0 B10R1.172 CNC1=NC(OC)=CC=C1 SBB051844 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.172 COC1=CC(C=O)=CC=C1 SBB040264 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.172 COC1=CC(CN)=CC=C1 SBB061735 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.172 COC1=CC(CO)=CC=C1 SBB063359 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.172 COC1=CC(NN)=CC=C1 SBB064981 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.172 COC1=CC=CC(C#N)=C1 SBB055059 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.172 COC1=CC=CC(CBr)=C1 SBB054900 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.172 COC1=CC=CC(CCl)=C1 SBB040609 [0,0,0,0,0,0|2,0,0]=2 8 B10R1.172 COC1=CC=CC(OC)=C1 SBB060066 [0,0,0,0,0,0|0,0,0]=0 9 B10R1.172 COC1=CC=NC(NN)=N1 SBB049790 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.172 COC1=CC=NC(OC)=C1 SBB086068 [0,0,0,0,0,0|1,0,0]=1 11 B10R1.172 COC1=CN=CC(C=O)=C1 SBB052243 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.172 ClCC1=CC=CC(CCl)=C1 SBB058861 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.172 N#CC1=CC(C=O)=CC=C1 SBB063181 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.172 N#CC1=CC(CO)=CC=C1 SBB065162 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.172 N#CC1=CC=CC(C#N)=C1 SBB065073 [0,0,0,0,0,0|4,0,0]=4 16 B10R1.172 N#CC1=CC=CC(CBr)=C1 SBB007997 [0,0,0,0,0,0|4,0,0]=4 17 B10R1.172 NCC1=CC=CC(CN)=C1 SBB056801 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.172 O=CC1=CC(CBr)=CC=C1 SBB052151 [0,0,0,0,0,0|4,0,0]=4 19 B10R1.172 O=CC1=CC=CC(C=O)=C1 SBB063365 [0,0,0,0,0,0|4,0,0]=4 20 B10R1.172 OCC1=CC=CC(CO)=C1 SBB068549 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.2 C#CC1=CC=CC(F)=C1 SBB064527 [1,0,0,0,0,0|2,0,1]=4 22 B9R1.2 C#CC1=CC=CC(N)=C1 SBB064269 [1,0,0,0,0,0|2,0,1]=4 23 B9R1.2 C#CC1=CC=CC(O)=C1 SBB005886 [1,0,0,0,0,0|1,0,1]=3 24 B9R1.2 C(=O)C1=CC=CC(C)=N1 SBB004287 [1,0,0,0,0,0|3,0,0]=4 25 B9R1.2 CC1=CC(C#N)=NC=C1 SBB055617 [1,0,0,0,0,0|3,0,0]=4 26 B9R1.2 CC1=CC(C=O)=NC=C1 SBB052226 [1,0,0,0,0,0|3,0,0]=4 27 B9R1.2 CC1=CC(CN)=NC=C1 SBB052434 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.2 CC1=CC=CC(C#N)=C1 SBB059209 [1,0,0,0,0,0|2,0,0]=3 29 B9R1.2 CC1=CC=CC(CBr)=C1 SBB054906 [1,0,0,0,0,0|2,0,0]=3 30 B9R1.2 CC1=CC=CC(CBr)=N1 SBB070747 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.2 CC1=CC=CC(CCl)=C1 SBB040670 [1,0,0,0,0,0|2,0,0]=3 32 B9R1.2 CC1=CC=CC(CN)=C1 SBB048016 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.2 CC1=CC=CC(CN)=N1 SBB079460 [1,0,0,0,0,0|3,0,0]=4 34 B9R1.2 CC1=CC=CC(CO)=C1 SBB064816 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.2 CC1=CC=CC(CO)=N1 SBB065460 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.2 CC1=CC=CC(CS)=C1 SBB086034 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.2 CC1=CN=CC(C#N)=C1 SBB065284 [1,0,0,0,0,0|3,0,0]=4 38 B9R1.2 CCC1=CC(C)=CC=C1 SBB061286 [1,0,0,0,0,0|1,0,0]=2 39 B9R1.2 CCC1=CC(C)=CC=C1 SBB061444 [1,0,0,0,0,0|1,0,0]=2 40 B9R1.2 CCC1=CC=CC(Br)=C1 SBB090239 [1,0,0,0,0,0|2,0,0]=3 41 B9R1.2 CCC1=CC=NC(N)=C1 SBB028207 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.2 CCC1=CN=CC(Br)=C1 SBB054407 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.2 CCC1=NC(N)=CC=C1 SBB028205 [1,0,0,0,0,0|3,0,0]=4 44 B9R1.2 CNC1=CC(Cl)=CC=C1 SBB086218 [1,0,0,0,0,0|2,0,0]=3 45 B9R1.2 COC1=CC(Br)=CC=C1 SBB007886 [1,0,0,0,0,0|1,0,0]=2 46 B9R1.2 COC1=CC(F)=CC=C1 SBB085642 [1,0,0,0,0,0|1,0,0]=2 47 B9R1.2 COC1=CC(N)=NC=C1 SBB051898 [1,0,0,0,0,0|2,0,0]=3 48 B9R1.2 COC1=CC(O)=CC=C1 SBB060932 [1,0,0,0,0,0|0,0,0]=1 49 B9R1.2 COC1=CC=CC(Br)=N1 SBB054383 [1,0,0,0,0,0|2,0,0]=3 50 B9R1.2 COC1=CC=CC(C)=C1 SBB061028 [1,0,0,0,0,0|0,0,0]=1 51 B9R1.2 COC1=CC=CC(F)=N1 SBB085671 [1,0,0,0,0,0|2,0,0]=3 52 B9R1.2 COC1=CC=CC(I)=C1 SBB059058 [1,0,0,0,0,0|1,0,0]=2 53 B9R1.2 COC1=CC=CC(N)=C1 SBB040499 [1,0,0,0,0,0|1,0,0]=2 54 B9R1.2 COC1=CC=CC(N)=N1 SBB051862 [1,0,0,0,0,0|2,0,0]=3 55 B9R1.2 COC1=CC=NC(Cl)=N1 SBB054496 [1,0,0,0,0,0|3,0,0]=4 56 B9R1.2 COC1=CN=CC(Br)=C1 SBB054402 [1,0,0,0,0,0|2,0,0]=3 57 B9R1.2 COC1=NC(N)=NC=C1 SBB051950 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.2 COC1=NC=CC(Br)=C1 SBB054328 [1,0,0,0,0,0|2,0,0]=3 59 B9R1.2 COC1=NC=CC(N)=C1 SBB051798 [1,0,0,0,0,0|2,0,0]=3 60 B9R1.2 COC1=NC=NC(Cl)=C1 SBB079086 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.2 CSC1=NC(C)=CC=N1 SBB086177 [1,0,0,0,0,0|2,1,0]=4 62 B9R1.2 ClCC1=CC(Cl)=CC=C1 SBB040671 [1,0,0,0,0,0|3,0,0]=4 63 B9R1.2 FC1=CC(CBr)=CC=C1 