0 B9R1.15 BrCC1=NC=CC=C1Br SY223889 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.15 C#CC1=CC=CC=C1C SY253599 [0,0,0,0,0,0|2,0,2]=4 2 B9R1.15 C#CC1=CC=CN=C1N SY076789 [0,0,0,0,0,0|2,0,2]=4 3 B9R1.15 C(=O)C1=CC=CN=C1Cl SY005203 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.15 C(=O)C1=CC=CN=C1F SY014361 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.15 C(=O)C1=NC=CC=C1O SY019646 [0,0,0,0,0,0|3,0,1]=4 6 B9R1.15 CC1=C(C#N)C=CC=N1 SY041601 [0,0,0,0,0,0|2,0,1]=3 7 B9R1.15 CC1=C(C=O)N=CC=C1 SY008466 [0,0,0,0,0,0|2,0,1]=3 8 B9R1.15 CC1=C(CO)C=CC=C1 SY013626 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.15 CC1=C(NN)C=CC=C1 SY004795 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.15 CC1=CC=CC=C1C=O SY001303 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.15 CC1=CC=CC=C1ON SY282054 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.15 CC1=CC=CC=C1ON SY282055 [0,0,0,0,0,0|4,0,0]=4 13 B9R1.15 CC1=CC=NN=C1C=O SY279280 [0,0,0,0,0,0|3,0,1]=4 14 B9R1.15 CC1=NC=CC=C1C=O SY042068 [0,0,0,0,0,0|2,0,1]=3 15 B9R1.15 CC1=NC=CC=C1CN SY035172 [0,0,0,0,0,0|2,0,0]=2 16 B9R1.15 CC1=NC=CC=C1NN SY026023 [0,0,0,0,0,0|3,0,0]=3 17 B9R1.15 CCC1=C(Br)C=NC=C1 SY029943 [0,0,0,0,0,0|4,0,0]=4 18 B9R1.15 CCC1=CC=CC=C1O SY012952 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.15 CCC1=NC=CC=C1Br SY029944 [0,0,0,0,0,0|2,0,0]=2 20 B9R1.15 CCC1=NC=NC=C1Br SY271974 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.15 CCC1=NC=NC=C1F SY099089 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.15 CNC1=CC=CC=C1Br SY246165 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.15 CNC1=CC=CC=C1Cl SY048562 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.15 CNC1=CC=CC=C1F SY018442 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.15 CNC1=CC=CC=C1N SY045512 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.15 COC1=C(Br)C=NC=N1 SY007901 [0,0,0,0,0,0|4,0,0]=4 27 B9R1.15 COC1=C(I)C=CC=C1 SY017939 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.15 COC1=CC=CC=C1Cl SY026857 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.15 COC1=CC=CC=C1N SY277586 [0,0,0,0,0,0|4,0,0]=4 30 B9R1.15 COC1=CC=CC=C1O SY048708 [0,0,0,0,0,0|4,0,0]=4 31 B9R1.15 COC1=CC=CN=C1Br SY017484 [0,0,0,0,0,0|3,0,0]=3 32 B9R1.15 COC1=CC=CN=C1Cl SY005476 [0,0,0,0,0,0|3,0,0]=3 33 B9R1.15 COC1=CC=CN=C1F SY035894 [0,0,0,0,0,0|3,0,0]=3 34 B9R1.15 COC1=CC=CN=C1N SY023972 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.15 COC1=CC=CNC1=O SY009058 [0,0,0,0,0,0|3,0,1]=4 36 B9R1.15 COC1=CN=CN=C1Cl SY021535 [0,0,0,0,0,0|4,0,0]=4 37 B9R1.15 COC1=CN=CN=C1N SY037449 [0,0,0,0,0,0|4,0,0]=4 38 B9R1.15 COC1=NC=CC=C1Br SY007904 [0,0,0,0,0,0|3,0,0]=3 39 B9R1.15 COC1=NC=CC=C1Cl SY022136 [0,0,0,0,0,0|3,0,0]=3 40 B9R1.15 COC1=NC=CC=C1I SY022129 [0,0,0,0,0,0|3,0,0]=3 41 B9R1.15 COC1=NC=CC=C1N SY009589 [0,0,0,0,0,0|3,0,0]=3 42 B9R1.15 COC1=NC=CC=C1O SY068872 [0,0,0,0,0,0|3,0,0]=3 43 B9R1.15 COC1=NC=CN=C1Br SY114135 [0,0,0,0,0,0|2,0,0]=2 44 B9R1.15 COC1=NC=CN=C1N SY021285 [0,0,0,0,0,0|2,0,0]=2 45 B9R1.15 CSC1=C(O)C=CC=C1 SY008439 [0,0,0,0,0,0|4,0,0]=4 46 B9R1.15 CSC1=CC=CN=C1F SY102930 [0,0,0,0,0,0|3,0,0]=3 47 B9R1.15 CSC1=CC=CN=C1N SY213869 [0,0,0,0,0,0|3,0,0]=3 48 B9R1.15 CSC1=NC=CC=C1N SY283974 [0,0,0,0,0,0|3,0,0]=3 49 B9R1.15 CSC1=NC=CN=C1C SY015340 [0,0,0,0,0,0|1,0,0]=1 50 B9R1.15 CSC1=NC=CN=C1N SY281646 [0,0,0,0,0,0|2,0,0]=2 51 B9R1.15 ClCC1=NC=CC=C1Br SY014101 [0,0,0,0,0,0|3,0,0]=3 52 B9R1.15 ClCC1=NC=CC=C1Cl SY121216 [0,0,0,0,0,0|3,0,0]=3 53 B9R1.15 FC1=CC=CN=C1CCl SY013902 [0,0,0,0,0,0|3,0,0]=3 54 B9R1.15 FC1=CC=CN=C1CCl SY014099 [0,0,0,0,0,0|3,0,0]=3 55 B9R1.15 N#CC1=C(Cl)C=CC=N1 SY004407 [0,0,0,0,0,0|3,0,1]=4 56 B9R1.15 N#CC1=C(F)C=CC=N1 SY014411 [0,0,0,0,0,0|3,0,1]=4 57 B9R1.15 N#CC1=CC=CN=C1Br SY023829 [0,0,0,0,0,0|3,0,1]=4 58 B9R1.15 N#CC1=CC=CN=C1F SY016471 [0,0,0,0,0,0|3,0,1]=4 59 B9R1.15 N#CC1=CC=CN=C1N SY012208 [0,0,0,0,0,0|3,0,1]=4 60 B9R1.15 N#CC1=NC=CC=C1Br SY003790 [0,0,0,0,0,0|3,0,1]=4 61 B9R1.15 N#CC1=NC=CC=C1N SY012209 [0,0,0,0,0,0|3,0,1]=4 62 B9R1.15 N#CC1=NC=CC=C1O SY031451 [0,0,0,0,0,0|3,0,1]=4 63 B9R1.15 N#CC1=NC=CN=C1Cl SY018233 [0,0,0,0,0,0|2,0,1]=3 64 B9R1.15 N#CC1=NC=CN=C1N SY021363 [0,0,0,0,0,0|2,0,1]=3 65 B9R1.15 NC1=C(CO)C=CC=C1 SY006439 [0,0,0,0,0,0|4,0,0]=4 66 B9R1.15 NC1=C(CO)C=CC=N1 SY007311 [0,0,0,0,0,0|3,0,0]=3 67 B9R1.15 NC1=CC=CN=C1C=O SY258410 [0,0,0,0,0,0|3,0,1]=4 68 B9R1.15 NC1=CC=CN=C1CO SY025458 [0,0,0,0,0,0|3,0,0]=3 69 B9R1.15 NC1=CN=CN=C1CO SY274675 [0,0,0,0,0,0|4,0,0]=4 70 B9R1.15 NC1=NC=CC=C1C=O SY005392 [0,0,0,0,0,0|3,0,1]=4 71 B9R1.15 NCC1=CC=CC=C1I SY041411 [0,0,0,0,0,0|4,0,0]=4 72 B9R1.15 NCC1=CC=CC=C1O SY018673 [0,0,0,0,0,0|4,0,0]=4 73 B9R1.15 NCC1=CC=CN=C1F SY163261 [0,0,0,0,0,0|3,0,0]=3 74 B9R1.15 NCC1=NC=CC=C1F SY035457 [0,0,0,0,0,0|3,0,0]=3 75 B9R1.15 NCC1=NC=CC=C1F SY042134 [0,0,0,0,0,0|3,0,0]=3 76 B9R1.15 NCC1=NC=CC=C1F SY047766 [0,0,0,0,0,0|3,0,0]=3 77 B9R1.15 NCC1=NC=CC=C1N SY035169 [0,0,0,0,0,0|3,0,0]=3 78 B9R1.15 NCC1=NC=CN=C1Cl SY023946 [0,0,0,0,0,0|2,0,0]=2 79 B9R1.15 NCC1=NC=CN=C1Cl SY025231 [0,0,0,0,0,0|2,0,0]=2 80 B9R1.15 NCC1=NC=CN=C1N SY035077 [0,0,0,0,0,0|2,0,0]=2 81 B9R1.15 NNC1=CC=CN=C1Cl SY138833 [0,0,0,0,0,0|4,0,0]=4 82 B9R1.15 NNC1=NC=CC=C1Cl SY011483 [0,0,0,0,0,0|4,0,0]=4 83 B9R1.15 NNC1=NC=CN=C1Cl SY031007 [0,0,0,0,0,0|3,0,0]=3 84 B9R1.15 O=CC1=C(Cl)C=CC=N1 SY008181 [0,0,0,0,0,0|3,0,1]=4 85 B9R1.15 O=CC1=CC=CN=C1Br SY004096 [0,0,0,0,0,0|3,0,1]=4 86 B9R1.15 O=CC1=NC=CC=C1Br SY005024 [0,0,0,0,0,0|3,0,1]=4 87 B9R1.15 O=CC1=NC=CC=C1F SY022254 [0,0,0,0,0,0|3,0,1]=4 88 B9R1.15 O=CC1=NC=CN=C1Cl SY023956 [0,0,0,0,0,0|2,0,1]=3 89 B9R1.15 OCC1=C(Br)C=CC=C1 SY006444 [0,0,0,0,0,0|4,0,0]=4 90 B9R1.15 OCC1=C(Cl)C=CC=C1 SY003561 [0,0,0,0,0,0|4,0,0]=4 91 B9R1.15 OCC1=C(I)C=CC=C1 SY013872 [0,0,0,0,0,0|4,0,0]=4 92 B9R1.15 OCC1=C(O)C=CC=C1 SY012296 [0,0,0,0,0,0|4,0,0]=4 93 B9R1.15 OCC1=CC=CC=C1F SY032653 [0,0,0,0,0,0|4,0,0]=4 94 B9R1.15 OCC1=CC=CN=C1Br SY053416 [0,0,0,0,0,0|3,0,0]=3 95 B9R1.15 OCC1=CC=CN=C1Cl SY003338 [0,0,0,0,0,0|3,0,0]=3 96 B9R1.15 OCC1=CC=CN=C1F SY022325 [0,0,0,0,0,0|3,0,0]=3 97 B9R1.15 OCC1=NC=CC=C1Br SY014320 [0,0,0,0,0,0|3,0,0]=3 98 B9R1.15 OCC1=NC=CC=C1Cl SY102632 [0,0,0,0,0,0|3,0,0]=3 99 B9R1.15 OCC1=NC=CC=C1F SY037894 [0,0,0,0,0,0|3,0,0]=3 100 B9R1.15 OCC1=NC=CN=C1Cl SY023912 [0,0,0,0,0,0|2,0,0]=2 101 B9R1.15 OCC1=NC=NC=C1Br SY021908 [0,0,0,0,0,0|4,0,0]=4 102 B8R1.2 BrCC1=CC=CN=C1 SY002302 [1,0,0,0,0,0|2,0,0]=3 103 B8R1.2 BrCC1=NC=CN=C1 SY024662 [1,0,0,0,0,0|1,0,0]=2 104 B8R1.2 BrCC1=NC=NC=C1 SY048121 [1,0,0,0,0,0|3,0,0]=4 105 B8R1.2 BrCC1=NC=NC=C1 SY285072 [1,0,0,0,0,0|3,0,0]=4 106 B8R1.2 C#CC1=CC=CC=N1 SY019272 [1,0,0,0,0,0|1,0,2]=4 107 B8R1.2 CCC1=CCCC=C1 SY292098 [1,0,0,0,0,0|2,0,1]=4 108 B8R1.2 CC[N+]1=CC=CC=C1 SY073856 [1,0,0,0,0,0|3,0,0]=4 109 B8R1.2 CNC1=CC=CN=C1 SY019910 [1,0,0,0,0,0|2,0,0]=3 110 B8R1.2 CNC1=NC=CC=N1 SY109149 [1,0,0,0,0,0|3,0,0]=4 111 B8R1.2 COC1=CC=CN=C1 SY024150 [1,0,0,0,0,0|2,0,0]=3 112 B8R1.2 COC1=CN=CN=C1 SY034303 [1,0,0,0,0,0|3,0,0]=4 113 B8R1.2 COC1=NN=CC=C1 SY047082 [1,0,0,0,0,0|3,0,0]=4 114 B8R1.2 CSC1=NC=CC=C1 SY015557 [1,0,0,0,0,0|2,0,0]=3 115 B8R1.2 ClCC1=CN=CN=C1 SY035908 [1,0,0,0,0,0|3,0,0]=4 116 