0 B10R1.10 BrC1=CC(CCO)=CC=C1 AK-40057 [0,0,0,0,0,0|1,1,0]=2 1 B10R1.10 BrCCC1=CC(Br)=CC=C1 AK142066 [0,0,0,0,0,0|1,1,0]=2 2 B10R1.10 C1=C(C=CC=C1Cl)CCO AK-46667 [0,0,0,0,0,0|1,1,0]=2 3 B10R1.10 C1=C(C=CC=C1F)CNC AK-16717 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.10 CC1=CC(CCCl)=CC=C1 AK162876 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.10 CC1=CC(CNC)=CC=C1 AK-89676 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.10 CC1=CC=CC(CCO)=C1 AK-87226 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.10 CCOC1=CC(Br)=NC=C1 AK146932 [0,0,0,0,0,0|3,1,0]=4 8 B10R1.10 CCOC1=CC(Cl)=NC=C1 AK114104 [0,0,0,0,0,0|3,1,0]=4 9 B10R1.10 CCOC1=CC(F)=CC=C1 AK-61826 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.10 CCOC1=CC=CC(Br)=C1 AK-44617 [0,0,0,0,0,0|2,1,0]=3 11 B10R1.10 CCOC1=CN=CC(N)=C1 AK100109 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.10 CCOC1=NC=CC(Br)=C1 AK129551 [0,0,0,0,0,0|3,1,0]=4 13 B10R1.10 CNCC1=CC(=CN=C1)Br AK-50635 [0,0,0,0,0,0|3,1,0]=4 14 B10R1.10 CNCC1=CC(Cl)=CC=C1 AK-76864 [0,0,0,0,0,0|2,1,0]=3 15 B10R1.10 CNCC1=CC=CC(Br)=C1 AK-16713 [0,0,0,0,0,0|2,1,0]=3 16 B10R1.10 FC1=NC=CC(OCC)=C1 AK-64190 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.10 N#CCC1=CC=CC(F)=C1 AK-27132 [0,0,0,0,0,0|0,0,2]=2 18 B10R1.10 N#CCC1=CC=CC(N)=C1 AK-76735 [0,0,0,0,0,0|1,0,2]=3 19 B10R1.10 NC1=CC(=NC=C1)NCC AK-47602 [0,0,0,0,0,0|4,0,0]=4 20 B10R1.10 NC1=CC=CC(CNC)=C1 AK-93009 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.10 NCCC1=CC=CC(Br)=C1 AK-44011 [0,0,0,0,0,0|0,1,0]=1 22 B10R1.10 NCCC1=CC=CC(Cl)=C1 AK-57464 [0,0,0,0,0,0|0,1,0]=1 23 B10R1.10 NCCC1=CC=CC(F)=C1 AK-41691 [0,0,0,0,0,0|0,0,0]=0 24 B10R1.10 NNCC1=CC=CC(Cl)=C1 AK163398 [0,0,0,0,0,0|1,1,0]=2 25 B10R1.10 OC1=CC=CC(CCN)=C1 AK-41280 [0,0,0,0,0,0|1,0,0]=1 26 B10R1.10 OCCC1=CC(F)=CC=C1 AK111050 [0,0,0,0,0,0|1,0,0]=1 27 B10R1.10 OCCC1=NC(Br)=CC=C1 AK-57002 [0,0,0,0,0,0|2,1,0]=3 28 B9R1.2 BrC1=CC(=CN=C1)CC AK-54800 [1,0,0,0,0,0|1,1,0]=3 29 B9R1.2 BrC1=CC(=NC=C1)CN AK-30719 [1,0,0,0,0,0|1,1,0]=3 30 B9R1.2 BrC1=CC(C=C)=CC=C1 AK-76367 [1,0,0,0,0,0|0,1,2]=4 31 B9R1.2 BrC1=CN=CC(=C1)CO AK-29246 [1,0,0,0,0,0|2,1,0]=4 32 B9R1.2 BrC1=NC=CC(=C1)CO AK-25314 [1,0,0,0,0,0|2,1,0]=4 33 B9R1.2 BrCC1=CC(Br)=NC=C1 AK-53557 [1,0,0,0,0,0|2,1,0]=4 34 B9R1.2 BrCC1=CC(I)=CC=C1 AK-54649 [1,0,0,0,0,0|1,1,0]=3 35 B9R1.2 BrCC1=CC=CC(Br)=N1 AK-48524 [1,0,0,0,0,0|2,1,0]=4 36 B9R1.2 C#CC1=CC=CC(Br)=C1 AK-45287 [1,0,0,0,0,0|0,1,2]=4 37 B9R1.2 C1=C(C=CC=C1Br)C#N AK-47279 [1,0,0,0,0,0|0,1,2]=4 38 B9R1.2 C1=C(C=CC=C1C#C)N AK-27092 [1,0,0,0,0,0|1,0,2]=4 39 B9R1.2 C1=C(C=CC=C1C#N)O AK-47400 [1,0,0,0,0,0|1,0,2]=4 40 B9R1.2 C1=C(C=CC=C1Cl)C#C AK-47344 [1,0,0,0,0,0|0,1,2]=4 41 B9R1.2 C1=C(C=CC=C1F)NN AK-47492 [1,0,0,0,0,0|1,0,0]=2 42 B9R1.2 C1=C(C=CN=C1OC)N AK-28456 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.2 C1=C(CO)C=CC=C1N AK-50595 [1,0,0,0,0,0|2,0,0]=3 44 B9R1.2 C1=C(N=C(C=C1)Cl)NN AK-27744 [1,0,0,0,0,0|2,1,0]=4 45 B9R1.2 C1=C(NN)C=CC=C1Br AK-25693 [1,0,0,0,0,0|1,1,0]=3 46 B9R1.2 C1=C(NN)C=CC=C1C AK-47381 [1,0,0,0,0,0|2,0,0]=3 47 B9R1.2 C1=CC=C(N=C1OC)Br AK-25939 [1,0,0,0,0,0|2,1,0]=4 48 B9R1.2 C1=CC=C(N=C1OC)C AK-44038 [1,0,0,0,0,0|3,0,0]=4 49 B9R1.2 C1=CC=C(N=C1OC)Cl AK-25492 [1,0,0,0,0,0|2,1,0]=4 50 B9R1.2 CC1=CC(CCl)=NC=C1 AK-74194 [1,0,0,0,0,0|3,0,0]=4 51 B9R1.2 CC1=CC(CO)=NC=C1 AK-74173 [1,0,0,0,0,0|3,0,0]=4 52 B9R1.2 CC1=CC(OC)=NC=C1 AK-39493 [1,0,0,0,0,0|3,0,0]=4 53 B9R1.2 CC1=CC=CC(CBr)=N1 AK-44889 [1,0,0,0,0,0|3,0,0]=4 54 B9R1.2 CC1=CC=CC(CCl)=N1 AK-40015 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.2 CC1=CN=CC(CBr)=C1 AK-56105 [1,0,0,0,0,0|3,0,0]=4 56 B9R1.2 CCC1=CC(N)=NC=C1 AK-29170 [1,0,0,0,0,0|2,0,0]=3 57 B9R1.2 CCC1=CC=CC(Br)=C1 AK111102 [1,0,0,0,0,0|0,1,0]=2 58 B9R1.2 CCC1=CC=CC(Br)=N1 AK-65167 [1,0,0,0,0,0|1,1,0]=3 59 B9R1.2 CCC1=NC=CC(Br)=C1 AK129552 [1,0,0,0,0,0|1,1,0]=3 60 B9R1.2 CNC1=CC(Br)=NC=C1 AK161537 [1,0,0,0,0,0|2,1,0]=4 61 B9R1.2 CNC1=CC=CC(Br)=C1 AK112706 [1,0,0,0,0,0|1,1,0]=3 62 B9R1.2 CNC1=NC(Cl)=CC=C1 AK-48574 [1,0,0,0,0,0|2,1,0]=4 63 B9R1.2 CNC1=NC=CC(Br)=C1 AK141589 [1,0,0,0,0,0|2,1,0]=4 64 B9R1.2 COC1=CC(Br)=CC=C1 AK-76817 [1,0,0,0,0,0|1,1,0]=3 65 B9R1.2 COC1=CC(Br)=NC=C1 AK-36780 [1,0,0,0,0,0|2,1,0]=4 66 B9R1.2 COC1=CC(C)=NC=C1 AK-67862 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.2 COC1=CC(Cl)=CC=C1 AK106212 [1,0,0,0,0,0|1,1,0]=3 68 B9R1.2 COC1=CC(Cl)=NC=C1 AK-25114 [1,0,0,0,0,0|2,1,0]=4 69 B9R1.2 COC1=CC=CC(F)=N1 AK130132 [1,0,0,0,0,0|2,0,0]=3 70 B9R1.2 COC1=CN=CC(=C1)O AK-28499 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.2 COC1=CN=CC(Br)=C1 AK-26045 [1,0,0,0,0,0|2,1,0]=4 72 B9R1.2 COC1=NC=CC(Br)=C1 AK-47404 [1,0,0,0,0,0|2,1,0]=4 73 B9R1.2 COC1=NC=CC(F)=C1 AK-77188 [1,0,0,0,0,0|2,0,0]=3 74 B9R1.2 COC1=NC=CC(I)=C1 AK-37008 [1,0,0,0,0,0|2,1,0]=4 75 B9R1.2 CSC1=CC=CC(Br)=N1 AK159822 [1,0,0,0,0,0|2,1,0]=4 76 B9R1.2 ClC1=CC(=NC=C1)CN AK-28137 [1,0,0,0,0,0|1,1,0]=3 77 B9R1.2 ClC1=CC(=NC=C1)CO AK-27991 [1,0,0,0,0,0|2,1,0]=4 78 B9R1.2 ClC1=CC(=NC=C1)OC AK-26290 [1,0,0,0,0,0|2,1,0]=4 79 B9R1.2 ClC1=CC(=NC=C1)SC AK-25786 [1,0,0,0,0,0|2,1,0]=4 80 B9R1.2 ClC1=CC(CO)=CC=C1 AK-51231 [1,0,0,0,0,0|1,1,0]=3 81 B9R1.2 ClC1=CC=CC(=N1)CO AK-28428 [1,0,0,0,0,0|2,1,0]=4 82 B9R1.2 ClC1=CN=CC(=C1)CO AK-23534 [1,0,0,0,0,0|2,1,0]=4 83 B9R1.2 ClC1=NC=CC(CBr)=C1 AK-50155 [1,0,0,0,0,0|2,1,0]=4 84 B9R1.2 ClC1=NC=CC(CBr)=C1 AK163959 [1,0,0,0,0,0|2,1,0]=4 85 B9R1.2 ClCC1=CC(=CN=C1)C AK-33495 [1,0,0,0,0,0|3,0,0]=4 86 B9R1.2 ClCC1=CC(I)=CC=C1 AK-94390 [1,0,0,0,0,0|1,1,0]=3 87 B9R1.2 ClCC1=CC=CC(Br)=N1 AK151971 [1,0,0,0,0,0|2,1,0]=4 88 B9R1.2 ClCC1=CN=CC(Br)=C1 AK-88388 [1,0,0,0,0,0|2,1,0]=4 89 B9R1.2 ClCC1=NC=CC(Cl)=C1 AK-46990 [1,0,0,0,0,0|2,1,0]=4 90 B9R1.2 FC1=CC(=CN=C1)C=O AK-30355 [1,0,0,0,0,0|2,0,1]=4 91 B9R1.2 FC1=CC(C=O)=NC=C1 AK-32767 [1,0,0,0,0,0|2,0,1]=4 92 B9R1.2 FC1=CC(CO)=CC=C1 AK-51232 [1,0,0,0,0,0|1,0,0]=2 93 B9R1.2 FC1=CC=CC(=N1)C#C AK100508 [1,0,0,0,0,0|1,0,2]=4 94 B9R1.2 FC1=CC=CC(CBr)=N1 AK-77216 [1,0,0,0,0,0|2,0,0]=3 95 B9R1.2 FC1=CC=CC(CCl)=N1 AK137993 [1,0,0,0,0,0|2,0,0]=3 96 B9R1.2 FC1=CN=CC(=C1)C#N AK-36132 [1,0,0,0,0,0|1,0,2]=4 97 B9R1.2 FC1=NC(=CC=C1)C=O AK-25580 [1,0,0,0,0,0|2,0,1]=4 98 B9R1.2 FC1=NC=CC(=C1)C#N AK-34998 [1,0,0,0,0,0|1,0,2]=4 99 B9R1.2 N#CC1=CC=CC(I)=C1 AK-76942 [1,0,0,0,0,0|0,1,2]=4 100 B9R1.2 N(N)C1=NC(=CC=C1)C AK-35513 [1,0,0,0,0,0|3,0,0]=4 101 B9R1.2 NC1=CC(=CN=C1)OC AK-27775 [1,0,0,0,0,0|3,0,0]=4 102 B9R1.2 NC1=CC(NC)=NC=C1 AK118733 [1,0,0,0,0,0|3,0,0]=4 103 B9R1.2 NC1=CC=CC(C#C)=C1 AK119642 [1,0,0,0,0,0|1,0,2]=4 104 B9R1.2 NC1=CC=CC(CN)=C1 AK-76655 [1,0,0,0,0,0|1,0,0]=2 105 B9R1.2 NC1=CC=CC(CO)=N1 AK-85732 [1,0,0,0,0,0|3,0,0]=4 106 B9R1.2 NC1=CC=CC(OC)=C1 AK309398 [1,0,0,0,0,0|2,0,0]=3 107 B9R1.2 NC1=CC=CC(SC)=C1 AK162933 [1,0,0,0,0,0|2,0,0]=3 108 B9R1.2 NC1=NC(=CC=C1)OC AK-27734 [1,0,0,0,0,0|3,0,0]=4 109 B9R1.2 NC1=NC(CC)=CC=C1 AK-28992 [1,0,0,0,0,0|2,0,0]=3 110 B9R1.2 NC1=NC=CC(=C1)CN AK-28487 [1,0,0,0,0,0|2,0,0]=3 111 B9R1.2 NC1=NC=CC(=C1)OC AK-25255 [1,0,0,0,0,0|3,0,0]=4 112 B9R1.2 NCC1=CC(Br)=NC=C1 AK111031 [1,0,0,0,0,0|1,1,0]=3 113 B9R1.2 NCC1=CC(C)=NC=C1 AK130210 [1,0,0,0,0,0|2,0,0]=3 114 B9R1.2 NCC1=CC(Cl)=NC=C1 AK-90264 [1,0,0,0,0,0|1,1,0]=3 115 B9R1.2 NCC1=CC(F)=CC=C1 AK-80195 [1,0,0,0,0,0|0,0,0]=1 116 B9R1.2 NCC1=CC(F)=NC=C1 AK186950 [1,0,0,0,0,0|1,0,0]=2 117 B9R1.2 NCC1=CC=CC(Br)=C1 AK-49144 [1,0,0,0,0,0|0,1,0]=2 118 B9R1.2 NCC1=CC=CC(C)=C1 AK-98167 [1,0,0,0,0,0|1,0,0]=2 119 B9R1.2 NCC1=CC=CC(Cl)=C1 AK-89641 [1,0,0,0,0,0|0,1,0]=2 120 B9R1.2 NCC1=CC=CC(I)=C1 AK-46127 [1,0,0,0,0,0|0,1,0]=2 121 B9R1.2 NCC1=NC(Br)=CC=C1 AK-39249 [1,0,0,0,0,0|1,1,0]=3 122 B9R1.2 NCC1=NC(Br)=CC=C1 AK-79055 [1,0,0,0,0,0|1,1,0]=3 123 B9R1.2 NCC1=NC(Cl)=CC=C1 AK105012 [1,0,0,0,0,0|1,1,0]=3 124 B9R1.2 NCC1=NC(Cl)=CN=C1 AK130178 [1,0,0,0,0,0|2,1,0]=4 125 B9R1.2 NCC1=NC(F)=CC=C1 AK112462 [1,0,0,0,0,0|1,0,0]=2 126 B9R1.2 NCC1=NC=CC(Br)=C1 AK-76280 [1,0,0,0,0,0|1,1,0]=3 127 B9R1.2 NCC1=NC=CC(Cl)=C1 AK164315 [1,0,0,0,0,0|1,1,0]=3 128 B9R1.2 NCC1=NC=CC(F)=C1 AK133025 [1,0,0,0,0,0|1,0,0]=2 129 B9R1.2 NNC1=CC=CC(Br)=N1 AK-68384 [1,0,0,0,0,0|2,1,0]=4 130 B9R1.2 NNC1=CC=CC(Cl)=C1 AK-46617 [1,0,0,0,0,0|1,1,0]=3 131 B9R1.2 O=C1C=C(CC)C=NN1 AK132530 [1,0,0,0,0,0|3,0,0]=4 132 B9R1.2 O=C1C=C(NN)C=CN1 AK117636 [1,0,0,0,0,0|3,0,0]=4 133 B9R1.2 O=C1C=C(OC)C=CN1 AK-35484 [1,0,0,0,0,0|3,0,0]=4 134 B9R1.2 O=C1NC=NC(CC)=C1 AK100022 [1,0,0,0,0,0|3,0,0]=4 135 B9R1.2 O=CC1=CC=CC(Br)=C1 AK-77027 [1,0,0,0,0,0|1,1,1]=4 136 B9R1.2 O=CC1=CC=CC(Cl)=C1 AK-68812 [1,0,0,0,0,0|1,1,1]=4 137 B9R1.2 O=CC1=CC=CC(F)=C1 AK112743 [1,0,0,0,0,0|1,0,1]=3 138 B9R1.2 O=CC1=CC=CC(I)=C1 AK-50045 [1,0,0,0,0,0|1,1,1]=4 139 B9R1.2 O=CC1=CC=CC(N)=C1 AK121859 [1,0,0,0,0,0|2,0,1]=4 140 B9R1.2 O=CC1=CC=CC(O)=C1 AK-77369 [1,0,0,0,0,0|2,0,1]=4 141 B9R1.2 O=CC1=CC=NC(F)=C1 