0 B11R1.21 CC(=O)C1=CC(I)=C(N)C=C1 X7016 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.21 CC(=O)C1=CC(I)=C(O)C=C1 1108AQ [0,0,0,0,0,0|3,0,1]=4 2 B11R1.21 CC(=O)C1=CC(N)=C(Br)C=C1 1073AQ [0,0,0,0,0,0|3,0,1]=4 3 B11R1.21 CC(=O)C1=CC(N)=C(C)C=C1 8759AA [0,0,0,0,0,0|2,0,1]=3 4 B11R1.21 CC(=O)C1=CC=C(C)C(O)=C1 W5512 [0,0,0,0,0,0|1,0,1]=2 5 B11R1.21 CC(C)C1=CC(Br)=C(O)C=C1 6556AD [0,0,0,0,0,0|2,0,0]=2 6 B11R1.21 CC(N)C1=CC(F)=C(O)C=C1 7727AC [0,0,0,0,0,0|3,0,0]=3 7 B11R1.21 CC(N)C1=CC=C(Cl)C(Cl)=C1 V8866 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.21 CC(O)C1=CC(Br)=C(F)C=C1 4966AC [0,0,0,0,0,0|3,0,0]=3 9 B11R1.21 CC1=C(C)C=C(C(C)N)C=C1 2930AF [0,0,0,0,0,0|2,0,0]=2 10 B11R1.21 CC1=C(C)C=C(C(N)=S)C=C1 2091AJ [0,0,0,0,0,0|3,0,1]=4 11 B11R1.21 CC1=C(F)C=C(C(N)=S)C=C1 5832AD [0,0,0,0,0,0|3,0,1]=4 12 B11R1.21 CC1=C(F)C=CC([C@@H](C)N)=C1 3792AA [0,0,0,0,0,0|3,0,0]=3 13 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 3798AA [0,0,0,0,0,0|3,0,0]=3 14 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 3799AA [0,0,0,0,0,0|3,0,0]=3 15 B11R1.21 CC1=CC(C(F)F)=CC=C1F 1169AD [0,0,0,0,0,0|4,0,0]=4 16 B11R1.21 CC1=CC(N(C)C)=CC=C1N 1607AB [0,0,0,0,0,0|3,0,0]=3 17 B11R1.21 CC1=CC=C(B(O)O)C=C1Br Z0083 [0,0,0,0,0,0|4,0,0]=4 18 B11R1.21 CC1=CC=C(C(=N)N)C=C1C 5252AH [0,0,0,0,0,0|3,0,1]=4 19 B11R1.21 CC1=CC=C(C(C)C)C=C1N B800 [0,0,0,0,0,0|1,0,0]=1 20 B11R1.21 CC1=CC=C(C(F)F)C=C1F 1136AD [0,0,0,0,0,0|3,0,0]=3 21 B11R1.21 CC1=CC=C([C@H](C)N)C=C1Cl 3803AA [0,0,0,0,0,0|2,0,0]=2 22 B11R1.21 C[C@@H](N)C1=CC(Cl)=C(F)C=C1 0358AA [0,0,0,0,0,0|3,0,0]=3 23 B11R1.21 C[C@@H](N)C1=CC(F)=C(Cl)C=C1 1180AL [0,0,0,0,0,0|3,0,0]=3 24 B11R1.21 C[C@@H](N)C1=CC=C(Cl)C(F)=C1 4775AA [0,0,0,0,0,0|3,0,0]=3 25 B11R1.21 C[C@@H](N)C1=CC=C(F)C(Cl)=C1 X9639 [0,0,0,0,0,0|3,0,0]=3 26 B11R1.21 C[C@@H](N)C1=CC=C(F)C(F)=C1 W5394 [0,0,0,0,0,0|3,0,0]=3 27 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Cl)C=C1 7502AA [0,0,0,0,0,0|3,0,0]=3 28 B11R1.21 C[C@H](N)C1=CC(F)=C(Cl)C=C1 2069AA [0,0,0,0,0,0|3,0,0]=3 29 B11R1.21 C[C@H](N)C1=CC(F)=C(F)C=C1 X3908 [0,0,0,0,0,0|3,0,0]=3 30 B11R1.21 C[C@H](N)C1=CC=C(Cl)C(F)=C1 X9597 [0,0,0,0,0,0|3,0,0]=3 31 B11R1.21 FC1=C(Br)C=CC(C(F)F)=C1 0998AQ [0,0,0,0,0,0|4,0,0]=4 32 B11R1.21 NC(=O)C1=CC(O)=C(O)C=C1 9447AJ [0,0,0,0,0,0|3,0,1]=4 33 B10R1.13 C=C(C)C1=CC=C(C)C=C1 3347AA [1,0,0,0,0,0|0,0,2]=3 34 B10R1.13 C=C(C)C1=CC=C(F)C=C1 2727AL [1,0,0,0,0,0|1,0,2]=4 35 B10R1.13 CC(=O)C1=CC=C(N)C=C1 6399AL [1,0,0,0,0,0|2,0,1]=4 36 B10R1.13 CC(Br)C1=CC=C(Br)C=C1 1606AL [1,0,0,0,0,0|2,0,0]=3 37 B10R1.13 CC(C)C1=CC=C(O)C=N1 0499AA [1,0,0,0,0,0|2,0,0]=3 38 B10R1.13 CC(C)C1=CC=C(S)C=C1 L740 [1,0,0,0,0,0|1,0,0]=2 39 B10R1.13 CC(C)C1=CN=C(N)C=C1 W7287 [1,0,0,0,0,0|2,0,0]=3 40 B10R1.13 CC(N)C1=CC=C(I)C=C1 4982AC [1,0,0,0,0,0|2,0,0]=3 41 B10R1.13 CC(N)C1=CC=C(N)C=C1 2415AJ [1,0,0,0,0,0|2,0,0]=3 42 B10R1.13 