0 B10R1.20 C(=O)C1=C(C#N)C=CC=C1 SBB059365 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.20 C(=O)C1=C(C=O)C=CC=C1 SBB008450 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.20 CCC1=CC=CC=C1C=O SBB064652 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.20 CNC1=C(C=O)C=CC=N1 SBB010268 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.20 CNC1=NC=CC=C1CO SBB054793 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.20 COC1=C(C#N)C=CC=N1 SBB019387 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.20 COC1=C(NN)C=CC=C1 SBB001582 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.20 COC1=C(OC)C=CC=C1 SBB060065 [0,0,0,0,0,0|1,0,1]=2 8 B10R1.20 COC1=C(SC)C=CC=C1 SBB058991 [0,0,0,0,0,0|1,0,1]=2 9 B10R1.20 COC1=CC=CC=C1C#N SBB063016 [0,0,0,0,0,0|1,0,1]=2 10 B10R1.20 COC1=CC=CC=C1C=O SBB040234 [0,0,0,0,0,0|1,0,0]=1 11 B10R1.20 COC1=CC=CC=C1CCl SBB058821 [0,0,0,0,0,0|1,0,1]=2 12 B10R1.20 COC1=CC=CC=C1CN SBB040466 [0,0,0,0,0,0|1,0,1]=2 13 B10R1.20 COC1=CC=CC=C1CO SBB041053 [0,0,0,0,0,0|1,0,1]=2 14 B10R1.20 COC1=CC=CC=C1NN SBB064481 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.20 N#CC1=C(C#N)C=CC=C1 SBB058787 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.20 N#CC1=C(CBr)C=CC=C1 SBB038006 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.20 N#CC1=C(CCl)C=CC=C1 SBB064065 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.20 OCC1=CC=CC=C1CO SBB064016 [0,0,0,0,0,0|3,0,1]=4 19 B9R1.15 C(=O)C1=CC=CN=C1Cl SBB004156 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.15 CC1=C(C#N)C=CC=C1 SBB058479 [1,0,0,0,0,0|1,0,1]=3 21 B9R1.15 CC1=C(C=O)C=CN=C1 SBB065410 [1,0,0,0,0,0|2,0,0]=3 22 B9R1.15 CC1=C(C=O)C=NC=C1 SBB052236 [1,0,0,0,0,0|2,0,0]=3 23 B9R1.15 CC1=C(CBr)N=CC=C1 SBB021212 [1,0,0,0,0,0|2,0,1]=4 24 B9R1.15 CC1=C(CCl)C=CC=C1 SBB040606 [1,0,0,0,0,0|1,0,1]=3 25 B9R1.15 CC1=C(CN)C=CC=C1 SBB042694 [1,0,0,0,0,0|1,0,1]=3 26 B9R1.15 CC1=C(NN)C=CC=C1 SBB017148 [1,0,0,0,0,0|2,0,0]=3 27 B9R1.15 CC1=C(NN)C=CC=C1 SBB064148 [1,0,0,0,0,0|2,0,0]=3 28 B9R1.15 CC1=CC=CC=C1CO SBB065157 [1,0,0,0,0,0|1,0,1]=3 29 B9R1.15 CC1=CC=CC=C1CS SBB086035 [1,0,0,0,0,0|1,0,1]=3 30 B9R1.15 CC1=CC=CN=C1C#N SBB055741 [1,0,0,0,0,0|2,0,1]=4 31 B9R1.15 CC1=CC=CN=C1C=O SBB052241 [1,0,0,0,0,0|2,0,0]=3 32 B9R1.15 CC1=CC=CN=C1CN SBB052454 [1,0,0,0,0,0|2,0,1]=4 33 B9R1.15 CC1=CC=NC=C1C#N SBB055519 [1,0,0,0,0,0|2,0,1]=4 34 B9R1.15 CCC1=C(N)C=CC=C1 SBB040452 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.15 CCC1=CC=CC=C1C SBB061450 [1,0,0,0,0,0|0,0,2]=3 36 B9R1.15 CNC1=CC=CC=C1Cl SBB086216 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.15 CNC1=CC=CC=C1F SBB051706 [1,0,0,0,0,0|2,0,0]=3 38 B9R1.15 CNC1=CC=CC=C1N SBB071575 [1,0,0,0,0,0|2,0,0]=3 39 B9R1.15 COC1=C(I)N=CC=C1 SBB098345 [1,0,0,0,0,0|2,0,0]=3 40 B9R1.15 COC1=C(N)C=CC=C1 SBB028142 [1,0,0,0,0,0|1,0,0]=2 41 B9R1.15 COC1=C(O)C=CC=C1 SBB058681 [1,0,0,0,0,0|1,0,0]=2 42 B9R1.15 COC1=CC=CC=C1Cl SBB060957 [1,0,0,0,0,0|1,0,0]=2 43 B9R1.15 COC1=CC=CC=C1F SBB040818 [1,0,0,0,0,0|1,0,0]=2 44 B9R1.15 COC1=CC=CN=C1Br SBB005633 [1,0,0,0,0,0|2,0,0]=3 45 B9R1.15 COC1=CC=CN=C1N SBB051907 [1,0,0,0,0,0|2,0,0]=3 46 B9R1.15 COC1=CC=CN=C1O SBB046500 [1,0,0,0,0,0|2,0,0]=3 47 B9R1.15 COC1=NC=CN=C1N SBB051948 [1,0,0,0,0,0|3,0,0]=4 48 B9R1.15 CSC1=C(Br)C=CC=C1 SBB006566 [1,0,0,0,0,0|1,1,0]=3 49 B9R1.15 CSC1=C(Cl)C=CC=C1 SBB058978 [1,0,0,0,0,0|1,1,0]=3 50 B9R1.15 CSC1=NC=CC=C1N SBB072554 [1,0,0,0,0,0|2,1,0]=4 51 B9R1.15 ClCC1=C(Cl)C=CC=C1 SBB040669 [1,0,0,0,0,0|2,0,1]=4 52 B9R1.15 FC1=C(CBr)C=CC=C1 SBB058868 [1,0,0,0,0,0|2,0,1]=4 53 B9R1.15 FC1=C(CCl)C=CC=C1 SBB040603 [1,0,0,0,0,0|2,0,1]=4 54 B9R1.15 N#CC1=C(Br)C=CC=C1 SBB008569 [1,0,0,0,0,0|2,0,1]=4 55 B9R1.15 N#CC1=C(Cl)C=CC=C1 SBB058443 [1,0,0,0,0,0|2,0,1]=4 56 B9R1.15 N#CC1=C(I)C=CC=C1 SBB059075 [1,0,0,0,0,0|2,0,1]=4 57 B9R1.15 N#CC1=C(N)C=CC=C1 SBB059814 [1,0,0,0,0,0|2,0,1]=4 58 B9R1.15 N#CC1=C(O)C=CC=C1 SBB007959 [1,0,0,0,0,0|1,0,1]=3 59 B9R1.15 N#CC1=C(O)N=CC=C1 SBB065243 [1,0,0,0,0,0|2,0,1]=4 60 B9R1.15 N#CC1=CC=CC=C1F SBB063132 [1,0,0,0,0,0|2,0,1]=4 61 B9R1.15 NC1=C(C=O)C=NC=C1 SBB014341 [1,0,0,0,0,0|3,0,0]=4 62 B9R1.15 NC1=C(CO)C=CC=C1 SBB058759 [1,0,0,0,0,0|2,0,1]=4 63 B9R1.15 NC1=CC=CC=C1C=O SBB061591 [1,0,0,0,0,0|2,0,0]=3 64 B9R1.15 NC1=CN=CC=C1C=O SBB052230 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.15 NC1=NC=CC=C1C=O SBB012985 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.15 NCC1=C(Cl)C=CC=C1 SBB004151 [1,0,0,0,0,0|2,0,1]=4 67 B9R1.15 NCC1=C(F)C=CC=C1 SBB028214 [1,0,0,0,0,0|2,0,1]=4 68 B9R1.15 NCC1=CC=CC=C1Br SBB052369 [1,0,0,0,0,0|2,0,1]=4 69 B9R1.15 NCC1=CC=CC=C1Br SBB052411 [1,0,0,0,0,0|2,0,1]=4 70 B9R1.15 NNC1=C(Cl)C=CC=C1 SBB017145 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.15 NNC1=CC=CC=C1Br SBB017150 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.15 NNC1=CC=CC=C1Br SBB063185 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.15 NNC1=CC=CC=C1F SBB012668 [1,0,0,0,0,0|3,0,0]=4 74 B9R1.15 NNC1=CC=CC=C1F SBB063993 [1,0,0,0,0,0|3,0,0]=4 75 B9R1.15 NNC1=CC=CC=C1I SBB001769 [1,0,0,0,0,0|3,0,0]=4 76 B9R1.15 O=CC1=C(F)C=NC=C1 SBB065535 [1,0,0,0,0,0|3,0,0]=4 77 B9R1.15 O=CC1=CC=CC=C1Br SBB040217 [1,0,0,0,0,0|2,0,0]=3 78 B9R1.15 O=CC1=CC=CC=C1Cl SBB040228 [1,0,0,0,0,0|2,0,0]=3 79 B9R1.15 O=CC1=CC=CC=C1F SBB040198 [1,0,0,0,0,0|2,0,0]=3 80 B9R1.15 O=CC1=CC=CC=C1I SBB017119 [1,0,0,0,0,0|2,0,0]=3 81 B9R1.15 O=CC1=CC=CC=C1O SBB040225 [1,0,0,0,0,0|1,0,0]=2 82 B9R1.15 O=CC1=CC=CN=C1Br SBB052224 [1,0,0,0,0,0|3,0,0]=4 83 B9R1.15 O=CC1=CC=CN=C1F SBB065263 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.15 O=CC1=CC=NC=C1Br SBB052233 [1,0,0,0,0,0|3,0,0]=4 85 B9R1.15 O=CC1=CN=CC=C1Cl SBB065433 [1,0,0,0,0,0|3,0,0]=4 86 B9R1.15 O=CC1=NC=CC=C1F SBB065527 [1,0,0,0,0,0|3,0,0]=4 87 B9R1.15 OCC1=C(F)C=CC=C1 SBB064085 [1,0,0,0,0,0|2,0,1]=4 88 B9R1.15 OCC1=C(O)C=CC=N1 SBB085588 [1,0,0,0,0,0|2,0,1]=4 89 B9R1.15 OCC1=CC=CC=C1Br SBB063922 [1,0,0,0,0,0|2,0,1]=4 90 B9R1.15 OCC1=CC=CC=C1Cl SBB058557 [1,0,0,0,0,0|2,0,1]=4 91 B9R1.15 OCC1=CC=CC=C1O SBB065036 [1,0,0,0,0,0|1,0,1]=3 92 B9R1.15 SCC1=CC=CC=C1Br SBB066540 [1,0,0,0,0,0|2,0,1]=4 93 B9R1.15 [NH3+]NC1=CC=CC=C1Cl SBB058433 [1,0,0,0,0,0|3,0,0]=4 94 B11R1.37 C(=O)C1=C(OC)C=C(O)C=C1 SBB008607 [0,1,0,0,0,0|1,0,0]=2 95 B11R1.37 C(=O)C1=C(OC)C=CC(C)=C1 SBB017648 [0,1,0,0,0,0|1,0,0]=2 96 B11R1.37 CCC1=CC(Br)=CC=C1NN SBB001776 [0,1,0,0,0,0|3,0,0]=4 97 B11R1.37 COC1=C(C#N)C=C(N)C=C1 SBB019228 [0,1,0,0,0,0|1,0,1]=3 98 B11R1.37 COC1=C(C=O)C=C(I)C=C1 SBB035873 [0,1,0,0,0,0|1,0,0]=2 99 B11R1.37 COC1=C(C=O)C=C(O)C=C1 SBB072119 [0,1,0,0,0,0|1,0,0]=2 100 B11R1.37 COC1=C(CBr)C=C(F)C=C1 SBB095700 [0,1,0,0,0,0|1,0,1]=3 101 B11R1.37 COC1=C(CCl)C=C(Cl)C=C1 SBB014940 [0,1,0,0,0,0|1,0,1]=3 102 B11R1.37 COC1=C(CN)C=C(F)C=C1 SBB087073 [0,1,0,0,0,0|1,0,1]=3 103 B11R1.37 COC1=C(CO)C=C(F)C=C1 SBB087136 [0,1,0,0,0,0|1,0,1]=3 104 B11R1.37 COC1=C(OC)C=C(Br)C=C1 SBB058860 [0,1,0,0,0,0|1,0,1]=3 105 B11R1.37 COC1=C(OC)C=C(F)C=C1 SBB087142 [0,1,0,0,0,0|1,0,1]=3 