SBB090883 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.2 FC1=CC=CC(CCl)=C1 SBB040605 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.2 N#CC1=CC(Br)=CC=C1 SBB054164 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.2 N#CC1=CC(I)=CC=C1 SBB055464 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.2 N#CC1=CC=CC(Cl)=C1 SBB063150 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.2 N#CC1=CC=CC(F)=C1 SBB063653 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.2 N#CC1=CC=CC(N)=C1 SBB063161 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.2 N#CC1=CN=CC(O)=C1 SBB065305 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.2 NC1=CC=CC(CO)=C1 SBB037932 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.2 NC1=NC=NC(OC)=C1 SBB004268 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.2 NCC1=CC(Cl)=CC=C1 SBB004155 [1,0,0,0,0,0|3,0,0]=4 74 B9R1.2 NCC1=CC=CC(Br)=C1 SBB005796 [1,0,0,0,0,0|3,0,0]=4 75 B9R1.2 NCC1=CC=CC(F)=C1 SBB028218 [1,0,0,0,0,0|3,0,0]=4 76 B9R1.2 NNC1=CC(Cl)=CC=C1 SBB017147 [1,0,0,0,0,0|3,0,0]=4 77 B9R1.2 NNC1=CC=CC(Br)=C1 SBB064980 [1,0,0,0,0,0|3,0,0]=4 78 B9R1.2 NNC1=CC=CC(Cl)=C1 SBB063250 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.2 NNC1=CC=CC(F)=C1 SBB063994 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.2 O=CC1=CC=CC(Br)=C1 SBB028648 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.2 O=CC1=CC=CC(Cl)=C1 SBB040204 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.2 O=CC1=CC=CC(F)=C1 SBB040273 [1,0,0,0,0,0|3,0,0]=4 83 B9R1.2 O=CC1=CC=CC(I)=C1 SBB064701 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.2 O=CC1=CC=CC(O)=C1 SBB040208 [1,0,0,0,0,0|2,0,0]=3 85 B9R1.2 OCC1=CC(F)=CC=C1 SBB064188 [1,0,0,0,0,0|3,0,0]=4 86 B9R1.2 OCC1=CC(I)=CC=C1 SBB068728 [1,0,0,0,0,0|3,0,0]=4 87 B9R1.2 OCC1=CC(S)=CC=C1 SBB054760 [1,0,0,0,0,0|2,1,0]=4 88 B9R1.2 OCC1=CC=CC(Br)=C1 SBB063014 [1,0,0,0,0,0|3,0,0]=4 89 B9R1.2 OCC1=CC=CC(Cl)=C1 SBB064716 [1,0,0,0,0,0|3,0,0]=4 90 B9R1.2 OCC1=CC=CC(O)=C1 SBB068731 [1,0,0,0,0,0|2,0,0]=3 91 B9R1.2 [NH3+]CC1=CC(I)=CC=C1 SBB058984 [1,0,0,0,0,0|3,0,0]=4 92 B11R1.9 CCC1=CC(C)=CC(CC)=C1 SBB060976 [0,1,0,0,0,0|2,0,0]=3 93 B11R1.9 COC1=CC(Br)=CC(OC)=C1 SBB059589 [0,1,0,0,0,0|0,0,0]=1 94 B11R1.9 COC1=CC(C#N)=CC(Cl)=C1 SBB055266 [0,1,0,0,0,0|2,0,0]=3 95 B11R1.9 COC1=CC(C)=CC(OC)=C1 SBB059392 [0,1,0,0,0,0|0,0,0]=1 96 B11R1.9 COC1=CC(F)=CC(OC)=C1 SBB087139 [0,1,0,0,0,0|0,0,0]=1 97 B11R1.9 COC1=CC(N)=CC(OC)=C1 SBB059344 [0,1,0,0,0,0|0,0,0]=1 98 B11R1.9 COC1=CC(N)=NC(OC)=N1 SBB000120 [0,1,0,0,0,0|2,0,0]=3 99 B11R1.9 COC1=CC(O)=CC(OC)=C1 SBB071724 [0,1,0,0,0,0|0,0,0]=1 100 B11R1.9 COC1=CC(OC)=NC(N)=N1 SBB006932 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.9 COC1=NC(Cl)=NC(OC)=N1 SBB054621 [0,1,0,0,0,0|3,0,0]=4 102 B11R1.9 COC1=NC(N)=NC(OC)=N1 SBB052030 [0,1,0,0,0,0|3,0,0]=4 103 B11R1.9 COC1=NC(OC)=NC(Cl)=C1 SBB054538 [0,1,0,0,0,0|2,0,0]=3 104 B11R1.189 C(=O)C1=CC(OCC)=CC=C1 SBB004072 [0,1,0,0,0,0|2,0,0]=3 105 B11R1.189 CCC1=CC(N=C=O)=CC=C1 SBB046945 [0,1,0,0,0,0|2,0,1]=4 106 B11R1.189 COC1=CC(CCBr)=CC=C1 SBB027258 [0,1,0,0,0,0|1,0,0]=2 107 B11R1.189 COC1=CC=CC(CC#N)=C1 SBB055078 [0,1,0,0,0,0|1,0,1]=3 108 B11R1.189 COC1=CC=CC(CC=O)=C1 SBB052208 [0,1,0,0,0,0|1,0,1]=3 109 B11R1.189 COC1=CC=CC(N=C=O)=C1 SBB048850 [0,1,0,0,0,0|1,0,1]=3 110 B11R1.189 COC1=CC=CC(N=C=S)=C1 SBB030514 [0,1,0,0,0,0|1,0,1]=3 111 B11R1.189 CSC1=CC=CC(N=C=O)=C1 SBB046963 [0,1,0,0,0,0|1,1,1]=4 112 B11R1.266 CC(=O)C1=CC(C#N)=CC=C1 SBB059192 [0,1,0,0,0,0|3,0,0]=4 113 B11R1.266 CN(C)C1=CC=CC(CO)=C1 SBB086789 [0,1,0,0,0,0|3,0,0]=4 114 B11R1.266 COC1=CC(B(O)O)=CC=C1 SBB048062 [0,1,0,0,0,0|2,0,0]=3 115 B11R1.266 COC1=CC(C(=O)Cl)=CC=C1 SBB058624 [0,1,0,0,0,0|2,0,0]=3 116 B11R1.266 COC1=CC(C(C)=O)=CC=C1 SBB040249 [0,1,0,0,0,0|1,0,0]=2 117 B11R1.266 COC1=CC(C(C)O)=CC=C1 SBB079068 [0,1,0,0,0,0|1,0,0]=2 118 B11R1.266 COC1=CC(N(C)C)=CC=C1 SBB060811 [0,1,0,0,0,0|1,0,0]=2 119 B11R1.266 COC1=CC=CC(C(C)N)=C1 SBB018584 [0,1,0,0,0,0|1,0,0]=2 120 B11R1.266 COC1=CC=CC(C(N)=S)=C1 SBB016506 [0,1,0,0,0,0|2,0,0]=3 121 B11R1.266 COC1=CN=CC(C(=O)O)=C1 SBB052945 [0,1,0,0,0,0|3,0,0]=4 122 B11R1.266 COC1=NC=CC(C(=O)O)=C1 SBB018666 [0,1,0,0,0,0|3,0,0]=4 123 B11R1.266 CSC1=CC=CC(C(=O)O)=C1 SBB058990 [0,1,0,0,0,0|2,1,0]=4 124 B11R1.266 OC(=O)C1=CC(OC)=CC=C1 SBB015065 [0,1,0,0,0,0|2,0,0]=3 125 B11R1.267 CCC1=CC=CC(CC)=C1N SBB040469 [0,1,0,0,0,0|2,0,0]=3 126 B11R1.267 COC1=C(F)C(C=O)=CC=C1 SBB068762 [0,1,0,0,0,0|2,0,0]=3 