CC(N)C1=NC=C(Br)C=C1 3774AC [1,0,0,0,0,0|3,0,0]=4 43 B10R1.13 CC(N)C1=NC=C(F)C=C1 5402AC [1,0,0,0,0,0|3,0,0]=4 44 B10R1.13 CC1=CC=C(C(=O)[O-])C=C1 8386AA [1,0,0,0,0,0|2,0,1]=4 45 B10R1.13 CC1=CC=C(C(C)N)N=C1 4578AH [1,0,0,0,0,0|2,0,0]=3 46 B10R1.13 CC1=CC=C(C(C)N)N=C1 9504AH [1,0,0,0,0,0|2,0,0]=3 47 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 5443AB [1,0,0,0,0,0|1,0,0]=2 48 B10R1.13 CC1=CC=C([S@@](C)=O)C=C1 N143 [1,0,0,0,0,0|2,0,0]=3 49 B10R1.13 CC1=CC[C@H](C(C)C)C=C1 3942AL [1,0,0,0,0,0|0,0,2]=3 50 B10R1.13 CN(C)C1=CC=[N+]([O-])C=C1 6241AL [1,0,0,0,0,0|3,0,0]=4 51 B10R1.13 CN(C)C1=CC=[N+]([O-])C=C1 6486AL [1,0,0,0,0,0|3,0,0]=4 52 B10R1.13 CN(C)C1=NC=C(N)C=C1 6679AB [1,0,0,0,0,0|3,0,0]=4 53 B10R1.13 CN(C)C1=NC=C(N)C=C1 W5002 [1,0,0,0,0,0|3,0,0]=4 54 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 X4561 [1,0,0,0,0,0|2,0,0]=3 55 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 X3988 [1,0,0,0,0,0|2,0,0]=3 56 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 0354AA [1,0,0,0,0,0|2,0,0]=3 57 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 7591AD [1,0,0,0,0,0|2,0,0]=3 58 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 0357AA [1,0,0,0,0,0|2,0,0]=3 59 B10R1.13 NC1=CC=C(C(F)F)C=C1 Z1981 [1,0,0,0,0,0|3,0,0]=4 60 B10R1.113 CC(C)C1=CC=CC(Cl)=N1 Y3806 [1,0,0,0,0,0|2,0,0]=3 61 B10R1.113 CC(C)C1=CC=CC(N)=N1 W8437 [1,0,0,0,0,0|2,0,0]=3 62 B10R1.113 CC(C)C1=CC=NC(O)=N1 3007AD [1,0,0,0,0,0|2,0,0]=3 63 B10R1.113 CC(C)C1=NC(Cl)=NC=C1 V9367 [1,0,0,0,0,0|3,0,0]=4 64 B10R1.113 CC(C)C1=NC=CC(Cl)=C1 6890AC [1,0,0,0,0,0|2,0,0]=3 65 B10R1.113 CC(C)C1=NC=CC(N)=N1 2378AA [1,0,0,0,0,0|3,0,0]=4 66 B10R1.113 CC(N)C1=CC(O)=CC=C1 Y9690 [1,0,0,0,0,0|1,0,0]=2 67 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 V5733 [1,0,0,0,0,0|2,0,0]=3 68 B10R1.113 CC1=CC(C(C)N)=NC=C1 5999AE [1,0,0,0,0,0|3,0,0]=4 69 B10R1.113 CC1=CC(N(C)C)=NC=C1 0347AB [1,0,0,0,0,0|3,0,0]=4 70 B10R1.113 CC1=CC=CC(C(C)C)=C1 5135AE [1,0,0,0,0,0|1,0,0]=2 71 B10R1.113 CC1=NC(C(C)N)=CC=C1 9513AH [1,0,0,0,0,0|3,0,0]=4 72 B10R1.113 CN(C)C1=CC=CC(Cl)=N1 8284AC [1,0,0,0,0,0|3,0,0]=4 73 B10R1.113 CN(C)C1=CC=CC(N)=C1 2773AB [1,0,0,0,0,0|2,0,0]=3 74 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 W5401 [1,0,0,0,0,0|2,0,0]=3 75 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 Z5107 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.113 C[C@@H](O)C1=CC(Cl)=CC=C1 3482AA [1,0,0,0,0,0|2,0,0]=3 77 B10R1.113 C[C@@H](O)C1=CC=CC(F)=C1 5245AA [1,0,0,0,0,0|2,0,0]=3 78 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 W5400 [1,0,0,0,0,0|2,0,0]=3 79 B10R1.113 C[C@H](O)C1=CC(Br)=CC=C1 6219AA [1,0,0,0,0,0|2,0,0]=3 80 B10R1.113 C[C@H](O)C1=CC(F)=CC=C1 5244AA [1,0,0,0,0,0|2,0,0]=3 81 B10R1.113 FC1=CC(C(Br)Br)=CC=C1 O150 [1,0,0,0,0,0|3,0,0]=4 82 B10R1.113 FC1=CC=CC(C(F)F)=C1 8582AD [1,0,0,0,0,0|3,0,0]=4 83 B10R1.113 