0 B9R1.1 BrCC1=CN=C(Br)C=N1 88780 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.1 BrCC1=NC=C(Br)C=C1 28859 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.1 C#CC1=CC=C(I)C=C1 F21257 [0,0,0,0,0,0|2,0,2]=4 3 B9R1.1 C#CC1=CN=C(Br)C=C1 68603 [0,0,0,0,0,0|1,0,2]=3 4 B9R1.1 C#CC1=CN=C(Cl)C=C1 83979 [0,0,0,0,0,0|1,0,2]=3 5 B9R1.1 C#CC1=CN=C(N)N=C1 P11652 [0,0,0,0,0,0|2,0,2]=4 6 B9R1.1 C#CC1=CN=C(O)C=C1 O11429 [0,0,0,0,0,0|1,0,2]=3 7 B9R1.1 C#CC1=NC=C(C)N=C1 79090 [0,0,0,0,0,0|1,0,2]=3 8 B9R1.1 C=CC1=CN=C(Cl)C=C1 F13416 [0,0,0,0,0,0|1,0,2]=3 9 B9R1.1 CC1=CC=C(CN)N=N1 P14549 [0,0,0,0,0,0|2,0,0]=2 10 B9R1.1 CC1=CN=C(C=O)C=N1 36020 [0,0,0,0,0,0|2,0,1]=3 11 B9R1.1 CC1=CN=C(CCl)C=C1 A10650 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.1 CC1=CN=C(CCl)C=C1 C16351 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.1 CC1=CN=C(CCl)C=N1 38701 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.1 CC1=CN=C(CCl)N=C1 27405 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.1 CC1=CN=C(CN)C=N1 P17860 [0,0,0,0,0,0|2,0,0]=2 16 B9R1.1 CC1=CN=C(CN)N=C1 38455 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.1 CC1=CN=C(CN)N=C1 72570 [0,0,0,0,0,0|4,0,0]=4 18 B9R1.1 CC1=CN=C(CN)N=C1 W10072 [0,0,0,0,0,0|4,0,0]=4 19 B9R1.1 CC1=CN=C(CO)C=N1 26144 [0,0,0,0,0,0|2,0,0]=2 20 B9R1.1 CC1=CN=C(CO)N=C1 38636 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.1 CC1=CN=C(NN)C=C1 BL010291 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.1 CC1=NC=C(C#N)C=N1 81926 [0,0,0,0,0,0|2,0,1]=3 23 B9R1.1 CC1=NC=C(CBr)C=N1 C76568 [0,0,0,0,0,0|2,0,0]=2 24 B9R1.1 CC1=NC=C(CCl)C=C1 CL0057 [0,0,0,0,0,0|1,0,0]=1 25 B9R1.1 CC1=NC=C(CCl)C=N1 P16099 [0,0,0,0,0,0|2,0,0]=2 26 B9R1.1 CC1=NC=C(CN)C=C1 72232 [0,0,0,0,0,0|1,0,0]=1 27 B9R1.1 CC1=NC=C(CN)C=N1 81411 [0,0,0,0,0,0|2,0,0]=2 28 B9R1.1 CC1=NN=C(C#N)C=C1 37499 [0,0,0,0,0,0|2,0,1]=3 29 B9R1.1 CC1=NN=C(CO)C=C1 P10568 [0,0,0,0,0,0|2,0,0]=2 30 B9R1.1 CCC1=CN=C(Br)C=C1 CS1557 [0,0,0,0,0,0|1,0,0]=1 31 B9R1.1 CCC1=CN=C(Cl)C=C1 72594 [0,0,0,0,0,0|1,0,0]=1 32 B9R1.1 CCC1=CN=C(N)C=N1 27455 [0,0,0,0,0,0|2,0,0]=2 33 B9R1.1 CCC1=CN=C(O)C=C1 25325 [0,0,0,0,0,0|1,0,0]=1 34 B9R1.1 CCC1=NC=C(Br)C=C1 26547 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.1 CCC1=NC=C(Br)C=N1 27600 [0,0,0,0,0,0|4,0,0]=4 36 B9R1.1 CCC1=NC=C(Cl)C=C1 C71513 [0,0,0,0,0,0|3,0,0]=3 37 B9R1.1 CCC1=NC=C(N)C=C1 C72111 [0,0,0,0,0,0|3,0,0]=3 38 B9R1.1 CCC1=NC=C(N)C=N1 81903 [0,0,0,0,0,0|4,0,0]=4 39 B9R1.1 CCC1=NN=C(Cl)C=C1 59639 [0,0,0,0,0,0|2,0,0]=2 40 B9R1.1 CCC1=NNC(=O)C=C1 65671 [0,0,0,0,0,0|2,0,1]=3 41 B9R1.1 CNC1=CC=C(O)C=C1 D77985 [0,0,0,0,0,0|3,0,0]=3 42 B9R1.1 CNC1=CN=C(Br)C=C1 D86940 [0,0,0,0,0,0|2,0,0]=2 43 B9R1.1 CNC1=CN=C(C)C=C1 D83365 [0,0,0,0,0,0|1,0,0]=1 44 B9R1.1 CNC1=NC=C(C)N=C1 AC2495 [0,0,0,0,0,0|2,0,0]=2 45 B9R1.1 CNC1=NC=C(N)C=C1 C74450 [0,0,0,0,0,0|4,0,0]=4 46 B9R1.1 CNC1=NN=C(Br)C=C1 C10836 [0,0,0,0,0,0|3,0,0]=3 47 B9R1.1 COC1=CN=C(F)C=C1 98092 [0,0,0,0,0,0|2,0,0]=2 48 B9R1.1 COC1=CN=C(N)N=C1 11206 [0,0,0,0,0,0|3,0,0]=3 49 B9R1.1 COC1=NC=C(N)N=C1 24331 [0,0,0,0,0,0|3,0,0]=3 50 B9R1.1 COC1=NN=C(I)C=C1 C15088 [0,0,0,0,0,0|3,0,0]=3 51 B9R1.1 CSC1=CN=C(Cl)N=C1 W16220 [0,0,0,0,0,0|3,0,0]=3 52 B9R1.1 C[N+]1=CC=C(C=O)C=C1 D95156 [0,0,0,0,0,0|3,0,1]=4 53 B9R1.1 ClCC1=CC=C(I)C=C1 AB8901 [0,0,0,0,0,0|3,0,0]=3 54 B9R1.1 ClCC1=CN=C(Br)C=C1 C71417 [0,0,0,0,0,0|2,0,0]=2 55 B9R1.1 ClCC1=CN=C(Br)C=C1 C73235 [0,0,0,0,0,0|2,0,0]=2 56 B9R1.1 ClCC1=CN=C(Cl)N=C1 BL010347 [0,0,0,0,0,0|3,0,0]=3 57 B9R1.1 ClCC1=NC=C(Br)C=C1 12269 [0,0,0,0,0,0|4,0,0]=4 58 B9R1.1 ClCC1=NC=C(Br)C=C1 C77222 [0,0,0,0,0,0|4,0,0]=4 59 B9R1.1 ClCC1=NN=C(Cl)C=C1 C72652 [0,0,0,0,0,0|3,0,0]=3 60 B9R1.1 ClCC1=NN=C(Cl)C=C1 P10986 [0,0,0,0,0,0|3,0,0]=3 61 B9R1.1 FCC1=CC=C(Br)C=C1 W10394 [0,0,0,0,0,0|3,0,0]=3 62 B9R1.1 N#CC1=CC=C(S)C=C1 F31167 [0,0,0,0,0,0|3,0,1]=4 63 B9R1.1 N#CC1=CN=C(Br)N=C1 77933 [0,0,0,0,0,0|3,0,1]=4 64 B9R1.1 N#CC1=CN=C(O)N=C1 AC4723 [0,0,0,0,0,0|3,0,1]=4 65 B9R1.1 N#CC1=NN=C(F)C=C1 38075 [0,0,0,0,0,0|3,0,1]=4 66 B9R1.1 N#CC1=NN=C(N)C=C1 37344 [0,0,0,0,0,0|3,0,1]=4 67 B9R1.1 NC1=CN=C(C=O)C=N1 F31178 [0,0,0,0,0,0|3,0,1]=4 68 B9R1.1 NC1=NC=C(CCl)C=N1 AC2011 [0,0,0,0,0,0|3,0,0]=3 69 B9R1.1 NCC1=CC=C(O)C=C1 AC1832 [0,0,0,0,0,0|3,0,0]=3 70 B9R1.1 NCC1=CN=C(Br)C=C1 68600 [0,0,0,0,0,0|2,0,0]=2 71 B9R1.1 NCC1=CN=C(Cl)C=N1 24129 [0,0,0,0,0,0|3,0,0]=3 72 B9R1.1 NCC1=CN=C(Cl)C=N1 W13762 [0,0,0,0,0,0|3,0,0]=3 73 B9R1.1 NCC1=CN=C(N)C=C1 F13784 [0,0,0,0,0,0|2,0,0]=2 74 B9R1.1 NCC1=CN=C(N)C=C1 P19117 [0,0,0,0,0,0|2,0,0]=2 75 B9R1.1 NCC1=CN=C(N)N=C1 82158 [0,0,0,0,0,0|3,0,0]=3 76 B9R1.1 NCC1=NC=C(Br)C=C1 32062 [0,0,0,0,0,0|4,0,0]=4 77 B9R1.1 NCC1=NC=C(Cl)C=C1 W13681 [0,0,0,0,0,0|4,0,0]=4 78 B9R1.1 NCC1=NC=C(F)C=C1 70856 [0,0,0,0,0,0|4,0,0]=4 79 B9R1.1 NCC1=NC=C(N)C=C1 O11499 [0,0,0,0,0,0|4,0,0]=4 80 B9R1.1 NCC1=NC=C(N)C=C1 W11510 [0,0,0,0,0,0|4,0,0]=4 81 B9R1.1 NCC1=NC=C(O)C=C1 24338 [0,0,0,0,0,0|4,0,0]=4 82 B9R1.1 NCC1=NN=C(Cl)C=C1 C76852 [0,0,0,0,0,0|3,0,0]=3 83 B9R1.1 NNC1=CN=C(Cl)C=C1 H10944 [0,0,0,0,0,0|3,0,0]=3 84 B9R1.1 NNC1=CN=C(Cl)C=N1 BL010279 [0,0,0,0,0,0|4,0,0]=4 85 B9R1.1 NNC1=CN=C(F)C=C1 73802 [0,0,0,0,0,0|3,0,0]=3 86 B9R1.1 N\N=C1\C=CC(Br)=NN1 A10641 [0,0,0,0,0,0|4,0,0]=4 87 B9R1.1 O=CC1=CN=C(O)N=C1 86751 [0,0,0,0,0,0|3,0,1]=4 88 B9R1.1 O=CC1=NN=C(Br)C=C1 P20764 [0,0,0,0,0,0|3,0,1]=4 89 B9R1.1 O=CC1=NN=C(Cl)C=C1 25514 [0,0,0,0,0,0|3,0,1]=4 90 B9R1.1 O=CC1=NN=C(O)C=C1 C77199 [0,0,0,0,0,0|3,0,1]=4 91 B9R1.1 OCC1=CC=C(S)C=C1 Y11017 [0,0,0,0,0,0|3,0,0]=3 92 B9R1.1 OCC1=CN=C(Cl)N=C1 BL010346 [0,0,0,0,0,0|3,0,0]=3 93 B9R1.1 OCC1=NN=C(Cl)C=C1 P11311 [0,0,0,0,0,0|3,0,0]=3 94 B8R1.2 BrCC1=CN=CN=C1 O11299 [1,0,0,0,0,0|2,0,0]=3 95 B8R1.2 BrCC1=NC=CN=C1 31757 [1,0,0,0,0,0|2,0,0]=3 96 B8R1.2 BrCC1=NN=CC=C1 27114 [1,0,0,0,0,0|2,0,0]=3 97 B8R1.2 C#CC1=CN=CN=C1 25642 [1,0,0,0,0,0|1,0,2]=4 98 B8R1.2 C#CC1=NC=CN=C1 P11646 [1,0,0,0,0,0|1,0,2]=4 99 B8R1.2 CCC1=NC=NC=C1 F17281 [1,0,0,0,0,0|3,0,0]=4 100 B8R1.2 CNC1=CN=CN=C1 Y10181 [1,0,0,0,0,0|2,0,0]=3 101 B8R1.2 CNC1=CN=NC=C1 A10648 [1,0,0,0,0,0|2,0,0]=3 102 B8R1.2 ClCC1=NC=CN=C1 37060 [1,0,0,0,0,0|2,0,0]=3 103 B8R1.2 ClCC1=NN=CC=C1 37063 [1,0,0,0,0,0|2,0,0]=3 104 B8R1.2 N#CC1=CN=NC=C1 37055 [1,0,0,0,0,0|2,0,1]=4 105 B8R1.2 N#CC1=NN=CC=C1 82702 [1,0,0,0,0,0|2,0,1]=4 106 B8R1.2 NCC1=CC=CC=C1 RB3068 [1,0,0,0,0,0|2,0,0]=3 107 B8R1.2 NCC1=CC=CN=N1 36976 [1,0,0,0,0,0|2,0,0]=3 108 B8R1.2 NCC1=CC=CN=N1 AT13034 [1,0,0,0,0,0|2,0,0]=3 109 B8R1.2 NCC1=CC=CN=N1 P15536 [1,0,0,0,0,0|2,0,0]=3 110 B8R1.2 NCC1=CC=NC=C1 35876 [1,0,0,0,0,0|3,0,0]=4 111 B8R1.2 NCC1=CN=CN=C1 26963 [1,0,0,0,0,0|2,0,0]=3 112 B8R1.2 NCC1=CN=NC=C1 27223 [1,0,0,0,0,0|2,0,0]=3 113 B8R1.2 NCC1=CN=NC=C1 36975 [1,0,0,0,0,0|2,0,0]=3 114 B8R1.2 NCC1=NC=CN=C1 67569 [1,0,0,0,0,0|2,0,0]=3 115 B8R1.2 NNC1=CC=CN=C1 S12141 [1,0,0,0,0,0|2,0,0]=3 116 B8R1.2 NNC1=CN=CN=C1 AT18412 [1,0,0,0,0,0|3,0,0]=4 117 B8R1.2 OCC1=CN=NC=C1 37054 [1,0,0,0,0,0|2,0,0]=3 118 B8R1.2 SCC1=CC=NC=C1 F18336 [1,0,0,0,0,0|3,0,0]=4 119 B8R1.2 SCC1=CN=CC=C1 F18343 [1,0,0,0,0,0|1,0,0]=2 120 B8R1.2 SCC1=NC=CC=C1 Y10072 [1,0,0,0,0,0|3,0,0]=4 121 B8R1.2 [C-]#[N+]C1=CC=CC=C1 AB1473 [1,0,0,0,0,0|2,0,1]=4 122 B8R1.3 BrC1=NC=C(I)C=N1 55463 [1,0,0,0,0,0|3,0,0]=4 123 B8R1.3 CC1=CC=C(C)N=N1 S11370 [1,0,0,0,0,0|1,0,0]=2 124 B8R1.3 CC1=CN=C(Br)C=N1 88781 [1,0,0,0,0,0|2,0,0]=3 125 B8R1.3 CC1=CN=C(F)N=C1 F11686 [1,0,0,0,0,0|2,0,0]=3 126 B8R1.3 CC1=CN=C(I)C=N1 W17940 [1,0,0,0,0,0|2,0,0]=3 127 B8R1.3 CC1=CN=C(N)C=N1 52044 [1,0,0,0,0,0|2,0,0]=3 128 B8R1.3 CC1=CN=C(N)N=C1 51196 [1,0,0,0,0,0|2,0,0]=3 129 B8R1.3 CC1=CN=C(O)C=N1 84954 [1,0,0,0,0,0|2,0,0]=3 130 B8R1.3 CC1=NC=C(F)C=N1 O11437 [1,0,0,0,0,0|2,0,0]=3 131 B8R1.3 CC1=NC=C(I)C=C1 C10582 [1,0,0,0,0,0|1,0,0]=2 132 B8R1.3 CC1=NC=C(O)C=N1 25911 [1,0,0,0,0,0|2,0,0]=3 133 B8R1.3 FC1=CN=C(Br)C=N1 Y10496 [1,0,0,0,0,0|3,0,0]=4 134 B8R1.3 FC1=NC=C(I)C=N1 