AK-29829 [1,0,0,0,0,0|2,0,1]=4 142 B9R1.2 OC1=CC(=CC=C1)C#C AK111295 [1,0,0,0,0,0|1,0,2]=4 143 B9R1.2 OC1=CC(CBr)=CC=C1 AK-99880 [1,0,0,0,0,0|2,0,0]=3 144 B9R1.2 OC1=CC(OC)=NC=C1 AK-68345 [1,0,0,0,0,0|3,0,0]=4 145 B9R1.2 OCC1=CC(=O)NC=C1 AK-72519 [1,0,0,0,0,0|3,0,0]=4 146 B9R1.2 OCC1=CC(C)=CN=C1 AK130310 [1,0,0,0,0,0|3,0,0]=4 147 B9R1.2 OCC1=CC(C)=NC=C1 AK-32751 [1,0,0,0,0,0|3,0,0]=4 148 B9R1.2 OCC1=CC(Cl)=NC=C1 AK-32643 [1,0,0,0,0,0|2,1,0]=4 149 B9R1.2 OCC1=CC(F)=NC=C1 AK-57689 [1,0,0,0,0,0|2,0,0]=3 150 B9R1.2 OCC1=CC(N)=CN=C1 AK135137 [1,0,0,0,0,0|3,0,0]=4 151 B9R1.2 OCC1=CC(N)=NC=C1 AK-25275 [1,0,0,0,0,0|3,0,0]=4 152 B9R1.2 OCC1=CC=CC(Br)=C1 AK110441 [1,0,0,0,0,0|1,1,0]=3 153 B9R1.2 OCC1=CC=CC(Br)=N1 AK-34739 [1,0,0,0,0,0|2,1,0]=4 154 B9R1.2 OCC1=NC(C)=CC=C1 AK-47726 [1,0,0,0,0,0|3,0,0]=4 155 B9R1.2 OCC1=NC(Cl)=CC=C1 AK-29179 [1,0,0,0,0,0|2,1,0]=4 156 B9R1.2 OCC1=NC=CC(Br)=C1 AK-25360 [1,0,0,0,0,0|2,1,0]=4 157 B9R1.8 BrCCC1=CC=CC=C1 AK-54085 [1,0,0,0,0,0|1,0,0]=2 158 B9R1.8 C1=C(C=CC=C1)CON AK-49180 [1,0,0,0,0,0|1,0,0]=2 159 B9R1.8 C1=C(CCN)N=CC=C1 AK-73075 [1,0,0,0,0,0|1,0,0]=2 160 B9R1.8 C1=C(CNN)C=CC=C1 AK-72938 [1,0,0,0,0,0|1,0,0]=2 161 B9R1.8 C1=C(N=CC=C1)COC AK-32294 [1,0,0,0,0,0|3,0,0]=4 162 B9R1.8 CCCC1=CC=NC=C1 AK109267 [1,0,0,0,0,0|2,0,0]=3 163 B9R1.8 CCCC1=NC=CN=C1 AK305719 [1,0,0,0,0,0|3,0,0]=4 164 B9R1.8 CCNC1=CC=CN=C1 AK126739 [1,0,0,0,0,0|3,0,0]=4 165 B9R1.8 CCOC1=NC=CC=C1 AK-88755 [1,0,0,0,0,0|3,0,0]=4 166 B9R1.8 CNCC1=CC=CN=C1 AK-77094 [1,0,0,0,0,0|3,0,0]=4 167 B9R1.8 CNCC1=CC=NC=C1 AK-36140 [1,0,0,0,0,0|3,0,0]=4 168 B9R1.8 CNCC1=NC=CC=C1 AK-82805 [1,0,0,0,0,0|3,0,0]=4 169 B9R1.8 CNNC1=CC=CC=C1 AK119038 [1,0,0,0,0,0|3,0,0]=4 170 B9R1.8 N#CCC1=CC=CN=C1 AK-44402 [1,0,0,0,0,0|1,0,2]=4 171 B9R1.8 NCCC1=CC=CN=C1 AK-45879 [1,0,0,0,0,0|1,0,0]=2 172 B9R1.8 NNCC1=CC=CN=C1 AK-50063 [1,0,0,0,0,0|2,0,0]=3 173 B9R1.8 NOCC1=CC=CC=C1 AK-82317 [1,0,0,0,0,0|1,0,0]=2 174 B9R1.8 OCCC1=CN=CN=C1 AK-32465 [1,0,0,0,0,0|3,0,0]=4 175 B9R1.8 OCCC1=NC=CN=C1 AK-45393 [1,0,0,0,0,0|3,0,0]=4 176 B9R1.8 ONCC1=CC=CC=C1 AK-49662 [1,0,0,0,0,0|2,0,0]=3 177 B9R1.8 ONCC1=CC=CC=C1 AK110567 [1,0,0,0,0,0|2,0,0]=3 178 B11R1.13 ClC1=C(CCN)C=CC=C1Cl AK-16706 [0,1,0,0,0,0|0,1,0]=2 179 B11R1.13 ClC1=C(Cl)C(CCO)=CC=C1 AK-86365 [0,1,0,0,0,0|1,1,0]=3 180 B11R1.13 FC1=C(CC#N)C=CC=C1Cl AK-34416 [0,1,0,0,0,0|0,1,2]=4 181 B11R1.13 FC1=C(F)C(OCC)=CC=C1 AK-45507 [0,1,0,0,0,0|2,0,0]=3 182 B11R1.13 N#CCC1=CC=CC(Cl)=C1Cl AK117217 [0,1,0,0,0,0|0,1,2]=4 183 B11R1.13 N#CCC1=CC=CC(F)=C1F AK-53692 [0,1,0,0,0,0|0,0,2]=3 184 B11R1.23 BrC1=CC(C(N)CO)=CC=C1 AK321205 [0,1,0,0,0,0|1,1,0]=3 185 B11R1.23 BrC1=CC([C@@H](N)CO)=CC=C1 AK160001 [0,1,0,0,0,0|1,1,0]=3 186 B11R1.23 BrC1=CC([C@H](N)CO)=CC=C1 AK167556 [0,1,0,0,0,0|1,1,0]=3 187 B11R1.23 C1=C(C=CC=C1F)C(CBr)=O AK-45729 [0,1,0,0,0,0|1,0,1]=3 188 B11R1.23 CC(NC)C1=CC=CC(Br)=C1 AK608016 [0,1,0,0,0,0|2,1,0]=4 189 B11R1.23 CC1=CC(C(CBr)=O)=CC=C1 AK-43564 [0,1,0,0,0,0|2,0,1]=4 190 B11R1.23 CC1=CC([C@H](N)CO)=CC=C1 AK548236 [0,1,0,0,0,0|2,0,0]=3 191 B11R1.23 CCC(=O)C1=CC=CC(Cl)=C1 AK101591 [0,1,0,0,0,0|1,1,1]=4 192 B11R1.23 CCC(C1=CC=CC(F)=C1)=O AK548314 [0,1,0,0,0,0|1,0,1]=3 193 B11R1.23 CCC(C1=CC=CC(O)=C1)=O AK-45536 [0,1,0,0,0,0|2,0,1]=4 194 B11R1.23 CC[C@@H](C1=CC=CC(Br)=C1)N AK687502 [0,1,0,0,0,0|1,1,0]=3 195 B11R1.23 CC[C@@H](C1=CC=CC(F)=C1)N AK134091 [0,1,0,0,0,0|1,0,0]=2 196 B11R1.23 CC[C@H](C1=CC=CC(C)=C1)N AK134022 [0,1,0,0,0,0|2,0,0]=3 197 B11R1.23 CC[C@H](C1=CC=CC(Cl)=C1)N AK153385 [0,1,0,0,0,0|1,1,0]=3 198 B11R1.23 CC[C@H](C1=CC=CC(F)=C1)N AK-42095 [0,1,0,0,0,0|1,0,0]=2 199 B11R1.23 ClC1=CC(C(CBr)=O)=CC=C1 AK-47073 [0,1,0,0,0,0|1,1,1]=4 200 B11R1.23 ClC1=CC([C@@H](N)CO)=CC=C1 AK143424 [0,1,0,0,0,0|1,1,0]=3 201 B11R1.23 ClC1=CC([C@H](N)CO)=CC=C1 AK143359 [0,1,0,0,0,0|1,1,0]=3 202 B11R1.23 ClC1=CC([C@H](N)CO)=CC=C1 AK172770 [0,1,0,0,0,0|1,1,0]=3 203 B11R1.23 FC1=CC([C@@H](N)CO)=CC=C1 AK607953 [0,1,0,0,0,0|1,0,0]=2 204 B11R1.23 FC1=CC([C@H](N)CO)=CC=C1 AK159103 [0,1,0,0,0,0|1,0,0]=2 205 B11R1.23 FC1=CC([C@H](N)CO)=CC=C1 AK548219 [0,1,0,0,0,0|1,0,0]=2 206 B11R1.23 FC1=CC=CC(=C1)C(=O)OC AK-47674 [0,1,0,0,0,0|2,0,1]=4 207 B11R1.23 FC1=CC=CC(C(N)CO)=N1 AK543202 [0,1,0,0,0,0|2,0,0]=3 208 B11R1.23 NNC(=O)C1=CC(Br)=CC=C1 AK-39193 [0,1,0,0,0,0|1,1,1]=4 209 B11R1.23 NNC(=O)C1=CC(Cl)=CC=C1 AK-60929 [0,1,0,0,0,0|1,1,1]=4 210 B11R1.23 OC1=CC=CC(C(N)CO)=C1 AK608024 [0,1,0,0,0,0|2,0,0]=3 211 B11R1.23 OC[C@H](O)C1=CC(Cl)=CC=C1 AK-45027 [0,1,0,0,0,0|1,1,0]=3 212 B11R1.23 O[C@@H](CCl)C1=CC(Cl)=CC=C1 AK-79203 [0,1,0,0,0,0|1,1,0]=3 213 B11R1.24 CCNCC1=CC=CC(Cl)=C1 AK158029 [0,1,0,0,0,0|1,1,0]=3 214 B11R1.24 CCNCC1=CC=CC(Cl)=C1 AK484893 [0,1,0,0,0,0|1,1,0]=3 215 B11R1.24 COCOC1=CC(F)=CC=C1 AK101350 [0,1,0,0,0,0|2,0,0]=3 216 B11R1.24 ClC1=CC=CC(NCCO)=N1 AK-66021 [0,1,0,0,0,0|2,1,0]=4 217 B11R1.24 OCCCC1=CC=CC(Br)=C1 AK106570 [0,1,0,0,0,0|1,1,0]=3 218 B11R1.34 BrC1=CC(CC#N)=CC(Br)=C1 AK-41509 [0,1,0,0,0,0|0,1,2]=4 219 B11R1.34 CCOC1=CC(F)=CC(Br)=C1 AK102974 [0,1,0,0,0,0|2,0,0]=3 220 B11R1.34 CNCC1=CC(Cl)=CC(Cl)=C1 AK-43704 [0,1,0,0,0,0|2,1,0]=4 221 B11R1.34 FC1=CC(Br)=CC(CC=C)=C1 AK187914 [0,1,0,0,0,0|1,0,1]=3 222 B11R1.34 FC1=CC(F)=CC(CC#N)=C1 AK-45304 [0,1,0,0,0,0|0,0,2]=3 223 B11R1.34 N#CCC1=CC(C)=CC(F)=C1 AK-64750 [0,1,0,0,0,0|0,0,2]=3 224 B11R1.34 N#CCC1=CC(Cl)=CC(Cl)=C1 AK-35481 [0,1,0,0,0,0|0,1,2]=4 225 B11R1.34 NCCC1=CC(Cl)=CC(Cl)=C1 AK110643 [0,1,0,0,0,0|0,1,0]=2 226 B11R1.157 C1=C(C=CC=C1Cl)CC(O)=O AK-47464 [0,1,0,0,0,0|1,1,1]=4 227 B11R1.157 C1=C(C=CC=C1F)CC(O)=O AK-72993 [0,1,0,0,0,0|1,0,1]=3 228 B11R1.157 C1=C(C=CC=C1O)CC(O)=O AK-48396 [0,1,0,0,0,0|2,0,1]=4 229 B11R1.157 CC(=O)CC1=CC(F)=CC=C1 AK-60937 [0,1,0,0,0,0|1,0,1]=3 230 B11R1.157 CC(C)CC1=CC(Br)=CC=C1 AK148389 [0,1,0,0,0,0|1,1,0]=3 231 B11R1.157 CC(CC1=CC=CC(Br)=C1)=O AK-94137 [0,1,0,0,0,0|1,1,1]=4 232 B11R1.157 CC(OC1=CC=CC(F)=C1)=O AK135677 [0,1,0,0,0,0|2,0,1]=4 233 B11R1.157 CN(C)CC1=CC=CC(Br)=C1 AK130105 [0,1,0,0,0,0|2,1,0]=4 234 B11R1.157 FC(F)OC1=CC(Br)=CC=C1 AK-87088 [0,1,0,0,0,0|2,1,0]=4 235 B11R1.157 FC(OC1=CC=CC(=C1)N)F AK-34187 [0,1,0,0,0,0|3,0,0]=4 236 B11R1.157 O=C(N)CC1=CC=CC(Cl)=C1 AK-86174 [0,1,0,0,0,0|0,1,1]=3 237 B11R1.157 O=C(N)CC1=CC=CC(N)=C1 AK124849 [0,1,0,0,0,0|1,0,1]=3 238 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 AK113021 [0,1,0,0,0,0|2,0,1]=4 239 B11R1.157 O=C(O)CC1=CC=CC(Br)=C1 AK-42053 [0,1,0,0,0,0|1,1,1]=4 240 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 AK-61642 [0,1,0,0,0,0|1,1,1]=4 241 B11R1.182 CC1=C(CC#N)C=C(F)C=C1 AK-37525 [0,1,0,0,0,0|0,0,2]=3 242 B11R1.182 CC1=CC(CC#N)=C(C)C=C1 AK-63581 [0,1,0,0,0,0|1,0,2]=4 243 B11R1.182 COCC1=CC(Br)=CC=C1F AK135092 [0,1,0,0,0,0|2,1,0]=4 244 B11R1.182 ClC1=CC=C(Cl)C(CC#N)=C1 AK-51238 [0,1,0,0,0,0|0,1,2]=4 245 B11R1.182 ClC1=CC=C(Cl)C(CCN)=C1 AK135196 [0,1,0,0,0,0|0,1,0]=2 246 B11R1.182 FC1=C(CC#N)C=C(Cl)C=C1 AK-36296 [0,1,0,0,0,0|0,1,2]=4 247 B11R1.182 FC1=CC(CC#N)=C(Br)C=C1 AK-36752 [0,1,0,0,0,0|0,0,2]=3 248 B11R1.182 FC1=CC(CC#N)=C(Cl)C=C1 AK-35010 [0,1,0,0,0,0|0,0,2]=3 249 B11R1.182 N#CCC1=CC(Br)=CC=C1F AK-94405 [0,1,0,0,0,0|0,1,2]=4 250 B11R1.182 NC1=CC=C(N)C=C1COC AK486936 [0,1,0,0,0,0|3,0,0]=4 251 B11R1.182 OCCC1=CC(Cl)=CC=C1Cl AK149274 [0,1,0,0,0,0|1,1,0]=3 252 B11R1.189 CNCC1=CC=CC(OC)=C1 AK-89685 [0,1,0,0,0,0|3,0,0]=4 253 B11R1.189 COC1=CC=CC(CCO)=C1 AK-89566 [0,1,0,0,0,0|2,0,0]=3 254 B11R1.189 N#CC1=CC=CC(CNC)=C1 AK-89682 [0,1,0,0,0,0|3,0,0]=4 255 B11R1.189 N#CCC1=CC=CC(OC)=C1 AK-88692 [0,1,0,0,0,0|1,0,2]=4 256 B11R1.189 OCCC1=CC=CC(=C1)C#N AK100051 [0,1,0,0,0,0|2,0,0]=3 257 B11R1.192 BrC1=C(C=C(C=C1)CC#N)F AK-53738 [0,1,0,0,0,0|0,0,2]=3 258 B11R1.192 C1=C(C=CC(=C1Cl)Cl)CC#N AK-46738 [0,1,0,0,0,0|0,1,2]=4 259 B11R1.192 C1=C(C=CC(=C1Cl)Cl)CNC AK-16705 [0,1,0,0,0,0|2,1,0]=4 260 B11R1.192 CC1=CC(OCC)=CC=C1Br AK-86746 [0,1,0,0,0,0|3,0,0]=4 261 B11R1.192 CC1=CC=C(CCN)C=C1C AK-33676 [0,1,0,0,0,0|1,0,0]=2 262 B11R1.192 CCCC1=CC=C(Br)C(F)=C1 AK-86763 [0,1,0,0,0,0|1,0,0]=2 263 B11R1.192 CCOC1=CC=C(Br)C(Cl)=C1 AK-86745 [0,1,0,0,0,0|2,1,0]=4 264 B11R1.192 CNCC1=CC=C(C)C(C)=C1 AK-82567 [0,1,0,0,0,0|3,0,0]=4 265 B11R1.192 COCC1=CC=C(F)C(Br)=C1 AK136514 [0,1,0,0,0,0|2,1,0]=4 266 B11R1.192 ClC1=C(C=CC(=C1)CC#N)F AK-36021 [0,1,0,0,0,0|0,1,2]=4 267 B11R1.192 FC1=CC(CCBr)=CC=C1F AK108344 [0,1,0,0,0,0|1,0,0]=2 268 B11R1.192 FC1=CC(OCC)=CC=C1Br AK-61436 [0,1,0,0,0,0|2,0,0]=3 269 B11R1.192 FC1=CC=C(CCN)C=C1F AK120581 [0,1,0,0,0,0|0,0,0]=1 270 B11R1.192 N#CCC1=CC=C(Cl)C(F)=C1 AK-34355 [0,1,0,0,0,0|0,0,2]=3 271 B11R1.192 N#CCC1=CC=C(F)C(Br)=C1 AK135460 [0,1,0,0,0,0|0,1,2]=4 272 B11R1.192 N#CCC1=CC=C(F)C(F)=C1 AK-41734 [0,1,0,0,0,0|0,0,2]=3 273 B11R1.192 OC1=CC=C(CCN)C=C1O AK142758 [0,1,0,0,0,0|1,0,0]=2 274 B11R1.192 OCCC1=CC(Cl)=C(Cl)C=C1 AK-45905 [0,1,0,0,0,0|1,1,0]=3 275 B11R2.35 BrC1=CC(=CC=C1)C2CC2 AK-81509 [0,0,0,1,0,0|1,1,0]=3 276 B11R2.35 BrC1=CC(C2CC2)=NC=C1 AK123378 [0,0,0,1,0,0|2,1,0]=4 277 B11R2.35 NC1=CC=CC(C2CC2)=C1 AK112946 [0,0,0,1,0,0|2,0,0]=3 278 B11R2.36 BrC1=CC2=C(C=C1)C=CC2 AK113550 [0,0,0,1,0,0|1,1,1]=4 279 B11R2.36 BrC1=CC2=C(C=C1)CCN2 AK-30084 [0,0,0,1,0,0|2,1,0]=4 280 B11R2.36 BrC1=CC2=C(C=C1)CCN2 AK-48733 [0,0,0,1,0,0|2,1,0]=4 281 B11R2.36 BrC1=CC2=C(CNC2)C=C1 AK-33061 [0,0,0,1,0,0|2,1,0]=4 282 B11R2.36 BrC1=CC2=C(NCC2)C=C1 AK-34182 [0,0,0,1,0,0|0,1,0]=2 283 B11R2.36 BrC1=CC2=C(NN=C2)C=C1 AK-23818 [0,0,0,1,0,0|1,1,1]=4 284 B11R2.36 BrC1=CC2=C(NN=N2)C=C1 AK-34667 [0,0,0,1,0,0|2,1,0]=4 285 B11R2.36 BrC1=CC=C2CCOC2=C1 AK114300 [0,0,0,1,0,0|2,1,0]=4 286 B11R2.36 BrC1=CC=C2NC=NC2=C1 AK-29293 [0,0,0,1,0,0|1,1,1]=4 287 B11R2.36 BrC1=CC=C2OCOC2=C1 AK-34440 [0,0,0,1,0,0|2,1,0]=4 288 B11R2.36 BrC1=CN=C2NCCC2=C1 AK-27505 [0,0,0,1,0,0|1,1,0]=3 289 B11R2.36 C1=C(C=C2C(=C1)[NH]N=C2)O AK-23554 [0,0,0,1,0,0|2,0,1]=4 290 B11R2.36 C1=C2C(=CC=C1C)[NH]C=C2 AK-30411 [0,0,0,1,0,0|1,0,2]=4 291 B11R2.36 C1=CC(=CC2=C1[NH]C=C2)Br AK-31145 [0,0,0,1,0,0|0,1,2]=4 292 B11R2.36 C1=CC(=CC2=C1[NH]C=C2)Cl AK-32262 [0,0,0,1,0,0|0,1,2]=4 293 B11R2.36 C1=CC2=C([NH]1)C=CC(=C2)O AK-39838 [0,0,0,1,0,0|1,0,2]=4 294 B11R2.36 C1=N[NH]C2=C1C=C(C=C2)Cl AK-23822 [0,0,0,1,0,0|1,1,1]=4 295 B11R2.36 CC1=CC2=C(NN=N2)C=C1 AK-58651 [0,0,0,1,0,0|3,0,0]=4 296 B11R2.36 CC1=CC=C2NC=NC2=C1 AK-87161 [0,0,0,1,0,0|2,0,1]=4 297 B11R2.36 CC1=CC=C2[NH]N=CC2=C1 AK-22235 [0,0,0,1,0,0|2,0,1]=4 298 B11R2.36 ClC1=CC2=C(C=C1)CCN2 AK-46887 [0,0,0,1,0,0|2,1,0]=4 299 B11R2.36 ClC1=CC2=C(CNC2)C=C1 AK-68483 [0,0,0,1,0,0|2,1,0]=4 300 B11R2.36 ClC1=CC=C2C(=C1)NCC2 AK-30184 [0,0,0,1,0,0|2,1,0]=4 301 B11R2.36 ClC1=CC=C2NN=NC2=C1 AK403403 [0,0,0,1,0,0|2,1,0]=4 302 B11R2.36 ClC1=CC=C2OCCC2=C1 AK143639 [0,0,0,1,0,0|1,1,0]=3 303 B11R2.36 ClC1=CN=C2NCCC2=C1 AK156379 [0,0,0,1,0,0|1,1,0]=3 304 B11R2.36 FC1=CC2=C(C=C1)C=CN2 AK-26628 [0,0,0,1,0,0|2,0,1]=4 305 B11R2.36 FC1=CC2=C(CCC2)C=C1 AK105101 [0,0,0,1,0,0|1,0,0]=2 306 B11R2.36 FC1=CC2=C(CNC2)C=C1 AK-65030 [0,0,0,1,0,0|2,0,0]=3 307 B11R2.36 FC1=CC2=C(NC=C2)C=C1 AK-30363 [0,0,0,1,0,0|0,0,2]=3 308 B11R2.36 FC1=CC2=C(NC=C2)C=N1 AK203950 [0,0,0,1,0,0|1,0,2]=4 309 B11R2.36 FC1=CC2=C(OC=C2)C=C1 AK-81560 [0,0,0,1,0,0|1,0,2]=4 310 B11R2.36 FC1=CC=C2C(=C1)[NH]N=C2 AK-25822 [0,0,0,1,0,0|3,0,0]=4 311 B11R2.36 FC1=CC=C2NC=NC2=C1 AK126224 [0,0,0,1,0,0|1,0,1]=3 312 B11R2.36 FC1=CC=C2[NH]N=CC2=C1 AK-23828 [0,0,0,1,0,0|1,0,1]=3 313 B11R2.36 FC1=CN=C2C(=C1)C=C[NH]2 AK-27511 [0,0,0,1,0,0|1,0,2]=4 314 B11R2.36 FC1=NC2=C(NC=C2)C=C1 AK-84438 [0,0,0,1,0,0|1,0,2]=4 315 B11R2.36 IC1=CC=C2[NH]N=CC2=C1 AK-27902 [0,0,0,1,0,0|1,1,1]=4 316 B11R2.36 NC1=CC2=C(NC=C2)C=C1 AK-35447 [0,0,0,1,0,0|1,0,2]=4 317 B11R2.36 NC1=CC2=C(NN=C2)C=C1 AK-23803 [0,0,0,1,0,0|2,0,1]=4 318 B11R2.36 NC1=CC2=C(OCO2)C=C1 AK-33266 [0,0,0,1,0,0|3,0,0]=4 319 B11R2.36 NC1=CC=C2OCCC2=C1 AK109466 [0,0,0,1,0,0|2,0,0]=3 320 B11R2.36 NC1=CC=C2OCOC2=C1 AK100870 [0,0,0,1,0,0|3,0,0]=4 321 B11R2.36 OC1=CC2=C(C=C1)CCN2 AK145623 [0,0,0,1,0,0|3,0,0]=4 322 B11R2.36 OC1=CC2=C(NCC2)C=C1 AK-60844 [0,0,0,1,0,0|1,0,0]=2 323 B11R2.36 OC1=CC=C2NC=NC2=C1 AK-45322 [0,0,0,1,0,0|2,0,1]=4 324 B11R2.106 BrC1=C2OCCC2=CC=C1 AK-49553 [0,0,0,1,0,0|1,1,0]=3 325 B11R2.106 BrC1=C2OCOC2=CC=C1 AK-32027 [0,0,0,1,0,0|2,1,0]=4 326 B11R2.106 BrC1=C2[NH]N=CC2=CC=C1 AK-26850 [0,0,0,1,0,0|1,1,1]=4 327 B11R2.106 BrC1=CC=CC2=C1CCC2 AK126711 [0,0,0,1,0,0|1,1,0]=3 328 B11R2.106 BrC1=CC=CC2=C1CCN2 AK-68725 [0,0,0,1,0,0|2,1,0]=4 329 B11R2.106 BrC1=CC=CC2=C1CNC2 AK-28312 [0,0,0,1,0,0|2,1,0]=4 330 B11R2.106 BrC1=CC=CC2=C1NC=C2 AK-27182 [0,0,0,1,0,0|0,1,2]=4 331 B11R2.106 C1=CC=C(C2=C1CCC2)O AK-38453 [0,0,0,1,0,0|2,0,0]=3 332 B11R2.106 CC1=C2NC=NC2=CC=C1 AK140118 [0,0,0,1,0,0|2,0,1]=4 333 B11R2.106 CC1=C2[NH]N=CC2=CC=C1 AK-24466 [0,0,0,1,0,0|2,0,1]=4 334 B11R2.106 CC1=CC=CC2=C1NC=C2 AK-36907 [0,0,0,1,0,0|1,0,2]=4 335 B11R2.106 ClC1=C2CCCC2=NC=C1 AK-38590 [0,0,0,1,0,0|2,1,0]=4 336 B11R2.106 ClC1=C2NC=NC2=CC=C1 AK139813 [0,0,0,1,0,0|1,1,1]=4 337 B11R2.106 ClC1=C2NN=CC2=CC=C1 AK-24465 [0,0,0,1,0,0|1,1,1]=4 338 B11R2.106 ClC1=C2NN=NC2=CC=C1 AK125386 [0,0,0,1,0,0|2,1,0]=4 339 B11R2.106 ClC1=CC=CC2=C1CCN2 AK-35110 [0,0,0,1,0,0|2,1,0]=4 340 B11R2.106 ClC1=CC=CC2=C1CNC2 AK-68481 [0,0,0,1,0,0|2,1,0]=4 341 B11R2.106 FC1=C2C(=CC=C1)[NH]N=C2 AK-23772 [0,0,0,1,0,0|3,0,0]=4 342 B11R2.106 FC1=C2C(C=CS2)=CC=C1 AK120871 [0,0,0,1,0,0|1,0,2]=4 343 B11R2.106 FC1=C2[NH]N=CC2=CC=C1 AK-24464 [0,0,0,1,0,0|1,0,1]=3 344 B11R2.106 FC1=CC=CC2=C1C=CN2 AK-25895 [0,0,0,1,0,0|2,0,1]=4 345 B11R2.106 FC1=CC=CC2=C1NC=C2 AK-29993 [0,0,0,1,0,0|0,0,2]=3 346 B11R2.106 FC1=CC=CC2=C1NCC2 AK145029 [0,0,0,1,0,0|0,0,0]=1 347 B11R2.106 IC1=CC=CC2=C1CCC2 AK138441 [0,0,0,1,0,0|1,1,0]=3 348 B11R2.106 NC1=C2CCCC2=CC=C1 AK-72591 [0,0,0,1,0,0|2,0,0]=3 349 B11R2.106 NC1=C2CCOC2=CC=C1 AK-83274 [0,0,0,1,0,0|3,0,0]=4 350 B11R2.106 NC1=C2NC=NC2=CC=C1 AK-30023 [0,0,0,1,0,0|2,0,1]=4 351 B11R2.106 NC1=C2OCCC2=CC=C1 AK142017 [0,0,0,1,0,0|2,0,0]=3 352 B11R2.106 NC1=C2OCOC2=CC=C1 AK-38427 [0,0,0,1,0,0|3,0,0]=4 353 B11R2.106 NC1=CC=CC2=C1CNC2 AK116799 [0,0,0,1,0,0|3,0,0]=4 354 B11R2.106 OC1=CC=CC2=C1CNC2 AK132783 [0,0,0,1,0,0|3,0,0]=4 355 B11R2.106 OC1=CC=CC2=C1NC=C2 AK-48053 [0,0,0,1,0,0|1,0,2]=4 356 B11R2.106 OC1=CC=CC2=C1NN=C2 AK-27878 [0,0,0,1,0,0|2,0,1]=4 357 B9R1.7 CC1=CC=C(CCO)O1 AK684573 [0,0,0,0,1,0|3,0,0]=4 358 B9R1.7 CCCC1=CC=C(Br)S1 AK-89997 [0,0,0,0,1,0|2,1,0]=4 359 B9R1.33 CC1=NC=CN1CCN AK-55496 [0,0,0,0,1,0|3,0,0]=4 360 B8R0.4 CCC\C=C\C=C\C=O AK-88482 [1,0,1,0,0,0|2,0,0]=4 361 B8R1.2 BrCC1=CC=CN=C1 AK-44682 [2,0,0,0,0,0|2,0,0]=4 362 B8R1.2 BrCC1=CC=NC=C1 AK-40271 [2,0,0,0,0,0|2,0,0]=4 363 B8R1.2 BrCC1=NC=CC=C1 AK-78919 [2,0,0,0,0,0|2,0,0]=4 364 B8R1.2 C1=C(N=CC=N1)CN AK-23965 [2,0,0,0,0,0|2,0,0]=4 365 B8R1.2 C1=CN=CC=C1OC AK-54547 [2,0,0,0,0,0|2,0,0]=4 366 B8R1.2 CC[N+]1=CC=CC=C1 AK607939 [2,0,0,0,0,0|1,0,0]=3 367 B8R1.2 CNC1=CC=CN=C1 AK-72893 [2,0,0,0,0,0|2,0,0]=4 368 B8R1.2 COC1=CC=CN=C1 AK-76565 [2,0,0,0,0,0|2,0,0]=4 369 B8R1.2 ICC1=CC=CC=C1 AK-54444 [2,0,0,0,0,0|1,0,0]=3 370 B8R1.2 N#CC1=CC=CC=C1 AK-49389 [2,0,0,0,0,0|0,0,2]=4 371 B8R1.2 N1=C(N=CC=C1)CN AK-23656 [2,0,0,0,0,0|2,0,0]=4 372 B8R1.2 NCC1=CC=NC=C1 AK-25866 [2,0,0,0,0,0|1,0,0]=3 373 B8R1.2 NCC1=CC=NC=C1 AK-50006 [2,0,0,0,0,0|1,0,0]=3 374 B8R1.2 NCC1=CC=NN=C1 AK-23789 [2,0,0,0,0,0|2,0,0]=4 375 B8R1.2 NCC1=CN=CN=C1 AK164227 [2,0,0,0,0,0|2,0,0]=4 376 B8R1.2 NCC1=NC=CC=N1 AK-73144 [2,0,0,0,0,0|2,0,0]=4 377 B8R1.2 NCC1=NC=CN=C1 AK-50813 [2,0,0,0,0,0|2,0,0]=4 378 B8R1.2 NCC1=NC=NC=C1 AK-23966 [2,0,0,0,0,0|2,0,0]=4 379 B8R1.2 NNC1=CC=CC=C1 AK114548 [2,0,0,0,0,0|1,0,0]=3 380 B8R1.2 NNC1=CC=CN=C1 AK-40869 [2,0,0,0,0,0|2,0,0]=4 381 B8R1.2 NNC1=CC=CN=C1 AK-75799 [2,0,0,0,0,0|2,0,0]=4 382 B8R1.2 NNC1=CC=NC=C1 AK-51295 [2,0,0,0,0,0|2,0,0]=4 383 B8R1.2 NNC1=NC=CC=C1 AK-26026 [2,0,0,0,0,0|2,0,0]=4 384 B8R1.2 NOC1=CC=CC=C1 AK-77703 [2,0,0,0,0,0|1,0,0]=3 385 B8R1.2 OCC1=CC=CN=C1 AK-46173 [2,0,0,0,0,0|2,0,0]=4 386 B8R1.2 OCC1=CC=NC=C1 AK-44706 [2,0,0,0,0,0|2,0,0]=4 387 B8R1.2 OCC1=CC=NC=C1 AK175384 [2,0,0,0,0,0|2,0,0]=4 388 B8R1.2 OCC1=NC=CC=C1 AK-53905 [2,0,0,0,0,0|2,0,0]=4 389 B8R1.2 ONC1=CC=CC=C1 AK139965 [2,0,0,0,0,0|2,0,0]=4 390 B8R1.4 BrC1=CC(Br)=CC=C1 AK-88659 [2,0,0,0,0,0|1,1,0]=4 391 B8R1.4 BrC1=CC=CC(N)=N1 AK-25560 [2,0,0,0,0,0|1,1,0]=4 392 B8R1.4 BrC1=NC=CC(=C1)F AK-27032 [2,0,0,0,0,0|2,0,0]=4 393 B8R1.4 C1=C(Br)C=CN=C1C AK-23747 [2,0,0,0,0,0|1,1,0]=4 394 B8R1.4 C1=C(C)C=CN=C1Cl AK-25858 [2,0,0,0,0,0|1,1,0]=4 395 B8R1.4 C1=C(C=C(N=C1)N)Br AK-23588 [2,0,0,0,0,0|1,1,0]=4 396 B8R1.4 C1=C(C=CC=C1Br)I AK-48371 [2,0,0,0,0,0|1,1,0]=4 397 B8R1.4 C1=C(C=CN=C1Br)C AK-26025 [2,0,0,0,0,0|1,1,0]=4 398 B8R1.4 C1=C(C=CN=C1C)Cl AK-25859 [2,0,0,0,0,0|1,1,0]=4 399 B8R1.4 C1=C(C=NC=C1O)C AK-25962 [2,0,0,0,0,0|2,0,0]=4 400 B8R1.4 C1=C(F)C=NC=C1Br AK-23525 [2,0,0,0,0,0|2,0,0]=4 401 B8R1.4 C1=C(N)C=CN=C1Br AK-26316 [2,0,0,0,0,0|1,1,0]=4 402 B8R1.4 C1=C(N=C(C=C1)Br)C AK-26079 [2,0,0,0,0,0|1,1,0]=4 403 B8R1.4 C1=C(N=C(C=C1)Cl)N AK-27165 [2,0,0,0,0,0|1,1,0]=4 404 B8R1.4 C1=C(N=CC=C1N)Cl AK-27134 [2,0,0,0,0,0|1,1,0]=4 405 B8R1.4 C1=C(N=CC=C1N)N AK-29267 [2,0,0,0,0,0|2,0,0]=4 406 B8R1.4 C1=CC(=CC(=N1)Cl)F AK-26795 [2,0,0,0,0,0|2,0,0]=4 407 B8R1.4 C1=CC=C(F)N=C1Br AK-25117 [2,0,0,0,0,0|2,0,0]=4 408 B8R1.4 C1=CC=C(N=C1C)Cl AK-32452 [2,0,0,0,0,0|1,1,0]=4 409 B8R1.4 C1=CC=C(N=C1C)F AK-25943 [2,0,0,0,0,0|1,0,0]=3 410 B8R1.4 C1=CC=C(N=C1N)N AK-33251 [2,0,0,0,0,0|2,0,0]=4 411 B8R1.4 C1=CN=C(C=C1Br)F AK-23505 [2,0,0,0,0,0|2,0,0]=4 412 B8R1.4 CC1=CC(C=CN1)=O AK-25534 [2,0,0,0,0,0|2,0,0]=4 413 B8R1.4 CC1=CC(F)=NC=C1 AK-26002 [2,0,0,0,0,0|1,0,0]=3 414 B8R1.4 CC1=CC(I)=CC=C1 AK161788 [2,0,0,0,0,0|0,1,0]=3 415 B8R1.4 CC1=CC=CC(I)=N1 AK-35898 [2,0,0,0,0,0|1,1,0]=4 416 B8R1.4 CC1=CC=CC(N)=N1 AK-28918 [2,0,0,0,0,0|2,0,0]=4 417 B8R1.4 CC1=CN=CC(Cl)=C1 AK-25547 [2,0,0,0,0,0|1,1,0]=4 418 B8R1.4 CC1=CN=CC(F)=C1 AK-25942 [2,0,0,0,0,0|1,0,0]=3 419 B8R1.4 CC1=NC=CC(I)=C1 AK-29006 [2,0,0,0,0,0|1,1,0]=4 420 B8R1.4 ClC1=CC(=NC=C1)F AK-25827 [2,0,0,0,0,0|2,0,0]=4 421 B8R1.4 ClC1=CC(N)=NC=C1 AK-23590 [2,0,0,0,0,0|1,1,0]=4 422 B8R1.4 ClC1=CC=CC(Br)=C1 AK-77010 [2,0,0,0,0,0|1,1,0]=4 423 B8R1.4 ClC1=NC(=CC=C1)F AK-32282 [2,0,0,0,0,0|2,0,0]=4 424 B8R1.4 FC1=CC(=CN=C1)O AK-23521 [2,0,0,0,0,0|2,0,0]=4 425 B8R1.4 FC1=CC(I)=CN=C1 AK-50098 [2,0,0,0,0,0|2,0,0]=4 426 B8R1.4 FC1=CC=CC(Br)=C1 AK-88414 [2,0,0,0,0,0|1,0,0]=3 427 B8R1.4 FC1=CC=CC(N)=N1 AK-28849 [2,0,0,0,0,0|1,0,0]=3 428 B8R1.4 FC1=NC=CC(=C1)O AK-29007 [2,0,0,0,0,0|2,0,0]=4 429 B8R1.4 IC1=CC(Cl)=CC=C1 AK-48399 [2,0,0,0,0,0|1,1,0]=4 430 B8R1.4 IC1=CC(F)=NC=C1 AK-25615 [2,0,0,0,0,0|2,0,0]=4 431 B8R1.4 IC1=CC(I)=CC=C1 AK-76947 [2,0,0,0,0,0|1,1,0]=4 432 B8R1.4 NC1=CC(=CN=C1)Cl AK-23676 [2,0,0,0,0,0|1,1,0]=4 433 B8R1.4 NC1=CC(=CN=C1)F AK-25590 [2,0,0,0,0,0|1,0,0]=3 434 B8R1.4 NC1=CC(=CN=C1)O AK-23677 [2,0,0,0,0,0|2,0,0]=4 435 B8R1.4 NC1=CC(=CN=C1)O AK-27981 [2,0,0,0,0,0|2,0,0]=4 436 B8R1.4 NC1=CC(=NC=C1)C AK-28926 [2,0,0,0,0,0|2,0,0]=4 437 B8R1.4 NC1=CC(=NC=C1)F AK-23726 [2,0,0,0,0,0|1,0,0]=3 438 B8R1.4 NC1=CC(=NC=C1)O AK-23727 [2,0,0,0,0,0|2,0,0]=4 439 B8R1.4 NC1=CC(Br)=CN=C1 AK-31985 [2,0,0,0,0,0|1,1,0]=4 440 B8R1.4 NC1=CC(N)=CN=C1 AK-81907 [2,0,0,0,0,0|2,0,0]=4 441 B8R1.4 NC1=CC=CC(I)=C1 AK-95998 [2,0,0,0,0,0|0,1,0]=3 442 B8R1.4 NC1=NC(F)=NC=C1 AK342333 [2,0,0,0,0,0|2,0,0]=4 443 B8R1.4 NC1=NC(I)=CC=C1 AK-44440 [2,0,0,0,0,0|1,1,0]=4 444 B8R1.4 NC1=NC=CC(=C1)F AK-28128 [2,0,0,0,0,0|1,0,0]=3 445 B8R1.4 NC1=NC=CC(=C1)O AK-23591 [2,0,0,0,0,0|2,0,0]=4 446 B8R1.4 O=C1C=C(F)C=CN1 AK-29630 [2,0,0,0,0,0|2,0,0]=4 447 B8R1.4 O=C1C=CC=C(C)N1 AK-29158 [2,0,0,0,0,0|2,0,0]=4 448 B8R1.4 O=C1NC(=CC=C1)N AK-28666 [2,0,0,0,0,0|2,0,0]=4 449 B8R1.4 OC1=CC=CC(I)=C1 AK-88502 [2,0,0,0,0,0|1,1,0]=4 450 B8R1.4 OC1=NC(F)=CC=C1 AK-29320 [2,0,0,0,0,0|2,0,0]=4 451 B8R1.4 OC1=NC=CC(C)=C1 AK-33151 [2,0,0,0,0,0|2,0,0]=4 452 B10R1.2 BrC1=CC=CC(=C1C)OC AK-34653 [1,1,0,0,0,0|1,1,0]=4 453 B10R1.2 BrCC1=C(C(=CC=C1)C)C AK-36442 [1,1,0,0,0,0|2,0,0]=4 454 B10R1.2 C1=C(C(=C(C=C1)F)C)C=O AK-33342 [1,1,0,0,0,0|1,0,1]=4 455 B10R1.2 C1=CC=C(C(=C1OC)F)F AK-47470 [1,1,0,0,0,0|1,0,0]=3 456 B10R1.2 CC1=C(C)C(OC)=CC=C1 AK117499 [1,1,0,0,0,0|2,0,0]=4 457 B10R1.2 CC1=CC=CC(CO)=C1C AK-58580 [1,1,0,0,0,0|2,0,0]=4 458 B10R1.2 CC1=CC=CC(OC)=C1O AK390061 [1,1,0,0,0,0|2,0,0]=4 459 B10R1.2 CCC1=CC=CC(O)=C1O AK103077 [1,1,0,0,0,0|1,0,0]=3 460 B10R1.2 COC1=C(Br)C(Br)=CC=C1 AK135817 [1,1,0,0,0,0|1,1,0]=4 461 B10R1.2 COC1=C(Cl)C(Cl)=CC=C1 AK-87701 [1,1,0,0,0,0|1,1,0]=4 462 B10R1.2 COC1=CC=CC(=C1Br)F AK-35197 [1,1,0,0,0,0|1,0,0]=3 463 B10R1.2 COC1=CC=CC(=C1C)N AK-25555 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.2 COC1=CC=CC(Br)=C1F AK-34561 [1,1,0,0,0,0|1,1,0]=4 465 B10R1.2 COC1=CC=CC(Cl)=C1N AK109648 [1,1,0,0,0,0|1,1,0]=4 466 B10R1.2 COC1=CC=CC(O)=C1Br AK-58508 [1,1,0,0,0,0|2,0,0]=4 467 B10R1.2 COC1=CC=CC(O)=C1N AK104920 [1,1,0,0,0,0|2,0,0]=4 468 B10R1.2 ClC1=C(C=CC=C1OC)O AK-21964 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.2 ClC1=C(C=O)C=CC=C1F AK-27086 [1,1,0,0,0,0|1,0,1]=4 470 B10R1.2 ClC1=C(N)C=CC=C1OC AK-24860 [1,1,0,0,0,0|2,0,0]=4 471 B10R1.2 ClC1=CC=CC(=C1F)OC AK-70913 [1,1,0,0,0,0|1,1,0]=4 472 B10R1.2 FC1=C(Br)C(CBr)=CC=C1 AK-53660 [1,1,0,0,0,0|1,0,0]=3 473 B10R1.2 FC1=C(C(=CC=C1)C=O)O AK-24776 [1,1,0,0,0,0|1,0,1]=4 474 B10R1.2 FC1=C(Cl)C(CBr)=CC=C1 AK-80100 [1,1,0,0,0,0|1,0,0]=3 475 B10R1.2 FC1=C(F)C(CO)=CC=C1 AK-48486 [1,1,0,0,0,0|1,0,0]=3 476 B10R1.2 FC1=C(N)C=CC=C1OC AK-36420 [1,1,0,0,0,0|2,0,0]=4 477 B10R1.2 N#CC1=CC=CC(F)=C1C AK-33837 [1,1,0,0,0,0|0,0,2]=4 478 B10R1.2 N#CC1=CC=CC(F)=C1F AK-48471 [1,1,0,0,0,0|0,0,2]=4 479 B10R1.2 N#CC1=CC=CC(F)=C1I AK-48835 [1,1,0,0,0,0|0,0,2]=4 480 B10R1.2 NC1=C(C#N)C=CC=C1F AK-32910 [1,1,0,0,0,0|0,0,2]=4 481 B10R1.2 NC1=C(C)C=CC=C1OC AK-35383 [1,1,0,0,0,0|2,0,0]=4 482 B10R1.2 NC1=C(C=CC=C1Cl)CO AK-31075 [1,1,0,0,0,0|1,1,0]=4 483 B10R1.2 NC1=C(OC)C=CC=C1F AK-35198 [1,1,0,0,0,0|1,0,0]=3 484 B10R1.2 NC1=C(OC)C=CC=C1I AK-76986 [1,1,0,0,0,0|1,1,0]=4 485 B10R1.2 NC1=CC=CC(=C1F)CO AK-27097 [1,1,0,0,0,0|2,0,0]=4 486 B10R1.2 NC1=CC=CC(OC)=C1Br AK-45647 [1,1,0,0,0,0|2,0,0]=4 487 B10R1.2 NCC1=CC=CC(Br)=C1F AK-43191 [1,1,0,0,0,0|0,1,0]=3 488 B10R1.2 NNC1=CC=CC(Cl)=C1F AK-35434 [1,1,0,0,0,0|1,1,0]=4 489 B10R1.2 NNC1=CC=CC(F)=C1F AK406788 [1,1,0,0,0,0|1,0,0]=3 490 B10R1.2 O=CC1=CC=CC(F)=C1Br AK-75859 [1,1,0,0,0,0|1,0,1]=4 491 B10R1.2 OC1=C(C)C=CC=C1CN AK338973 [1,1,0,0,0,0|1,0,0]=3 492 B10R1.2 OC1=C(OC)C=CC=C1Br AK-93007 [1,1,0,0,0,0|1,1,0]=4 493 B10R1.2 OC1=C(OC)C=CC=C1I AK113106 [1,1,0,0,0,0|1,1,0]=4 494 B10R1.2 OC1=C(OC)C=CC=C1N AK128378 [1,1,0,0,0,0|2,0,0]=4 495 B10R1.2 OCC1=C(F)C(Br)=CC=C1 AK-48980 [1,1,0,0,0,0|1,1,0]=4 496 B10R1.2 OCC1=CC=CC(Br)=C1N AK-47203 [1,1,0,0,0,0|1,1,0]=4 497 B10R1.2 OCC1=CC=CC(Cl)=C1Cl AK-94212 [1,1,0,0,0,0|1,1,0]=4 498 B10R1.2 OCC1=CC=CC(I)=C1Br AK-94351 [1,1,0,0,0,0|1,1,0]=4 499 B10R1.2 OCC1=CC=CC(N)=C1N AK402049 [1,1,0,0,0,0|2,0,0]=4 500 B10R1.8 BrCC1=CC(Br)=CC(Br)=C1 AK161843 [1,1,0,0,0,0|1,1,0]=4 501 B10R1.8 C1=C(C=C(C=C1C)F)C#N AK-34125 [1,1,0,0,0,0|0,0,2]=4 502 B10R1.8 C1=C(C=C(C=C1C=O)Cl)F AK-49147 [1,1,0,0,0,0|1,0,1]=4 503 B10R1.8 C1=C(C=C(C=C1CBr)C)C AK-68241 [1,1,0,0,0,0|2,0,0]=4 504 B10R1.8 C1=C(C=C(C=C1CO)Cl)Cl AK-44986 [1,1,0,0,0,0|1,1,0]=4 505 B10R1.8 C1=C(C=C(C=C1Cl)CCl)Cl AK-72944 [1,1,0,0,0,0|1,1,0]=4 506 B10R1.8 C1=C(C=C(C=C1Cl)Cl)CN AK-46560 [1,1,0,0,0,0|0,1,0]=3 507 B10R1.8 C1=C(C=C(C=C1F)I)C#N AK-36220 [1,1,0,0,0,0|0,0,2]=4 508 B10R1.8 C1=C(Cl)C=C(F)C=C1C#N AK-48945 [1,1,0,0,0,0|0,0,2]=4 509 B10R1.8 C1=C(NN)C=C(C=C1Cl)Cl AK-49098 [1,1,0,0,0,0|1,1,0]=4 510 B10R1.8 CC1=CC(=CC(=C1)NN)C AK-47458 [1,1,0,0,0,0|2,0,0]=4 511 B10R1.8 CC1=CC(OC)=CC(Br)=C1 AK-45494 [1,1,0,0,0,0|1,1,0]=4 512 B10R1.8 CC1=CC(OC)=CC(F)=C1 AK-63350 [1,1,0,0,0,0|1,0,0]=3 513 B10R1.8 COC1=CC(Br)=CC(Br)=C1 AK-76710 [1,1,0,0,0,0|1,1,0]=4 514 B10R1.8 COC1=CC(Cl)=CC(Br)=C1 AK-61610 [1,1,0,0,0,0|1,1,0]=4 515 B10R1.8 COC1=CC(F)=CC(Br)=C1 AK-34563 [1,1,0,0,0,0|1,0,0]=3 516 B10R1.8 COC1=CC(F)=CC(F)=C1 AK-48808 [1,1,0,0,0,0|1,0,0]=3 517 B10R1.8 COC1=CC(N)=CC(Br)=C1 AK-79156 [1,1,0,0,0,0|1,1,0]=4 518 B10R1.8 COC1=CC(N)=CC(F)=C1 AK-34258 [1,1,0,0,0,0|1,0,0]=3 519 B10R1.8 FC1=CC(=CC(=C1)O)OC AK-51326 [1,1,0,0,0,0|1,0,0]=3 520 B10R1.8 FC1=CC(=CC(F)=C1)C#C AK-40196 [1,1,0,0,0,0|0,0,2]=4 521 B10R1.8 FC1=CC(Br)=CC(CBr)=C1 AK-53880 [1,1,0,0,0,0|1,0,0]=3 522 B10R1.8 N#CC1=CC(F)=CC(Br)=C1 AK-33788 [1,1,0,0,0,0|0,0,2]=4 523 B10R1.8 N#CC1=CC(F)=CC(N)=C1 AK-25594 [1,1,0,0,0,0|0,0,2]=4 524 B10R1.8 NC1=CC(C)=CC(OC)=C1 AK-48405 [1,1,0,0,0,0|2,0,0]=4 525 B10R1.8 NC1=CC(OC)=CC(Cl)=C1 AK-94383 [1,1,0,0,0,0|1,1,0]=4 526 B10R1.8 NNC1=CC(F)=CC(F)=C1 AK-88784 [1,1,0,0,0,0|1,0,0]=3 527 B10R1.8 NNC1=CC(F)=NC(F)=C1 AK165604 [1,1,0,0,0,0|2,0,0]=4 528 B10R1.8 NOC1=CC(Cl)=CC(Cl)=C1 AK141702 [1,1,0,0,0,0|1,1,0]=4 529 B10R1.8 O=CC1=CC(C)=CC(F)=C1 AK-33874 [1,1,0,0,0,0|1,0,1]=4 530 B10R1.8 O=CC1=CC(F)=CC(Br)=C1 AK-31133 [1,1,0,0,0,0|1,0,1]=4 531 B10R1.8 O=CC1=CC(F)=CC(F)=C1 AK-51227 [1,1,0,0,0,0|1,0,1]=4 532 B10R1.8 OC1=CC(=CC(F)=C1)C#N AK-64303 [1,1,0,0,0,0|0,0,2]=4 533 B10R1.8 OC1=CC(OC)=CC(Br)=C1 AK105689 [1,1,0,0,0,0|1,1,0]=4 534 B10R1.8 OC1=CC(OC)=CC(Cl)=C1 AK-80058 [1,1,0,0,0,0|1,1,0]=4 535 B10R1.8 OCC1=CC(Br)=CC(Br)=C1 AK113197 [1,1,0,0,0,0|1,1,0]=4 536 B10R1.8 OCC1=CC(Cl)=CC(N)=C1 AK-38634 [1,1,0,0,0,0|1,1,0]=4 537 B10R1.8 OCC1=CC(F)=CC(Br)=C1 AK-34122 [1,1,0,0,0,0|1,0,0]=3 538 B10R1.30 BrC1=C(C=C(C=C1)Cl)OC AK-33708 [1,1,0,0,0,0|1,1,0]=4 539 B10R1.30 BrC1=C(C=C(C=C1)F)CO AK-37845 [1,1,0,0,0,0|1,0,0]=3 540 B10R1.30 BrC1=C(C=C(N)C=C1)OC AK-33882 [1,1,0,0,0,0|2,0,0]=4 541 B10R1.30 C1=C(Br)C=CC(=C1CO)O AK-34249 [1,1,0,0,0,0|1,1,0]=4 542 B10R1.30 C1=C(C(=CC=C1F)Br)C#N AK-35701 [1,1,0,0,0,0|0,0,2]=4 543 B10R1.30 C1=C(C(=CC=C1F)Br)C=O AK-36950 [1,1,0,0,0,0|1,0,1]=4 544 B10R1.30 C1=C(C(=CC=C1F)C)C=O AK-27209 [1,1,0,0,0,0|1,0,1]=4 545 B10R1.30 C1=C(C(=CC=C1F)O)C=O AK-24761 [1,1,0,0,0,0|1,0,1]=4 546 B10R1.30 C1=C(C(=CC=C1N)F)OC AK-23774 [1,1,0,0,0,0|2,0,0]=4 547 B10R1.30 C1=C(N)C=CC(=C1OC)C AK-33584 [1,1,0,0,0,0|2,0,0]=4 548 B10R1.30 C1=CC(=C(C=C1F)C=O)F AK-46524 [1,1,0,0,0,0|1,0,1]=4 549 B10R1.30 CC1=CC=C(Br)C=C1OC AK-65070 [1,1,0,0,0,0|1,1,0]=4 550 B10R1.30 CC1=CC=C(O)C(CC)=N1 AK-28571 [1,1,0,0,0,0|2,0,0]=4 551 B10R1.30 CCC1=NC(C)=CC=C1O AK-57887 [1,1,0,0,0,0|2,0,0]=4 552 B10R1.30 COC1=C(Br)C=CC(C)=C1 AK-81015 [1,1,0,0,0,0|2,0,0]=4 553 B10R1.30 COC1=C(C)C=CC(C)=C1 AK-60854 [1,1,0,0,0,0|2,0,0]=4 554 B10R1.30 COC1=C(Cl)C=CC(F)=C1 AK-35210 [1,1,0,0,0,0|1,0,0]=3 555 B10R1.30 COC1=C(I)C=CC(N)=C1 AK109901 [1,1,0,0,0,0|2,0,0]=4 556 B10R1.30 