106 B11R1.37 COC1=C(OC)C=C(O)C=C1 SBB055250 [0,1,0,0,0,0|1,0,1]=3 107 B11R1.37 COC1=CC(C)=CC=C1C=O SBB010322 [0,1,0,0,0,0|1,0,0]=2 108 B11R1.37 COC1=CC(F)=CC=C1C#N SBB063923 [0,1,0,0,0,0|1,0,1]=3 109 B11R1.37 COC1=CC(F)=CC=C1C=O SBB064433 [0,1,0,0,0,0|1,0,0]=2 110 B11R1.37 COC1=CC=C(Br)C=C1C#N SBB020096 [0,1,0,0,0,0|1,0,1]=3 111 B11R1.37 COC1=CC=C(Br)C=C1C=O SBB020095 [0,1,0,0,0,0|1,0,0]=2 112 B11R1.37 COC1=CC=C(Br)C=C1CO SBB064488 [0,1,0,0,0,0|1,0,1]=3 113 B11R1.37 COC1=CC=C(Cl)C=C1C#N SBB055247 [0,1,0,0,0,0|1,0,1]=3 114 B11R1.37 COC1=CC=C(Cl)C=C1C=O SBB068756 [0,1,0,0,0,0|1,0,0]=2 115 B11R1.37 COC1=CC=C(Cl)C=C1NN SBB012665 [0,1,0,0,0,0|2,0,0]=3 116 B11R1.37 COC1=CC=C(F)C=C1C#N SBB064644 [0,1,0,0,0,0|1,0,1]=3 117 B11R1.37 COC1=CC=C(F)C=C1C=O SBB052144 [0,1,0,0,0,0|1,0,0]=2 118 B11R1.37 COC1=CC=C(S)C=C1OC SBB066510 [0,1,0,0,0,0|1,0,1]=3 119 B11R1.37 COC1=NC(C)=CC=C1C#N SBB072562 [0,1,0,0,0,0|2,0,1]=4 120 B11R1.37 COC1=NC=C(Br)C=C1C=O SBB065477 [0,1,0,0,0,0|2,0,0]=3 121 B11R1.37 N#CC1=CC(F)=CC=C1C=O SBB052141 [0,1,0,0,0,0|3,0,0]=4 122 B11R1.41 CCC1=CC=CC=C1N=C=O SBB046955 [0,1,0,0,0,0|2,0,1]=4 123 B11R1.41 CCC1=CC=CC=C1N=C=S SBB087721 [0,1,0,0,0,0|2,0,1]=4 124 B11R1.41 CCNC1=C(OC)C=CC=C1 SBB080368 [0,1,0,0,0,0|0,0,2]=3 125 B11R1.41 CCOC1=CC=CC=C1C#N SBB063688 [0,1,0,0,0,0|1,0,1]=3 126 B11R1.41 CCOC1=CC=CC=C1C=O SBB040196 [0,1,0,0,0,0|1,0,0]=2 127 B11R1.41 CCOC1=CC=CC=C1CN SBB070035 [0,1,0,0,0,0|1,0,1]=3 128 B11R1.41 CCOC1=CC=CC=C1NN SBB001773 [0,1,0,0,0,0|2,0,0]=3 129 B11R1.41 COC1=C(\C=N\O)C=CC=C1 SBB008011 [0,1,0,0,0,0|1,0,0]=2 130 B11R1.41 COC1=CC=CC=C1CC#N SBB065125 [0,1,0,0,0,0|0,0,2]=3 131 B11R1.41 COC1=CC=CC=C1CC=O SBB052207 [0,1,0,0,0,0|0,0,1]=2 132 B11R1.41 COC1=CC=CC=C1CCBr SBB027259 [0,1,0,0,0,0|0,0,2]=3 133 B11R1.41 COC1=CC=CC=C1N=C=O SBB048855 [0,1,0,0,0,0|1,0,1]=3 134 B11R1.41 COC1=CC=CC=C1N=C=S SBB002730 [0,1,0,0,0,0|1,0,1]=3 135 B11R1.41 COCC1=C(CN)C=CC=C1 SBB085424 [0,1,0,0,0,0|1,0,1]=3 136 B11R1.53 CC(C)C1=CC=CC=C1NN SBB001771 [0,1,0,0,0,0|3,0,0]=4 137 B11R1.53 CCC1=C(B(O)O)C=CC=C1 SBB025627 [0,1,0,0,0,0|3,0,0]=4 138 B11R1.53 CCC1=CC=CC=C1C(=O)O SBB052735 [0,1,0,0,0,0|2,0,0]=3 139 B11R1.53 CCC1=CC=CC=C1[N+](=O)[O-] SBB060418 [0,1,0,0,0,0|3,0,0]=4 140 B11R1.53 CNC1=C(C(=O)O)C=CC=C1 SBB006591 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.53 CNC1=C(C(N)=O)C=CC=C1 SBB017649 [0,1,0,0,0,0|2,0,0]=3 142 B11R1.53 CNC1=CC=CC=C1[N+](=O)[O-] SBB111711 [0,1,0,0,0,0|3,0,0]=4 143 B11R1.53 CNC1=NC=CC=C1C(=O)O SBB027645 [0,1,0,0,0,0|3,0,0]=4 144 B11R1.53 COC1=C(C(N)=S)C=CC=C1 SBB088105 [0,1,0,0,0,0|1,0,0]=2 145 B11R1.53 COC1=C([C@@H](C)N)C=CC=C1 SBB027293 [0,1,0,0,0,0|0,0,2]=3 146 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 SBB027290 [0,1,0,0,0,0|0,0,2]=3 147 B11R1.53 COC1=C([N+](=O)[O-])C=NC=C1 SBB012806 [0,1,0,0,0,0|3,0,0]=4 148 B11R1.53 COC1=CC=CC=C1C(=O)Cl SBB061370 [0,1,0,0,0,0|1,0,0]=2 149 B11R1.53 COC1=CC=CC=C1C(=O)O SBB040527 [0,1,0,0,0,0|1,0,0]=2 150 B11R1.53 COC1=CC=CC=C1C(C)=O SBB040282 [0,1,0,0,0,0|0,0,1]=2 151 B11R1.53 COC1=CC=CC=C1[N+](=O)[O-] SBB061020 [0,1,0,0,0,0|2,0,0]=3 152 B11R1.53 COC1=CC=CN=C1[N+](=O)[O-] SBB055722 [0,1,0,0,0,0|3,0,0]=4 153 B11R1.53 COC1=NC=CC=C1B(O)O SBB052567 [0,1,0,0,0,0|3,0,0]=4 154 B11R1.53 COC1=NC=CC=C1C(=O)O SBB005441 [0,1,0,0,0,0|2,0,0]=3 155 B11R1.53 COC1=NC=CC=C1[N+](=O)[O-] SBB065303 [0,1,0,0,0,0|3,0,0]=4 156 B11R1.53 CSC1=C([N+](=O)[O-])C=CC=C1 SBB058972 [0,1,0,0,0,0|2,1,0]=4 157 B11R1.53 CSC1=CC=CC=C1B(O)O SBB052543 [0,1,0,0,0,0|2,1,0]=4 158 B11R1.53 CSC1=CC=CC=C1C(=O)O SBB071591 [0,1,0,0,0,0|1,1,0]=3 159 B11R1.53 CSC1=NC=CC=C1C(=O)Cl SBB090661 [0,1,0,0,0,0|2,1,0]=4 160 B11R1.53 CSC1=NC=CC=C1C(=O)O SBB003868 [0,1,0,0,0,0|2,1,0]=4 161 B11R1.53 N#CC1=C(C(=O)O)C=CC=C1 SBB008461 [0,1,0,0,0,0|3,0,0]=4 162 B11R1.53 N#CC1=C(C(N)=O)C=CC=C1 SBB007653 [0,1,0,0,0,0|3,0,0]=4 163 B11R1.53 NCC1=CC=CC=C1C(=O)O SBB013822 [0,1,0,0,0,0|3,0,0]=4 164 B11R1.53 O=C(O)C1=CC=CC=C1CBr SBB052679 [0,1,0,0,0,0|3,0,0]=4 165 B11R1.53 O=CC1=C(B(O)O)C=CC=C1 SBB048061 [0,1,0,0,0,0|3,0,0]=4 166 B11R1.53 O=CC1=CC=CC=C1C(=O)O SBB040275 [0,1,0,0,0,0|3,0,0]=4 167 B11R1.53 O=CC1=CC=CC=C1[N+](=O)[O-] SBB040201 [0,1,0,0,0,0|3,0,0]=4 168 B11R1.265 CCC1=C(NN)C(C)=CC=C1 SBB001766 [0,1,0,0,0,0|3,0,0]=4 169 B11R1.265 CCC1=CC=CC(C)=C1C#N SBB055360 [0,1,0,0,0,0|2,0,1]=4 170 B11R1.265 COC1=C(C#N)C(=O)NC=C1 SBB055629 [0,1,0,0,0,0|2,0,1]=4 171 B11R1.265 COC1=C(C#N)C=CC=C1F SBB086763 [0,1,0,0,0,0|1,0,1]=3 172 B11R1.265 COC1=C(C=O)C(O)=CC=C1 SBB042847 [0,1,0,0,0,0|1,0,0]=2 173 B11R1.265 COC1=C(CBr)C=CC=C1F SBB095698 [0,1,0,0,0,0|1,0,1]=3 174 B11R1.265 COC1=C(CN)C=CC=C1F SBB087072 [0,1,0,0,0,0|1,0,1]=3 175 B11R1.265 COC1=C(CO)C=CC=C1F SBB087135 [0,1,0,0,0,0|1,0,1]=3 176 B11R1.265 COC1=C(F)C=CC=C1C=O SBB068761 [0,1,0,0,0,0|1,0,0]=2 177 B11R1.265 COC1=CC=CC(F)=C1C#N SBB055259 [0,1,0,0,0,0|1,0,1]=3 178 B11R1.265 COC1=CC=CC(F)=C1C=O SBB086986 [0,1,0,0,0,0|1,0,0]=2 179 B11R1.265 COC1=CC=CC(F)=C1CBr SBB095697 [0,1,0,0,0,0|1,0,1]=3 180 B11R1.265 COC1=CC=CC(F)=C1CO SBB087141 [0,1,0,0,0,0|1,0,1]=3 181 B11R1.265 COC1=CC=CC(N)=C1OC SBB036148 [0,1,0,0,0,0|1,0,1]=3 182 B11R2.1 BrC1=COC2=CC=CC=C12 SBB054554 [0,0,0,1,0,0|1,0,1]=3 183 B11R2.1 BrC1=CSC2=C1C=CC=C2 SBB003415 [0,0,0,1,0,0|1,1,1]=4 184 B11R2.1 CC1=CNC2=CC=CC=C12 SBB055975 [0,0,0,1,0,0|2,0,0]=3 185 B11R2.1 CC1=CSC2=CC=CC=C12 SBB086600 [0,0,0,1,0,0|2,0,0]=3 186 B11R2.1 ClC1=NSC2=C1C=CC=C2 SBB088345 [0,0,0,1,0,0|2,1,0]=4 187 B11R2.1 N1N=C(Cl)C2=C1C=CC=C2 SBB004051 [0,0,0,1,0,0|3,0,0]=4 188 B11R2.1 NC1=C2C=CC=CC2=NS1 SBB018834 [0,0,0,1,0,0|3,0,0]=4 189 B11R2.1 NC1=CNC2=C1C=CC=C2 SBB010263 [0,0,0,1,0,0|2,0,1]=4 190 B11R2.1 NC1=NCC2=C1C=CC=C2 SBB003870 [0,0,0,1,0,0|3,0,0]=4 191 B11R2.1 NC1=NCC2=C1C=CC=C2 SBB003871 [0,0,0,1,0,0|3,0,0]=4 192 B11R2.1 NC1=NNC2=CC=CC=C21 SBB052086 [0,0,0,1,0,0|3,0,0]=4 193 B11R2.1 NC1=NOC2=CC=CC=C21 SBB040079 [0,0,0,1,0,0|2,0,0]=3 194 B11R2.1 NC1CCC2=C1C=CC=C2 SBB004212 [0,0,0,1,0,0|2,0,1]=4 195 B11R2.1 O=C1CCC2=C1C=CC=N2 SBB056372 [0,0,0,1,0,0|3,0,0]=4 196 B11R2.1 O=C1CCC2=CC=CC=C12 SBB056339 [0,0,0,1,0,0|2,0,0]=3 197 B11R2.1 O=C1COC2=CC=CC=C12 SBB056285 [0,0,0,1,0,0|1,0,0]=2 198 B11R2.1 O=C1NNC2=C1C=CC=C2 SBB004210 [0,0,0,1,0,0|3,0,0]=4 199 B11R2.1 O=C1OCC2=C1C=CC=C2 SBB056840 [0,0,0,1,0,0|3,0,0]=4 200 B11R2.1 OC1=NOC2=CC=CC=C21 SBB056388 [0,0,0,1,0,0|2,0,0]=3 201 B11R2.20 C1=CC2=C(C=C1)CCCC2 SBB060619 [0,0,0,1,0,0|1,0,2]=4 202 B11R2.20 C1=CC2=C(C=C1)CNCC2 SBB027303 [0,0,0,1,0,0|2,0,1]=4 203 B11R2.20 C1=CC2=C(C=C1)N=CC=N2 SBB085760 [0,0,0,1,0,0|2,0,1]=4 204 B11R2.20 C1=CC2=C(C=C1)SCCN2 SBB010332 [0,0,0,1,0,0|1,1,1]=4 205 B11R2.20 C1=CC2=C(C=CC=N2)N=C1 SBB059694 [0,0,0,1,0,0|2,0,1]=4 206 B11R2.20 C1=CC2=CC=NC=C2C=C1 SBB060380 [0,0,0,1,0,0|2,0,0]=3 207 B11R2.20 C1=CC2=CN=CC=C2N=C1 SBB056301 [0,0,0,1,0,0|2,0,1]=4 208 B11R2.20 C1=CC2=CN=CN=C2C=C1 SBB085761 [0,0,0,1,0,0|2,0,1]=4 209 B11R2.20 C1=CC=C2NCCCC2=C1 SBB040463 [0,0,0,1,0,0|1,0,2]=4 210 B11R2.20 C1=CC=C2OCCNC2=C1 SBB039942 [0,0,0,1,0,0|1,0,1]=3 