127 B11R1.267 COC1=CC=CC(C#N)=C1O SBB055374 [0,1,0,0,0,0|2,0,0]=3 128 B11R1.267 COC1=CC=CC(C=O)=C1O SBB000109 [0,1,0,0,0,0|2,0,0]=3 129 B11R1.267 COC1=CC=CC(CN)=C1O SBB080389 [0,1,0,0,0,0|2,0,0]=3 130 B11R1.267 COC1=CC=CC(CO)=C1O SBB064806 [0,1,0,0,0,0|2,0,0]=3 131 B11R1.267 COC1=CC=CC(OC)=C1N SBB027291 [0,1,0,0,0,0|0,0,0]=1 132 B11R1.267 COC1=CC=CC(OC)=C1O SBB056797 [0,1,0,0,0,0|0,0,0]=1 133 B11R1.267 COC1=NC=NC(OC)=C1N SBB051966 [0,1,0,0,0,0|2,0,0]=3 134 B11R1.280 C(=O)C1=CC(OC)=C(O)C=C1 SBB000108 [0,1,0,0,0,0|2,0,0]=3 135 B11R1.280 C(=O)C1=CC=C(C)C(OC)=C1 SBB008620 [0,1,0,0,0,0|2,0,0]=3 136 B11R1.280 CCC1=C(N)C=CC(C#N)=C1 SBB086499 [0,1,0,0,0,0|3,0,0]=4 137 B11R1.280 CCC1=CC(OC)=C(O)C=C1 SBB008068 [0,1,0,0,0,0|1,0,0]=2 138 B11R1.280 CCC1=CC=C(O)C(C=O)=C1 SBB079031 [0,1,0,0,0,0|3,0,0]=4 139 B11R1.280 COC1=C(F)C=CC(CO)=C1 SBB054758 [0,1,0,0,0,0|2,0,0]=3 140 B11R1.280 COC1=C(O)C=CC(C#N)=C1 SBB019877 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.280 COC1=C(O)C=CC(CN)=C1 SBB003667 [0,1,0,0,0,0|2,0,0]=3 142 B11R1.280 COC1=CC(C#N)=CC=C1F SBB063008 [0,1,0,0,0,0|2,0,0]=3 143 B11R1.280 COC1=CC(C=O)=CC=C1F SBB063627 [0,1,0,0,0,0|2,0,0]=3 144 B11R1.280 COC1=CC(CO)=C(Cl)C=C1 SBB068708 [0,1,0,0,0,0|2,0,0]=3 145 B11R1.280 COC1=CC(CO)=CC=C1O SBB058789 [0,1,0,0,0,0|2,0,0]=3 146 B11R1.280 COC1=CC=C(Br)C(C#N)=C1 SBB028776 [0,1,0,0,0,0|2,0,0]=3 147 B11R1.280 COC1=CC=C(Br)C(C=O)=C1 SBB063083 [0,1,0,0,0,0|2,0,0]=3 148 B11R1.280 COC1=CC=C(F)C(C#N)=C1 SBB055306 [0,1,0,0,0,0|2,0,0]=3 149 B11R1.280 COC1=CC=C(F)C(C=O)=C1 SBB063820 [0,1,0,0,0,0|2,0,0]=3 150 B11R1.280 COC1=CC=C(N)C(OC)=C1 SBB040471 [0,1,0,0,0,0|0,0,0]=1 151 B11R1.280 COC1=CC=C(N)C(OC)=N1 SBB000290 [0,1,0,0,0,0|1,0,0]=2 152 B11R1.280 COC1=CC=C(O)C(C=O)=C1 SBB063767 [0,1,0,0,0,0|2,0,0]=3 153 B11R1.280 COC1=NC=C(Br)C(OC)=N1 SBB054539 [0,1,0,0,0,0|2,0,0]=3 154 B9R1.14 COC1=C(C=O)SC=C1 SBB086238 [0,0,0,0,1,0|3,0,0]=4 155 B9R1.14 COC1=CSC=C1OC SBB042426 [0,0,0,0,1,0|1,0,0]=2 156 B9R1.14 N1C=C(CC)C(CC)=C1 SBB059631 [0,0,0,0,1,0|3,0,0]=4 157 B8R1.2 C#CC1=CC=CC=C1 SBB040919 [2,0,0,0,0,0|1,0,1]=4 158 B8R1.2 CCC1=CC=CC=C1 SBB040891 [2,0,0,0,0,0|1,0,0]=3 159 B8R1.2 CCC1=CC=CC=N1 SBB060373 [2,0,0,0,0,0|2,0,0]=4 160 B8R1.2 CCC1=CC=NC=C1 SBB061128 [2,0,0,0,0,0|2,0,0]=4 161 B8R1.2 CCC1=CN=CC=C1 SBB060374 [2,0,0,0,0,0|2,0,0]=4 162 B8R1.2 CNC1=CC=CC=C1 SBB008162 [2,0,0,0,0,0|1,0,0]=3 163 B8R1.2 CNC1=CC=CC=C1 SBB059778 [2,0,0,0,0,0|1,0,0]=3 164 B8R1.2 N#CC1=CC=CC=C1 SBB028746 [2,0,0,0,0,0|2,0,0]=4 165 B8R1.2 NCC1=CC=CC=C1 SBB040473 [2,0,0,0,0,0|2,0,0]=4 166 B8R1.2 NNC1=CC=CC=C1 SBB040886 [2,0,0,0,0,0|2,0,0]=4 167 B8R1.2 OCC1=CC=CC=C1 SBB058558 [2,0,0,0,0,0|2,0,0]=4 168 B8R1.2 ONC1=CC=CC=C1 SBB008413 [2,0,0,0,0,0|2,0,0]=4 169 B8R1.2 [NH3+]NC1=CC=CC=C1 SBB060000 [2,0,0,0,0,0|2,0,0]=4 170 B8R1.4 CC1=CC(=O)NC=C1 SBB004346 [2,0,0,0,0,0|1,0,1]=4 171 B8R1.4 CC1=CC(Br)=NC=C1 SBB054348 [2,0,0,0,0,0|2,0,0]=4 172 B8R1.4 CC1=CC(C)=NC=N1 SBB059547 [2,0,0,0,0,0|2,0,0]=4 173 B8R1.4 CC1=CC(Cl)=NC=C1 SBB054263 [2,0,0,0,0,0|2,0,0]=4 174 B8R1.4 CC1=CC(F)=NC=C1 SBB054405 [2,0,0,0,0,0|2,0,0]=4 175 B8R1.4 CC1=CC(N)=CC=C1 SBB040444 [2,0,0,0,0,0|1,0,0]=3 176 B8R1.4 CC1=CC(N)=NC=C1 SBB004354 [2,0,0,0,0,0|2,0,0]=4 177 B8R1.4 CC1=CC(O)=CC=C1 SBB060101 [2,0,0,0,0,0|0,0,0]=2 178 B8R1.4 CC1=CC(O)=NC=N1 SBB081936 [2,0,0,0,0,0|2,0,0]=4 179 B8R1.4 CC1=CC=CC(=O)N1 SBB004345 [2,0,0,0,0,0|1,0,1]=4 180 B8R1.4 CC1=CC=CC(Br)=C1 SBB060207 [2,0,0,0,0,0|1,0,0]=3 181 B8R1.4 CC1=CC=CC(Br)=N1 SBB054376 [2,0,0,0,0,0|2,0,0]=4 182 B8R1.4 CC1=CC=CC(C)=N1 SBB060371 [2,0,0,0,0,0|1,0,0]=3 183 B8R1.4 CC1=CC=CC(Cl)=N1 SBB048080 [2,0,0,0,0,0|2,0,0]=4 184 B8R1.4 CC1=CC=CC(F)=C1 SBB061650 [2,0,0,0,0,0|1,0,0]=3 185 B8R1.4 CC1=CC=CC(I)=N1 SBB054318 [2,0,0,0,0,0|2,0,0]=4 186 B8R1.4 CC1=CC=CC(N)=N1 SBB004355 [2,0,0,0,0,0|2,0,0]=4 187 B8R1.4 CC1=CC=NC(C)=C1 SBB060369 [2,0,0,0,0,0|1,0,0]=3 188 B8R1.4 CC1=CN=CC(Br)=C1 SBB054290 [2,0,0,0,0,0|2,0,0]=4 189 B8R1.4 CC1=CN=CC(C)=C1 SBB060372 [2,0,0,0,0,0|1,0,0]=3 190 B8R1.4 CC1=CN=CC(N)=C1 SBB051822 [2,0,0,0,0,0|2,0,0]=4 191 B8R1.4 CC1=CN=CC(O)=C1 SBB055598 [2,0,0,0,0,0|1,0,0]=3 192 B8R1.4 CC1=NC=CC(Br)=C1 SBB088565 [2,0,0,0,0,0|2,0,0]=4 193 B8R1.4 CC1=NC=CC(N)=C1 SBB027134 [2,0,0,0,0,0|2,0,0]=4 194 B8R1.4 ClC1=CC=CC(I)=C1 SBB098968 [2,0,0,0,0,0|2,0,0]=4 195 B8R1.4 FC1=CC(Br)=CC=C1 SBB088990 [2,0,0,0,0,0|2,0,0]=4 196 B8R1.4 FC1=CC(I)=CC=C1 SBB096228 [2,0,0,0,0,0|2,0,0]=4 197 B8R1.4 FC1=CC=CC(Cl)=C1 SBB085773 [2,0,0,0,0,0|2,0,0]=4 