COC1=CC(Br)=CC=C1Br AK-36985 [1,1,0,0,0,0|1,1,0]=4 557 B10R1.30 COC1=CC(Br)=CC=C1Cl AK-33621 [1,1,0,0,0,0|1,1,0]=4 558 B10R1.30 COC1=CC(Br)=CC=C1I AK-64617 [1,1,0,0,0,0|1,1,0]=4 559 B10R1.30 COC1=CC(F)=CC=C1Br AK-35209 [1,1,0,0,0,0|1,0,0]=3 560 B10R1.30 COC1=CC(I)=CC=C1Br AK-72575 [1,1,0,0,0,0|1,1,0]=4 561 B10R1.30 COC1=CC(I)=CC=C1Cl AK-33545 [1,1,0,0,0,0|1,1,0]=4 562 B10R1.30 ClC1=C(C=C(C=C1)F)NN AK-35344 [1,1,0,0,0,0|1,0,0]=3 563 B10R1.30 ClC1=C(C=C(N)C=C1)OC AK-46519 [1,1,0,0,0,0|2,0,0]=4 564 B10R1.30 ClC1=CC=C(Br)C(CBr)=C1 AK-86621 [1,1,0,0,0,0|1,1,0]=4 565 B10R1.30 FC1=C(C=C(C=C1)Br)OC AK-44892 [1,1,0,0,0,0|1,1,0]=4 566 B10R1.30 FC1=CC(=C(N)C=C1)OC AK-28545 [1,1,0,0,0,0|1,0,0]=3 567 B10R1.30 FC1=CC(C#N)=C(F)C=C1 AK-48579 [1,1,0,0,0,0|0,0,2]=4 568 B10R1.30 FC1=CC=C(Br)C=C1CC AK136297 [1,1,0,0,0,0|0,1,0]=3 569 B10R1.30 N#CC1=CC(F)=CC=C1C AK-36362 [1,1,0,0,0,0|0,0,2]=4 570 B10R1.30 N#CC1=CC(F)=CC=C1N AK-35848 [1,1,0,0,0,0|0,0,2]=4 571 B10R1.30 N#CC1=CC(F)=CC=C1O AK-98170 [1,1,0,0,0,0|0,0,2]=4 572 B10R1.30 NC1=CC(CO)=C(F)C=C1 AK-80394 [1,1,0,0,0,0|2,0,0]=4 573 B10R1.30 NC1=CC=C(Br)C=C1CN AK144545 [1,1,0,0,0,0|0,1,0]=3 574 B10R1.30 NC1=CC=C(Br)C=C1NC AK-38065 [1,1,0,0,0,0|1,1,0]=4 575 B10R1.30 NC1=CC=C(Br)C=C1OC AK-48941 [1,1,0,0,0,0|1,1,0]=4 576 B10R1.30 NC1=CC=C(C)C=C1NC AK127230 [1,1,0,0,0,0|2,0,0]=4 577 B10R1.30 NC1=CC=C(Cl)C=C1CC AK-41750 [1,1,0,0,0,0|0,1,0]=3 578 B10R1.30 NC1=CC=C(Cl)C=C1NC AK-68011 [1,1,0,0,0,0|1,1,0]=4 579 B10R1.30 NC1=CC=C(N)C=C1OC AK-93492 [1,1,0,0,0,0|2,0,0]=4 580 B10R1.30 NCC1=C(Cl)C=CC(Cl)=C1 AK-77471 [1,1,0,0,0,0|0,1,0]=3 581 B10R1.30 NCC1=C(F)C=CC(Cl)=C1 AK-34410 [1,1,0,0,0,0|0,1,0]=3 582 B10R1.30 NCC1=C(N)C=CC(Br)=C1 AK-45441 [1,1,0,0,0,0|0,1,0]=3 583 B10R1.30 NCC1=CC(Br)=CC=C1Cl AK-39330 [1,1,0,0,0,0|0,1,0]=3 584 B10R1.30 NNC1=CC(Br)=CC=C1Br AK118957 [1,1,0,0,0,0|1,1,0]=4 585 B10R1.30 NNC1=CC(Br)=CC=C1F AK157682 [1,1,0,0,0,0|1,1,0]=4 586 B10R1.30 NNC1=CC(C)=CC=C1C AK-35669 [1,1,0,0,0,0|2,0,0]=4 587 B10R1.30 NNC1=CC(C)=CC=C1Cl AK402174 [1,1,0,0,0,0|2,0,0]=4 588 B10R1.30 NNC1=CC(Cl)=CC=C1C AK402177 [1,1,0,0,0,0|1,1,0]=4 589 B10R1.30 NNC1=CC(F)=CC=C1Br AK205416 [1,1,0,0,0,0|1,0,0]=3 590 B10R1.30 NNC1=CC(F)=CC=C1F AK-64243 [1,1,0,0,0,0|1,0,0]=3 591 B10R1.30 O=C1C=CC(Br)=CN1CC AK156669 [1,1,0,0,0,0|1,1,0]=4 592 B10R1.30 OC1=CC=C(Br)C(CC)=C1 AK207125 [1,1,0,0,0,0|1,0,0]=3 593 B10R1.30 OC1=CC=C(Br)C(OC)=C1 AK-49206 [1,1,0,0,0,0|2,0,0]=4 594 B10R1.30 OC1=CC=C(Br)C=C1OC AK-79389 [1,1,0,0,0,0|1,1,0]=4 595 B10R1.30 OC1=CC=C(C)C=C1OC AK-75601 [1,1,0,0,0,0|2,0,0]=4 596 B10R1.30 OC1=CC=C(C)N=C1CC AK-41005 [1,1,0,0,0,0|2,0,0]=4 597 B10R1.30 OC1=CC=C(F)C(OC)=C1 AK-94399 [1,1,0,0,0,0|2,0,0]=4 598 B10R1.30 OC1=CC=C(N)C=C1OC AK-79118 [1,1,0,0,0,0|2,0,0]=4 599 B10R1.30 OCC1=C(Cl)C=CC(F)=C1 AK-34414 [1,1,0,0,0,0|1,0,0]=3 600 B10R1.30 OCC1=CC(Br)=CC=C1Br AK103133 [1,1,0,0,0,0|1,1,0]=4 601 B10R1.30 OCC1=CC(Br)=CC=C1Cl AK-33393 [1,1,0,0,0,0|1,1,0]=4 602 B10R1.30 OCC1=CC(Br)=CC=C1F AK-37019 [1,1,0,0,0,0|1,1,0]=4 603 B10R1.30 OCC1=CC(Br)=CC=C1N AK-26716 [1,1,0,0,0,0|1,1,0]=4 604 B10R1.30 OCC1=CC(Cl)=CC=C1Br AK-35824 [1,1,0,0,0,0|1,1,0]=4 605 B10R1.30 OCC1=CC(Cl)=CC=C1Cl AK135145 [1,1,0,0,0,0|1,1,0]=4 606 B10R1.30 OCC1=CC(Cl)=CC=C1N AK116363 [1,1,0,0,0,0|1,1,0]=4 607 B10R1.30 OCC1=CC(F)=CC=C1I AK-61202 [1,1,0,0,0,0|1,0,0]=3 608 B10R1.30 OCC1=CC(I)=CC=C1Br AK158350 [1,1,0,0,0,0|1,1,0]=4 609 B10R1.30 OCC1=CC(I)=CC=C1C AK544172 [1,1,0,0,0,0|1,1,0]=4 610 B10R1.113 BrC1=CC(=CC=C1)C(F)F AK-50673 [1,1,0,0,0,0|1,1,0]=4 611 B10R1.113 C1=C(C(C)=O)C=C(C=C1)O AK-46681 [1,1,0,0,0,0|1,0,1]=4 612 B10R1.113 C1=C(C=CC=C1F)C(O)=O AK-53854 [1,1,0,0,0,0|1,0,1]=4 613 B10R1.113 CC(C1=CC(Br)=CC=C1)C AK-61854 [1,1,0,0,0,0|0,1,0]=3 614 B10R1.113 CC(C1=CC(F)=CN=C1)=O AK101043 [1,1,0,0,0,0|1,0,1]=4 615 B10R1.113 CC(C1=CC=CC(Br)=C1)=O AK-44590 [1,1,0,0,0,0|0,1,1]=4 616 B10R1.113 CC(C1=CC=CC(C)=C1)=O AK143347 [1,1,0,0,0,0|1,0,1]=4 617 B10R1.113 CC(C1=NC(F)=CC=C1)=O AK-74181 [1,1,0,0,0,0|1,0,1]=4 618 B10R1.113 CC(N)C1=CC=CC(C)=C1 AK-95787 [1,1,0,0,0,0|1,0,0]=3 619 B10R1.113 CC(O)C1=CC(N)=NC=C1 AK109512 [1,1,0,0,0,0|2,0,0]=4 620 B10R1.113 CC(O)C1=NC(Br)=CC=C1 AK-58995 [1,1,0,0,0,0|1,1,0]=4 621 B10R1.113 CC1=CC=CC(=C1)C(N)=N AK-45199 [1,1,0,0,0,0|1,0,1]=4 622 B10R1.113 CN(C)C1=CC(F)=NC=C1 AK141581 [1,1,0,0,0,0|2,0,0]=4 623 B10R1.113 CN(C)C1=CC=CC(Br)=C1 AK-63444 [1,1,0,0,0,0|1,1,0]=4 624 B10R1.113 C[C@@H](C1=CC=CC(N)=C1)N AK326677 [1,1,0,0,0,0|1,0,0]=3 625 B10R1.113 C[C@@H](N)C1=CC(Br)=NC=C1 AK608012 [1,1,0,0,0,0|1,1,0]=4 626 B10R1.113 C[C@@H](N)C1=CC(Cl)=CN=C1 AK668419 [1,1,0,0,0,0|1,1,0]=4 627 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=C1 AK-33750 [1,1,0,0,0,0|0,1,0]=3 628 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=C1 AK338979 [1,1,0,0,0,0|0,1,0]=3 629 B10R1.113 C[C@@H](N)C1=CC=CC(C)=C1 AK-45077 [1,1,0,0,0,0|1,0,0]=3 630 B10R1.113 C[C@@H](N)C1=CC=CC(C)=C1 AK133442 [1,1,0,0,0,0|1,0,0]=3 631 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 AK-29516 [1,1,0,0,0,0|0,0,0]=2 632 B10R1.113 C[C@@H](N)C1=NC(F)=CC=C1 AK668445 [1,1,0,0,0,0|1,0,0]=3 633 B10R1.113 C[C@@H](O)C1=CC=CC(Cl)=C1 AK103057 [1,1,0,0,0,0|0,1,0]=3 634 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 AK335908 [1,1,0,0,0,0|1,0,0]=3 635 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 AK-33217 [1,1,0,0,0,0|0,1,0]=3 636 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 AK338984 [1,1,0,0,0,0|0,1,0]=3 637 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 AK-35182 [1,1,0,0,0,0|0,0,0]=2 638 B10R1.113 C[C@H](O)C1=CC=CC(Br)=C1 AK-58281 [1,1,0,0,0,0|0,1,0]=3 639 B10R1.113 FC1=CC(B(O)O)=CC=C1 AK-45904 [1,1,0,0,0,0|2,0,0]=4 640 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 AK-16801-7 [1,1,0,0,0,0|0,1,1]=4 641 B10R1.113 NC1=CC(C(C)=O)=CC=C1 AK-83273 [1,1,0,0,0,0|1,0,1]=4 642 B10R1.113 NC1=CC(N(C)C)=CC=C1 AK162007 [1,1,0,0,0,0|2,0,0]=4 643 B10R1.113 NC1=NC(C(C)C)=CC=C1 AK-29534 [1,1,0,0,0,0|2,0,0]=4 644 B10R1.113 N[C@@H](C1=CC=CC(F)=C1)C AK-45028 [1,1,0,0,0,0|0,0,0]=2 645 B10R1.113 N[C@H](C1=CC=CC(F)=C1)C AK-42995 [1,1,0,0,0,0|0,0,0]=2 646 B10R1.113 O=C(N)C1=CC=CC(Br)=C1 AK-61366 [1,1,0,0,0,0|0,1,1]=4 647 B10R1.113 OC1=CC=CC(N(C)C)=C1 AK-51741 [1,1,0,0,0,0|2,0,0]=4 648 B10R1.113 OC1=CC=CC([C@H](N)C)=C1 AK-77840 [1,1,0,0,0,0|1,0,0]=3 649 B10R1.172 BrCC1=CC(CBr)=CC=C1 AK-94069 [1,1,0,0,0,0|1,1,0]=4 650 B10R1.172 C1=C(C=CC=C1C#N)CCl AK-44731 [1,1,0,0,0,0|2,0,0]=4 651 B10R1.172 C1=C(C=CC=C1OC)CN AK-48953 [1,1,0,0,0,0|1,0,0]=3 652 B10R1.172 C1=CC=C(C#N)C=C1CN AK-37373 [1,1,0,0,0,0|1,0,0]=3 653 B10R1.172 CCC1=CC=CC(CC)=N1 AK-89097 [1,1,0,0,0,0|2,0,0]=4 654 B10R1.172 CCC1=CC=CC(CO)=N1 AK-33575 [1,1,0,0,0,0|2,0,0]=4 655 B10R1.172 COC1=CC(=NC=C1)CN AK-30303 [1,1,0,0,0,0|2,0,0]=4 656 B10R1.172 COC1=CC(OC)=CC=C1 AK-91612 [1,1,0,0,0,0|2,0,0]=4 657 B10R1.172 COC1=CC=CC(C#C)=C1 AK-40046 [1,1,0,0,0,0|2,0,0]=4 658 B10R1.172 N#CC1=CC=CC(CC)=C1 AK-81888 [1,1,0,0,0,0|1,0,0]=3 659 B10R1.172 N#CC1=CC=CC(NC)=C1 AK137807 [1,1,0,0,0,0|2,0,0]=4 660 B10R1.172 N#CC1=CC=CC(OC)=C1 AK-88694 [1,1,0,0,0,0|2,0,0]=4 661 B10R1.172 N#CC1=CC=NC(CC)=C1 AK149177 [1,1,0,0,0,0|2,0,0]=4 662 B10R1.172 NCC1=CC=CC(C#C)=C1 AK127841 [1,1,0,0,0,0|1,0,0]=3 663 B10R1.172 NCC1=NC=CC(OC)=C1 AK145886 [1,1,0,0,0,0|2,0,0]=4 664 B10R1.172 NNC1=CC=CC(C#N)=C1 AK-39869 [1,1,0,0,0,0|2,0,0]=4 665 B10R1.172 O=CC1=CC=CC(CBr)=C1 AK-54641 [1,1,0,0,0,0|2,0,0]=4 666 B10R1.172 O=CC1=CC=CC(CC)=C1 AK-94141 [1,1,0,0,0,0|1,0,0]=3 667 B10R1.172 O=CC1=CC=CC(OC)=C1 AK-84426 [1,1,0,0,0,0|2,0,0]=4 668 B10R1.172 O=CC1=NC(CC)=CC=C1 AK100815 [1,1,0,0,0,0|2,0,0]=4 669 B10R1.172 OCC1=CC=CC(OC)=C1 AK106250 [1,1,0,0,0,0|2,0,0]=4 670 B10R1.172 OCC1=NC(CN)=CC=C1 AK683775 [1,1,0,0,0,0|2,0,0]=4 671 B10R1.176 BrC1=C(C=C(C#N)C=C1)F AK-25372 [1,1,0,0,0,0|0,0,2]=4 672 B10R1.176 BrC1=C(C=C(C=C1)OC)F AK-35245 [1,1,0,0,0,0|1,0,0]=3 673 B10R1.176 BrC1=C(C=C(C=C1)OC)O AK-35950 [1,1,0,0,0,0|2,0,0]=4 674 B10R1.176 BrC1=C(C=C(C=O)C=C1)F AK-25371 [1,1,0,0,0,0|1,0,1]=4 675 B10R1.176 BrC1=C(C=CC(=C1)OC)F AK-61342 [1,1,0,0,0,0|1,1,0]=4 676 B10R1.176 BrC1=C(N)C=CC(=C1)OC AK-34684 [1,1,0,0,0,0|1,1,0]=4 677 B10R1.176 BrCC1=CC=C(Br)C(Br)=C1 AK150724 [1,1,0,0,0,0|1,1,0]=4 678 B10R1.176 C1=C(C(=CC=C1CO)Cl)Cl AK-46784 [1,1,0,0,0,0|1,1,0]=4 679 B10R1.176 C1=C(C(=CC=C1OC)N)F AK-35251 [1,1,0,0,0,0|1,0,0]=3 680 B10R1.176 C1=C(C(=CC=C1OC)O)Cl AK-33801 [1,1,0,0,0,0|1,1,0]=4 681 B10R1.176 C1=C(C=CC(=C1Br)O)CO AK-45658 [1,1,0,0,0,0|1,1,0]=4 682 B10R1.176 C1=C(C=CC(=C1F)Cl)C#N AK-32842 [1,1,0,0,0,0|0,0,2]=4 683 B10R1.176 C1=C(C=CC(=C1F)Cl)C=O AK-29387 [1,1,0,0,0,0|1,0,1]=4 684 B10R1.176 C1=C(C=CC(=C1F)N)C#N AK-35927 [1,1,0,0,0,0|0,0,2]=4 685 B10R1.176 C1=C(C=CC(=C1N)C)OC AK-35382 [1,1,0,0,0,0|2,0,0]=4 686 B10R1.176 C1=C(NN)C=C(C(=C1)C)C AK-47561 [1,1,0,0,0,0|2,0,0]=4 687 B10R1.176 CC1=C(Br)C=C(CBr)C=C1 