211 B11R2.20 C1=CN=C2C=CC=CC2=C1 SBB060379 [0,0,0,1,0,0|1,0,1]=3 212 B9R1.14 COC1=C(C=O)SC=C1 SBB086238 [0,0,0,0,1,0|2,0,0]=3 213 B9R1.14 COC1=CSC=C1OC SBB042426 [0,0,0,0,1,0|2,0,1]=4 214 B8R1.2 C#CC1=CC=CC=C1 SBB040919 [2,0,0,0,0,0|0,0,2]=4 215 B8R1.2 C=CC1=NC=CN=C1 SBB055880 [2,0,0,0,0,0|2,0,0]=4 216 B8R1.2 CCC1=CC=CC=C1 SBB040891 [2,0,0,0,0,0|1,0,0]=3 217 B8R1.2 CCC1=CC=CC=N1 SBB060373 [2,0,0,0,0,0|2,0,0]=4 218 B8R1.2 CCC1=CC=NC=C1 SBB061128 [2,0,0,0,0,0|2,0,0]=4 219 B8R1.2 CCC1=CN=CC=C1 SBB060374 [2,0,0,0,0,0|2,0,0]=4 220 B8R1.2 CNC1=CC=CC=C1 SBB008162 [2,0,0,0,0,0|1,0,0]=3 221 B8R1.2 CNC1=CC=CC=C1 SBB059778 [2,0,0,0,0,0|1,0,0]=3 222 B8R1.2 N#CC1=CC=CC=C1 SBB028746 [2,0,0,0,0,0|1,0,1]=4 223 B8R1.2 NCC1=CC=CC=C1 SBB040473 [2,0,0,0,0,0|1,0,1]=4 224 B8R1.2 NNC1=CC=CC=C1 SBB040886 [2,0,0,0,0,0|2,0,0]=4 225 B8R1.2 O=CC1=CC=CN=C1 SBB004359 [2,0,0,0,0,0|2,0,0]=4 226 B8R1.2 O=CC1=CC=NC=C1 SBB004357 [2,0,0,0,0,0|2,0,0]=4 227 B8R1.2 O=CC1=NC=CC=C1 SBB004358 [2,0,0,0,0,0|2,0,0]=4 228 B8R1.2 OCC1=CC=CC=C1 SBB058558 [2,0,0,0,0,0|1,0,1]=4 229 B8R1.2 ONC1=CC=CC=C1 SBB008413 [2,0,0,0,0,0|2,0,0]=4 230 B8R1.2 [NH3+]NC1=CC=CC=C1 SBB060000 [2,0,0,0,0,0|2,0,0]=4 231 B8R1.5 CC1=C(C)C=CC=C1 SBB040816 [2,0,0,0,0,0|0,0,1]=3 232 B8R1.5 CC1=C(C)C=NC=C1 SBB040907 [2,0,0,0,0,0|1,0,1]=4 233 B8R1.5 CC1=C(C)N=CC=C1 SBB060735 [2,0,0,0,0,0|1,0,1]=4 234 B8R1.5 CC1=C(N)C=CC=C1 SBB028141 [2,0,0,0,0,0|1,0,0]=3 235 B8R1.5 CC1=C(N)C=CN=C1 SBB027197 [2,0,0,0,0,0|2,0,0]=4 236 B8R1.5 CC1=C(N)C=NC=C1 SBB028185 [2,0,0,0,0,0|2,0,0]=4 237 B8R1.5 CC1=CC=CC=C1N SBB058642 [2,0,0,0,0,0|1,0,0]=3 238 B8R1.5 CC1=CC=CC=C1O SBB060100 [2,0,0,0,0,0|0,0,1]=3 239 B8R1.5 CC1=CC=CN=C1Br SBB054403 [2,0,0,0,0,0|2,0,0]=4 240 B8R1.5 CC1=CC=CN=C1I SBB054379 [2,0,0,0,0,0|2,0,0]=4 241 B8R1.5 CC1=CC=CN=C1N SBB004356 [2,0,0,0,0,0|2,0,0]=4 242 B8R1.5 CC1=CC=CNC1=O SBB040120 [2,0,0,0,0,0|2,0,0]=4 243 B8R1.5 CC1=CC=NC=C1Br SBB054294 [2,0,0,0,0,0|2,0,0]=4 244 B8R1.5 CC1=CC=NC=C1O SBB055538 [2,0,0,0,0,0|1,0,1]=4 245 B8R1.5 CC1=NC=CC=C1Br SBB054275 [2,0,0,0,0,0|2,0,0]=4 246 B8R1.5 CC1=NC=CC=C1Cl SBB054401 [2,0,0,0,0,0|2,0,0]=4 247 B8R1.5 CC1=NC=CC=C1N SBB069748 [2,0,0,0,0,0|2,0,0]=4 248 B8R1.5 CN1C=CC=CC1=S SBB085613 [2,0,0,0,0,0|2,0,0]=4 249 B8R1.5 C[N+]1=CC=CC=C1Br SBB088730 [2,0,0,0,0,0|2,0,0]=4 250 B8R1.5 ClC1=CC=CC=C1Cl SBB040881 [2,0,0,0,0,0|2,0,0]=4 251 B8R1.5 FC1=C(Br)C=CC=C1 SBB088989 [2,0,0,0,0,0|2,0,0]=4 252 B8R1.5 FC1=C(Cl)C=CC=C1 SBB085774 [2,0,0,0,0,0|2,0,0]=4 253 B8R1.5 FC1=C(I)C=CC=C1 SBB096229 [2,0,0,0,0,0|2,0,0]=4 254 B8R1.5 NC1=C(Br)C=CC=C1 SBB058717 [2,0,0,0,0,0|2,0,0]=4 255 B8R1.5 NC1=C(O)C=CC=C1 SBB040832 [2,0,0,0,0,0|1,0,0]=3 256 B8R1.5 NC1=C(O)C=CC=N1 SBB028186 [2,0,0,0,0,0|2,0,0]=4 257 B8R1.5 NC1=C(S)C=CC=C1 SBB009960 [2,0,0,0,0,0|1,1,0]=4 258 B8R1.5 NC1=CC=CC=C1Cl SBB040494 [2,0,0,0,0,0|2,0,0]=4 259 B8R1.5 NC1=CC=CC=C1Cl SBB087744 [2,0,0,0,0,0|2,0,0]=4 260 B8R1.5 NC1=CC=CC=C1F SBB040472 [2,0,0,0,0,0|2,0,0]=4 261 B8R1.5 NC1=CC=CC=C1I SBB016575 [2,0,0,0,0,0|2,0,0]=4 262 B8R1.5 NC1=CC=CC=C1N SBB040801 [2,0,0,0,0,0|2,0,0]=4 263 B8R1.5 NC1=CC=CN=C1O SBB051906 [2,0,0,0,0,0|2,0,0]=4 264 B8R1.5 NC1=CC=NC=C1O SBB051918 [2,0,0,0,0,0|2,0,0]=4 265 B8R1.5 NC1=CN=CC=C1O SBB051888 [2,0,0,0,0,0|2,0,0]=4 266 B8R1.5 O=C1C=CC=CN1O SBB004329 [2,0,0,0,0,0|2,0,0]=4 267 B8R1.5 OC1=C(Br)C=NC=C1 SBB088832 [2,0,0,0,0,0|2,0,0]=4 268 B8R1.5 OC1=C(O)N=CC=C1 SBB004333 [2,0,0,0,0,0|2,0,0]=4 269 B8R1.5 OC1=CC=CC=C1I SBB055205 [2,0,0,0,0,0|1,0,0]=3 270 B8R1.5 OC1=CC=CC=C1O SBB040792 [2,0,0,0,0,0|1,0,0]=3 271 B8R1.5 OC1=CC=CN=C1Br SBB003805 [2,0,0,0,0,0|2,0,0]=4 272 B8R1.5 OC1=CC=CN=C1Cl SBB054358 [2,0,0,0,0,0|2,0,0]=4 273 B8R1.5 OC1=CC=CN=C1I SBB054374 [2,0,0,0,0,0|2,0,0]=4 274 B8R1.5 OC1=NC=CC=C1Cl SBB054336 [2,0,0,0,0,0|2,0,0]=4 275 B8R1.5 SC1=CC=CC=C1Br SBB063171 [2,0,0,0,0,0|1,1,0]=4 276 B8R1.5 [O-][N+]1=CC=CC=C1O SBB004330 [2,0,0,0,0,0|2,0,0]=4 277 B10R1.2 C(=O)C1=C(Cl)C(Cl)=CC=C1 SBB003792 [1,1,0,0,0,0|2,0,0]=4 278 B10R1.2 C(=O)C1=C(F)C(Cl)=CC=C1 SBB003987 [1,1,0,0,0,0|2,0,0]=4 279 B10R1.2 C(=O)C1=C(F)C(F)=CC=C1 SBB006572 [1,1,0,0,0,0|2,0,0]=4 280 B10R1.2 CC1=C(C)C(C#N)=CC=C1 SBB064687 [1,1,0,0,0,0|1,0,1]=4 281 B10R1.2 CC1=C(C)C(C=O)=CC=C1 SBB060150 [1,1,0,0,0,0|1,0,0]=3 282 B10R1.2 CC1=C(C)C(C=O)=CC=C1 SBB062996 [1,1,0,0,0,0|1,0,0]=3 283 B10R1.2 CC1=C(C)C(CN)=CC=C1 SBB017637 [1,1,0,0,0,0|1,0,1]=4 284 B10R1.2 CC1=C(Cl)C=CC=C1CN SBB017657 [1,1,0,0,0,0|1,0,1]=4 285 B10R1.2 CC1=C(F)C(C=O)=CC=C1 SBB064504 [1,1,0,0,0,0|2,0,0]=4 286 B10R1.2 CC1=C(F)C=CC=C1C#N SBB063635 [1,1,0,0,0,0|1,0,1]=4 287 B10R1.2 CC1=C(F)C=CC=C1C=O SBB052190 [1,1,0,0,0,0|1,0,0]=3 288 B10R1.2 CC1=C(F)C=CC=C1CN SBB086093 [1,1,0,0,0,0|1,0,1]=4 289 B10R1.2 CC1=C(F)C=CC=C1CO SBB064442 [1,1,0,0,0,0|1,0,1]=4 290 B10R1.2 CC1=C(N)C=CC=C1CO SBB064073 [1,1,0,0,0,0|1,0,1]=4 291 B10R1.2 CC1=C(NN)C=CC=C1Cl SBB001765 [1,1,0,0,0,0|2,0,0]=4 292 B10R1.2 CC1=C(O)C(C=O)=CC=C1 SBB068759 [1,1,0,0,0,0|1,0,0]=3 293 B10R1.2 CCC1=C(O)C(C)=CC=C1 SBB071423 [1,1,0,0,0,0|0,0,2]=4 294 B10R1.2 CCC1=CC=CC(C)=C1I SBB100083 [1,1,0,0,0,0|2,0,0]=4 295 B10R1.2 CCC1=CC=CC(C)=C1N SBB040448 [1,1,0,0,0,0|2,0,0]=4 296 B10R1.2 COC1=C(O)C(C)=CC=C1 SBB008271 [1,1,0,0,0,0|1,0,0]=3 297 B10R1.2 COC1=CC=CC(Cl)=C1F SBB087470 [1,1,0,0,0,0|1,0,0]=3 298 B10R1.2 COC1=CC=CC(F)=C1Br SBB093393 [1,1,0,0,0,0|1,0,0]=3 299 B10R1.2 COC1=CC=CC(F)=C1F SBB055052 [1,1,0,0,0,0|1,0,0]=3 300 B10R1.2 COC1=CC=CC(F)=C1O SBB086225 [1,1,0,0,0,0|1,0,0]=3 301 B10R1.2 O=CC1=CC=CC(F)=C1O SBB068760 [1,1,0,0,0,0|1,0,0]=3 302 B10R1.2 OC1=CC=CC(C=O)=C1O SBB004190 [1,1,0,0,0,0|1,0,0]=3 303 B10R1.4 C(=O)NC1=CC=CC=C1Cl SBB004025 [1,1,0,0,0,0|2,0,0]=4 304 B10R1.4 C=CCC1=CC=CC=C1O SBB044905 [1,1,0,0,0,0|0,0,0]=2 305 B10R1.4 C=CCN1C=CC=CC1=O SBB007666 [1,1,0,0,0,0|1,0,1]=4 306 B10R1.4 CC1=C(N=C=S)C=CC=C1 SBB006592 [1,1,0,0,0,0|1,0,1]=4 307 B10R1.4 CC1=CC=CC=C1CC#N SBB058333 [1,1,0,0,0,0|0,0,2]=4 308 B10R1.4 CCCC1=CC=CC=C1N SBB085906 [1,1,0,0,0,0|2,0,0]=4 309 B10R1.4 CCNC1=CC=CC=C1N SBB111820 [1,1,0,0,0,0|2,0,0]=4 310 B10R1.4 CCOC1=C(F)C=CC=C1 SBB086154 [1,1,0,0,0,0|1,0,0]=3 311 B10R1.4 CCOC1=C(N)N=CC=C1 SBB014971 [1,1,0,0,0,0|2,0,0]=4 312 B10R1.4 CCOC1=CC=CC=C1C SBB060978 [1,1,0,0,0,0|0,0,1]=3 313 B10R1.4 CCOC1=CC=CC=C1Cl SBB061024 [1,1,0,0,0,0|1,0,0]=3 314 B10R1.4 CCOC1=CC=CC=C1O SBB060424 [1,1,0,0,0,0|1,0,0]=3 315 B10R1.4 CNCC1=C(Br)C=CC=C1 SBB092552 [1,1,0,0,0,0|2,0,0]=4 316 B10R1.4 CNCC1=CC=CC=C1Cl SBB010370 [1,1,0,0,0,0|2,0,0]=4 317 B10R1.4 CNCC1=CC=CC=C1F SBB086087 [1,1,0,0,0,0|2,0,0]=4 318 B10R1.4 C[N+]1=C(\C=N\O)C=CC=C1 SBB058030 [1,1,0,0,0,0|2,0,0]=4 319 B10R1.4 C\C=C\C1=C(O)C=CC=C1 SBB071429 [1,1,0,0,0,0|0,0,0]=2 320 B10R1.4 FC1=C(CCBr)C=CC=C1 SBB018050 [1,1,0,0,0,0|2,0,0]=4 321 B10R1.4 NC1=C(OCC)C=CC=C1 SBB006726 [1,1,0,0,0,0|1,0,0]=3 322 B10R1.4 OCCC1=C(F)C=CC=C1 SBB086155 [1,1,0,0,0,0|2,0,0]=4 323 B10R1.4 O\N=C\C1=C(F)C=CC=C1 SBB086056 [1,1,0,0,0,0|2,0,0]=4 324 B10R1.4 O\N=C\C1=CC=CC=C1Cl SBB061849 [1,1,0,0,0,0|2,0,0]=4 325 B10R1.4 O\N=C\C1=CC=CC=C1O SBB080181 [1,1,0,0,0,0|1,0,0]=3 326 B10R1.25 C(=O)C1=C(Cl)C=C(F)C=C1 SBB003983 [1,1,0,0,0,0|2,0,0]=4 327 B10R1.25 C(=O)C1=C(F)C=C(Cl)C=C1 SBB003985 [1,1,0,0,0,0|2,0,0]=4 328 B10R1.25 CC1=C(CN)C=CC(Cl)=C1 SBB017658 [1,1,0,0,0,0|1,0,1]=4 329 B10R1.25 CC1=C(CN)C=CC(F)=C1 SBB086092 [1,1,0,0,0,0|1,0,1]=4 330 B10R1.25 CC1=C(CO)C=CC(F)=C1 SBB086160 [1,1,0,0,0,0|1,0,1]=4 331 B10R1.25 CC1=C([Mg]Br)C=CC(F)=C1 SBB094834 [1,1,0,0,0,0|2,0,0]=4 332 B10R1.25 CC1=CC(Br)=CC=C1C#N SBB005832 [1,1,0,0,0,0|1,0,1]=4 333 B10R1.25 CC1=CC(C)=C(C=O)C=C1 SBB058778 [1,1,0,0,0,0|1,0,0]=3 334 B10R1.25 CC1=CC(C)=C(CCl)C=C1 SBB005790 [1,1,0,0,0,0|1,0,1]=4 335 B10R1.25 CC1=CC(C)=C(NN)C=C1 SBB017144 [1,1,0,0,0,0|2,0,0]=4 336 B10R1.25 CC1=CC(C)=C(NN)C=C1 SBB028155 [1,1,0,0,0,0|2,0,0]=4 337 B10R1.25 CC1=CC(Cl)=CC=C1C#N SBB055175 [1,1,0,0,0,0|1,0,1]=4 338 B10R1.25 CC1=CC(Cl)=CC=C1NN SBB059597 [1,1,0,0,0,0|2,0,0]=4 339 B10R1.25 CC1=CC(Cl)=NC=C1C=O SBB069020 [1,1,0,0,0,0|2,0,0]=4 340 B10R1.25 CC1=CC(F)=CC=C1C#N SBB063003 [1,1,0,0,0,0|1,0,1]=4 341 B10R1.25 CC1=CC(F)=CC=C1C=O SBB052157 [1,1,0,0,0,0|1,0,0]=3 342 B10R1.25 CC1=CC=C(C#N)C(C)=C1 SBB085784 [1,1,0,0,0,0|1,0,1]=4 343 B10R1.25 CC1=CC=C(C=O)C(Br)=C1 SBB064054 [1,1,0,0,0,0|2,0,0]=4 344 B10R1.25 CC1=CC=C(C=O)C(Cl)=C1 SBB052218 [1,1,0,0,0,0|2,0,0]=4 345 B10R1.25 CC1=CC=C(C=O)C(F)=C1 SBB063769 [1,1,0,0,0,0|2,0,0]=4 346 B10R1.25 CC1=CC=C(C=O)C(O)=C1 SBB052148 [1,1,0,0,0,0|1,0,0]=3 347 B10R1.25 CCC1=C(C)C=C(C)C=C1 SBB061315 [1,1,0,0,0,0|0,0,2]=4 348 B10R1.25 CNC1=C(F)C=C(F)C=C1 SBB086276 [1,1,0,0,0,0|2,0,0]=4 349 B10R1.25 COC1=C(Br)C=C(F)C=C1 SBB093396 [1,1,0,0,0,0|1,0,0]=3 350 B10R1.25 COC1=C(C)C=C(F)C=C1 SBB086153 [1,1,0,0,0,0|0,0,1]=3 351 B10R1.25 COC1=C(Cl)C=C(F)C=C1 SBB087483 [1,1,0,0,0,0|1,0,0]=3 352 B10R1.25 COC1=C(Cl)C=C(N)C=C1 SBB004001 [1,1,0,0,0,0|1,0,0]=3 353 B10R1.25 COC1=C(F)C=C(Br)C=C1 SBB093394 [1,1,0,0,0,0|1,0,0]=3 354 B10R1.25 COC1=C(F)C=C(Cl)C=C1 SBB087482 [1,1,0,0,0,0|1,0,0]=3 355 B10R1.25 COC1=C(F)C=C(F)C=C1 SBB086326 [1,1,0,0,0,0|1,0,0]=3 356 B10R1.25 COC1=C(I)C=C(N)C=C1 SBB072089 [1,1,0,0,0,0|1,0,0]=3 357 B10R1.25 COC1=C(N)C=C(Br)C=N1 SBB093040 [1,1,0,0,0,0|2,0,0]=4 358 B10R1.25 COC1=C(O)C=C(C)C=C1 SBB008267 [1,1,0,0,0,0|1,0,0]=3 359 B10R1.25 COC1=C(O)C=C(N)C=C1 SBB007884 [1,1,0,0,0,0|1,0,0]=3 360 B10R1.25 COC1=CC=C(C)C=C1C SBB061025 [1,1,0,0,0,0|0,0,1]=3 361 B10R1.25 COC1=CC=C(C)C=C1N SBB040483 [1,1,0,0,0,0|1,0,0]=3 362 B10R1.25 COC1=CC=C(Cl)C=C1C SBB058911 [1,1,0,0,0,0|0,0,1]=3 363 B10R1.25 COC1=CC=C(Cl)C=C1Cl SBB061030 [1,1,0,0,0,0|1,0,0]=3 364 B10R1.25 COC1=CC=C(Cl)C=C1N SBB040470 [1,1,0,0,0,0|1,0,0]=3 365 B10R1.25 COC1=CC=C(Cl)C=C1O SBB055202 [1,1,0,0,0,0|1,0,0]=3 366 B10R1.25 COC1=CC=C(F)C=C1N SBB051693 [1,1,0,0,0,0|1,0,0]=3 367 B10R1.25 COC1=CC=C(N)C=C1C SBB085975 [1,1,0,0,0,0|0,0,1]=3 368 B10R1.25 COC1=CC=C(N)C=C1F SBB028264 [1,1,0,0,0,0|1,0,0]=3 369 B10R1.25 COC1=CC=C(N)C=C1N SBB061625 [1,1,0,0,0,0|1,0,0]=3 370 B10R1.25 COC1=CC=C(N)N=C1Br SBB005638 [1,1,0,0,0,0|2,0,0]=4 371 B10R1.25 COC1=NC=C(Br)C=C1C SBB054332 [1,1,0,0,0,0|1,0,1]=4 372 B10R1.25 CSC1=C(C)C=C(O)C=C1 SBB071462 [1,1,0,0,0,0|0,1,1]=4 373 B10R1.25 CSC1=C(N)C=C(Cl)C=C1 SBB088828 [1,1,0,0,0,0|1,1,0]=4 374 B10R1.25 O=CC1=C(Cl)C=C(O)C=C1 SBB004014 [1,1,0,0,0,0|2,0,0]=4 375 B10R1.25 O=CC1=CC=C(Br)C=C1F SBB063396 [1,1,0,0,0,0|2,0,0]=4 376 B10R1.25 O=CC1=CC=C(Br)C=C1O SBB052189 [1,1,0,0,0,0|1,0,0]=3 377 B10R1.25 O=CC1=CC=C(Cl)C=C1Cl SBB040230 [1,1,0,0,0,0|2,0,0]=4 378 B10R1.25 O=CC1=CC=C(Cl)C=C1O SBB052140 [1,1,0,0,0,0|1,0,0]=3 379 B10R1.25 O=CC1=CC=C(F)C=C1Br SBB062999 [1,1,0,0,0,0|2,0,0]=4 380 B10R1.25 O=CC1=CC=C(F)C=C1F SBB063157 [1,1,0,0,0,0|2,0,0]=4 381 B10R1.25 O=CC1=CC=C(F)C=C1O SBB052162 [1,1,0,0,0,0|1,0,0]=3 382 B10R1.25 O=CC1=CC=C(O)C=C1F SBB065071 [1,1,0,0,0,0|2,0,0]=4 383 B10R1.25 O=CC1=CC=C(O)C=C1O SBB040226 [1,1,0,0,0,0|1,0,0]=3 384 B10R1.30 C(=O)C1=C(C)C=CC(C)=C1 SBB008435 [1,1,0,0,0,0|1,0,0]=3 385 B10R1.30 C(=O)C1=C(Cl)C=CC(Cl)=C1 SBB003793 [1,1,0,0,0,0|2,0,0]=4 386 B10R1.30 C(=O)C1=C(F)C=CC(F)=C1 SBB006570 [1,1,0,0,0,0|2,0,0]=4 387 B10R1.30 CC1=C(C#N)C=C(N)C=C1 SBB002351 [1,1,0,0,0,0|1,0,1]=4 388 B10R1.30 CC1=C(CN)C=C(Cl)C=C1 SBB017659 [1,1,0,0,0,0|1,0,1]=4 389 B10R1.30 CC1=C(CO)C=C(F)C=C1 SBB086159 [1,1,0,0,0,0|1,0,1]=4 390 B10R1.30 CC1=C([Mg]Br)C=C(F)C=C1 SBB094836 [1,1,0,0,0,0|2,0,0]=4 391 B10R1.30 CC1=CC(CCl)=C(C)C=C1 SBB040679 [1,1,0,0,0,0|1,0,1]=4 392 B10R1.30 CC1=CC=C(Cl)C=C1NN SBB001772 [1,1,0,0,0,0|2,0,0]=4 393 B10R1.30 CC1=CC=C(F)C(C=O)=C1 SBB063764 [1,1,0,0,0,0|2,0,0]=4 394 B10R1.30 CC1=CC=C(F)C=C1C#N SBB055288 [1,1,0,0,0,0|1,0,1]=4 395 B10R1.30 CC1=CC=C(F)C=C1C=O SBB064371 [1,1,0,0,0,0|1,0,0]=3 396 B10R1.30 CC1=CC=C(F)C=C1CN SBB069917 [1,1,0,0,0,0|1,0,1]=4 397 B10R1.30 CC1=CC=C(O)C(C=O)=C1 SBB063013 [1,1,0,0,0,0|1,0,0]=3 398 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 SBB059051 [1,1,0,0,0,0|1,0,0]=3 399 B10R1.30 COC1=C(Br)C=CC(F)=C1 SBB093400 [1,1,0,0,0,0|1,0,0]=3 400 B10R1.30 COC1=C(Br)C=CC(N)=C1 SBB059059 [1,1,0,0,0,0|1,0,0]=3 401 B10R1.30 COC1=C(C)C=CC(Cl)=C1 SBB059060 [1,1,0,0,0,0|0,0,1]=3 402 B10R1.30 COC1=C(C)C=CC(F)=C1 SBB086158 [1,1,0,0,0,0|0,0,1]=3 403 B10R1.30 COC1=C(C)C=CC(N)=C1 SBB085977 [1,1,0,0,0,0|0,0,1]=3 404 B10R1.30 COC1=C(Cl)C=CC(Br)=C1 SBB059053 [1,1,0,0,0,0|1,0,0]=3 405 B10R1.30 COC1=C(F)C=CC(F)=C1 SBB086327 [1,1,0,0,0,0|1,0,0]=3 406 B10R1.30 COC1=C(O)C=CC(C)=C1 SBB008258 [1,1,0,0,0,0|1,0,0]=3 407 B10R1.30 COC1=C(O)C=CC(N)=C1 SBB010275 [1,1,0,0,0,0|1,0,0]=3 408 B10R1.30 COC1=CC(Br)=CC=C1N SBB051732 [1,1,0,0,0,0|1,0,0]=3 409 B10R1.30 COC1=CC(Br)=CN=C1N SBB070411 [1,1,0,0,0,0|2,0,0]=4 410 B10R1.30 COC1=CC(C)=CC=C1F SBB086162 [1,1,0,0,0,0|1,0,0]=3 411 B10R1.30 COC1=CC(Cl)=CC=C1N SBB085532 [1,1,0,0,0,0|1,0,0]=3 412 B10R1.30 COC1=CC(F)=CC=C1O SBB055422 [1,1,0,0,0,0|1,0,0]=3 413 B10R1.30 COC1=CC(N)=CC=C1Cl SBB070068 [1,1,0,0,0,0|1,0,0]=3 414 B10R1.30 N#CC1=CC(Br)=CC=C1O SBB040157 [1,1,0,0,0,0|1,0,1]=4 415 B10R1.30 N#CC1=CC(Cl)=CC=C1O SBB055230 [1,1,0,0,0,0|1,0,1]=4 416 B10R1.30 N#CC1=CC(N)=CC=C1O SBB072993 [1,1,0,0,0,0|1,0,1]=4 417 B10R1.30 NC1=CC=C(Br)C=C1C=O SBB092543 [1,1,0,0,0,0|2,0,0]=4 418 B10R1.30 NC1=CC=C(Cl)C=C1C=O SBB063929 [1,1,0,0,0,0|2,0,0]=4 419 B10R1.30 O=CC1=C(F)C=CC(Br)=C1 SBB040272 [1,1,0,0,0,0|2,0,0]=4 420 B10R1.30 O=CC1=C(O)C=CC(Br)=C1 SBB016339 [1,1,0,0,0,0|1,0,0]=3 421 B10R1.30 O=CC1=C(O)C=CC(Cl)=C1 SBB004013 [1,1,0,0,0,0|1,0,0]=3 422 B10R1.30 O=CC1=C(O)C=CC(I)=C1 SBB035854 [1,1,0,0,0,0|1,0,0]=3 423 B10R1.30 O=CC1=CC(Br)=CC=C1Br SBB063082 [1,1,0,0,0,0|2,0,0]=4 424 B10R1.30 O=CC1=CC(Cl)=CC=C1F SBB063766 [1,1,0,0,0,0|2,0,0]=4 425 B10R1.30 O=CC1=CC(F)=CC=C1Br SBB052173 [1,1,0,0,0,0|2,0,0]=4 426 B10R1.30 O=CC1=CC(F)=CC=C1Cl SBB063392 [1,1,0,0,0,0|2,0,0]=4 427 B10R1.30 O=CC1=CC(F)=CC=C1O SBB064409 [1,1,0,0,0,0|1,0,0]=3 428 B10R1.30 O=CC1=CC(I)=CC=C1F SBB063108 [1,1,0,0,0,0|2,0,0]=4 429 B10R1.30 O=CC1=CC(O)=CC=C1Br SBB063077 [1,1,0,0,0,0|2,0,0]=4 430 B10R1.30 O=CC1=CC(O)=CC=C1O SBB052127 [1,1,0,0,0,0|1,0,0]=3 431 B10R1.30 OCC1=CC(Br)=CC=C1O