0,0|2,0,0]=4 224 B11R1.24 CCNCC1=CC=CC(O)=C1 SY018672 [1,1,0,0,0,0|2,0,0]=4 225 B11R1.24 CNCCC1=CC=CC(Cl)=C1 SY002516 [1,1,0,0,0,0|1,0,1]=4 226 B11R1.24 CNCCC1=CC=CC(F)=C1 SY002844 [1,1,0,0,0,0|1,0,1]=4 227 B11R1.24 COCOC1=CC(Br)=CC=C1 SY165520 [1,1,0,0,0,0|1,0,1]=4 228 B11R1.24 COCOC1=CC=CC(Cl)=C1 SY224767 [1,1,0,0,0,0|1,0,1]=4 229 B11R1.28 BrCCCCC1=CC=CC=C1 SY036816 [1,1,0,0,0,0|1,0,1]=4 230 B11R1.28 BrCCOCC1=CC=CC=C1 SY021677 [1,1,0,0,0,0|2,0,0]=4 231 B11R1.28 CCNCCC1=CC=CC=C1 SY248623 [1,1,0,0,0,0|1,0,1]=4 232 B11R1.28 ClCCNCC1=CC=CC=C1 SY239742 [1,1,0,0,0,0|2,0,0]=4 233 B11R1.28 ICCOCC1=CC=CC=C1 SY260861 [1,1,0,0,0,0|2,0,0]=4 234 B11R1.28 NCCOCC1=CC=CC=C1 SY018893 [1,1,0,0,0,0|2,0,0]=4 235 B11R1.28 NOCCCC1=CC=CC=C1 SY281833 [1,1,0,0,0,0|1,0,1]=4 236 B11R1.28 NOCCCC1=CC=CC=C1 SY281834 [1,1,0,0,0,0|1,0,1]=4 237 B11R1.28 NOCCOC1=CC=CC=C1 SY006322 [1,1,0,0,0,0|1,0,1]=4 238 B11R1.28 OCCCCC1=CC=CC=C1 SY015871 [1,1,0,0,0,0|1,0,1]=4 239 B11R1.28 OCCNCC1=CC=CC=C1 SY001172 [1,1,0,0,0,0|2,0,0]=4 240 B11R1.28 OCCOCC1=CC=CC=C1 SY015814 [1,1,0,0,0,0|2,0,0]=4 241 B11R1.91 CC(=O)CCC1=CC=CC=C1 SY013502 [1,1,0,0,0,0|1,0,1]=4 242 B11R1.91 CC(C)NCC1=CC=CC=C1 SY032809 [1,1,0,0,0,0|2,0,0]=4 243 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 SY045434 [1,1,0,0,0,0|0,0,0]=2 244 B11R1.20 CC(=O)CC1=CC=C(C)C=C1 SY042746 [1,1,0,0,0,0|0,0,0]=2 245 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 SY017113 [1,1,0,0,0,0|0,0,0]=2 246 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 SY017054 [1,1,0,0,0,0|0,0,0]=2 247 B11R1.20 CC(=O)NC1=CC=C(Br)C=C1 SY049651 [1,1,0,0,0,0|1,0,0]=3 248 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 SY035719 [1,1,0,0,0,0|1,0,0]=3 249 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 SY001162 [1,1,0,0,0,0|1,0,0]=3 250 B11R1.20 CC(=O)NC1=NC=C(Br)C=C1 SY022132 [1,1,0,0,0,0|2,0,0]=4 251 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 SY016072 [1,1,0,0,0,0|1,0,0]=3 252 B11R1.20 CC(=O)OC1=CC=C(N)C=C1 SY233693 [1,1,0,0,0,0|1,0,0]=3 253 B11R1.20 CC(C)CC1=CC=C(N)C=C1 SY035752 [1,1,0,0,0,0|1,0,1]=4 254 B11R1.20 CC1=CC=C(CC(=O)Cl)C=C1 SY246635 [1,1,0,0,0,0|1,0,0]=3 255 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 SY013543 [1,1,0,0,0,0|0,0,0]=2 256 B11R1.20 CC1=CC=C(CC(=O)O)C=N1 SY031092 [1,1,0,0,0,0|1,0,0]=3 257 B11R1.20 CN(C)CC1=CC=C(N)C=C1 SY003571 [1,1,0,0,0,0|2,0,0]=4 258 B11R1.20 NC(=O)CC1=CC=C(Br)C=C1 SY132432 [1,1,0,0,0,0|1,0,0]=3 259 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 SY001683 [1,1,0,0,0,0|1,0,0]=3 260 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 SY001637 [1,1,0,0,0,0|0,0,0]=2 261 B11R1.20 O=C(Cl)OC1=CC=C(Br)C=C1 SY113865 [1,1,0,0,0,0|2,0,0]=4 262 B11R1.20 O=C(Cl)OC1=CC=C(I)C=C1 SY296872 [1,1,0,0,0,0|2,0,0]=4 263 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 SY001685 [1,1,0,0,0,0|0,0,0]=2 264 B11R1.20 O=C(O)CC1=CC=C(Cl)N=C1 SY041953 [1,1,0,0,0,0|1,0,0]=3 265 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 SY001347 [1,1,0,0,0,0|0,0,0]=2 266 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 SY016997 [1,1,0,0,0,0|0,0,0]=2 267 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 SY004128 [1,1,0,0,0,0|0,0,0]=2 268 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 SY097003 [1,1,0,0,0,0|1,0,0]=3 269 B11R1.20 O=C(O)CC1=NC=C(F)C=C1 SY039154 [1,1,0,0,0,0|1,0,0]=3 270 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 SY051220 [1,1,0,0,0,0|0,0,1]=3 271 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 SY036428 [1,1,0,0,0,0|0,0,1]=3 272 B11R1.36 CC(=O)C(O)C1=CC=CC=C1 SY028287 [1,1,0,0,0,0|0,0,0]=2 273 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 SY053096 [1,1,0,0,0,0|1,0,0]=3 274 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 SY004963 [1,1,0,0,0,0|0,0,0]=2 275 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 SY020842 [1,1,0,0,0,0|0,0,0]=2 276 B11R1.36 C[C@H](C(=O)O)C1=CC=CC=C1 SY021075 [1,1,0,0,0,0|0,0,0]=2 277 B11R1.36 NC(=O)[C@@H](N)C1=CC=CC=C1 SY009237 [1,1,0,0,0,0|1,0,0]=3 278 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 SY006358 [1,1,0,0,0,0|0,0,0]=2 279 B11R1.36 NC(C(=O)O)C1=CC=CN=C1 SY015083 [1,1,0,0,0,0|1,0,0]=3 280 B11R1.36 NC(C(=O)O)C1=CC=CN=C1 SY184594 [1,1,0,0,0,0|1,0,0]=3 281 B11R1.36 NC(C(=O)O)C1=NC=CC=C1 SY022365 [1,1,0,0,0,0|1,0,0]=3 282 B11R1.36 NC(C(=O)O)C1=NC=CC=C1 SY032366 [1,1,0,0,0,0|1,0,0]=3 283 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 SY006196 [1,1,0,0,0,0|0,0,0]=2 284 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 SY005672 [1,1,0,0,0,0|0,0,0]=2 285 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 SY004129 [1,1,0,0,0,0|0,0,1]=3 286 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 SY110356 [1,1,0,0,0,0|0,0,0]=2 287 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 SY001670 [1,1,0,0,0,0|0,0,0]=2 288 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 SY289327 [1,1,0,0,0,0|0,0,0]=2 289 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 SY001645 [1,1,0,0,0,0|0,0,0]=2 290 B11R1.86 CC(=O)CC1=C(Br)C=CC=C1 SY011510 [1,1,0,0,0,0|0,0,0]=2 291 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 SY037165 [1,1,0,0,0,0|0,0,0]=2 292 B11R1.86 CC(=O)NC1=C(Br)C=CC=C1 SY034454 [1,1,0,0,0,0|1,0,0]=3 293 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 SY004721 [1,1,0,0,0,0|1,0,0]=3 294 B11R1.86 CC(=O)NC1=CC=CC=C1Cl SY048591 [1,1,0,0,0,0|1,0,0]=3 295 B11R1.86 CC(=O)NC1=CC=CC=C1N SY050887 [1,1,0,0,0,0|1,0,0]=3 296 B11R1.86 CC(=O)NC1=NC=CC=C1O SY084890 [1,1,0,0,0,0|2,0,0]=4 297 B11R1.86 CC(=O)OC1=CC=CC=C1Br SY265515 [1,1,0,0,0,0|1,0,0]=3 298 B11R1.86 CC(=O)OC1=CC=CC=C1C SY052277 [1,1,0,0,0,0|1,0,0]=3 299 B11R1.86 CC(=O)OC1=CC=CC=C1F SY224313 [1,1,0,0,0,0|1,0,0]=3 300 B11R1.86 CC(C)CC1=CC=CC=C1N SY036357 [1,1,0,0,0,0|1,0,1]=4 301 B11R1.86 CC1=C(OC(=O)Cl)C=CC=C1 SY296811 [1,1,0,0,0,0|2,0,0]=4 302 B11R1.86 CC1=CC=CC=C1CC(=O)O SY003130 [1,1,0,0,0,0|0,0,0]=2 303 B11R1.86 N=C(N)CC1=C(Cl)C=CC=C1 SY003979 [1,1,0,0,0,0|2,0,0]=4 304 B11R1.86 NC(=O)CC1=CC=CC=C1Cl SY016301 [1,1,0,0,0,0|1,0,0]=3 305 B11R1.86 NC1=CC=CC=C1CC(=O)O SY101243 [1,1,0,0,0,0|0,0,0]=2 306 B11R1.86 O=C(Cl)OC1=CC=CC=C1Br SY296808 [1,1,0,0,0,0|2,0,0]=4 307 B11R1.86 O=C(Cl)OC1=CC=CC=C1F SY202667 [1,1,0,0,0,0|2,0,0]=4 308 B11R1.86 O=C(Cl)OC1=CC=CC=C1I SY296904 [1,1,0,0,0,0|2,0,0]=4 309 B11R1.86 O=C(O)CC1=CC=CC=C1Br SY003588 [1,1,0,0,0,0|0,0,0]=2 310 B11R1.86 O=C(O)CC1=CC=CC=C1F SY003125 [1,1,0,0,0,0|0,0,0]=2 311 B11R1.86 O=C(O)CC1=CC=CC=C1I SY035508 [1,1,0,0,0,0|0,0,0]=2 312 B11R1.86 O=C(O)CC1=CC=CN=C1Cl SY096906 [1,1,0,0,0,0|1,0,0]=3 313 B11R1.86 O=C(O)CC1=NC=CC=C1F SY058130 [1,1,0,0,0,0|1,0,0]=3 314 B11R1.157 CC(=O)CC1=CC=CC(Cl)=C1 SY050661 [1,1,0,0,0,0|0,0,0]=2 315 B11R1.157 CC(=O)CC1=NC=CC(Br)=C1 SY249484 [1,1,0,0,0,0|1,0,0]=3 316 B11R1.157 CC(=O)NC1=CC(Br)=CN=C1 SY128013 [1,1,0,0,0,0|2,0,0]=4 317 B11R1.157 CC(=O)NC1=CC(Cl)=NC=C1 SY064864 [1,1,0,0,0,0|2,0,0]=4 318 B11R1.157 CC(=O)NC1=CC=CC(F)=C1 SY040632 [1,1,0,0,0,0|1,0,0]=3 319 B11R1.157 CC(=O)NC1=CC=CC(N)=C1 SY006038 [1,1,0,0,0,0|1,0,0]=3 320 B11R1.157 CC(=O)NC1=NC(N)=CC=C1 SY025653 [1,1,0,0,0,0|2,0,0]=4 321 B11R1.157 CC(=O)NC1=NC=CC(Br)=C1 SY116307 [1,1,0,0,0,0|2,0,0]=4 322 B11R1.157 CC(=O)OC1=CC=CC(Cl)=C1 SY224191 [1,1,0,0,0,0|1,0,0]=3 323 B11R1.157 CC(=O)OC1=CC=CC(F)=C1 SY042571 [1,1,0,0,0,0|1,0,0]=3 324 B11R1.157 CC1=CC(CC(=O)O)=CC=C1 SY048780 [1,1,0,0,0,0|0,0,0]=2 325 B11R1.157 CC1=CC(OC(=O)Cl)=CC=C1 SY203736 [1,1,0,0,0,0|2,0,0]=4 326 B11R1.157 CC1=CC=CC(CC(=O)O)=N1 SY249639 [1,1,0,0,0,0|1,0,0]=3 327 B11R1.157 NC(=O)CC1=CC=CC(Br)=C1 SY274676 [1,1,0,0,0,0|1,0,0]=3 328 B11R1.157 O=C(Cl)OC1=CC=CC(Br)=C1 SY296957 [1,1,0,0,0,0|2,0,0]=4 329 B11R1.157 O=C(Cl)OC1=CC=CC(Cl)=C1 SY293019 [1,1,0,0,0,0|2,0,0]=4 330 B11R1.157 O=C(Cl)OC1=CC=CC(F)=C1 SY293018 [1,1,0,0,0,0|2,0,0]=4 331 B11R1.157 O=C(O)CC1=CC=CC(Br)=C1 SY004367 [1,1,0,0,0,0|0,0,0]=2 332 B11R1.157 O=C(O)CC1=CC=CC(Cl)=C1 SY004837 [1,1,0,0,0,0|0,0,0]=2 333 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 SY001712 [1,1,0,0,0,0|0,0,0]=2 334 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 SY032267 [1,1,0,0,0,0|0,0,0]=2 335 B11R1.157 O=C(O)CC1=CC=CC(O)=C1 SY013505 [1,1,0,0,0,0|0,0,0]=2 336 B11R1.157 O=C(O)CC1=NC(Cl)=CC=C1 SY058123 [1,1,0,0,0,0|1,0,0]=3 337 B11R1.509 CC(C)(Cl)CC1=CC=CC=C1 SY096691 [1,1,0,0,0,0|1,0,1]=4 338 B11R1.509 CC(C)(O)CC1=CC=CC=C1 SY047029 [1,1,0,0,0,0|0,0,2]=4 339 B11R1.509 CS(=O)(=O)OC1=CC=CC=C1 SY050523 [1,1,0,0,0,0|2,0,0]=4 340 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SY003488 [1,1,0,0,0,0|2,0,0]=4 341 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SY011391 [1,1,0,0,0,0|2,0,0]=4 342 B11R1.509 NS(=O)(=O)CC1=CC=CC=C1 SY048725 [1,1,0,0,0,0|1,0,1]=4 343 B11R1.509 O=S(=O)(F)CC1=CC=CC=C1 SY038235 [1,1,0,0,0,0|1,0,1]=4 344 B11R1.7 COP(C)(=O)C1=CC=CC=C1 SY300619 [0,1,0,0,1,0|1,0,0]=3 345 B11R1.7 COS(=O)(=O)C1=CC=CN=C1 SY284287 [0,1,0,0,1,0|2,0,0]=4 346 B11R1.7 CO[Si](C)(C)C1=CC=CC=C1 SY043367 [0,1,0,0,1,0|1,1,0]=4 347 B11R1.7 O=S(=O)(O[Na])C1=CC=CC=C1 SY004063 [0,1,0,0,1,0|2,0,0]=4 348 B11R1.12 CO[C@H](CN)C1=CC=CC=C1 SY286579 [0,1,0,0,1,0|1,0,1]=4 349 B11R1.22 CC1=CC=C(C(=O)C=O)C=C1 SY283036 [0,1,0,0,1,0|2,0,0]=4 350 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 SY022605 [0,1,0,0,1,0|2,0,0]=4 351 B11R1.22 CC1=CC=C(C(=O)CO)C=C1 SY026844 [0,1,0,0,1,0|2,0,0]=4 352 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 SY048426 [0,1,0,0,1,0|2,0,0]=4 353 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 SY001608 [0,1,0,0,1,0|1,0,0]=3 354 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 SY049111 [0,1,0,0,1,0|1,0,0]=3 355 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 SY002144 [0,1,0,0,1,0|1,0,0]=3 356 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 SY003666 [0,1,0,0,1,0|1,0,0]=3 357 B11R1.22 CNC(=O)C1=CC=C(Br)C=C1 SY020021 [0,1,0,0,1,0|1,0,0]=3 358 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 SY005511 [0,1,0,0,1,0|1,0,0]=3 359 B11R1.22 CNC(=O)C1=CN=C(Cl)C=C1 SY107933 [0,1,0,0,1,0|2,0,0]=4 360 B11R1.22 CNC(=S)C1=CC=C(Br)C=C1 SY262030 [0,1,0,0,1,0|1,1,0]=4 361 B11R1.22 COC(=N)C1=CC=C(Br)C=C1 SY028781 [0,1,0,0,1,0|1,0,0]=3 362 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 SY001702 [0,1,0,0,1,0|0,0,0]=2 363 B11R1.22 COC(=O)C1=CC=C(Br)C=N1 SY009344 [0,1,0,0,1,0|1,0,0]=3 364 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 SY017140 [0,1,0,0,1,0|0,0,0]=2 365 B11R1.22 