O=C([O-])C1=CC(O)=CC=C1 8975AL [1,0,0,0,0,0|2,0,1]=4 84 B10R1.176 CC1=C(Br)C=C(CBr)C=C1 2176AB [1,0,0,0,0,0|2,0,0]=3 85 B10R1.176 CC1=C(F)C=C(CBr)C=C1 7166AA [1,0,0,0,0,0|2,0,0]=3 86 B10R1.176 CC1=C(O)C=CC(CO)=C1 9583AA [1,0,0,0,0,0|3,0,0]=4 87 B10R1.176 CC1=CC(CN)=CC=C1Br W3251 [1,0,0,0,0,0|3,0,0]=4 88 B10R1.176 CC1=CC(CO)=CC=C1N 2117AF [1,0,0,0,0,0|3,0,0]=4 89 B10R1.176 CC1=CC=C(C=O)C=C1O Z0696 [1,0,0,0,0,0|1,0,1]=3 90 B10R1.176 CCC1=CC(C)=C(C)C=C1 6497AL [1,0,0,0,0,0|1,0,0]=2 91 B10R1.176 CCC1=CC(F)=C(N)C=C1 2714AC [1,0,0,0,0,0|2,0,0]=3 92 B10R1.176 CCC1=CC(F)=C(N)C=C1 3498AA [1,0,0,0,0,0|2,0,0]=3 93 B10R1.176 CCC1=CC(N)=C(F)C=C1 7951AA [1,0,0,0,0,0|2,0,0]=3 94 B10R1.176 CCC1=CC(N)=C(N)C=C1 2716AA [1,0,0,0,0,0|2,0,0]=3 95 B10R1.176 CN1C=CC(CO)=CC1=O 9917AH [1,0,0,0,0,0|2,0,1]=4 96 B10R1.176 CNC1=CC=C(C)C(Br)=C1 2220AJ [1,0,0,0,0,0|2,0,0]=3 97 B10R1.176 CNC1=CC=C(C)C(Cl)=C1 V7723 [1,0,0,0,0,0|2,0,0]=3 98 B10R1.176 CNC1=CC=C(Cl)C(Cl)=C1 Z7949 [1,0,0,0,0,0|3,0,0]=4 99 B10R1.176 COC1=CC=C(N)C(C)=C1 Z9736 [1,0,0,0,0,0|3,0,0]=4 100 B10R1.176 COC1=CN=C(C)C(Br)=C1 X3672 [1,0,0,0,0,0|3,0,0]=4 101 B10R1.176 COC1=NC=C(Cl)C(O)=C1 Y3794 [1,0,0,0,0,0|3,0,0]=4 102 B10R1.176 CSC1=CC=C(Br)C(C)=C1 Z1061 [1,0,0,0,0,0|3,0,0]=4 103 B10R1.176 CSC1=CC=C(Br)C(F)=C1 Z1097 [1,0,0,0,0,0|3,0,0]=4 104 B10R1.176 FC1=C(Br)C=C(CCl)C=C1 2257AC [1,0,0,0,0,0|3,0,0]=4 105 B10R1.176 FC1=CC(CCl)=CC=C1Br Z8298 [1,0,0,0,0,0|3,0,0]=4 106 B10R1.176 FC1=CC(CCl)=CC=C1Cl X2645 [1,0,0,0,0,0|3,0,0]=4 107 B10R1.176 N#CC1=CC=C(Br)C(O)=C1 6118AJ [1,0,0,0,0,0|2,0,1]=4 108 B10R1.176 N#CC1=CC=C(N)C(O)=C1 Z4880 [1,0,0,0,0,0|2,0,1]=4 109 B10R1.176 NC1=C(N)C=C(CO)C=C1 7078AE [1,0,0,0,0,0|3,0,0]=4 110 B10R1.176 NC1=CC=C(CO)C=C1Cl 1122AL [1,0,0,0,0,0|3,0,0]=4 111 B10R1.176 NCC1=CC=C(Br)C(F)=C1 1145AD [1,0,0,0,0,0|3,0,0]=4 112 B10R1.176 OCC1=CC(O)=C(I)C=C1 2103AC [1,0,0,0,0,0|2,0,0]=3 113 B10R1.176 OCC1=CC=C(F)C(I)=C1 7762AD [1,0,0,0,0,0|3,0,0]=4 114 B10R1.176 OCC1=CC=C(I)C(F)=C1 5048AA [1,0,0,0,0,0|3,0,0]=4 115 B12R1.23 CC1=CC=C(C(F)(F)F)C=C1I Z9510 [0,1,0,0,0,0|3,0,0]=4 116 B12R1.23 CC1=CC=C(S(C)(=O)=O)C=C1F 5551AJ [0,1,0,0,0,0|3,0,0]=4 117 B12R1.23 CC1=CC=C(S(C)(=O)=O)C=C1N 5586AJ [0,1,0,0,0,0|3,0,0]=4 118 B12R1.48 CC(C)C1=CC=C(C#N)C(=O)N1 5964AE [0,1,0,0,0,0|1,0,2]=4 119 B12R1.48 CC(C)C1=NC(Cl)=C(C#N)C=C1 8462AC [0,1,0,0,0,0|2,0,1]=4 120 B12R1.48 CC1=C(C=O)C=CC(N(C)C)=C1 0821AD [0,1,0,0,0,0|2,0,1]=4 121 B12R1.48 CCC1=CC=C(C(=O)O)C=C1O Q690 [0,1,0,0,0,0|2,0,1]=4 122 B12R1.56 CC(C)C1=CC=C(N)C(C#N)=C1 W6907 [0,1,0,0,0,0|2,0,0]=3 123 B12R1.56 CC1=CC=C(B(O)O)C=C1CO Z1442 [0,1,0,0,0,0|3,0,0]=4 124 B12R1.56 COC1=CC([C@@H](C)N)=CC=C1F X9126 [0,1,0,0,0,0|2,0,0]=3 125 B12R1.56 COC1=CC([C@@H](C)N)=CC=C1F X9637 [0,1,0,0,0,0|2,0,0]=3 126 B12R1.232 CC(=O)C1=C(C)C=C(C)C(C)=C1 6898AD [0,1,0,0,0,0|2,0,1]=4 127 B12R1.232 CC(N)C1=CC(F)=C(Cl)C=C1Cl V8113 [0,1,0,0,0,0|3,0,0]=4 128 B12R1.232 CC1=C(O)C=C(C(C)C)C(Br)=C1 1230AD [0,1,0,0,0,0|0,0,0]=1 129 B12R1.232 CC1=CC(O)=C(C(C)C)C=C1N 7086AE [0,1,0,0,0,0|1,0,0]=2 130 B12R1.367 CC1=C(C)C=C(C(=O)CCl)C=C1 4488AE [0,1,0,0,0,0|2,0,1]=4 131 B12R1.367 CC1=CC=C(C(=O)CBr)C=C1C 2008AL [0,1,0,0,0,0|2,0,1]=4 132 B12R1.367 CC1=CC=C(C(N)CO)C=C1C 4968AH [0,1,0,0,0,0|2,0,0]=3 133 B12R1.367 CCC(C)C1=CC(Br)=C(O)C=C1 7213AE [0,1,0,0,0,0|2,0,0]=3 134 B12R1.367 COC(=O)C1=CC=C(Cl)C(O)=C1 Z4261 [0,1,0,0,0,0|2,0,1]=4 135 B12R1.367 NC[C@@H](O)C1=CC(O)=C(O)C=C1 9726AB [0,1,0,0,0,0|2,0,0]=3 136 B12R1.367 OCC(Cl)C1=CC=C(Cl)C(Cl)=C1 2028AL [0,1,0,0,0,0|3,0,0]=4 137 B12R1.893 CC(=O)C1=C(F)C(F)=C(C)C=C1 8665AD [0,1,0,0,0,0|2,0,1]=4 138 B12R1.893 CC1=C(O)C(C)=C([N+](=O)[O-])C=C1 8372AE [0,1,0,0,0,0|3,0,0]=4 139 B12R1.1005 CC(C)C1=CC(Br)=C(N)C(Br)=C1 Y3593 [0,1,0,0,0,0|2,0,0]=3 140 B12R2.291 FC1=C(F)C=C(C2CO2)C=C1 5201AJ [0,0,0,1,0,0|3,0,0]=4 141 B10R1.58 CC1=C(C)SC(C(C)C)=N1 L606 [0,0,0,0,1,0|3,0,0]=4 142 B10R1.58 CC1=NN(C(C)C)C=C1Br 1199AD [0,0,0,0,1,0|3,0,0]=4 143 B10R1.58 CC1=NN(C(C)C)C=C1I 1198AD [0,0,0,0,1,0|3,0,0]=4 144 B12R1.19 CC(=O)NC1=CC(N)=C(C)C=C1 7210AE [0,0,0,0,0,1|2,0,1]=4 145 B12R1.19 CC(=O)NC1=CC=C(Cl)C(O)=C1 V4906 [0,0,0,0,0,1|2,0,1]=4 146 B12R1.19 CC(C)OC1=CC=C(F)C(F)=C1 V4196 [0,0,0,0,0,1|2,0,0]=3 147 B12R1.19 CC(C)OC1=CC=C(N)C(F)=C1 V8041 [0,0,0,0,0,1|2,0,0]=3 148 B9R1.1 CC1=NC=C(CCl)C=C1 Y9334 [2,0,0,0,0,0|2,0,0]=4 149 B9R1.1 CCC1=CC=C(C)C=C1 9372AB [2,0,0,0,0,0|0,0,0]=2 150 B9R1.1 CCC1=CC=C(Cl)C=N1 2584AA [2,0,0,0,0,0|2,0,0]=4 151 B9R1.1 CCC1=CC=C(N)C=N1 5249AA [2,0,0,0,0,0|2,0,0]=4 152 B9R1.1 CCC1=CC=C(S)C=C1 S243 [2,0,0,0,0,0|1,0,0]=3 153 B9R1.1 CCC1=CNC(=O)C=C1 7602AB [2,0,0,0,0,0|2,0,0]=4 154 B9R1.1 CNC1=CC=C(Br)C=C1 V7923 [2,0,0,0,0,0|2,0,0]=4 155 B9R1.1 CNC1=CC=C(Cl)C=C1 V5059 [2,0,0,0,0,0|2,0,0]=4 156 B9R1.1 CNC1=CC=C(N)C=C1 F921 [2,0,0,0,0,0|2,0,0]=4 157 B9R1.1 CSC1=CC=C(S)C=C1 U208 [2,0,0,0,0,0|2,0,0]=4 158 B9R1.1 C[N+]1=CC=C(CO)C=C1 7356AE [2,0,0,0,0,0|2,0,0]=4 159 B9R1.6 CC(Cl)C1=CC=CC=C1 U237 [2,0,0,0,0,0|1,0,0]=3 160 B9R1.6 CN(C)C1=CC=NC=C1 6487AL [2,0,0,0,0,0|2,0,0]=4 161 B9R1.6 CN(C)C1=NC=CC=C1 8318AB [2,0,0,0,0,0|2,0,0]=4 162 B9R1.6 CP(C)C1=CC=CC=C1 7271AL [2,0,0,0,0,0|1,0,0]=3 163 B9R1.6 C[C@@H](N)C1=CC=CC=N1 6298AA [2,0,0,0,0,0|2,0,0]=4 164 B9R1.6 C[C@@H](N)C1=CC=CN=C1 8353AH [2,0,0,0,0,0|2,0,0]=4 165 B9R1.6 C[C@H](N)C1=CC=NC=C1 4830AJ [2,0,0,0,0,0|2,0,0]=4 166 B9R1.2 CCC1=CC(F)=CC=C1 0760AC [2,0,0,0,0,0|1,0,0]=3 167 B9R1.2 CCC1=CC(N)=CC=N1 5543AJ [2,0,0,0,0,0|2,0,0]=4 168 B9R1.2 CCC1=CC=NC(Cl)=C1 5411AB [2,0,0,0,0,0|2,0,0]=4 169 B9R1.2 CCC1=NC(C)=CC=C1 2156AA [2,0,0,0,0,0|2,0,0]=4 170 B9R1.2 CSC1=CC=CC(O)=C1 1026AE [2,0,0,0,0,0|1,0,0]=3 171 B9R1.2 OC1=CC=CC(CBr)=C1 Y9989 [2,0,0,0,0,0|1,0,0]=3 172 B9R1.2 OCC1=CC(S)=CC=C1 0333AF [2,0,0,0,0,0|1,1,0]=4 173 B9R1.69 CC1=C(F)C=C(F)C=C1 X4510 [2,0,0,0,0,0|2,0,0]=4 174 B9R1.69 CC1=CC(N)=C(N)C=C1 1704AA [2,0,0,0,0,0|2,0,0]=4 175 B9R1.69 CC1=CC=C(C)C(N)=C1 7917AF [2,0,0,0,0,0|1,0,0]=3 176 B9R1.69 CC1=CC=C(C)C(S)=C1 L103 [2,0,0,0,0,0|0,1,0]=3 177 B9R1.69 CC1=CC=C(N)C(C)=C1 5318AL [2,0,0,0,0,0|2,0,0]=4 178 B9R1.69 CC1=CC=C(N)C(O)=N1 Z8999 [2,0,0,0,0,0|2,0,0]=4 179 B9R1.69 CC1=CC=C(O)C=C1I Z0737 [2,0,0,0,0,0|2,0,0]=4 180 B9R1.69 CC1=CC=C(S)C=C1F 7321AE [2,0,0,0,0,0|2,0,0]=4 181 B9R1.69 CC1=CN=C(F)C(O)=C1 Y3761 [2,0,0,0,0,0|2,0,0]=4 182 B9R1.69 NC1=CC=C(F)C(O)=C1 0161AA [2,0,0,0,0,0|2,0,0]=4 183 B9R1.69 OC1=CC(F)=CC=C1I 3213AJ [2,0,0,0,0,0|2,0,0]=4 184 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 9483AH [1,1,0,0,0,0|1,0,1]=4 185 B11R1.3 CCC1=CC=C(C(C)N)C=C1 4489AD [1,1,0,0,0,0|1,0,0]=3 186 B11R1.3 CCC1=CC=C([C@H](C)N)C=C1 0840AB [1,1,0,0,0,0|1,0,0]=3 187 B11R1.3 CN(C)C1=NC=C(CN)C=C1 V5451 [1,1,0,0,0,0|2,0,0]=4 188 B11R1.3 COC1=CC=C(C(C)N)C=C1 4964AJ [1,1,0,0,0,0|1,0,0]=3 189 B11R1.3 C[C@@H](N)C1=CC=C(C#N)C=C1 W4398 [1,1,0,0,0,0|1,0,1]=4 190 B11R1.3 [C@@H](C)(N)C1=CC=C(C#N)C=C1 0683AP [1,1,0,0,0,0|1,0,1]=4 191 B11R1.19 CC(C)(C)C1=CC=C(Br)N=C1 1609AJ [1,1,0,0,0,0|2,0,0]=4 192 B11R1.19 CC(C)(C)C1=CC=C(F)C=C1 V7377 [1,1,0,0,0,0|1,0,0]=3 193 B11R1.19 CC(C)(C)C1=CC=[N+]([O-])C=C1 7969AD [1,1,0,0,0,0|2,0,0]=4 194 B11R1.19 CC(C)(N)C1=CC=C(Br)C=C1 5952AD [1,1,0,0,0,0|1,0,0]=3 195 B11R1.19 CC(C)(O)C1=CC=C(F)C=C1 V5764 [1,1,0,0,0,0|1,0,0]=3 196 B11R1.19 CC(C)(O)C1=NC=C(Br)C=C1 W5164 [1,1,0,0,0,0|2,0,0]=4 197 B11R1.19 CC(C)(O)C1=NC=C(Cl)C=C1 5454AB [1,1,0,0,0,0|2,0,0]=4 198 B11R1.19 CC(F)(F)C1=CC=C(Br)C=C1 0092AA [1,1,0,0,0,0|2,0,0]=4 199 B11R1.19 C[Si](C)(C)C1=CC=C(F)C=C1 1626AL [1,1,0,0,0,0|1,1,0]=4 200 B11R1.22 CC(C#N)C1=CC=C(N)C=C1 2826AB [1,1,0,0,0,0|1,0,1]=4 201 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 7936AB [1,1,0,0,0,0|1,0,1]=4 202 B11R1.22 CC1=CC=C(C(O)CN)C=C1 7582AB [1,1,0,0,0,0|1,0,0]=3 203 B11R1.22 CC1=CC=C(C(O)CN)C=C1 9378AJ [1,1,0,0,0,0|1,0,0]=3 204 B11R1.22 CC1=CC=C(N(C)C=O)C=C1 8372AL [1,1,0,0,0,0|1,0,1]=4 205 B11R1.22 CCC(N)C1=CC=C(Br)C=C1 1643AC [1,1,0,0,0,0|2,0,0]=4 206 B11R1.22 CCC(N)C1=CC=C(C)C=C1 5656AD [1,1,0,0,0,0|1,0,0]=3 207 B11R1.22 CCC(N)C1=CC=C(F)C=C1 8597AC [1,1,0,0,0,0|2,0,0]=4 208 B11R1.22 CCC(N)C1=CC=C(F)C=C1 9157AE [1,1,0,0,0,0|2,0,0]=4 209 B11R1.22 CCC(O)C1=CC=C(Br)C=C1 1423AL [1,1,0,0,0,0|2,0,0]=4 210 B11R1.22 CCN(N)C1=CC=C(C)C=C1 4836AL [1,1,0,0,0,0|2,0,0]=4 211 B11R1.22 CC[C@@H](N)C1=CC=C(C)C=C1 1684AB [1,1,0,0,0,0|1,0,0]=3 212 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 Y6691 [1,1,0,0,0,0|2,0,0]=4 213 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 X9085 [1,1,0,0,0,0|2,0,0]=4 214 B11R1.22 CNC(C)C1=CC=C(F)C=C1 5899AE [1,1,0,0,0,0|1,0,0]=3 215 B11R1.22 COC(C)C1=CC=C(Br)C=C1 6457AE [1,1,0,0,0,0|1,0,0]=3 216 B11R1.22 ClC1=CC=C(C(Br)CBr)C=C1 0999AQ [1,1,0,0,0,0|2,0,0]=4 