B8R1.2 ClCC1=NC=CC=N1 SY018344 [1,0,0,0,0,0|3,0,0]=4 117 B8R1.2 ClCC1=NC=CN=C1 SY024416 [1,0,0,0,0,0|1,0,0]=2 118 B8R1.2 ICC1=CC=CN=C1 SY027729 [1,0,0,0,0,0|2,0,0]=3 119 B8R1.2 NCC1=CC=CC=C1 SY020429 [1,0,0,0,0,0|3,0,0]=4 120 B8R1.2 NCC1=CN=CN=C1 SY104794 [1,0,0,0,0,0|3,0,0]=4 121 B8R1.2 NCC1=NC=CC=N1 SY019710 [1,0,0,0,0,0|3,0,0]=4 122 B8R1.2 NCC1=NC=CC=N1 SY019711 [1,0,0,0,0,0|3,0,0]=4 123 B8R1.2 NCC1=NC=CN=C1 SY006799 [1,0,0,0,0,0|1,0,0]=2 124 B8R1.2 NCC1=NC=CN=C1 SY020278 [1,0,0,0,0,0|1,0,0]=2 125 B8R1.2 NCC1=NC=NC=C1 SY041990 [1,0,0,0,0,0|3,0,0]=4 126 B8R1.2 NNC1=CC=CC=N1 SY013843 [1,0,0,0,0,0|3,0,0]=4 127 B8R1.2 NNC1=CC=CN=C1 SY018650 [1,0,0,0,0,0|3,0,0]=4 128 B8R1.2 NOC1=CC=CN=C1 SY282516 [1,0,0,0,0,0|3,0,0]=4 129 B8R1.2 NOC1=CC=CN=C1 SY282517 [1,0,0,0,0,0|3,0,0]=4 130 B8R1.2 O=CC1=NC=CN=C1 SY023908 [1,0,0,0,0,0|1,0,1]=3 131 B8R1.2 OCC1=CC=CC=N1 SY005684 [1,0,0,0,0,0|2,0,0]=3 132 B8R1.2 OCC1=CC=CN=C1 SY001086 [1,0,0,0,0,0|2,0,0]=3 133 B8R1.2 OCC1=CC=CN=N1 SY013184 [1,0,0,0,0,0|3,0,0]=4 134 B8R1.2 OCC1=CC=NN=C1 SY111189 [1,0,0,0,0,0|3,0,0]=4 135 B8R1.2 OCC1=CN=CN=C1 SY016520 [1,0,0,0,0,0|3,0,0]=4 136 B8R1.2 OCC1=NC=CC=N1 SY009461 [1,0,0,0,0,0|3,0,0]=4 137 B8R1.2 OCC1=NC=CN=C1 SY004183 [1,0,0,0,0,0|1,0,0]=2 138 B8R1.2 OCC1=NC=NC=C1 SY037570 [1,0,0,0,0,0|3,0,0]=4 139 B8R1.5 BrC1=CC=CN=C1Br SY012472 [1,0,0,0,0,0|3,0,0]=4 140 B8R1.5 BrC1=CC=CN=C1I SY022374 [1,0,0,0,0,0|3,0,0]=4 141 B8R1.5 CC1=C(N)C=NC=N1 SY007134 [1,0,0,0,0,0|3,0,0]=4 142 B8R1.5 CC1=C(N)N=CC=N1 SY004895 [1,0,0,0,0,0|1,0,0]=2 143 B8R1.5 CC1=C(O)C=CC=N1 SY007645 [1,0,0,0,0,0|2,0,0]=3 144 B8R1.5 CC1=CC=CN=C1Br SY008917 [1,0,0,0,0,0|2,0,0]=3 145 B8R1.5 CC1=CC=CN=C1Cl SY017766 [1,0,0,0,0,0|2,0,0]=3 146 B8R1.5 CC1=CC=CN=C1F SY016853 [1,0,0,0,0,0|2,0,0]=3 147 B8R1.5 CC1=CC=CNC1=O SY020532 [1,0,0,0,0,0|2,0,1]=4 148 B8R1.5 CC1=CC=NN=C1Cl SY096919 [1,0,0,0,0,0|3,0,0]=4 149 B8R1.5 CC1=CC=NN=C1N SY013686 [1,0,0,0,0,0|3,0,0]=4 150 B8R1.5 CC1=CN=CN=C1Cl SY021347 [1,0,0,0,0,0|3,0,0]=4 151 B8R1.5 CC1=NC=CC=C1Br SY004393 [1,0,0,0,0,0|2,0,0]=3 152 B8R1.5 CC1=NC=CC=C1Cl SY013090 [1,0,0,0,0,0|2,0,0]=3 153 B8R1.5 CC1=NC=CC=C1N SY003689 [1,0,0,0,0,0|2,0,0]=3 154 B8R1.5 CC1=NC=CN=C1Br SY023914 [1,0,0,0,0,0|1,0,0]=2 155 B8R1.5 CC1=NC=CN=C1Cl SY008899 [1,0,0,0,0,0|1,0,0]=2 156 B8R1.5 CC1=NC=CN=C1O SY005478 [1,0,0,0,0,0|1,0,0]=2 157 B8R1.5 CC1=NC=NC=C1Br SY031501 [1,0,0,0,0,0|3,0,0]=4 158 B8R1.5 ClC1=C(Br)C=CC=N1 SY004419 [1,0,0,0,0,0|3,0,0]=4 159 B8R1.5 ClC1=CC=CN=C1Br SY019780 [1,0,0,0,0,0|3,0,0]=4 160 B8R1.5 ClC1=NC=CC=C1I SY004388 [1,0,0,0,0,0|3,0,0]=4 161 B8R1.5 ClC1=NC=CN=C1Cl SY004668 [1,0,0,0,0,0|2,0,0]=3 162 B8R1.5 ClC1=NC=CN=C1I SY039432 [1,0,0,0,0,0|2,0,0]=3 163 B8R1.5 FC1=C(I)C=CC=N1 SY004135 [1,0,0,0,0,0|3,0,0]=4 164 B8R1.5 FC1=CC=CN=C1Br SY019785 [1,0,0,0,0,0|3,0,0]=4 165 B8R1.5 FC1=NC=CC=C1Br SY024684 [1,0,0,0,0,0|3,0,0]=4 166 B8R1.5 FC1=NC=CC=C1Cl SY024689 [1,0,0,0,0,0|3,0,0]=4 167 B8R1.5 NC1=C(Cl)N=CC=C1 SY005474 [1,0,0,0,0,0|3,0,0]=4 168 B8R1.5 NC1=C(Cl)N=CC=N1 SY003686 [1,0,0,0,0,0|2,0,0]=3 169 B8R1.5 NC1=C(N)N=CC=N1 SY020176 [1,0,0,0,0,0|2,0,0]=3 170 B8R1.5 NC1=CC=CN=C1Br SY013790 [1,0,0,0,0,0|3,0,0]=4 171 B8R1.5 NC1=CC=CN=C1F SY030938 [1,0,0,0,0,0|3,0,0]=4 172 B8R1.5 NC1=CC=CN=C1O SY008406 [1,0,0,0,0,0|3,0,0]=4 173 B8R1.5 NC1=NC=CC=C1Br SY006500 [1,0,0,0,0,0|3,0,0]=4 174 B8R1.5 NC1=NC=CC=C1Cl SY002650 [1,0,0,0,0,0|3,0,0]=4 175 B8R1.5 NC1=NC=CC=C1F SY002465 [1,0,0,0,0,0|3,0,0]=4 176 B8R1.5 NC1=NC=CC=C1I SY002851 [1,0,0,0,0,0|3,0,0]=4 177 B8R1.5 NC1=NC=CN=C1Br SY017457 [1,0,0,0,0,0|2,0,0]=3 178 B8R1.5 NC1=NC=CNC1=O SY021602 [1,0,0,0,0,0|2,0,1]=4 179 B8R1.5 OC1=C(Br)N=CC=C1 SY004806 [1,0,0,0,0,0|3,0,0]=4 180 B8R1.5 OC1=CC=CN=C1Cl SY001399 [1,0,0,0,0,0|3,0,0]=4 181 B8R1.5 OC1=CC=CN=C1F SY014301 [1,0,0,0,0,0|3,0,0]=4 182 B8R1.5 OC1=CC=CN=C1I SY015100 [1,0,0,0,0,0|3,0,0]=4 183 B8R1.5 OC1=CC=CN=C1O SY015232 [1,0,0,0,0,0|3,0,0]=4 184 B8R1.5 OC1=NC=CC=C1Br SY008491 [1,0,0,0,0,0|3,0,0]=4 185 B8R1.5 OC1=NC=CC=C1Cl SY007422 [1,0,0,0,0,0|3,0,0]=4 186 B8R1.5 OC1=NC=CC=C1F SY002356 [1,0,0,0,0,0|3,0,0]=4 187 B10R1.2 CC1=C(Br)C=CC=C1CO SY030258 [0,1,0,0,0,0|3,0,0]=4 188 B10R1.2 CC1=C(C)C(CN)=CC=C1 SY002793 [0,1,0,0,0,0|3,0,0]=4 189 B10R1.2 CC1=C(Cl)C=CN=C1CCl SY257891 [0,1,0,0,0,0|2,0,0]=3 190 B10R1.2 CCC1=C(F)C(Cl)=NC=N1 SY011522 [0,1,0,0,0,0|3,0,0]=4 191 B10R1.2 COC1=C(Br)C(O)=CC=N1 SY297867 [0,1,0,0,0,0|3,0,0]=4 192 B10R1.2 COC1=C(C)C(Br)=CC=C1 SY027570 [0,1,0,0,0,0|3,0,0]=4 193 B10R1.2 COC1=C(C)C(Cl)=CC=C1 SY049178 [0,1,0,0,0,0|3,0,0]=4 194 B10R1.2 COC1=C(C)C(N)=CC=C1 SY005759 [0,1,0,0,0,0|3,0,0]=4 195 B10R1.2 COC1=CC=CC(C)=C1C SY048935 [0,1,0,0,0,0|3,0,0]=4 196 B10R1.2 COC1=NC=CC(Cl)=C1Br SY029552 [0,1,0,0,0,0|3,0,0]=4 197 B10R1.2 COC1=NC=CC(Cl)=C1I SY271483 [0,1,0,0,0,0|3,0,0]=4 198 B10R1.2 COC1=NC=CC(I)=C1C SY282993 [0,1,0,0,0,0|2,0,0]=3 199 B10R1.2 COC1=NC=CC(I)=C1Cl SY245987 [0,1,0,0,0,0|3,0,0]=4 200 B10R1.2 COC1=NC=CC(N)=C1Br SY099797 [0,1,0,0,0,0|3,0,0]=4 201 B10R1.2 COC1=NC=CC(N)=C1C SY263714 [0,1,0,0,0,0|2,0,0]=3 202 B10R1.2 CSC1=C(C)C(Br)=CC=C1 SY129461 [0,1,0,0,0,0|3,0,0]=4 203 B10R1.2 NCC1=NC=CC(Cl)=C1F SY233399 [0,1,0,0,0,0|3,0,0]=4 204 B10R1.2 OCC1=NC=CC(Cl)=C1F SY233402 [0,1,0,0,0,0|3,0,0]=4 205 B10R1.4 CC1=CC=CC=C1CCO SY036944 [0,1,0,0,0,0|2,0,0]=3 206 B10R1.4 CC1=CC=CC=C1OCCl SY298330 [0,1,0,0,0,0|3,0,0]=4 207 B10R1.4 CCNC1=NC=CC=C1N SY184449 [0,1,0,0,0,0|2,0,0]=3 208 B10R1.4 CCOC1=C(Br)C=CC=C1 SY018463 [0,1,0,0,0,0|3,0,0]=4 209 B10R1.4 CCOC1=C(C)C=CN=C1 SY129406 [0,1,0,0,0,0|3,0,0]=4 210 B10R1.4 CCOC1=CC=CN=C1F SY035897 [0,1,0,0,0,0|2,0,0]=3 211 B10R1.4 CCOC1=CC=CNC1=O SY023905 [0,1,0,0,0,0|2,0,1]=4 212 B10R1.4 CCOC1=NC=CC=C1Br SY053418 [0,1,0,0,0,0|2,0,0]=3 213 B10R1.4 CCSC1=CC=CN=C1Br SY285813 [0,1,0,0,0,0|2,0,0]=3 214 B10R1.4 CCSC1=CC=CN=C1F SY285811 [0,1,0,0,0,0|2,0,0]=3 215 B10R1.4 CNCC1=C(Br)C=CC=C1 SY005450 [0,1,0,0,0,0|3,0,0]=4 216 B10R1.4 CNCC1=CC=CC=C1C SY021461 [0,1,0,0,0,0|2,0,0]=3 217 B10R1.4 CNCC1=CC=CC=C1Cl SY023323 [0,1,0,0,0,0|3,0,0]=4 218 B10R1.4 CNCC1=CC=CC=C1F SY005451 [0,1,0,0,0,0|3,0,0]=4 219 B10R1.4 CNCC1=CC=CN=C1C SY031590 [0,1,0,0,0,0|1,0,0]=2 220 B10R1.4 COCC1=CC=CC=C1O SY026429 [0,1,0,0,0,0|3,0,0]=4 221 B10R1.4 ClC1=C(CCBr)C=CC=C1 SY004845 [0,1,0,0,0,0|3,0,0]=4 222 B10R1.4 FC1=CC=CC=C1CCCl SY035952 [0,1,0,0,0,0|3,0,0]=4 223 B10R1.4 NCCC1=CC=CC=C1N SY104426 [0,1,0,0,0,0|3,0,0]=4 224 B10R1.4 NCCC1=CC=CC=C1O SY040467 [0,1,0,0,0,0|3,0,0]=4 225 B10R1.4 NOCC1=NC=CC=C1F SY281659 [0,1,0,0,0,0|3,0,0]=4 226 B10R1.4 NOCC1=NC=CC=C1F SY281660 [0,1,0,0,0,0|3,0,0]=4 227 B10R1.4 OCCC1=C(Br)C=CC=C1 SY011299 [0,1,0,0,0,0|3,0,0]=4 228 B10R1.4 OCCC1=C(Cl)C=CC=C1 SY005018 [0,1,0,0,0,0|3,0,0]=4 229 B10R1.4 OCCC1=CC=CC=C1F SY021828 [0,1,0,0,0,0|3,0,0]=4 230 B10R1.4 OCCC1=CC=CC=C1I SY096684 [0,1,0,0,0,0|3,0,0]=4 231 B10R1.4 OCCC1=CC=CC=C1O SY066615 [0,1,0,0,0,0|3,0,0]=4 232 B10R1.4 OCCC1=NC=CN=C1Cl SY247692 [0,1,0,0,0,0|1,0,0]=2 233 B10R1.20 CCC1=CC=CC=C1C=O SY066602 [0,1,0,0,0,0|2,0,1]=4 234 B10R1.20 CCC1=CC=CC=C1ON SY282222 [0,1,0,0,0,0|3,0,0]=4 235 B10R1.20 CCC1=CC=CC=C1ON SY282223 [0,1,0,0,0,0|3,0,0]=4 236 B10R1.20 CCC1=NC=CN=C1OC SY032230 [0,1,0,0,0,0|0,0,0]=1 237 B10R1.20 CNC1=NC=CC=C1CO SY030421 [0,1,0,0,0,0|2,0,0]=3 