COC(=O)C1=CC=C(Cl)N=N1 SY007129 [0,1,0,0,1,0|2,0,0]=4 366 B11R1.22 COC(=O)C1=CC=C(F)N=C1 SY022281 [0,1,0,0,1,0|1,0,0]=3 367 B11R1.22 COC(=O)C1=CC=C(N)N=N1 SY006049 [0,1,0,0,1,0|2,0,0]=4 368 B11R1.22 COC(=O)C1=CC=C(O)C=C1 SY006626 [0,1,0,0,1,0|0,0,0]=2 369 B11R1.22 COC(=O)C1=CN=C(Br)C=C1 SY009097 [0,1,0,0,1,0|1,0,0]=3 370 B11R1.22 COC(=O)C1=CN=C(C)C=C1 SY002953 [0,1,0,0,1,0|1,0,0]=3 371 B11R1.22 COC(=O)C1=CN=C(Cl)C=C1 SY006706 [0,1,0,0,1,0|1,0,0]=3 372 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 SY019433 [0,1,0,0,1,0|2,0,0]=4 373 B11R1.22 COC(=O)C1=CN=C(I)C=C1 SY026656 [0,1,0,0,1,0|1,0,0]=3 374 B11R1.22 COC(=O)C1=CN=C(N)C=C1 SY006453 [0,1,0,0,1,0|1,0,0]=3 375 B11R1.22 COC(=O)C1=CN=C(N)C=N1 SY006678 [0,1,0,0,1,0|2,0,0]=4 376 B11R1.22 COC(=O)C1=CN=C(N)N=C1 SY014367 [0,1,0,0,1,0|2,0,0]=4 377 B11R1.22 COC(=O)C1=CN=C(O)C=C1 SY032672 [0,1,0,0,1,0|1,0,0]=3 378 B11R1.22 COC(=O)C1=CN=C(O)N=C1 SY041468 [0,1,0,0,1,0|2,0,0]=4 379 B11R1.22 COC(=O)C1=COC(=O)C=C1 SY018974 [0,1,0,0,1,0|1,0,0]=3 380 B11R1.22 COC(=O)C1=NC=C(Br)C=N1 SY006806 [0,1,0,0,1,0|2,0,0]=4 381 B11R1.22 COC(=O)C1=NC=C(Br)N=C1 SY018538 [0,1,0,0,1,0|2,0,0]=4 382 B11R1.22 COC(=O)C1=NC=C(C)C=C1 SY046550 [0,1,0,0,1,0|1,0,0]=3 383 B11R1.22 COC(=O)C1=NC=C(C)C=N1 SY040125 [0,1,0,0,1,0|2,0,0]=4 384 B11R1.22 COC(=O)C1=NC=C(C)N=C1 SY024382 [0,1,0,0,1,0|2,0,0]=4 385 B11R1.22 COC(=O)C1=NC=C(Cl)C=C1 SY031483 [0,1,0,0,1,0|1,0,0]=3 386 B11R1.22 COC(=O)C1=NC=C(Cl)C=N1 SY124516 [0,1,0,0,1,0|2,0,0]=4 387 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 SY018612 [0,1,0,0,1,0|2,0,0]=4 388 B11R1.22 COC(=O)C1=NC=C(F)C=C1 SY096916 [0,1,0,0,1,0|1,0,0]=3 389 B11R1.22 COC(=O)C1=NC=C(F)C=N1 SY036635 [0,1,0,0,1,0|2,0,0]=4 390 B11R1.22 COC(=O)C1=NC=C(N)C=C1 SY031871 [0,1,0,0,1,0|1,0,0]=3 391 B11R1.22 COC(=O)C1=NC=C(N)N=C1 SY098745 [0,1,0,0,1,0|2,0,0]=4 392 B11R1.22 COC(=O)C1=NC=C(O)C=C1 SY021663 [0,1,0,0,1,0|1,0,0]=3 393 B11R1.22 COC(=O)C1=NC=C(O)C=N1 SY037102 [0,1,0,0,1,0|2,0,0]=4 394 B11R1.22 COC(=O)C1=NC=C(O)N=C1 SY031016 [0,1,0,0,1,0|2,0,0]=4 395 B11R1.22 COC(=O)C1=NN=C(Br)C=C1 SY043175 [0,1,0,0,1,0|2,0,0]=4 396 B11R1.22 COC(=O)C1=NN=C(C)C=C1 SY007132 [0,1,0,0,1,0|2,0,0]=4 397 B11R1.22 COC(=O)C1=NNC(=O)C=C1 SY008390 [0,1,0,0,1,0|2,0,0]=4 398 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 SY028321 [0,1,0,0,1,0|2,0,0]=4 399 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 SY039916 [0,1,0,0,1,0|2,0,0]=4 400 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 SY020165 [0,1,0,0,1,0|2,0,0]=4 401 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 SY001789 [0,1,0,0,1,0|2,0,0]=4 402 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 SY035573 [0,1,0,0,1,0|2,0,0]=4 403 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 SY007335 [0,1,0,0,1,0|2,0,0]=4 404 B11R1.22 NNC(=O)C1=CC=C(N)C=C1 SY036768 [0,1,0,0,1,0|2,0,0]=4 405 B11R1.22 NNC(=O)C1=CC=C(O)C=C1 SY009530 [0,1,0,0,1,0|2,0,0]=4 406 B11R1.22 O=C(CBr)C1=CC=C(I)C=C1 SY041321 [0,1,0,0,1,0|2,0,0]=4 407 B11R1.22 O=C(CCl)C1=CC=C(Br)C=C1 SY096724 [0,1,0,0,1,0|2,0,0]=4 408 B11R1.22 O=C(CO)C1=CC=C(Br)C=C1 SY130953 [0,1,0,0,1,0|2,0,0]=4 409 B11R1.22 O=C(CO)C1=CC=C(Cl)C=C1 SY130959 [0,1,0,0,1,0|2,0,0]=4 410 B11R1.22 O=C(CO)C1=CC=C(I)C=C1 SY130961 [0,1,0,0,1,0|2,0,0]=4 411 B11R1.23 CC1=CC(C(=O)CO)=CC=C1 SY130975 [0,1,0,0,1,0|2,0,0]=4 412 B11R1.23 CCC(=O)C1=CC(Br)=NC=C1 SY301439 [0,1,0,0,1,0|2,0,0]=4 413 B11R1.23 CCC(=O)C1=CC=CC(C)=C1 SY004012 [0,1,0,0,1,0|1,0,0]=3 414 B11R1.23 CCC(=O)C1=CC=CC(Cl)=C1 SY018227 [0,1,0,0,1,0|1,0,0]=3 415 B11R1.23 CCC(=O)C1=CC=CC(F)=C1 SY016989 [0,1,0,0,1,0|1,0,0]=3 416 B11R1.23 CCC(=O)C1=CC=CC(O)=C1 SY047086 [0,1,0,0,1,0|1,0,0]=3 417 B11R1.23 CNC(=O)C1=CC(Cl)=CC=N1 SY007502 [0,1,0,0,1,0|2,0,0]=4 418 B11R1.23 CNC(=O)C1=CC=CC(N)=C1 SY051152 [0,1,0,0,1,0|1,0,0]=3 419 B11R1.23 COC(=N)C1=CC=CC(Br)=C1 SY028780 [0,1,0,0,1,0|1,0,0]=3 420 B11R1.23 COC(=O)C1=CC(=O)NC=C1 SY027263 [0,1,0,0,1,0|1,0,0]=3 421 B11R1.23 COC(=O)C1=CC(N)=CN=C1 SY013226 [0,1,0,0,1,0|1,0,0]=3 422 B11R1.23 COC(=O)C1=CC(N)=NC=C1 SY003259 [0,1,0,0,1,0|1,0,0]=3 423 B11R1.23 COC(=O)C1=CC(O)=CN=C1 SY003383 [0,1,0,0,1,0|1,0,0]=3 424 B11R1.23 COC(=O)C1=CC(O)=NC=N1 SY016732 [0,1,0,0,1,0|2,0,0]=4 425 B11R1.23 COC(=O)C1=CC=CC(=O)N1 SY043112 [0,1,0,0,1,0|1,0,0]=3 426 B11R1.23 COC(=O)C1=CC=CC(Br)=C1 SY002781 [0,1,0,0,1,0|0,0,0]=2 427 B11R1.23 COC(=O)C1=CC=CC(Cl)=C1 SY033868 [0,1,0,0,1,0|0,0,0]=2 428 B11R1.23 COC(=O)C1=CC=CC(Cl)=N1 SY007550 [0,1,0,0,1,0|1,0,0]=3 429 B11R1.23 COC(=O)C1=CC=CC(N)=C1 SY031535 [0,1,0,0,1,0|0,0,0]=2 430 B11R1.23 COC(=O)C1=CC=CC(O)=C1 SY001617 [0,1,0,0,1,0|0,0,0]=2 431 B11R1.23 COC(=O)C1=CC=CC(S)=C1 SY124895 [0,1,0,0,1,0|0,0,0]=2 432 B11R1.23 COC(=O)C1=CC=NC(Br)=C1 SY016338 [0,1,0,0,1,0|1,0,0]=3 433 B11R1.23 COC(=O)C1=CC=NC(C)=C1 SY104461 [0,1,0,0,1,0|1,0,0]=3 434 B11R1.23 COC(=O)C1=CC=NC(Cl)=C1 SY016465 [0,1,0,0,1,0|1,0,0]=3 435 B11R1.23 COC(=O)C1=CC=NC(F)=C1 SY047621 [0,1,0,0,1,0|1,0,0]=3 436 B11R1.23 COC(=O)C1=CN=CC(Br)=C1 SY005317 [0,1,0,0,1,0|1,0,0]=3 437 B11R1.23 COC(=O)C1=CN=CC(C)=C1 SY004562 [0,1,0,0,1,0|1,0,0]=3 438 B11R1.23 COC(=O)C1=CN=CC(O)=C1 SY005899 [0,1,0,0,1,0|1,0,0]=3 439 B11R1.23 COC(=O)C1=C[N+](C)=CC=C1 SY281801 [0,1,0,0,1,0|1,0,0]=3 