198 B8R1.4 NC1=CC(Br)=CC=C1 SBB040484 [2,0,0,0,0,0|2,0,0]=4 199 B8R1.4 NC1=CC(O)=CC=C1 SBB059791 [2,0,0,0,0,0|1,0,0]=3 200 B8R1.4 NC1=CC=CC(Cl)=C1 SBB040450 [2,0,0,0,0,0|2,0,0]=4 201 B8R1.4 NC1=CC=CC(F)=C1 SBB059856 [2,0,0,0,0,0|2,0,0]=4 202 B8R1.4 O=C1C=CC=C(O)N1 SBB004090 [2,0,0,0,0,0|1,0,1]=4 203 B8R1.4 OC1=CC(Cl)=CN=C1 SBB054268 [2,0,0,0,0,0|2,0,0]=4 204 B8R1.4 OC1=CC(O)=NC=N1 SBB080740 [2,0,0,0,0,0|2,0,0]=4 205 B8R1.4 OC1=CC=CC(Cl)=C1 SBB061136 [2,0,0,0,0,0|1,0,0]=3 206 B8R1.4 OC1=CC=CC(O)=C1 SBB040843 [2,0,0,0,0,0|0,0,0]=2 207 B8R1.4 OC1=CC=NC(Cl)=C1 SBB085746 [2,0,0,0,0,0|2,0,0]=4 208 B8R1.4 OC1=CC=NC(O)=C1 SBB004331 [2,0,0,0,0,0|1,0,0]=3 209 B8R1.4 OC1=CN=CC(Br)=C1 SBB081337 [2,0,0,0,0,0|2,0,0]=4 210 B8R1.4 OC1=CN=CC(F)=C1 SBB062707 [2,0,0,0,0,0|2,0,0]=4 211 B8R1.4 OC1=NC(C)=CC=N1 SBB004337 [2,0,0,0,0,0|2,0,0]=4 212 B8R1.4 OC1=NC=CC(Br)=C1 SBB054250 [2,0,0,0,0,0|2,0,0]=4 213 B8R1.4 SC1=CC=CC(Br)=C1 SBB066529 [2,0,0,0,0,0|1,1,0]=4 214 B8R1.4 [NH3+]C1=CC=CC([NH3+])=C1 SBB061252 [2,0,0,0,0,0|2,0,0]=4 215 B10R1.2 CC1=C(C)C(C#N)=CC=C1 SBB064687 [1,1,0,0,0,0|2,0,0]=4 216 B10R1.2 CC1=C(C)C(C=O)=CC=C1 SBB060150 [1,1,0,0,0,0|2,0,0]=4 217 B10R1.2 CC1=C(C)C(C=O)=CC=C1 SBB062996 [1,1,0,0,0,0|2,0,0]=4 218 B10R1.2 CC1=C(C)C(CN)=CC=C1 SBB017637 [1,1,0,0,0,0|2,0,0]=4 219 B10R1.2 CC1=C(F)C(C#N)=CC=C1 SBB063009 [1,1,0,0,0,0|2,0,0]=4 220 B10R1.2 CC1=C(F)C(C=O)=CC=C1 SBB064504 [1,1,0,0,0,0|2,0,0]=4 221 B10R1.2 CC1=C(F)C(CBr)=CC=C1 SBB005816 [1,1,0,0,0,0|2,0,0]=4 222 B10R1.2 CC1=C(O)C(C=O)=CC=C1 SBB068759 [1,1,0,0,0,0|2,0,0]=4 223 B10R1.2 CCC1=C(O)C(C)=CC=C1 SBB071423 [1,1,0,0,0,0|1,0,0]=3 224 B10R1.2 CCC1=CC=CC(C)=C1I SBB100083 [1,1,0,0,0,0|1,0,0]=3 225 B10R1.2 CCC1=CC=CC(C)=C1N SBB040448 [1,1,0,0,0,0|1,0,0]=3 226 B10R1.2 COC1=C(O)C(C)=CC=C1 SBB008271 [1,1,0,0,0,0|0,0,0]=2 227 B10R1.2 COC1=CC=CC(Cl)=C1F SBB087470 [1,1,0,0,0,0|1,0,0]=3 228 B10R1.2 COC1=CC=CC(F)=C1Br SBB093393 [1,1,0,0,0,0|1,0,0]=3 229 B10R1.2 COC1=CC=CC(F)=C1F SBB055052 [1,1,0,0,0,0|1,0,0]=3 230 B10R1.2 COC1=CC=CC(F)=C1O SBB086225 [1,1,0,0,0,0|1,0,0]=3 231 B10R1.2 OC1=CC=CC(C=O)=C1O SBB004190 [1,1,0,0,0,0|2,0,0]=4 232 B10R1.8 CC1=CC(C)=CC(C#N)=C1 SBB063063 [1,1,0,0,0,0|2,0,0]=4 233 B10R1.8 CC1=CC(C)=CC(C=O)=C1 SBB063352 [1,1,0,0,0,0|2,0,0]=4 234 B10R1.8 CC1=CC(C)=CC(CBr)=C1 SBB008310 [1,1,0,0,0,0|2,0,0]=4 235 B10R1.8 CC1=CC(C)=CC(CO)=C1 SBB064815 [1,1,0,0,0,0|2,0,0]=4 236 B10R1.8 CC1=CC(F)=CC(C#N)=C1 SBB063640 [1,1,0,0,0,0|2,0,0]=4 237 B10R1.8 CC1=CC(F)=CC(C=O)=C1 SBB064351 [1,1,0,0,0,0|2,0,0]=4 238 B10R1.8 CC1=CC(F)=CC(CN)=C1 SBB086085 [1,1,0,0,0,0|2,0,0]=4 239 B10R1.8 CC1=CC(F)=CC(CO)=C1 SBB086168 [1,1,0,0,0,0|2,0,0]=4 240 B10R1.8 CCC1=CC(C)=CC(C)=C1 SBB060975 [1,1,0,0,0,0|1,0,0]=3 241 B10R1.8 COC1=CC(F)=CC(Cl)=C1 SBB087479 [1,1,0,0,0,0|1,0,0]=3 242 B10R1.8 COC1=CC(F)=CC(F)=C1 SBB086329 [1,1,0,0,0,0|1,0,0]=3 243 B10R1.8 COC1=CC(O)=CC(C)=C1 SBB008618 [1,1,0,0,0,0|0,0,0]=2 244 B10R1.8 COC1=NC(N)=NC(C)=C1 SBB006744 [1,1,0,0,0,0|2,0,0]=4 245 B10R1.8 N#CC1=CC(Cl)=CC(O)=C1 SBB055253 [1,1,0,0,0,0|2,0,0]=4 246 B10R1.8 O=CC1=CC(O)=CC(O)=C1 SBB063018 [1,1,0,0,0,0|2,0,0]=4 247 B10R1.8 OCC1=CC(O)=CC(O)=C1 SBB059366 [1,1,0,0,0,0|2,0,0]=4 248 B10R1.10 CC1=CC(N=C=O)=CC=C1 SBB064239 [1,1,0,0,0,0|1,0,1]=4 249 B10R1.10 CC1=CC=CC(CC#N)=C1 SBB068545 [1,1,0,0,0,0|1,0,1]=4 250 B10R1.10 CCOC1=CC(N)=CC=C1 SBB059860 [1,1,0,0,0,0|1,0,0]=3 251 B10R1.10 CCOC1=CC=CC(C)=C1 SBB060989 [1,1,0,0,0,0|0,0,0]=2 252 B10R1.10 CCOC1=CC=CC(O)=C1 SBB005788 [1,1,0,0,0,0|0,0,0]=2 253 B10R1.10 CNCC1=CC(O)=CC=C1 SBB046532 [1,1,0,0,0,0|1,0,0]=3 254 B10R1.10 CNCC1=NC(C)=CC=C1 SBB110044 [1,1,0,0,0,0|2,0,0]=4 255 B10R1.10 NNCC1=CC(O)=CC=C1 SBB003436 [1,1,0,0,0,0|2,0,0]=4 256 B10R1.10 OCCC1=CC(F)=CC=C1 SBB055447 [1,1,0,0,0,0|2,0,0]=4 257 B10R1.10 O\N=C\C1=CC=CC(O)=C1 SBB028669 [1,1,0,0,0,0|2,0,0]=4 258 B10R1.30 C(=O)C1=C(C)C=CC(C)=C1 SBB008435 [1,1,0,0,0,0|2,0,0]=4 259 B10R1.30 CC1=CC(C#N)=C(F)C=C1 SBB064083 [1,1,0,0,0,0|2,0,0]=4 260 B10R1.30 CC1=CC(CCl)=C(C)C=C1 SBB040679 [1,1,0,0,0,0|2,0,0]=4 261 B10R1.30 CC1=CC(CN)=C(F)C=C1 SBB086091 [1,1,0,0,0,0|2,0,0]=4 262 B10R1.30 CC1=CC=C(F)C(C=O)=C1 SBB063764 [1,1,0,0,0,0|2,0,0]=4 263 B10R1.30 CC1=CC=C(O)C(C=O)=C1 SBB063013 [1,1,0,0,0,0|2,0,0]=4 264 B10R1.30 CCC1=C(O)C=CC(C)=N1 SBB080737 [1,1,0,0,0,0|2,0,0]=4 265 B10R1.30 CCC1=NC(C)=CC=C1O SBB080762 [1,1,0,0,0,0|2,0,0]=4 266 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 SBB059051 [1,1,0,0,0,0|1,0,0]=3 267 B10R1.30 COC1=C(Br)C=CC(F)=C1 