238 B10R1.20 COC1=C(C#N)C=CC=N1 SY039103 [0,1,0,0,0,0|2,0,1]=4 239 B10R1.20 COC1=C(CCl)C=CC=C1 SY018869 [0,1,0,0,0,0|3,0,0]=4 240 B10R1.20 COC1=C(CO)C=CC=C1 SY019123 [0,1,0,0,0,0|3,0,0]=4 241 B10R1.20 COC1=C(CO)C=CC=N1 SY039815 [0,1,0,0,0,0|2,0,0]=3 242 B10R1.20 COC1=CC=CC=C1OC SY001445 [0,1,0,0,0,0|3,0,0]=4 243 B10R1.20 COC1=CC=CN=C1C#N SY032382 [0,1,0,0,0,0|2,0,1]=4 244 B10R1.20 COC1=CC=CN=C1CCl SY245277 [0,1,0,0,0,0|2,0,0]=3 245 B10R1.20 COC1=CC=CN=C1CN SY032383 [0,1,0,0,0,0|2,0,0]=3 246 B10R1.20 COC1=CC=CN=C1OC SY038240 [0,1,0,0,0,0|2,0,0]=3 247 B10R1.20 COC1=NC=CC=C1C=O SY022300 [0,1,0,0,0,0|2,0,1]=4 248 B10R1.20 COC1=NC=CC=C1CN SY031860 [0,1,0,0,0,0|2,0,0]=3 249 B10R1.20 COC1=NC=CC=C1ON SY282518 [0,1,0,0,0,0|3,0,0]=4 250 B10R1.20 COC1=NC=CC=C1ON SY282519 [0,1,0,0,0,0|3,0,0]=4 251 B10R1.20 N#CC1=C(CCl)N=CC=C1 SY247868 [0,1,0,0,0,0|2,0,1]=4 252 B10R1.20 N#CC1=NC=CC=C1CBr SY096659 [0,1,0,0,0,0|2,0,1]=4 253 B10R1.20 NCC1=CC=CC=C1CO SY021933 [0,1,0,0,0,0|3,0,0]=4 254 B10R1.20 OCC1=CC=CC=C1CO SY026742 [0,1,0,0,0,0|3,0,0]=4 255 B10R1.25 CC1=C(C#N)C=CC(O)=N1 SY025598 [0,1,0,0,0,0|2,0,1]=4 256 B10R1.25 CC1=CC(Br)=CC=C1CBr SY035640 [0,1,0,0,0,0|3,0,0]=4 257 B10R1.25 CC1=CC(Br)=CC=C1CN SY040566 [0,1,0,0,0,0|3,0,0]=4 258 B10R1.25 CC1=CC(Br)=CN=C1C#N SY031479 [0,1,0,0,0,0|2,0,1]=4 259 B10R1.25 CC1=CC(Br)=CN=C1C=O SY067645 [0,1,0,0,0,0|2,0,1]=4 260 B10R1.25 CC1=CC(Cl)=CN=C1C#N SY031485 [0,1,0,0,0,0|2,0,1]=4 261 B10R1.25 CC1=CC(N)=CC=C1CO SY026487 [0,1,0,0,0,0|3,0,0]=4 262 B10R1.25 CC1=CC=C(CBr)C(C)=C1 SY107769 [0,1,0,0,0,0|3,0,0]=4 263 B10R1.25 CC1=CC=C(CO)C(C)=C1 SY049649 [0,1,0,0,0,0|3,0,0]=4 264 B10R1.25 CC1=NC(Cl)=CC=C1C=O SY123425 [0,1,0,0,0,0|2,0,1]=4 265 B10R1.25 CC1=NC(Cl)=CN=C1CCl SY250612 [0,1,0,0,0,0|1,0,0]=2 266 B10R1.25 CC1=NC(F)=CC=C1C#N SY007136 [0,1,0,0,0,0|2,0,1]=4 267 B10R1.25 CC1=NC(F)=CC=C1C=O SY065275 [0,1,0,0,0,0|2,0,1]=4 268 B10R1.25 CC1=NC(N)=CC=C1C#N SY003430 [0,1,0,0,0,0|2,0,1]=4 269 B10R1.25 CCC1=CC=C(N)C=C1Br SY241973 [0,1,0,0,0,0|3,0,0]=4 270 B10R1.25 CCC1=CC=C(O)C=C1O SY049095 [0,1,0,0,0,0|3,0,0]=4 271 B10R1.25 CCC1=CN=C(Cl)N=C1Cl SY037670 [0,1,0,0,0,0|3,0,0]=4 272 B10R1.25 CNC1=CC=C(Br)N=C1Br SY311933 [0,1,0,0,0,0|3,0,0]=4 273 B10R1.25 CNC1=NC=C(Br)C=C1N SY129401 [0,1,0,0,0,0|3,0,0]=4 274 B10R1.25 CNC1=NC=C(Cl)C=C1Cl SY144592 [0,1,0,0,0,0|3,0,0]=4 275 B10R1.25 COC1=C(C)C=C(Br)C=C1 SY018966 [0,1,0,0,0,0|3,0,0]=4 276 B10R1.25 COC1=C(C)C=C(N)C=N1 SY022268 [0,1,0,0,0,0|2,0,0]=3 277 B10R1.25 COC1=CC=C(Br)N=C1F SY068737 [0,1,0,0,0,0|3,0,0]=4 278 B10R1.25 COC1=CC=C(Br)N=C1N SY102751 [0,1,0,0,0,0|3,0,0]=4 279 B10R1.25 COC1=CC=C(F)C=C1C SY040560 [0,1,0,0,0,0|3,0,0]=4 280 B10R1.25 COC1=CC=C(I)N=C1Br SY041749 [0,1,0,0,0,0|3,0,0]=4 281 B10R1.25 COC1=CC=C(N)C=C1C SY045490 [0,1,0,0,0,0|3,0,0]=4 282 B10R1.25 COC1=CN=C(Cl)N=C1C SY108870 [0,1,0,0,0,0|3,0,0]=4 283 B10R1.25 COC1=NC=C(Br)C=C1C SY023988 [0,1,0,0,0,0|2,0,0]=3 284 B10R1.25 COC1=NC=C(Br)C=C1Cl SY030549 [0,1,0,0,0,0|3,0,0]=4 285 B10R1.25 COC1=NC=C(Br)C=C1F SY022296 [0,1,0,0,0,0|3,0,0]=4 286 B10R1.25 COC1=NC=C(Br)C=C1N SY022291 [0,1,0,0,0,0|3,0,0]=4 287 B10R1.25 COC1=NC=C(Cl)C=C1Br SY015477 [0,1,0,0,0,0|3,0,0]=4 288 B10R1.25 COC1=NC=C(F)C=C1Br SY022326 [0,1,0,0,0,0|3,0,0]=4 289 B10R1.25 COC1=NC=C(F)C=C1O SY045811 [0,1,0,0,0,0|3,0,0]=4 290 B10R1.25 COC1=NC=C(N)C=C1Br SY022514 [0,1,0,0,0,0|3,0,0]=4 291 B10R1.25 FC1=CC=C(CBr)C(F)=N1 SY265440 [0,1,0,0,0,0|3,0,0]=4 292 B10R1.25 FC1=CN=C(CBr)C(F)=C1 SY261225 [0,1,0,0,0,0|3,0,0]=4 293 B10R1.25 N#CC1=NC=C(Cl)N=C1Cl SY031593 [0,1,0,0,0,0|2,0,1]=4 294 B10R1.25 NCC1=NC=C(F)C=C1F SY035344 [0,1,0,0,0,0|3,0,0]=4 295 B10R1.25 O=CC1=NC=C(Cl)N=C1Cl SY265014 [0,1,0,0,0,0|2,0,1]=4 296 B10R1.25 OCC1=CC=C(Cl)N=C1Cl SY034368 [0,1,0,0,0,0|3,0,0]=4 297 B10R1.25 OCC1=NC=C(Br)C=C1F SY033947 [0,1,0,0,0,0|3,0,0]=4 298 B10R1.25 OCC1=NC=C(Cl)N=C1Cl SY265013 [0,1,0,0,0,0|2,0,0]=3 299 B10R1.25 OCC1=NC=C(F)C=C1F SY069982 [0,1,0,0,0,0|3,0,0]=4 300 B10R1.30 CC1=CC=C(Br)C(CO)=N1 SY264263 [0,1,0,0,0,0|3,0,0]=4 301 B10R1.30 CC1=CC=C(Br)C=C1CO SY153594 [0,1,0,0,0,0|3,0,0]=4 302 B10R1.30 CC1=CC=C(C)C(CN)=C1 SY010975 [0,1,0,0,0,0|3,0,0]=4 303 B10R1.30 CC1=CC=C(Cl)N=C1C#N SY114608 [0,1,0,0,0,0|2,0,1]=4 304 B10R1.30 CC1=CC=C(I)C=C1CO SY225927 [0,1,0,0,0,0|3,0,0]=4 305 B10R1.30 CC1=CC=C(O)C=C1CO SY026141 [0,1,0,0,0,0|3,0,0]=4 306 B10R1.30 CC1=NC=C(Br)C=C1CCl SY059775 [0,1,0,0,0,0|2,0,0]=3 307 B10R1.30 CC1=NC=C(Br)C=C1CN SY035464 [0,1,0,0,0,0|2,0,0]=3 308 B10R1.30 CC1=NC=C(Br)C=C1CO SY059774 [0,1,0,0,0,0|2,0,0]=3 309 B10R1.30 CCC1=CC(Br)=CC=C1I SY021073 [0,1,0,0,0,0|3,0,0]=4 310 B10R1.30 CCC1=CC(Br)=CN=C1Cl SY263628 [0,1,0,0,0,0|2,0,0]=3 311 B10R1.30 CCC1=CC(Br)=CN=C1F SY263627 [0,1,0,0,0,0|2,0,0]=3 312 B10R1.30 CCC1=CC(Cl)=CC=C1Br SY070323 [0,1,0,0,0,0|3,0,0]=4 313 B10R1.30 CCC1=CC(Cl)=NN=C1Cl SY034778 [0,1,0,0,0,0|3,0,0]=4 314 B10R1.30 CCC1=NC(C)=CC=C1O SY021192 [0,1,0,0,0,0|2,0,0]=3 315 B10R1.30 CCC1=NC(Cl)=NC=C1Br SY273207 [0,1,0,0,0,0|3,0,0]=4 316 B10R1.30 COC1=C(Br)C=CC(N)=N1 SY114734 [0,1,0,0,0,0|3,0,0]=4 317 B10R1.30 COC1=C(C)C=CC(O)=C1 SY224175 [0,1,0,0,0,0|3,0,0]=4 318 B10R1.30 COC1=C(Cl)N=CC(N)=C1 SY026735 [0,1,0,0,0,0|3,0,0]=4 319 B10R1.30 COC1=CC(Br)=CC=C1C SY041361 [0,1,0,0,0,0|3,0,0]=4 320 B10R1.30 COC1=CC(Br)=CN=C1Cl SY022257 [0,1,0,0,0,0|3,0,0]=4 321 B10R1.30 COC1=CC(Br)=CN=C1F SY035896 [0,1,0,0,0,0|3,0,0]=4 322 B10R1.30 COC1=CC(Br)=CN=C1N SY014679 [0,1,0,0,0,0|3,0,0]=4 323 B10R1.30 COC1=CC(C)=CN=C1Cl SY310347 [0,1,0,0,0,0|3,0,0]=4 324 B10R1.30 COC1=CC(F)=CN=C1Cl SY264842 [0,1,0,0,0,0|3,0,0]=4 325 B10R1.30 COC1=CC(N)=CC=C1C SY007315 [0,1,0,0,0,0|3,0,0]=4 326 B10R1.30 COC1=NC(Br)=CC=C1N SY065610 [0,1,0,0,0,0|3,0,0]=4 327 B10R1.30 COC1=NC(Br)=CC=C1O SY278164 [0,1,0,0,0,0|3,0,0]=4 328 B10R1.30 COC1=NC(Br)=CN=C1Cl SY058999 [0,1,0,0,0,0|2,0,0]=3 329 B10R1.30 COC1=NC(Br)=CN=C1I SY058998 [0,1,0,0,0,0|2,0,0]=3 330 B10R1.30 COC1=NC(Br)=CN=C1N SY018457 [0,1,0,0,0,0|2,0,0]=3 331 B10R1.30 COC1=NC(C)=CC=C1Br SY024903 [0,1,0,0,0,0|3,0,0]=4 332 B10R1.30 COC1=NC(C)=CC=C1N SY021479 [0,1,0,0,0,0|3,0,0]=4 333 B10R1.30 COC1=NC(Cl)=CC=C1Br SY015982 [0,1,0,0,0,0|3,0,0]=4 334 B10R1.30 FC1=CC=C(Br)C(CBr)=N1 SY247537 [0,1,0,0,0,0|3,0,0]=4 335 B10R1.30 N#CC1=NC(Br)=CN=C1N SY026823 [0,1,0,0,0,0|2,0,1]=4 336 B10R1.30 N#CC1=NC(Cl)=CN=C1Cl SY029032 [0,1,0,0,0,0|2,0,1]=4 337 B10R1.30 N#CC1=NC(F)=CN=C1F SY239763 [0,1,0,0,0,0|2,0,1]=4 338 B10R1.30 N#CC1=NC(F)=CN=C1O SY273803 [0,1,0,0,0,0|2,0,1]=4 339 B10R1.30 NC1=NC=C(Br)C=C1CBr SY293133 [0,1,0,0,0,0|3,0,0]=4 340 B10R1.30 NC1=NC=C(Br)C=C1CO SY007504 [0,1,0,0,0,0|3,0,0]=4 341 B10R1.30 NCC1=CC(Br)=CN=C1N SY129402 [0,1,0,0,0,0|3,0,0]=4 342 B10R1.30 OCC1=NC(Br)=CC=C1Br SY266278 [0,1,0,0,0,0|3,0,0]=4 343 B10R1.30 OCC1=NC(Cl)=CC=C1Br SY068007 [0,1,0,0,0,0|3,0,0]=4 344 B10R1.30 OCC1=NC(F)=CC=C1Br SY156787 [0,1,0,0,0,0|3,0,0]=4 345 B10R1.61 CC(=O)C1=C(C)C=CC=N1 SY005230 [0,1,0,0,0,0|1,0,1]=3 346 B10R1.61 CC(=O)C1=CC=CC=C1C SY002283 [0,1,0,0,0,0|2,0,1]=4 347 B10R1.61 CC(=O)C1=CC=CN=C1C SY108212 [0,1,0,0,0,0|1,0,1]=3 348 B10R1.61 CC(=O)C1=CC=CN=C1Cl SY007174 [0,1,0,0,0,0|2,0,1]=4 349 B10R1.61 CC(=O)C1=CC=CN=C1F SY064682 [0,1,0,0,0,0|2,0,1]=4 350 B10R1.61 CC(=O)C1=CC=CN=C1N SY040774 [0,1,0,0,0,0|2,0,1]=4 351 B10R1.61 CC(=O)C1=NC=CC=C1Br SY029920 [0,1,0,0,0,0|2,0,1]=4 352 B10R1.61 CC(=O)C1=NC=CC=C1F SY022346 [0,1,0,0,0,0|2,0,1]=4 353 B10R1.61 CC(=O)C1=NC=CC=C1N SY240339 [0,1,0,0,0,0|2,0,1]=4 354 B10R1.61 CC(=O)C1=NC=CN=C1C SY027476 [0,1,0,0,0,0|0,0,1]=2 355 B10R1.61 CC(C)C1=C(N)C=CC=C1 SY006015 [0,1,0,0,0,0|3,0,0]=4 356 B10R1.61 CC(C)C1=CC=CC=C1Br SY026917 [0,1,0,0,0,0|3,0,0]=4 357 B10R1.61 CC(C)C1=CC=CC=C1I SY048195 [0,1,0,0,0,0|3,0,0]=4 358 B10R1.61 CC(N)C1=CC=CC=C1Cl SY002632 [0,1,0,0,0,0|3,0,0]=4 359 B10R1.61 CC(N)C1=CC=CC=C1F SY002510 [0,1,0,0,0,0|3,0,0]=4 360 B10R1.61 CC(N)C1=CC=CC=C1F SY096571 [0,1,0,0,0,0|3,0,0]=4 361 B10R1.61 CC(N)C1=CC=CC=C1O SY026082 [0,1,0,0,0,0|3,0,0]=4 362 B10R1.61 CC(N)C1=CC=CN=C1F SY249601 [0,1,0,0,0,0|2,0,0]=3 363 B10R1.61 CC(O)C1=C(Br)C=CC=C1 SY005052 [0,1,0,0,0,0|3,0,0]=4 364 B10R1.61 CC(O)C1=C(Cl)C=CC=C1 SY005057 [0,1,0,0,0,0|3,0,0]=4 365 B10R1.61 CC(O)C1=C(F)C=CC=C1 SY005055 [0,1,0,0,0,0|3,0,0]=4 366 B10R1.61 CC(O)C1=C(N)C=CC=C1 SY005046 [0,1,0,0,0,0|3,0,0]=4 367 B10R1.61 CC(O)C1=NC=CN=C1Cl SY291852 [0,1,0,0,0,0|1,0,0]=2 368 B10R1.61 CC1=C(C(C)N)C=CC=C1 SY006058 [0,1,0,0,0,0|2,0,0]=3 369 B10R1.61 CC1=C(C(C)O)C=CC=C1 SY005056 [0,1,0,0,0,0|2,0,0]=3 370 B10R1.61 CC1=C([N+](=O)[O-])C=CC=N1 SY008045 [0,1,0,0,0,0|3,0,0]=4 371 B10R1.61 CC1=CC=CC=C1C(C)N SY002511 [0,1,0,0,0,0|2,0,0]=3 372 B10R1.61 CC1=CC=CC=C1C(F)F SY265643 [0,1,0,0,0,0|3,0,0]=4 373 B10R1.61 CC1=CC=CN=C1C(=O)O SY005196 [0,1,0,0,0,0|2,0,1]=4 374 B10R1.61 CC1=CC=CN=C1C(F)F SY265782 [0,1,0,0,0,0|2,0,0]=3 375 B10R1.61 CC1=NC=CC=C1B(O)O SY013012 [0,1,0,0,0,0|3,0,0]=4 376 B10R1.61 CC1=NC=CC=C1B(O)O SY110016 [0,1,0,0,0,0|3,0,0]=4 377 B10R1.61 CC1=NC=CC=C1C(=O)O SY007014 [0,1,0,0,0,0|2,0,1]=4 378 B10R1.61 CC1=NC=CC=C1C(C)N SY249588 [0,1,0,0,0,0|1,0,0]=2 379 B10R1.61 CC1=NC=CN=C1C(=O)O SY006147 [0,1,0,0,0,0|1,0,1]=3 380 B10R1.61 C[C@@H](O)C1=CC=CC=C1Br SY024770 [0,1,0,0,0,0|3,0,0]=4 381 B10R1.61 C[C@@H](O)C1=CC=CC=C1Cl SY024788 [0,1,0,0,0,0|3,0,0]=4 382 B10R1.61 C[C@@H](O)C1=CC=CC=C1F SY040023 [0,1,0,0,0,0|3,0,0]=4 383 B10R1.61 C[C@H](N)C1=CC=CC=C1F SY008657 [0,1,0,0,0,0|3,0,0]=4 384 B10R1.61 C[C@H](N)C1=CC=CC=C1F SY224243 [0,1,0,0,0,0|3,0,0]=4 385 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl SY024787 [0,1,0,0,0,0|3,0,0]=4 386 B10R1.61 C[C@H](O)C1=NC=CC=C1Br SY289336 [0,1,0,0,0,0|2,0,0]=3 387 B10R1.61 FC(F)C1=NC=CC=C1Cl SY265781 [0,1,0,0,0,0|3,0,0]=4 388 B10R1.61 FC1=CC=CN=C1C(F)F SY265894 [0,1,0,0,0,0|3,0,0]=4 389 B10R1.61 NC(=O)C1=NC=CN=C1Cl SY021613 [0,1,0,0,0,0|2,0,1]=4 390 B10R1.61 NC(=O)C1=NC=CN=C1O SY017450 [0,1,0,0,0,0|2,0,1]=4 391 B10R1.61 NC1=C(C(=O)O)N=CC=N1 SY005247 [0,1,0,0,0,0|2,0,1]=4 392 B10R1.61 O=C(O)C1=NC=CN=C1Br SY021901 [0,1,0,0,0,0|2,0,1]=4 393 B10R1.61 O=C(O)C1=NC=CN=C1Cl SY013464 [0,1,0,0,0,0|2,0,1]=4 394 B10R1.61 O=C(O)C1=NC=CN=C1I SY023922 [0,1,0,0,0,0|2,0,1]=4 395 B10R1.61 O=C(O)C1=NC=CN=C1O SY017462 [0,1,0,0,0,0|2,0,1]=4 396 B10R1.245 CC1=C(CO)C(N)=CC=C1 SY129178 [0,1,0,0,0,0|3,0,0]=4 397 B10R1.245 CC1=CC=CC(C)=C1CBr SY102337 [0,1,0,0,0,0|3,0,0]=4 398 B10R1.245 COC1=C(Br)C=CN=C1N SY285333 [0,1,0,0,0,0|3,0,0]=4 399 B10R1.245 COC1=C(C)C=CC=C1C SY048974 [0,1,0,0,0,0|3,0,0]=4 400 B10R1.245 COC1=C(C)NC=CC1=O SY097426 [0,1,0,0,0,0|2,0,1]=4 401 B10R1.245 COC1=C(N)C=CN=C1C SY092825 [0,1,0,0,0,0|2,0,0]=3 402 B10R1.245 COC1=C(N)C=CN=C1Cl SY275183 [0,1,0,0,0,0|3,0,0]=4 403 B10R1.245 OCC1=C(Cl)C=CN=C1Br SY253531 [0,1,0,0,0,0|3,0,0]=4 404 B10R1.245 OCC1=C(I)C=CN=C1F SY022286 [0,1,0,0,0,0|3,0,0]=4 405 B10R2.7 C1=CC2=C(C=C1)CNC2 SY006502 [0,0,0,1,0,0|3,0,0]=4 406 B10R2.7 C1=CC2=C(C=C1)NCC2 SY012760 [0,0,0,1,0,0|3,0,0]=4 407 B10R2.7 C1=CC2=C(C=C1)OCC2 SY003884 [0,0,0,1,0,0|3,0,0]=4 408 B10R2.7 C1=CC2=C(N=C1)NCC2 SY005307 [0,0,0,1,0,0|2,0,0]=3 409 B10R2.7 C1=CC=C2CNCC2=C1 SY006104 [0,0,0,1,0,0|3,0,0]=4 410 B10R2.7 C1=CC=C2CSCC2=C1 SY143431 [0,0,0,1,0,0|3,0,0]=4 411 B10R2.7 C1=CN=C2CCCC2=C1 SY005163 [0,0,0,1,0,0|1,0,0]=2 412 B10R2.7 C1=CN=C2CCNC2=C1 SY253170 [0,0,0,1,0,0|2,0,0]=3 413 B10R2.7 C1=CN=C2CCOC2=C1 SY285018 [0,0,0,1,0,0|2,0,0]=3 414 B10R2.7 C1=CN=C2CNCC2=C1 SY002978 [0,0,0,1,0,0|2,0,0]=3 415 B10R2.7 C1=CN=C2CNCC2=C1 SY005549 [0,0,0,1,0,0|2,0,0]=3 416 B10R2.7 C1=CN=C2CNCC2=N1 SY018653 [0,0,0,1,0,0|1,0,0]=2 417 B10R2.7 C1=CN=C2CNCC2=N1 SY031903 [0,0,0,1,0,0|1,0,0]=2 418 B10R2.7 C1=CN=C2NC=CC2=N1 SY023099 [0,0,0,1,0,0|1,0,2]=4 419 B10R2.7 C1=CN=C2NC=NC2=N1 SY025046 [0,0,0,1,0,0|2,0,1]=4 420 B10R2.7 C1=CN=C2OCOC2=C1 SY296678 [0,0,0,1,0,0|3,0,0]=4 421 B10R2.7 C1=NC=C2CNCC2=N1 SY006962 [0,0,0,1,0,0|3,0,0]=4 422 B10R2.7 C1=NC=C2CNCC2=N1 SY018652 [0,0,0,1,0,0|3,0,0]=4 423 B10R2.7 C1=NN=C2NCCC2=C1 SY294612 [0,0,0,1,0,0|3,0,0]=4 424 B8R1.11 BrCC1=C(Br)SC=C1 SY041583 [0,0,0,0,1,0|3,0,0]=4 425 B8R1.11 CC1=C(C#N)N=CN1 SY035699 [0,0,0,0,1,0|1,0,2]=4 426 B8R1.11 CC1=C(C=O)NC=C1 SY013401 [0,0,0,0,1,0|1,0,2]=4 427 B8R1.11 CC1=C(C=O)NC=N1 SY017270 [0,0,0,0,1,0|1,0,2]=4 428 B8R1.11 CC1=C(C=O)SC=N1 SY021358 [0,0,0,0,1,0|2,0,1]=4 429 B8R1.11 CC1=C(CCl)C=NO1 SY197419 [0,0,0,0,1,0|3,0,0]=4 430 B8R1.11 CC1=C(CCl)N=CO1 SY147182 [0,0,0,0,1,0|2,0,0]=3 431 B8R1.11 CC1=C(CCl)OC=N1 SY233036 [0,0,0,0,1,0|2,0,0]=3 432 B8R1.11 CC1=C(CN)C=NO1 SY035076 [0,0,0,0,1,0|3,0,0]=4 433 B8R1.11 CC1=C(CO)C=CO1 SY026412 [0,0,0,0,1,0|2,0,0]=3 434 B8R1.11 CC1=C(CO)N=CN1 SY017269 [0,0,0,0,1,0|1,0,1]=3 435 B8R1.11 CC1=C(CO)NC=N1 SY007668 [0,0,0,0,1,0|1,0,1]=3 436 B8R1.11 CC1=C(CO)ON=C1 SY226579 [0,0,0,0,1,0|3,0,0]=4 437 B8R1.11 CC1=NNC=C1C=O SY024565 [0,0,0,0,1,0|2,0,1]=4 438 B8R1.11 CC1=NON=C1C=O SY162027 [0,0,0,0,1,0|2,0,1]=4 439 B8R1.11 CC1=NON=C1CN SY109552 [0,0,0,0,1,0|2,0,0]=3 440 B8R1.11 CCC1=CN=CN1C SY268701 [0,0,0,0,1,0|3,0,0]=4 441 B8R1.11 CCC1=CNN=C1C SY263511 [0,0,0,0,1,0|1,0,0]=2 442 B8R1.11 CCC1=NNC=C1I SY247711 [0,0,0,0,1,0|2,0,0]=3 443 B8R1.11 CCN1N=CC=C1N SY042021 [0,0,0,0,1,0|2,0,0]=3 444 B8R1.11 CCN1N=NC=C1N SY262138 [0,0,0,0,1,0|3,0,0]=4 445 B8R1.11 CN1C=CN=C1C#N SY034553 [0,0,0,0,1,0|2,0,1]=4 446 B8R1.11 CN1C=CN=C1C=O SY001200 [0,0,0,0,1,0|2,0,1]=4 447 B8R1.11 CN1C=CN=C1CCl SY110045 [0,0,0,0,1,0|2,0,0]=3 448 B8R1.11 CN1C=CN=C1CN SY020883 [0,0,0,0,1,0|2,0,0]=3 449 B8R1.11 CN1C=CN=C1CO SY003332 [0,0,0,0,1,0|2,0,0]=3 450 B8R1.11 CN1C=NN=C1CO SY043008 [0,0,0,0,1,0|3,0,0]=4 451 B8R1.11 CN1N=CC=C1C=O SY017963 [0,0,0,0,1,0|2,0,1]=4 452 B8R1.11 CN1N=CC=C1CBr SY280197 [0,0,0,0,1,0|2,0,0]=3 453 B8R1.11 CN1N=CC=C1CCl SY024067 [0,0,0,0,1,0|2,0,0]=3 454 B8R1.11 CN1N=CC=C1CN SY023427 [0,0,0,0,1,0|2,0,0]=3 455 B8R1.11 CN1N=CC=C1CN SY035234 [0,0,0,0,1,0|2,0,0]=3 456 B8R1.11 CN1N=CC=C1CO SY024066 [0,0,0,0,1,0|2,0,0]=3 457 B8R1.11 CN1N=CN=C1CO SY139822 [0,0,0,0,1,0|2,0,0]=3 458 B8R1.11 CN1N=NN=C1CO SY224134 [0,0,0,0,1,0|3,0,0]=4 459 B8R1.11 NC1=C(CO)SC=C1 SY269223 [0,0,0,0,1,0|3,0,0]=4 460 B7R1.3 BrC1=CN=CN=N1 SY300036 [2,0,0,0,0,0|2,0,0]=4 461 B7R1.3 BrC1=NC=CN=C1 SY019862 [2,0,0,0,0,0|1,0,0]=3 462 B7R1.3 CC1=CC=NN=C1 SY046980 [2,0,0,0,0,0|2,0,0]=4 463 B7R1.3 CC1=NC=CC=N1 SY008219 [2,0,0,0,0,0|2,0,0]=4 464 B7R1.3 CC1=NC=NC=C1 SY009308 [2,0,0,0,0,0|2,0,0]=4 465 B7R1.3 CC1=NN=CC=C1 SY031534 [2,0,0,0,0,0|2,0,0]=4 466 B7R1.3 IC1=CC=CN=C1 SY007548 [2,0,0,0,0,0|2,0,0]=4 467 B7R1.3 IC1=CN=CC=N1 SY005099 [2,0,0,0,0,0|1,0,0]=3 468 B7R1.3 IC1=NC=CC=C1 SY013861 [2,0,0,0,0,0|2,0,0]=4 469 B7R1.3 NC1=NC=CN=C1 SY001512 [2,0,0,0,0,0|1,0,0]=3 470 B7R1.3 NC1=NC=CN=N1 SY011250 [2,0,0,0,0,0|2,0,0]=4 471 B7R1.3 OC1=CN=CC=N1 SY007023 [2,0,0,0,0,0|1,0,0]=3 472 B7R1.3 SC1=CC=CC=N1 SY009099 [2,0,0,0,0,0|2,0,0]=4 473 B9R1.1 BrCC1=NC=C(Br)C=C1 SY116614 [1,1,0,0,0,0|2,0,0]=4 474 B9R1.1 C#CC1=CN=C(Br)C=N1 SY251421 [1,1,0,0,0,0|0,0,2]=4 475 B9R1.1 C#CC1=CN=C(N)C=N1 SY075734 [1,1,0,0,0,0|0,0,2]=4 476 B9R1.1 CC1=CN=C(C#N)C=N1 SY022841 [1,1,0,0,0,0|1,0,1]=4 477 B9R1.1 CC1=CN=C(CBr)C=C1 SY253141 [1,1,0,0,0,0|2,0,0]=4 478 B9R1.1 CC1=CN=C(CN)C=C1 SY032973 [1,1,0,0,0,0|2,0,0]=4 479 B9R1.1 CC1=CN=C(CN)C=N1 SY299685 [1,1,0,0,0,0|1,0,0]=3 480 B9R1.1 CC1=CN=C(CO)C=C1 SY025498 [1,1,0,0,0,0|2,0,0]=4 481 B9R1.1 CC1=NC=C(CN)C=C1 SY034719 [1,1,0,0,0,0|2,0,0]=4 482 B9R1.1 CC1=NC=C(CO)C=C1 SY028280 [1,1,0,0,0,0|2,0,0]=4 483 B9R1.1 CCC1=CC=C(C)C=C1 SY035727 [1,1,0,0,0,0|2,0,0]=4 484 B9R1.1 CCC1=CC=C(I)C=C1 SY101013 [1,1,0,0,0,0|2,0,0]=4 485 B9R1.1 CCC1=CC=C(N)C=C1 SY012867 [1,1,0,0,0,0|2,0,0]=4 486 B9R1.1 CCC1=CN=C(Cl)N=C1 SY007766 [1,1,0,0,0,0|2,0,0]=4 487 B9R1.1 CCC1=CN=C(N)C=C1 SY025370 [1,1,0,0,0,0|1,0,0]=3 488 B9R1.1 CCC1=NC=C(Br)C=C1 SY096806 [1,1,0,0,0,0|1,0,0]=3 489 B9R1.1 CCC1=NNC(=O)C=C1 SY060323 [1,1,0,0,0,0|2,0,0]=4 490 B9R1.1 CNC1=NC=C(C)N=C1 SY028837 [1,1,0,0,0,0|1,0,0]=3 491 B9R1.1 COC1=CC=C(O)C=N1 SY022315 [1,1,0,0,0,0|2,0,0]=4 492 B9R1.1 COC1=CN=C(Br)C=C1 SY022318 [1,1,0,0,0,0|2,0,0]=4 493 B9R1.1 COC1=CN=C(Br)C=N1 SY021384 [1,1,0,0,0,0|1,0,0]=3 494 B9R1.1 COC1=CN=C(Cl)C=C1 SY038294 [1,1,0,0,0,0|2,0,0]=4 495 B9R1.1 COC1=CN=C(F)C=C1 SY068837 [1,1,0,0,0,0|2,0,0]=4 496 B9R1.1 COC1=CN=C(I)C=C1 SY038998 [1,1,0,0,0,0|2,0,0]=4 497 B9R1.1 COC1=CN=C(N)C=C1 SY005382 [1,1,0,0,0,0|2,0,0]=4 498 B9R1.1 COC1=CN=C(N)C=N1 SY017458 [1,1,0,0,0,0|1,0,0]=3 499 B9R1.1 COC1=NC=C(Br)C=C1 SY007569 [1,1,0,0,0,0|2,0,0]=4 500 B9R1.1 COC1=NC=C(C)C=C1 SY030140 [1,1,0,0,0,0|2,0,0]=4 501 B9R1.1 COC1=NC=C(F)C=C1 SY013020 [1,1,0,0,0,0|2,0,0]=4 502 B9R1.1 COC1=NC=C(I)C=C1 SY049516 [1,1,0,0,0,0|2,0,0]=4 503 B9R1.1 COC1=NC=C(N)C=C1 SY005187 [1,1,0,0,0,0|2,0,0]=4 504 B9R1.1 CSC1=CC=C(Br)C=N1 SY015731 [1,1,0,0,0,0|2,0,0]=4 505 B9R1.1 CSC1=CN=C(Br)C=N1 SY018833 [1,1,0,0,0,0|1,0,0]=3 506 B9R1.1 CSC1=CN=C(N)C=C1 SY014724 [1,1,0,0,0,0|2,0,0]=4 507 B9R1.1 ClC1=NC=C(CBr)C=C1 SY110170 [1,1,0,0,0,0|2,0,0]=4 508 B9R1.1 ClCC1=NC=C(Br)C=C1 SY060820 [1,1,0,0,0,0|2,0,0]=4 509 B9R1.1 FC1=NC=C(CCl)C=C1 SY097557 [1,1,0,0,0,0|2,0,0]=4 510 B9R1.1 N#CC1=CN=C(N)C=N1 SY002808 [1,1,0,0,0,0|1,0,1]=4 511 B9R1.1 N#CC1=NC=C(Br)N=C1 SY030677 [1,1,0,0,0,0|1,0,1]=4 512 B9R1.1 N#CC1=NC=C(Cl)N=C1 SY013569 [1,1,0,0,0,0|1,0,1]=4 513 B9R1.1 NC1=CC=C(CO)C=N1 SY041964 [1,1,0,0,0,0|2,0,0]=4 514 B9R1.1 NC1=CN=C(C=O)C=N1 SY263206 [1,1,0,0,0,0|1,0,1]=4 515 B9R1.1 NC1=CN=C(CO)C=C1 SY025459 [1,1,0,0,0,0|2,0,0]=4 516 B9R1.1 NCC1=CC=C(F)N=C1 SY099778 [1,1,0,0,0,0|2,0,0]=4 517 B9R1.1 NCC1=CC=C(N)C=N1 SY026755 [1,1,0,0,0,0|2,0,0]=4 518 B9R1.1 NCC1=CC=C(O)C=N1 SY067618 [1,1,0,0,0,0|2,0,0]=4 519 B9R1.1 NCC1=CN=C(Br)C=C1 SY031854 [1,1,0,0,0,0|2,0,0]=4 520 B9R1.1 NCC1=CN=C(Cl)C=C1 SY030632 [1,1,0,0,0,0|2,0,0]=4 521 B9R1.1 NCC1=CN=C(N)C=C1 SY035477 [1,1,0,0,0,0|2,0,0]=4 522 B9R1.1 NCC1=NC=C(Br)C=C1 SY009514 [1,1,0,0,0,0|2,0,0]=4 523 B9R1.1 NCC1=NC=C(Br)C=C1 SY025387 [1,1,0,0,0,0|2,0,0]=4 524 B9R1.1 NCC1=NC=C(Cl)C=C1 SY032976 [1,1,0,0,0,0|2,0,0]=4 525 B9R1.1 NCC1=NC=C(Cl)N=C1 SY069970 [1,1,0,0,0,0|1,0,0]=3 526 B9R1.1 NCC1=NC=C(F)C=C1 SY028018 [1,1,0,0,0,0|2,0,0]=4 527 B9R1.1 O=CC1=NC=C(Cl)N=C1 SY098538 [1,1,0,0,0,0|1,0,1]=4 528 B9R1.1 OCC1=CC=C(Br)N=C1 SY015051 [1,1,0,0,0,0|2,0,0]=4 529 B9R1.1 OCC1=CN=C(Cl)C=C1 SY003337 [1,1,0,0,0,0|2,0,0]=4 530 B9R1.1 OCC1=CN=C(F)C=C1 SY022294 [1,1,0,0,0,0|2,0,0]=4 531 B9R1.1 OCC1=NC=C(Br)C=C1 SY002137 [1,1,0,0,0,0|2,0,0]=4 532 B9R1.1 OCC1=NC=C(Cl)C=C1 SY029489 [1,1,0,0,0,0|2,0,0]=4 533 B9R1.1 OCC1=NC=C(Cl)N=C1 SY029707 [1,1,0,0,0,0|1,0,0]=3 534 B9R1.1 OCC1=NC=C(F)C=C1 SY097010 [1,1,0,0,0,0|2,0,0]=4 535 B9R1.2 BrCC1=CC=CC(Br)=N1 SY022087 [1,1,0,0,0,0|2,0,0]=4 536 B9R1.2 CC1=CC(CBr)=NC=C1 SY253139 [1,1,0,0,0,0|2,0,0]=4 537 B9R1.2 CC1=CC(CN)=NC=C1 SY032971 [1,1,0,0,0,0|2,0,0]=4 538 B9R1.2 CC1=CC=CC(CN)=N1 SY035072 [1,1,0,0,0,0|2,0,0]=4 539 B9R1.2 CC1=CN=CC(CCl)=C1 SY021371 [1,1,0,0,0,0|2,0,0]=4 540 B9R1.2 CC1=CN=CC(CN)=C1 SY035481 [1,1,0,0,0,0|2,0,0]=4 541 B9R1.2 CC1=NC(CO)=CC=C1 SY004267 [1,1,0,0,0,0|2,0,0]=4 542 B9R1.2 CCC1=CC(Br)=CC=C1 SY025138 [1,1,0,0,0,0|2,0,0]=4 543 B9R1.2 CCC1=CC(N)=CC=C1 SY002616 [1,1,0,0,0,0|2,0,0]=4 544 B9R1.2 CCC1=NC(C)=CC=C1 SY046027 [1,1,0,0,0,0|1,0,0]=3 545 B9R1.2 CCC1=NC(Cl)=NC=C1 SY021045 [1,1,0,0,0,0|2,0,0]=4 546 B9R1.2 CCC1=NC=CC(N)=C1 SY026184 [1,1,0,0,0,0|1,0,0]=3 547 B9R1.2 CNC1=CC(Br)=CN=C1 SY244240 [1,1,0,0,0,0|2,0,0]=4 548 B9R1.2 CNC1=NC(Br)=CC=C1 SY152462 [1,1,0,0,0,0|2,0,0]=4 549 B9R1.2 CNC1=NC(C)=CC=C1 SY187746 [1,1,0,0,0,0|2,0,0]=4 550 B9R1.2 CNC1=NC=CC(Br)=C1 SY037276 [1,1,0,0,0,0|2,0,0]=4 551 B9R1.2 COC1=CC=CC(Br)=N1 SY007898 [1,1,0,0,0,0|2,0,0]=4 552 B9R1.2 COC1=CC=CC(Cl)=N1 SY015984 [1,1,0,0,0,0|2,0,0]=4 553 B9R1.2 COC1=CC=CC(F)=N1 SY032408 [1,1,0,0,0,0|2,0,0]=4 554 B9R1.2 COC1=CC=CC(I)=N1 SY041538 [1,1,0,0,0,0|2,0,0]=4 555 B9R1.2 COC1=CN=CC(Br)=C1 SY005613 [1,1,0,0,0,0|2,0,0]=4 556 B9R1.2 COC1=CN=CC(Cl)=C1 SY239823 [1,1,0,0,0,0|2,0,0]=4 557 B9R1.2 COC1=CN=CC(Cl)=N1 SY031631 [1,1,0,0,0,0|1,0,0]=3 558 B9R1.2 COC1=CN=CC(N)=C1 SY003728 [1,1,0,0,0,0|2,0,0]=4 559 B9R1.2 COC1=CN=CC(O)=C1 SY004014 [1,1,0,0,0,0|2,0,0]=4 560 B9R1.2 COC1=NC(N)=CC=C1 SY003761 [1,1,0,0,0,0|2,0,0]=4 561 B9R1.2 COC1=NC(N)=CN=C1 SY010731 [1,1,0,0,0,0|1,0,0]=3 562 B9R1.2 COC1=NC=CC(Br)=C1 SY008980 [1,1,0,0,0,0|2,0,0]=4 563 B9R1.2 COC1=NC=CC(C)=C1 SY047060 [1,1,0,0,0,0|2,0,0]=4 564 B9R1.2 COC1=NC=CC(Cl)=C1 SY022137 [1,1,0,0,0,0|2,0,0]=4 565 B9R1.2 COC1=NC=CC(I)=C1 SY047228 [1,1,0,0,0,0|2,0,0]=4 566 B9R1.2 COC1=NC=CC(N)=C1 SY005153 [1,1,0,0,0,0|2,0,0]=4 567 B9R1.2 COC1=NC=CC(O)=C1 SY035360 [1,1,0,0,0,0|2,0,0]=4 568 B9R1.2 CSC1=NC(Br)=CN=N1 SY284789 [1,1,0,0,0,0|2,0,0]=4 569 B9R1.2 ClCC1=CC(Br)=CN=C1 SY019817 [1,1,0,0,0,0|2,0,0]=4 570 B9R1.2 ClCC1=CC=CC(Br)=N1 SY024882 [1,1,0,0,0,0|2,0,0]=4 571 B9R1.2 ClCC1=CN=CC(Br)=C1 SY021902 [1,1,0,0,0,0|2,0,0]=4 572 B9R1.2 ClCC1=CN=CC(Cl)=C1 SY039239 [1,1,0,0,0,0|2,0,0]=4 573 B9R1.2 ClCC1=NC=CC(Cl)=C1 SY111657 [1,1,0,0,0,0|2,0,0]=4 574 B9R1.2 FC1=CC(CBr)=NC=C1 SY253136 [1,1,0,0,0,0|2,0,0]=4 575 B9R1.2 FC1=CC(CBr)=NC=C1 SY253884 [1,1,0,0,0,0|2,0,0]=4 576 B9R1.2 FC1=CC(CBr)=NC=C1 SY254085 [1,1,0,0,0,0|2,0,0]=4 577 B9R1.2 FC1=NC(CBr)=CC=C1 SY046741 [1,1,0,0,0,0|2,0,0]=4 578 B9R1.2 N#CC1=NC(Br)=CN=C1 SY110942 [1,1,0,0,0,0|1,0,1]=4 579 B9R1.2 N#CC1=NC(Cl)=CN=C1 SY017451 [1,1,0,0,0,0|1,0,1]=4 580 B9R1.2 N#CC1=NC(F)=CN=C1 SY273802 [1,1,0,0,0,0|1,0,1]=4 581 B9R1.2 NC1=CC(CBr)=CN=C1 SY262017 [1,1,0,0,0,0|2,0,0]=4 582 B9R1.2 NC1=CC(CO)=NC=C1 SY026008 [1,1,0,0,0,0|2,0,0]=4 583 B9R1.2 NC1=CC=CC(CO)=N1 SY017265 [1,1,0,0,0,0|2,0,0]=4 584 B9R1.2 NC1=NC(CBr)=CC=C1 SY159857 [1,1,0,0,0,0|2,0,0]=4 585 B9R1.2 NCC1=CC(Br)=CN=C1 SY034714 [1,1,0,0,0,0|2,0,0]=4 586 B9R1.2 NCC1=CC(Cl)=CN=C1 SY024111 [1,1,0,0,0,0|2,0,0]=4 587 B9R1.2 NCC1=CC=CC(N)=N1 