SBB054777 [1,1,0,0,0,0|1,0,1]=4 432 B10R1.30 [NH3+]C1=CC=C(Br)C=C1CC SBB058409 [1,1,0,0,0,0|2,0,0]=4 433 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 SBB040857 [1,1,0,0,0,0|1,0,1]=4 434 B10R1.61 CC(=O)C1=C(N)C=CC=C1 SBB058825 [1,1,0,0,0,0|1,0,1]=4 435 B10R1.61 CC(=O)C1=CC=CC=C1C SBB063140 [1,1,0,0,0,0|0,0,1]=3 436 B10R1.61 CC(=O)C1=CC=CC=C1Cl SBB040259 [1,1,0,0,0,0|1,0,1]=4 437 B10R1.61 CC(=O)C1=CC=CC=C1F SBB058458 [1,1,0,0,0,0|1,0,1]=4 438 B10R1.61 CC(=O)C1=CC=CC=C1I SBB064803 [1,1,0,0,0,0|1,0,1]=4 439 B10R1.61 CC(=O)C1=CC=CC=C1O SBB040261 [1,1,0,0,0,0|0,0,1]=3 440 B10R1.61 CC(=O)C1=CN=CC=C1C SBB055670 [1,1,0,0,0,0|1,0,1]=4 441 B10R1.61 CC(C)C1=C(Br)C=CC=C1 SBB092412 [1,1,0,0,0,0|2,0,0]=4 442 B10R1.61 CC(C)C1=C(N)C=CC=C1 SBB040455 [1,1,0,0,0,0|2,0,0]=4 443 B10R1.61 CC(N)C1=C(Cl)C=CC=C1 SBB046790 [1,1,0,0,0,0|2,0,0]=4 444 B10R1.61 CC(O)C1=CC=CC=C1N SBB072985 [1,1,0,0,0,0|2,0,0]=4 445 B10R1.61 CC1=C(C(=O)Cl)C=NC=C1 SBB053632 [1,1,0,0,0,0|2,0,0]=4 446 B10R1.61 CC1=C(C(=O)O)C=CC=C1 SBB040521 [1,1,0,0,0,0|1,0,0]=3 447 B10R1.61 CC1=C(C(=O)O)C=CN=C1 SBB028020 [1,1,0,0,0,0|2,0,0]=4 448 B10R1.61 CC1=C(C(=O)O)C=NC=C1 SBB018540 [1,1,0,0,0,0|2,0,0]=4 449 B10R1.61 CC1=C(C(N)=O)C=CC=C1 SBB007860 [1,1,0,0,0,0|1,0,0]=3 450 B10R1.61 CC1=CC=CC=C1B(O)O SBB052539 [1,1,0,0,0,0|2,0,0]=4 451 B10R1.61 CC1=CC=CC=C1C(N)=S SBB036004 [1,1,0,0,0,0|1,0,0]=3 452 B10R1.61 CC1=CC=CN=C1C(=O)O SBB052853 [1,1,0,0,0,0|2,0,0]=4 453 B10R1.61 CC1=CC=CN=C1C(N)=O SBB055568 [1,1,0,0,0,0|2,0,0]=4 454 B10R1.61 CC1=CC=NC=C1C(=O)O SBB028489 [1,1,0,0,0,0|2,0,0]=4 455 B10R1.61 CC1=NC=CC=C1C(=O)Cl SBB053635 [1,1,0,0,0,0|2,0,0]=4 456 B10R1.61 CC1=NC=CC=C1C(=O)O SBB004196 [1,1,0,0,0,0|2,0,0]=4 457 B10R1.61 CC1=NC=CC=C1C(N)=O SBB055551 [1,1,0,0,0,0|2,0,0]=4 458 B10R1.61 CS(=O)C1=C(F)C=CC=C1 SBB087301 [1,1,0,0,0,0|1,1,0]=4 459 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 SBB086152 [1,1,0,0,0,0|2,0,0]=4 460 B10R1.61 C[C@H](O)C1=CC=CC=C1Br SBB064753 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl SBB064728 [1,1,0,0,0,0|2,0,0]=4 462 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 SBB092542 [1,1,0,0,0,0|2,0,0]=4 463 B10R1.61 NC(=O)C1=C(F)C=CC=C1 SBB058361 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.61 NC(=O)C1=C(N)C=CC=C1 SBB007561 [1,1,0,0,0,0|2,0,0]=4 465 B10R1.61 NC(=O)C1=C(O)C=CC=C1 SBB058584 [1,1,0,0,0,0|1,0,0]=3 466 B10R1.61 NC(=O)C1=C(O)C=CC=N1 SBB058310 [1,1,0,0,0,0|2,0,0]=4 467 B10R1.61 NC(=O)C1=CC=CC=C1Cl SBB004023 [1,1,0,0,0,0|2,0,0]=4 468 B10R1.61 NC(=S)C1=C(Br)C=CC=C1 SBB095207 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.61 NC(=S)C1=C(F)C=CC=C1 SBB016504 [1,1,0,0,0,0|2,0,0]=4 470 B10R1.61 NC(=S)C1=CC=CC=C1N SBB045972 [1,1,0,0,0,0|2,0,0]=4 471 B10R1.61 O=C(Cl)C1=C(Br)C=CC=C1 SBB040697 [1,1,0,0,0,0|2,0,0]=4 472 B10R1.61 O=C(Cl)C1=C(Cl)C=CC=C1 SBB058743 [1,1,0,0,0,0|2,0,0]=4 473 B10R1.61 O=C(Cl)C1=C(F)C=CC=C1 SBB040627 [1,1,0,0,0,0|2,0,0]=4 474 B10R1.61 O=C(O)C1=C(O)C=CC=N1 SBB006727 [1,1,0,0,0,0|2,0,0]=4 475 B10R1.61 O=C(O)C1=C(O)C=NC=C1 SBB065382 [1,1,0,0,0,0|2,0,0]=4 476 B10R1.61 O=C(O)C1=CC=CC=C1Br SBB058412 [1,1,0,0,0,0|2,0,0]=4 477 B10R1.61 O=C(O)C1=CC=CC=C1Cl SBB040524 [1,1,0,0,0,0|2,0,0]=4 478 B10R1.61 O=C(O)C1=CC=CC=C1F SBB040569 [1,1,0,0,0,0|2,0,0]=4 479 B10R1.61 O=C(O)C1=CC=CC=C1I SBB063117 [1,1,0,0,0,0|2,0,0]=4 480 B10R1.61 O=C(O)C1=CC=CC=C1O SBB052826 [1,1,0,0,0,0|1,0,0]=3 481 B10R1.61 O=C(O)C1=CC=CN=C1O SBB004180 [1,1,0,0,0,0|2,0,0]=4 482 B10R1.61 O=C(O)C1=CN=CC=C1O SBB052972 [1,1,0,0,0,0|2,0,0]=4 483 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=C1 SBB060648 [1,1,0,0,0,0|2,0,0]=4 484 B10R1.61 OB(O)C1=CC=CC=C1O SBB071215 [1,1,0,0,0,0|2,0,0]=4 485 B10R1.245 C(=O)C1=C(F)C=CC=C1F SBB006685 [1,1,0,0,0,0|2,0,0]=4 486 B10R1.245 C=CC1=C(F)C=CC=C1F SBB086132 [1,1,0,0,0,0|1,0,0]=3 487 B10R1.245 CC1=C(C#N)C(F)=CC=C1 SBB064355 [1,1,0,0,0,0|1,0,1]=4 488 B10R1.245 CC1=CC=CC(C)=C1C#N SBB079382 [1,1,0,0,0,0|1,0,1]=4 489 B10R1.245 CC1=CC=CC(C)=C1CO SBB079383 [1,1,0,0,0,0|1,0,1]=4 490 B10R1.245 CC1=CC=CC(C)=C1NN SBB001780 [1,1,0,0,0,0|2,0,0]=4 491 B10R1.245 CC1=CC=CC(C)=C1NN SBB064979 [1,1,0,0,0,0|2,0,0]=4 492 B10R1.245 CC1=CC=CC(Cl)=C1C#N SBB086802 [1,1,0,0,0,0|1,0,1]=4 493 B10R1.245 CC1=CC=CC(F)=C1C=O SBB086001 [1,1,0,0,0,0|1,0,0]=3 494 B10R1.245 CNC1=C(C)C=CC=C1C SBB048618 [1,1,0,0,0,0|1,0,1]=4 495 B10R1.245 COC1=C(C)NC=CC1=O SBB055733 [1,1,0,0,0,0|1,0,1]=4 496 B10R1.245 COC1=C(Cl)C=CC=C1F SBB087474 [1,1,0,0,0,0|1,0,0]=3 497 B10R1.245 COC1=C(F)C=CC=C1F SBB086324 [1,1,0,0,0,0|1,0,0]=3 498 B10R1.245 COC1=C(F)C=CC=C1N SBB051694 [1,1,0,0,0,0|1,0,0]=3 499 B10R1.245 COC1=C(N)C=CC=C1Cl SBB018379 [1,1,0,0,0,0|1,0,0]=3 500 B10R1.245 N#CC1=C(F)C=CC=C1O SBB055260 [1,1,0,0,0,0|1,0,1]=4 501 B10R1.245 O=CC1=C(Cl)C=CC=C1Cl SBB040210 [1,1,0,0,0,0|2,0,0]=4 502 B10R1.245 O=CC1=C(Cl)C=CC=C1O SBB052161 [1,1,0,0,0,0|1,0,0]=3 503 B10R1.245 O=CC1=C(F)C=CC=C1Cl SBB040205 [1,1,0,0,0,0|2,0,0]=4 504 B10R1.245 O=CC1=C(O)C=CC=C1F SBB086124 [1,1,0,0,0,0|1,0,0]=3 505 B10R1.39 COC1=C(C(=O)O)SC=C1 SBB036127 [0,1,0,0,1,0|2,0,0]=4 506 B10R1.39 COC1=CSC=C1C(=O)Cl SBB053643 [0,1,0,0,1,0|2,0,0]=4 507 B12R1.46 COC1=C(C(=O)O)C=C(F)C=N1 SBB065609 [0,2,0,0,0,0|2,0,0]=4 508 B12R1.46 COC1=C(C(C)=O)C=C(Cl)C=C1 SBB015037 [0,2,0,0,0,0|0,0,1]=3 509 B12R1.46 COC1=C(C(C)=O)C=C(O)C=C1 SBB116856 [0,2,0,0,0,0|0,0,1]=3 510 B12R1.46 COC1=C(C(N)=O)C=C(F)C=C1 SBB088259 [0,2,0,0,0,0|1,0,0]=3 511 B12R1.46 COC1=C([N+](=O)[O-])C=C(Cl)C=C1 SBB058888 [0,2,0,0,0,0|2,0,0]=4 512 B12R1.46 COC1=C([N+](=O)[O-])C=C(N)C=C1 SBB064165 [0,2,0,0,0,0|2,0,0]=4 513 B12R1.46 COC1=CC=C(Br)C=C1C(=O)O SBB023085 [0,2,0,0,0,0|1,0,0]=3 514 B12R1.46 COC1=CC=C(Cl)C=C1B(O)O SBB052529 [0,2,0,0,0,0|2,0,0]=4 515 B12R1.46 COC1=CC=C(Cl)C=C1C(=O)O SBB063166 [0,2,0,0,0,0|1,0,0]=3 516 B12R1.46 COC1=CC=C(F)C=C1B(O)O SBB071077 [0,2,0,0,0,0|2,0,0]=4 517 B12R1.46 COC1=CC=C(F)C=C1C(=O)O SBB064673 [0,2,0,0,0,0|1,0,0]=3 518 B12R1.46 COC1=CC=C(F)C=C1C(C)=O SBB019335 [0,2,0,0,0,0|0,0,1]=3 519 B12R1.46 COC1=CC=C(F)C=C1[N+](=O)[O-] SBB063401 [0,2,0,0,0,0|2,0,0]=4 520 B12R1.46 COC1=CC=C(I)C=C1[N+](=O)[O-] SBB064799 [0,2,0,0,0,0|2,0,0]=4 521 B12R1.46 COC1=NC=C(Br)C=C1C(=O)O SBB052918 [0,2,0,0,0,0|2,0,0]=4 522 B12R1.46 COC1=NC=C(Cl)C=C1C(=O)O SBB090645 [0,2,0,0,0,0|2,0,0]=4 523 B12R1.57 CC1=CC=C(C(C)C)C(C=O)=C1 SBB060459 [0,2,0,0,0,0|2,0,0]=4 524 B12R1.57 COC1=C(C(=O)O)C=CC(Cl)=C1 SBB057716 [0,2,0,0,0,0|1,0,0]=3 525 B12R1.57 COC1=CC(Cl)=CC=C1B(O)O SBB071090 [0,2,0,0,0,0|2,0,0]=4 526 B12R1.57 COC1=CC(F)=CC=C1B(O)O SBB071046 [0,2,0,0,0,0|2,0,0]=4 527 B12R1.57 COC1=CC(F)=CC=C1C(=O)O SBB064420 [0,2,0,0,0,0|1,0,0]=3 528 B12R1.57 COC1=CC(F)=CC=C1C(C)=O SBB063562 [0,2,0,0,0,0|0,0,1]=3 529 B12R1.57 COC1=CC(N)=CC=C1C(=O)O SBB063336 [0,2,0,0,0,0|1,0,0]=3 530 B12R1.78 CCC1=C(OC)C=CC(OC)=C1 SBB014717 [0,2,0,0,0,0|0,0,2]=4 531 B12R1.78 COC1=C(CCl)C=C(C=O)C=C1 SBB006784 [0,2,0,0,0,0|1,0,1]=4 532 B12R1.78 COC1=C(OC)C=C(C#N)C=C1 SBB028801 [0,2,0,0,0,0|1,0,1]=4 533 B12R1.78 COC1=C(OC)C=C(CN)C=C1 