O10782 [1,0,0,0,0,0|3,0,0]=4 135 B8R1.3 FC1=NN=C(Br)C=C1 C72413 [1,0,0,0,0,0|3,0,0]=4 136 B8R1.3 IC1=CN=C(I)C=N1 I11480 [1,0,0,0,0,0|3,0,0]=4 137 B8R1.3 NC1=CC=C(O)C=C1 C75965 [1,0,0,0,0,0|3,0,0]=4 138 B8R1.3 NC1=CN=C(Br)N=C1 26764 [1,0,0,0,0,0|3,0,0]=4 139 B8R1.3 NC1=CN=C(I)N=C1 P19402 [1,0,0,0,0,0|3,0,0]=4 140 B8R1.3 NC1=CN=C(N)C=N1 C14950 [1,0,0,0,0,0|3,0,0]=4 141 B8R1.3 NC1=CN=C(N)C=N1 F20076 [1,0,0,0,0,0|3,0,0]=4 142 B8R1.3 NC1=NC=C(O)C=C1 BL008086 [1,0,0,0,0,0|2,0,0]=3 143 B8R1.3 NC1=NC=C(O)C=N1 24754 [1,0,0,0,0,0|3,0,0]=4 144 B8R1.3 NC1=NN=C(F)C=C1 C71319 [1,0,0,0,0,0|3,0,0]=4 145 B8R1.3 NC1=NNC(=O)C=C1 A11691 [1,0,0,0,0,0|3,0,0]=4 146 B8R1.3 OC1=NC=C(F)C=N1 61070 [1,0,0,0,0,0|3,0,0]=4 147 B8R1.3 SC1=CC=C(I)C=C1 F20637 [1,0,0,0,0,0|3,0,0]=4 148 B10R1.1 C=CCC1=CC=C(O)C=C1 AC1877 [0,1,0,0,0,0|2,0,1]=4 149 B10R1.1 CC1=CC=C(CNN)C=C1 O10109 [0,1,0,0,0,0|2,0,0]=3 150 B10R1.1 CC1=CN=C(CC#N)C=C1 C74949 [0,1,0,0,0,0|2,0,1]=4 151 B10R1.1 CC1=CN=C(CCN)N=C1 73044 [0,1,0,0,0,0|3,0,0]=4 152 B10R1.1 CC1=NC=C(CCO)C=C1 54746 [0,1,0,0,0,0|0,0,0]=1 153 B10R1.1 CCNC1=CC=C(F)C=C1 AB11321 [0,1,0,0,0,0|2,0,0]=3 154 B10R1.1 CCOC1=CN=C(Br)C=N1 52691 [0,1,0,0,0,0|2,0,0]=3 155 B10R1.1 CCOC1=CN=C(Br)N=C1 38793 [0,1,0,0,0,0|2,0,0]=3 156 B10R1.1 CCOC1=NC=C(Cl)C=C1 F52729 [0,1,0,0,0,0|3,0,0]=4 157 B10R1.1 CCSC1=CC=C(C)C=C1 H10147 [0,1,0,0,0,0|1,0,0]=2 158 B10R1.1 CNCC1=CC=C(O)C=C1 31972 [0,1,0,0,0,0|2,0,0]=3 159 B10R1.1 COCC1=CC=C(O)C=C1 63646 [0,1,0,0,0,0|2,0,0]=3 160 B10R1.1 COCC1=CN=C(Cl)N=C1 W10973 [0,1,0,0,0,0|2,0,0]=3 161 B10R1.1 CSCC1=CC=C(Br)C=C1 W19176 [0,1,0,0,0,0|2,0,0]=3 162 B10R1.1 CSCC1=CC=C(C)C=C1 W19462 [0,1,0,0,0,0|1,0,0]=2 163 B10R1.1 CSCC1=CC=C(F)C=C1 W18716 [0,1,0,0,0,0|2,0,0]=3 164 B10R1.1 N#CCC1=CN=C(Br)C=C1 AB10135 [0,1,0,0,0,0|1,0,1]=3 165 B10R1.1 N#CCC1=CN=C(F)C=C1 93599 [0,1,0,0,0,0|1,0,1]=3 166 B10R1.1 N#CCC1=NN=C(Cl)C=C1 88652 [0,1,0,0,0,0|2,0,1]=4 167 B10R1.1 NCCC1=CN=C(Cl)C=C1 85004 [0,1,0,0,0,0|1,0,0]=2 168 B10R1.1 NNCC1=CC=C(F)C=C1 36999 [0,1,0,0,0,0|3,0,0]=4 169 B10R1.1 NNCC1=CN=C(Cl)C=C1 W16788 [0,1,0,0,0,0|2,0,0]=3 170 B10R1.1 NOCC1=CC=C(Cl)C=C1 78769 [0,1,0,0,0,0|3,0,0]=4 171 B10R1.1 O=CCC1=CC=C(Cl)C=C1 74968 [0,1,0,0,0,0|2,0,1]=4 172 B10R1.1 OCCC1=NC=C(Br)C=C1 37598 [0,1,0,0,0,0|3,0,0]=4 173 B10R1.1 OCCC1=NC=C(F)C=C1 P18353 [0,1,0,0,0,0|3,0,0]=4 174 B10R1.3 C#CC1=CC=C(CBr)C=C1 79956 [0,1,0,0,0,0|1,0,2]=4 175 B10R1.3 C#CC1=CC=C(CCl)C=C1 79958 [0,1,0,0,0,0|1,0,2]=4 176 B10R1.3 C#CC1=CN=C(C#C)C=C1 T70234 [0,1,0,0,0,0|0,0,3]=4 177 B10R1.3 C#CC1=CN=C(C=O)C=C1 51748 [0,1,0,0,0,0|0,0,3]=4 178 B10R1.3 C#CC1=CN=C(CO)C=C1 AC2758 [0,1,0,0,0,0|0,0,2]=3 179 B10R1.3 C#CC1=CN=C(OC)N=C1 AB10272 [0,1,0,0,0,0|1,0,2]=4 180 B10R1.3 C#CC1=NC=C(OC)C=C1 D84302 [0,1,0,0,0,0|1,0,1]=3 181 B10R1.3 C=CC1=CC=C(CO)C=C1 F14590 [0,1,0,0,0,0|1,0,2]=4 182 B10R1.3 C=CC1=CN=C(C#N)C=C1 79121 [0,1,0,0,0,0|0,0,3]=4 183 B10R1.3 CNC1=CC=C(C=O)C=C1 D93507 [0,1,0,0,0,0|2,0,1]=4 184 B10R1.3 CNC1=CC=C(CO)C=C1 20987 [0,1,0,0,0,0|2,0,0]=3 185 B10R1.3 CNC1=CN=C(C#N)C=C1 O11307 [0,1,0,0,0,0|1,0,1]=3 186 B10R1.3 CNC1=NC=C(C#N)C=C1 88567 [0,1,0,0,0,0|1,0,1]=3 187 B10R1.3 CNC1=NC=C(C=O)C=C1 P10732 [0,1,0,0,0,0|1,0,1]=3 188 B10R1.3 COC1=CN=C(C#N)N=C1 39271 [0,1,0,0,0,0|2,0,1]=4 189 B10R1.3 COC1=CN=C(C=O)C=N1 P10975 [0,1,0,0,0,0|2,0,1]=4 190 B10R1.3 COC1=CN=C(CBr)C=C1 O10508 [0,1,0,0,0,0|1,0,0]=2 191 B10R1.3 COC1=CN=C(CCl)C=C1 81763 [0,1,0,0,0,0|1,0,0]=2 192 B10R1.3 COC1=CN=C(CCl)C=N1 F30446 [0,1,0,0,0,0|2,0,0]=3 193 B10R1.3 COC1=CN=C(CN)C=C1 AC7188 [0,1,0,0,0,0|1,0,0]=2 194 B10R1.3 COC1=CN=C(CO)N=C1 F30447 [0,1,0,0,0,0|2,0,0]=3 195 B10R1.3 COC1=NC=C(CCl)C=C1 82159 [0,1,0,0,0,0|1,0,0]=2 196 B10R1.3 COC1=NC=C(CN)C=C1 C73256 [0,1,0,0,0,0|1,0,0]=2 197 B10R1.3 COC1=NC=C(CN)C=N1 P10610 [0,1,0,0,0,0|2,0,0]=3 198 B10R1.3 COC1=NC=C(CO)C=N1 P11192 [0,1,0,0,0,0|2,0,0]=3 199 B10R1.3 COC1=NC=C(CO)N=C1 F30445 [0,1,0,0,0,0|2,0,0]=3 200 B10R1.3 COC1=NC=C(NN)C=C1 F13050 [0,1,0,0,0,0|2,0,0]=3 201 B10R1.3 COC1=NN=C(CO)C=C1 P11745 [0,1,0,0,0,0|2,0,0]=3 202 B10R1.3 COC1=NN=C(OC)C=C1 C75238 [0,1,0,0,0,0|2,0,0]=3 203 B10R1.3 CSC1=CC=C(NN)C=C1 79686 [0,1,0,0,0,0|3,0,0]=4 204 B10R1.3 CSC1=CN=C(SC)N=C1 W16219 [0,1,0,0,0,0|2,0,0]=3 205 B10R1.3 CSC1=NC=C(C#N)C=N1 C74953 [0,1,0,0,0,0|2,0,1]=4 206 B10R1.3 CSC1=NC=C(C=O)C=N1 P10273 [0,1,0,0,0,0|2,0,1]=4 207 B10R1.3 CSC1=NC=C(CO)C=N1 S10007 [0,1,0,0,0,0|2,0,0]=3 208 B10R1.3 N#CC1=CN=C(C#N)C=C1 AB11965 [0,1,0,0,0,0|1,0,2]=4 209 B10R1.3 N#CC1=CN=C(C=O)C=C1 26613 [0,1,0,0,0,0|1,0,2]=4 210 B10R1.3 N#CC1=CN=C(CCl)C=C1 P11633 [0,1,0,0,0,0|1,0,1]=3 211 B10R1.3 N#CC1=CN=C(CN)C=C1 P16132 [0,1,0,0,0,0|1,0,1]=3 212 B10R1.3 N#CC1=CN=C(CN)C=C1 W18493 [0,1,0,0,0,0|1,0,1]=3 213 B10R1.3 N#CC1=CN=C(CO)C=C1 36548 [0,1,0,0,0,0|1,0,1]=3 214 B10R1.3 N#CC1=NC=C(CCl)C=C1 C71847 [0,1,0,0,0,0|1,0,1]=3 215 B10R1.3 N#CC1=NC=C(CN)C=C1 AB1091 [0,1,0,0,0,0|1,0,1]=3 216 B10R1.3 NCC1=CC=C(CBr)C=C1 54465 [0,1,0,0,0,0|2,0,0]=3 217 B10R1.3 NCC1=CC=C(CCl)C=C1 51899 [0,1,0,0,0,0|2,0,0]=3 218 B10R1.3 O=CC1=CC=C(CCl)C=C1 CL9238 [0,1,0,0,0,0|2,0,1]=4 219 B10R1.3 O=CC1=CN=C(C=O)C=C1 D80964 [0,1,0,0,0,0|1,0,2]=4 220 B10R1.3 SCC1=CC=C(CS)C=C1 T70041 [0,1,0,0,0,0|2,0,0]=3 221 B10R1.13 C=C(C)C1=CC=C(I)C=C1 AC1339 [0,1,0,0,0,0|2,0,1]=4 222 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 AC7918 [0,1,0,0,0,0|2,0,1]=4 223 B10R1.13 CC(=O)C1=CN=C(O)N=C1 F13147 [0,1,0,0,0,0|2,0,1]=4 224 B10R1.13 CC(=O)C1=NC=C(C)N=C1 56571 [0,1,0,0,0,0|1,0,1]=3 225 B10R1.13 CC(=O)C1=NC=C(O)N=C1 C71512 [0,1,0,0,0,0|2,0,1]=4 226 B10R1.13 CC(=O)C1=NN=C(Cl)C=C1 P10979 [0,1,0,0,0,0|2,0,1]=4 227 B10R1.13 CC(C)C1=CC=C(O)C=C1 D72532 [0,1,0,0,0,0|2,0,0]=3 228 B10R1.13 CC(C)C1=NC=C(Br)C=C1 C71514 [0,1,0,0,0,0|3,0,0]=4 229 B10R1.13 CC(C)C1=NC=C(N)C=C1 D81293 [0,1,0,0,0,0|3,0,0]=4 230 B10R1.13 CC(C)C1=NC=C(N)C=C1 RB1132 [0,1,0,0,0,0|3,0,0]=4 231 B10R1.13 CC(C)C1=NN=C(Br)C=C1 Y11125 [0,1,0,0,0,0|2,0,0]=3 232 B10R1.13 CC(C)C1=NNC(=O)C=C1 65672 [0,1,0,0,0,0|2,0,1]=4 233 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 20068 [0,1,0,0,0,0|1,0,0]=2 234 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 Y14023 [0,1,0,0,0,0|1,0,0]=2 235 B10R1.13 CC1=CC=C([C@H](C)O)C=C1 W19044 [0,1,0,0,0,0|1,0,0]=2 236 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 97006 [0,1,0,0,0,0|3,0,0]=4 237 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 A11173 [0,1,0,0,0,0|3,0,0]=4 238 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 T73083 [0,1,0,0,0,0|2,0,0]=3 239 B10R1.13 CC1=CN=C(C(C)C)C=N1 W18369 [0,1,0,0,0,0|1,0,0]=2 240 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 Y10810 [0,1,0,0,0,0|2,0,0]=3 241 B10R1.13 CC1=CN=C([C@H](C)N)C=N1 56575 [0,1,0,0,0,0|1,0,0]=2 242 B10R1.13 CC1=CN=C([C@H](C)O)C=C1 AB7629 [0,1,0,0,0,0|2,0,0]=3 243 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 F16847 [0,1,0,0,0,0|0,0,0]=1 244 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 Y11095 [0,1,0,0,0,0|0,0,0]=1 245 B10R1.13 CC1=NC=C([C@H](C)N)C=N1 AT24774 [0,1,0,0,0,0|1,0,0]=2 246 B10R1.13 CN(C)C1=CN=C(Cl)C=C1 C15764 [0,1,0,0,0,0|2,0,0]=3 247 B10R1.13 CN(C)C1=CN=C(Cl)N=C1 D80206 [0,1,0,0,0,0|3,0,0]=4 248 B10R1.13 CN(C)C1=CN=C(N)C=C1 N10123 [0,1,0,0,0,0|2,0,0]=3 249 B10R1.13 CN(C)C1=NN=C(Br)C=C1 A12070 [0,1,0,0,0,0|3,0,0]=4 250 B10R1.13 CN(C)C1=NN=C(Cl)C=C1 S10309 [0,1,0,0,0,0|3,0,0]=4 251 B10R1.13 CN(N)C1=CC=C(Br)C=C1 E10129 [0,1,0,0,0,0|3,0,0]=4 252 B10R1.13 C[C@H](Cl)C1=CC=C(F)C=C1 AC6174 [0,1,0,0,0,0|2,0,0]=3 253 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 C16655 [0,1,0,0,0,0|2,0,0]=3 254 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 Y10310 [0,1,0,0,0,0|2,0,0]=3 255 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 Y10311 [0,1,0,0,0,0|2,0,0]=3 256 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 20069 [0,1,0,0,0,0|2,0,0]=3 257 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 