AK104782 [1,1,0,0,0,0|1,1,0]=4 688 B10R1.176 CC1=C(Br)C=C(CO)C=C1 AK104804 [1,1,0,0,0,0|1,1,0]=4 689 B10R1.176 CC1=C(Br)C=CC(CBr)=C1 AK-77564 [1,1,0,0,0,0|2,0,0]=4 690 B10R1.176 CC1=C(F)C=C(NN)C=C1 AK-33474 [1,1,0,0,0,0|1,0,0]=3 691 B10R1.176 CC1=CC(CC)=CC=C1C AK135930 [1,1,0,0,0,0|1,0,0]=3 692 B10R1.176 CC1=CC(CC)=CC=C1I AK149749 [1,1,0,0,0,0|1,0,0]=3 693 B10R1.176 CC1=CC(OC)=CC=C1Br AK-79399 [1,1,0,0,0,0|2,0,0]=4 694 B10R1.176 CC1=CC=C(OC)C=C1Cl AK-35608 [1,1,0,0,0,0|1,1,0]=4 695 B10R1.176 CC1=CC=C(OC)C=C1F AK-35069 [1,1,0,0,0,0|1,0,0]=3 696 B10R1.176 COC1=CC(Br)=C(Br)C=C1 AK-86954 [1,1,0,0,0,0|1,1,0]=4 697 B10R1.176 COC1=CC(Br)=C(C)C=C1 AK-87529 [1,1,0,0,0,0|1,1,0]=4 698 B10R1.176 COC1=CC(Br)=C(I)C=C1 AK-57049 [1,1,0,0,0,0|1,1,0]=4 699 B10R1.176 COC1=CC(N)=C(F)C=C1 AK-35882 [1,1,0,0,0,0|2,0,0]=4 700 B10R1.176 COC1=CC(O)=C(I)C=C1 AK104921 [1,1,0,0,0,0|2,0,0]=4 701 B10R1.176 COC1=CC=C(Br)C(I)=C1 AK110455 [1,1,0,0,0,0|1,1,0]=4 702 B10R1.176 COC1=CC=C(Cl)C(Br)=C1 AK-34474 [1,1,0,0,0,0|1,1,0]=4 703 B10R1.176 COC1=CC=C(Cl)C(F)=C1 AK-53797 [1,1,0,0,0,0|1,0,0]=3 704 B10R1.176 COC1=CC=C(F)C(Cl)=C1 AK113602 [1,1,0,0,0,0|1,1,0]=4 705 B10R1.176 COC1=CC=C(N)C(N)=C1 AK-46468 [1,1,0,0,0,0|2,0,0]=4 706 B10R1.176 COC1=CC=C(O)C(C)=C1 AK-44144 [1,1,0,0,0,0|2,0,0]=4 707 B10R1.176 ClC1=C(C=C(CBr)C=C1)F AK-53882 [1,1,0,0,0,0|1,0,0]=3 708 B10R1.176 FC1=C(I)C=CC(=C1)C#N AK-36755 [1,1,0,0,0,0|0,0,2]=4 709 B10R1.176 FC1=CC(CBr)=CC=C1Br AK-53889 [1,1,0,0,0,0|1,0,0]=3 710 B10R1.176 N#CC1=CC=C(C)C(F)=C1 AK-27738 [1,1,0,0,0,0|0,0,2]=4 711 B10R1.176 N#CC1=CC=C(O)C(F)=C1 AK-35068 [1,1,0,0,0,0|0,0,2]=4 712 B10R1.176 NC1=CC(OC)=CC=C1Br AK-35788 [1,1,0,0,0,0|2,0,0]=4 713 B10R1.176 NC1=CC(OC)=CC=C1Cl AK-34292 [1,1,0,0,0,0|2,0,0]=4 714 B10R1.176 NC1=CC(OC)=CC=C1I AK-33440 [1,1,0,0,0,0|2,0,0]=4 715 B10R1.176 NC1=CC=C(CC)C=C1F AK112540 [1,1,0,0,0,0|0,0,0]=2 716 B10R1.176 NC1=CC=C(CC)C=C1N AK112821 [1,1,0,0,0,0|1,0,0]=3 717 B10R1.176 NC1=CC=C(OC)C=C1C AK-32687 [1,1,0,0,0,0|2,0,0]=4 718 B10R1.176 NC1=CC=C(OC)C=C1Cl AK-61306 [1,1,0,0,0,0|1,1,0]=4 719 B10R1.176 NC1=CC=C(OC)C=C1F AK130572 [1,1,0,0,0,0|1,0,0]=3 720 B10R1.176 NC1=CC=C(OC)C=C1I AK-33894 [1,1,0,0,0,0|1,1,0]=4 721 B10R1.176 NCC1=CC=C(Br)C(Cl)=C1 AK685441 [1,1,0,0,0,0|0,1,0]=3 722 B10R1.176 NCC1=CC=C(Br)C(F)=C1 AK161180 [1,1,0,0,0,0|0,0,0]=2 723 B10R1.176 NCC1=CC=C(Cl)C(F)=C1 AK-86434 [1,1,0,0,0,0|0,0,0]=2 724 B10R1.176 NCC1=NC(Cl)=C(Br)C=C1 AK164147 [1,1,0,0,0,0|1,1,0]=4 725 B10R1.176 NNC1=CC=C(Cl)C(Cl)=C1 AK-40067 [1,1,0,0,0,0|1,1,0]=4 726 B10R1.176 NNC1=CC=C(F)C(F)=C1 AK-79408 [1,1,0,0,0,0|1,0,0]=3 727 B10R1.176 OC1=CC(CC)=CC=C1N AK-93570 [1,1,0,0,0,0|1,0,0]=3 728 B10R1.176 OC1=CC(CO)=CC=C1F AK270577 [1,1,0,0,0,0|2,0,0]=4 729 B10R1.176 OC1=CC(CO)=CC=C1I AK-84465 [1,1,0,0,0,0|2,0,0]=4 730 B10R1.176 OC1=CC(OC)=CC=C1C AK-65055 [1,1,0,0,0,0|2,0,0]=4 731 B10R1.176 OC1=CC(OC)=CC=C1N AK-82144 [1,1,0,0,0,0|2,0,0]=4 732 B10R1.176 OC1=CC=C(CO)C=C1C AK-98675 [1,1,0,0,0,0|2,0,0]=4 733 B10R1.176 OC1=CC=C(OC)C=C1Br AK-33686 [1,1,0,0,0,0|1,1,0]=4 734 B10R1.176 OC1=CC=C(OC)C=C1N AK-34044 [1,1,0,0,0,0|2,0,0]=4 735 B10R1.176 OCC1=CC=C(Br)C(C)=C1 AK-86221 [1,1,0,0,0,0|2,0,0]=4 736 B10R1.176 OCC1=CC=C(Br)C(F)=C1 AK-53787 [1,1,0,0,0,0|1,0,0]=3 737 B10R1.176 OCC1=CC=C(C)C(C)=C1 AK-79908 [1,1,0,0,0,0|2,0,0]=4 738 B10R1.176 OCC1=CC=C(F)C(F)=C1 AK-61983 [1,1,0,0,0,0|1,0,0]=3 739 B10R1.176 OCC1=CC=C(I)C(F)=C1 AK-94385 [1,1,0,0,0,0|1,0,0]=3 740 B10R1.176 SCC1=CC=C(F)C(F)=C1 AK190698 [1,1,0,0,0,0|1,0,0]=3 741 B10R1.1 BrC1=CC=C(C=C1)CC=O AK-25692 [1,1,0,0,0,0|1,0,1]=4 742 B10R1.1 C1=C(C=CC(=C1)Br)CCO AK-35260 [1,1,0,0,0,0|1,0,0]=3 743 B10R1.1 C1=C(C=CC(=C1)Br)CNC AK-16714 [1,1,0,0,0,0|2,0,0]=4 744 B10R1.1 C1=C(C=CC(=C1)Br)OCC AK-47317 [1,1,0,0,0,0|2,0,0]=4 745 B10R1.1 C1=C(C=CC(=C1)F)CC#N AK-46633 [1,1,0,0,0,0|0,0,2]=4 746 B10R1.1 C1=C(C=CC(=C1)O)CCN AK-47332 [1,1,0,0,0,0|0,0,0]=2 747 B10R1.1 C1=CC(=CC=C1CC#N)C AK-46578 [1,1,0,0,0,0|0,0,2]=4 748 B10R1.1 C1=CC(=CC=C1CCO)I AK-40186 [1,1,0,0,0,0|1,0,0]=3 749 B10R1.1 C1=CC(=CC=C1CCO)O AK-35340 [1,1,0,0,0,0|1,0,0]=3 750 B10R1.1 C1=CC(=CC=C1CNC)Cl AK-16704 [1,1,0,0,0,0|2,0,0]=4 751 B10R1.1 CC1=CC=C(CCN)C=C1 AK-49684 [1,1,0,0,0,0|0,0,0]=2 752 B10R1.1 CCCC1=CC=C(Br)C=C1 AK-49955 [1,1,0,0,0,0|1,0,0]=3 753 B10R1.1 CCOC1=CC=C(I)C=C1 AK-46446 [1,1,0,0,0,0|2,0,0]=4 754 B10R1.1 CNCC1=CC=C(N)C=C1 AK-78884 [1,1,0,0,0,0|2,0,0]=4 755 B10R1.1 ClC1=CC=C(CCBr)C=C1 AK-35996 [1,1,0,0,0,0|1,0,0]=3 756 B10R1.1 ClC1=CC=C(CCN)C=C1 AK-72548 [1,1,0,0,0,0|0,0,0]=2 757 B10R1.1 ClC1=CC=C(CCO)C=C1 AK-86505 [1,1,0,0,0,0|1,0,0]=3 758 B10R1.1 FC1=CC=C(C=C1)CCBr AK-42361 [1,1,0,0,0,0|1,0,0]=3 759 B10R1.1 FC1=CC=C(C=C1)NCC AK113245 [1,1,0,0,0,0|2,0,0]=4 760 B10R1.1 FC1=CC=C(CCO)C=C1 AK-51236 [1,1,0,0,0,0|1,0,0]=3 761 B10R1.1 N#CCC1=CC=C(I)C=C1 AK121967 [1,1,0,0,0,0|0,0,2]=4 762 B10R1.1 N#CCC1=CC=C(O)C=C1 AK-33252 [1,1,0,0,0,0|0,0,2]=4 763 B10R1.1 NC1=CC=C(CC#N)C=C1 AK100092 [1,1,0,0,0,0|0,0,2]=4 764 B10R1.1 NC1=CC=C(CCO)C=C1 AK-47701 [1,1,0,0,0,0|1,0,0]=3 765 B10R1.1 NC1=CC=C(COC)C=C1 AK-78891 [1,1,0,0,0,0|2,0,0]=4 766 B10R1.1 NCCC1=CC=C(Br)C=C1 AK-50627 [1,1,0,0,0,0|0,0,0]=2 767 B10R1.1 NCCC1=CC=C(N)C=C1 AK-45820 [1,1,0,0,0,0|0,0,0]=2 768 B10R1.1 NNCC1=CC=C(Cl)C=C1 AK132927 [1,1,0,0,0,0|1,0,0]=3 769 B10R1.1 NNCC1=CC=C(F)C=C1 AK128817 [1,1,0,0,0,0|1,0,0]=3 770 B10R1.1 NOCC1=CC=C(F)C=C1 AK-86671 [1,1,0,0,0,0|1,0,0]=3 771 B10R1.1 OC1=CC=C(CCBr)C=C1 AK-59257 [1,1,0,0,0,0|1,0,0]=3 772 B10R1.1 OC1=CC=C(CCC)C=C1 AK164480 [1,1,0,0,0,0|1,0,0]=3 773 B10R1.1 OC1=CC=C(COC)C=C1 AK-42631 [1,1,0,0,0,0|2,0,0]=4 774 B10R1.1 OC1=CC=C(OCC)C=C1 AK163223 [1,1,0,0,0,0|2,0,0]=4 775 B10R1.1 OCCC1=CC=C(C)N=C1 AK-28132 [1,1,0,0,0,0|2,0,0]=4 776 B10R1.4 BrC1=CC=CC=C1CCO AK-70908 [1,1,0,0,0,0|1,0,0]=3 777 B10R1.4 C1=C(C(=CC=C1)CC#N)Br AK-45669 [1,1,0,0,0,0|0,0,2]=4 778 B10R1.4 CC1=CC=CC=C1CCO AK117334 [1,1,0,0,0,0|1,0,0]=3 779 B10R1.4 CC1=CC=CC=C1CNC AK-89673 [1,1,0,0,0,0|2,0,0]=4 780 B10R1.4 CNCC1=CC=CC=C1Br AK-16712 [1,1,0,0,0,0|2,0,0]=4 781 B10R1.4 CNCC1=CC=CC=C1F AK-16716 [1,1,0,0,0,0|2,0,0]=4 782 B10R1.4 ClC1=CC=CC=C1CCO AK-45697 [1,1,0,0,0,0|1,0,0]=3 783 B10R1.4 FC1=CC=CC=C1CCN AK-98141 [1,1,0,0,0,0|0,0,0]=2 784 B10R1.4 N#CCC1=CC=CC=C1F AK-48152 [1,1,0,0,0,0|0,0,2]=4 785 B10R1.4 N#CCC1=CC=CC=C1N AK-88479 [1,1,0,0,0,0|0,0,2]=4 786 B10R1.4 NC1=CC=CC=C1CCN AK-88349 [1,1,0,0,0,0|0,0,0]=2 787 B10R1.4 NCCC1=C(Cl)C=CC=C1 AK-57465 [1,1,0,0,0,0|0,0,0]=2 788 B10R1.4 NCCC1=CC=CC=C1Br AK-47292 [1,1,0,0,0,0|0,0,0]=2 789 B10R1.4 NNCC1=CC=CC=C1F AK-35444 [1,1,0,0,0,0|1,0,0]=3 790 B10R1.4 NOCC1=CC=CC=C1F AK-69176 [1,1,0,0,0,0|1,0,0]=3 791 B10R1.4 OC1=CC=CC=C1CCN AK114741 [1,1,0,0,0,0|0,0,0]=2 792 B10R1.4 OC1=CC=CC=C1COC AK151421 [1,1,0,0,0,0|2,0,0]=4 793 B10R1.4 OC1=CC=CC=C1OCC AK-94233 [1,1,0,0,0,0|2,0,0]=4 794 B10R1.4 OCCC1=CC=CC=C1I AK149280 [1,1,0,0,0,0|1,0,0]=3 795 B10R1.4 OCCC1=CC=CC=C1N AK-35531 [1,1,0,0,0,0|1,0,0]=3 796 B10R1.15 CC(C1=CC=CC=C1)CN AK-67959 [1,1,0,0,0,0|0,0,0]=2 797 B10R1.15 CC[C@@H](C1=NC=CC=C1)N AK544238 [1,1,0,0,0,0|2,0,0]=4 798 B10R1.15 CC[C@H](C1=NC=CC=C1)N AK668420 [1,1,0,0,0,0|2,0,0]=4 799 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 AK-47624 [1,1,0,0,0,0|0,0,0]=2 800 B10R1.15 C[C@@H](NC)C1=CC=CC=C1 AK140531 [1,1,0,0,0,0|2,0,0]=4 801 B10R1.15 ClC(C=C)C1=CC=CC=C1 AK173991 [1,1,0,0,0,0|1,0,1]=4 802 B10R1.15 FC(C1=CC=CC=C1)CBr AK-93540 [1,1,0,0,0,0|1,0,0]=3 803 B10R1.15 NCC(C1=CC=CC=C1)=O AK-26107 [1,1,0,0,0,0|0,0,1]=3 804 B10R1.15 NCC(O)C1=NC=CC=C1 AK157200 [1,1,0,0,0,0|1,0,0]=3 805 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 AK-45230 [1,1,0,0,0,0|0,0,0]=2 806 B10R1.15 NC[C@@H](O)C1=CC=CN=C1 AK-96401 [1,1,0,0,0,0|1,0,0]=3 807 B10R1.15 N[C@H](C1=CC=CC=C1)CO AK-41249 [1,1,0,0,0,0|1,0,0]=3 808 B10R1.15 OC(C1=CC=CC=C1)CBr AK-76552 [1,1,0,0,0,0|1,0,0]=3 809 B10R1.15 OC(C1=CC=CC=C1)CO AK117070 [1,1,0,0,0,0|1,0,0]=3 810 B10R1.15 OCC(=O)C1=CC=CC=C1 AK-94786 [1,1,0,0,0,0|1,0,1]=4 811 B10R1.15 OCC(N)C1=CC=CC=C1 AK-47370 [1,1,0,0,0,0|1,0,0]=3 812 B10R1.15 O[C@@H](C1=CC=CC=C1)CO AK-45210 [1,1,0,0,0,0|1,0,0]=3 813 B10R1.15 O[C@H](C1=CC=CC=C1)CO AK-33573 [1,1,0,0,0,0|1,0,0]=3 814 B10R1.15 [C@H](N)(C1=CC=CC=C1)CO AK-41260 [1,1,0,0,0,0|1,0,0]=3 815 B10R1.17 BrCCOC1=CC=CC=C1 AK-88423 [1,1,0,0,0,0|1,0,0]=3 816 B10R1.17 C=CCOC1=CC=CC=C1 AK116728 [1,1,0,0,0,0|1,0,1]=4 817 B10R1.17 CCCC[N+]1=CC=CC=C1 AK107641 [1,1,0,0,0,0|2,0,0]=4 818 B10R1.17 CCCC[N+]1=CC=CC=C1 AK676172 [1,1,0,0,0,0|2,0,0]=4 819 B10R1.17 CCCOC1=CC=CC=C1 AK544046 [1,1,0,0,0,0|1,0,0]=3 820 B10R1.17 CCNCC1=CC=NC=C1 AK-48167 [1,1,0,0,0,0|2,0,0]=4 821 B10R1.17 CCNCC1=NC=CC=C1 AK-82541 [1,1,0,0,0,0|2,0,0]=4 822 B10R1.17 CNCCC1=CC=CN=C1 AK-33941 [1,1,0,0,0,0|1,0,0]=3 823 B10R1.17 CNCCC1=NC=CC=C1 AK163686 [1,1,0,0,0,0|1,0,0]=3 824 B10R1.17 ClCCOC1=CC=CC=C1 AK113619 [1,1,0,0,0,0|1,0,0]=3 