SBB042487 [0,2,0,0,0,0|1,0,1]=4 534 B12R1.78 COC1=C(OC)C=C(CO)C=C1 SBB058837 [0,2,0,0,0,0|1,0,1]=4 535 B12R1.78 COC1=CC(C#N)=C(OC)C=C1 SBB058340 [0,2,0,0,0,0|1,0,1]=4 536 B12R1.78 COC1=CC(CN)=C(OC)C=C1 SBB047767 [0,2,0,0,0,0|1,0,1]=4 537 B12R1.78 COC1=CC(OC)=C(CN)C=C1 SBB000428 [0,2,0,0,0,0|1,0,1]=4 538 B12R1.78 COC1=CC(OC)=C(CN)C=C1 SBB047769 [0,2,0,0,0,0|1,0,1]=4 539 B12R1.78 COC1=CC=C(C#N)C(OC)=C1 SBB063099 [0,2,0,0,0,0|1,0,1]=4 540 B12R1.78 COC1=CC=C(C=O)C(OC)=C1 SBB040221 [0,2,0,0,0,0|1,0,0]=3 541 B12R1.78 COC1=CC=C(C=O)C(OC)=N1 SBB065549 [0,2,0,0,0,0|2,0,0]=4 542 B12R1.78 COC1=CC=C(C=O)C=C1CO SBB300126 [0,2,0,0,0,0|1,0,1]=4 543 B12R1.78 COC1=CC=C(C=O)C=C1OC SBB040236 [0,2,0,0,0,0|1,0,1]=4 544 B12R1.78 COC1=CC=C(CO)C(OC)=C1 SBB063101 [0,2,0,0,0,0|1,0,1]=4 545 B12R1.78 COC1=CC=C(OC)C(C=O)=C1 SBB040207 [0,2,0,0,0,0|1,0,0]=3 546 B12R1.78 COC1=CC=C(OC)C(CCl)=C1 SBB090509 [0,2,0,0,0,0|1,0,1]=4 547 B12R1.112 CCOC1=C(C#N)C=C(N)C=C1 SBB019179 [0,2,0,0,0,0|1,0,1]=4 548 B12R1.112 CCOC1=CC=C(Br)C=C1C#N SBB029708 [0,2,0,0,0,0|1,0,1]=4 549 B12R1.112 CCOC1=CC=C(Br)C=C1C=O SBB020097 [0,2,0,0,0,0|1,0,0]=3 550 B12R1.112 CCOC1=CC=C(Cl)C=C1C=O SBB020848 [0,2,0,0,0,0|1,0,0]=3 551 B12R1.112 CCOC1=CC=C(I)C=C1C#N SBB035907 [0,2,0,0,0,0|1,0,1]=4 552 B12R1.234 C(=O)C1=C(OC)C(F)=CC(F)=C1 SBB088590 [0,2,0,0,0,0|1,0,0]=3 553 B12R1.234 COC1=C(Br)C=C(Br)C=C1C#N SBB020108 [0,2,0,0,0,0|1,0,1]=4 554 B12R1.234 COC1=C(Br)C=C(Br)C=C1C=O SBB020107 [0,2,0,0,0,0|1,0,0]=3 555 B12R1.234 COC1=C(C#N)C=C(Cl)C=C1Cl SBB074379 [0,2,0,0,0,0|1,0,1]=4 556 B12R1.234 COC1=C(C#N)C=C(F)C=C1F SBB088234 [0,2,0,0,0,0|1,0,1]=4 557 B12R1.234 COC1=C(CBr)C=C(F)C=C1F SBB098711 [0,2,0,0,0,0|1,0,1]=4 558 B12R1.234 COC1=C(CN)C=C(F)C=C1F SBB088749 [0,2,0,0,0,0|1,0,1]=4 559 B12R1.234 COC1=C(Cl)C=C(Cl)C=C1C=O SBB072280 [0,2,0,0,0,0|1,0,0]=3 560 B12R1.234 COC1=C(I)C=C(Br)C=C1C=O SBB020113 [0,2,0,0,0,0|1,0,0]=3 561 B12R1.268 COC1=C(CC#N)C=C(F)C=C1 SBB087891 [0,2,0,0,0,0|0,0,2]=4 562 B12R1.268 COC1=C(N=C=O)C=C(Cl)C=C1 SBB046958 [0,2,0,0,0,0|1,0,1]=4 563 B12R1.268 COC1=CC=C(Br)C=C1\C=N\O SBB029702 [0,2,0,0,0,0|1,0,0]=3 564 B12R1.268 COC1=CC=C(Cl)C=C1N=C=S SBB092533 [0,2,0,0,0,0|1,0,1]=4 565 B12R1.448 C(=O)C1=C(OC)C=C(F)C(F)=C1 SBB088591 [0,2,0,0,0,0|1,0,0]=3 566 B12R1.448 COC1=C(CBr)C=C(F)C(F)=C1 SBB098718 [0,2,0,0,0,0|1,0,1]=4 567 B12R1.448 COC1=C(CN)C=C(F)C(F)=C1 SBB088753 [0,2,0,0,0,0|1,0,1]=4 568 B12R1.448 COC1=CC(=O)C(=O)C=C1OC SBB019278 [0,2,0,0,0,0|1,0,1]=4 569 B12R1.448 COC1=CC(C)=C(N)C=C1OC SBB017682 [0,2,0,0,0,0|1,0,1]=4 570 B12R1.448 COC1=CC(F)=C(F)C=C1C#N SBB063666 [0,2,0,0,0,0|1,0,1]=4 571 B12R1.448 COC1=CC(F)=C(F)C=C1OC SBB088862 [0,2,0,0,0,0|1,0,1]=4 572 B12R1.652 COC1=C(C#N)C(F)=C(F)C=C1 SBB088237 [0,2,0,0,0,0|1,0,1]=4 573 B12R1.652 COC1=C(C=O)C(F)=C(F)C=C1 SBB064642 [0,2,0,0,0,0|1,0,0]=3 574 B12R1.652 COC1=C(CBr)C(F)=C(F)C=C1 SBB098714 [0,2,0,0,0,0|1,0,1]=4 575 B12R1.652 COC1=C(CN)C(F)=C(F)C=C1 SBB088743 [0,2,0,0,0,0|1,0,1]=4 576 B12R1.75 C(=O)C1=CC=CC=C1OC(F)F SBB003836 [0,2,0,0,0,0|1,0,0]=3 577 B12R1.75 CC(=O)OC1=C(CN)C=CC=C1 SBB051628 [0,2,0,0,0,0|1,0,1]=4 578 B12R1.75 CC(C)OC1=C(C=O)C=CC=C1 SBB017957 [0,2,0,0,0,0|1,0,0]=3 579 B12R1.75 CCC1=C(NC(C)=O)C=CC=C1 SBB058947 [0,2,0,0,0,0|1,0,1]=4 580 B12R1.75 CCC1=C(NC(N)=O)C=CC=C1 SBB087812 [0,2,0,0,0,0|2,0,0]=4 581 B12R1.75 COC1=C(NC(N)=S)C=CC=C1 SBB055318 [0,2,0,0,0,0|1,0,0]=3 582 B12R1.75 COC1=CC=CC=C1CC(=O)O SBB063364 [0,2,0,0,0,0|0,0,1]=3 583 B12R1.75 COC1=CC=CC=C1CC(N)=S SBB089825 [0,2,0,0,0,0|0,0,1]=3 584 B12R1.75 COC1=CC=CC=C1NC(N)=O SBB087990 [0,2,0,0,0,0|1,0,0]=3 585 B12R1.75 FC(F)OC1=C(CBr)C=CC=C1 SBB098715 [0,2,0,0,0,0|1,0,1]=4 586 B12R1.75 N#CC1=CC=CC=C1OC(F)F SBB021782 [0,2,0,0,0,0|1,0,1]=4 587 B12R1.75 NCC1=CC=CC=C1OC(F)F SBB088741 [0,2,0,0,0,0|1,0,1]=4 588 B12R1.75 OCC1=CC=CC=C1OC(F)F SBB088868 [0,2,0,0,0,0|1,0,1]=4 589 B12R1.77 CCC(=O)C1=CC=CC=C1OC SBB019455 [0,2,0,0,0,0|0,0,1]=3 590 B12R1.77 CNC1=CC=CC=C1C(=O)OC SBB058534 [0,2,0,0,0,0|1,0,1]=4 591 B12R1.77 COC(=O)C1=C(C=O)C=CC=C1 SBB064193 [0,2,0,0,0,0|1,0,0]=3 592 B12R1.77 COC(=O)C1=C(CN)C=CC=C1 SBB092824 [0,2,0,0,0,0|1,0,1]=4 593 B12R1.77 COC(=O)C1=CC=CC=C1C#N SBB053726 [0,2,0,0,0,0|1,0,1]=4 594 B12R1.77 COC(=O)C1=CC=CC=C1OC SBB061390 [0,2,0,0,0,0|0,0,1]=3 595 B12R1.77 COC1=C(C(=O)CBr)C=CC=C1 SBB040611 [0,2,0,0,0,0|0,0,1]=3 596 B12R1.77 COC1=C(C(=O)NN)C=CC=C1 SBB017611 [0,2,0,0,0,0|1,0,0]=3 597 B12R1.77 COC1=CC=CC=C1\C(N)=N/O SBB076113 [0,2,0,0,0,0|1,0,0]=3 598 B12R1.121 C#CCOC1=C(C=O)C=CC=C1 SBB005020 [0,2,0,0,0,0|1,0,0]=3 599 B12R1.121 C(=O)C1=C(OCC=C)C=CC=C1 SBB007636 [0,2,0,0,0,0|1,0,0]=3 600 B12R1.121 CCCOC1=CC=CC=C1C=O SBB001592 [0,2,0,0,0,0|1,0,0]=3 601 B12R1.121 COC1=C(CCCBr)C=CC=C1 SBB302485 [0,2,0,0,0,0|0,0,2]=4 602 B12R1.121 COC1=C(OCCBr)C=CC=C1 SBB008602 [0,2,0,0,0,0|0,0,2]=4 603 B12R1.121 COC1=C(OCCN)C=CC=C1 SBB093198 [0,2,0,0,0,0|0,0,2]=4 604 B12R1.121 COC1=C(OCCO)C=CC=C1 SBB056548 [0,2,0,0,0,0|0,0,2]=4 605 B12R1.121 COC1=CC=CC=C1OCC#N SBB055161 [0,2,0,0,0,0|0,0,2]=4 606 B12R1.121 COC1=CC=CC=C1OCCN SBB024035 [0,2,0,0,0,0|0,0,2]=4 607 B12R1.121 COC1=CC=CC=C1\C=C\C=O SBB040240 [0,2,0,0,0,0|0,0,0]=2 608 B12R1.121 N#CCOC1=CC=CC=C1C#N SBB029803 [0,2,0,0,0,0|1,0,1]=4 609 B12R1.121 N#CCOC1=CC=CC=C1C=O SBB020122 [0,2,0,0,0,0|1,0,0]=3 610 B12R1.169 CCOC1=CC=CC=C1N=C=O SBB048854 [0,2,0,0,0,0|1,0,1]=4 611 B12R1.169 CCOC1=CC=CC=C1N=C=S SBB017400 [0,2,0,0,0,0|1,0,1]=4 612 B12R1.169 CCOC1=CC=CC=C1OCC SBB060361 [0,2,0,0,0,0|0,0,2]=4 613 B12R1.169 CCOC1=CC=CC=C1\C=N\O SBB029656 [0,2,0,0,0,0|1,0,0]=3 614 B12R1.283 CCOC1=C(C(C)N)C=CC=C1 SBB046787 [0,2,0,0,0,0|0,0,2]=4 615 B12R1.283 CCOC1=C(C(C)N)C=CC=C1 SBB080352 [0,2,0,0,0,0|0,0,2]=4 616 B12R1.283 CCOC1=CC=CC=C1B(O)O SBB048064 [0,2,0,0,0,0|2,0,0]=4 617 B12R1.283 CCOC1=CC=CC=C1C(=O)O SBB063520 [0,2,0,0,0,0|1,0,0]=3 618 B12R1.283 CCOC1=CC=CC=C1C(C)=O SBB042629 [0,2,0,0,0,0|0,0,1]=3 619 B12R1.283 CCOC1=CC=CC=C1[N+](=O)[O-] SBB061021 [0,2,0,0,0,0|2,0,0]=4 620 B12R1.283 CCOC1=NC=CC=C1C(=O)O SBB005439 [0,2,0,0,0,0|2,0,0]=4 621 B12R1.283 CCSC1=C(C(=O)O)C=CC=C1 SBB049901 [0,2,0,0,0,0|1,1,0]=4 622 B12R1.542 CCOC1=CC=CC(F)=C1C#N SBB087893 [0,2,0,0,0,0|1,0,1]=4 623 B12R1.542 COC1=C(CC#N)C=CC=C1F SBB087889 [0,2,0,0,0,0|0,0,2]=4 624 B12R1.76 COC1=C(C(F)(F)F)C=CC=C1 SBB089126 [0,2,0,0,0,0|1,0,1]=4 625 B12R1.76 COC1=C(S(=O)(=O)Cl)C=CC=C1 SBB301624 [0,2,0,0,0,0|2,0,0]=4 626 B12R1.87 COC1=C(C(=O)Cl)C=CC=C1F SBB090852 [0,2,0,0,0,0|1,0,0]=3 627 B12R1.87 COC1=C(C(=O)O)C=CC=C1C SBB027570 [0,2,0,0,0,0|1,0,0]=3 628 B12R1.87 COC1=C(C(=O)O)C=CC=C1F SBB088376 [0,2,0,0,0,0|1,0,0]=3 629 B12R1.87 COC1=C(C(C)=O)C=CC=C1Cl SBB015036 [0,2,0,0,0,0|0,0,1]=3 630 B12R1.87 COC1=C(C(N)=O)C=CC=C1F SBB088255 [0,2,0,0,0,0|1,0,0]=3 631 B12R1.87 COC1=C([N+](=O)[O-])C=CC=C1Cl SBB090638 [0,2,0,0,0,0|2,0,0]=4 632 B12R1.261 CC(=O)C1=C(C(C)=O)C=CC=C1 SBB008490 [0,2,0,0,0,0|1,0,1]=4 633 B12R1.261 CC(=O)C1=CC=CC=C1C(=O)O SBB038601 [0,2,0,0,0,0|2,0,0]=4 634 B12R1.261 CS(=O)C1=CC=CC=C1C(=O)O SBB052751 [0,2,0,0,0,0|1,1,0]=4 635 