20071 [0,1,0,0,0,0|2,0,0]=3 258 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 O11060 [0,1,0,0,0,0|2,0,0]=3 259 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 Y11752 [0,1,0,0,0,0|2,0,0]=3 260 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 Y11753 [0,1,0,0,0,0|2,0,0]=3 261 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 Y10879 [0,1,0,0,0,0|2,0,0]=3 262 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 Y14795 [0,1,0,0,0,0|2,0,0]=3 263 B10R1.13 C[C@H](N)C1=CN=C(Br)C=C1 81501 [0,1,0,0,0,0|1,0,0]=2 264 B10R1.13 C[C@H](N)C1=CN=C(Cl)C=C1 N11108 [0,1,0,0,0,0|1,0,0]=2 265 B10R1.13 C[C@H](N)C1=CN=C(Cl)C=C1 N11223 [0,1,0,0,0,0|1,0,0]=2 266 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 66671 [0,1,0,0,0,0|3,0,0]=4 267 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 74099 [0,1,0,0,0,0|3,0,0]=4 268 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 74101 [0,1,0,0,0,0|3,0,0]=4 269 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 81462 [0,1,0,0,0,0|3,0,0]=4 270 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 D82399 [0,1,0,0,0,0|3,0,0]=4 271 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 N11298 [0,1,0,0,0,0|3,0,0]=4 272 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 Y11564 [0,1,0,0,0,0|3,0,0]=4 273 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 N13196 [0,1,0,0,0,0|3,0,0]=4 274 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 Y12226 [0,1,0,0,0,0|3,0,0]=4 275 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 90530 [0,1,0,0,0,0|3,0,0]=4 276 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 F17006 [0,1,0,0,0,0|3,0,0]=4 277 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 N11135 [0,1,0,0,0,0|3,0,0]=4 278 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 Y10461 [0,1,0,0,0,0|3,0,0]=4 279 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 Y11597 [0,1,0,0,0,0|3,0,0]=4 280 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 Y13385 [0,1,0,0,0,0|3,0,0]=4 281 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 SC1272 [0,1,0,0,0,0|2,0,0]=3 282 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 SC1278 [0,1,0,0,0,0|2,0,0]=3 283 B10R1.13 C[C@H](O)C1=CC=C(O)C=C1 25877 [0,1,0,0,0,0|2,0,0]=3 284 B10R1.13 C[C@H](O)C1=CN=C(Br)C=C1 AT11876 [0,1,0,0,0,0|1,0,0]=2 285 B10R1.13 C[C@H](O)C1=CN=C(Cl)N=C1 P15879 [0,1,0,0,0,0|2,0,0]=3 286 B10R1.13 C[C@H](O)C1=NC=C(Br)C=C1 Y13723 [0,1,0,0,0,0|3,0,0]=4 287 B10R1.13 ClC1=NN=C(C(Cl)Cl)C=C1 58548 [0,1,0,0,0,0|3,0,0]=4 288 B10R1.13 FC(F)C1=CC=C(I)C=C1 C71790 [0,1,0,0,0,0|3,0,0]=4 289 B10R1.13 FC(F)C1=CN=C(Cl)C=C1 D80116 [0,1,0,0,0,0|2,0,0]=3 290 B10R1.13 FC(F)C1=NN=C(Cl)C=C1 C73280 [0,1,0,0,0,0|3,0,0]=4 291 B10R1.13 NC(=O)C1=CN=C(O)C=C1 C74893 [0,1,0,0,0,0|2,0,1]=4 292 B10R1.13 NC1=CN=C(C(F)F)C=N1 D84905 [0,1,0,0,0,0|3,0,0]=4 293 B10R1.13 O=[N+]([O-])C1=CN=C(I)C=C1 T72219 [0,1,0,0,0,0|3,0,0]=4 294 B10R1.25 CC1=C(C#N)C=CC(Br)=N1 22703 [0,1,0,0,0,0|2,0,1]=4 295 B10R1.25 CC1=C(C#N)C=CC(Cl)=N1 22614 [0,1,0,0,0,0|2,0,1]=4 296 B10R1.25 CC1=C(C#N)C=CC(N)=N1 29233 [0,1,0,0,0,0|2,0,1]=4 297 B10R1.25 CC1=C(C=O)C=CC(Br)=N1 C16730 [0,1,0,0,0,0|2,0,1]=4 298 B10R1.25 CC1=C(C=O)C=CC(F)=N1 C76919 [0,1,0,0,0,0|2,0,1]=4 299 B10R1.25 CC1=C(CBr)C=CC(Br)=C1 93716 [0,1,0,0,0,0|3,0,0]=4 300 B10R1.25 CC1=C(CCl)C=CC(Br)=C1 AB10222 [0,1,0,0,0,0|3,0,0]=4 301 B10R1.25 CC1=C(CF)C=CC(Br)=C1 C73525 [0,1,0,0,0,0|3,0,0]=4 302 B10R1.25 CC1=C(CN)C=CC(Br)=C1 C71550 [0,1,0,0,0,0|3,0,0]=4 303 B10R1.25 CC1=C(CN)C=CC(N)=N1 D93406 [0,1,0,0,0,0|2,0,0]=3 304 B10R1.25 CC1=C(CO)C=CC(F)=N1 C76920 [0,1,0,0,0,0|2,0,0]=3 305 B10R1.25 CC1=C(CO)C=CC(N)=C1 F19834 [0,1,0,0,0,0|3,0,0]=4 306 B10R1.25 CC1=CC(Br)=C(CCl)N=C1 D96976 [0,1,0,0,0,0|3,0,0]=4 307 B10R1.25 CC1=CC(Br)=C(CN)C=C1 W19042 [0,1,0,0,0,0|2,0,0]=3 308 B10R1.25 CC1=CC(Br)=C(CN)N=C1 24111 [0,1,0,0,0,0|3,0,0]=4 309 B10R1.25 CC1=CC(Br)=C(CO)N=C1 D96975 [0,1,0,0,0,0|3,0,0]=4 310 B10R1.25 CC1=CC(Br)=NC=C1C=O C77172 [0,1,0,0,0,0|2,0,1]=4 311 B10R1.25 CC1=CC(C)=C(C=O)C=N1 C14259 [0,1,0,0,0,0|1,0,1]=3 312 B10R1.25 CC1=CC(C)=C(CBr)C=C1 24686 [0,1,0,0,0,0|2,0,0]=3 313 B10R1.25 CC1=CC(Cl)=C(C#N)C=N1 O11222 [0,1,0,0,0,0|1,0,1]=3 314 B10R1.25 CC1=CC(Cl)=C(CN)C=C1 N12896 [0,1,0,0,0,0|2,0,0]=3 315 B10R1.25 CC1=CC(Cl)=NC=C1C#N P12141 [0,1,0,0,0,0|2,0,1]=4 316 B10R1.25 CC1=CC(F)=C(NN)C=C1 D82866 [0,1,0,0,0,0|3,0,0]=4 317 B10R1.25 CC1=CC(F)=C(NN)C=C1 W17784 [0,1,0,0,0,0|3,0,0]=4 318 B10R1.25 CC1=CC(N)=C(CO)C=N1 C72979 [0,1,0,0,0,0|1,0,0]=2 319 B10R1.25 CC1=CC(O)=NC=C1C#N F13917 [0,1,0,0,0,0|2,0,1]=4 320 B10R1.25 CC1=CC=C(C=O)C(Br)=N1 D82345 [0,1,0,0,0,0|1,0,1]=3 321 B10R1.25 CC1=CC=C(CBr)C(Br)=N1 C77257 [0,1,0,0,0,0|1,0,0]=2 322 B10R1.25 CC1=CC=C(CO)C(Cl)=N1 W17836 [0,1,0,0,0,0|1,0,0]=2 323 B10R1.25 CC1=CN=C(CN)C(C)=C1 D83303 [0,1,0,0,0,0|3,0,0]=4 324 B10R1.25 CC1=NC(C)=C(CO)C=C1 F12480 [0,1,0,0,0,0|1,0,0]=2 325 B10R1.25 CC1=NC(N)=C(C#N)C=N1 66179 [0,1,0,0,0,0|2,0,1]=4 326 B10R1.25 CC1=NC(N)=C(C=O)C=N1 66180 [0,1,0,0,0,0|2,0,1]=4 327 B10R1.25 CC1=NC=C(C#N)C(Cl)=N1 26628 [0,1,0,0,0,0|2,0,1]=4 328 B10R1.25 CC1=NC=C(CN)C(N)=N1 33128 [0,1,0,0,0,0|2,0,0]=3 329 B10R1.25 CCC1=C(Br)C=C(N)C=C1 27953 [0,1,0,0,0,0|2,0,0]=3 330 B10R1.25 CCC1=C(Br)C=C(O)C=C1 Y11628 [0,1,0,0,0,0|2,0,0]=3 331 B10R1.25 CCC1=C(Cl)C=C(N)C=C1 W17033 [0,1,0,0,0,0|2,0,0]=3 332 B10R1.25 CCC1=C(F)C=C(Br)C=C1 D82415 [0,1,0,0,0,0|2,0,0]=3 333 B10R1.25 CCC1=C(F)C=C(O)C=C1 C11362 [0,1,0,0,0,0|2,0,0]=3 334 B10R1.25 CCC1=C(N)C=C(Br)C=C1 C72839 [0,1,0,0,0,0|2,0,0]=3 335 B10R1.25 CCC1=C(N)C=C(Cl)C=C1 C74962 [0,1,0,0,0,0|2,0,0]=3 336 B10R1.25 CCC1=CNC(=S)NC1=O 24523 [0,1,0,0,0,0|2,0,1]=4 337 B10R1.25 CCC1=NC=C(Br)C=C1N 38360 [0,1,0,0,0,0|3,0,0]=4 338 B10R1.25 CCC1=NC=C(Cl)N=C1Cl C72268 [0,1,0,0,0,0|2,0,0]=3 339 B10R1.25 CCN1C=CC(Br)=CC1=O P13647 [0,1,0,0,0,0|3,0,0]=4 340 B10R1.25 CNC1=C(Br)C=C(F)C=C1 71883 [0,1,0,0,0,0|3,0,0]=4 341 B10R1.25 CNC1=C(C)C=C(O)C=C1 C16321 [0,1,0,0,0,0|3,0,0]=4 342 B10R1.25 COC1=C(Br)C=C(Cl)N=C1 S10226 [0,1,0,0,0,0|2,0,0]=3 343 B10R1.25 COC1=C(C)C=C(O)C=C1 95659 [0,1,0,0,0,0|3,0,0]=4 344 B10R1.25 COC1=C(C)N=C(Br)C=C1 W15448 [0,1,0,0,0,0|2,0,0]=3 345 B10R1.25 COC1=C(C)N=C(C)N=C1 O11463 [0,1,0,0,0,0|2,0,0]=3 346 B10R1.25 COC1=C(C)N=C(Cl)N=C1 72823 [0,1,0,0,0,0|3,0,0]=4 347 B10R1.25 COC1=C(C)N=C(N)N=C1 FD10682 [0,1,0,0,0,0|3,0,0]=4 348 B10R1.25 COC1=C(Cl)C=C(C)C=N1 C71882 [0,1,0,0,0,0|3,0,0]=4 349 B10R1.25 COC1=C(Cl)C=C(I)C=C1 F15482 [0,1,0,0,0,0|3,0,0]=4 350 B10R1.25 COC1=C(Cl)C=C(N)N=C1 37736 [0,1,0,0,0,0|2,0,0]=3 351 B10R1.25 COC1=C(Cl)N=C(I)C=C1 72074 [0,1,0,0,0,0|2,0,0]=3 352 B10R1.25 COC1=C(F)N=C(Br)C=C1 CS1206 [0,1,0,0,0,0|2,0,0]=3 353 B10R1.25 COC1=C(I)C=C(Cl)N=C1 S10146 [0,1,0,0,0,0|2,0,0]=3 354 B10R1.25 COC1=C(I)C=C(Cl)N=N1 S11536 [0,1,0,0,0,0|3,0,0]=4 355 B10R1.25 COC1=C(N)N=C(C)C=C1 84162 [0,1,0,0,0,0|1,0,0]=2 356 B10R1.25 COC1=C(N)N=C(Cl)C=N1 C91504 [0,1,0,0,0,0|3,0,0]=4 357 B10R1.25 COC1=C(N)N=C(F)C=C1 D70935 [0,1,0,0,0,0|2,0,0]=3 358 B10R1.25 COC1=CC=C(Br)N=C1Br 79976 [0,1,0,0,0,0|2,0,0]=3 359 B10R1.25 COC1=CC=C(C)N=C1Cl C73850 [0,1,0,0,0,0|1,0,0]=2 360 B10R1.25 COC1=CC=C(C)N=C1I F30133 [0,1,0,0,0,0|1,0,0]=2 361 B10R1.25 COC1=CC=C(Cl)N=C1Br C72025 [0,1,0,0,0,0|2,0,0]=3 362 B10R1.25 COC1=CC=C(Cl)N=C1Cl 81824 [0,1,0,0,0,0|2,0,0]=3 363 B10R1.25 COC1=CC=C(Cl)N=C1I 82334 [0,1,0,0,0,0|2,0,0]=3 364 B10R1.25 COC1=CC=C(N)N=C1Cl F19661 [0,1,0,0,0,0|2,0,0]=3 365 B10R1.25 COC1=CN=C(Br)C=C1Cl F16734 [0,1,0,0,0,0|2,0,0]=3 366 B10R1.25 COC1=CN=C(Br)C=C1N AC1554 [0,1,0,0,0,0|2,0,0]=3 367 B10R1.25 COC1=CN=C(Br)C=C1O AT23971 [0,1,0,0,0,0|2,0,0]=3 368 B10R1.25 COC1=CN=C(C)N=C1Cl F30537 [0,1,0,0,0,0|2,0,0]=3 369 B10R1.25 COC1=CN=C(Cl)C=C1N C71879 [0,1,0,0,0,0|2,0,0]=3 370 B10R1.25 COC1=CN=C(N)NC1=O 28170 [0,1,0,0,0,0|3,0,0]=4 371 B10R1.25 COC1=CNC(=O)C=C1Br W15670 [0,1,0,0,0,0|2,0,1]=4 372 B10R1.25 COC1=NC=C(Cl)N=C1Cl W12644 [0,1,0,0,0,0|3,0,0]=4 373 B10R1.25 COC1=NN=C(Cl)C=C1C C77016 [0,1,0,0,0,0|3,0,0]=4 374 B10R1.25 COC1=NN=C(Cl)C=C1N P10109 [0,1,0,0,0,0|3,0,0]=4 375 B10R1.25 CSC1=C(Br)C=C(F)C=C1 69928 [0,1,0,0,0,0|3,0,0]=4 376 B10R1.25 CSC1=C(Cl)C=C(Br)C=C1 Y11168 [0,1,0,0,0,0|3,0,0]=4 377 B10R1.25 CSC1=C(Cl)N=C(Cl)N=C1 P13091 [0,1,0,0,0,0|3,0,0]=4 378 B10R1.25 CSC1=C(F)C=C(N)C=C1 94984 [0,1,0,0,0,0|3,0,0]=4 379 B10R1.25 CSC1=C(F)N=C(F)C=C1 D79861 [0,1,0,0,0,0|2,0,0]=3 380 B10R1.25 CSC1=NC=C(Cl)N=C1Cl 38290 [0,1,0,0,0,0|3,0,0]=4 381 B10R1.25 ClCC1=CC=C(Cl)N=C1Cl F19959 [0,1,0,0,0,0|2,0,0]=3 382 B10R1.25 ClCC1=CN=C(Cl)C=C1Cl F12172 [0,1,0,0,0,0|2,0,0]=3 383 B10R1.25 FC1=C(CBr)C=CC(I)=C1 55991 [0,1,0,0,0,0|3,0,0]=4 384 B10R1.25 FC1=CC(I)=C(CBr)C=C1 56051 [0,1,0,0,0,0|3,0,0]=4 385 B10R1.25 N#CC1=C(I)C=C(Br)N=C1 53798 [0,1,0,0,0,0|2,0,1]=4 386 B10R1.25 N#CC1=C(I)C=C(Cl)N=C1 P11914 [0,1,0,0,0,0|2,0,1]=4 387 B10R1.25 N#CC1=C(N)N=C(Cl)C=C1 F50737 [0,1,0,0,0,0|2,0,1]=4 388 B10R1.25 N#CC1=C(N)N=C(N)C=C1 D83412 [0,1,0,0,0,0|2,0,1]=4 389 B10R1.25 N#CC1=CC=C(Cl)N=C1Br C72031 [0,1,0,0,0,0|2,0,1]=4 390 B10R1.25 N#CC1=CC=C(N)N=C1Cl O11528 [0,1,0,0,0,0|2,0,1]=4 391 B10R1.25 N#CC1=CC=C(O)N=C1O C15658 [0,1,0,0,0,0|2,0,1]=4 392 B10R1.25 NC1=C(CO)C=CC(Br)=N1 97230 [0,1,0,0,0,0|2,0,0]=3 393 B10R1.25 NC1=C(CO)C=NC(Cl)=N1 O10101 [0,1,0,0,0,0|3,0,0]=4 394 B10R1.25 NC1=CC(Cl)=NC=C1C=O 22929 [0,1,0,0,0,0|2,0,1]=4 395 B10R1.25 NCC1=C(Br)C=C(Cl)C=C1 C73878 [0,1,0,0,0,0|3,0,0]=4 396 B10R1.25 NCC1=C(Br)C=C(F)C=C1 Y11612 [0,1,0,0,0,0|3,0,0]=4 397 B10R1.25 NCC1=C(Cl)C=C(Br)C=C1 Y12485 [0,1,0,0,0,0|3,0,0]=4 398 B10R1.25 NCC1=C(F)C=C(O)C=C1 N14725 [0,1,0,0,0,0|3,0,0]=4 399 B10R1.25 NCC1=C(O)C=C(Br)C=C1 N13143 [0,1,0,0,0,0|3,0,0]=4 400 B10R1.25 O=CC1=C(Cl)N=C(Br)C=C1 26730 [0,1,0,0,0,0|2,0,1]=4 401 B10R1.25 O=CC1=C(F)N=C(Br)C=C1 74727 [0,1,0,0,0,0|2,0,1]=4 402 B10R1.25 O=CC1=C(O)N=C(Br)C=C1 D80553 [0,1,0,0,0,0|2,0,1]=4 403 B10R1.25 O=CC1=CC=C(Cl)N=C1Br C71249 [0,1,0,0,0,0|2,0,1]=4 404 B10R1.25 O=CC1=CC=C(F)N=C1Cl F12185 [0,1,0,0,0,0|2,0,1]=4 405 B10R1.25 O=CC1=CN=C(Br)C=C1Cl CL0319 [0,1,0,0,0,0|2,0,1]=4 406 B10R1.25 OCC1=C(Br)C=C(O)C=C1 98273 [0,1,0,0,0,0|3,0,0]=4 407 B10R1.25 OCC1=C(Cl)C=C(O)C=C1 CL9122 [0,1,0,0,0,0|3,0,0]=4 408 B10R1.25 OCC1=C(Cl)N=C(Cl)N=C1 O10032 [0,1,0,0,0,0|3,0,0]=4 409 B10R1.25 OCC1=C(F)N=C(Cl)C=C1 D70022 [0,1,0,0,0,0|2,0,0]=3 410 B10R1.25 OCC1=C(I)C=C(Cl)C=C1 95677 [0,1,0,0,0,0|3,0,0]=4 411 B10R1.25 OCC1=C(O)C=C(Br)C=C1 35526 [0,1,0,0,0,0|3,0,0]=4 412 B10R1.25 OCC1=CC=C(Br)N=C1Br C75600 [0,1,0,0,0,0|2,0,0]=3 413 B10R1.176 BrCC1=CC(Br)=C(Br)C=C1 C76015 [0,1,0,0,0,0|3,0,0]=4 414 B10R1.176 CC1=C(Br)C=C(CO)N=C1 AC5138 [0,1,0,0,0,0|3,0,0]=4 415 B10R1.176 CC1=C(Br)C=C(CO)N=C1 F31019 [0,1,0,0,0,0|3,0,0]=4 416 B10R1.176 CC1=C(Br)C=CC(CN)=C1 N12558 [0,1,0,0,0,0|3,0,0]=4 417 B10R1.176 CC1=C(Br)C=CC(CN)=C1 Y12257 [0,1,0,0,0,0|3,0,0]=4 418 B10R1.176 CC1=C(Cl)C=C(C#N)C=N1 79582 [0,1,0,0,0,0|1,0,1]=3 419 B10R1.176 CC1=C(F)C=CC(CBr)=C1 D87871 [0,1,0,0,0,0|3,0,0]=4 420 B10R1.176 CC1=C(O)C=C(C=O)C=C1 W16814 [0,1,0,0,0,0|2,0,1]=4 421 B10R1.176 CC1=C(O)C=CC(CN)=C1 N14331 [0,1,0,0,0,0|3,0,0]=4 422 B10R1.176 CC1=C(O)C=CC(CO)=C1 C73536 [0,1,0,0,0,0|3,0,0]=4 423 B10R1.176 CC1=CC(C#N)=CN=C1Br 25892 [0,1,0,0,0,0|2,0,1]=4 424 B10R1.176 CC1=CC(C#N)=CN=C1C 72102 [0,1,0,0,0,0|1,0,1]=3 425 B10R1.176 CC1=CC(C#N)=CN=C1N 28393 [0,1,0,0,0,0|2,0,1]=4 426 B10R1.176 CC1=CC(C=O)=CN=C1Br 78107 [0,1,0,0,0,0|2,0,1]=4 427 B10R1.176 CC1=CC(CN)=CN=C1Cl D79766 [0,1,0,0,0,0|2,0,0]=3 428 B10R1.176 CC1=NC=C(C#N)C=C1N C74692 [0,1,0,0,0,0|1,0,1]=3 429 B10R1.176 CCC1=CC(Br)=C(C)C=C1 D93128 [0,1,0,0,0,0|1,0,0]=2 430 B10R1.176 CCC1=CC(Br)=C(I)C=C1 Y11303 [0,1,0,0,0,0|2,0,0]=3 431 B10R1.176 CCC1=CC(C)=C(C)C=C1 C77212 [0,1,0,0,0,0|1,0,0]=2 432 B10R1.176 CCC1=CC(C)=C(I)C=C1 W17700 [0,1,0,0,0,0|2,0,0]=3 433 B10R1.176 CCC1=CC(F)=C(N)C=C1 N13141 [0,1,0,0,0,0|2,0,0]=3 434 B10R1.176 CCC1=CC(N)=C(N)C=C1 76101 [0,1,0,0,0,0|2,0,0]=3 435 B10R1.176 CCC1=CC(O)=C(Cl)C=C1 O10732 [0,1,0,0,0,0|2,0,0]=3 436 B10R1.176 CCC1=NC(Cl)=C(Br)C=C1 C72403 [0,1,0,0,0,0|3,0,0]=4 437 B10R1.176 CN1C=C(CN)C=CC1=O P16593 [0,1,0,0,0,0|2,0,1]=4 438 B10R1.176 CN1C=C(CO)C=CC1=O 37238 [0,1,0,0,0,0|2,0,1]=4 439 B10R1.176 CN1C=CC(CN)=CC1=O 37096 [0,1,0,0,0,0|3,0,0]=4 440 B10R1.176 CN1C=CC(CO)=CC1=O 37252 [0,1,0,0,0,0|3,0,0]=4 441 B10R1.176 COC1=CC(=O)N(C)C=C1 79097 [0,1,0,0,0,0|3,0,0]=4 442 B10R1.176 COC1=CC(Br)=C(C)C=N1 P20929 [0,1,0,0,0,0|3,0,0]=4 443 B10R1.176 COC1=CC(Br)=C(C)N=C1 P12000 [0,1,0,0,0,0|1,0,0]=2 444 B10R1.176 COC1=CC(Br)=C(Cl)N=C1 C14046 [0,1,0,0,0,0|2,0,0]=3 445 B10R1.176 COC1=CC(Cl)=C(I)C=C1 D72033 [0,1,0,0,0,0|3,0,0]=4 446 B10R1.176 COC1=CC(F)=C(N)N=C1 C71770 [0,1,0,0,0,0|2,0,0]=3 447 B10R1.176 COC1=CC(O)=C(N)C=C1 20700 [0,1,0,0,0,0|3,0,0]=4 448 B10R1.176 COC1=CC(O)=C(O)C=C1 F18177 [0,1,0,0,0,0|3,0,0]=4 449 B10R1.176 COC1=CN=C(Br)C(F)=C1 D83224 [0,1,0,0,0,0|2,0,0]=3 450 B10R1.176 COC1=CN=C(Br)C(N)=C1 24981 [0,1,0,0,0,0|2,0,0]=3 451 B10R1.176 COC1=CN=C(Cl)C(C)=C1 C76383 [0,1,0,0,0,0|2,0,0]=3 452 B10R1.176 COC1=CN=C(Cl)C(N)=N1 C72387 [0,1,0,0,0,0|3,0,0]=4 453 B10R1.176 COC1=NC(C)=C(N)N=C1 D82743 [0,1,0,0,0,0|3,0,0]=4 454 B10R1.176 COC1=NC=C(C)C(N)=C1 C72054 [0,1,0,0,0,0|3,0,0]=4 455 B10R1.176 CSC1=CN=C(Br)C(F)=C1 D79863 [0,1,0,0,0,0|2,0,0]=3 456 B10R1.176 CSC1=CN=C(Cl)C(C)=C1 D79862 [0,1,0,0,0,0|2,0,0]=3 457 B10R1.176 CSC1=CN=C(Cl)C(Cl)=N1 38289 [0,1,0,0,0,0|3,0,0]=4 458 B10R1.176 ClC1=C(Br)C=CC(CBr)=C1 76034 [0,1,0,0,0,0|3,0,0]=4 459 B10R1.176 ClC1=C(I)C=C(CBr)C=N1 C77062 [0,1,0,0,0,0|2,0,0]=3 460 B10R1.176 FC1=C(I)C=CC(CBr)=C1 CL9459 [0,1,0,0,0,0|3,0,0]=4 461 B10R1.176 FC1=CC(CCl)=CN=C1Cl D84735 [0,1,0,0,0,0|2,0,0]=3 462 B10R1.176 N#CC1=CC(Cl)=C(O)N=C1 C73769 [0,1,0,0,0,0|2,0,1]=4 463 B10R1.176 N#CC1=CN=C(Cl)C(F)=C1 C71097 [0,1,0,0,0,0|2,0,1]=4 464 B10R1.176 NC1=C(F)C=C(CO)C=C1 74966 [0,1,0,0,0,0|3,0,0]=4 465 B10R1.176 NC1=C(O)C=CC(CO)=C1 Y13579 [0,1,0,0,0,0|3,0,0]=4 466 B10R1.176 NCC1=CC(F)=C(Br)C=C1 95673 [0,1,0,0,0,0|3,0,0]=4 467 B10R1.176 NCC1=CC(F)=C(Br)C=C1 CS1629 [0,1,0,0,0,0|3,0,0]=4 468 B10R1.176 NCC1=CC(F)=C(N)C=C1 C90556 [0,1,0,0,0,0|3,0,0]=4 469 B10R1.176 NCC1=CC(O)=C(Cl)C=C1 Y11334 [0,1,0,0,0,0|3,0,0]=4 470 B10R1.176 NCC1=CC(O)=C(F)C=C1 D71055 [0,1,0,0,0,0|3,0,0]=4 471 B10R1.176 NCC1=CC(O)=C(O)C=C1 S11863 [0,1,0,0,0,0|3,0,0]=4 472 B10R1.176 NCC1=CN=C(Cl)C(F)=C1 Y12730 [0,1,0,0,0,0|2,0,0]=3 473 B10R1.176 O=CC1=CC(Cl)=C(O)N=C1 A12705 [0,1,0,0,0,0|2,0,1]=4 474 B10R1.176 O=CC1=CN=C(Br)C(F)=C1 O11553 [0,1,0,0,0,0|2,0,1]=4 475 B10R1.176 O=CC1=CN=C(Cl)C(Cl)=C1 97698 [0,1,0,0,0,0|2,0,1]=4 476 B10R1.176 O=CC1=CN=C(Cl)C(F)=C1 C16801 [0,1,0,0,0,0|2,0,1]=4 477 B10R1.176 OC1=C(F)C=CC(CCl)=C1 D79295 [0,1,0,0,0,0|3,0,0]=4 478 B10R1.176 OCC1=CC(I)=C(Cl)N=C1 C72451 [0,1,0,0,0,0|2,0,0]=3 479 B10R1.176 OCC1=CC(O)=C(F)C=C1 C77207 [0,1,0,0,0,0|3,0,0]=4 480 B10R1.176 OCC1=CN=C(Cl)C(Cl)=C1 89008 [0,1,0,0,0,0|2,0,0]=3 481 B10R2.31 NC1=CC2=C(C=C1)CC2 67858 [0,0,0,1,0,0|2,0,0]=3 482 B10R2.31 NC1=CC2=C(C=C1)CC2 D83029 [0,0,0,1,0,0|2,0,0]=3 483 B8R1.1 BrCC1=CN=C(Br)S1 24688 [0,0,0,0,1,0|3,0,0]=4 484 B8R1.1 C#CC1=CN(C)N=C1 65015 [0,0,0,0,1,0|1,0,2]=4 485 B8R1.1 C#CC1=CSC(C)=N1 32023 [0,0,0,0,1,0|1,0,2]=4 486 B8R1.1 CC1=CC(C=O)=CS1 P15425 [0,0,0,0,1,0|2,0,1]=4 487 B8R1.1 CC1=CC(CBr)=NO1 F30090 [0,0,0,0,1,0|3,0,0]=4 488 B8R1.1 CC1=CC(CCl)=NO1 71171 [0,0,0,0,1,0|3,0,0]=4 489 B8R1.1 CC1=CC=C(C=O)N1 29847 [0,0,0,0,1,0|1,0,2]=4 490 B8R1.1 CC1=CC=C(CN)S1 71266 [0,0,0,0,1,0|2,0,0]=3 491 B8R1.1 CC1=CC=C(CO)S1 W10513 [0,0,0,0,1,0|2,0,0]=3 492 B8R1.1 CC1=CN=C(CO)N1 P16461 [0,0,0,0,1,0|2,0,1]=4 493 B8R1.1 CC1=CN=C(CO)S1 C73831 [0,0,0,0,1,0|3,0,0]=4 494 B8R1.1 CC1=CNC(C#N)=N1 O11258 [0,0,0,0,1,0|2,0,1]=4 495 B8R1.1 CC1=CNC(C=O)=C1 D84258 [0,0,0,0,1,0|2,0,1]=4 496 B8R1.1 CC1=CNC(C=O)=N1 23109 [0,0,0,0,1,0|2,0,1]=4 497 B8R1.1 