SBB093400 [1,1,0,0,0,0|1,0,0]=3 268 B10R1.30 COC1=C(Br)C=CC(N)=C1 SBB059059 [1,1,0,0,0,0|1,0,0]=3 269 B10R1.30 COC1=C(C)C=CC(Cl)=C1 SBB059060 [1,1,0,0,0,0|1,0,0]=3 270 B10R1.30 COC1=C(C)C=CC(F)=C1 SBB086158 [1,1,0,0,0,0|1,0,0]=3 271 B10R1.30 COC1=C(C)C=CC(N)=C1 SBB085977 [1,1,0,0,0,0|1,0,0]=3 272 B10R1.30 COC1=C(Cl)C=CC(Br)=C1 SBB059053 [1,1,0,0,0,0|1,0,0]=3 273 B10R1.30 COC1=C(F)C=CC(F)=C1 SBB086327 [1,1,0,0,0,0|1,0,0]=3 274 B10R1.30 COC1=C(O)C=CC(C)=C1 SBB008258 [1,1,0,0,0,0|0,0,0]=2 275 B10R1.30 COC1=C(O)C=CC(N)=C1 SBB010275 [1,1,0,0,0,0|1,0,0]=3 276 B10R1.30 COC1=CC(Br)=CC=C1N SBB051732 [1,1,0,0,0,0|1,0,0]=3 277 B10R1.30 COC1=CC(Br)=CN=C1N SBB070411 [1,1,0,0,0,0|2,0,0]=4 278 B10R1.30 COC1=CC(C)=CC=C1F SBB086162 [1,1,0,0,0,0|0,0,0]=2 279 B10R1.30 COC1=CC(Cl)=CC=C1N SBB085532 [1,1,0,0,0,0|1,0,0]=3 280 B10R1.30 COC1=CC(F)=CC=C1O SBB055422 [1,1,0,0,0,0|1,0,0]=3 281 B10R1.30 COC1=CC(N)=CC=C1Cl SBB070068 [1,1,0,0,0,0|1,0,0]=3 282 B10R1.30 O=CC1=CC(O)=CC=C1Br SBB063077 [1,1,0,0,0,0|2,0,0]=4 283 B10R1.30 O=CC1=CC(O)=CC=C1O SBB052127 [1,1,0,0,0,0|2,0,0]=4 284 B10R1.30 [NH3+]C1=CC=C(Br)C=C1CC SBB058409 [1,1,0,0,0,0|2,0,0]=4 285 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 SBB040258 [1,1,0,0,0,0|2,0,0]=4 286 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 SBB055121 [1,1,0,0,0,0|2,0,0]=4 287 B10R1.113 CC(=O)C1=CC=CC(C)=C1 SBB061772 [1,1,0,0,0,0|1,0,0]=3 288 B10R1.113 CC(=O)C1=CC=CC(C)=N1 SBB068974 [1,1,0,0,0,0|2,0,0]=4 289 B10R1.113 CC(=O)C1=CC=CC(F)=C1 SBB063564 [1,1,0,0,0,0|2,0,0]=4 290 B10R1.113 CC(=O)C1=CC=CC(N)=C1 SBB058713 [1,1,0,0,0,0|2,0,0]=4 291 B10R1.113 CC(=O)C1=CC=CC(O)=C1 SBB040280 [1,1,0,0,0,0|1,0,0]=3 292 B10R1.113 CC(N)C1=CC(Br)=CC=C1 SBB047651 [1,1,0,0,0,0|2,0,0]=4 293 B10R1.113 CC(N)C1=CC(Cl)=CC=C1 SBB046822 [1,1,0,0,0,0|2,0,0]=4 294 B10R1.113 CC(N)C1=CC=CC(O)=C1 SBB080427 [1,1,0,0,0,0|1,0,0]=3 295 B10R1.113 CC(O)C1=CC(N)=CC=C1 SBB008559 [1,1,0,0,0,0|2,0,0]=4 296 B10R1.113 CC(O)C1=CC=CC(Cl)=C1 SBB068833 [1,1,0,0,0,0|2,0,0]=4 297 B10R1.113 CC1=CC(B(O)O)=CC=C1 SBB048058 [1,1,0,0,0,0|2,0,0]=4 298 B10R1.113 CC1=CC(C(Br)Br)=CC=C1 SBB061660 [1,1,0,0,0,0|2,0,0]=4 299 B10R1.113 CC1=CC(C(N)=O)=CC=C1 SBB007861 [1,1,0,0,0,0|2,0,0]=4 300 B10R1.113 CC1=CC(N(C)C)=CC=C1 SBB008276 [1,1,0,0,0,0|1,0,0]=3 301 B10R1.113 CC1=CC=CC(C(=O)Cl)=C1 SBB058758 [1,1,0,0,0,0|2,0,0]=4 302 B10R1.113 CC1=CC=CC(C(=O)O)=C1 SBB040526 [1,1,0,0,0,0|2,0,0]=4 303 B10R1.113 CC1=CC=CC(C(C)C)=C1 SBB061535 [1,1,0,0,0,0|1,0,0]=3 304 B10R1.113 CC1=CC=CC(C(C)N)=C1 SBB046820 [1,1,0,0,0,0|1,0,0]=3 305 B10R1.113 CC1=CC=CC(C(N)=S)=C1 SBB086796 [1,1,0,0,0,0|2,0,0]=4 306 B10R1.113 CN(C)C1=CC=CC(Cl)=C1 SBB008273 [1,1,0,0,0,0|2,0,0]=4 307 B10R1.113 CN(C)C1=CC=CC(F)=C1 SBB086090 [1,1,0,0,0,0|2,0,0]=4 308 B10R1.113 C[C@@H](O)C1=CC=CC(Br)=C1 SBB064272 [1,1,0,0,0,0|2,0,0]=4 309 B10R1.113 C[C@@H](O)C1=CC=CC(F)=C1 SBB086151 [1,1,0,0,0,0|2,0,0]=4 310 B10R1.113 NC(=O)C1=CC=CC(O)=C1 SBB079277 [1,1,0,0,0,0|2,0,0]=4 311 B10R1.113 O=C(O)C1=CC(O)=CC=C1 SBB058844 [1,1,0,0,0,0|2,0,0]=4 312 B10R1.113 O=[N+]([O-])C1=CC(O)=CC=C1 SBB061211 [1,1,0,0,0,0|2,0,0]=4 313 B10R1.113 OB(O)C1=CC(O)=CC=C1 SBB052523 [1,1,0,0,0,0|2,0,0]=4 314 B10R1.176 CC1=C(C)C=C(C#N)C=C1 SBB055432 [1,1,0,0,0,0|2,0,0]=4 315 B10R1.176 CC1=C(F)C=CC([Mg]Br)=C1 SBB094835 [1,1,0,0,0,0|2,0,0]=4 316 B10R1.176 CC1=C(N)C=CC(C#N)=C1 SBB064128 [1,1,0,0,0,0|2,0,0]=4 317 B10R1.176 CC1=CC(C#N)=CC=C1Br SBB064428 [1,1,0,0,0,0|2,0,0]=4 318 B10R1.176 CC1=CC(C#N)=CC=C1F SBB063636 [1,1,0,0,0,0|2,0,0]=4 319 B10R1.176 CC1=CC(C=O)=CC=C1F SBB063863 [1,1,0,0,0,0|2,0,0]=4 320 B10R1.176 CC1=CC(CN)=CC=C1F SBB069920 [1,1,0,0,0,0|2,0,0]=4 321 B10R1.176 CC1=CC=C(C=O)C=C1C SBB063355 [1,1,0,0,0,0|2,0,0]=4 322 B10R1.176 CC1=CC=C(CN)C=C1C SBB028250 [1,1,0,0,0,0|2,0,0]=4 323 B10R1.176 CC1=CC=C(CO)C=C1C SBB063329 [1,1,0,0,0,0|2,0,0]=4 324 B10R1.176 CC1=CC=C(NN)C=C1C SBB028372 [1,1,0,0,0,0|2,0,0]=4 325 B10R1.176 CCC1=CC(C)=C(C)C=C1 SBB061288 [1,1,0,0,0,0|1,0,0]=3 326 B10R1.176 CCC1=CC=C(O)C(N)=C1 SBB000071 [1,1,0,0,0,0|2,0,0]=4 327 B10R1.176 CNC1=CC(Cl)=C(Cl)C=C1 SBB051773 [1,1,0,0,0,0|2,0,0]=4 328 B10R1.176 COC1=CC(C)=C(F)C=C1 SBB086166 [1,1,0,0,0,0|0,0,0]=2 329 B10R1.176 COC1=CC(Cl)=C(F)C=C1 SBB087476 [1,1,0,0,0,0|1,0,0]=3 330 B10R1.176 COC1=CC(F)=C(Br)C=C1 SBB055267 [1,1,0,0,0,0|1,0,0]=3 331 B10R1.176 COC1=CC(F)=C(Cl)C=C1 SBB087475 [1,1,0,0,0,0|1,0,0]=3 332 B10R1.176 COC1=CC(F)=C(F)C=C1 SBB086325 [1,1,0,0,0,0|1,0,0]=3 333 B10R1.176 COC1=CC(N)=C(C)C=C1 