217 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 9601AB [1,1,0,0,0,0|2,0,0]=4 218 B11R1.22 NCC(O)C1=CC=C(F)C=C1 3928AE [1,1,0,0,0,0|2,0,0]=4 219 B11R1.22 NCC(O)C1=CC=C(F)C=C1 5412AB [1,1,0,0,0,0|2,0,0]=4 220 B11R1.22 OCC(Cl)C1=CC=C(Cl)C=C1 2030AL [1,1,0,0,0,0|2,0,0]=4 221 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 5554AC [1,1,0,0,0,0|2,0,0]=4 222 B11R1.22 OC[C@H](O)C1=CC=C(Cl)C=C1 X3150 [1,1,0,0,0,0|2,0,0]=4 223 B11R1.166 CC(=O)C1=C(Br)C=C(C)C=C1 1378AL [1,1,0,0,0,0|1,0,1]=4 224 B11R1.166 CC1=C(N(C)C)C=CC(N)=C1 9005AD [1,1,0,0,0,0|2,0,0]=4 225 B11R1.166 CC1=CC(Br)=CC=C1N(C)C V6277 [1,1,0,0,0,0|2,0,0]=4 226 B11R1.166 CC1=CC(N)=C(N(C)C)C=C1 6144AD [1,1,0,0,0,0|1,0,0]=3 227 B11R1.166 CC1=NC(Cl)=C(C(C)C)C=N1 7391AC [1,1,0,0,0,0|2,0,0]=4 228 B11R1.166 CN(C)C1=C(F)C=C(N)C=C1 2086AE [1,1,0,0,0,0|2,0,0]=4 229 B11R1.166 CN(C)C1=C(N)C=C(F)C=C1 6145AD [1,1,0,0,0,0|2,0,0]=4 230 B11R1.166 CN(C)C1=CC=C(N)C=C1Cl 6600AE [1,1,0,0,0,0|2,0,0]=4 231 B11R1.166 C[C@@H](N)C1=C(Cl)C=C(Cl)C=C1 1178AL [1,1,0,0,0,0|2,0,0]=4 232 B11R1.166 C[C@@H](N)C1=C(F)C=C(F)C=C1 2379AC [1,1,0,0,0,0|2,0,0]=4 233 B11R1.166 C[C@H](N)C1=CC=C(F)C=C1F W8708 [1,1,0,0,0,0|2,0,0]=4 234 B11R1.166 C[C@H](N)C1=CC=C(F)C=C1F W8720 [1,1,0,0,0,0|2,0,0]=4 235 B11R1.23 CC(CO)C1=CC=CC(=O)C1 W6317 [1,1,0,0,0,0|0,0,2]=4 236 B11R1.23 CC1=CC=CC(C(O)CN)=C1 7583AB [1,1,0,0,0,0|2,0,0]=4 237 B11R1.23 CCC(N)C1=CC(Cl)=CC=C1 2535AE [1,1,0,0,0,0|2,0,0]=4 238 B11R1.23 CCC(N)C1=CC(N)=CC=C1 1913AJ [1,1,0,0,0,0|2,0,0]=4 239 B11R1.23 CC[C@@H](N)C1=CC=CC(F)=C1 X9176 [1,1,0,0,0,0|2,0,0]=4 240 B11R1.23 CC[C@H](N)C1=CC=CC(Cl)=C1 9082AH [1,1,0,0,0,0|2,0,0]=4 241 B11R1.23 CNC(=O)C1=CC=CC(O)=C1 2288AJ [1,1,0,0,0,0|1,0,1]=4 242 B11R1.23 NC(CO)C1=CC(Cl)=CC=C1 3155AH [1,1,0,0,0,0|2,0,0]=4 243 B11R1.23 NCC(O)C1=CC(Cl)=CC=C1 2712AC [1,1,0,0,0,0|2,0,0]=4 244 B11R1.23 NCC(O)C1=CC(F)=CC=C1 5405AB [1,1,0,0,0,0|2,0,0]=4 245 B11R1.23 N[C@@H](CO)C1=CC(Cl)=CC=C1 N836 [1,1,0,0,0,0|2,0,0]=4 246 B11R1.23 OCC(Cl)C1=CC=CC(Cl)=C1 2029AL [1,1,0,0,0,0|2,0,0]=4 247 B11R1.23 OC[C@H](O)C1=CC=CC(Cl)=C1 X3148 [1,1,0,0,0,0|2,0,0]=4 248 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 6985AA [1,1,0,0,0,0|2,0,0]=4 249 B11R1.74 CC1=NC(O)=CC(C(C)C)=N1 0894AE [1,1,0,0,0,0|2,0,0]=4 250 B11R1.74 C[C@H](N)C1=CC(F)=CC(F)=C1 W6333 [1,1,0,0,0,0|2,0,0]=4 251 B11R1.155 CC(C)(C)C1=CC(=O)C=CO1 1594AC [1,1,0,0,0,0|1,0,1]=4 252 B11R1.155 CC(C)(C)C1=NC=CC(Br)=C1 1718AA [1,1,0,0,0,0|2,0,0]=4 253 B11R1.155 CC(C)(C)C1=NC=CC(N)=C1 V5730 [1,1,0,0,0,0|2,0,0]=4 254 B11R1.155 CC(C)(O)C1=CC=CC(F)=C1 V5757 [1,1,0,0,0,0|1,0,0]=3 255 B11R1.155 CC1=CC=CC(C(C)(C)C)=C1 6162AL [1,1,0,0,0,0|1,0,0]=3 256 B11R1.155 CS(=O)(=O)C1=CC(O)=CC=C1 2313AJ [1,1,0,0,0,0|2,0,0]=4 257 B11R1.159 CC(=O)C1=CC=CC(O)=C1F Z8077 [1,1,0,0,0,0|1,0,1]=4 258 B11R1.159 CC(C)C1=CC=CC(O)=C1O 0871AB [1,1,0,0,0,0|0,0,0]=2 259 B11R1.159 