CC1=COC(C=O)=N1 P10997 [0,0,0,0,1,0|2,0,1]=4 498 B8R1.1 CC1=CSC(CCl)=N1 W16105 [0,0,0,0,1,0|2,0,0]=3 499 B8R1.1 CC1=CSC(CO)=N1 78422 [0,0,0,0,1,0|2,0,0]=3 500 B8R1.1 CC1=NC(C#N)=CS1 24243 [0,0,0,0,1,0|2,0,1]=4 501 B8R1.1 CC1=NC(CBr)=CS1 C76311 [0,0,0,0,1,0|2,0,0]=3 502 B8R1.1 CC1=NC(CBr)=NO1 F13555 [0,0,0,0,1,0|3,0,0]=4 503 B8R1.1 CC1=NC(CCl)=NO1 C71636 [0,0,0,0,1,0|3,0,0]=4 504 B8R1.1 CC1=NC(CN)=NO1 72162 [0,0,0,0,1,0|3,0,0]=4 505 B8R1.1 CC1=NC(CO)=CN1 22905 [0,0,0,0,1,0|2,0,0]=3 506 B8R1.1 CC1=NC=C(C#N)S1 F13465 [0,0,0,0,1,0|2,0,1]=4 507 B8R1.1 CC1=NC=C(C=O)O1 C10143 [0,0,0,0,1,0|2,0,1]=4 508 B8R1.1 CC1=NC=C(CBr)S1 F16665 [0,0,0,0,1,0|2,0,0]=3 509 B8R1.1 CC1=NC=C(CN)S1 72160 [0,0,0,0,1,0|2,0,0]=3 510 B8R1.1 CC1=NC=C(CN)S1 F14010 [0,0,0,0,1,0|2,0,0]=3 511 B8R1.1 CC1=NN=C(CN)N1 AT12331 [0,0,0,0,1,0|3,0,0]=4 512 B8R1.1 CC1=NN=C(CN)S1 F30252 [0,0,0,0,1,0|3,0,0]=4 513 B8R1.1 CC1=NN=C(CO)S1 F13044 [0,0,0,0,1,0|3,0,0]=4 514 B8R1.1 CC1=NNC(CO)=C1 71135 [0,0,0,0,1,0|2,0,0]=3 515 B8R1.1 CC1=NNC(CO)=N1 W19133 [0,0,0,0,1,0|3,0,0]=4 516 B8R1.1 CC1=NOC(CBr)=C1 C15689 [0,0,0,0,1,0|2,0,0]=3 517 B8R1.1 CC1=NOC(CN)=C1 20228 [0,0,0,0,1,0|2,0,0]=3 518 B8R1.1 CC1=NOC(CN)=N1 S10792 [0,0,0,0,1,0|3,0,0]=4 519 B8R1.1 CCC1=CC(N)=NO1 71263 [0,0,0,0,1,0|2,0,0]=3 520 B8R1.1 CCC1=CC(O)=NO1 AC2644 [0,0,0,0,1,0|2,0,0]=3 521 B8R1.1 CCC1=CC=C(C)O1 A12137 [0,0,0,0,1,0|1,0,0]=2 522 B8R1.1 CCC1=CN=C(N)S1 84403 [0,0,0,0,1,0|2,0,0]=3 523 B8R1.1 CCN1C=C(O)C=N1 AT11883 [0,0,0,0,1,0|3,0,0]=4 524 B8R1.1 CN1C=C(CCl)C=N1 71934 [0,0,0,0,1,0|2,0,0]=3 525 B8R1.1 CN1C=CC(C#N)=N1 35174 [0,0,0,0,1,0|2,0,1]=4 526 B8R1.1 CN1C=CC(C=O)=C1 AT16322 [0,0,0,0,1,0|2,0,1]=4 527 B8R1.1 CN1C=CC(CCl)=N1 33393 [0,0,0,0,1,0|2,0,0]=3 528 B8R1.1 CN1C=NC(CCl)=N1 29909 [0,0,0,0,1,0|3,0,0]=4 529 B8R1.1 CN1C=NC(CN)=C1 38318 [0,0,0,0,1,0|3,0,0]=4 530 B8R1.1 CN1C=NC(CN)=C1 82874 [0,0,0,0,1,0|3,0,0]=4 531 B8R1.1 CN1C=NC(CO)=N1 26175 [0,0,0,0,1,0|3,0,0]=4 532 B8R1.1 CNC1=CN(C)N=C1 S10801 [0,0,0,0,1,0|2,0,0]=3 533 B8R1.1 CNC1=CN(C)N=C1 W19310 [0,0,0,0,1,0|2,0,0]=3 534 B8R1.1 CNC1=NC(Br)=CS1 A11743 [0,0,0,0,1,0|3,0,0]=4 535 B8R1.1 CNC1=NC(C)=NS1 72649 [0,0,0,0,1,0|3,0,0]=4 536 B8R1.1 CNC1=NN=C(C)S1 71271 [0,0,0,0,1,0|3,0,0]=4 537 B8R1.1 CNC1=NOC(C)=C1 AT19776 [0,0,0,0,1,0|3,0,0]=4 538 B8R1.1 CSC1=CN=C(N)S1 C77378 [0,0,0,0,1,0|3,0,0]=4 539 B8R1.1 CSC1=NN=C(C)S1 D80857 [0,0,0,0,1,0|3,0,0]=4 540 B8R1.1 NC1=NNC(CO)=C1 P10905 [0,0,0,0,1,0|3,0,0]=4 541 B8R1.1 NCC1=CC(Cl)=CS1 P12197 [0,0,0,0,1,0|3,0,0]=4 542 B8R1.1 NCC1=CC=C(Br)S1 P15264 [0,0,0,0,1,0|3,0,0]=4 543 B8R1.1 NCC1=CC=C(Cl)S1 P10560 [0,0,0,0,1,0|3,0,0]=4 544 B8R1.1 NCC1=CN=C(Br)S1 C13963 [0,0,0,0,1,0|3,0,0]=4 545 B8R1.1 NCC1=CN=C(Br)S1 S11077 [0,0,0,0,1,0|3,0,0]=4 546 B8R1.1 NCC1=CSC(Br)=C1 P11133 [0,0,0,0,1,0|3,0,0]=4 547 B8R1.1 NCC1=NC(Br)=CS1 22984 [0,0,0,0,1,0|3,0,0]=4 548 B8R1.1 NCC1=NC(Br)=CS1 68978 [0,0,0,0,1,0|3,0,0]=4 549 B8R1.1 OCC1=CC(Br)=NO1 69279 [0,0,0,0,1,0|3,0,0]=4 550 B8R1.1 OCC1=CSC(Cl)=C1 37630 [0,0,0,0,1,0|3,0,0]=4 551 B7R1.3 BrC1=CN=NC=C1 85151 [2,0,0,0,0,0|2,0,0]=4 552 B7R1.3 BrC1=NC=NC=C1 54642 [2,0,0,0,0,0|2,0,0]=4 553 B7R1.3 BrC1=NC=NC=C1 54644 [2,0,0,0,0,0|2,0,0]=4 554 B7R1.3 CC1=NC=CN=N1 C74235 [2,0,0,0,0,0|2,0,0]=4 555 B7R1.3 ClC1=CN=CC=C1 P19758 [2,0,0,0,0,0|1,0,0]=3 556 B7R1.3 ClC1=NN=CC=C1 57588 [2,0,0,0,0,0|2,0,0]=4 557 B7R1.3 NC1=CC=CC=C1 T70935 [2,0,0,0,0,0|2,0,0]=4 558 B7R1.3 NC1=CC=CC=C1 T71037 [2,0,0,0,0,0|2,0,0]=4 559 B7R1.3 O=C1C=CNN=C1 D87946 [2,0,0,0,0,0|2,0,0]=4 560 B7R1.3 SC1=NC=CN=C1 F16108 [2,0,0,0,0,0|2,0,0]=4 561 B9R0.48 CCOC(=O)\C=C\C(C)=O 71109 [0,1,1,0,0,0|2,0,0]=4 562 B9R1.2 C#CC1=CC(Br)=CN=C1 50294 [1,1,0,0,0,0|0,0,2]=4 563 B9R1.2 C#CC1=CC(Cl)=CN=C1 C77589 [1,1,0,0,0,0|0,0,2]=4 564 B9R1.2 C=CC1=CC(Br)=CN=C1 50995 [1,1,0,0,0,0|0,0,2]=4 565 B9R1.2 C=CC1=CC(C)=CN=C1 79122 [1,1,0,0,0,0|0,0,2]=4 566 B9R1.2 CC1=CC(C#N)=CN=C1 71242 [1,1,0,0,0,0|1,0,1]=4 567 B9R1.2 CC1=CC(CO)=NN=C1 F30430 [1,1,0,0,0,0|2,0,0]=4 568 B9R1.2 CC1=CN=CC(CN)=C1 72799 [1,1,0,0,0,0|1,0,0]=3 569 B9R1.2 CCC1=CC(=O)NN=C1 S11511 [1,1,0,0,0,0|1,0,0]=3 570 B9R1.2 CCC1=CC(Br)=CN=C1 25835 [1,1,0,0,0,0|0,0,0]=2 571 B9R1.2 CCC1=CC=CC(Br)=N1 O10692 [1,1,0,0,0,0|2,0,0]=4 572 B9R1.2 CCC1=NC(C)=CN=C1 D84033 [1,1,0,0,0,0|1,0,0]=3 573 B9R1.2 CCC1=NC=CC(Br)=C1 S10560 [1,1,0,0,0,0|2,0,0]=4 574 B9R1.2 CNC1=CC(N)=CC=C1 36494 [1,1,0,0,0,0|2,0,0]=4 575 B9R1.2 CNC1=NC(C)=CN=C1 74811 [1,1,0,0,0,0|2,0,0]=4 576 B9R1.2 COC1=CC(Cl)=CN=N1 E70128 [1,1,0,0,0,0|2,0,0]=4 577 B9R1.2 COC1=NC(N)=CN=C1 24364 [1,1,0,0,0,0|2,0,0]=4 578 B9R1.2 CSC1=CC(F)=CC=C1 A12732 [1,1,0,0,0,0|2,0,0]=4 579 B9R1.2 CSC1=CC(O)=CC=C1 W12966 [1,1,0,0,0,0|2,0,0]=4 580 B9R1.2 CSC1=NC(N)=CN=C1 W17367 [1,1,0,0,0,0|2,0,0]=4 581 B9R1.2 N#CC1=CC(F)=CN=C1 82241 [1,1,0,0,0,0|1,0,1]=4 582 B9R1.2 NC1=CC(CO)=CN=C1 20770 [1,1,0,0,0,0|1,0,0]=3 583 B9R1.2 NC1=CC=CC(CF)=C1 32172 [1,1,0,0,0,0|2,0,0]=4 584 B9R1.2 NCC1=CC(Br)=CN=C1 Y14573 [1,1,0,0,0,0|1,0,0]=3 585 B9R1.2 NCC1=CC(Cl)=CN=C1 29807 [1,1,0,0,0,0|1,0,0]=3 586 B9R1.2 NCC1=CC=C[N+]([O-])=C1 W12624 [1,1,0,0,0,0|1,0,1]=4 587 B9R1.2 NCC1=CN=CC(Cl)=N1 P10985 [1,1,0,0,0,0|2,0,0]=4 588 B9R1.2 OCC1=CC(Cl)=CN=C1 26741 [1,1,0,0,0,0|1,0,0]=3 589 B9R1.2 OCC1=CN=CC(Br)=N1 N13194 [1,1,0,0,0,0|2,0,0]=4 590 B9R1.6 CC(=O)C1=NN=CC=C1 37064 [1,1,0,0,0,0|1,0,1]=4 591 B9R1.6 C[C@H](Cl)C1=NC=CC=C1 F13294 [1,1,0,0,0,0|2,0,0]=4 592 B9R1.6 C[C@H](N)C1=CC=CC=C1 D77753 [1,1,0,0,0,0|1,0,0]=3 593 B9R1.6 C[C@H](N)C1=CC=CN=C1 20316 [1,1,0,0,0,0|0,0,0]=2 594 B9R1.6 C[C@H](N)C1=CC=CN=C1 74003 [1,1,0,0,0,0|0,0,0]=2 595 B9R1.6 C[C@H](N)C1=CC=CN=C1 74005 [1,1,0,0,0,0|0,0,0]=2 596 B9R1.6 C[C@H](N)C1=CC=CN=C1 F31031 [1,1,0,0,0,0|0,0,0]=2 597 B9R1.6 C[C@H](N)C1=CC=CN=C1 F31032 [1,1,0,0,0,0|0,0,0]=2 598 B9R1.6 C[C@H](N)C1=CC=NC=C1 F31033 [1,1,0,0,0,0|2,0,0]=4 599 B9R1.6 C[C@H](N)C1=CC=NC=C1 N10538 [1,1,0,0,0,0|2,0,0]=4 600 B9R1.6 C[C@H](N)C1=CN=CN=C1 37059 [1,1,0,0,0,0|1,0,0]=3 601 B9R1.6 C[C@H](N)C1=CN=CN=C1 AT25773 [1,1,0,0,0,0|1,0,0]=3 602 B9R1.6 C[C@H](N)C1=CN=NC=C1 37052 [1,1,0,0,0,0|1,0,0]=3 603 B9R1.6 C[C@H](N)C1=NC=CN=C1 24931 [1,1,0,0,0,0|1,0,0]=3 604 B9R1.6 C[C@H](O)C1=NC=CC=C1 A11519 [1,1,0,0,0,0|2,0,0]=4 605 B9R1.6 C[C@H](O)C1=NC=CC=C1 C16040 [1,1,0,0,0,0|2,0,0]=4 606 B9R1.6 C[C@H](O)C1=NC=CN=C1 D82306 [1,1,0,0,0,0|1,0,0]=3 607 B9R1.8 BrCCC1=CC=NC=C1 C71689 [1,1,0,0,0,0|2,0,0]=4 608 B9R1.8 CCNC1=CC=CN=C1 C15578 [1,1,0,0,0,0|0,0,0]=2 609 B9R1.8 CNCC1=CC=NC=C1 AR1712 [1,1,0,0,0,0|2,0,0]=4 610 B9R1.8 CNCC1=CN=NC=C1 P16258 [1,1,0,0,0,0|1,0,0]=3 611 B9R1.8 ClCCC1=CC=NC=C1 O11064 [1,1,0,0,0,0|2,0,0]=4 612 B9R1.8 N#CCC1=CN=NC=C1 37056 [1,1,0,0,0,0|1,0,1]=4 613 B9R1.8 N#CCC1=NC=CN=C1 50051 [1,1,0,0,0,0|1,0,1]=4 614 B9R1.8 NCCC1=NC=CN=C1 AR1061 [1,1,0,0,0,0|1,0,0]=3 615 B9R1.8 NNCC1=CC=CN=C1 78930 [1,1,0,0,0,0|1,0,0]=3 616 B9R1.8 NNCC1=CN=CN=C1 37093 [1,1,0,0,0,0|2,0,0]=4 617 B9R1.8 NNCC1=NC=CN=C1 37235 [1,1,0,0,0,0|2,0,0]=4 618 B9R1.8 NOCC1=CN=CC=C1 AC6038 [1,1,0,0,0,0|1,0,0]=3 619 B9R1.8 OCCC1=CN=CN=C1 27368 [1,1,0,0,0,0|1,0,0]=3 620 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 C11398 [1,1,0,0,0,0|1,0,1]=4 621 B9R1.15 C#CC1=C(N)C=CN=C1 C71943 [1,1,0,0,0,0|0,0,2]=4 622 B9R1.15 C#CC1=CC=CN=C1F C77200 [1,1,0,0,0,0|0,0,2]=4 623 B9R1.15 C#CC1=CC=CN=C1O CS1686 [1,1,0,0,0,0|0,0,2]=4 624 B9R1.15 C=CC1=CC=CN=C1Br 83953 [1,1,0,0,0,0|0,0,2]=4 625 B9R1.15 C=CC1=CC=CN=C1C P11579 [1,1,0,0,0,0|0,0,2]=4 626 B9R1.15 CC1=C(C#N)C=CC=N1 AB2931 [1,1,0,0,0,0|1,0,1]=4 627 B9R1.15 CC1=C(CBr)C=CC=N1 F16424 [1,1,0,0,0,0|1,0,0]=3 628 B9R1.15 CC1=C(CCl)C=CC=N1 24248 [1,1,0,0,0,0|1,0,0]=3 629 B9R1.15 CC1=C(CCl)C=NC=C1 C72783 [1,1,0,0,0,0|1,0,0]=3 630 B9R1.15 CC1=C(CCl)C=NC=N1 F31172 [1,1,0,0,0,0|2,0,0]=4 631 B9R1.15 CC1=C(CO)C=NC=C1 38669 [1,1,0,0,0,0|1,0,0]=3 632 B9R1.15 CC1=NC=CC=C1CN 72802 [1,1,0,0,0,0|1,0,0]=3 633 B9R1.15 CC1=NC=CC=C1CN AB7634 [1,1,0,0,0,0|1,0,0]=3 634 