440 B11R1.23 COC(=O)C1=NC(Br)=CC=C1 SY009096 [0,1,0,0,1,0|1,0,0]=3 441 B11R1.23 COC(=O)C1=NC(Br)=CN=C1 SY011898 [0,1,0,0,1,0|2,0,0]=4 442 B11R1.23 COC(=O)C1=NC(Br)=NC=C1 SY242088 [0,1,0,0,1,0|2,0,0]=4 443 B11R1.23 COC(=O)C1=NC(C)=CC=C1 SY030535 [0,1,0,0,1,0|1,0,0]=3 444 B11R1.23 COC(=O)C1=NC(C)=CN=C1 SY023907 [0,1,0,0,1,0|2,0,0]=4 445 B11R1.23 COC(=O)C1=NC(Cl)=CN=C1 SY014086 [0,1,0,0,1,0|2,0,0]=4 446 B11R1.23 COC(=O)C1=NC(Cl)=NC=C1 SY019317 [0,1,0,0,1,0|2,0,0]=4 447 B11R1.23 COC(=O)C1=NC(N)=CC=C1 SY017264 [0,1,0,0,1,0|1,0,0]=3 448 B11R1.23 COC(=O)C1=NC(N)=CN=C1 SY017454 [0,1,0,0,1,0|2,0,0]=4 449 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 SY019236 [0,1,0,0,1,0|1,0,0]=3 450 B11R1.23 COC(=O)C1=NC=CC(C)=C1 SY284479 [0,1,0,0,1,0|1,0,0]=3 451 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 SY003263 [0,1,0,0,1,0|1,0,0]=3 452 B11R1.23 COC(=O)C1=NC=CC(F)=C1 SY240688 [0,1,0,0,1,0|1,0,0]=3 453 B11R1.23 COC(=O)C1=NC=CC(I)=C1 SY027672 [0,1,0,0,1,0|1,0,0]=3 454 B11R1.23 COC(=O)C1=NC=CC(N)=C1 SY026101 [0,1,0,0,1,0|1,0,0]=3 455 B11R1.23 COC(=O)C1=NC=CC(O)=C1 SY011047 [0,1,0,0,1,0|1,0,0]=3 456 B11R1.23 COC(=O)C1=NC=NC(Cl)=C1 SY015373 [0,1,0,0,1,0|2,0,0]=4 457 B11R1.23 NCC(=O)C1=CC(Br)=CC=C1 SY019239 [0,1,0,0,1,0|2,0,0]=4 458 B11R1.23 NNC(=O)C1=CC=CC(Br)=C1 SY040432 [0,1,0,0,1,0|2,0,0]=4 459 B11R1.23 NNC(=O)C1=CC=CC(F)=C1 SY078945 [0,1,0,0,1,0|2,0,0]=4 460 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 SY004172 [0,1,0,0,1,0|2,0,0]=4 461 B11R1.23 O=C(CBr)C1=CC=CC(Br)=C1 SY014721 [0,1,0,0,1,0|2,0,0]=4 462 B11R1.23 O=C(CBr)C1=CC=CC(F)=C1 SY031402 [0,1,0,0,1,0|2,0,0]=4 463 B11R1.23 O=C(CO)C1=CC=CC(Br)=C1 SY130965 [0,1,0,0,1,0|2,0,0]=4 464 B11R1.23 O=C(CO)C1=CC=CC(Cl)=C1 SY130969 [0,1,0,0,1,0|2,0,0]=4 465 B11R1.23 O=C(CO)C1=CC=CC(F)=C1 SY130967 [0,1,0,0,1,0|2,0,0]=4 466 B11R1.23 O=C(CO)C1=CC=CC(I)=C1 SY130987 [0,1,0,0,1,0|2,0,0]=4 467 B11R1.222 CC1=CC=CC=C1C(=O)CO SY130976 [0,1,0,0,1,0|2,0,0]=4 468 B11R1.222 CCC(=O)C1=C(O)C=CC=C1 SY015244 [0,1,0,0,1,0|1,0,0]=3 469 B11R1.222 CCC(=O)C1=CC=CC=C1Cl SY031881 [0,1,0,0,1,0|1,0,0]=3 470 B11R1.222 CCC(=O)C1=CC=CC=C1F SY003995 [0,1,0,0,1,0|1,0,0]=3 471 B11R1.222 CNC(=O)C1=CC=CC=C1Br SY025140 [0,1,0,0,1,0|1,0,0]=3 472 B11R1.222 CNC(=O)C1=CC=CC=C1N SY005082 [0,1,0,0,1,0|1,0,0]=3 473 B11R1.222 CNC(=O)C1=CC=CC=C1O SY034205 [0,1,0,0,1,0|1,0,0]=3 474 B11R1.222 COC(=N)C1=CC=CC=C1Br SY028779 [0,1,0,0,1,0|1,0,0]=3 475 B11R1.222 COC(=O)C1=C(Br)C=CC=N1 SY005700 [0,1,0,0,1,0|1,0,0]=3 476 B11R1.222 COC(=O)C1=C(Br)C=NC=C1 SY013223 [0,1,0,0,1,0|1,0,0]=3 477 B11R1.222 COC(=O)C1=C(C)C=CC=N1 SY005197 [0,1,0,0,1,0|1,0,0]=3 478 B11R1.222 COC(=O)C1=C(C)C=NC=C1 SY097021 [0,1,0,0,1,0|1,0,0]=3 479 B11R1.222 COC(=O)C1=C(C)C=NN=C1 SY098406 [0,1,0,0,1,0|2,0,0]=4 480 B11R1.222 COC(=O)C1=C(Cl)C=CC=C1 SY009666 [0,1,0,0,1,0|0,0,0]=2 481 B11R1.222 COC(=O)C1=C(Cl)C=NC=C1 SY043110 [0,1,0,0,1,0|1,0,0]=3 482 B11R1.222 COC(=O)C1=C(F)C=CC=C1 SY017085 [0,1,0,0,1,0|0,0,0]=2 483 B11R1.222 COC(=O)C1=C(N)C=CC=N1 SY005552 [0,1,0,0,1,0|1,0,0]=3 484 B11R1.222 COC(=O)C1=C(N)C=CN=C1 SY007632 [0,1,0,0,1,0|1,0,0]=3 485 B11R1.222 COC(=O)C1=C(N)C=NC=C1 SY007492 [0,1,0,0,1,0|1,0,0]=3 486 B11R1.222 COC(=O)C1=C(N)N=CC=C1 SY007227 [0,1,0,0,1,0|1,0,0]=3 487 B11R1.222 COC(=O)C1=C(N)N=CC=N1 SY005164 [0,1,0,0,1,0|2,0,0]=4 488 B11R1.222 COC(=O)C1=C(O)C=CC=C1 SY008800 [0,1,0,0,1,0|0,0,0]=2 489 B11R1.222 COC(=O)C1=C(O)C=NC=C1 SY005796 [0,1,0,0,1,0|1,0,0]=3 490 B11R1.222 COC(=O)C1=CC=CC=C1Br SY001469 [0,1,0,0,1,0|0,0,0]=2 491 B11R1.222 COC(=O)C1=CC=CC=C1I SY002220 [0,1,0,0,1,0|0,0,0]=2 492 B11R1.222 COC(=O)C1=CC=CN=C1C SY014898 [0,1,0,0,1,0|1,0,0]=3 493 B11R1.222 COC(=O)C1=CC=CN=C1Cl SY018350 [0,1,0,0,1,0|1,0,0]=3 494 B11R1.222 COC(=O)C1=CC=CN=C1F SY022292 [0,1,0,0,1,0|1,0,0]=3 495 B11R1.222 COC(=O)C1=CC=CN=C1N SY298758 [0,1,0,0,1,0|1,0,0]=3 496 B11R1.222 COC(=O)C1=CC=COC1=O SY035712 [0,1,0,0,1,0|1,0,0]=3 497 B11R1.222 COC(=O)C1=CC=NC=C1F SY035895 [0,1,0,0,1,0|1,0,0]=3 498 B11R1.222 COC(=O)C1=CC=NC=C1I SY097031 [0,1,0,0,1,0|1,0,0]=3 499 B11R1.222 COC(=O)C1=CC=NN=C1N SY011640 [0,1,0,0,1,0|2,0,0]=4 500 B11R1.222 COC(=O)C1=CN=CC=C1C SY030816 [0,1,0,0,1,0|1,0,0]=3 501 B11R1.222 COC(=O)C1=CN=CN=C1O SY018263 [0,1,0,0,1,0|2,0,0]=4 502 B11R1.222 COC(=O)C1=NC=CC=C1F SY014689 [0,1,0,0,1,0|1,0,0]=3 503 B11R1.222 COC(=O)C1=NC=CC=C1O SY028348 [0,1,0,0,1,0|1,0,0]=3 504 B11R1.222 COC(=O)C1=NC=CN=C1Br SY021286 [0,1,0,0,1,0|2,0,0]=4 505 B11R1.222 COC(=O)C1=NC=CN=C1C SY036007 [0,1,0,0,1,0|2,0,0]=4 506 B11R1.222 COC(=O)C1=NC=CN=C1Cl SY017459 [0,1,0,0,1,0|2,0,0]=4 507 B11R1.222 COC(=O)C1=NC=CN=C1I SY023923 [0,1,0,0,1,0|2,0,0]=4 508 B11R1.222 COC(=O)C1=NC=CN=C1O SY020956 [0,1,0,0,1,0|2,0,0]=4 509 B11R1.222 COC(=O)C1=NC=NC=C1N SY274674 [0,1,0,0,1,0|2,0,0]=4 510 B11R1.222 NNC(=O)C1=CC=CC=C1N SY040605 [0,1,0,0,1,0|2,0,0]=4 511 B11R1.222 O=C(CBr)C1=CC=CC=C1Br SY041192 [0,1,0,0,1,0|2,0,0]=4 512 B11R1.222 O=C(CBr)C1=CC=CC=C1Cl SY004173 [0,1,0,0,1,0|2,0,0]=4 513 B11R1.222 O=C(CBr)C1=CC=CC=C1F SY022607 [0,1,0,0,1,0|2,0,0]=4 514 B11R1.222 O=C(CO)C1=CC=CC=C1Br SY130966 [0,1,0,0,1,0|2,0,0]=4 515 B11R1.222 O=C(CO)C1=CC=CC=C1Cl SY032642 [0,1,0,0,1,0|2,0,0]=4 516 B11R1.222 O=C(CO)C1=CC=CC=C1F