CC(O)C1=C(F)C(Br)=CC=C1 4219AA [1,1,0,0,0,0|2,0,0]=4 260 B11R1.159 CC(O)C1=CC=CC(F)=C1F 4879AJ [1,1,0,0,0,0|2,0,0]=4 261 B11R1.167 CC(C)C1=C(I)C=CC(O)=C1 0454AA [1,1,0,0,0,0|0,0,0]=2 262 B11R1.167 CC(C)C1=CC(Br)=CC=C1O Z0453 [1,1,0,0,0,0|1,0,0]=3 263 B11R1.167 CC(N)C1=C(Cl)C=CC(Cl)=C1 9385AH [1,1,0,0,0,0|2,0,0]=4 264 B11R1.167 CC1=C(N(C)C)C=C(N)C=C1 9814AB [1,1,0,0,0,0|2,0,0]=4 265 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(Cl)=C1 8392AH [1,1,0,0,0,0|2,0,0]=4 266 B11R1.266 CC(C)C1=CC=CC(NN)=C1 2311AJ [1,1,0,0,0,0|1,0,0]=3 267 B11R1.266 CC(C)C1=CC=CC(NN)=C1 8650AH [1,1,0,0,0,0|1,0,0]=3 268 B11R1.266 CN(C)C1=NC(CO)=CC=C1 0979AB [1,1,0,0,0,0|2,0,0]=4 269 B11R1.266 COC1=CC=CC(C(C)C)=N1 Z0625 [1,1,0,0,0,0|1,0,0]=3 270 B11R1.266 C[C@@H](N)C1=CC(C#N)=CC=C1 X9714 [1,1,0,0,0,0|2,0,0]=4 271 B11R1.266 C[C@@H](N)C1=CC(C#N)=CC=C1 X9730 [1,1,0,0,0,0|2,0,0]=4 272 B11R1.192 C=CCC1=CC=C(O)C(O)=C1 W2121 [1,1,0,0,0,0|1,0,1]=4 273 B11R1.192 CCNC1=CC(C)=C(C)C=C1 8938AD [1,1,0,0,0,0|1,0,0]=3 274 B11R1.192 CCNC1=CC(F)=C(F)C=C1 3983AD [1,1,0,0,0,0|2,0,0]=4 275 B11R1.192 CCOC1=CC(C)=C(N)C=C1 9507AC [1,1,0,0,0,0|2,0,0]=4 276 B11R1.192 CCOC1=CC(F)=C(N)C=C1 6418AB [1,1,0,0,0,0|2,0,0]=4 277 B11R1.192 CCOC1=CC=C(N)C(F)=C1 V5603 [1,1,0,0,0,0|2,0,0]=4 278 B11R1.192 CCOC1=CC=C(N)C(N)=C1 X9397 [1,1,0,0,0,0|2,0,0]=4 279 B11R1.192 FC1=C(Cl)C=C(CCBr)C=C1 4994AA [1,1,0,0,0,0|2,0,0]=4 280 B11R1.192 NCCC1=CC=C(F)C(F)=C1 1164AB [1,1,0,0,0,0|2,0,0]=4 281 B11R1.192 OCCC1=CC=C(F)C(F)=C1 X7944 [1,1,0,0,0,0|2,0,0]=4 282 B11R1.277 CC1=C(O)C=C(C=O)C(Br)=C1 8418AB [1,1,0,0,0,0|1,0,1]=4 283 B11R1.278 COC1=C(Cl)C(O)=C(Br)C=C1 Z8693 [1,1,0,0,0,0|2,0,0]=4 284 B11R1.278 COC1=C(Cl)C(O)=C(F)C=C1 Z6402 [1,1,0,0,0,0|2,0,0]=4 285 B11R1.279 CCC1=CC=C(OC)C(Br)=C1 V9924 [1,1,0,0,0,0|1,0,0]=3 286 B11R1.279 CCC1=CC=C(OC)C=C1O 2074AL [1,1,0,0,0,0|1,0,0]=3 287 B11R1.279 COC1=C(Br)C=C(CN)C=C1 4741AJ [1,1,0,0,0,0|2,0,0]=4 288 B11R1.279 COC1=C(I)C=C(CO)C=C1 4275AH [1,1,0,0,0,0|2,0,0]=4 289 B11R1.279 COC1=C(N)C=C(CO)C=C1 2341AA [1,1,0,0,0,0|2,0,0]=4 290 B11R1.279 COC1=CC(Cl)=C(CO)C=C1 8489AH [1,1,0,0,0,0|2,0,0]=4 291 B11R1.279 COC1=CC=C(CBr)C(Cl)=C1 7963AB [1,1,0,0,0,0|2,0,0]=4 292 B11R1.279 COC1=CC=C(CCl)C=C1F 1271AE [1,1,0,0,0,0|2,0,0]=4 293 B11R1.279 COC1=CC=C(CN)C(F)=C1 5987AC [1,1,0,0,0,0|2,0,0]=4 294 B11R1.279 COC1=CC=C(CN)C=C1F 1411AL [1,1,0,0,0,0|2,0,0]=4 295 B11R1.280 CCC1=CC(C=O)=C(O)C=C1 7392AB [1,1,0,0,0,0|1,0,1]=4 296 B11R1.280 COC1=CC(CO)=CC=C1Br Z0261 [1,1,0,0,0,0|2,0,0]=4 297 B11R1.280 COC1=CC(OC)=C(S)C=C1 6358AD [1,1,0,0,0,0|2,0,0]=4 298 B11R1.280 COC1=CC=C(Cl)C(CO)=C1 0359AA [1,1,0,0,0,0|2,0,0]=4 299 B13R1.35 CC(C)OC1=CC=C(C=O)C(Cl)=C1 Z0024 [0,1,0,0,0,1|1,0,1]=4 300 B13R1.52 CC1=CC=C(OC(C)C)C=C1C=O Z0029 [0,1,0,0,0,1|0,0,1]=3 301 B13R1.510 CC1=C(C)C=C(C(=O)C(C)Br)C=C1 7560AE [0,1,0,0,0,1|2,0,0]=4 302 B13R1.876 