825 B10R1.17 N#CCNC1=CC=CC=C1 AK109260 [1,1,0,0,0,0|0,0,2]=4 826 B10R1.17 NCCCC1=CC=NC=C1 AK-81582 [1,1,0,0,0,0|1,0,0]=3 827 B10R1.17 NCCNC1=NC=CC=N1 AK-58765 [1,1,0,0,0,0|2,0,0]=4 828 B10R1.17 NCCOC1=CC=CN=C1 AK108382 [1,1,0,0,0,0|1,0,0]=3 829 B10R1.17 NCCOC1=CC=NC=C1 AK158871 [1,1,0,0,0,0|1,0,0]=3 830 B10R1.17 NCCOC1=NC=CC=C1 AK-86743 [1,1,0,0,0,0|1,0,0]=3 831 B10R1.17 NOCCC1=CC=CC=C1 AK-58452 [1,1,0,0,0,0|0,0,0]=2 832 B10R1.17 O=CCCC1=CC=CC=C1 AK-41238 [1,1,0,0,0,0|1,0,0]=3 833 B10R1.17 O=CCOC1=CC=CC=C1 AK-92294 [1,1,0,0,0,0|1,0,1]=4 834 B10R1.17 O=COCC1=CC=CC=C1 AK113965 [1,1,0,0,0,0|1,0,1]=4 835 B10R1.17 OCC#CC1=CC=CC=C1 AK106192 [1,1,0,0,0,0|1,0,1]=4 836 B10R1.17 OCCCC1=CC=CC=C1 AK114527 [1,1,0,0,0,0|1,0,0]=3 837 B10R1.17 OCCCC1=CC=NC=C1 AK-73053 [1,1,0,0,0,0|2,0,0]=4 838 B10R1.17 OCCCC1=NC=CC=C1 AK-82450 [1,1,0,0,0,0|2,0,0]=4 839 B10R1.17 OCCSC1=NC=CC=C1 AK387693 [1,1,0,0,0,0|2,0,0]=4 840 B10R1.17 [NH]CCOC1=CC=CC=C1 AK-46660 [1,1,0,0,0,0|0,0,1]=3 841 B10R1.18 CC(C)OC1=CC=CC=C1 AK110874 [1,1,0,0,0,0|2,0,0]=4 842 B10R1.18 FC(F)OC1=CC=CC=C1 AK161726 [1,1,0,0,0,0|2,0,0]=4 843 B10R1.18 N=C(N)CC1=CC=CC=C1 AK-77604 [1,1,0,0,0,0|0,0,1]=3 844 B10R1.18 NC(NC1=CC=CC=C1)=N AK117130 [1,1,0,0,0,0|1,0,1]=4 845 B10R1.18 O=C(N)CC1=CC=CC=C1 AK-45803 [1,1,0,0,0,0|0,0,1]=3 846 B10R1.18 O=C(N)CC1=CC=CN=C1 AK-81612 [1,1,0,0,0,0|1,0,1]=4 847 B10R1.18 S=C(N)NC1=CC=CC=C1 AK305328 [1,1,0,0,0,0|1,0,1]=4 848 B12R1.24 CC1=C(F)C=CC=C1[C@@H](N)CO AK335746 [0,2,0,0,0,0|1,0,0]=3 849 B12R1.24 CC1=C(F)C=CC=C1[C@H](N)CO AK335745 [0,2,0,0,0,0|1,0,0]=3 850 B12R1.24 FC1=C(Cl)C=CC=C1[C@H](N)CO AK607991 [0,2,0,0,0,0|1,1,0]=4 851 B12R1.224 O=C(O)CC1=CC=CC(F)=C1C AK-94142 [0,2,0,0,0,0|1,0,1]=4 852 B12R1.224 O=C(O)CC1=CC=CC(F)=C1Cl AK101139 [0,2,0,0,0,0|1,0,1]=4 853 B12R1.224 O=C(O)CC1=CC=CC(F)=C1F AK-44652 [0,2,0,0,0,0|1,0,1]=4 854 B12R1.542 N#CC1=C(F)C=CC=C1OCC AK115717 [0,2,0,0,0,0|2,0,0]=4 855 B12R1.544 CCOC1=C(F)C(F)=C(Br)C=C1 AK-47899 [0,2,0,0,0,0|2,0,0]=4 856 B12R1.544 OC1=CC=C(OCC)C(F)=C1F AK112648 [0,2,0,0,0,0|2,0,0]=4 857 B12R1.10 CC(C)(C1=CC=CC(Br)=C1)CO AK158872 [0,2,0,0,0,0|1,1,0]=4 858 B12R1.17 OCCC(N)C1=CC=CC(Cl)=C1 AK-44745 [0,2,0,0,0,0|1,1,0]=4 859 B12R1.354 CC[C@@H](C1=CC(F)=CC=C1F)N AK134085 [0,2,0,0,0,0|1,0,0]=3 860 B12R1.354 FC1=CC=C(F)C([C@H](N)CO)=C1 AK172746 [0,2,0,0,0,0|1,0,0]=3 861 B12R1.358 ClC1=CC(Cl)=CC(C(N)CO)=C1 AK-85685 [0,2,0,0,0,0|1,1,0]=4 862 B12R1.358 FC1=CC(F)=CC([C@@H](N)CO)=C1 AK167672 [0,2,0,0,0,0|1,0,0]=3 863 B12R1.358 FC1=CC(F)=CC([C@H](N)CO)=C1 AK548218 [0,2,0,0,0,0|1,0,0]=3 864 B12R1.367 CCC(C1=CC=C(F)C(F)=C1)=O AK115109 [0,2,0,0,0,0|1,0,1]=4 865 B12R1.367 CC[C@@H](C1=CC=C(F)C(F)=C1)N AK133446 [0,2,0,0,0,0|1,0,0]=3 866 B12R1.367 CC[C@H](C1=CC=C(F)C(F)=C1)N AK133434 [0,2,0,0,0,0|1,0,0]=3 867 B12R1.367 ClC1=CC=C(C(N)CO)C=C1Cl AK406388 [0,2,0,0,0,0|1,1,0]=4 868 B12R1.367 ClC1=CC=C([C@@H](N)CO)C=C1Cl AK172646 [0,2,0,0,0,0|1,1,0]=4 869 B12R1.367 ClC1=CC=C([C@H](N)CO)C=C1Cl AK159392 [0,2,0,0,0,0|1,1,0]=4 870 B12R1.367 FC1=CC=C([C@H](N)CO)C=C1Cl AK321858 [0,2,0,0,0,0|1,1,0]=4 871 B12R1.435 COC1=CC([C@H](N)CO)=CC=C1 AK544247 [0,2,0,0,0,0|2,0,0]=4 872 B12R1.435 CSC1=CC([C@H](N)CO)=CC=C1 AK607965 [0,2,0,0,0,0|2,0,0]=4 873 B12R1.435 N#CC1=CC=CC([C@@H](N)CO)=C1 AK608006 [0,2,0,0,0,0|2,0,0]=4 874 B12R1.435 N#CC1=CC=CC([C@H](N)CC)=C1 AK-42511 [0,2,0,0,0,0|2,0,0]=4 875 B12R1.435 N[C@@H](C1=CC=CC(OC)=C1)CC AK-42211 [0,2,0,0,0,0|2,0,0]=4 876 B12R1.28 COCCOC1=CC=CC(N)=C1 AK105501 [0,2,0,0,0,0|2,0,0]=4 877 B12R1.50 O=C(OC)CC1=CC=CC(F)=C1 AK161785 [0,2,0,0,0,0|1,0,1]=4 878 B12R1.50 OCC(N)CC1=CC=CC(Cl)=C1 AK158851 [0,2,0,0,0,0|0,1,0]=3 879 B12R1.50 OC[C@@H](N)CC1=CC=CC(Cl)=C1 AK191230 [0,2,0,0,0,0|0,1,0]=3 880 B12R1.226 C1=C(C=CC=C1CCC(O)=O)Cl AK-48858 [0,2,0,0,0,0|1,1,0]=4 881 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 AK-35123 [0,2,0,0,0,0|1,1,0]=4 882 B12R1.226 O=C(O)CCC1=CC=CC(F)=C1 AK-43261 [0,2,0,0,0,0|1,0,0]=3 883 B12R1.226 O=C(O)CCC1=CC=CC(N)=C1 AK-33600 [0,2,0,0,0,0|2,0,0]=4 884 B12R1.226 O=C(O)CCC1=CC=CC(O)=C1 AK-86241 [0,2,0,0,0,0|2,0,0]=4 885 B12R1.226 OC(=O)COC1=CC(F)=CC=C1 AK-83320 [0,2,0,0,0,0|1,0,1]=4 886 B12R1.374 FC1=CC(OCC#C)=C(F)C=C1 AK-79696 [0,2,0,0,0,0|1,0,1]=4 887 B12R1.382 CCNCC1=CC=CC(OC)=C1 AK-97801 [0,2,0,0,0,0|2,0,0]=4 888 B12R1.382 COC1=CC(CCNC)=CC=C1 AK-94115 [0,2,0,0,0,0|1,0,0]=3 889 B12R1.385 OC1=CC(NCCO)=CC=C1C AK-88725 [0,2,0,0,0,0|2,0,0]=4 890 B12R1.41 N#CCC1=CC(OC)=CC(F)=C1 AK-64794 [0,2,0,0,0,0|0,0,2]=4 891 B12R1.44 N#CCC1=CC(F)=C(F)C(F)=C1 AK156133 [0,2,0,0,0,0|0,0,2]=4 892 B12R1.101 O=C(O)CC1=CC(Cl)=CC(F)=C1 AK-33988 [0,2,0,0,0,0|1,0,1]=4 893 B12R1.19 BrC1=C(C=C(C=C1)CC(=O)O)F AK-36941 [0,2,0,0,0,0|1,0,1]=4 894 B12R1.19 CC1=C(F)C=C(CC(O)=O)C=C1 AK-34427 [0,2,0,0,0,0|1,0,1]=4 895 B12R1.19 NC1=C(F)C=C(CC(O)=O)C=C1 AK-35348 [0,2,0,0,0,0|1,0,1]=4 896 B12R1.19 O=C(O)CC1=CC=C(Cl)C(F)=C1 AK-39619 [0,2,0,0,0,0|1,0,1]=4 897 B12R1.19 O=C(O)CC1=CC=C(O)C(F)=C1 AK-35250 [0,2,0,0,0,0|1,0,1]=4 898 B12R1.19 OC(=O)CC1=CC(F)=C(F)C=C1 AK-41956 [0,2,0,0,0,0|1,0,1]=4 899 B12R1.127 FC1=CC=C(Br)C(OC(F)F)=C1 AK-93639 [0,2,0,0,0,0|2,0,0]=4 900 B12R1.127 NC1=CC=C(F)C=C1OC(C)C AK158053 [0,2,0,0,0,0|2,0,0]=4 901 B12R1.127 O=C(O)CC1=CC(F)=CC=C1Br AK-41072 [0,2,0,0,0,0|1,0,1]=4 902 B12R1.270 COC1=CC=C(Br)C(CCO)=C1 AK103214 [0,2,0,0,0,0|2,0,0]=4 903 B12R1.279 OCCC1=CC=CC(=C1)B(O)O AK-77608 [0,2,0,0,0,0|2,0,0]=4 904 B12R1.286 OC1=CC=C(CCN)C=C1OC AK139276 [0,2,0,0,0,0|1,0,0]=3 905 B12R1.288 C1=C(C=CC(=C1F)OC)CC#N AK-39815 [0,2,0,0,0,0|0,0,2]=4 906 B12R1.288 OC1=CC(CCN)=CC=C1OC AK129564 [0,2,0,0,0,0|1,0,0]=3 907 B10R1.25 NCC1=CC=C(F)C=C1F AK-61922 [0,0,1,1,0,0|1,0,1]=4 908 B10R2.31 BrC1=CC=C2CCC2=C1 AK-54784 [1,0,0,1,0,0|0,1,0]=3 909 B10R2.7 C12=C(CNC1)C=CC=C2 AK-46308 [1,0,0,1,0,0|2,0,0]=4 910 B10R2.7 C12=C(NCC1)C=CC=C2 AK-49832 [1,0,0,1,0,0|0,0,0]=2 911 B10R2.7 C12=C(NN=C1)C=CC=C2 AK-49124 [1,0,0,1,0,0|1,0,1]=4 912 B10R2.7 C12=CC=CC=C1N=CN2 AK109037 [1,0,0,1,0,0|1,0,1]=4 913 B10R2.7 C12=CC=CC=C1OCO2 AK-48090 [1,0,0,1,0,0|2,0,0]=4 914 B10R2.7 C12=NC=CC=C1CCN2 AK-23969 [1,0,0,1,0,0|1,0,0]=3 915 B10R2.7 C1=CC=CC2=C1CCO2 AK-35322 [1,0,0,1,0,0|1,0,0]=3 916 B10R2.7 C=12NCCC1C=CN=C2 AK-76917 [1,0,0,1,0,0|1,0,0]=3 917 B10R2.7 C=12NCCC1C=CN=C2 AK138671 [1,0,0,1,0,0|1,0,0]=3 918 B10R2.7 N1N=NC2=C1C=CC=C2 AK-44446 [1,0,0,1,0,0|2,0,0]=4 919 B10R2.320 BrC1C2=CC=CC=C2C1 AK163275 [1,0,0,1,0,0|1,0,0]=3 920 B10R2.320 C1=CC=CC2=C1CC2=O AK-72898 [1,0,0,1,0,0|1,0,1]=4 921 B12R2.82 CC1=C(F)C=CC2=C1C=NN2 AK136946 [0,1,0,1,0,0|1,0,1]=4 922 B12R2.82 FC1=C(Cl)C2=C(NC=C2)C=C1 AK-33639 [0,1,0,1,0,0|0,0,2]=4 923 B12R2.82 FC1=C(F)C=CC2=C1NN=C2 AK152828 [0,1,0,1,0,0|1,0,1]=4 924 B12R2.202 FC1=C2NC(Cl)=NC2=CC=C1 AK-30683 [0,1,0,1,0,0|1,0,1]=4 925 B12R2.202 FC1=CC=CC2=C1NC(=O)S2 AK-87026 [0,1,0,1,0,0|1,0,1]=4 926 B12R2.202 NC1=NC2=C(F)C=CC=C2S1 AK-87186 [0,1,0,1,0,0|1,0,1]=4 927 B12R2.202 O=C1NC2=C(C=CC=C2Br)C1 AK-41628 [0,1,0,1,0,0|0,1,1]=4 928 B12R2.202 O=C1NC2=C(C=CC=C2Cl)C1 AK-31070 [0,1,0,1,0,0|0,1,1]=4 929 B12R2.202 O=C1NC2=C(C=CC=C2F)C1 AK-51558 [0,1,0,1,0,0|0,0,1]=3 930 B12R2.202 O=C1NC2=C(F)C=CC=C2N1 AK-46854 [0,1,0,1,0,0|1,0,1]=4 931 B12R2.202 OC1CC2=C(C(Br)=CC=C2)C1 AK146728 [0,1,0,1,0,0|1,1,0]=4 932 B12R2.202 S=C1SC2=CC=CC(F)=C2N1 AK119590 [0,1,0,1,0,0|1,0,1]=4 933 B12R2.1081 BrC1=C2CNCCC2=CC=C1 AK-24976 [0,1,0,1,0,0|0,1,0]=3 934 B12R2.1081 BrC1=CC=CC2=C1CCCN2 AK-32886 [0,1,0,1,0,0|1,1,0]=4 935 B12R2.1081 BrC1=CC=CC2=C1CCCN2 AK-75613 [0,1,0,1,0,0|1,1,0]=4 936 B12R2.1081 BrC1=CC=CC2=C1CCCO2 AK174586 [0,1,0,1,0,0|1,1,0]=4 937 B12R2.1081 BrC1=CC=CC2=C1CCNC2 AK-30487 [0,1,0,1,0,0|1,1,0]=4 938 B12R2.1081 BrC1=CC=CC2=C1CCNC2 AK-31737 [0,1,0,1,0,0|1,1,0]=4 939 B12R2.1081 BrC1=CC=CC2=C1CNCC2 AK-74291 [0,1,0,1,0,0|0,1,0]=3 940 B12R2.1081 BrC1=CC=CC2=C1OCCC2 AK172683 [0,1,0,1,0,0|1,1,0]=4 941 B12R2.1081 C1=CC=C(O)C2=C1CCCN2 AK-26240 [0,1,0,1,0,0|1,0,0]=3 942 B12R2.1081 C1=CC=C2OCCOC2=C1O AK-24644 [0,1,0,1,0,0|2,0,0]=4 943 B12R2.1081 CC1=C2C(=CC=C1)NCCC2 AK-39845 [0,1,0,1,0,0|2,0,0]=4 944 B12R2.1081 ClC1=C2C(=CC=C1)NCCC2 AK-39782 [0,1,0,1,0,0|1,1,0]=4 945 B12R2.1081 ClC1=CC=CC2=C1CNCC2 AK-74292 [0,1,0,1,0,0|0,1,0]=3 946 B12R2.1081 ClC1=CC=CC2=C1NCCC2 AK151548 [0,1,0,1,0,0|0,1,0]=3 947 B12R2.1081 FC1=C2OCCNC2=CC=C1 AK-26964 [0,1,0,1,0,0|1,0,0]=3 948 B12R2.1081 FC1=CC=CC2=C1CCNC2 AK-30479 [0,1,0,1,0,0|1,0,0]=3 949 B12R2.1081 NC1=CC=CC2=C1CCNC2 AK101759 [0,1,0,1,0,0|2,0,0]=4 950 B12R2.1081 NC1=CC=CC2=C1CNCC2 AK101863 [0,1,0,1,0,0|1,0,0]=3 951 B12R2.1081 OC1=CC=CC2=C1CNCC2 AK101812 [0,1,0,1,0,0|1,0,0]=3 952 B12R2.132 FC1=CC=C2[NH]N=C(C2=C1)I AK-23832 [0,1,0,1,0,0|1,0,1]=4 953 B12R2.132 NC1CCC2=C1C=C(Cl)C=C2 AK-36062 [0,1,0,1,0,0|1,1,0]=4 954 B12R2.132 NC1CCC2=C1C=C(F)C=C2 AK164000 [0,1,0,1,0,0|1,0,0]=3 955 B12R2.132 N[C@@H]1CCC2=C1C=C(F)C=C2 AK-42229 [0,1,0,1,0,0|1,0,0]=3 956 