B12R1.437 COC1=C(B(O)O)C(F)=CC=C1 SBB019327 [0,2,0,0,0,0|2,0,0]=4 636 B12R1.437 COC1=C(C(C)=O)C(O)=CC=C1 SBB071417 [0,2,0,0,0,0|0,0,1]=3 637 B12R1.437 COC1=C([N+](=O)[O-])C(C)=CC=C1 SBB008616 [0,2,0,0,0,0|2,0,0]=4 638 B12R1.437 COC1=CC=CC(Br)=C1[N+](=O)[O-] SBB055382 [0,2,0,0,0,0|2,0,0]=4 639 B12R1.437 COC1=CC=CC(F)=C1C(=O)Cl SBB090848 [0,2,0,0,0,0|1,0,0]=3 640 B12R1.437 COC1=CC=CC(F)=C1C(=O)O SBB052773 [0,2,0,0,0,0|1,0,0]=3 641 B12R1.437 COC1=CC=CC(F)=C1C(C)=O SBB088157 [0,2,0,0,0,0|0,0,1]=3 642 B12R1.437 COC1=CC=CC(F)=C1C(N)=O SBB088257 [0,2,0,0,0,0|1,0,0]=3 643 B12R1.437 COC1=CC=CC(N)=C1C(=O)O SBB052640 [0,2,0,0,0,0|1,0,0]=3 644 B12R1.437 COC1=CC=CC(O)=C1C(=O)O SBB052659 [0,2,0,0,0,0|1,0,0]=3 645 B12R1.741 COC1=C(C=O)C(F)=CC=C1F SBB088586 [0,2,0,0,0,0|1,0,0]=3 646 B12R1.1879 C(=O)C1=C(OC)C=CC=C1OC SBB006541 [0,2,0,0,0,0|1,0,0]=3 647 B12R1.1879 COC1=C(OC)C(C=O)=CC=C1 SBB040206 [0,2,0,0,0,0|1,0,0]=3 648 B12R1.1879 COC1=C(OC)C(CO)=CC=C1 SBB058562 [0,2,0,0,0,0|1,0,1]=4 649 B12R1.1879 COC1=CC=CC(C#N)=C1OC SBB057288 [0,2,0,0,0,0|1,0,1]=4 650 B12R1.1879 COC1=CC=CC(OC)=C1C#N SBB068894 [0,2,0,0,0,0|1,0,1]=4 651 B12R1.1879 COC1=CC=CC(OC)=C1CN SBB059502 [0,2,0,0,0,0|1,0,1]=4 652 B12R1.1879 COC1=CC=CC(OC)=C1SC SBB059007 [0,2,0,0,0,0|1,0,1]=4 653 B10R1.15 CCC(=O)C1=CC=CC=C1 SBB058853 [0,0,1,1,0,0|2,0,0]=4 654 B10R1.15 CNC(=O)C1=CC=CC=C1 SBB051421 [0,0,1,1,0,0|2,0,0]=4 655 B10R1.15 COC(=N)C1=CC=CC=C1 SBB055305 [0,0,1,1,0,0|1,0,0]=3 656 B10R1.15 COC(=O)C1=CC=CC=C1 SBB058212 [0,0,1,1,0,0|1,0,0]=3 657 B10R1.15 COC(=O)C1=CC=CC=N1 SBB008127 [0,0,1,1,0,0|2,0,0]=4 658 B10R1.15 COC(=O)C1=CC=NC=C1 SBB058848 [0,0,1,1,0,0|2,0,0]=4 659 B10R1.15 COC(=O)C1=CN=CC=C1 SBB040924 [0,0,1,1,0,0|2,0,0]=4 660 B10R1.172 COC1=CC(C=O)=CC=C1 SBB040264 [0,0,1,1,0,0|1,0,0]=3 661 B10R1.172 COC1=CC(CN)=CC=C1 SBB061735 [0,0,1,1,0,0|1,0,1]=4 662 B10R1.172 COC1=CC(CO)=CC=C1 SBB063359 [0,0,1,1,0,0|1,0,1]=4 663 B10R1.172 COC1=CC(NN)=CC=C1 SBB064981 [0,0,1,1,0,0|2,0,0]=4 664 B10R1.172 COC1=CC=CC(C#N)=C1 SBB055059 [0,0,1,1,0,0|1,0,1]=4 665 B10R1.172 COC1=CC=CC(CBr)=C1 SBB054900 [0,0,1,1,0,0|1,0,1]=4 666 B10R1.172 COC1=CC=CC(CCl)=C1 SBB040609 [0,0,1,1,0,0|1,0,1]=4 667 B10R1.172 COC1=CC=CC(OC)=C1 SBB060066 [0,0,1,1,0,0|1,0,1]=4 668 B10R1.172 COC1=CN=CC(C=O)=C1 SBB052243 [0,0,1,1,0,0|2,0,0]=4 669 B10R1.176 COC1=CC(C)=C(F)C=C1 SBB086166 [0,0,1,1,0,0|1,0,1]=4 670 B10R1.176 COC1=CC(Cl)=C(F)C=C1 SBB087476 [0,0,1,1,0,0|2,0,0]=4 671 B10R1.176 COC1=CC(F)=C(Br)C=C1 SBB055267 [0,0,1,1,0,0|2,0,0]=4 672 B10R1.176 COC1=CC(F)=C(Cl)C=C1 SBB087475 [0,0,1,1,0,0|2,0,0]=4 673 B10R1.176 COC1=CC(F)=C(F)C=C1 SBB086325 [0,0,1,1,0,0|2,0,0]=4 674 B10R1.176 COC1=CC(N)=C(C)C=C1 SBB058810 [0,0,1,1,0,0|1,0,1]=4 675 B10R1.176 COC1=CC(N)=C(O)C=C1 SBB009779 [0,0,1,1,0,0|2,0,0]=4 676 B10R1.176 COC1=CC=C(Br)C(C)=C1 SBB054214 [0,0,1,1,0,0|1,0,1]=4 677 B10R1.176 COC1=CC=C(Br)C(N)=C1 SBB051753 [0,0,1,1,0,0|2,0,0]=4 678 B10R1.176 COC1=CC=C(C)C(F)=C1 SBB086170 [0,0,1,1,0,0|1,0,1]=4 679 B10R1.176 COC1=CC=C(Cl)C(C)=C1 SBB061027 [0,0,1,1,0,0|1,0,1]=4 680 B10R1.176 COC1=CC=C(Cl)C(N)=C1 SBB008038 [0,0,1,1,0,0|2,0,0]=4 681 B10R1.176 COC1=CC=C(N)C(C)=C1 SBB080570 [0,0,1,1,0,0|1,0,1]=4 682 B10R1.176 COC1=CC=C(N)C(F)=C1 SBB071687 [0,0,1,1,0,0|2,0,0]=4 683 B10R1.176 COC1=CC=C(N)C(N)=C1 SBB048084 [0,0,1,1,0,0|2,0,0]=4 684 B10R2.7 C1=CC2=C(C=C1)CCC2 SBB060083 [1,0,0,1,0,0|0,0,2]=4 685 B10R2.7 C1=CC2=C(C=C1)OC=C2 SBB060607 [1,0,0,1,0,0|0,0,0]=2 686 B10R2.7 C1=CC2=C(C=C1)OCO2 SBB059641 [1,0,0,1,0,0|1,0,0]=3 687 B10R2.7 C1=CC2=C(C=C1)SC=N2 SBB058513 [1,0,0,1,0,0|1,1,0]=4 688 B10R2.7 C1=CC=C2CC=CC2=C1 SBB040862 [1,0,0,1,0,0|0,0,0]=2 689 B10R2.7 C1=CC=C2COCC2=C1 SBB068697 [1,0,0,1,0,0|1,0,1]=4 690 B10R2.7 C1=CC=C2NC=CC2=C1 SBB055980 [1,0,0,1,0,0|1,0,0]=3 691 B10R2.7 C1=CC=C2NN=CC2=C1 SBB040063 [1,0,0,1,0,0|2,0,0]=4 692 B10R2.7 C1=CC=C2OCCC2=C1 SBB056038 [1,0,0,1,0,0|0,0,1]=3 693 B10R2.7 C1=CC=C2SC=CC2=C1 SBB055961 [1,0,0,1,0,0|0,1,0]=3 694 B10R2.7 C1=CC=C2SCNC2=C1 SBB017116 [1,0,0,1,0,0|1,1,0]=4 695 B10R2.7 C1=CC=C2[S+]=CSC2=C1 SBB099195 [1,0,0,1,0,0|1,1,0]=4 696 B10R2.7 N1C=CC2=C1N=CC=C2 SBB004295 [1,0,0,1,0,0|2,0,0]=4 697 B10R2.7 N1C=NC2=C1C=CC=C2 SBB004294 [1,0,0,1,0,0|2,0,0]=4 698 B10R2.7 N1CCC2=C1C=CC=C2 SBB004291 [1,0,0,1,0,0|1,0,1]=4 699 B12R2.24 BrC1=CC2=C(C=C1)N=CC=C2 SBB001559 [0,1,0,1,0,0|1,0,1]=4 700 B12R2.24 BrC1=CC2=C(C=CC=C2)N=C1 SBB059386 [0,1,0,1,0,0|1,0,1]=4 701 B12R2.24 BrC1=CC=C2C=CC=CC2=N1 SBB093967 [0,1,0,1,0,0|1,0,1]=4 702 B12R2.24 BrC1=CC=C2C=NC=CC2=C1 SBB054600 [0,1,0,1,0,0|2,0,0]=4 703 B12R2.24 BrC1=CC=C2OCCOC2=C1 SBB003399 [0,1,0,1,0,0|1,0,1]=4 704 B12R2.24 BrC1=NC=C2C=CC=CC2=C1 SBB093966 [0,1,0,1,0,0|2,0,0]=4 705 B12R2.24 CC1=CC2=C(C=C1)N=CC=C2 SBB059125 [0,1,0,1,0,0|1,0,1]=4 706 B12R2.24 CC1=CC2=C(C=CC=N2)C=C1 SBB059301 [0,1,0,1,0,0|1,0,1]=4 707 B12R2.24 CC1=CC=C2C=CC=CC2=C1 SBB060085 [0,1,0,1,0,0|1,0,0]=3 708 B12R2.24 CC1=CC=C2OCCNC2=C1 SBB076666 [0,1,0,1,0,0|1,0,1]=4 709 B12R2.24 CC1=NC2=C(C=CC=C2)C=C1 SBB008939 [0,1,0,1,0,0|1,0,0]=3 710 B12R2.24 CC1=NC2=NC=CC=C2C=C1 SBB042157 [0,1,0,1,0,0|2,0,0]=4 711 B12R2.24 CC1CNC2=CC=CC=C2O1 SBB080829 [0,1,0,1,0,0|1,0,1]=4 712 B12R2.24 C[N+]1=CC=C2C=CC=CC2=C1 SBB086356 [0,1,0,1,0,0|1,0,0]=3 713 B12R2.24 ClC1=CC=C2C=CC=CC2=N1 SBB056975 [0,1,0,1,0,0|1,0,1]=4 714 B12R2.24 FC1=CC2=C(C=C1)N=CC=C2 SBB086530 [0,1,0,1,0,0|1,0,1]=4 715 B12R2.24 FC1=CC2=C(C=CC=C2)C=C1 SBB086491 [0,1,0,1,0,0|1,0,1]=4 716 B12R2.24 IC1=CC2=C(C=C1)OCCO2 SBB054608 [0,1,0,1,0,0|1,0,1]=4 717 B12R2.24 IC1=CC=C2N=CC=CC2=C1 SBB054593 [0,1,0,1,0,0|1,0,1]=4 718 B12R2.24 NC1=CC2=C(C=C1)N=CC=C2 SBB008124 [0,1,0,1,0,0|1,0,1]=4 719 B12R2.24 NC1=CC2=C(C=C1)OCOC2 SBB006754 [0,1,0,1,0,0|1,0,1]=4 720 B12R2.24 NC1=CC2=C(C=CC=C2)N=C1 SBB004125 [0,1,0,1,0,0|1,0,1]=4 721 B12R2.24 NC1=CC2=C(C=CC=C2)N=C1 SBB004128 [0,1,0,1,0,0|1,0,1]=4 722 B12R2.24 NC1=CC2=CC=CC=C2C=N1 SBB051996 [0,1,0,1,0,0|2,0,0]=4 723 B12R2.24 NC1=CC2=CN=CC=C2C=C1 SBB069969 [0,1,0,1,0,0|2,0,0]=4 724 B12R2.24 NC1=CC=C2C=CC=CC2=C1 SBB057506 [0,1,0,1,0,0|1,0,1]=4 725 B12R2.24 NC1=CC=C2N=CC=CC2=C1 SBB004130 [0,1,0,1,0,0|1,0,1]=4 726 B12R2.24 NC1=CC=C2OCCOC2=C1 SBB038600 [0,1,0,1,0,0|1,0,1]=4 727 B12R2.24 NC1=NC2=CC=CC=C2C=C1 SBB051994 [0,1,0,1,0,0|1,0,1]=4 728 B12R2.24 O=C1C=CC2=C(C=CC=C2)O1 SBB000094 [0,1,0,1,0,0|0,0,1]=3 729 B12R2.24 O=C1C=CC2=CC=CC=C2N1 SBB004119 [0,1,0,1,0,0|1,0,1]=4 730 B12R2.24 O=C1CCC2=C(C=CC=C2)O1 SBB058834 [0,1,0,1,0,0|2,0,0]=4 731 B12R2.24 O=C1CCC2=CC=CC=C2N1 SBB056014 [0,1,0,1,0,0|2,0,0]=4 732 B12R2.24 O=C1CNC2=C(C=CC=C2)N1 SBB017923 [0,1,0,1,0,0|2,0,0]=4 733 B12R2.24 O=C1COC2=C(N=CC=C2)N1 SBB006815 [0,1,0,1,0,0|2,0,0]=4 734 B12R2.24 O=C1COC2=CC=CC=C2N1 SBB016409 [0,1,0,1,0,0|1,0,0]=3 735 B12R2.24 O=C1CSC2=C(C=CC=C2)N1 SBB061807 [0,1,0,1,0,0|1,1,0]=4 736 B12R2.24 OC1=CC2=C(C=CC=C2)N=C1 SBB059635 [0,1,0,1,0,0|1,0,1]=4 737 B12R2.24 OC1=CC2=CC=CC=C2C=C1 SBB040896 [0,1,0,1,0,0|1,0,1]=4 738 B12R2.24 OC1=CC=C2C=CN=CC2=C1 SBB056018 [0,1,0,1,0,0|2,0,0]=4 739 B12R2.24 OC1=CC=C2N=CC=CC2=C1 