CC(C)OC1=C(Br)C=C(N)C(N)=C1 V2690 [0,1,0,0,0,1|2,0,0]=4 303 B13R1.876 CC(C)OC1=CC(F)=C(F)C=C1Br Z1249 [0,1,0,0,0,1|2,0,0]=4 304 B13R1.2879 CC1=C(C)C=C(OC(C)CN)C=C1 8125AC [0,1,0,0,0,1|1,0,0]=3 305 B13R1.3763 CC1=CC(OC(C)C)=CC(C)=C1Br Z1078 [0,1,0,0,0,1|2,0,0]=4 306 B13R1.50 CC1=CC=C(C(F)(F)F)C=C1CO 8698AD [0,2,0,0,0,0|2,0,0]=4 307 B13R1.272 CC(C)(C#N)C1=CC=C(F)C(F)=C1 Z6670 [0,2,0,0,0,0|2,0,0]=4 308 B13R1.272 CC(C)(CN)C1=CC=C(Cl)C(Cl)=C1 V3471 [0,2,0,0,0,0|2,0,0]=4 309 B13R1.272 CCC(C)(C)C1=CC(Br)=C(O)C=C1 6384AD [0,2,0,0,0,0|2,0,0]=4 310 B13R1.272 CCC(C)(C)C1=CC=C(O)C(N)=C1 X4641 [0,2,0,0,0,0|2,0,0]=4 311 B13R1.877 CC1=CC(O)=C(C(C)(C)C)C=C1Cl 3056AL [0,2,0,0,0,0|1,0,0]=3 312 B13R1.7922 CC1=CC(C(C)(C)C)=CC(C)=C1N 5790AB [0,2,0,0,0,0|2,0,0]=4 313 B13R1.7922 CC1=CC(C(C)(C)C)=CC(O)=C1O 5883AF [0,2,0,0,0,0|1,0,0]=3 314 B13R1.144 CCOC1=C(F)C=C(C(C)N)C=C1 7138AE [0,2,0,0,0,0|2,0,0]=4 315 B13R1.3091 COC1=C(OC)C=C(C(C)O)C=C1 4922AJ [0,2,0,0,0,0|1,0,0]=3 316 B13R1.3380 COC1=C(Br)C=C(C(C)C)C=C1Br Z1090 [0,2,0,0,0,0|1,0,0]=3 317 B13R1.13 CC(=O)C1=CC(C(C)C)=CC=C1O 8301AA [0,2,0,0,0,0|1,0,1]=4 318 B13R1.13 CC(C)C1=CC(B(O)O)=C(F)C=C1 X1889 [0,2,0,0,0,0|1,0,0]=3 319 B13R1.13 CC(C)C1=CC(C(=O)O)=C(O)C=C1 5567AJ [0,2,0,0,0,0|1,0,0]=3 320 B13R1.466 CNCC(O)C1=CC=C(O)C(O)=C1 X0382 [0,2,0,0,0,0|2,0,0]=4 321 B11R1.53 CC(C)C1=CC=CC=C1CO 0808AB [0,0,1,1,0,0|0,0,2]=4 322 B11R2.34 BrC1=CC=C(C2CC2)N=C1 8560AB [1,0,0,1,0,0|2,0,0]=4 323 B11R2.34 BrC1=CC=C(C2CO2)C=C1 1753AL [1,0,0,1,0,0|2,0,0]=4 324 B11R2.34 ClC1=CC=C(C2CO2)C=C1 0625AQ [1,0,0,1,0,0|2,0,0]=4 325 B11R2.34 ClC1=NC=C(C2CC2)C=C1 Y3582 [1,0,0,1,0,0|2,0,0]=4 326 B11R2.34 FC1=CC=C(C2CO2)C=C1 0449AQ [1,0,0,1,0,0|2,0,0]=4 327 B11R2.35 BrC1=CC(C2CC2)=CN=C1 Y3583 [1,0,0,1,0,0|2,0,0]=4 328 B11R2.35 BrC1=CC(C2CC2)=NC=C1 1717AA [1,0,0,1,0,0|2,0,0]=4 329 B11R2.35 ClC1=CC([C@@H]2CO2)=CC=C1 I069 [1,0,0,1,0,0|2,0,0]=4 330 B13R2.1057 NC1(C2=CC=C(Cl)C(Cl)=C2)CC1 9420AH [0,1,0,1,0,0|2,0,0]=4 331 B13R2.430 CC(C)C1=CC2=C(C=CN2)C=C1 0928AQ [0,1,0,1,0,0|1,0,1]=4 332 B13R2.430 CC(N)C1=CC=C2OCOC2=C1 1241AD [0,1,0,1,0,0|1,0,0]=3 333 B13R2.430 C[C@@H](N)C1=CC2=C(C=C1)OCO2 8347AH [0,1,0,1,0,0|1,0,0]=3 334 B13R2.430 C[C@H](N)C1=CC2=C(C=C1)OCO2 8391AH [0,1,0,1,0,0|1,0,0]=3 335 B9R1.35 CC1=CNC(C(C)C)=N1 1747AJ [1,0,0,0,1,0|2,0,0]=4 336 B9R1.35 CC1=NNC(C(C)C)=C1 3767AD [1,0,0,0,1,0|2,0,0]=4 337 B11R1.20 CC(C)NC1=CC=C(Cl)C=C1 V3609 [1,0,0,0,0,1|1,0,0]=3 338 B11R1.20 CC(C)OC1=CC=C(F)C=C1 Z0614 [1,0,0,0,0,1|1,0,0]=3 339 B11R1.20 CC(C)OC1=NC=C(Cl)C=C1 Z0473 [1,0,0,0,0,1|2,0,0]=4 340 B11R1.20 CC(C)OC1=NC=C(F)C=C1 Z9507 [1,0,0,0,0,1|2,0,0]=4 341 B11R1.20 CC(C)OC1=NC=C(I)C=C1 Z1054 [1,0,0,0,0,1|2,0,0]=4 342 B11R1.20 CC1=CC=C(\C=[N+](\C)[O-])C=C1 5147AD [1,0,0,0,0,1|2,0,0]=4 343 B11R1.157 CC(C)NC1=NC(Br)=CC=C1 V8760 [1,0,0,0,0,1|2,0,0]=4 344 B11R1.157 CC(C)OC1=CC=CC(Br)=N1 V6058 [1,0,0,0,0,1|2,0,0]=4