SY130968 [0,1,0,0,1,0|2,0,0]=4 517 B11R1.222 O=C(CO)C1=CC=CC=C1I SY130988 [0,1,0,0,1,0|2,0,0]=4 518 B11R1.222 O=C(NO)C1=CC=CC=C1O SY046520 [0,1,0,0,1,0|2,0,0]=4 519 B11R1.30 CCOC(=O)CC1=CSC=N1 SY023096 [0,1,0,0,1,0|2,0,0]=4 520 B11R1.30 CCOC(=O)CC1=NC=CS1 SY025747 [0,1,0,0,1,0|2,0,0]=4 521 B11R1.30 CCOC(=O)CC1=NNC=C1 SY030920 [0,1,0,0,1,0|2,0,0]=4 522 B11R1.30 CCOC(=O)CN1C=CC=N1 SY025207 [0,1,0,0,1,0|2,0,0]=4 523 B11R1.30 CCOC(=O)CN1C=CN=C1 SY005432 [0,1,0,0,1,0|2,0,0]=4 524 B11R1.30 CCOC(=O)NC1=CC=CS1 SY002881 [0,1,0,0,1,0|2,0,0]=4 525 B11R1.31 COC(=O)C(=O)C1=CC=CS1 SY126238 [0,1,0,0,1,0|1,0,1]=4 526 B11R1.31 COC(=O)C(C)C1=CC=CN1 SY299896 [0,1,0,0,1,0|1,0,0]=3 527 B11R1.31 COC(=O)C(C)C1=COC=C1 SY285802 [0,1,0,0,1,0|1,0,0]=3 528 B11R1.39 COC(=O)CC1=CN=C(C)O1 SY223929 [0,1,0,0,1,0|2,0,0]=4 529 B11R1.39 COC(=O)CC1=CN=C(N)S1 SY070099 [0,1,0,0,1,0|2,0,0]=4 530 B11R1.39 COC(=O)CC1=CSC(N)=N1 SY122159 [0,1,0,0,1,0|2,0,0]=4 531 B13R1.11 CNC(=O)CC(=O)C1=CC=CC=C1 SY027105 [0,1,0,0,0,1|1,0,0]=3 532 B13R1.11 COC(=O)CC(=O)C1=CC=CC=C1 SY033453 [0,1,0,0,0,1|0,0,0]=2 533 B13R1.11 COC(=O)CC(=O)C1=CC=NC=C1 SY005601 [0,1,0,0,0,1|1,0,0]=3 534 B13R1.11 COC(=O)CC(N)C1=CC=CN=C1 SY020335 [0,1,0,0,0,1|1,0,0]=3 535 B13R1.11 COC(=O)CN(C)C1=NC=CC=C1 SY021379 [0,1,0,0,0,1|1,0,0]=3 536 B13R1.14 COC(=O)CCC1=CC=C(Br)C=C1 SY013642 [0,1,0,0,0,1|0,0,0]=2 537 B13R1.14 COC(=O)CCC1=CC=C(I)C=C1 SY028002 [0,1,0,0,0,1|0,0,0]=2 538 B13R1.14 COC(=O)CCC1=CC=C(O)C=C1 SY003634 [0,1,0,0,0,1|0,0,0]=2 539 B13R1.14 COC(=O)COC1=CC=C(Cl)N=C1 SY026758 [0,1,0,0,0,1|1,0,0]=3 540 B13R1.14 COC(=O)COC1=CC=C(N)C=C1 SY102551 [0,1,0,0,0,1|0,0,0]=2 541 B13R1.14 COC(=O)COC1=NC=C(Br)C=C1 SY022407 [0,1,0,0,0,1|1,0,0]=3 542 B13R1.14 COC(=O)\C=C\C1=CC=C(Br)C=C1 SY012273 [0,1,0,0,0,1|0,0,1]=3 543 B13R1.15 COC(=O)CCC1=CC=CC(Br)=C1 SY110360 [0,1,0,0,0,1|0,0,0]=2 544 B13R1.15 COC(=O)CCC1=CC=CC(O)=C1 SY046258 [0,1,0,0,0,1|0,0,0]=2 545 B13R1.15 COC(=O)\C=C\C1=CC=CC(O)=C1 SY029355 [0,1,0,0,0,1|0,0,1]=3 546 B13R1.42 CCCC(=O)CCC1=CC=CC=C1 SY192902 [0,1,0,0,0,1|1,0,0]=3 547 B13R1.42 CCOC(=O)C#CC1=CC=CC=C1 SY010778 [0,1,0,0,0,1|0,0,1]=3 548 B13R1.42 CCOC(=O)C#CC1=CC=CN=C1 SY022416 [0,1,0,0,0,1|1,0,1]=4 549 B13R1.42 CCOC(=O)C#CC1=CC=NC=C1 SY022415 [0,1,0,0,0,1|1,0,1]=4 550 B13R1.42 CCOC(=O)C#CC1=NC=CC=C1 SY022417 [0,1,0,0,0,1|1,0,1]=4 551 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 SY013603 [0,1,0,0,0,1|0,0,0]=2 552 B13R1.42 CCOC(=O)CCC1=CC=CN=C1 SY022460 [0,1,0,0,0,1|1,0,0]=3 553 B13R1.42 CCOC(=O)CCC1=CC=NC=C1 SY022459 [0,1,0,0,0,1|1,0,0]=3 554 B13R1.42 CCOC(=O)CCC1=NC=CC=C1 SY022461 [0,1,0,0,0,1|1,0,0]=3 555 B13R1.42 CCOC(=O)CNC1=CC=CC=C1 SY049148 [0,1,0,0,0,1|0,0,0]=2 556 B13R1.42 CCOC(=O)COC1=CC=CC=C1 SY017862 [0,1,0,0,0,1|0,0,0]=2 557 B13R1.42 CCOC(=O)\C=C\C1=CC=CC=C1 SY005492 [0,1,0,0,0,1|0,0,1]=3 558 B13R1.42 CCOC(=O)\C=C\C1=CC=NC=C1 SY108025 [0,1,0,0,0,1|1,0,1]=4 559 B13R1.42 CCOC(=O)\C=C\C1=NC=CC=C1 SY125931 [0,1,0,0,0,1|1,0,1]=4 560 B13R1.42 O=C(CCF)OCC1=CC=CC=C1 SY017432 [0,1,0,0,0,1|1,0,0]=3 561 B13R1.42 O=C(CCO)OCC1=CC=CC=C1 SY017868 [0,1,0,0,0,1|1,0,0]=3 562 B13R1.42 [C-]#[N+]CC(=O)OCC1=CC=CC=C1 SY249703 [0,1,0,0,0,1|1,0,1]=4 563 B13R1.135 COC(=O)C(Cl)CC1=CC=CC=C1 SY035299 [0,1,0,0,0,1|0,0,0]=2 564 B13R1.135 COC(=O)C(N)CC1=CC=CC=C1 SY106384 [0,1,0,0,0,1|0,0,0]=2 565 B13R1.135 COC(=O)C(O)CC1=CC=CC=C1 SY112626 [0,1,0,0,0,1|0,0,0]=2 566 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 SY004788 [0,1,0,0,0,1|0,0,0]=2 567 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 SY033782 [0,1,0,0,0,1|0,0,0]=2 568 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 SY034266 [0,1,0,0,0,1|0,0,0]=2 569 B13R1.135 COC(=O)[C@H](O)CC1=CC=CC=C1 SY033769 [0,1,0,0,0,1|0,0,0]=2 570 B13R1.135 CON(C)C(=O)CC1=CC=CC=C1 SY201708 [0,1,0,0,0,1|2,0,0]=4 571 B13R1.351 C[C@H](N)C(=O)OCC1=CC=CC=C1 SY029626 [0,1,0,0,0,1|1,0,0]=3 572 B13R1.351 C[C@H](N)C(=O)OCC1=CC=CC=C1 SY030492 [0,1,0,0,0,1|1,0,0]=3 573 B13R1.351 C[C@H](O)C(=O)OCC1=CC=CC=C1 SY059510 [0,1,0,0,0,1|1,0,0]=3 574 B13R1.351 O=C(Cl)C(=O)OCC1=CC=CC=C1 SY292158 [0,1,0,0,0,1|2,0,0]=4 575 B13R1.528 COC(=O)CCC1=CC=CC=C1Br SY017608 [0,1,0,0,0,1|0,0,0]=2 576 B13R1.19 CCOC(=O)CC1=CC=C(Br)C=C1 SY002712 [0,2,0,0,0,0|0,0,0]=2 577 B13R1.19 CCOC(=O)CC1=CC=C(C)C=C1 SY043330 [0,2,0,0,0,0|0,0,0]=2 578 B13R1.19 CCOC(=O)CC1=CC=C(Cl)C=C1 SY030471 [0,2,0,0,0,0|0,0,0]=2 579 B13R1.19 CCOC(=O)CC1=CC=C(F)C=C1 SY021383 [0,2,0,0,0,0|0,0,0]=2 580 B13R1.19 CCOC(=O)CC1=CC=C(I)C=C1 SY041746 [0,2,0,0,0,0|0,0,0]=2 581 B13R1.19 CCOC(=O)CC1=CC=C(N)C=C1 SY020920 [0,2,0,0,0,0|0,0,0]=2 582 B13R1.19 CCOC(=O)CC1=CC=C(O)C=C1 SY015387 [0,2,0,0,0,0|0,0,0]=2 583 B13R1.19 CCOC(=O)CC1=CN=C(Cl)C=C1 SY059530 [0,2,0,0,0,0|1,0,0]=3 584 B13R1.19 CCOC(=O)CC1=NC=C(Br)C=C1 SY097190 [0,2,0,0,0,0|1,0,0]=3 585 B13R1.19 CCOC(=O)CC1=NC=C(Br)C=N1 SY009334 [0,2,0,0,0,0|2,0,0]=4 586 B13R1.19 CCOC(=O)CC1=NC=C(F)C=C1 SY258263 [0,2,0,0,0,0|1,0,0]=3 587 B13R1.19 CCOC(=O)CC1=NC=C(N)C=C1 SY043113 [0,2,0,0,0,0|1,0,0]=3 588 B13R1.19 CCOC(=O)CC1=NC=C(N)C=N1 SY024379 [0,2,0,0,0,0|2,0,0]=4 589 B13R1.19 CCOC(=O)NC1=CC=C(Cl)N=C1 SY039251 [0,2,0,0,0,0|2,0,0]=4 590 B13R1.20 CCOC(=O)CC1=CC(Br)=CC=C1 SY004525 [0,2,0,0,0,0|0,0,0]=2 