SBB058810 [1,1,0,0,0,0|1,0,0]=3 334 B10R1.176 COC1=CC(N)=C(N)C=N1 SBB062788 [1,1,0,0,0,0|2,0,0]=4 335 B10R1.176 COC1=CC(N)=C(O)C=C1 SBB009779 [1,1,0,0,0,0|1,0,0]=3 336 B10R1.176 COC1=CC=C(Br)C(C)=C1 SBB054214 [1,1,0,0,0,0|0,0,0]=2 337 B10R1.176 COC1=CC=C(Br)C(N)=C1 SBB051753 [1,1,0,0,0,0|1,0,0]=3 338 B10R1.176 COC1=CC=C(C)C(F)=C1 SBB086170 [1,1,0,0,0,0|1,0,0]=3 339 B10R1.176 COC1=CC=C(Cl)C(C)=C1 SBB061027 [1,1,0,0,0,0|0,0,0]=2 340 B10R1.176 COC1=CC=C(Cl)C(N)=C1 SBB008038 [1,1,0,0,0,0|1,0,0]=3 341 B10R1.176 COC1=CC=C(N)C(Br)=N1 SBB070409 [1,1,0,0,0,0|2,0,0]=4 342 B10R1.176 COC1=CC=C(N)C(C)=C1 SBB080570 [1,1,0,0,0,0|0,0,0]=2 343 B10R1.176 COC1=CC=C(N)C(F)=C1 SBB071687 [1,1,0,0,0,0|1,0,0]=3 344 B10R1.176 COC1=CC=C(N)C(N)=C1 SBB048084 [1,1,0,0,0,0|1,0,0]=3 345 B10R1.176 COC1=NC=C(F)C(O)=N1 SBB086323 [1,1,0,0,0,0|2,0,0]=4 346 B10R1.176 N#CC1=CC=C(O)C(O)=C1 SBB008582 [1,1,0,0,0,0|2,0,0]=4 347 B10R1.176 O=CC1=CC=C(O)C(O)=C1 SBB040269 [1,1,0,0,0,0|2,0,0]=4 348 B12R1.11 COC1=CC(C(=O)O)=CC(Cl)=C1 SBB052709 [0,2,0,0,0,0|2,0,0]=4 349 B12R1.11 COC1=CC(F)=CC(B(O)O)=C1 SBB071249 [0,2,0,0,0,0|2,0,0]=4 350 B12R1.11 COC1=CC([N+](=O)[O-])=CC(N)=C1 SBB013930 [0,2,0,0,0,0|2,0,0]=4 351 B12R1.58 CCC1=CC(CC)=CC(CC)=C1 SBB057514 [0,2,0,0,0,0|2,0,0]=4 352 B12R1.58 COC1=CC(C#N)=CC(OC)=C1 SBB008557 [0,2,0,0,0,0|0,0,0]=2 353 B12R1.58 COC1=CC(C=O)=CC(OC)=C1 SBB063173 [0,2,0,0,0,0|0,0,0]=2 354 B12R1.58 COC1=CC(CBr)=CC(OC)=C1 SBB054918 [0,2,0,0,0,0|0,0,0]=2 355 B12R1.58 COC1=CC(CN)=CC(OC)=C1 SBB058623 [0,2,0,0,0,0|0,0,0]=2 356 B12R1.58 COC1=CC(CO)=CC(OC)=C1 SBB064954 [0,2,0,0,0,0|0,0,0]=2 357 B12R1.235 COC1=C(O)C(C=O)=CC(Br)=C1 SBB016357 [0,2,0,0,0,0|2,0,0]=4 358 B12R1.235 COC1=C(O)C(C=O)=CC(Cl)=C1 SBB058391 [0,2,0,0,0,0|2,0,0]=4 359 B12R1.235 COC1=C(O)C(CO)=CC(Br)=C1 SBB079143 [0,2,0,0,0,0|2,0,0]=4 360 B12R1.235 COC1=CC(=O)C=C(OC)C1=O SBB057170 [0,2,0,0,0,0|0,0,0]=2 361 B12R1.235 COC1=CC(C)=CC(OC)=C1O SBB071401 [0,2,0,0,0,0|0,0,0]=2 362 B12R1.235 COC1=CC(O)=CC(OC)=C1O SBB051437 [0,2,0,0,0,0|0,0,0]=2 363 B12R1.300 COC1=C(O)C(Br)=CC(C#N)=C1 SBB019879 [0,2,0,0,0,0|2,0,0]=4 364 B12R1.300 COC1=C(O)C(Cl)=CC(C#N)=C1 SBB019878 [0,2,0,0,0,0|2,0,0]=4 365 B12R1.300 COC1=C(O)C(Cl)=CC(C=O)=C1 SBB001593 [0,2,0,0,0,0|2,0,0]=4 366 B12R1.300 COC1=C(O)C(I)=CC(C#N)=C1 SBB019882 [0,2,0,0,0,0|2,0,0]=4 367 B12R1.300 COC1=CC(C#N)=CC(N)=C1O SBB115983 [0,2,0,0,0,0|2,0,0]=4 368 B12R1.300 COC1=CC(C=O)=C(O)C(Br)=C1 SBB097687 [0,2,0,0,0,0|2,0,0]=4 369 B12R1.300 COC1=CC(C=O)=CC(Br)=C1O SBB016336 [0,2,0,0,0,0|2,0,0]=4 370 B12R1.300 COC1=CC(C=O)=CC(O)=C1O SBB042846 [0,2,0,0,0,0|2,0,0]=4 371 B12R1.300 COC1=CC(OC)=C(N)C(Cl)=C1 SBB007589 [0,2,0,0,0,0|0,0,0]=2 372 B12R1.300 OC1=C(OC)C=C(C=O)C=C1I SBB006927 [0,2,0,0,0,0|2,0,0]=4 373 B12R1.270 C(=O)C1=CC=C(O)C(OCC)=C1 SBB008268 [0,2,0,0,0,0|2,0,0]=4 374 B12R1.270 CCOC1=C(O)C=CC(C#N)=C1 SBB019883 [0,2,0,0,0,0|2,0,0]=4 375 B12R1.270 CCOC1=C(O)C=CC(CN)=C1 SBB027126 [0,2,0,0,0,0|2,0,0]=4 376 B12R1.278 CCOC1=CC(CCN)=CC=C1 SBB017676 [0,2,0,0,0,0|1,0,0]=3 377 B12R1.278 CCOC1=CC=CC(OCC)=C1 SBB060990 [0,2,0,0,0,0|0,0,0]=2 378 B12R1.279 CCOC1=CC(C(C)=O)=CC=C1 SBB046295 [0,2,0,0,0,0|1,0,0]=3 379 B12R1.279 CCOC1=CC=CC(C(=O)O)=C1 SBB015074 [0,2,0,0,0,0|2,0,0]=4 380 B12R1.279 CCOC1=CC=CC(C(C)N)=C1 SBB046788 [0,2,0,0,0,0|1,0,0]=3 381 B12R1.279 CCOC1=CC=CC([N+](=O)[O-])=C1 SBB064694 [0,2,0,0,0,0|2,0,0]=4 382 B12R1.280 C(=O)C1=C(O)C(OCC)=CC=C1 SBB008590 [0,2,0,0,0,0|2,0,0]=4 383 B12R1.280 COC1=CC=CC(\C=N\O)=C1O SBB080215 [0,2,0,0,0,0|2,0,0]=4 384 B12R1.286 CCOC1=CC(C=O)=C(O)C=C1 SBB085314 [0,2,0,0,0,0|2,0,0]=4 385 B12R1.286 COC1=C(O)C=CC(SC#N)=C1 SBB000226 [0,2,0,0,0,0|0,1,1]=4 386 B12R1.286 COC1=C(O)C=CC(\C=N\O)=C1 SBB019876 [0,2,0,0,0,0|2,0,0]=4 387 B12R1.286 OC1=C(OC)C=C(CC=C)C=C1 SBB012362 [0,2,0,0,0,0|1,0,1]=4 388 B12R1.382 C#CCOC1=CC=CC(C=O)=C1 SBB302068 [0,2,0,0,0,0|2,0,0]=4 389 B12R1.382 CCCOC1=CC(C=O)=CC=C1 SBB009935 [0,2,0,0,0,0|2,0,0]=4 390 B12R1.382 COC1=CC(OCCN)=CC=C1 SBB016461 [0,2,0,0,0,0|0,0,0]=2 391 B12R1.382 COC1=CC=CC(CCCN)=C1 SBB010466 [0,2,0,0,0,0|1,0,0]=3 392 B12R1.382 COC1=CC=CC(OCCBr)=C1 SBB011620 [0,2,0,0,0,0|0,0,0]=2 393 B12R1.382 O=CC1=CC(OCCO)=CC=C1 SBB052152 [0,2,0,0,0,0|2,0,0]=4 394 B12R1.435 COC(=O)C1=CC(CO)=CC=C1 SBB059613 [0,2,0,0,0,0|2,0,0]=4 395 B12R1.435 COC(=O)C1=CC=CC(CBr)=C1 SBB005793 [0,2,0,0,0,0|2,0,0]=4 396 B12R1.435 COC(=O)C1=CC=CC(OC)=C1 SBB063351 [0,2,0,0,0,0|0,0,0]=2 397 B12R1.435 COC(=O)C1=NC=CC(OC)=C1 SBB053797 [0,2,0,0,0,0|1,0,0]=3 