B12R2.132 N[C@H]1CCC2=C1C=C(F)C=C2 AK-42484 [0,1,0,1,0,0|1,0,0]=3 957 B12R2.132 OC1CCC2=C1C=C(Br)C=C2 AK146224 [0,1,0,1,0,0|1,1,0]=4 958 B12R2.196 BrC1=N[NH]C2=C(C=CC=C12)F AK-30610 [0,1,0,1,0,0|1,0,1]=4 959 B12R2.196 NC1CCC2=C(F)C=CC=C12 AK-80219 [0,1,0,1,0,0|1,0,0]=3 960 B12R2.196 NC1CCC2=C1C=CC=C2Br AK174612 [0,1,0,1,0,0|1,1,0]=4 961 B12R2.196 NC1CCC2=C1C=CC=C2Cl AK164257 [0,1,0,1,0,0|1,1,0]=4 962 B12R2.196 NC1COC2=C(Br)C=CC=C12 AK684522 [0,1,0,1,0,0|1,1,0]=4 963 B12R2.196 N[C@@H]1CCC2=C1C=CC=C2Br AK-42512 [0,1,0,1,0,0|1,1,0]=4 964 B12R2.196 N[C@@H]1COC2=C(Br)C=CC=C12 AK677834 [0,1,0,1,0,0|1,1,0]=4 965 B12R2.196 N[C@@H]1COC2=C(Cl)C=CC=C12 AK677835 [0,1,0,1,0,0|1,1,0]=4 966 B12R2.196 N[C@H]1CCC2=C1C=CC=C2Br AK-42513 [0,1,0,1,0,0|1,1,0]=4 967 B12R2.196 N[C@H]1CCC2=C1C=CC=C2F AK-42269 [0,1,0,1,0,0|1,0,0]=3 968 B12R2.196 O=C1CCC2=C1C=CC=C2F AK-30423 [0,1,0,1,0,0|1,0,1]=4 969 B12R2.24 BrC1=CC2=C(C=C1)CCCN2 AK-74154 [0,1,0,1,0,0|1,1,0]=4 970 B12R2.24 BrC1=CC2=C(C=C1)CCCO2 AK172637 [0,1,0,1,0,0|1,1,0]=4 971 B12R2.24 BrC1=CC2=C(C=C1)CCNC2 AK-30489 [0,1,0,1,0,0|1,1,0]=4 972 B12R2.24 BrC1=CC2=C(C=C1)NCCO2 AK-31794 [0,1,0,1,0,0|0,1,0]=3 973 B12R2.24 BrC1=CC2=C(C=C1)NCCO2 AK-57130 [0,1,0,1,0,0|0,1,0]=3 974 B12R2.24 BrC1=CC2=C(CCCC2)C=C1 AK105097 [0,1,0,1,0,0|1,1,0]=4 975 B12R2.24 BrC1=CC2=C(CNCC2)C=C1 AK-30488 [0,1,0,1,0,0|0,1,0]=3 976 B12R2.24 BrC1=CC2=C(NCCC2)C=C1 AK-24972 [0,1,0,1,0,0|0,1,0]=3 977 B12R2.24 BrC1=CC=C2CCOCC2=C1 AK-87302 [0,1,0,1,0,0|1,1,0]=4 978 B12R2.24 BrC1=CC=C2CNCCC2=C1 AK-25184 [0,1,0,1,0,0|0,1,0]=3 979 B12R2.24 BrC1=CC=C2OCCNC2=C1 AK-28714 [0,1,0,1,0,0|1,1,0]=4 980 B12R2.24 BrC1=CN=C2C(OCCN2)=C1 AK-82737 [0,1,0,1,0,0|1,1,0]=4 981 B12R2.24 C1=C(C=C2C(=C1)CCCN2)O AK-26152 [0,1,0,1,0,0|2,0,0]=4 982 B12R2.24 C1=C(O)C=C2C(=C1)CCCC2 AK-47633 [0,1,0,1,0,0|2,0,0]=4 983 B12R2.24 C1=C(O)C=CC2=C1CCCN2 AK-25789 [0,1,0,1,0,0|1,0,0]=3 984 B12R2.24 C1C2=CC=C(C=C2CCN1)O AK-33289 [0,1,0,1,0,0|1,0,0]=3 985 B12R2.24 CC1=CC2=C(C=C1)CCCN2 AK-44791 [0,1,0,1,0,0|2,0,0]=4 986 B12R2.24 CC1=CC2=C(CCCC2)C=C1 AK-61038 [0,1,0,1,0,0|2,0,0]=4 987 B12R2.24 CC1=CC=C2C(=C1)CNCC2 AK-27238 [0,1,0,1,0,0|2,0,0]=4 988 B12R2.24 ClC1=CC2=C(C=C1)CCCN2 AK545138 [0,1,0,1,0,0|1,1,0]=4 989 B12R2.24 ClC1=CC2=C(C=C1)CCNC2 AK-36483 [0,1,0,1,0,0|1,1,0]=4 990 B12R2.24 ClC1=CC2=C(C=C1)NCCO2 AK-47683 [0,1,0,1,0,0|0,1,0]=3 991 B12R2.24 ClC1=CC2=C(CCCN2)C=C1 AK-64273 [0,1,0,1,0,0|1,1,0]=4 992 B12R2.24 ClC1=CC2=C(CNCC2)C=C1 AK-28677 [0,1,0,1,0,0|0,1,0]=3 993 B12R2.24 ClC1=CC=C2NCCCC2=C1 AK-43157 [0,1,0,1,0,0|0,1,0]=3 994 B12R2.24 ClC1=NC2=C(C=C1)NCCN2 AK-31088 [0,1,0,1,0,0|1,1,0]=4 995 B12R2.24 ClC1=NC2=C(CNCC2)C=C1 AK-27507 [0,1,0,1,0,0|1,1,0]=4 996 B12R2.24 ClC1=NC2=C(CNCC2)C=C1 AK-28329 [0,1,0,1,0,0|1,1,0]=4 997 B12R2.24 FC1=CC2=C(C=C1)OCCN2 AK-26963 [0,1,0,1,0,0|1,0,0]=3 998 B12R2.24 FC1=CC2=C(NCCC2)C=C1 AK115880 [0,1,0,1,0,0|0,0,0]=2 999 B12R2.24 FC1=CC=C2OCCNC2=C1 AK-75887 [0,1,0,1,0,0|1,0,0]=3 1000 B12R2.24 NC1=CC2=C(C=C1)CCNC2 AK-68791 [0,1,0,1,0,0|2,0,0]=4 1001 B12R2.24 OC1=CC2=C(CNCC2)C=C1 AK-44277 [0,1,0,1,0,0|1,0,0]=3 1002 B12R2.24 OC1=CC=2CCCOC2C=C1 AK-66832 [0,1,0,1,0,0|2,0,0]=4 1003 B12R2.24 OC1=CC=C2OCCNC2=C1 AK-94231 [0,1,0,1,0,0|2,0,0]=4 1004 B12R2.24 OC1=CC=C2OCCOC2=C1 AK-37842 [0,1,0,1,0,0|2,0,0]=4 1005 B12R2.203 CC1=CC=CC2=C1C(=O)CC2 AK-41002 [0,1,0,1,0,0|2,0,0]=4 1006 B12R2.203 FC1=C2C(=O)COC2=CC=C1 AK100224 [0,1,0,1,0,0|1,0,1]=4 1007 B12R2.203 FC1=C2C(CCC2=CC=C1)=O AK-30094 [0,1,0,1,0,0|1,0,0]=3 1008 B12R2.203 NC1=NNC2=CC=CC(F)=C12 AK-79353 [0,1,0,1,0,0|1,0,1]=4 1009 B12R2.203 NC1CCC2=C1C(Br)=CC=C2 AK608488 [0,1,0,1,0,0|0,1,0]=3 1010 B12R2.203 N[C@H]1CCC2=C1C(F)=CC=C2 AK608001 [0,1,0,1,0,0|0,0,0]=2 1011 B12R2.203 O=C1CCC2=C1C(Br)=CC=C2 AK-28759 [0,1,0,1,0,0|1,1,0]=4 1012 B12R2.203 O=C1CCC2=C1C(Cl)=CC=C2 AK-29207 [0,1,0,1,0,0|1,1,0]=4 1013 B12R2.203 O=C1CCC2=C1C(N)=CC=C2 AK-30069 [0,1,0,1,0,0|2,0,0]=4 1014 B12R2.203 O=C1CCC2=C1C(O)=CC=C2 AK-36137 [0,1,0,1,0,0|2,0,0]=4 1015 B12R2.612 C1=C(C=CC2=C1CCC2=O)Cl AK-31971 [0,1,0,1,0,0|1,1,0]=4 1016 B12R2.612 CC1=CC=C2C(N)CCC2=C1 AK-60573 [0,1,0,1,0,0|1,0,0]=3 1017 B12R2.612 FC1=CC2=C(C(=NO2)N)C=C1 AK-24372 [0,1,0,1,0,0|1,0,1]=4 1018 B12R2.612 NC1CCC2=C1C=CC(Cl)=C2 AK-31447 [0,1,0,1,0,0|0,1,0]=3 1019 B12R2.612 NC1COC2=CC(Br)=CC=C12 AK-27555 [0,1,0,1,0,0|0,1,0]=3 1020 B12R2.612 N[C@@H]1CCC2=C1C=CC(Br)=C2 AK175313 [0,1,0,1,0,0|0,1,0]=3 1021 B12R2.612 N[C@@H]1CCC2=C1C=CC(Cl)=C2 AK-76304 [0,1,0,1,0,0|0,1,0]=3 1022 B12R2.612 N[C@@H]1CCC2=C1C=CC(Cl)=C2 AK544242 [0,1,0,1,0,0|0,1,0]=3 1023 B12R2.612 N[C@@H]1CCC2=C1C=CC(F)=C2 AK-42485 [0,1,0,1,0,0|0,0,0]=2 1024 B12R2.612 N[C@H]1CCC2=C1C=CC(Br)=C2 AK-51085 [0,1,0,1,0,0|0,1,0]=3 1025 B12R2.612 N[C@H]1CCC2=C1C=CC(Cl)=C2 AK-76305 [0,1,0,1,0,0|0,1,0]=3 1026 B12R2.612 N[C@H]1CCC2=C1C=CC(Cl)=C2 AK544243 [0,1,0,1,0,0|0,1,0]=3 1027 B12R2.612 O=C1CCC2=C1C=CC(Br)=C2 AK-25818 [0,1,0,1,0,0|1,1,0]=4 1028 B12R2.612 O=C1CCC2=C1C=CC(C)=C2 AK-41812 [0,1,0,1,0,0|2,0,0]=4 1029 B12R2.612 O=C1CCC2=C1C=CC(F)=C2 AK-26274 [0,1,0,1,0,0|1,0,0]=3 1030 B12R2.612 O=C1CCC2=C1C=CC(I)=C2 AK-29326 [0,1,0,1,0,0|1,1,0]=4 1031 B12R2.612 O=C1CCC2=C1C=CC(N)=C2 AK-34777 [0,1,0,1,0,0|2,0,0]=4 1032 B12R2.612 OB1OCC2=CC(F)=CC=C12 AK163946 [0,1,0,1,0,0|2,0,0]=4 1033 B12R2.612 OC1CCC2=C1C=CC(Cl)=C2 AK109538 [0,1,0,1,0,0|1,1,0]=4 1034 B12R2.246 CC1=CC(F)=CC2=C1NC=C2 AK119748 [0,1,0,1,0,0|0,0,2]=4 1035 B12R2.246 FC1=CC(Br)=CC2=C1NC=C2 AK-85710 [0,1,0,1,0,0|0,0,2]=4 1036 B12R2.246 FC1=CC(F)=CC2=C1NC=C2 AK-25738 [0,1,0,1,0,0|0,0,2]=4 1037 B12R2.246 FC1=CC2=C(C(F)=C1)CCN2 AK122270 [0,1,0,1,0,0|2,0,0]=4 1038 B12R2.246 FC1=CC2=C(NC=C2)C(Br)=C1 AK-81631 [0,1,0,1,0,0|0,0,2]=4 1039 B12R2.2294 FC1=CC(C2CC2)=CC(Br)=C1 AK187915 [0,1,0,1,0,0|1,0,0]=3 1040 B12R2.606 BrC1=CC=C2CC(CC2=C1)O AK-36598 [0,1,0,1,0,0|1,1,0]=4 1041 B12R2.606 C1=CC(=CC2=C1N=C(N)S2)F AK-34786 [0,1,0,1,0,0|1,0,1]=4 1042 B12R2.606 CC1=NC2=C(N1)C=CC(F)=C2 AK-88922 [0,1,0,1,0,0|1,0,1]=4 1043 B12R2.606 CC1NC2=C(C=C(F)C=C2)C1 AK-89513 [0,1,0,1,0,0|0,0,0]=2 1044 B12R2.606 FC1=CC=C2C(N=C(Cl)N2)=C1 AK-32821 [0,1,0,1,0,0|1,0,1]=4 1045 B12R2.606 FC1=CC=C2NC(=O)SC2=C1 AK-30083 [0,1,0,1,0,0|1,0,1]=4 1046 B12R2.606 FC1=CC=C2[NH]C(=CC2=C1)C AK-26800 [0,1,0,1,0,0|0,0,2]=4 1047 B12R2.606 NC1=NC2=C(S1)C=CC(F)=C2 AK-51569 [0,1,0,1,0,0|1,0,1]=4 1048 B12R2.606 NC1CC2=C(C=C(Br)C=C2)C1 AK-34676 [0,1,0,1,0,0|0,1,0]=3 1049 B12R2.606 NC1CC2=C(C=C(F)C=C2)C1 AK-32562 [0,1,0,1,0,0|0,0,0]=2 1050 B12R2.606 NC1CC2=C(C=C(I)C=C2)C1 AK136096 [0,1,0,1,0,0|0,1,0]=3 1051 B12R2.606 O=C1CC2=CC(F)=CN=C2N1 AK-88818 [0,1,0,1,0,0|1,0,1]=4 1052 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)C1 AK-39225 [0,1,0,1,0,0|0,1,1]=4 1053 B12R2.606 O=C1NC2=C(C=C(F)C=C2)C1 AK-23028 [0,1,0,1,0,0|0,0,1]=3 1054 B12R2.606 O=C1NC2=C(C=C(N)C=C2)C1 AK-37753 [0,1,0,1,0,0|1,0,1]=4 1055 B12R2.606 O=C1NC2=CC=C(F)C=C2N1 AK-22224 [0,1,0,1,0,0|1,0,1]=4 1056 B12R2.606 S=C1NC2=CC=C(F)C=C2N1 AK109690 [0,1,0,1,0,0|1,0,1]=4 1057 B12R2.221 FC1=CC=C(F)C2=C1NC=C2 AK-25659 [0,1,0,1,0,0|0,0,2]=4 1058 B12R2.221 OC1=C2CCCC2=C(Cl)C=C1 AK-42152 [0,1,0,1,0,0|1,1,0]=4 1059 B12R2.44 C1=C(C=O)C=CC2=C1CCO2 AK-27740 [0,1,0,1,0,0|2,0,0]=4 1060 B12R2.44 COC1=CC2=C(NCC2)C=C1 AK-34134 [0,1,0,1,0,0|1,0,0]=3 1061 B12R2.44 N#CC1=CC2=C(NCC2)C=C1 AK-31453 [0,1,0,1,0,0|1,0,0]=3 1062 B12R2.44 O=CC1=CC=C2CCCC2=C1 AK-46178 [0,1,0,1,0,0|2,0,0]=4 1063 B12R2.315 N#CC1=CC=CC2=C1NCC2 AK-39961 [0,1,0,1,0,0|1,0,0]=3 1064 B12R2.315 O=CC1=C2OCCC2=CC=C1 AK-49532 [0,1,0,1,0,0|2,0,0]=4 1065 B12R2.100 FC1=C(Br)C=C2NN=CC2=C1 AK110753 [0,1,0,1,0,0|1,0,1]=4 1066 B12R2.100 FC1=C(C=C2[NH]C=CC2=C1)F AK-26629 [0,1,0,1,0,0|0,0,2]=4 1067 B12R2.100 FC1=C(F)C=C2C=NNC2=C1 AK-68503 [0,1,0,1,0,0|1,0,1]=4 1068 B12R2.100 FC1=CC2=C(C=C1F)CCN2 AK-36972 [0,1,0,1,0,0|0,0,0]=2 1069 B12R2.100 FC1=CC2=C(NC=C2)C=C1Cl AK-25330 [0,1,0,1,0,0|0,0,2]=4 1070 B12R2.100 OC1=CC2=C(CCC2)C=C1Br AK167878 [0,1,0,1,0,0|1,1,0]=4 1071 B8R1.1 CCC1=CC=C(C)S1 AK103790 [1,0,0,0,1,0|2,0,0]=4 1072 B8R1.1 NCC1=CC(Br)=CS1 AK-77634 [1,0,0,0,1,0|1,1,0]=4 1073 B8R1.1 NCC1=CC=C(Br)S1 AK-68661 [1,0,0,0,1,0|1,1,0]=4 1074 B8R1.1 NCC1=CC=C(Cl)S1 AK170725 [1,0,0,0,1,0|1,1,0]=4 1075 B8R1.11 NCC1=CC=CN1C AK-44946 [1,0,0,0,1,0|2,0,0]=4 1076 B8R1.8 NCCC1=CC=CS1 AK-44822 [1,0,0,0,1,0|1,0,0]=3 1077 B8R1.8 NCCC1=CN=CS1 AK140134 [1,0,0,0,1,0|2,0,0]=4 1078 B8R1.8 NCCC1=CNC=N1 AK-29414 [1,0,0,0,1,0|2,0,0]=4 1079 B8R1.8 NCCC1=CSC=C1 AK-28310 [1,0,0,0,1,0|1,0,0]=3 1080 B8R1.8 NCCC1=CSC=C1 AK-49962 [1,0,0,0,1,0|1,0,0]=3 1081 B8R1.8 NCCC1=NC=CN1 AK170004 [1,0,0,0,1,0|2,0,0]=4 1082 B8R1.8 NCCN1C=CC=C1 AK-34573 [1,0,0,0,1,0|1,0,0]=3 1083 B8R1.8 NCCN1C=CN=C1 AK-26623 [1,0,0,0,1,0|2,0,0]=4 1084 B8R1.8 NCCN1C=CN=C1 AK-33443 [1,0,0,0,1,0|2,0,0]=4 1085 B8R1.8 OCCC1=CC=CS1 AK-43981 [1,0,0,0,1,0|2,0,0]=4 1086 B8R1.8 OCCC1=CSC=C1 AK-68259 [1,0,0,0,1,0|2,0,0]=4