591 B13R1.20 CCOC(=O)CC1=CC(Br)=CN=C1 SY238207 [0,2,0,0,0,0|1,0,0]=3 592 B13R1.20 CCOC(=O)CC1=CC(Cl)=NC=N1 SY253606 [0,2,0,0,0,0|2,0,0]=4 593 B13R1.20 CCOC(=O)CC1=NC(C)=CC=C1 SY108732 [0,2,0,0,0,0|1,0,0]=3 594 B13R1.20 CCOC(=O)CC1=NC=CC(Br)=C1 SY038447 [0,2,0,0,0,0|1,0,0]=3 595 B13R1.47 CCOC(=O)C(Br)C1=NC=CC=C1 SY279015 [0,2,0,0,0,0|1,0,0]=3 596 B13R1.47 CCOC(=O)C(N)C1=CC=CC=C1 SY211257 [0,2,0,0,0,0|0,0,0]=2 597 B13R1.47 CCOC(=O)C(N)C1=CC=CN=C1 SY284563 [0,2,0,0,0,0|1,0,0]=3 598 B13R1.47 CCOC(=O)C(N)C1=CC=NC=C1 SY007583 [0,2,0,0,0,0|1,0,0]=3 599 B13R1.47 CCOC(=O)C(N)C1=NC=CC=C1 SY007582 [0,2,0,0,0,0|1,0,0]=3 600 B13R1.47 CCOC(=O)[C@@H](O)C1=CC=CC=C1 SY017476 [0,2,0,0,0,0|0,0,0]=2 601 B13R1.47 CCOC(=O)[C@H](N)C1=CC=CC=C1 SY104927 [0,2,0,0,0,0|0,0,0]=2 602 B13R1.47 CCOC(=O)[C@H](O)C1=CC=CC=C1 SY017475 [0,2,0,0,0,0|0,0,0]=2 603 B13R1.470 CCOC(=O)CC1=CC=CC=C1C SY048389 [0,2,0,0,0,0|0,0,0]=2 604 B13R1.470 CCOC(=O)CC1=CC=CC=C1Cl SY108409 [0,2,0,0,0,0|0,0,0]=2 605 B13R1.470 CCOC(=O)CC1=CC=CN=C1Cl SY097610 [0,2,0,0,0,0|1,0,0]=3 606 B13R1.470 CCOC(=O)CC1=NC=CC=C1Br SY025618 [0,2,0,0,0,0|1,0,0]=3 607 B13R1.470 CCOC(=O)CC1=NC=CC=C1F SY267155 [0,2,0,0,0,0|1,0,0]=3 608 B13R1.470 CCOC(=O)CC1=NC=CN=C1Cl SY247691 [0,2,0,0,0,0|2,0,0]=4 609 B13R1.21 COC(=O)C(=O)C1=CC=C(Cl)C=C1 SY156486 [0,2,0,0,0,0|0,0,1]=3 610 B13R1.21 COC(=O)C(C)C1=CC=C(Br)C=C1 SY202075 [0,2,0,0,0,0|0,0,0]=2 611 B13R1.21 COC(=O)[C@@H](C)C1=CC=C(O)C=C1 SY232324 [0,2,0,0,0,0|0,0,0]=2 612 B13R1.21 COC(=O)[C@H](C)C1=CC=C(O)C=C1 SY233039 [0,2,0,0,0,0|0,0,0]=2 613 B13R1.21 COC(=O)[C@H](N)C1=CC=C(O)C=C1 SY021499 [0,2,0,0,0,0|0,0,0]=2 614 B13R1.532 COC(=O)C(CN)C1=CC=CC=C1 SY032343 [0,2,0,0,0,0|0,0,0]=2 615 B13R1.696 COC(=O)C(=O)C1=CC=CC=C1C SY235497 [0,2,0,0,0,0|0,0,1]=3 616 B13R1.696 COC(=O)C(Br)C1=CC=CC=C1Cl SY011604 [0,2,0,0,0,0|0,0,0]=2 617 B13R1.696 COC(=O)[C@@H](N)C1=CC=CC=C1Cl SY015015 [0,2,0,0,0,0|0,0,0]=2 618 B13R1.696 COC(=O)[C@@H](N)C1=CC=CC=C1Cl SY046910 [0,2,0,0,0,0|0,0,0]=2 619 B13R1.696 COC(=O)[C@@H](O)C1=CC=CC=C1Cl SY056507 [0,2,0,0,0,0|0,0,0]=2 620 B13R1.696 COC(=O)[C@H](O)C1=CC=CC=C1Cl SY061035 [0,2,0,0,0,0|0,0,0]=2 621 B13R1.708 COC(=O)C(C)(C)C1=CC=CC=C1 SY002717 [0,2,0,0,0,0|0,0,0]=2 622 B13R1.708 COC(=O)C(C)(N)C1=CC=CC=C1 SY036953 [0,2,0,0,0,0|0,0,0]=2 623 B13R1.708 COC(=O)C(C)(N)C1=CC=CC=C1 SY039079 [0,2,0,0,0,0|0,0,0]=2 624 B13R1.133 O=C(O)C(=O)CC1=CC=C(F)C=C1 SY235376 [0,2,0,0,0,0|2,0,0]=4 625 B13R1.202 CC1=CC=CC=C1NC(=O)C(C)Cl SY131962 [0,2,0,0,0,0|2,0,0]=4 626 B13R1.5 C=CC1=CC=C(CC(=O)OC)C=C1 SY033553 [0,2,0,0,0,0|0,0,0]=2 627 B13R1.5 COC(=O)CC1=CC=C(C#N)C=C1 SY110721 [0,2,0,0,0,0|0,0,0]=2 628 B13R1.5 COC(=O)CC1=CC=C(C=O)C=C1 SY113262 [0,2,0,0,0,0|0,0,0]=2 629 B13R1.5 COC(=O)CC1=CC=C(CBr)C=C1 SY059274 [0,2,0,0,0,0|0,0,0]=2 630 B13R1.5 COC(=O)CC1=CC=C(OC)C=C1 SY048791 [0,2,0,0,0,0|0,0,0]=2 631 B13R1.2679 COC(=O)CC1=CC=C(Br)C=C1F SY018077 [0,2,0,0,0,0|0,0,0]=2 632 B13R1.2679 COC(=O)CC1=CC=C(Cl)C=C1Br SY045730 [0,2,0,0,0,0|0,0,0]=2 633 B13R1.2679 COC(=O)CC1=CC=C(O)C=C1F SY121288 [0,2,0,0,0,0|0,0,0]=2 634 B13R1.2679 COC(=O)CC1=CC=C(O)C=C1O SY024356 [0,2,0,0,0,0|0,0,0]=2 635 B13R1.2679 COC(=O)OC1=CC=C(F)C=C1C SY036013 [0,2,0,0,0,0|1,0,0]=3 636 B13R1.2679 O=C(CCl)CC1=CC=C(Br)C=C1F SY287986 [0,2,0,0,0,0|2,0,0]=4 637 B13R1.2879 COC(=O)CC1=CC=C(Cl)C(N)=C1 SY109988 [0,2,0,0,0,0|0,0,0]=2 638 B13R1.2879 COC(=O)CC1=CC=C(N)C(F)=C1 SY297119 [0,2,0,0,0,0|0,0,0]=2 639 B13R1.2879 COC(=O)CC1=CC=C(N)C(O)=C1 SY260184 [0,2,0,0,0,0|0,0,0]=2 640 B13R1.2879 COC(=O)CC1=NC=C(C)C(Br)=C1 SY248662 [0,2,0,0,0,0|1,0,0]=3 641 B13R1.40 COC(=O)CC1=CC=CC(Br)=C1O SY273655 [0,2,0,0,0,0|0,0,0]=2 642 B13R1.40 COC(=O)CC1=CC=CC(Cl)=C1Cl SY003616 [0,2,0,0,0,0|0,0,0]=2 643 B13R1.81 COC(=O)CC1=CC=CC(OC)=C1 SY048964 [0,2,0,0,0,0|0,0,0]=2 644 B13R1.2872 COC(=O)CC1=CC(Br)=CC=C1F SY277968 [0,2,0,0,0,0|0,0,0]=2 645 B13R1.2872 COC(=O)CC1=CC(Br)=CC=C1O SY108718 [0,2,0,0,0,0|0,0,0]=2 646 B13R1.2872 COC(=O)CC1=CC(Cl)=CC=C1Cl SY203558 [0,2,0,0,0,0|0,0,0]=2 647 B13R1.2872 COC(=O)CC1=CC(F)=CC=C1C SY277643 [0,2,0,0,0,0|0,0,0]=2 648 B13R1.2872 O=C(CCl)CC1=CC(Br)=CC=C1F SY287985 [0,2,0,0,0,0|2,0,0]=4 649 B13R1.2874 COC(=O)CC1=CC(C)=CC(N)=C1 SY269060 [0,2,0,0,0,0|0,0,0]=2 650 B13R1.2874 COC(=O)CC1=NC(C)=CC(Br)=C1 SY281657 [0,2,0,0,0,0|1,0,0]=3 651 B13R1.3080 COP(=O)(CC1=CC=CC=C1)OC SY284594 [0,2,0,0,0,0|1,0,0]=3 652 B13R1.91 COC(=O)CC1=CC=CC=C1C#N SY287402 [0,2,0,0,0,0|0,0,0]=2 653 B13R1.91 COC(=O)CC1=CC=CC=C1C=O SY039719 [0,2,0,0,0,0|0,0,0]=2 654 B13R1.91 COC(=O)CC1=CC=CC=C1OC SY053750 [0,2,0,0,0,0|0,0,0]=2 655 B13R1.4928 COC(=O)CC1=C(Cl)N=CN=C1Cl SY056801 [0,2,0,0,0,0|2,0,0]=4 656 B11R1.25 COC(=O)CCC1=CC=CN1 SY047286 [0,0,1,1,0,0|1,0,1]=4 657 B11R2.1 C1=CC2=C(C=C1)C=CN2C SY246326 [1,0,0,1,0,0|1,0,1]=4 658 B11R2.1 C1=CC2=C(C=C1)N(C)C=C2 SY246277 [1,0,0,1,0,0|1,0,1]=4 659 B11R2.1 C1=CC2=C(C=CC=C2)N1C SY246324 [1,0,0,1,0,0|1,0,1]=4 660 B11R2.1 C1=CC=CC2=C1C=CN2C SY246325 [1,0,0,1,0,0|1,0,1]=4 661 B11R2.1 C1=CC=CC2=C1N(C)C=C2 SY246327 [1,0,0,1,0,0|1,0,1]=4 662 B11R2.1 CC1=COC2=CC=CC=C12 SY028461 [1,0,0,1,0,0|2,0,0]=4 663 B11R2.1 CN1C=NC2=CC=CC=C21 SY042696 [1,0,0,1,0,0|2,0,0]=4 664 B11R2.20 C1=CC2=C(C=C1)CCC=C2 SY050004 [1,0,0,1,0,0|1,0,1]=4 665 B11R2.20 C1=CC2=C(C=C1)CNCC2 SY001156 [1,0,0,1,0,0|1,0,1]=4 666 B11R2.20 C1=CC2=C(C=C1)CNNC2 SY022231 [1,0,0,1,0,0|2,0,0]=4 667 B11R2.20 C1=CC2=C(C=C1)COCC2 SY018228 [1,0,0,1,0,0|0,0,1]=3 668 B11R2.20 C1=CC2=C(C=C1)CSCC2 SY286030 [1,0,0,1,0,0|0,1,1]=4 669 B11R2.239 C1=CC=C(C2CNC2)C=C1 SY059527 [1,0,0,1,0,0|1,0,1]=4 670 B11R2.10 BrC1=CC2=C(C=CC=C2)C1 SY004720 [1,0,0,1,0,0|1,0,1]=4 671 B11R2.10 BrC1=CC2=CC=CC=C2O1 SY101367 [1,0,0,1,0,0|1,0,1]=4 672 B11R2.10 BrC1=NC2=CC=CC=C2O1 SY192184 [1,0,0,1,0,0|2,0,0]=4 673 B11R2.10 BrC1CC2=C(C=CC=C2)C1 SY185759 [1,0,0,1,0,0|1,0,1]=4 674 B11R2.10 CC1=CC2=C(C=CC=C2)C1 SY037985 [1,0,0,1,0,0|1,0,0]=3 675 B11R2.10 CC1=CC2=CC=CC=C2O1 SY039830 [1,0,0,1,0,0|0,0,2]=4 676 B11R2.10 CC1=NC2=CC=CC=C2N1 SY015991 [1,0,0,1,0,0|2,0,0]=4 677 B11R2.10 CC1=NC2=CC=CC=C2O1 SY048477 [1,0,0,1,0,0|1,0,1]=4 678 B11R2.10 CC1=NC2=CC=CC=C2S1 SY001190 [1,0,0,1,0,0|1,1,0]=4 679 B11R2.10 CC1CC2=C(C=CC=C2)N1 SY014921 [1,0,0,1,0,0|1,0,1]=4 680 B11R2.10 ClC1=CC2=CC=CC=C2O1 SY045676 [1,0,0,1,0,0|1,0,1]=4 681 B11R2.10 ClC1=NC2=C(C=CC=C2)O1 SY010741 [1,0,0,1,0,0|2,0,0]=4 682 B11R2.10 NC1=NC2=C(C=CC=C2)O1 SY010713 [1,0,0,1,0,0|2,0,0]=4 683 B11R2.10 O=C1CC2=C(C=CC=C2)C1 SY001481 [1,0,0,1,0,0|0,0,0]=2 684 B11R2.10 O=C1CC2=C(C=CC=C2)O1 SY038967 [1,0,0,1,0,0|0,0,0]=2 685 B11R2.10 O=C1CC2=CC=CC=C2N1 SY004718 [1,0,0,1,0,0|1,0,0]=3 686 B11R2.10 O=C1CC2=CC=CN=C2N1 SY008090 [1,0,0,1,0,0|2,0,0]=4 687 B11R2.10 O=C1NC2=C(C=CC=C2)O1 SY007021 [1,0,0,1,0,0|1,0,0]=3 688 B11R2.10 O=C1NC2=C(C=CN=C2)O1 SY130167 [1,0,0,1,0,0|2,0,0]=4 689 B11R2.10 O=C1NC2=CC=CN=C2O1 SY116296 [1,0,0,1,0,0|2,0,0]=4 690 B11R2.10 O=C1NC2=NC=CC=C2O1 SY007988 [1,0,0,1,0,0|2,0,0]=4 691 B11R2.10 OC1=NC2=CC=CC=C2N1 SY033248 [1,0,0,1,0,0|2,0,0]=4 692 B11R2.10 OC1=NC2=CC=CC=C2S1 SY003005 [1,0,0,1,0,0|1,1,0]=4 693 B11R2.10 OC1CC2=C(C=CC=C2)C1 SY033139 [1,0,0,1,0,0|0,0,2]=4 694 B11R2.10 SC1=NC2=CC=CC=C2O1 SY048415 [1,0,0,1,0,0|1,1,0]=4 695 B13R2.10 NC1=NC(C2=CC=CC=C2)CC1 SY262882 [0,0,0,1,0,1|2,0,0]=4 696 B13R2.10 O=C1CC(C2=CC=CC=C2)CN1 SY031841 [0,0,0,1,0,1|1,0,0]=3 697 B13R2.10 O=C1NC(C2=CC=CC=C2)CO1 SY037846 [0,0,0,1,0,1|0,0,0]=2 698 B13R2.10 O=C1NCC(C2=NC=CC=C2)N1 SY039518 [0,0,0,1,0,1|2,0,0]=4 699 B13R2.10 O=C1N[C@@H](C2=CC=CC=C2)CO1 SY013456 [0,0,0,1,0,1|0,0,0]=2 700 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CO1 SY020305 [0,0,0,1,0,1|0,0,0]=2 701 B13R2.33 O=C1CCC2=CC=CC=C2CC1 SY036148 [0,0,0,1,0,1|1,0,0]=3 702 B13R2.57 C1=C2C=CC=CC2=CC=C1OC SY246289 [0,0,0,1,0,1|1,0,1]=4 703 B13R2.57 C1=CC2=CC=C(OC)C=C2C=C1 SY246288 [0,0,0,1,0,1|1,0,1]=4 704 B13R2.57 COC1=CC2=CC=CC=C2N=C1 SY021113 [0,0,0,1,0,1|1,0,1]=4 705 B13R2.57 COC1=NC2=CC=CC=C2C=C1 SY034140 [0,0,0,1,0,1|1,0,1]=4 706 B13R2.15 O=C1CCCN1C2=CC=CC=C2 SY020012 [0,1,0,1,0,0|2,0,0]=4 707 B13R2.26 CCOC1=NC2=CC=CC=C2N1 SY244449 [0,1,0,1,0,0|2,0,0]=4 708 B13R2.163 O=C1CC2=CC=CC=C2C=CN1 SY018989 [0,1,0,1,0,0|1,0,1]=4 709 B13R2.163 O=C1CCCC2=CC=CC=C2N1 SY017407 [0,1,0,1,0,0|2,0,0]=4 710 B13R2.163 O=C1CCNC2=CC=CC=C2N1 SY079183 [0,1,0,1,0,0|2,0,0]=4 711 B13R2.45 O=CC1=C(Cl)C2=C(C=CC=C2)C1 SY264217 [0,1,0,1,0,0|2,0,0]=4 712 B13R2.3085 CN1C(=O)C(=O)C2=C1C=CC=C2 SY048456 [0,1,0,1,0,0|1,0,1]=4 713 B13R2.3085 CN1C(=O)C(=O)C2=C1C=CC=C2 SY293688 [0,1,0,1,0,0|1,0,1]=4 714 B13R2.3085 CN1C(=O)C(N)C2=C1C=CC=C2 SY059152 [0,1,0,1,0,0|1,0,0]=3 715 B13R2.3085 CN1C(=O)N(C)C2=CC=CC=C21 SY045942 [0,1,0,1,0,0|2,0,0]=4 716 B13R2.359 CC1(C)C(=O)CC2=C1C=CC=C2 SY266706 [0,1,0,1,0,0|1,0,0]=3 717 B13R2.359 CC1(C)C(=O)NC2=C1C=CC=C2 SY107503 [0,1,0,1,0,0|2,0,0]=4 718 B13R2.3028 CN1C(=O)CC2=C1C=C(N)C=C2 SY097175 [0,1,0,1,0,0|1,0,0]=3 719 B13R2.3028 CN1C(=O)NC2=CC=C(Br)C=C21 SY074812 [0,1,0,1,0,0|2,0,0]=4 720 B13R2.3028 CN1C(=O)NC2=CC=C(N)C=C21 SY292247 [0,1,0,1,0,0|2,0,0]=4 721 B13R2.3028 CN1C(=O)SC2=CC=C(N)C=C21 SY223503 [0,1,0,1,0,0|2,0,0]=4 722 B13R2.3683 CC1=CC2=C(C=C1)CC(=O)CC2 SY238121 [0,1,0,1,0,0|1,0,0]=3 723 B13R2.3683 CC1=CC=C2NC(=O)OCC2=C1 SY129172 [0,1,0,1,0,0|1,0,0]=3 724 B13R2.3683 NC1=CC=C2NC(=O)OCC2=C1 SY129160 [0,1,0,1,0,0|1,0,0]=3 725 B13R2.3683 O=C1CC2=C(C=C(O)C=C2)CN1 SY035160 [0,1,0,1,0,0|1,0,0]=3 726 B13R2.3683 O=C1CCC2=C(C=CC(=O)N2)C1 SY277863 [0,1,0,1,0,0|2,0,0]=4 727 B13R2.3683 O=C1CCC2=C(C=CC(Br)=C2)N1 SY004486 [0,1,0,1,0,0|2,0,0]=4 728 B13R2.3683 O=C1CCC2=C(C=CC(O)=C2)N1 SY002022 [0,1,0,1,0,0|2,0,0]=4 729 B13R2.3683 O=C1CCC2=CC(Br)=CC=C2C1 SY013008 [0,1,0,1,0,0|1,0,0]=3 730 B13R2.3683 O=C1CCC2=CC(Br)=CC=C2O1 SY108538 [0,1,0,1,0,0|2,0,0]=4 731 B13R2.3683 O=C1NC2=CC=C(Br)C=C2CO1 SY059722 [0,1,0,1,0,0|1,0,0]=3 732 B13R2.3683 O=C1NC2=CC=C(F)C=C2CO1 SY129151 [0,1,0,1,0,0|1,0,0]=3 733 B13R2.3683 O=C1NC2=CC=C(I)C=C2CO1 SY129171 [0,1,0,1,0,0|1,0,0]=3 734 B13R2.3683 O=C1NC2=NC=C(Br)C=C2CO1 SY060507 [0,1,0,1,0,0|2,0,0]=4 735 B13R2.54 COC1=NC2=C(Br)C=CC=C2N1 SY280317 [0,1,0,1,0,0|2,0,0]=4 736 B13R2.155 NC1=CC=C2COC(=O)NC2=C1 SY129167 [0,1,0,1,0,0|1,0,0]=3 737 B13R2.155 O=C1CC2=C(C=CC(Br)=C2)CN1 SY263246 [0,1,0,1,0,0|1,0,0]=3 738 B13R2.155 O=C1CCC2=C(C=C(Br)C=C2)N1 SY024896 [0,1,0,1,0,0|2,0,0]=4 739 B13R2.155 O=C1CCC2=C(C=C(Br)C=C2)O1 SY289389 [0,1,0,1,0,0|2,0,0]=4 740 B13R2.155 O=C1CCC2=C(C=C(F)C=C2)N1 SY016687 [0,1,0,1,0,0|2,0,0]=4 