398 B12R1.435 COC1=CC(C(=O)C=O)=CC=C1 SBB087783 [0,2,0,0,0,0|1,0,1]=4 399 B12R1.435 COC1=CC(C(=O)CBr)=CC=C1 SBB065145 [0,2,0,0,0,0|1,0,0]=3 400 B12R1.435 COC1=CC(\C(N)=N\O)=CC=C1 SBB087995 [0,2,0,0,0,0|2,0,0]=4 401 B12R1.435 COC1=CC=CC(C(=O)NN)=C1 SBB032275 [0,2,0,0,0,0|2,0,0]=4 402 B12R1.438 CC(=O)OC1=CC=CC(C=O)=C1 SBB064213 [0,2,0,0,0,0|2,0,0]=4 403 B12R1.438 CC(C)OC1=CC(CN)=CC=C1 SBB010164 [0,2,0,0,0,0|2,0,0]=4 404 B12R1.438 CC(C)OC1=CC=CC(C=O)=C1 SBB009948 [0,2,0,0,0,0|2,0,0]=4 405 B12R1.438 COC1=CC(NC(C)=O)=CC=C1 SBB080674 [0,2,0,0,0,0|1,0,0]=3 406 B12R1.438 COC1=CC=CC(CC(=O)O)=C1 SBB042511 [0,2,0,0,0,0|1,0,1]=4 407 B12R1.438 COC1=CC=CC(CC(N)=S)=C1 SBB055060 [0,2,0,0,0,0|1,0,1]=4 408 B12R1.438 COC1=CC=CC(NC(N)=O)=C1 SBB087993 [0,2,0,0,0,0|1,0,1]=4 409 B12R1.438 CSC1=CC(NC(C)=O)=CC=C1 SBB115887 [0,2,0,0,0,0|1,1,0]=4 410 B12R1.438 FC(F)OC1=CC(CBr)=CC=C1 SBB098716 [0,2,0,0,0,0|2,0,0]=4 411 B12R1.438 N#CC1=CC=CC(OC(F)F)=C1 SBB088242 [0,2,0,0,0,0|2,0,0]=4 412 B12R1.438 NCC1=CC(OC(F)F)=CC=C1 SBB073438 [0,2,0,0,0,0|2,0,0]=4 413 B12R1.438 O=CC1=CC=CC(OC(F)F)=C1 SBB064711 [0,2,0,0,0,0|2,0,0]=4 414 B12R1.438 OCC1=CC=CC(OC(F)F)=C1 SBB088867 [0,2,0,0,0,0|2,0,0]=4 415 B12R1.56 COC1=C(N)C=CC([N+](=O)[O-])=C1 SBB056804 [0,2,0,0,0,0|2,0,0]=4 416 B12R1.56 COC1=C(O)C=CC([N+](=O)[O-])=C1 SBB008019 [0,2,0,0,0,0|2,0,0]=4 417 B12R1.56 COC1=CC(B(O)O)=CC=C1F SBB071262 [0,2,0,0,0,0|2,0,0]=4 418 B12R1.56 COC1=CC(C(=O)O)=CC=C1C SBB048279 [0,2,0,0,0,0|2,0,0]=4 419 B12R1.56 COC1=CC(C(=O)O)=CC=C1Cl SBB008504 [0,2,0,0,0,0|2,0,0]=4 420 B12R1.56 COC1=CC(C(=O)O)=CC=C1F SBB051453 [0,2,0,0,0,0|2,0,0]=4 421 B12R1.56 COC1=CC(C(=O)O)=CC=C1N SBB008622 [0,2,0,0,0,0|2,0,0]=4 422 B12R1.56 COC1=CC(C(=O)O)=CC=C1O SBB008280 [0,2,0,0,0,0|2,0,0]=4 423 B12R1.56 COC1=CC(C(C)=O)=CC=C1F SBB064944 [0,2,0,0,0,0|1,0,0]=3 424 B12R1.56 COC1=CC(C(C)=O)=CC=C1O SBB008060 [0,2,0,0,0,0|1,0,0]=3 425 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1Br SBB055504 [0,2,0,0,0,0|2,0,0]=4 426 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1C SBB065728 [0,2,0,0,0,0|2,0,0]=4 427 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1Cl SBB065746 [0,2,0,0,0,0|2,0,0]=4 428 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1I SBB064459 [0,2,0,0,0,0|2,0,0]=4 429 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1[O-] SBB005407 [0,2,0,0,0,0|2,0,0]=4 430 B12R1.258 CC(=O)C1=CC=CC(C(C)=O)=C1 SBB071421 [0,2,0,0,0,0|2,0,0]=4 431 B12R1.436 COC1=CC=CC(C(F)(F)F)=C1 SBB089131 [0,2,0,0,0,0|2,0,0]=4 432 B12R1.436 COC1=CC=CC(S(=O)(=O)Cl)=C1 SBB018078 [0,2,0,0,0,0|1,1,0]=4 433 B12R1.440 COC1=C(C)C(C(=O)O)=CC=C1 SBB064170 [0,2,0,0,0,0|2,0,0]=4 434 B12R1.440 COC1=C(F)C(B(O)O)=CC=C1 SBB052541 [0,2,0,0,0,0|2,0,0]=4 435 B12R1.440 COC1=C(O)C(C(=O)O)=CC=C1 SBB063040 [0,2,0,0,0,0|2,0,0]=4 436 B12R1.440 COC1=CC=CC(C(=O)O)=C1F SBB052782 [0,2,0,0,0,0|2,0,0]=4 437 B12R1.440 COC1=CC=CC([N+](=O)[O-])=C1Br SBB008642 [0,2,0,0,0,0|2,0,0]=4 438 B12R1.440 COC1=CC=CC([N+](=O)[O-])=C1C SBB055492 [0,2,0,0,0,0|2,0,0]=4 439 B12R1.453 COC1=CC(C(=O)O)=C(Cl)C=C1 SBB026476 [0,2,0,0,0,0|2,0,0]=4 440 B12R1.453 COC1=CC(C(N)=O)=C(Br)C=C1 SBB039990 [0,2,0,0,0,0|2,0,0]=4 441 B12R1.453 COC1=CC([N+](=O)[O-])=C(N)C=C1 SBB043655 [0,2,0,0,0,0|2,0,0]=4 442 B12R1.453 COC1=CC([N+](=O)[O-])=C(O)C=C1 SBB008447 [0,2,0,0,0,0|2,0,0]=4 443 B12R1.453 COC1=CC=C(Br)C(C(=O)Cl)=C1 SBB100623 [0,2,0,0,0,0|2,0,0]=4 444 B12R1.453 COC1=CC=C(Br)C(C(=O)O)=C1 SBB063335 [0,2,0,0,0,0|2,0,0]=4 445 B12R1.453 COC1=CC=C(Br)C([N+](=O)[O-])=C1 SBB009974 [0,2,0,0,0,0|2,0,0]=4 446 B12R1.453 COC1=CC=C(C)C(C(=O)O)=C1 SBB087983 [0,2,0,0,0,0|2,0,0]=4 447 B12R1.453 COC1=CC=C(C)C([N+](=O)[O-])=C1 SBB008488 [0,2,0,0,0,0|2,0,0]=4 448 B12R1.453 COC1=CC=C(Cl)C([N+](=O)[O-])=C1 SBB065038 [0,2,0,0,0,0|2,0,0]=4 449 B12R1.453 COC1=CC=C(F)C(B(O)O)=C1 SBB071214 [0,2,0,0,0,0|2,0,0]=4 450 B12R1.453 COC1=CC=C(N)C(C(=O)O)=C1 SBB052619 [0,2,0,0,0,0|2,0,0]=4 451 B12R1.453 COC1=CC=C(O)C(C(=O)O)=C1 SBB058327 [0,2,0,0,0,0|2,0,0]=4 452 B12R1.453 COC1=CC=C(O)C(C(C)=O)=C1 SBB063252 [0,2,0,0,0,0|1,0,0]=3 453 B12R1.654 C(=O)C1=C(Cl)C=CC(OC)=C1F SBB090841 [0,2,0,0,0,0|2,0,0]=4 454 B12R1.654 C(=O)C1=C(F)C=CC(OC)=C1Cl SBB090845 [0,2,0,0,0,0|2,0,0]=4 455 B12R1.654 C(=O)C1=C(F)C=CC(OC)=C1F SBB088589 [0,2,0,0,0,0|2,0,0]=4 456 B12R1.654 C(=O)C1=CC=C(F)C(OC)=C1F SBB088595 [0,2,0,0,0,0|2,0,0]=4 457 B12R1.654 COC1=C(Cl)C(C#N)=C(F)C=C1 SBB090328 [0,2,0,0,0,0|2,0,0]=4 458 B12R1.654 COC1=C(Cl)C(CBr)=C(F)C=C1 SBB101284 [0,2,0,0,0,0|2,0,0]=4 459 B12R1.654 COC1=C(Cl)C(CN)=C(F)C=C1 SBB091012 [0,2,0,0,0,0|2,0,0]=4 460 B12R1.654 COC1=C(F)C(C#N)=C(Cl)C=C1 SBB090326 [0,2,0,0,0,0|2,0,0]=4 461 B12R1.654 COC1=C(F)C(C#N)=C(F)C=C1 SBB088236 [0,2,0,0,0,0|2,0,0]=4 462 B12R1.654 COC1=C(F)C(C#N)=CC=C1F SBB064370 [0,2,0,0,0,0|2,0,0]=4 463 B12R1.654 COC1=C(F)C(CBr)=C(Cl)C=C1 SBB101286 [0,2,0,0,0,0|2,0,0]=4 464 B12R1.654 COC1=C(F)C(CBr)=C(F)C=C1 SBB098722 [0,2,0,0,0,0|2,0,0]=4 465 B12R1.654 COC1=C(F)C(CBr)=CC=C1F SBB098713 [0,2,0,0,0,0|2,0,0]=4 466 B12R1.654 COC1=C(F)C(CN)=C(Cl)C=C1 SBB091013 [0,2,0,0,0,0|2,0,0]=4 467 B12R1.654 COC1=C(F)C(CN)=C(F)C=C1 SBB088746 [0,2,0,0,0,0|2,0,0]=4 468 B12R1.654 COC1=C(F)C(CN)=CC=C1F SBB088745 [0,2,0,0,0,0|2,0,0]=4 469 B12R1.1879 C(=O)C1=C(OC)C=CC=C1OC SBB006541 [0,2,0,0,0,0|0,0,0]=2 470 B12R1.1879 COC1=C(OC)C(C=O)=CC=C1 SBB040206 [0,2,0,0,0,0|2,0,0]=4 471 B12R1.1879 COC1=C(OC)C(CO)=CC=C1 SBB058562 [0,2,0,0,0,0|2,0,0]=4 472 B12R1.1879 COC1=CC=CC(C#N)=C1OC SBB057288 [0,2,0,0,0,0|2,0,0]=4 473 B12R1.1879 COC1=CC=CC(OC)=C1C#N SBB068894 [0,2,0,0,0,0|0,0,0]=2 474 B12R1.1879 COC1=CC=CC(OC)=C1CN SBB059502 [0,2,0,0,0,0|0,0,0]=2 475 B12R1.1879 COC1=CC=CC(OC)=C1SC SBB059007 [0,2,0,0,0,0|0,0,0]=2 476 B12R1.78 CCC1=C(OC)C=CC(OC)=C1 SBB014717 [0,2,0,0,0,0|1,0,0]=3 477 B12R1.78 COC1=C(OC)C=C(C#N)C=C1 SBB028801 [0,2,0,0,0,0|2,0,0]=4 478 B12R1.78 COC1=C(OC)C=C(CN)C=C1 SBB042487 [0,2,0,0,0,0|2,0,0]=4 479 B12R1.78 COC1=C(OC)C=C(CO)C=C1 SBB058837 [0,2,0,0,0,0|2,0,0]=4 480 B12R1.78 COC1=CC(C#N)=C(OC)C=C1 SBB058340 [0,2,0,0,0,0|2,0,0]=4 481 B12R1.78 COC1=CC(CN)=C(OC)C=C1 SBB047767 [0,2,0,0,0,0|2,0,0]=4 482 B12R1.78 COC1=CC(OC)=C(CN)C=C1 SBB000428 [0,2,0,0,0,0|0,0,0]=2 483 B12R1.78 COC1=CC(OC)=C(CN)C=C1 SBB047769 [0,2,0,0,0,0|0,0,0]=2 484 B12R1.78 COC1=CC=C(C#N)C(OC)=C1 SBB063099 [0,2,0,0,0,0|0,0,0]=2 485 B12R1.78 COC1=CC=C(C=O)C(OC)=C1 SBB040221 [0,2,0,0,0,0|0,0,0]=2 486 B12R1.78 COC1=CC=C(C=O)C(OC)=N1 SBB065549 [0,2,0,0,0,0|1,0,0]=3 487 B12R1.78 COC1=CC=C(C=O)C=C1OC SBB040236 [0,2,0,0,0,0|2,0,0]=4 488 B12R1.78 COC1=CC=C(CO)C(OC)=C1 SBB063101 [0,2,0,0,0,0|0,0,0]=2 489 B12R1.78 COC1=CC=C(OC)C(C=O)=C1 SBB040207 [0,2,0,0,0,0|2,0,0]=4 490 B12R1.78 COC1=CC=C(OC)C(CCl)=C1 SBB090509 [0,2,0,0,0,0|2,0,0]=4 491 B12R1.78 COC1=NC(OC)=C(C=O)C=N1 SBB049503 [0,2,0,0,0,0|2,0,0]=4 492 B12R1.449 COC1=C(O)C=C(Br)C(C#N)=C1 SBB028709 [0,2,0,0,0,0|2,0,0]=4 493 B12R1.449 COC1=C(O)C=C(Br)C(C=O)=C1 SBB019880 [0,2,0,0,0,0|2,0,0]=4 494 B12R1.449 COC1=C(O)C=C(Cl)C(C=O)=C1 SBB010751 [0,2,0,0,0,0|2,0,0]=4 495 B12R1.449 COC1=CC(C=O)=C(O)C=C1O SBB072148 [0,2,0,0,0,0|2,0,0]=4 496 B12R1.449 NC1=C(OC)C=C(OC)C(Cl)=C1 SBB003682 [0,2,0,0,0,0|0,0,0]=2 497 B10R1.149 COC(=O)C1=CC=CN1C SBB086060 [0,0,1,1,0,0|2,0,0]=4 498 B10R2.7 C1=C2OCCOC2=CS1 SBB042427 [0,0,0,1,1,0|1,0,0]=3 499 B12R2.44 COC1=CC2=NON=C2C=C1 SBB086688 [0,1,0,1,0,0|1,0,0]=3 500 B12R2.44 COC1=CC2=NSN=C2C=C1 SBB088014 [0,1,0,1,0,0|1,1,0]=4 501 B12R2.44 COC1=CC=C2C=CNC2=C1 SBB055970 [0,1,0,1,0,0|1,0,1]=4 502 B12R2.44 COC1=CC=C2NC=NC2=C1 SBB086586 [0,1,0,1,0,0|1,0,1]=4 503 B12R2.44 N#CC1=CC=C2OCOC2=C1 SBB014538 [0,1,0,1,0,0|2,0,0]=4 504 B12R2.44 N1C=CC2=C1C=CC(OC)=C2 SBB004094 [0,1,0,1,0,0|1,0,1]=4 505 B12R2.44 NCC1=CC=C2OCOC2=C1 SBB002587 [0,1,0,1,0,0|2,0,0]=4 506 B12R2.44 OCC1=CC2=C(C=C1)OCO2 SBB004053 [0,1,0,1,0,0|2,0,0]=4 507 B12R2.315 COC1=C2C=CNC2=CC=C1 SBB055969 [0,1,0,1,0,0|1,0,1]=4 508 B12R2.315 COC1=C2NC=CC2=CC=C1 SBB055971 [0,1,0,1,0,0|1,0,1]=4 509 B12R2.315 O=CC1=CC=CC2=C1OCO2 SBB004074 [0,1,0,1,0,0|2,0,0]=4 510 B10R1.3 C#CC1=CC=C(OC)C=C1 SBB063612 [0,0,0,0,1,1|1,0,1]=4 511 B10R1.3 CCC1=CC=C(CC)C=C1 SBB061169 [0,0,0,0,1,1|2,0,0]=4 512 B10R1.3 CCC1=CC=C(OC)C=C1 SBB060457 [0,0,0,0,1,1|1,0,0]=3 513 B10R1.3 CNC1=CC=C(OC)C=C1 SBB072645 [0,0,0,0,1,1|1,0,0]=3 514 B10R1.3 COC1=CC=C(C#N)C=C1 SBB059484 [0,0,0,0,1,1|2,0,0]=4 515 B10R1.3 COC1=CC=C(C#N)C=N1 SBB055563 [0,0,0,0,1,1|2,0,0]=4 516 B10R1.3 COC1=CC=C(C=O)C=C1 SBB040224 [0,0,0,0,1,1|2,0,0]=4 517 B10R1.3 COC1=CC=C(C=O)C=N1 SBB052248 [0,0,0,0,1,1|2,0,0]=4 518 B10R1.3 COC1=CC=C(CBr)C=C1 SBB054916 [0,0,0,0,1,1|2,0,0]=4 519 B10R1.3 COC1=CC=C(CCl)C=C1 SBB040608 [0,0,0,0,1,1|2,0,0]=4 520 B10R1.3 COC1=CC=C(CN)C=C1 SBB040460 [0,0,0,0,1,1|2,0,0]=4 521 B10R1.3 COC1=CC=C(CO)C=C1 SBB063123 [0,0,0,0,1,1|2,0,0]=4 522 B10R1.3 COC1=CC=C(NN)C=C1 SBB012784 [0,0,0,0,1,1|2,0,0]=4 523 B10R1.3 COC1=CC=C(NN)C=C1 SBB063180 [0,0,0,0,1,1|2,0,0]=4 524 B10R1.3 COC1=CC=C(OC)C=C1 SBB060067 [0,0,0,0,1,1|0,0,0]=2