SY035074 [1,1,0,0,0,0|2,0,0]=4 588 B9R1.2 NCC1=CN=CC(F)=C1 SY023017 [1,1,0,0,0,0|2,0,0]=4 589 B9R1.2 NCC1=NC(F)=CC=C1 SY028019 [1,1,0,0,0,0|2,0,0]=4 590 B9R1.2 NCC1=NC=CC(Br)=C1 SY021750 [1,1,0,0,0,0|2,0,0]=4 591 B9R1.2 NCC1=NC=CC(Cl)=C1 SY031877 [1,1,0,0,0,0|2,0,0]=4 592 B9R1.2 NCC1=NC=CC(F)=C1 SY032986 [1,1,0,0,0,0|2,0,0]=4 593 B9R1.2 O=CC1=NC(F)=CN=C1 SY277878 [1,1,0,0,0,0|1,0,1]=4 594 B9R1.2 OCC1=CC(Br)=CN=C1 SY020890 [1,1,0,0,0,0|2,0,0]=4 595 B9R1.2 OCC1=CC=CC(Cl)=N1 SY007573 [1,1,0,0,0,0|2,0,0]=4 596 B9R1.2 OCC1=NC(Br)=CC=C1 SY009306 [1,1,0,0,0,0|2,0,0]=4 597 B9R1.2 OCC1=NC(Br)=CN=C1 SY118861 [1,1,0,0,0,0|1,0,0]=3 598 B9R1.2 OCC1=NC(Cl)=CC=C1 SY007659 [1,1,0,0,0,0|2,0,0]=4 599 B9R1.2 OCC1=NC(Cl)=CN=C1 SY023948 [1,1,0,0,0,0|1,0,0]=3 600 B9R1.2 OCC1=NC(F)=CC=C1 SY015411 [1,1,0,0,0,0|2,0,0]=4 601 B9R1.2 OCC1=NC=CC(Br)=C1 SY021911 [1,1,0,0,0,0|2,0,0]=4 602 B9R1.2 OCC1=NC=CC(Cl)=C1 SY003339 [1,1,0,0,0,0|2,0,0]=4 603 B9R1.6 C=C(C)C1=NC=CC=C1 SY225338 [1,1,0,0,0,0|1,0,1]=4 604 B9R1.6 CC(=O)C1=CN=CC=N1 SY004986 [1,1,0,0,0,0|0,0,1]=3 605 B9R1.6 CC(N)C1=CC=CN=C1 SY005518 [1,1,0,0,0,0|1,0,0]=3 606 B9R1.6 CC(N)C1=CC=NN=C1 SY245175 [1,1,0,0,0,0|2,0,0]=4 607 B9R1.6 CC(N)C1=NC=CC=C1 SY005425 [1,1,0,0,0,0|1,0,0]=3 608 B9R1.6 CC(N)C1=NC=CC=C1 SY023696 [1,1,0,0,0,0|1,0,0]=3 609 B9R1.6 CC(N)C1=NC=CC=N1 SY270479 [1,1,0,0,0,0|2,0,0]=4 610 B9R1.6 CC(N)C1=NC=CN=C1 SY107192 [1,1,0,0,0,0|0,0,0]=2 611 B9R1.6 CC(O)C1=CC=CN=C1 SY006085 [1,1,0,0,0,0|1,0,0]=3 612 B9R1.6 CC(O)C1=NC=CC=C1 SY004070 [1,1,0,0,0,0|1,0,0]=3 613 B9R1.6 C[C@@H](N)C1=CC=CN=C1 SY105422 [1,1,0,0,0,0|1,0,0]=3 614 B9R1.6 C[C@@H](N)C1=NC=CC=C1 SY016895 [1,1,0,0,0,0|1,0,0]=3 615 B9R1.6 C[C@@H](N)C1=NC=CC=N1 SY310791 [1,1,0,0,0,0|2,0,0]=4 616 B9R1.6 C[C@@H](O)C1=CC=CC=C1 SY007833 [1,1,0,0,0,0|2,0,0]=4 617 B9R1.6 C[C@@H](O)C1=CN=CC=C1 SY008212 [1,1,0,0,0,0|1,0,0]=3 618 B9R1.6 C[C@@H](O)C1=NC=CC=C1 SY009224 [1,1,0,0,0,0|1,0,0]=3 619 B9R1.6 C[C@H](N)C1=CC=CN=C1 SY033903 [1,1,0,0,0,0|1,0,0]=3 620 B9R1.6 C[C@H](N)C1=NC=CC=C1 SY010698 [1,1,0,0,0,0|1,0,0]=3 621 B9R1.6 C[C@H](O)C1=CN=CC=C1 SY008211 [1,1,0,0,0,0|1,0,0]=3 622 B9R1.6 FC(F)C1=NC=CN=C1 SY265906 [1,1,0,0,0,0|1,0,0]=3 623 B9R1.6 NC(=O)C1=NC=CN=C1 SY013550 [1,1,0,0,0,0|1,0,1]=4 624 B9R1.6 O=C(O)C1=NC=CN=C1 SY001166 [1,1,0,0,0,0|1,0,1]=4 625 B9R1.6 OB(O)C1=NC=CN=C1 SY102176 [1,1,0,0,0,0|2,0,0]=4 626 B9R1.8 BrCCC1=NC=CC=C1 SY004999 [1,1,0,0,0,0|1,0,0]=3 627 B9R1.8 CCCC1=NC=CC=C1 SY035538 [1,1,0,0,0,0|1,0,0]=3 628 B9R1.8 CNCC1=CC=CN=C1 SY002368 [1,1,0,0,0,0|1,0,0]=3 629 B9R1.8 CNCC1=NC=CC=C1 SY003781 [1,1,0,0,0,0|1,0,0]=3 630 B9R1.8 COCC1=CC=CC=C1 SY049310 [1,1,0,0,0,0|2,0,0]=4 631 B9R1.8 NCCC1=CC=CN=C1 SY003234 [1,1,0,0,0,0|1,0,0]=3 632 B9R1.8 NNCC1=NC=CC=C1 SY042125 [1,1,0,0,0,0|2,0,0]=4 633 B9R1.8 NOCC1=CC=CN=C1 SY029692 [1,1,0,0,0,0|2,0,0]=4 634 B9R1.8 NOCC1=CC=CN=C1 SY281597 [1,1,0,0,0,0|2,0,0]=4 635 B9R1.8 NOCC1=NC=CC=C1 SY281576 [1,1,0,0,0,0|2,0,0]=4 636 B9R1.8 NOCC1=NC=CC=C1 SY281577 [1,1,0,0,0,0|2,0,0]=4 637 B9R1.8 OCCC1=CC=CN=C1 SY004170 [1,1,0,0,0,0|1,0,0]=3 638 B9R1.8 OCCC1=NC=CN=C1 SY025413 [1,1,0,0,0,0|0,0,0]=2 639 B9R1.8 SCCC1=CC=CC=C1 SY039368 [1,1,0,0,0,0|2,0,0]=4 640 B9R1.3 CC1=C(Br)C=CN=C1Br SY065734 [1,1,0,0,0,0|2,0,0]=4 641 B9R1.3 CC1=C(Br)C=CN=C1Cl SY034659 [1,1,0,0,0,0|2,0,0]=4 642 B9R1.3 CC1=C(Br)C=CN=C1F SY037826 [1,1,0,0,0,0|2,0,0]=4 643 B9R1.3 CC1=C(C)C(=O)NC=N1 SY036346 [1,1,0,0,0,0|2,0,0]=4 644 B9R1.3 CC1=C(C)C(Cl)=NC=N1 SY024254 [1,1,0,0,0,0|2,0,0]=4 645 B9R1.3 CC1=C(C)C(F)=CC=C1 SY008867 [1,1,0,0,0,0|2,0,0]=4 646 B9R1.3 CC1=C(C)C(N)=NC=C1 SY047178 [1,1,0,0,0,0|2,0,0]=4 647 B9R1.3 CC1=C(Cl)C=CN=C1Br SY129234 [1,1,0,0,0,0|2,0,0]=4 648 B9R1.3 CC1=C(Cl)C=CN=C1N SY114799 [1,1,0,0,0,0|2,0,0]=4 649 B9R1.3 CC1=C(I)C=CN=C1Cl SY022301 [1,1,0,0,0,0|2,0,0]=4 650 B9R1.3 CC1=C(I)C=CN=C1F SY022288 [1,1,0,0,0,0|2,0,0]=4 651 B9R1.3 CC1=CC=CC(I)=C1C SY048327 [1,1,0,0,0,0|2,0,0]=4 652 B9R1.3 CC1=NC=CC(Br)=C1C SY113482 [1,1,0,0,0,0|1,0,0]=3 653 B9R1.3 CC1=NC=CC(Br)=C1Cl SY233418 [1,1,0,0,0,0|2,0,0]=4 654 B9R1.3 CC1=NC=CC(N)=C1C SY026503 [1,1,0,0,0,0|1,0,0]=3 655 B9R1.69 CC1=C(Br)C=C(N)C=N1 SY024696 [1,1,0,0,0,0|2,0,0]=4 656 B9R1.69 CC1=C(Br)C=CC(Cl)=N1 SY019304 [1,1,0,0,0,0|2,0,0]=4 657 B9R1.69 CC1=C(Br)C=CC(N)=N1 SY003423 [1,1,0,0,0,0|2,0,0]=4 658 B9R1.69 CC1=C(Br)N=CC(N)=N1 SY067173 [1,1,0,0,0,0|1,0,0]=3 659 B9R1.69 CC1=C(C)N=CC(O)=C1 SY277468 [1,1,0,0,0,0|1,0,0]=3 660 B9R1.69 CC1=C(Cl)C=CC(N)=N1 SY021462 [1,1,0,0,0,0|2,0,0]=4 661 B9R1.69 CC1=C(Cl)N=CC(N)=C1 SY028363 [1,1,0,0,0,0|2,0,0]=4 662 B9R1.69 CC1=C(F)C=CC(Br)=N1 SY019950 [1,1,0,0,0,0|2,0,0]=4 663 B9R1.69 CC1=C(F)C=CC(Cl)=N1 SY017449 [1,1,0,0,0,0|2,0,0]=4 664 B9R1.69 CC1=C(F)C=CC(N)=N1 SY078690 [1,1,0,0,0,0|2,0,0]=4 665 B9R1.69 CC1=C(I)C=CC(N)=N1 SY013205 [1,1,0,0,0,0|2,0,0]=4 666 B9R1.69 CC1=C(N)N=CC(Br)=C1 SY003424 [1,1,0,0,0,0|2,0,0]=4 667 B9R1.69 CC1=C(N)N=CC(O)=C1 SY125712 [1,1,0,0,0,0|2,0,0]=4 668 B9R1.69 CC1=CC(Br)=CN=C1Br SY018252 [1,1,0,0,0,0|2,0,0]=4 669 B9R1.69 CC1=CC(Br)=CN=C1C SY034362 [1,1,0,0,0,0|1,0,0]=3 670 B9R1.69 CC1=CC(Br)=CN=C1Cl SY002697 [1,1,0,0,0,0|2,0,0]=4 671 B9R1.69 CC1=CC(Br)=CN=C1F SY003968 [1,1,0,0,0,0|2,0,0]=4 672 B9R1.69 CC1=CC(Br)=CN=C1O SY007024 [1,1,0,0,0,0|2,0,0]=4 673 B9R1.69 CC1=CC(Cl)=CN=C1Br SY015056 [1,1,0,0,0,0|2,0,0]=4 674 B9R1.69 CC1=CC(Cl)=CN=C1Cl SY024707 [1,1,0,0,0,0|2,0,0]=4 675 B9R1.69 CC1=CC(Cl)=CN=C1F SY019985 [1,1,0,0,0,0|2,0,0]=4 676 B9R1.69 CC1=CC(Cl)=CN=C1N SY019853 [1,1,0,0,0,0|2,0,0]=4 677 B9R1.69 CC1=CC(F)=CN=C1Br SY039930 [1,1,0,0,0,0|2,0,0]=4 678 B9R1.69 CC1=CC(F)=CN=C1Cl SY023651 [1,1,0,0,0,0|2,0,0]=4 679 B9R1.69 CC1=CC(I)=CN=C1Br SY041758 [1,1,0,0,0,0|2,0,0]=4 680 B9R1.69 CC1=CC(I)=CN=C1Cl SY040812 [1,1,0,0,0,0|2,0,0]=4 681 B9R1.69 CC1=CC(I)=CN=C1F SY030201 [1,1,0,0,0,0|2,0,0]=4 682 B9R1.69 CC1=CC(I)=CN=C1N SY025932 [1,1,0,0,0,0|2,0,0]=4 683 B9R1.69 CC1=CC(I)=CN=C1O SY041380 [1,1,0,0,0,0|2,0,0]=4 684 B9R1.69 CC1=CC(N)=CN=C1Br SY024695 [1,1,0,0,0,0|2,0,0]=4 685 B9R1.69 CC1=CC(N)=CN=C1F SY030959 [1,1,0,0,0,0|2,0,0]=4 686 B9R1.69 CC1=CC(O)=CN=C1Br SY047641 [1,1,0,0,0,0|2,0,0]=4 687 B9R1.69 CC1=CC(O)=CN=C1Cl SY024020 [1,1,0,0,0,0|2,0,0]=4 688 B9R1.69 CC1=CC(O)=CN=C1F SY022139 [1,1,0,0,0,0|2,0,0]=4 689 B9R1.69 CC1=CC=C(Br)C(C)=N1 SY009345 [1,1,0,0,0,0|2,0,0]=4 690 B9R1.69 CC1=CC=C(Br)N=C1N SY058796 [1,1,0,0,0,0|2,0,0]=4 691 B9R1.69 CC1=CC=C(C)C(Cl)=N1 SY026988 [1,1,0,0,0,0|2,0,0]=4 692 B9R1.69 CC1=CC=C(C)C(N)=N1 SY011904 [1,1,0,0,0,0|2,0,0]=4 693 B9R1.69 CC1=CC=C(Cl)N=C1Cl SY010935 [1,1,0,0,0,0|2,0,0]=4 694 B9R1.69 CC1=CC=C(I)C=C1C SY029574 [1,1,0,0,0,0|2,0,0]=4 695 B9R1.69 CC1=CC=C(N)C(C)=N1 SY008752 [1,1,0,0,0,0|2,0,0]=4 696 B9R1.69 CC1=CN=C(Br)C(C)=C1 SY018892 [1,1,0,0,0,0|2,0,0]=4 697 B9R1.69 CC1=CN=C(Br)C(N)=N1 SY246624 [1,1,0,0,0,0|2,0,0]=4 698 B9R1.69 CC1=CN=C(C)C(Cl)=N1 SY021607 [1,1,0,0,0,0|1,0,0]=3 699 B9R1.69 CC1=CN=C(C)C(N)=N1 SY021611 [1,1,0,0,0,0|1,0,0]=3 700 B9R1.69 CC1=CN=C(Cl)C(C)=N1 SY023945 [1,1,0,0,0,0|1,0,0]=3 701 B9R1.69 CC1=CN=C(N)C(Br)=N1 SY037445 [1,1,0,0,0,0|2,0,0]=4 702 B9R1.69 CC1=CN=C(N)C(C)=C1 SY023723 [1,1,0,0,0,0|2,0,0]=4 703 B9R1.69 CC1=CN=C(N)C(C)=N1 SY025870 [1,1,0,0,0,0|1,0,0]=3 704 B9R1.69 CC1=NC(Br)=CC=C1Br SY020510 [1,1,0,0,0,0|2,0,0]=4 705 B9R1.69 CC1=NC(Br)=CC=C1N SY008963 [1,1,0,0,0,0|2,0,0]=4 706 B9R1.69 CC1=NC(Br)=CC=C1O SY023603 [1,1,0,0,0,0|2,0,0]=4 707 B9R1.69 CC1=NC(Br)=CN=C1I SY290493 [1,1,0,0,0,0|1,0,0]=3 708 B9R1.69 CC1=NC(Br)=CN=C1N SY067172 [1,1,0,0,0,0|1,0,0]=3 709 B9R1.69 CC1=NC(Br)=CN=C1O SY108685 [1,1,0,0,0,0|1,0,0]=3 710 B9R1.69 CC1=NC(Cl)=CC=C1N SY007925 [1,1,0,0,0,0|2,0,0]=4 711 B9R1.69 CC1=NC(Cl)=CN=C1Br SY071182 [1,1,0,0,0,0|1,0,0]=3 712 B9R1.69 CC1=NC(Cl)=CN=C1I SY290494 [1,1,0,0,0,0|1,0,0]=3 713 B9R1.69 CC1=NC(F)=CC=C1Br SY003431 [1,1,0,0,0,0|2,0,0]=4 714 B9R1.69 CC1=NC(F)=CC=C1I SY226256 [1,1,0,0,0,0|2,0,0]=4 715 B9R1.69 CC1=NC(I)=CC=C1O SY245043 [1,1,0,0,0,0|2,0,0]=4 716 B9R1.69 CC1=NC(I)=CN=C1Cl SY287550 [1,1,0,0,0,0|1,0,0]=3 717 B9R1.69 CC1=NC(O)=CC=C1Br SY023710 [1,1,0,0,0,0|2,0,0]=4 718 B9R1.69 CC1=NC=C(Br)C=C1Br SY057719 [1,1,0,0,0,0|2,0,0]=4 719 B9R1.69 CC1=NC=C(Br)C=C1N SY021289 [1,1,0,0,0,0|2,0,0]=4 720 B9R1.69 CC1=NC=C(Cl)C=C1N SY026555 [1,1,0,0,0,0|2,0,0]=4 721 B9R1.69 CC1=NC=C(Cl)N=C1Cl SY016010 [1,1,0,0,0,0|1,0,0]=3 722 B9R1.69 ClC1=CN=C(Cl)C(Cl)=N1 SY114323 [1,1,0,0,0,0|2,0,0]=4 723 B9R1.69 ClC1=CN=C(I)C(Cl)=N1 SY024653 [1,1,0,0,0,0|2,0,0]=4 724 B9R1.69 NC1=CN=C(Br)C(Cl)=N1 SY008157 [1,1,0,0,0,0|2,0,0]=4 725 B9R1.69 NC1=NC(Br)=C(Br)N=C1 SY121350 [1,1,0,0,0,0|2,0,0]=4 726 B9R1.69 NC1=NC(Br)=CN=C1Br SY007717 [1,1,0,0,0,0|2,0,0]=4 727 B9R1.69 NC1=NC(Br)=CN=C1Cl SY031523 [1,1,0,0,0,0|2,0,0]=4 728 B9R1.69 NC1=NC(Cl)=C(I)N=C1 SY268609 [1,1,0,0,0,0|2,0,0]=4 729 B9R1.69 NC1=NC(Cl)=CN=C1Br SY007481 [1,1,0,0,0,0|2,0,0]=4 730 B9R1.69 NC1=NC(Cl)=CN=C1I SY275425 [1,1,0,0,0,0|2,0,0]=4 731 B9R1.69 NC1=NC=C(Br)N=C1Br SY005814 [1,1,0,0,0,0|2,0,0]=4 732 B9R1.69 NC1=NC=C(Br)N=C1Cl SY031557 [1,1,0,0,0,0|2,0,0]=4 733 B9R1.69 NC1=NC=C(Br)N=C1N SY005791 [1,1,0,0,0,0|2,0,0]=4 734 B9R1.69 NC1=NC=C(Cl)N=C1Br SY034394 [1,1,0,0,0,0|2,0,0]=4 735 B9R1.69 NC1=NC=C(Cl)N=C1Cl SY014382 [1,1,0,0,0,0|2,0,0]=4 736 B9R1.69 NC1=NC=C(I)N=C1Cl SY098462 [1,1,0,0,0,0|2,0,0]=4 737 B9R1.69 OC1=NC=C(Br)N=C1Br SY017456 [1,1,0,0,0,0|2,0,0]=4 738 B9R1.14 BrCC1=C(CBr)SC=C1 SY246817 [0,1,0,0,1,0|2,0,0]=4 739 B9R1.14 CCN1C=CN=C1C=O SY041719 [0,1,0,0,1,0|1,0,1]=4 740 B9R1.14 CCN1N=CN=C1CO SY022557 [0,1,0,0,1,0|1,0,0]=3 741 B9R1.14 ClCC1=C(CCl)SC=N1 SY131098 [0,1,0,0,1,0|2,0,0]=4 742 B9R1.14 OCC1=C(CO)SC=C1 SY246810 [0,1,0,0,1,0|2,0,0]=4 743 B9R1.14 OCC1=C(CO)SC=N1 SY023809 [0,1,0,0,1,0|2,0,0]=4 744 B9R1.14 OCC1=C(CO)SC=N1 SY131097 [0,1,0,0,1,0|2,0,0]=4 745 B9R1.22 CC1=NC(C)=C(CN)S1 SY035454 [0,1,0,0,1,0|2,0,0]=4 746 B9R1.22 CC1=NN(C)C(CCl)=C1 SY041961 [0,1,0,0,1,0|2,0,0]=4 747 B9R1.22 CC1=NN(C)C(CN)=C1 SY031442 [0,1,0,0,1,0|2,0,0]=4 748 B9R1.22 CC1=NN(C)C(CO)=C1 SY032615 [0,1,0,0,1,0|2,0,0]=4 749 B9R1.22 CC1=NN(C)C=C1CN SY081005 [0,1,0,0,1,0|2,0,0]=4 750 B9R1.27 CC1=NOC(C)=C1CCl SY027121 [0,1,0,0,1,0|2,0,0]=4 751 B9R1.27 CC1=NOC(C)=C1CN SY035342 [0,1,0,0,1,0|2,0,0]=4 752 B9R1.27 CC1=NOC(C)=C1CO SY004843 [0,1,0,0,1,0|2,0,0]=4 753 B9R1.27 CCC1=C(C)CNC1=O SY032675 [0,1,0,0,1,0|2,0,0]=4 754 B9R1.27 CN1N=CC(F)=C1CO SY280145 [0,1,0,0,1,0|2,0,0]=4 755 B9R1.33 CC1=C(CC#N)OC=N1 SY233046 [0,1,0,0,1,0|1,0,1]=4 756 B9R1.33 CC1=NC=CN1CCN SY033876 [0,1,0,0,1,0|1,0,0]=3 757 B9R1.41 CC(=O)C1=CC=NN1C SY005764 [0,1,0,0,1,0|1,0,1]=4 758 B9R1.41 CC(C)C1=C(Br)SC=N1 SY010924 [0,1,0,0,1,0|2,0,0]=4 759 B9R1.41 CC(C)C1=CNN=C1N SY069100 [0,1,0,0,1,0|2,0,0]=4 760 B9R1.41 CC1=C(C(F)F)SC=C1 SY265783 [0,1,0,0,1,0|2,0,0]=4 761 B9R1.41 CC1=C(C(F)F)SC=N1 SY265887 [0,1,0,0,1,0|2,0,0]=4 762 B9R1.41 CC1=CNN=C1C(F)F SY308655 [0,1,0,0,1,0|2,0,0]=4 763 B9R1.41 CC1=NNC=C1C(C)C SY265373 [0,1,0,0,1,0|1,0,0]=3 764 B9R1.41 CN1N=CC=C1C(F)F SY265853 [0,1,0,0,1,0|2,0,0]=4 765 B9R1.132 CCN1C=C[N+](C)=C1C SY060847 [0,1,0,0,1,0|1,0,1]=4 766 B9R1.132 CCN1C=C[N+](C)=C1C SY108393 [0,1,0,0,1,0|1,0,1]=4 767 B9R1.132 CCN1C=C[N+](C)=C1C SY250276 [0,1,0,0,1,0|1,0,1]=4 768 B11R1.159 CC1=C(N)C(C(C)C)=NC=C1 SY251570 [0,2,0,0,0,0|2,0,0]=4 769 B11R1.267 COC1=C(C)C(CCl)=NC=C1 SY257938 [0,2,0,0,0,0|2,0,0]=4 770 B11R1.17 CC1=C(OCCN)C=CC=C1 SY008284 [0,2,0,0,0,0|2,0,0]=4 771 B11R1.17 CC1=CC=CC=C1NCCO SY012279 [0,2,0,0,0,0|2,0,0]=4 772 B11R1.41 CCOC1=NC=CC=C1C=O SY271472 [0,2,0,0,0,0|1,0,1]=4 773 B11R1.41 CNCC1=CC=CC=C1CO SY021761 [0,2,0,0,0,0|2,0,0]=4 774 B11R1.41 CNCC1=CC=CC=C1OC SY107300 [0,2,0,0,0,0|2,0,0]=4 775 B11R1.41 COC1=CC=CC=C1CCO SY023218 [0,2,0,0,0,0|2,0,0]=4 776 B11R1.41 COC1=NC=CC=C1CON SY281633 [0,2,0,0,0,0|2,0,0]=4 777 B11R1.41 COC1=NC=CC=C1CON SY281634 [0,2,0,0,0,0|2,0,0]=4 778 B11R1.81 CCOC1=NC=C(Br)C=C1N SY025116 [0,2,0,0,0,0|2,0,0]=4 779 B11R1.81 CCSC1=CC=C(Cl)N=C1Br SY285814 [0,2,0,0,0,0|2,0,0]=4 780 B11R1.86 CC(C)OC1=NC=CC=C1Br SY077021 [0,2,0,0,0,0|2,0,0]=4 781 B11R1.182 CCSC1=CC(Br)=CN=C1Cl SY285815 [0,2,0,0,0,0|2,0,0]=4 782 B11R1.182 CCSC1=CC(Cl)=CN=C1Br SY285816 [0,2,0,0,0,0|2,0,0]=4 783 B11R1.222 COC(=O)C1=C(C)C=CC=N1 SY005197 [0,2,0,0,0,0|1,0,1]=4 784 B11R1.222 COC(=O)C1=C(N)N=CC=N1 SY005164 [0,2,0,0,0,0|1,0,1]=4 785 B11R1.222 COC(=O)C1=CC=CN=C1C SY014898 [0,2,0,0,0,0|1,0,1]=4 786 B11R1.222 COC(=O)C1=NC=CN=C1Br SY021286 [0,2,0,0,0,0|1,0,1]=4 787 B11R1.222 COC(=O)C1=NC=CN=C1C SY036007 [0,2,0,0,0,0|0,0,1]=3 788 B11R1.222 COC(=O)C1=NC=CN=C1Cl SY017459 [0,2,0,0,0,0|1,0,1]=4 789 B11R1.222 COC(=O)C1=NC=CN=C1I SY023923 [0,2,0,0,0,0|1,0,1]=4 790 B11R1.222 COC(=O)C1=NC=CN=C1O SY020956 [0,2,0,0,0,0|1,0,1]=4 791 B11R1.605 OCCC1=C(I)C=CN=C1F SY267132 [0,2,0,0,0,0|2,0,0]=4 792 B11R1.37 COC1=CC(Br)=CN=C1OC SY258509 [0,2,0,0,0,0|2,0,0]=4 793 B11R1.37 COC1=NC=C(Br)C=C1CO SY021803 [0,2,0,0,0,0|2,0,0]=4 794 B11R1.37 OCC1=CC=C(Cl)N=C1CO SY036823 [0,2,0,0,0,0|2,0,0]=4 795 B11R1.53 CCC1=NC=CN=C1C(C)=O SY027477 [0,2,0,0,0,0|0,0,0]=2 796 B11R1.53 COC1=CC=CC=C1C(C)N SY026500 [0,2,0,0,0,0|2,0,0]=4 797 B11R1.53 COC1=CC=CC=C1C(C)O SY011446 [0,2,0,0,0,0|2,0,0]=4 798 B11R1.53 COC1=NC=CC=C1C(C)=O SY038106 [0,2,0,0,0,0|1,0,1]=4 799 B11R1.53 COC1=NC=CC=C1C(C)N SY249589 [0,2,0,0,0,0|1,0,0]=3 800 B11R1.53 COC1=NC=CC=C1C(F)F SY265900 [0,2,0,0,0,0|2,0,0]=4 801 B11R1.166 CC(C)C1=C(Br)C=C(N)C=N1 SY289046 [0,2,0,0,0,0|2,0,0]=4 802 B11R1.166 CC(O)C1=NC=C(Cl)C=C1F SY072446 [0,2,0,0,0,0|2,0,0]=4 803 B11R1.166 CC1=CC(O)=CC=C1C(C)C SY051849 [0,2,0,0,0,0|2,0,0]=4 804 B11R1.464 CC1=C(CO)C(Cl)=CC(Cl)=N1 SY296682 [0,2,0,0,0,0|2,0,0]=4 805 B11R1.464 COC1=C(Cl)C=C(Cl)N=C1C SY021049 [0,2,0,0,0,0|2,0,0]=4 806 B11R1.87 CC(C)(C)C1=NC=CC=C1O SY146834 [0,2,0,0,0,0|2,0,0]=4 807 B11R1.87 CC1=CC=CN=C1C(F)(F)F SY035999 [0,2,0,0,0,0|2,0,0]=4 808 B11R1.156 CC(O)C1=C(Cl)C=CN=C1Cl SY277865 [0,2,0,0,0,0|2,0,0]=4 809 B9R2.50 C1=CC=C2CCC2=C1 SY052978 [1,0,0,1,0,0|2,0,0]=4 810 B9R2.3 C1=CC2=C(CSC2)S1 SY246818 [0,0,0,1,1,0|2,0,0]=4 811 B9R2.3 C1=CN2CCCC2=N1 SY040307 [0,0,0,1,1,0|1,0,0]=3 812 B9R2.3 C1=NC2=C(CNC2)S1 SY018654 [0,0,0,1,1,0|2,0,0]=4 813 B9R2.3 C1=NC2=C(CNC2)S1 SY023812 [0,0,0,1,1,0|2,0,0]=4 814 B11R2.106 BrC1=C2CCCC2=NC=N1 SY261733 [0,1,0,1,0,0|2,0,0]=4 815 B11R2.106 BrC1=CC=CC2=C1CCC2 SY022574 [0,1,0,1,0,0|2,0,0]=4 816 B11R2.106 CC1=CC=CC2=C1CCN2 SY019161 [0,1,0,1,0,0|2,0,0]=4 817 B11R2.106 CC1=CC=CC2=C1NCC2 SY107457 [0,1,0,1,0,0|2,0,0]=4 818 B11R2.106 ClC1=C2CCCC2=NC=N1 SY011645 [0,1,0,1,0,0|2,0,0]=4 819 B11R2.106 