741 B13R2.155 O=C1CCC2=CC=C(O)C=C2N1 SY009657 [0,1,0,1,0,0|2,0,0]=4 742 B13R2.155 O=C1NC2=CC(Br)=CC=C2CO1 SY058763 [0,1,0,1,0,0|1,0,0]=3 743 B13R2.155 O=C1NC2=CC(Cl)=CC=C2CO1 SY129152 [0,1,0,1,0,0|1,0,0]=3 744 B13R2.155 O=C1NC2=CC(F)=CC=C2CO1 SY129162 [0,1,0,1,0,0|1,0,0]=3 745 B13R2.5179 CC1=C2COC(=O)NC2=CC=C1 SY100557 [0,1,0,1,0,0|1,0,0]=3 746 B13R2.5179 NC1=C2COC(=O)NC2=CC=C1 SY129177 [0,1,0,1,0,0|1,0,0]=3 747 B13R2.5179 O=C1CC2=C(CN1)C(Br)=CC=C2 SY263243 [0,1,0,1,0,0|1,0,0]=3 748 B13R2.5179 O=C1CCC2=C(C=CC=C2Br)N1 SY035130 [0,1,0,1,0,0|2,0,0]=4 749 B13R2.5179 O=C1CCC2=C(C=CC=C2O)N1 SY104338 [0,1,0,1,0,0|2,0,0]=4 750 B13R2.5179 O=C1NC2=CC=CC(Br)=C2CO1 SY129212 [0,1,0,1,0,0|1,0,0]=3 751 B13R2.5179 O=C1NC2=CC=CC(Cl)=C2CO1 SY129163 [0,1,0,1,0,0|1,0,0]=3 752 B13R2.5179 O=C1NC2=CC=CC(F)=C2CO1 SY129155 [0,1,0,1,0,0|1,0,0]=3 753 B13R2.5190 CN1C(=O)CC2=C1C=CC(N)=C2 SY006674 [0,1,0,1,0,0|1,0,0]=3 754 B13R2.5190 CN1C(=O)NC2=CC(N)=CC=C21 SY292248 [0,1,0,1,0,0|2,0,0]=4 755 B13R2.222 O=P1(Cl)OCC2=CC=CC=C2O1 SY290788 [0,1,0,1,0,0|2,0,0]=4 756 B13R2.162 CC1=C2NC(=O)OCC2=CC=C1 SY129182 [0,1,0,1,0,0|1,0,0]=3 757 B13R2.162 CC1=CC=CC2=C1NC(=O)CC2 SY021047 [0,1,0,1,0,0|2,0,0]=4 758 B13R2.162 NC1=C2NC(=O)OCC2=CC=C1 SY129157 [0,1,0,1,0,0|1,0,0]=3 759 B13R2.162 O=C1CCC2=C(C1)C(Br)=CC=C2 SY042920 [0,1,0,1,0,0|1,0,0]=3 760 B13R2.162 O=C1CCC2=C(C1)C(F)=CC=C2 SY267880 [0,1,0,1,0,0|1,0,0]=3 761 B13R2.162 O=C1NC2=C(Br)C=CC=C2CO1 SY129180 [0,1,0,1,0,0|1,0,0]=3 762 B13R2.162 O=C1NC2=C(Cl)C=CC=C2CO1 SY129207 [0,1,0,1,0,0|1,0,0]=3 763 B13R2.162 O=C1NC2=C(F)C=CC=C2CO1 SY129153 [0,1,0,1,0,0|1,0,0]=3 764 B13R2.4825 CN1C(=O)CC2=C(Br)C=CN=C21 SY263014 [0,1,0,1,0,0|2,0,0]=4 765 B13R2.4825 CN1C(=O)CC2=C1C=CC=C2N SY263286 [0,1,0,1,0,0|1,0,0]=3 766 B9R1.6 C1=CC=C(B(O)O)C=C1 SY257095 [1,0,0,0,1,0|1,0,1]=4 767 B9R1.6 C=C(Br)C1=CC=CC=C1 SY011143 [1,0,0,0,1,0|1,0,1]=4 768 B9R1.6 C=C(C)C1=NC=CC=C1 SY225338 [1,0,0,0,1,0|2,0,0]=4 769 B9R1.6 CC(=O)C1=CC=NC=C1 SY005519 [1,0,0,0,1,0|1,0,0]=3 770 B9R1.6 CC(=O)C1=CN=CC=N1 SY004986 [1,0,0,0,1,0|2,0,0]=4 771 B9R1.6 CC(=O)C1=CN=CN=C1 SY005489 [1,0,0,0,1,0|2,0,0]=4 772 B9R1.6 CC(=O)C1=NC=CC=N1 SY004966 [1,0,0,0,1,0|2,0,0]=4 773 B9R1.6 C[C@@H](O)C1=CC=CC=C1 SY007833 [1,0,0,0,1,0|0,0,2]=4 774 B9R1.6 N=C(N)C1=CC=CC=C1 SY018319 [1,0,0,0,1,0|2,0,0]=4 775 B9R1.6 N=C(N)C1=CC=CC=C1 SY035738 [1,0,0,0,1,0|2,0,0]=4 776 B9R1.6 NC(=O)C1=CC=CC=C1 SY047098 [1,0,0,0,1,0|1,0,0]=3 777 B9R1.6 NC(=O)C1=CC=NC=C1 SY018471 [1,0,0,0,1,0|2,0,0]=4 778 B9R1.6 NC(=O)C1=CN=CC=C1 SY024804 [1,0,0,0,1,0|2,0,0]=4 779 B9R1.6 NC(=O)C1=NC=CC=C1 SY048638 [1,0,0,0,1,0|2,0,0]=4 780 B9R1.6 O=C(O)C1=CC=CC=C1 SY009192 [1,0,0,0,1,0|0,0,0]=2 781 B9R1.6 O=C(O)C1=CC=CN=N1 SY013220 [1,0,0,0,1,0|2,0,0]=4 782 B9R1.6 O=C(O)C1=CC=NC=C1 SY002246 [1,0,0,0,1,0|1,0,0]=3 783 B9R1.6 O=C(O)C1=CC=NN=C1 SY004681 [1,0,0,0,1,0|2,0,0]=4 784 B9R1.6 O=C(O)C1=CN=CC=C1 SY011111 [1,0,0,0,1,0|1,0,0]=3 785 B9R1.6 O=C(O)C1=CN=CN=C1 SY004100 [1,0,0,0,1,0|2,0,0]=4 786 B9R1.6 O=C(O)C1=NC=CC=C1 SY001169 [1,0,0,0,1,0|1,0,0]=3 787 B9R1.6 O=C(O)C1=NC=CC=N1 SY004101 [1,0,0,0,1,0|2,0,0]=4 788 B9R1.6 O=C(O)C1=NC=CN=C1 SY001166 [1,0,0,0,1,0|2,0,0]=4 789 B9R1.6 O=C(O)C1=NC=NC=C1 SY005548 [1,0,0,0,1,0|2,0,0]=4 790 B9R1.6 O=C([O-])C1=CC=CC=C1 SY010134 [1,0,0,0,1,0|0,0,1]=3 791 B9R1.6 O=C([O-])C1=NC=CC=C1 SY037125 [1,0,0,0,1,0|1,0,1]=4 792 B9R1.6 OB(O)C1=CC=CC=C1 SY001599 [1,0,0,0,1,0|1,0,1]=4 793 B9R1.13 CC(=O)NC1=CSC=C1 SY002880 [1,0,0,0,1,0|2,0,0]=4 794 B9R1.13 O=C(O)CC1=CC=CN1 SY010732 [1,0,0,0,1,0|1,0,0]=3 795 B9R1.13 O=C(O)CC1=CC=NN1 SY045525 [1,0,0,0,1,0|2,0,0]=4 796 B9R1.13 O=C(O)CC1=CC=NO1 SY226123 [1,0,0,0,1,0|2,0,0]=4 797 B9R1.13 O=C(O)CC1=CN=CO1 SY129690 [1,0,0,0,1,0|2,0,0]=4 798 B9R1.13 O=C(O)CC1=CNC=N1 SY009288 [1,0,0,0,1,0|2,0,0]=4 799 B9R1.13 O=C(O)CC1=CSC=C1 SY001354 [1,0,0,0,1,0|1,0,0]=3 800 B9R1.13 O=C(O)CC1=CSC=N1 SY008170 [1,0,0,0,1,0|2,0,0]=4 801 B9R1.13 O=C(O)CC1=CSC=N1 SY023095 [1,0,0,0,1,0|2,0,0]=4 802 B9R1.13 O=C(O)CC1=NC=CS1 SY025481 [1,0,0,0,1,0|2,0,0]=4 803 B9R1.13 O=C(O)CC1=NNC=C1 SY274439 [1,0,0,0,1,0|2,0,0]=4 804 B9R1.13 O=C(O)CN1C=CC=N1 SY022023 [1,0,0,0,1,0|2,0,0]=4 805 B9R1.13 O=C(O)CN1C=CN=C1 SY003214 [1,0,0,0,1,0|2,0,0]=4 806 B9R1.11 CCC(=O)C1=CC=CS1 SY031388 [0,0,0,0,2,0|2,0,0]=4 807 B9R1.11 COC(=O)C1=CC=CN1 SY001201 [0,0,0,0,2,0|1,0,0]=3 808 B9R1.11 COC(=O)C1=CC=CS1 SY048432 [0,0,0,0,2,0|1,0,0]=3 809 B9R1.11 COC(=O)C1=CC=NO1 SY078826 [0,0,0,0,2,0|2,0,0]=4 810 B9R1.11 COC(=O)C1=CNC=C1 SY005883 [0,0,0,0,2,0|1,0,0]=3 811 B9R1.11 COC(=O)C1=CNC=N1 SY019856 [0,0,0,0,2,0|2,0,0]=4 812 B9R1.11 COC(=O)C1=CNN=C1 SY011914 [0,0,0,0,2,0|2,0,0]=4 813 B9R1.11 COC(=O)C1=CSC=C1 SY019965 [0,0,0,0,2,0|1,0,0]=3 814 B9R1.11 COC(=O)C1=CSC=N1 SY007519 [0,0,0,0,2,0|2,0,0]=4 815 B9R1.11 COC(=O)C1=NC=CN1 SY026818 [0,0,0,0,2,0|2,0,0]=4 816 B9R1.11 COC(=O)C1=NC=CS1 SY013211 [0,0,0,0,2,0|2,0,0]=4 817 B9R1.11 COC(=O)C1=NNC=C1 SY013591 [0,0,0,0,2,0|2,0,0]=4 818 B13R1.718 CCC(=O)OCCC1=CC=CC=C1 SY049056 [0,0,0,0,0,2|1,0,0]=3 819 B13R1.718 COC(=O)CCNC1=CC=CC=C1 SY028349 [0,0,0,0,0,2|0,0,0]=2 820 B13R1.718 COC(=O)CNCC1=CC=CC=C1 SY174443 [0,0,0,0,0,2|0,0,0]=2 821 B13R1.718 NNC(=O)COCC1=CC=CC=C1 SY185971 [0,0,0,0,0,2|2,0,0]=4