B9R1.15 CC1=NC=CN=C1CCl P11784 [1,1,0,0,0,0|2,0,0]=4 635 B9R1.15 CC1=NC=CN=C1CN E70300 [1,1,0,0,0,0|2,0,0]=4 636 B9R1.15 CC1=NC=CN=C1CN P19746 [1,1,0,0,0,0|2,0,0]=4 637 B9R1.15 CC1=NC=CN=C1CO P10784 [1,1,0,0,0,0|2,0,0]=4 638 B9R1.15 CCC1=C(Br)C=CC=N1 P11641 [1,1,0,0,0,0|2,0,0]=4 639 B9R1.15 CCC1=C(Br)C=CN=C1 38064 [1,1,0,0,0,0|0,0,0]=2 640 B9R1.15 CCC1=C(F)C=CC=C1 F20938 [1,1,0,0,0,0|1,0,0]=3 641 B9R1.15 CCC1=C(O)C=CC=N1 71246 [1,1,0,0,0,0|2,0,0]=4 642 B9R1.15 CCC1=CC=CN=C1Br D80252 [1,1,0,0,0,0|0,0,0]=2 643 B9R1.15 CCC1=CC=CN=C1N 55791 [1,1,0,0,0,0|0,0,0]=2 644 B9R1.15 CCC1=CC=NN=C1Cl S11385 [1,1,0,0,0,0|1,0,0]=3 645 B9R1.15 CCC1=CC=NNC1=O S11452 [1,1,0,0,0,0|1,0,1]=4 646 B9R1.15 CCC1=NC=CN=C1N RB3385 [1,1,0,0,0,0|1,0,0]=3 647 B9R1.15 CCC1=NC=CNC1=O S12194 [1,1,0,0,0,0|1,0,1]=4 648 B9R1.15 CNC1=C(C)C=CN=C1 C12398 [1,1,0,0,0,0|1,0,0]=3 649 B9R1.15 CNC1=C(N)C=CN=C1 F51691 [1,1,0,0,0,0|1,0,0]=3 650 B9R1.15 CNC1=CC=CN=C1N 94808 [1,1,0,0,0,0|1,0,0]=3 651 B9R1.15 CNC1=NC=CN=C1N 25161 [1,1,0,0,0,0|2,0,0]=4 652 B9R1.15 COC1=C(Br)C=CN=C1 26564 [1,1,0,0,0,0|1,0,0]=3 653 B9R1.15 COC1=C(I)C=CN=C1 D82954 [1,1,0,0,0,0|1,0,0]=3 654 B9R1.15 COC1=C(N)C=CN=C1 35474 [1,1,0,0,0,0|1,0,0]=3 655 B9R1.15 COC1=CNC=NC1=O H10327 [1,1,0,0,0,0|2,0,0]=4 656 B9R1.15 COC1=NC=CN=C1Br 27717 [1,1,0,0,0,0|2,0,0]=4 657 B9R1.15 CSC1=C(F)N=CC=C1 F50785 [1,1,0,0,0,0|1,0,0]=3 658 B9R1.15 CSC1=C(N)C=CN=C1 W16024 [1,1,0,0,0,0|1,0,0]=3 659 B9R1.15 FC1=C(CBr)C=CC=N1 72213 [1,1,0,0,0,0|1,0,0]=3 660 B9R1.15 N#CC1=C(Br)C=CN=C1 55794 [1,1,0,0,0,0|1,0,1]=4 661 B9R1.15 NC1=C(CO)C=NC=C1 28348 [1,1,0,0,0,0|1,0,0]=3 662 B9R1.15 NCC1=C(Br)C=CN=C1 F30244 [1,1,0,0,0,0|1,0,0]=3 663 B9R1.15 NCC1=C(Cl)C=CN=C1 73185 [1,1,0,0,0,0|1,0,0]=3 664 B9R1.15 NCC1=C(I)C=CC=C1 C75019 [1,1,0,0,0,0|2,0,0]=4 665 B9R1.15 NCC1=CC=CN=C1Br D82416 [1,1,0,0,0,0|1,0,0]=3 666 B9R1.15 NCC1=CC=CN=C1Cl 51113 [1,1,0,0,0,0|1,0,0]=3 667 B9R1.15 NCC1=CC=CN=C1N 89358 [1,1,0,0,0,0|1,0,0]=3 668 B9R1.15 NCC1=CC=CN=C1O 55767 [1,1,0,0,0,0|1,0,0]=3 669 B9R1.15 NCC1=NC=CN=C1N AB3037 [1,1,0,0,0,0|2,0,0]=4 670 B9R1.15 O=C1NC=CC=C1CO P16012 [1,1,0,0,0,0|1,0,1]=4 671 B9R1.15 O=CC1=C(Br)C=CN=C1 P16584 [1,1,0,0,0,0|1,0,1]=4 672 B9R1.15 O=CC1=C(O)C=CN=C1 P10968 [1,1,0,0,0,0|1,0,1]=4 673 B9R1.15 OCC1=C(Br)C=CN=C1 71972 [1,1,0,0,0,0|1,0,0]=3 674 B9R1.15 OCC1=C(F)C=CN=C1 P15839 [1,1,0,0,0,0|1,0,0]=3 675 B9R1.15 OCC1=NC=CN=C1Cl 80497 [1,1,0,0,0,0|2,0,0]=4 676 B9R1.69 BrC1=CC(I)=C(Br)C=N1 53803 [1,1,0,0,0,0|2,0,0]=4 677 B9R1.69 CC1=C(Br)C=C(F)C=N1 22786 [1,1,0,0,0,0|1,0,0]=3 678 B9R1.69 CC1=C(Br)C=C(F)N=C1 C14400 [1,1,0,0,0,0|1,0,0]=3 679 B9R1.69 CC1=C(Br)C=C(N)N=C1 72100 [1,1,0,0,0,0|1,0,0]=3 680 B9R1.69 CC1=C(C)N=C(Br)C=N1 Y10500 [1,1,0,0,0,0|2,0,0]=4 681 B9R1.69 CC1=C(C)N=C(Cl)C=N1 Y10049 [1,1,0,0,0,0|2,0,0]=4 682 B9R1.69 CC1=C(C)N=C(Cl)N=C1 P17845 [1,1,0,0,0,0|2,0,0]=4 683 B9R1.69 CC1=C(C)N=C(N)C=C1 C75720 [1,1,0,0,0,0|1,0,0]=3 684 B9R1.69 CC1=C(C)N=C(O)C=N1 C75680 [1,1,0,0,0,0|2,0,0]=4 685 B9R1.69 CC1=C(Cl)C=C(N)N=C1 C71138 [1,1,0,0,0,0|1,0,0]=3 686 B9R1.69 CC1=C(Cl)C=C(O)C=N1 94607 [1,1,0,0,0,0|1,0,0]=3 687 B9R1.69 CC1=C(Cl)C=CC(Br)=N1 C16781 [1,1,0,0,0,0|2,0,0]=4 688 B9R1.69 CC1=C(Cl)C=CC(O)=N1 C10556 [1,1,0,0,0,0|2,0,0]=4 689 B9R1.69 CC1=C(Cl)C=NC(O)=C1 C76951 [1,1,0,0,0,0|2,0,0]=4 690 B9R1.69 CC1=C(F)C=C(Cl)C=C1 D77788 [1,1,0,0,0,0|2,0,0]=4 691 B9R1.69 CC1=C(F)C=C(N)C=N1 D70662 [1,1,0,0,0,0|1,0,0]=3 692 B9R1.69 CC1=C(I)C=C(N)N=C1 72489 [1,1,0,0,0,0|1,0,0]=3 693 B9R1.69 CC1=C(I)C=CC(F)=N1 22653 [1,1,0,0,0,0|2,0,0]=4 694 B9R1.69 CC1=C(I)C=NC(Br)=C1 I10152 [1,1,0,0,0,0|2,0,0]=4 695 B9R1.69 CC1=C(I)C=NC(F)=C1 22752 [1,1,0,0,0,0|2,0,0]=4 696 B9R1.69 CC1=C(N)NC(=O)N=C1 26036 [1,1,0,0,0,0|2,0,0]=4 697 B9R1.69 CC1=C(O)C=C(I)C=C1 D76555 [1,1,0,0,0,0|2,0,0]=4 698 B9R1.69 CC1=CC(=O)NN=C1C P11942 [1,1,0,0,0,0|2,0,0]=4 699 B9R1.69 CC1=CC(Br)=C(Br)C=N1 A51123 [1,1,0,0,0,0|1,0,0]=3 700 B9R1.69 CC1=CC(Br)=C(C)C=N1 N13082 [1,1,0,0,0,0|0,0,0]=2 701 B9R1.69 CC1=CC(Br)=C(C)N=C1 P10110 [1,1,0,0,0,0|0,0,0]=2 702 B9R1.69 CC1=CC(Br)=C(Cl)C=N1 P17115 [1,1,0,0,0,0|1,0,0]=3 703 B9R1.69 CC1=CC(Br)=C(Cl)C=N1 P17937 [1,1,0,0,0,0|1,0,0]=3 704 B9R1.69 CC1=CC(Br)=C(F)C=N1 C71771 [1,1,0,0,0,0|1,0,0]=3 705 B9R1.69 CC1=CC(Br)=C(O)C=N1 53715 [1,1,0,0,0,0|1,0,0]=3 706 B9R1.69 CC1=CC(Br)=CN=C1I I11229 [1,1,0,0,0,0|2,0,0]=4 707 B9R1.69 CC1=CC(C)=C(Br)C=N1 W18180 [1,1,0,0,0,0|1,0,0]=3 708 B9R1.69 CC1=CC(C)=NN=C1Cl 37531 [1,1,0,0,0,0|2,0,0]=4 709 B9R1.69 CC1=CC(C)=NNC1=O P10153 [1,1,0,0,0,0|2,0,0]=4 710 B9R1.69 CC1=CC(Cl)=C(Br)C=N1 39191 [1,1,0,0,0,0|1,0,0]=3 711 B9R1.69 CC1=CC(Cl)=C(C)C=N1 O11204 [1,1,0,0,0,0|0,0,0]=2 712 B9R1.69 CC1=CC(Cl)=C(F)C=N1 P20444 [1,1,0,0,0,0|1,0,0]=3 713 B9R1.69 CC1=CC(Cl)=C(F)N=C1 O10975 [1,1,0,0,0,0|1,0,0]=3 714 B9R1.69 CC1=CC(Cl)=C(N)C=N1 F52035 [1,1,0,0,0,0|1,0,0]=3 715 B9R1.69 CC1=CC(Cl)=NN=C1C 24353 [1,1,0,0,0,0|2,0,0]=4 716 B9R1.69 CC1=CC(F)=CN=C1N 27788 [1,1,0,0,0,0|2,0,0]=4 717 B9R1.69 CC1=CC(I)=C(Br)C=C1 T71407 [1,1,0,0,0,0|2,0,0]=4 718 B9R1.69 CC1=CC(I)=C(N)N=C1 I10161 [1,1,0,0,0,0|1,0,0]=3 719 B9R1.69 CC1=CC(I)=CN=C1Cl I10138 [1,1,0,0,0,0|2,0,0]=4 720 B9R1.69 CC1=CC(I)=CN=C1F A10643 [1,1,0,0,0,0|2,0,0]=4 721 B9R1.69 CC1=CC(N)=C(Br)C=N1 24320 [1,1,0,0,0,0|1,0,0]=3 722 B9R1.69 CC1=CC(N)=C(Cl)C=N1 AC2062 [1,1,0,0,0,0|1,0,0]=3 723 B9R1.69 CC1=CC(N)=C(F)C=N1 31394 [1,1,0,0,0,0|1,0,0]=3 724 B9R1.69 CC1=CC(N)=C(I)C=N1 C76714 [1,1,0,0,0,0|1,0,0]=3 725 B9R1.69 CC1=CC(O)=C(Br)C=N1 C72039 [1,1,0,0,0,0|1,0,0]=3 726 B9R1.69 CC1=CC(O)=CN=C1C W19117 [1,1,0,0,0,0|1,0,0]=3 727 B9R1.69 CC1=CC(O)=CN=C1Cl 25601 [1,1,0,0,0,0|2,0,0]=4 728 B9R1.69 CC1=CC(O)=CN=C1F BL009882 [1,1,0,0,0,0|2,0,0]=4 729 B9R1.69 CC1=CC(O)=CN=C1N 72099 [1,1,0,0,0,0|2,0,0]=4 730 B9R1.69 CC1=CC=C(Cl)NC1=O 78111 [1,1,0,0,0,0|1,0,1]=4 731 B9R1.69 CC1=CC=C(N)C(I)=N1 C71773 [1,1,0,0,0,0|1,0,0]=3 732 B9R1.69 CC1=CC=C(N)N=C1N N13200 [1,1,0,0,0,0|1,0,0]=3 733 B9R1.69 CC1=CC=C(O)C(Cl)=N1 35292 [1,1,0,0,0,0|1,0,0]=3 734 B9R1.69 CC1=CN=C(Br)C=C1Br F11640 [1,1,0,0,0,0|1,0,0]=3 735 B9R1.69 CC1=CN=C(Br)C=C1Cl F11669 [1,1,0,0,0,0|1,0,0]=3 736 B9R1.69 CC1=CN=C(Br)C=C1F D70629 [1,1,0,0,0,0|1,0,0]=3 737 B9R1.69 CC1=CN=C(Br)C=C1N 79079 [1,1,0,0,0,0|1,0,0]=3 738 B9R1.69 CC1=CN=C(C)C(I)=N1 W18438 [1,1,0,0,0,0|1,0,0]=3 739 B9R1.69 CC1=CN=C(C)C(N)=C1 P11581 [1,1,0,0,0,0|0,0,0]=2 740 B9R1.69 CC1=CN=C(C)C(N)=N1 26305 [1,1,0,0,0,0|1,0,0]=3 741 B9R1.69 CC1=CN=C(C)C=C1N W13730 [1,1,0,0,0,0|0,0,0]=2 742 B9R1.69 CC1=CN=C(C)N=C1Cl C16332 [1,1,0,0,0,0|1,0,0]=3 743 B9R1.69 CC1=CN=C(C)N=C1N 32026 [1,1,0,0,0,0|1,0,0]=3 744 B9R1.69 CC1=CN=C(Cl)C(Br)=N1 D79794 [1,1,0,0,0,0|2,0,0]=4 745 B9R1.69 CC1=CN=C(Cl)C(Cl)=N1 O10568 [1,1,0,0,0,0|2,0,0]=4 746 B9R1.69 CC1=CN=C(Cl)C(N)=N1 N13219 [1,1,0,0,0,0|2,0,0]=4 747 B9R1.69 CC1=CN=C(Cl)C(O)=C1 C77105 [1,1,0,0,0,0|1,0,0]=3 748 B9R1.69 CC1=CN=C(F)C(O)=C1 79064 [1,1,0,0,0,0|1,0,0]=3 749 B9R1.69 CC1=CN=C(F)C=C1N D83156 [1,1,0,0,0,0|1,0,0]=3 750 B9R1.69 CC1=CN=C(I)C(C)=C1 72078 [1,1,0,0,0,0|1,0,0]=3 751 B9R1.69 CC1=CN=C(I)C(C)=N1 D71968 [1,1,0,0,0,0|2,0,0]=4 752 B9R1.69 CC1=CN=C(N)C(=O)N1 C75150 [1,1,0,0,0,0|2,0,0]=4 753 B9R1.69 CC1=CN=C(N)C(C)=C1 S10186 [1,1,0,0,0,0|1,0,0]=3 754 B9R1.69 CC1=CN=C(N)C=C1C F18079 [1,1,0,0,0,0|1,0,0]=3 755 B9R1.69 CC1=CN=C(N)N=C1Br O11187 [1,1,0,0,0,0|2,0,0]=4 756 B9R1.69 CC1=CN=C(N)N=C1O F19190 [1,1,0,0,0,0|2,0,0]=4 757 B9R1.69 CC1=C[N+]([O-])=C(Br)C=C1 24827 [1,1,0,0,0,0|1,0,1]=4 758 B9R1.69 CC1=C[N+]([O-])=C(Cl)C=C1 74280 [1,1,0,0,0,0|1,0,1]=4 759 B9R1.69 CC1=NC(C)=C(Br)C=N1 S10258 [1,1,0,0,0,0|2,0,0]=4 760 B9R1.69 CC1=NC(C)=C(Cl)C=N1 AT11427 [1,1,0,0,0,0|2,0,0]=4 761 B9R1.69 CC1=NC(C)=C(O)C=N1 72557 [1,1,0,0,0,0|2,0,0]=4 762 B9R1.69 CC1=NC(Cl)=C(Br)C=N1 P11032 [1,1,0,0,0,0|2,0,0]=4 763 B9R1.69 CC1=NC(N)=C(Br)C=N1 C74246 [1,1,0,0,0,0|2,0,0]=4 764 B9R1.69 CC1=NC(N)=C(Cl)C=N1 C75179 [1,1,0,0,0,0|2,0,0]=4 765 B9R1.69 