IC1=C2CCOC2=NC=C1 SY099325 [0,1,0,1,0,0|2,0,0]=4 820 B11R2.106 NC1=C2CCOC2=NC=C1 SY265179 [0,1,0,1,0,0|2,0,0]=4 821 B11R2.106 NC1=CC=CC2=C1CCC2 SY106803 [0,1,0,1,0,0|2,0,0]=4 822 B11R2.106 OC1=C2CCCC2=NC=N1 SY016088 [0,1,0,1,0,0|2,0,0]=4 823 B11R2.106 OC1=CC=CC2=C1CCC2 SY107623 [0,1,0,1,0,0|2,0,0]=4 824 B11R2.10 BrC1CC2=C(C=CC=C2)C1 SY185759 [0,1,0,1,0,0|2,0,0]=4 825 B11R2.10 CC1CC2=C(C=CC=C2)N1 SY014921 [0,1,0,1,0,0|2,0,0]=4 826 B11R2.10 OC1CC2=C(C=CC=C2)C1 SY033139 [0,1,0,1,0,0|2,0,0]=4 827 B11R2.20 C1=CC2=C(C=C1)CNCC2 SY001156 [0,1,0,1,0,0|2,0,0]=4 828 B11R2.20 C1=CC2=C(C=C1)COCC2 SY018228 [0,1,0,1,0,0|2,0,0]=4 829 B11R2.20 C1=CC2=C(C=C1)CSCC2 SY286030 [0,1,0,1,0,0|2,0,0]=4 830 B11R2.20 C1=CC2=C(C=C1)NCCC2 SY001847 [0,1,0,1,0,0|2,0,0]=4 831 B11R2.20 C1=CC2=C(C=C1)OCCC2 SY174231 [0,1,0,1,0,0|2,0,0]=4 832 B11R2.20 C1=CC2=C(CCCC2)N=C1 SY004991 [0,1,0,1,0,0|1,0,0]=3 833 B11R2.20 C1=CC2=C(CCNC2)N=C1 SY022463 [0,1,0,1,0,0|1,0,0]=3 834 B11R2.20 C1=CC2=C(CNCC2)N=C1 SY114285 [0,1,0,1,0,0|1,0,0]=3 835 B11R2.20 C1=CC2=C(N=C1)NCCC2 SY022462 [0,1,0,1,0,0|1,0,0]=3 836 B11R2.20 C1=CC2=C(N=C1)NCCO2 SY008040 [0,1,0,1,0,0|2,0,0]=4 837 B11R2.20 C1=CN=C2CCCNC2=C1 SY011552 [0,1,0,1,0,0|1,0,0]=3 838 B11R2.20 C1=CN=C2CCNCC2=C1 SY022124 [0,1,0,1,0,0|1,0,0]=3 839 B11R2.20 C1=CN=C2OCCNC2=C1 SY130735 [0,1,0,1,0,0|2,0,0]=4 840 B11R2.20 C1=CN=C2OCCOC2=C1 SY045905 [0,1,0,1,0,0|2,0,0]=4 841 B11R2.20 C1=NC2=C(CCCC2)N=C1 SY020997 [0,1,0,1,0,0|0,0,0]=2 842 B11R2.20 C1=NC=C2CNCCC2=N1 SY025899 [0,1,0,1,0,0|2,0,0]=4 843 B11R2.55 BrC1=CC=CN=C1C2CC2 SY041201 [0,1,0,1,0,0|2,0,0]=4 844 B11R2.55 CC1=CC=CC=C1C2CC2 SY263839 [0,1,0,1,0,0|2,0,0]=4 845 B11R2.55 CC1=CC=CN=C1C2CC2 SY264189 [0,1,0,1,0,0|1,0,0]=3 846 B11R2.1 CC1CCC2=NC=CN=C21 SY036943 [0,1,0,1,0,0|0,0,0]=2 847 B11R2.1 CC1CNC2=C1C=CC=C2 SY178552 [0,1,0,1,0,0|2,0,0]=4 848 B11R2.1 NC1CCC2=C1C=CC=C2 SY004953 [0,1,0,1,0,0|2,0,0]=4 849 B11R2.1 NC1CCC2=CC=CC=C21 SY004234 [0,1,0,1,0,0|2,0,0]=4 850 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 SY030463 [0,1,0,1,0,0|2,0,0]=4 851 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 SY028017 [0,1,0,1,0,0|2,0,0]=4 852 B11R2.1 O=C1CCC2=CC=CN=C12 SY009408 [0,1,0,1,0,0|1,0,1]=4 853 B11R2.1 O=C1CCC2=NC=CC=C12 SY009444 [0,1,0,1,0,0|1,0,1]=4 854 B11R2.1 OC1CCC2=C1C=CC=C2 SY014889 [0,1,0,1,0,0|2,0,0]=4 855 B11R2.1 OC1CCC2=C1N=CC=C2 SY017306 [0,1,0,1,0,0|1,0,0]=3 856 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 SY275070 [0,1,0,1,0,0|2,0,0]=4 857 B11R2.36 BrC1=CC2=C(C=C1)CCC2 SY040210 [0,1,0,1,0,0|2,0,0]=4 858 B11R2.36 BrC1=CC2=C(N=C1)NCC2 SY002908 [0,1,0,1,0,0|2,0,0]=4 859 B11R2.36 BrC1=CN=C2CCCC2=C1 SY042931 [0,1,0,1,0,0|1,0,0]=3 860 B11R2.36 BrC1=CN=C2CNCC2=C1 SY041929 [0,1,0,1,0,0|2,0,0]=4 861 B11R2.36 BrC1=NC=C2CCCC2=N1 SY261732 [0,1,0,1,0,0|2,0,0]=4 862 B11R2.36 ClC1=CC2=C(CCC2)N=C1 SY294772 [0,1,0,1,0,0|1,0,0]=3 863 B11R2.36 ClC1=CC=C2CCCC2=N1 SY123708 [0,1,0,1,0,0|1,0,0]=3 864 B11R2.36 NC1=NC=C2CCCC2=N1 SY109183 [0,1,0,1,0,0|2,0,0]=4 865 B11R2.36 O=C1C=C2CCCC2=NN1 SY180609 [0,1,0,1,0,0|2,0,0]=4 866 B11R2.36 O=C1C=CC2=C(CCC2)N1 SY048029 [0,1,0,1,0,0|1,0,1]=4 867 B11R2.36 OC1=CN=C2NCCC2=C1 SY263070 [0,1,0,1,0,0|2,0,0]=4 868 B7R1.1 BrCC1=CSC=C1 SY021673 [1,0,0,0,1,0|2,0,0]=4 869 B7R1.1 BrCC1=NC=CN1 SY024828 [1,0,0,0,1,0|1,0,1]=4 870 B7R1.1 BrCC1=NC=CO1 SY024822 [1,0,0,0,1,0|2,0,0]=4 871 B7R1.1 CCC1=CC=CS1 SY048489 [1,0,0,0,1,0|1,0,0]=3 872 B7R1.1 CCC1=CNC=N1 SY055411 [1,0,0,0,1,0|0,0,1]=3 873 B7R1.1 CCC1=CSC=C1 SY036406 [1,0,0,0,1,0|1,0,0]=3 874 B7R1.1 CCN1C=CC=N1 SY014479 [1,0,0,0,1,0|1,0,0]=3 875 B7R1.1 CNC1=NC=CS1 SY104581 [1,0,0,0,1,0|2,0,0]=4 876 B7R1.1 COC1=CNN=C1 SY100279 [1,0,0,0,1,0|2,0,0]=4 877 B7R1.1 COC1=NNC=C1 SY147600 [1,0,0,0,1,0|2,0,0]=4 878 B7R1.1 CSC1=NC=CN1 SY025774 [1,0,0,0,1,0|1,0,1]=4 879 B7R1.1 ClCC1=CN=CO1 SY232319 [1,0,0,0,1,0|2,0,0]=4 880 B7R1.1 ClCC1=NC=CO1 SY016952 [1,0,0,0,1,0|2,0,0]=4 881 B7R1.1 ClCC1=NC=CS1 SY031528 [1,0,0,0,1,0|2,0,0]=4 882 B7R1.1 ClCC1=NNC=C1 SY012821 [1,0,0,0,1,0|2,0,0]=4 883 B7R1.1 NCC1=CC=CN1 SY032090 [1,0,0,0,1,0|1,0,1]=4 884 B7R1.1 NCC1=CC=NO1 SY021529 [1,0,0,0,1,0|2,0,0]=4 885 B7R1.1 NCC1=CNC=N1 SY018114 [1,0,0,0,1,0|1,0,1]=4 886 B7R1.1 NCC1=CNN=C1 SY042195 [1,0,0,0,1,0|2,0,0]=4 887 B7R1.1 NCC1=COC=C1 SY002989 [1,0,0,0,1,0|2,0,0]=4 888 B7R1.1 NCC1=COC=N1 SY026493 [1,0,0,0,1,0|2,0,0]=4 889 B7R1.1 NCC1=COC=N1 SY043130 [1,0,0,0,1,0|2,0,0]=4 890 B7R1.1 NCC1=CON=C1 SY211967 [1,0,0,0,1,0|2,0,0]=4 891 B7R1.1 NCC1=CSC=C1 SY006774 [1,0,0,0,1,0|2,0,0]=4 892 B7R1.1 NCC1=CSC=C1 SY018599 [1,0,0,0,1,0|2,0,0]=4 893 B7R1.1 NCC1=CSC=N1 SY021530 [1,0,0,0,1,0|2,0,0]=4 894 B7R1.1 NCC1=CSC=N1 SY023202 [1,0,0,0,1,0|2,0,0]=4 895 B7R1.1 NCC1=NC=CN1 SY025359 [1,0,0,0,1,0|1,0,1]=4 896 B7R1.1 NCC1=NC=CO1 SY026394 [1,0,0,0,1,0|2,0,0]=4 897 B7R1.1 NCC1=NC=CS1 SY005679 [1,0,0,0,1,0|2,0,0]=4 898 B7R1.1 NCC1=NC=CS1 SY005981 [1,0,0,0,1,0|2,0,0]=4 899 B7R1.1 NCC1=NNC=C1 SY005508 [1,0,0,0,1,0|2,0,0]=4 900 B7R1.1 NCC1=NNC=N1 SY035453 [1,0,0,0,1,0|2,0,0]=4 901 B7R1.1 NCC1=NOC=C1 SY024118 [1,0,0,0,1,0|2,0,0]=4 902 B7R1.1 NCC1=NOC=C1 SY034799 [1,0,0,0,1,0|2,0,0]=4 903 B7R1.1 OCC1=CC=CS1 SY036796 [1,0,0,0,1,0|2,0,0]=4 904 B7R1.1 OCC1=CC=NO1 SY179337 [1,0,0,0,1,0|2,0,0]=4 905 B7R1.1 OCC1=CN=CO1 SY025391 [1,0,0,0,1,0|2,0,0]=4 906 B7R1.1 OCC1=CN=CS1 SY002035 [1,0,0,0,1,0|2,0,0]=4 907 B7R1.1 OCC1=CNC=N1 SY003265 [1,0,0,0,1,0|1,0,1]=4 908 B7R1.1 OCC1=CNN=C1 SY042536 [1,0,0,0,1,0|2,0,0]=4 909 B7R1.1 OCC1=COC=C1 SY033055 [1,0,0,0,1,0|2,0,0]=4 910 B7R1.1 OCC1=COC=N1 SY012558 [1,0,0,0,1,0|2,0,0]=4 911 B7R1.1 OCC1=CSC=C1 SY017648 [1,0,0,0,1,0|2,0,0]=4 912 B7R1.1 OCC1=NC=CN1 SY041704 [1,0,0,0,1,0|1,0,1]=4 913 B7R1.1 OCC1=NC=CS1 SY017208 [1,0,0,0,1,0|2,0,0]=4 914 B7R1.1 OCC1=NNC=C1 SY012820 [1,0,0,0,1,0|2,0,0]=4 915 B7R1.4 CC1=C(Br)N=CN1 SY024634 [1,0,0,0,1,0|1,0,1]=4 916 B7R1.4 CC1=C(Br)SC=N1 SY021986 [1,0,0,0,1,0|2,0,0]=4 917 B7R1.4 CC1=C(C)NC=C1 SY284153 [1,0,0,0,1,0|0,0,1]=3 918 B7R1.4 CC1=C(C)NC=N1 SY036818 [1,0,0,0,1,0|0,0,1]=3 919 B7R1.4 CC1=C(I)N=CN1 SY034657 [1,0,0,0,1,0|1,0,1]=4 920 B7R1.4 CC1=C(N)N=CN1 SY024335 [1,0,0,0,1,0|1,0,1]=4 921 B7R1.4 CC1=CC=NN1C SY032670 [1,0,0,0,1,0|1,0,0]=3 922 B7R1.4 CC1=CNN=C1Br SY035870 [1,0,0,0,1,0|2,0,0]=4 923 B7R1.4 CC1=CNN=C1C SY024902 [1,0,0,0,1,0|1,0,0]=3 924 B7R1.4 CC1=CNN=C1C SY102711 [1,0,0,0,1,0|1,0,0]=3 925 B7R1.4 CC1=CNN=C1N SY026483 [1,0,0,0,1,0|2,0,0]=4 926 B7R1.4 CC1=CON=C1Br SY037253 [1,0,0,0,1,0|2,0,0]=4 927 B7R1.4 CC1=CSC=C1C SY100626 [1,0,0,0,1,0|2,0,0]=4 928 B7R1.4 CC1=NN=NN1C SY253276 [1,0,0,0,1,0|2,0,0]=4 929 B7R1.4 CC1=NNC=C1Br SY010801 [1,0,0,0,1,0|2,0,0]=4 930 B7R1.4 CC1=NNC=C1I SY010800 [1,0,0,0,1,0|2,0,0]=4 931 B7R1.4 CC1=NOC=C1Br SY265513 [1,0,0,0,1,0|2,0,0]=4 932 B7R1.4 CC1=NON=C1C SY130728 [1,0,0,0,1,0|1,0,0]=3 933 B7R1.4 CN1C=CN=C1Br SY013969 [1,0,0,0,1,0|2,0,0]=4 934 B7R1.4 CN1C=CN=C1Cl SY019835 [1,0,0,0,1,0|2,0,0]=4 935 B7R1.4 CN1C=CN=C1N SY010735 [1,0,0,0,1,0|2,0,0]=4 936 B7R1.4 CN1N=CC=C1Br SY043010 [1,0,0,0,1,0|2,0,0]=4 937 B7R1.4 CN1N=CC=C1I SY037964 [1,0,0,0,1,0|2,0,0]=4 938 B7R1.4 CN1N=CC=C1N SY003710 [1,0,0,0,1,0|2,0,0]=4 939 B7R1.4 CN1N=CC=C1O SY047635 [1,0,0,0,1,0|2,0,0]=4 940 B7R1.4 CN1N=CN=C1Br SY021471 [1,0,0,0,1,0|2,0,0]=4