SBB004117 [0,1,0,1,0,0|1,0,1]=4 740 B12R2.24 SC1=CC2=C(C=CC=C2)C=C1 SBB059269 [0,1,0,1,0,0|1,0,1]=4 741 B12R2.132 CC1=CC2=C(C=C1)CCC2=O SBB069423 [0,1,0,1,0,0|2,0,0]=4 742 B12R2.132 CC1=CNC2=C1C=C(F)C=C2 SBB086634 [0,1,0,1,0,0|2,0,0]=4 743 B12R2.132 CC1=CSC2=C1C=C(Br)C=C2 SBB097094 [0,1,0,1,0,0|2,0,0]=4 744 B12R2.132 CC1=CSC2=C1C=C(Cl)C=C2 SBB089968 [0,1,0,1,0,0|2,0,0]=4 745 B12R2.132 CC1=CSC2=CC=C(F)C=C12 SBB088020 [0,1,0,1,0,0|2,0,0]=4 746 B12R2.132 CN1C=NC2=CC=C(N)C=C21 SBB071966 [0,1,0,1,0,0|2,0,0]=4 747 B12R2.132 NC1=CC2=C(C=C1)CCC2=O SBB066648 [0,1,0,1,0,0|2,0,0]=4 748 B12R2.132 NC1=CC2=C(C=C1)OCC2=O SBB074348 [0,1,0,1,0,0|1,0,0]=3 749 B12R2.132 O=C1CCC2=C1C=C(Br)C=C2 SBB067175 [0,1,0,1,0,0|2,0,0]=4 750 B12R2.132 O=C1CCC2=CC=C(F)C=C12 SBB056321 [0,1,0,1,0,0|2,0,0]=4 751 B12R2.132 O=C1COC2=CC=C(Cl)C=C12 SBB068529 [0,1,0,1,0,0|1,0,0]=3 752 B12R2.612 CC1=CC=C2C(=O)CCC2=C1 SBB056356 [0,1,0,1,0,0|2,0,0]=4 753 B12R2.612 CN1C=CC2=C1C=CC(N)=C2 SBB010309 [0,1,0,1,0,0|1,0,0]=3 754 B12R2.612 CN1C=NC2=CC(N)=CC=C21 SBB047718 [0,1,0,1,0,0|2,0,0]=4 755 B12R2.612 CN1N=CC2=CC(Br)=CC=C21 SBB054728 [0,1,0,1,0,0|2,0,0]=4 756 B12R2.612 CN1N=CC2=CC(N)=CC=C21 SBB052094 [0,1,0,1,0,0|2,0,0]=4 757 B12R2.612 O=C1CCC2=C1C=CC(Cl)=C2 SBB069432 [0,1,0,1,0,0|2,0,0]=4 758 B12R2.612 O=C1CCC2=CC(Br)=CC=C12 SBB054671 [0,1,0,1,0,0|2,0,0]=4 759 B12R2.612 O=C1CCC2=CC(F)=CC=C12 SBB054670 [0,1,0,1,0,0|2,0,0]=4 760 B12R2.612 O=C1COC2=CC(O)=CC=C12 SBB038967 [0,1,0,1,0,0|1,0,0]=3 761 B12R2.612 OC1=NOC2=CC(Cl)=CC=C21 SBB054626 [0,1,0,1,0,0|2,0,0]=4 762 B12R2.1 C(=O)C1=CNC2=C1C=CC=C2 SBB004120 [0,1,0,1,0,0|1,0,1]=4 763 B12R2.1 C=CN1C=NC2=CC=CC=C21 SBB001661 [0,1,0,1,0,0|1,0,1]=4 764 B12R2.1 O=CC1=CSC2=CC=CC=C12 SBB052322 [0,1,0,1,0,0|0,1,1]=4 765 B12R2.1 OCC1=CNC2=C1C=CC=C2 SBB004095 [0,1,0,1,0,0|2,0,0]=4 766 B12R2.18 CC1CC2=CC=CC=C2C1=O SBB067570 [0,1,0,1,0,0|2,0,0]=4 767 B12R2.18 CN1C(=O)CC2=CC=CC=C21 SBB006878 [0,1,0,1,0,0|1,0,1]=4 768 B12R2.18 CN1C(=O)OC2=C1C=CC=C2 SBB017054 [0,1,0,1,0,0|2,0,0]=4 769 B12R2.18 CN1C(=O)SC2=C1C=CC=C2 SBB071442 [0,1,0,1,0,0|2,0,0]=4 770 B12R2.18 CN1C(=S)NC2=CC=CC=C21 SBB018392 [0,1,0,1,0,0|2,0,0]=4 771 B12R2.18 CN1C(=S)OC2=C1C=CC=C2 SBB012364 [0,1,0,1,0,0|2,0,0]=4 772 B12R2.18 CN1C(=S)SC2=CC=CC=C21 SBB007611 [0,1,0,1,0,0|2,0,0]=4 773 B12R2.18 CN1C(N)=NC2=C1C=CC=C2 SBB004092 [0,1,0,1,0,0|2,0,0]=4 774 B12R2.18 CN1C2=CC=CC=C2N=C1Cl SBB079664 [0,1,0,1,0,0|2,0,0]=4 775 B12R2.18 CN1C2=CC=CC=C2N=C1S SBB039024 [0,1,0,1,0,0|2,0,0]=4 776 B12R2.18 O=C1C2=CC=CC=C2CC1Br SBB054709 [0,1,0,1,0,0|2,0,0]=4 777 B12R2.315 CCC1=C2NC=CC2=CC=C1 SBB007573 [0,1,0,1,0,0|1,0,0]=3 778 B12R2.315 COC1=C2C=CNC2=CC=C1 SBB055969 [0,1,0,1,0,0|0,0,0]=2 779 B12R2.315 COC1=C2NC=CC2=CC=C1 SBB055971 [0,1,0,1,0,0|0,0,0]=2 780 B12R2.315 COC1=C2NC=CC2=CC=N1 SBB056382 [0,1,0,1,0,0|1,0,0]=3 781 B12R2.315 N#CC1=CC=CC2=C1C=CN2 SBB018741 [0,1,0,1,0,0|2,0,0]=4 782 B12R2.315 N#CC1=CC=CC2=C1NC=C2 SBB066719 [0,1,0,1,0,0|2,0,0]=4 783 B12R2.315 NCC1=C2C=CNC2=CC=C1 SBB108728 [0,1,0,1,0,0|2,0,0]=4 784 B12R2.315 O=CC1=CC=CC2=C1C=CN2 SBB014557 [0,1,0,1,0,0|2,0,0]=4 785 B12R2.315 O=CC1=CC=CC2=C1NC=C2 SBB066621 [0,1,0,1,0,0|2,0,0]=4 786 B12R2.315 O=CC1=CC=CC2=C1OCC2 SBB059729 [0,1,0,1,0,0|1,0,0]=3 787 B12R2.315 O=CC1=CC=CC2=C1OCO2 SBB004074 [0,1,0,1,0,0|1,0,0]=3 788 B12R2.315 OCC1=CC=CC2=C1C=CN2 SBB018599 [0,1,0,1,0,0|2,0,0]=4 789 B12R2.1081 BrC1=C2C=CC=CC2=CC=C1 SBB060210 [0,1,0,1,0,0|1,0,1]=4 790 B12R2.1081 BrC1=C2C=CN=CC2=CC=C1 SBB040185 [0,1,0,1,0,0|2,0,0]=4 791 B12R2.1081 BrC1=C2C=NC=CC2=CC=C1 SBB054599 [0,1,0,1,0,0|2,0,0]=4 792 B12R2.1081 BrC1=C2N=CC=CC2=CC=C1 SBB054586 [0,1,0,1,0,0|1,0,1]=4 793 B12R2.1081 BrC1=CC=CC2=NC=CC=C12 SBB093965 [0,1,0,1,0,0|1,0,1]=4 794 B12R2.1081 BrC1=CC=NC2=CC=CC=C12 SBB054590 [0,1,0,1,0,0|1,0,1]=4 795 B12R2.1081 BrC1=CN=CC2=CC=CC=C12 SBB054598 [0,1,0,1,0,0|2,0,0]=4 796 B12R2.1081 CC1=C2C=CC=CC2=CC=C1 SBB060401 [0,1,0,1,0,0|1,0,0]=3 797 B12R2.1081 CC1=CC=CC2=CC=CN=C12 SBB080579 [0,1,0,1,0,0|1,0,1]=4 798 B12R2.1081 CC1=CC=CC2=NC=CC=C12 SBB059687 [0,1,0,1,0,0|1,0,1]=4 799 B12R2.1081 CC1=CC=NC2=C1C=CC=C2 SBB058784 [0,1,0,1,0,0|1,0,0]=3 800 B12R2.1081 CC1=NC=CC2=CC=CC=C21 SBB056020 [0,1,0,1,0,0|1,0,0]=3 801 B12R2.1081 C[N+]1=C2C=CC=CC2=CC=C1 SBB061147 [0,1,0,1,0,0|1,0,0]=3 802 B12R2.1081 ClC1=C2C=CC=CC2=CC=C1 SBB060227 [0,1,0,1,0,0|1,0,1]=4 803 B12R2.1081 ClC1=C2C=CC=CC2=NC=C1 SBB017078 [0,1,0,1,0,0|1,0,1]=4 804 B12R2.1081 ClC1=CC=CC2=C1N=CC=C2 SBB059477 [0,1,0,1,0,0|1,0,1]=4 805 B12R2.1081 ClC1=NC=CC2=C1C=CC=C2 SBB059626 [0,1,0,1,0,0|2,0,0]=4 806 B12R2.1081 FC1=CC=CC2=C1C=CC=C2 SBB086490 [0,1,0,1,0,0|1,0,1]=4 807 B12R2.1081 FC1=CC=CC2=C1N=CC=C2 SBB059577 [0,1,0,1,0,0|1,0,1]=4 808 B12R2.1081 NC1=C2C=CC=CC2=CC=C1 SBB040451 [0,1,0,1,0,0|1,0,1]=4 809 B12R2.1081 NC1=C2C=NC=CC2=CC=C1 SBB051999 [0,1,0,1,0,0|2,0,0]=4 810 B12R2.1081 NC1=C2N=CC=CC2=CC=C1 SBB004126 [0,1,0,1,0,0|1,0,1]=4 811 B12R2.1081 NC1=C2OCCOC2=CC=C1 SBB052002 [0,1,0,1,0,0|1,0,1]=4 812 B12R2.1081 NC1=CC=CC2=C1C=CC=N2 SBB010065 [0,1,0,1,0,0|1,0,1]=4 813 B12R2.1081 NC1=CC=CC2=C1C=CN=C2 SBB004127 [0,1,0,1,0,0|2,0,0]=4 814 B12R2.1081 NC1=CC=NC2=C1C=CC=C2 SBB018823 [0,1,0,1,0,0|1,0,1]=4 815 B12R2.1081 NC1=CN=CC2=CC=CC=C12 SBB051995 [0,1,0,1,0,0|2,0,0]=4 816 B12R2.1081 NC1=NC=CC2=C1C=CC=C2 SBB004129 [0,1,0,1,0,0|2,0,0]=4 817 B12R2.1081 NC1CCOC2=CC=CC=C21 SBB042737 [0,1,0,1,0,0|0,0,2]=4 818 B12R2.1081 O=C1C=COC2=C1C=CC=C2 SBB086467 [0,1,0,1,0,0|0,0,1]=3 819 B12R2.1081 O=C1CCCC2=C1C=CC=C2 SBB066987 [0,1,0,1,0,0|1,0,1]=4 820 B12R2.1081 O=C1CCOC2=CC=CC=C12 SBB056286 [0,1,0,1,0,0|0,0,1]=3 821 B12R2.1081 OC1=C2N=CC=CC2=CC=C1 SBB009097 [0,1,0,1,0,0|1,0,1]=4 822 B12R2.1081 OC1=CC=CC2=C1C=CC=N2 SBB004118 [0,1,0,1,0,0|1,0,1]=4 823 B12R2.1081 OC1=CC=CC2=C1C=NC=C2 SBB086406 [0,1,0,1,0,0|2,0,0]=4 824 B12R2.1081 OC1=CC=CC2=CC=CC=C12 SBB040845 [0,1,0,1,0,0|1,0,1]=4 825 B12R2.1081 OC1=CC=NC2=C1C=CC=C2 SBB086405 [0,1,0,1,0,0|1,0,1]=4 826 B12R2.1081 OC1=COCC2=CC=CC=C12 SBB067393 [0,1,0,1,0,0|1,0,1]=4 827 B12R2.1081 OC1=NC=CC2=CC=CC=C21 SBB004122 [0,1,0,1,0,0|2,0,0]=4 828 B12R2.1081 O[C@H]1CCOC2=CC=CC=C21 SBB086707 [0,1,0,1,0,0|0,0,2]=4 829 B12R2.1081 SC1=NC=CC2=CC=CC=C21 SBB046002 [0,1,0,1,0,0|2,0,0]=4 830 B12R2.1081 [O-][N+]1=CC=CC2=C1C=CC=C2 SBB058323 [0,1,0,1,0,0|1,0,1]=4 831 B12R2.1081 [S-]C1=CC=CC2=C1N=CC=C2 SBB017114 [0,1,0,1,0,0|1,0,1]=4 832 B12R2.2028 CC1CC(=O)C2=CC=CC=C21 SBB067569 [0,1,0,1,0,0|1,0,1]=4 833 B12R2.2028 CN1N=C(N)C2=C1C=CC=C2 SBB052076 [0,1,0,1,0,0|2,0,0]=4 834 B12R2.2028 O=C1CC(=O)C2=CC=CC=C12 SBB058387 [0,1,0,1,0,0|2,0,0]=4 835 B12R2.2403 O=S1(=O)C=CC2=C1C=CC=C2 SBB088011 [0,1,0,1,0,0|1,1,0]=4 836 B12R2.196 O=C1CCC2=C1C=CC=C2Br SBB066977 [0,1,0,1,0,0|2,0,0]=4 837 B12R2.196 O=C1CCC2=C1C=CC=C2F SBB067819 [0,1,0,1,0,0|2,0,0]=4 838 B12R2.196 O=C1CCC2=C1C=CC=C2O SBB067319 [0,1,0,1,0,0|2,0,0]=4 839 B8R1.11 CC1=C(C=O)C=CO1 SBB052277 [1,0,0,0,1,0|2,0,0]=4 840 B8R1.11 CC1=C(C=O)SC=C1 SBB040199 [1,0,0,0,1,0|2,0,0]=4 841 B8R1.11 CN1C=CC=C1C=O SBB040239 [1,0,0,0,1,0|2,0,0]=4