CC1=NC(N)=C(F)C=N1 C72634 [1,1,0,0,0,0|2,0,0]=4 766 B9R1.69 CC1=NC(N)=C(I)C=C1 65855 [1,1,0,0,0,0|1,0,0]=3 767 B9R1.69 CC1=NC(N)=C(O)C=C1 25163 [1,1,0,0,0,0|1,0,0]=3 768 B9R1.69 CC1=NC(O)=C(Br)C=N1 25539 [1,1,0,0,0,0|2,0,0]=4 769 B9R1.69 CC1=NC(O)=C(Cl)C=N1 I11731 [1,1,0,0,0,0|2,0,0]=4 770 B9R1.69 CC1=NC(O)=C(F)C=N1 25762 [1,1,0,0,0,0|2,0,0]=4 771 B9R1.69 CC1=NC=C(Br)C=C1O 24970 [1,1,0,0,0,0|1,0,0]=3 772 B9R1.69 CC1=NC=C(Cl)N=C1Cl 84118 [1,1,0,0,0,0|2,0,0]=4 773 B9R1.69 CC1=NC=C(F)C=C1N D96784 [1,1,0,0,0,0|1,0,0]=3 774 B9R1.69 CC1=NC=C(N)N=C1Br Y10498 [1,1,0,0,0,0|2,0,0]=4 775 B9R1.69 CC1=NN=C(Cl)C=C1Cl D82608 [1,1,0,0,0,0|2,0,0]=4 776 B9R1.69 CC1=NNC(=O)C(Br)=C1 22926 [1,1,0,0,0,0|2,0,0]=4 777 B9R1.69 CC1=NNC(=O)C(N)=C1 P10094 [1,1,0,0,0,0|2,0,0]=4 778 B9R1.69 CN1C=CC(Cl)=NC1=O AC9729 [1,1,0,0,0,0|2,0,0]=4 779 B9R1.69 CN1C=CC(N)=NC1=O CS1032 [1,1,0,0,0,0|2,0,0]=4 780 B9R1.69 CN1C=NC(Cl)=CC1=O 26623 [1,1,0,0,0,0|2,0,0]=4 781 B9R1.69 CN1N=CC(I)=CC1=O P13043 [1,1,0,0,0,0|2,0,0]=4 782 B9R1.69 ClC1=CC(Br)=C(Br)C=N1 D75402 [1,1,0,0,0,0|2,0,0]=4 783 B9R1.69 ClC1=CC(Br)=C(Cl)C=N1 36009 [1,1,0,0,0,0|2,0,0]=4 784 B9R1.69 ClC1=CC(Br)=NC=C1Br C71140 [1,1,0,0,0,0|2,0,0]=4 785 B9R1.69 ClC1=CC(I)=CN=C1Cl P10789 [1,1,0,0,0,0|2,0,0]=4 786 B9R1.69 ClC1=CN=C(Br)C=C1Cl C71139 [1,1,0,0,0,0|2,0,0]=4 787 B9R1.69 ClC1=CN=C(I)C(Br)=C1 F31146 [1,1,0,0,0,0|2,0,0]=4 788 B9R1.69 ClC1=NC=C(I)C=C1Br I11218 [1,1,0,0,0,0|2,0,0]=4 789 B9R1.69 FC1=C(Br)C=C(Cl)N=C1 22600 [1,1,0,0,0,0|2,0,0]=4 790 B9R1.69 FC1=C(Br)C=CC(I)=N1 80855 [1,1,0,0,0,0|2,0,0]=4 791 B9R1.69 FC1=C(Br)C=NC(Cl)=C1 O11361 [1,1,0,0,0,0|2,0,0]=4 792 B9R1.69 FC1=C(Cl)N=C(Br)C=C1 P18746 [1,1,0,0,0,0|2,0,0]=4 793 B9R1.69 FC1=C(I)C=C(Br)C=N1 A51189 [1,1,0,0,0,0|2,0,0]=4 794 B9R1.69 FC1=C(I)C=C(Cl)C=N1 FD10647 [1,1,0,0,0,0|2,0,0]=4 795 B9R1.69 FC1=C(I)C=CC(Cl)=N1 D73177 [1,1,0,0,0,0|2,0,0]=4 796 B9R1.69 FC1=C(I)C=NC(Cl)=C1 W11410 [1,1,0,0,0,0|2,0,0]=4 797 B9R1.69 FC1=CC(Br)=C(F)C=N1 W17979 [1,1,0,0,0,0|2,0,0]=4 798 B9R1.69 FC1=CC(Br)=C(F)N=C1 P11496 [1,1,0,0,0,0|2,0,0]=4 799 B9R1.69 FC1=CC(Br)=CN=C1I 89502 [1,1,0,0,0,0|2,0,0]=4 800 B9R1.69 FC1=CC(Cl)=C(F)C=N1 C76731 [1,1,0,0,0,0|2,0,0]=4 801 B9R1.69 FC1=CC(Cl)=CN=C1I 90322 [1,1,0,0,0,0|2,0,0]=4 802 B9R1.69 FC1=CC(F)=C(I)C=N1 FD10678 [1,1,0,0,0,0|2,0,0]=4 803 B9R1.69 FC1=CC(I)=CN=C1F C76730 [1,1,0,0,0,0|2,0,0]=4 804 B9R1.69 FC1=CC=C(Cl)N=C1I F12266 [1,1,0,0,0,0|2,0,0]=4 805 B9R1.69 FC1=CC=C(F)C(Br)=N1 P17349 [1,1,0,0,0,0|2,0,0]=4 806 B9R1.69 FC1=CC=C(F)C(F)=N1 P15955 [1,1,0,0,0,0|2,0,0]=4 807 B9R1.69 FC1=CN=C(Br)C=C1Br N11824 [1,1,0,0,0,0|2,0,0]=4 808 B9R1.69 FC1=CN=C(Cl)C=C1Cl F30640 [1,1,0,0,0,0|2,0,0]=4 809 B9R1.69 FC1=NC(Cl)=C(Br)C=C1 F30308 [1,1,0,0,0,0|2,0,0]=4 810 B9R1.69 NC1=C(Br)C=C(F)N=C1 D79622 [1,1,0,0,0,0|2,0,0]=4 811 B9R1.69 NC1=C(Br)C=C(O)C=N1 AC2117 [1,1,0,0,0,0|2,0,0]=4 812 B9R1.69 NC1=C(Br)C=CC(Br)=N1 AC1724 [1,1,0,0,0,0|2,0,0]=4 813 B9R1.69 NC1=C(Br)C=CC(F)=N1 33206 [1,1,0,0,0,0|2,0,0]=4 814 B9R1.69 NC1=C(Br)C=NC(Cl)=C1 22670 [1,1,0,0,0,0|2,0,0]=4 815 B9R1.69 NC1=C(Br)C=NC(F)=C1 37637 [1,1,0,0,0,0|2,0,0]=4 816 B9R1.69 NC1=C(F)C=CC(Br)=N1 S10296 [1,1,0,0,0,0|2,0,0]=4 817 B9R1.69 NC1=C(F)C=CC(F)=N1 C10743 [1,1,0,0,0,0|2,0,0]=4 818 B9R1.69 NC1=C(F)N=C(Br)C=C1 F20849 [1,1,0,0,0,0|2,0,0]=4 819 B9R1.69 NC1=C(F)N=C(I)C=C1 80825 [1,1,0,0,0,0|2,0,0]=4 820 B9R1.69 NC1=C(I)C=C(Cl)N=C1 C15647 [1,1,0,0,0,0|2,0,0]=4 821 B9R1.69 NC1=C(I)C=NC(Br)=C1 W15293 [1,1,0,0,0,0|2,0,0]=4 822 B9R1.69 NC1=C(O)C=CC(Cl)=N1 83945 [1,1,0,0,0,0|2,0,0]=4 823 B9R1.69 NC1=CC(Br)=C(Br)C=N1 27104 [1,1,0,0,0,0|2,0,0]=4 824 B9R1.69 NC1=CC(Br)=C(I)C=N1 36509 [1,1,0,0,0,0|2,0,0]=4 825 B9R1.69 NC1=CC(Br)=NC=C1Br F31109 [1,1,0,0,0,0|2,0,0]=4 826 B9R1.69 NC1=CC(Br)=NC=C1F S10141 [1,1,0,0,0,0|2,0,0]=4 827 B9R1.69 NC1=CC(Br)=NC=C1O AC2756 [1,1,0,0,0,0|2,0,0]=4 828 B9R1.69 NC1=CC(Cl)=NC=C1O C14679 [1,1,0,0,0,0|2,0,0]=4 829 B9R1.69 NC1=CC(F)=C(Cl)C=N1 C72569 [1,1,0,0,0,0|2,0,0]=4 830 B9R1.69 NC1=CC(F)=C(F)C=N1 82058 [1,1,0,0,0,0|2,0,0]=4 831 B9R1.69 NC1=CC(F)=C(I)C=N1 C73286 [1,1,0,0,0,0|2,0,0]=4 832 B9R1.69 NC1=CC(F)=CN=C1Br 22580 [1,1,0,0,0,0|2,0,0]=4 833 B9R1.69 NC1=CC(F)=CN=C1Cl 28131 [1,1,0,0,0,0|2,0,0]=4 834 B9R1.69 NC1=CC(F)=NC=C1F F31110 [1,1,0,0,0,0|2,0,0]=4 835 B9R1.69 NC1=CC(I)=C(Cl)C=N1 56810 [1,1,0,0,0,0|2,0,0]=4 836 B9R1.69 NC1=CC(I)=C(F)C=N1 P15421 [1,1,0,0,0,0|2,0,0]=4 837 B9R1.69 NC1=CC(N)=C(Br)C=N1 26611 [1,1,0,0,0,0|2,0,0]=4 838 B9R1.69 NC1=CC=C(Br)C(I)=N1 76247 [1,1,0,0,0,0|2,0,0]=4 839 B9R1.69 NC1=CC=C(Br)N=C1I C77125 [1,1,0,0,0,0|2,0,0]=4 840 B9R1.69 NC1=CC=C(Cl)N=C1I 75745 [1,1,0,0,0,0|2,0,0]=4 841 B9R1.69 NC1=CC=C(F)C(Br)=N1 84492 [1,1,0,0,0,0|2,0,0]=4 842 B9R1.69 NC1=CC=C(F)N=C1F F30297 [1,1,0,0,0,0|2,0,0]=4 843 B9R1.69 NC1=CC=C(N)C(Br)=N1 D70612 [1,1,0,0,0,0|2,0,0]=4 844 B9R1.69 NC1=CN=C(Br)C(Br)=C1 25893 [1,1,0,0,0,0|2,0,0]=4 845 B9R1.69 NC1=CN=C(Br)C=C1N CS1476 [1,1,0,0,0,0|2,0,0]=4 846 B9R1.69 NC1=CN=C(Cl)C(F)=C1 W12189 [1,1,0,0,0,0|2,0,0]=4 847 B9R1.69 NC1=CN=C(Cl)C(N)=C1 C75644 [1,1,0,0,0,0|2,0,0]=4 848 B9R1.69 NC1=CN=C(Cl)C=C1F P12282 [1,1,0,0,0,0|2,0,0]=4 849 B9R1.69 NC1=CN=C(Cl)C=C1O O11344 [1,1,0,0,0,0|2,0,0]=4 850 B9R1.69 NC1=CN=C(F)C(F)=C1 W12191 [1,1,0,0,0,0|2,0,0]=4 851 B9R1.69 NC1=CN=C(F)C=C1F D82706 [1,1,0,0,0,0|2,0,0]=4 852 B9R1.69 NC1=CN=C(F)C=C1N CS1368 [1,1,0,0,0,0|2,0,0]=4 853 B9R1.69 NC1=CN=C(N)C=C1N H10391 [1,1,0,0,0,0|2,0,0]=4 854 B9R1.69 NC1=NC(Cl)=C(I)C=C1 W17873 [1,1,0,0,0,0|2,0,0]=4 855 B9R1.69 NC1=NC(F)=C(Cl)C=C1 Y14647 [1,1,0,0,0,0|2,0,0]=4 856 B9R1.69 NC1=NC(N)=C(I)C=C1 71808 [1,1,0,0,0,0|2,0,0]=4 857 B9R1.69 NC1=NC=C(F)C=C1O F12177 [1,1,0,0,0,0|2,0,0]=4 858 B9R1.69 OC1=C(F)C=C(F)C=N1 W17865 [1,1,0,0,0,0|2,0,0]=4 859 B9R1.69 OC1=C(F)N=C(Br)C=C1 96388 [1,1,0,0,0,0|2,0,0]=4 860 B9R1.69 OC1=C(I)C=C(Cl)N=C1 W12390 [1,1,0,0,0,0|2,0,0]=4 861 B9R1.69 OC1=CC(Br)=C(F)N=C1 O11382 [1,1,0,0,0,0|2,0,0]=4 862 B9R1.69 OC1=CC(Br)=CN=C1Br C76772 [1,1,0,0,0,0|2,0,0]=4 863 B9R1.69 OC1=CC(Cl)=C(Cl)C=N1 29162 [1,1,0,0,0,0|2,0,0]=4 864 B9R1.69 OC1=CC(Cl)=C(F)N=C1 RB1108 [1,1,0,0,0,0|2,0,0]=4 865 B9R1.69 OC1=CC(Cl)=CN=C1F RB1101 [1,1,0,0,0,0|2,0,0]=4 866 B9R1.69 OC1=CC(F)=CN=C1Br 79185 [1,1,0,0,0,0|2,0,0]=4 867 B9R1.69 OC1=CC(F)=CN=C1Cl Y10122 [1,1,0,0,0,0|2,0,0]=4 868 B9R1.69 OC1=CC(I)=C(Cl)C=N1 W17867 [1,1,0,0,0,0|2,0,0]=4 869 B9R1.69 OC1=CC(I)=C(F)C=N1 W16947 [1,1,0,0,0,0|2,0,0]=4 870 B9R1.69 OC1=CC=C(Cl)C(Cl)=N1 S10252 [1,1,0,0,0,0|2,0,0]=4 871 B9R1.69 OC1=CC=C(Cl)N=C1Cl 81828 [1,1,0,0,0,0|2,0,0]=4 872 B9R1.69 OC1=CN=C(Br)C(Cl)=C1 68808 [1,1,0,0,0,0|2,0,0]=4 873 B9R1.69 OC1=CN=C(F)C=C1F 70871 [1,1,0,0,0,0|2,0,0]=4 874 B9R1.69 OC1=NC(F)=C(Br)C=C1 C14402 [1,1,0,0,0,0|2,0,0]=4 875 B9R1.69 OC1=NC(F)=C(I)C=C1 F11075 [1,1,0,0,0,0|2,0,0]=4 876 B9R1.7 CC1=CC=C(CCN)S1 29986 [0,1,0,0,1,0|1,0,0]=3 877 B9R1.7 CC1=CC=C(CCO)O1 F16227 [0,1,0,0,1,0|1,0,0]=3 878 B9R1.7 CC1=NC(CCN)=NO1 72552 [0,1,0,0,1,0|2,0,0]=4 879 B9R1.7 CCCC1=NC(I)=CN1 W16409 [0,1,0,0,1,0|2,0,0]=4 880 B9R1.7 CCC[N+]1=CN(C)C=C1 D70791 [0,1,0,0,1,0|2,0,0]=4 881 B9R1.7 CCOC1=CC(N)=NO1 31468 [0,1,0,0,1,0|2,0,0]=4 882 B9R1.7 CN1C=C(CCN)C=N1 AC1366 [0,1,0,0,1,0|1,0,0]=3 883 B9R1.7 CN1C=CC(CNN)=N1 P18046 [0,1,0,0,1,0|2,0,0]=4 884 B9R1.7 CN1C=NC(CCN)=C1 P10213 [0,1,0,0,1,0|2,0,0]=4 885 B9R1.7 COCC1=CC(N)=NN1 P13383 [0,1,0,0,1,0|2,0,0]=4 886 B9R1.7 NC1=NNC(CCO)=C1 F52237 [0,1,0,0,1,0|2,0,0]=4 887 B9R1.7 NCCC1=CC(Br)=CS1 AC3072 [0,1,0,0,1,0|2,0,0]=4 888 B9R1.21 CCC1=CSC(C=O)=N1 H10618 [0,1,0,0,1,0|1,0,1]=4 889 B9R1.21 CCC1=NOC(CO)=C1 D78962 [0,1,0,0,1,0|2,0,0]=4 890 B9R1.21 CCN1C=C(CO)C=N1 71382 [0,1,0,0,1,0|2,0,0]=4 891 B9R1.21 CCN1C=NC(C=O)=C1 AT15572 [0,1,0,0,1,0|1,0,1]=4 892 B9R1.21 CSC1=CC=C(CO)O1 D93647 [0,1,0,0,1,0|2,0,0]=4 893 B9R1.21 OCC1=CC(CO)=NN1 F11497 [0,1,0,0,1,0|2,0,0]=4 894 B9R1.22 CC1=NC(Br)=C(CBr)S1 C73419 [0,1,0,0,1,0|2,0,0]=4 895 B9R1.22 CC1=NC(C)=C(CN)S1 72289 [0,1,0,0,1,0|2,0,0]=4 896 B9R1.22 CC1=NC(C)=C(CO)S1 71413 [0,1,0,0,1,0|2,0,0]=4 897 B9R1.22 CC1=NC(CO)=C(Br)S1 W18069 [0,1,0,0,1,0|2,0,0]=4 898 B9R1.22 CC1=NC(CO)=C(C)O1 S11075 [0,1,0,0,1,0|2,0,0]=4 899 B9R1.22 CC1=NN(C)C(CCl)=C1 W10400 [0,1,0,0,1,0|2,0,0]=4 900 B9R1.22 CC1=NN(C)C(CN)=C1 P10233 [0,1,0,0,1,0|2,0,0]=4 901 B9R1.22 CN1C=C(F)C(CO)=N1 97595 [0,1,0,0,1,0|2,0,0]=4 902 B9R1.22 COC1=NN(C)C=C1Br P17795 [0,1,0,0,1,0|2,0,0]=4 903 B9R1.22 COC1=NN(C)C=C1N 72943 [0,1,0,0,1,0|2,0,0]=4 904 B9R1.22 COC1=NN(C)C=C1N P19123 [0,1,0,0,1,0|2,0,0]=4 905 B9R1.23 CC1=C(C)SC(CO)=N1 S11102 [0,1,0,0,1,0|2,0,0]=4 906 B9R1.23 CC1=CC(CCl)=NN1C 38503 [0,1,0,0,1,0|2,0,0]=4 907 B9R1.23 CCC1=NC(C)=C(Br)S1 C76798 [0,1,0,0,1,0|1,0,0]=3 908 B9R1.23 CCN1C=C(C)C(N)=N1 P18700 [0,1,0,0,1,0|2,0,0]=4 909 B9R1.23 CCN1C=C(N)C(C)=N1 D79752 [0,1,0,0,1,0|1,0,0]=3 910 B9R1.35 CC(=O)C1=CNC(C)=C1 C75858 [0,1,0,0,1,0|0,0,2]=4 911 B9R1.35 CC(=O)C1=CSC(C)=N1 A12305 [0,1,0,0,1,0|1,0,1]=4 912 B9R1.35 CC(=O)C1=NC(C)=CO1 36487 [0,1,0,0,1,0|1,0,1]=4 913 B9R1.35 CC(=O)C1=NN(C)C=C1 P10302 [0,1,0,0,1,0|1,0,1]=4 914 B9R1.35 CC(C)C1=CN=C(Br)S1 27295 [0,1,0,0,1,0|2,0,0]=4 915 B9R1.35 CC(C)C1=CN=C(N)S1 84416 [0,1,0,0,1,0|2,0,0]=4 916 B9R1.35 CC(C)C1=CSC(N)=N1 29941 [0,1,0,0,1,0|2,0,0]=4 917 B9R1.35 CC(C)N1C=CC(O)=N1 79210 [0,1,0,0,1,0|2,0,0]=4 918 B9R1.35 CC1=CNC(C(C)C)=N1 F31131 [0,1,0,0,1,0|1,0,0]=3 919 B9R1.35 CC1=NN=C(C(C)C)N1 A12905 [0,1,0,0,1,0|2,0,0]=4 920 B9R1.35 CC1=NOC([C@H](C)N)=N1 70858 [0,1,0,0,1,0|2,0,0]=4 921 B9R1.35 CC1=NOC([C@H](C)N)=N1 70930 [0,1,0,0,1,0|2,0,0]=4 922 B9R1.35 C[C@H](N)C1=CC(Br)=CS1 D81119 [0,1,0,0,1,0|2,0,0]=4 923 B9R1.35 C[C@H](N)C1=CC=C(Br)O1 Y11515 [0,1,0,0,1,0|2,0,0]=4 924 B9R1.35 C[C@H](N)C1=CC=C(Br)O1 Y13452 [0,1,0,0,1,0|2,0,0]=4 925 B9R1.35 C[C@H](N)C1=CN(C)N=C1 79129 [0,1,0,0,1,0|1,0,0]=3 926 B9R1.35 C[C@H](N)C1=CN(C)N=C1 P10329 [0,1,0,0,1,0|1,0,0]=3 927 B9R1.35 C[C@H](O)C1=CSC(Cl)=C1 38491 [0,1,0,0,1,0|2,0,0]=4 928 B9R1.132 CCC1=C(Cl)C(N)=NN1 W19615 [0,1,0,0,1,0|2,0,0]=4 929 B9R1.132 CN1N=CC(CO)=C1Br 97715 [0,1,0,0,1,0|2,0,0]=4 930 B9R1.132 CN1N=CC(CO)=C1Cl W16169 [0,1,0,0,1,0|2,0,0]=4 931 B11R1.1 C=CCCC1=CC=C(Br)C=C1 VT1222 [0,2,0,0,0,0|2,0,0]=4 932 B11R1.1 C=CCCC1=CC=C(O)C=C1 AC1840 [0,2,0,0,0,0|2,0,0]=4 933 B11R1.1 CC1=NC=C(CCCN)C=C1 73040 [0,2,0,0,0,0|0,0,0]=2 934 B11R1.1 CCCNC1=NN=C(Cl)C=C1 A12954 [0,2,0,0,0,0|2,0,0]=4 935 B11R1.1 CCNCC1=CC=C(C)C=C1 78307 [0,2,0,0,0,0|1,0,0]=3 936 B11R1.1 CCNCC1=CC=C(N)C=C1 AC1810 [0,2,0,0,0,0|2,0,0]=4 937 B11R1.1 CCNCC1=CC=C(O)C=C1 31967 [0,2,0,0,0,0|2,0,0]=4 938 B11R1.1 CCNCC1=CN=C(Cl)C=C1 F11983 [0,2,0,0,0,0|1,0,0]=3 939 B11R1.1 CCOCC1=CC=C(Br)C=C1 W19177 [0,2,0,0,0,0|2,0,0]=4 940 B11R1.1 CCOCC1=CC=C(O)C=C1 27758 [0,2,0,0,0,0|2,0,0]=4 941 B11R1.1 CCOCC1=CN=C(Cl)C=C1 D73333 [0,2,0,0,0,0|1,0,0]=3 942 B11R1.1 CNCCC1=CC=C(N)C=C1 76010 [0,2,0,0,0,0|2,0,0]=4 943 B11R1.1 ClCCOC1=CC=C(Cl)C=C1 C72197 [0,2,0,0,0,0|2,0,0]=4 944 B11R1.1 FC1=CC=C(CCCBr)C=C1 AB8466 [0,2,0,0,0,0|2,0,0]=4 945 B11R1.1 FC1=CC=C(CCCI)C=C1 AC3098 [0,2,0,0,0,0|2,0,0]=4 946 B11R1.1 N#CCCC1=CC=C(Br)C=C1 O10869 [0,2,0,0,0,0|2,0,0]=4 947 B11R1.1 NCCCC1=CC=C(F)C=C1 C72058 [0,2,0,0,0,0|2,0,0]=4 948 B11R1.1 O=CCCC1=CC=C(Br)C=C1 29444 [0,2,0,0,0,0|2,0,0]=4 949 B11R1.1 O=CCCC1=CC=C(Cl)C=C1 AB6893 [0,2,0,0,0,0|2,0,0]=4 950 B11R1.1 O=CCCC1=CC=C(O)C=C1 F19751 [0,2,0,0,0,0|2,0,0]=4 951 B11R1.1 OCCOC1=CC=C(Br)C=C1 AC1411 [0,2,0,0,0,0|2,0,0]=4 952 B11R1.20 CC(=O)NC1=CN=C(C)C=C1 N16920 [0,2,0,0,0,0|0,0,1]=3 953 B11R1.20 CC(=O)NC1=CN=C(O)C=C1 C75099 [0,2,0,0,0,0|1,0,1]=4 954 B11R1.20 CC(C)NC1=CC=C(F)C=C1 22289 [0,2,0,0,0,0|2,0,0]=4 955 B11R1.20 CC(C)OC1=CN=C(Cl)C=C1 C71698 [0,2,0,0,0,0|1,0,0]=3 956 B11R1.20 CC(C)OC1=NN=C(Cl)C=C1 AT23121 [0,2,0,0,0,0|2,0,0]=4 957 B11R1.20 CC(C)OC1=NN=C(I)C=C1 C73322 [0,2,0,0,0,0|2,0,0]=4 958 B11R1.20 CC(C)SC1=CC=C(Br)C=C1 AT20955 [0,2,0,0,0,0|2,0,0]=4 959 B11R1.20 CC1=CC=C(C[C@H](C)N)C=C1 N10874 [0,2,0,0,0,0|1,0,0]=3 960 B11R1.20 CC1=CN=C(OC(C)C)C=C1 W12584 [0,2,0,0,0,0|2,0,0]=4 961 B11R1.20 C[C@H](N)CC1=CC=C(Br)C=C1 84989 [0,2,0,0,0,0|2,0,0]=4 962 B11R1.20 C[C@H](N)CC1=CC=C(Br)C=C1 Y14838 [0,2,0,0,0,0|2,0,0]=4 963 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 N11301 [0,2,0,0,0,0|2,0,0]=4 964 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 N11302 [0,2,0,0,0,0|2,0,0]=4 965 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 Y11173 [0,2,0,0,0,0|2,0,0]=4 966 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 Y11623 [0,2,0,0,0,0|2,0,0]=4 967 B11R1.20 C[C@H](N)CC1=CC=C(O)C=C1 84990 [0,2,0,0,0,0|2,0,0]=4 968 B11R1.20 C[C@H](O)CC1=CC=C(F)C=C1 C75202 [0,2,0,0,0,0|2,0,0]=4 969 B11R1.20 FC(F)OC1=CN=C(Cl)C=C1 33633 [0,2,0,0,0,0|2,0,0]=4 970 B11R1.20 NC(=O)CC1=CN=C(Cl)C=C1 84999 [0,2,0,0,0,0|1,0,1]=4 971 B11R1.20 NC1=NC=C(CC(=O)O)C=C1 F18175 [0,2,0,0,0,0|1,0,1]=4 972 B11R1.22 CC1=CC=C(C(=O)CCl)C=C1 D93745 [0,2,0,0,0,0|1,0,1]=4 973 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 D81498 [0,2,0,0,0,0|1,0,0]=3 974 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 N10531 [0,2,0,0,0,0|1,0,0]=3 975 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 N11058 [0,2,0,0,0,0|1,0,0]=3 976 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 N11096 [0,2,0,0,0,0|1,0,0]=3 977 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 Y10547 [0,2,0,0,0,0|1,0,0]=3 978 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 Y13360 [0,2,0,0,0,0|1,0,0]=3 979 B11R1.22 CC1=NC=C([C@@H](N)CO)C=C1 N11363 [0,2,0,0,0,0|0,0,0]=2 980 B11R1.22 CC1=NC=C([C@@H](N)CO)C=C1 Y11568 [0,2,0,0,0,0|0,0,0]=2 981 B11R1.22 CC1=NC=C([C@@H](N)CO)C=C1 Y13394 [0,2,0,0,0,0|0,0,0]=2 982 B11R1.22 CCC(=O)C1=CN=C(Cl)C=C1 F13171 [0,2,0,0,0,0|1,0,0]=3 983 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 F16933 [0,2,0,0,0,0|2,0,0]=4 984 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 N10949 [0,2,0,0,0,0|2,0,0]=4 985 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 N10950 [0,2,0,0,0,0|2,0,0]=4 986 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 N12584 [0,2,0,0,0,0|2,0,0]=4 987 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 Y10817 [0,2,0,0,0,0|2,0,0]=4 988 B11R1.22 CC[C@H](N)C1=CC=C(C)C=C1 Y10160 [0,2,0,0,0,0|1,0,0]=3 989 B11R1.22 CC[C@H](N)C1=CC=C(C)C=C1 Y10161 [0,2,0,0,0,0|1,0,0]=3 990 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 D81275 [0,2,0,0,0,0|2,0,0]=4 991 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 S11131 [0,2,0,0,0,0|2,0,0]=4 992 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 Y11768 [0,2,0,0,0,0|2,0,0]=4 993 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y10163 [0,2,0,0,0,0|2,0,0]=4 994 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y10164 [0,2,0,0,0,0|2,0,0]=4 995 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y10653 [0,2,0,0,0,0|2,0,0]=4 996 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y11063 [0,2,0,0,0,0|2,0,0]=4 997 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y11174 [0,2,0,0,0,0|2,0,0]=4 998 B11R1.22 CC[C@H](N)C1=CC=C(I)C=C1 Y14552 [0,2,0,0,0,0|2,0,0]=4 999 B11R1.22 CC[C@H](N)C1=CC=C(I)C=C1 Y14553 [0,2,0,0,0,0|2,0,0]=4 1000 B11R1.22 CC[C@H](N)C1=CC=C(O)C=C1 N12238 [0,2,0,0,0,0|2,0,0]=4 1001 B11R1.22 CC[C@H](O)C1=CC=C(Br)C=C1 AB6446 [0,2,0,0,0,0|2,0,0]=4 1002 B11R1.22 CN[C@@H](C)C1=CC=C(Br)C=C1 N10761 [0,2,0,0,0,0|2,0,0]=4 1003 B11R1.22 CN[C@@H](C)C1=CC=C(Br)C=C1 Y10719 [0,2,0,0,0,0|2,0,0]=4 1004 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 F16874 [0,2,0,0,0,0|2,0,0]=4 1005 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 F16927 [0,2,0,0,0,0|2,0,0]=4 1006 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y10862 [0,2,0,0,0,0|2,0,0]=4 1007 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y10897 [0,2,0,0,0,0|2,0,0]=4 1008 B11R1.22 CN[C@@H](C)C1=CC=C(F)C=C1 N13109 [0,2,0,0,0,0|2,0,0]=4 1009 B11R1.22 COC(=O)C1=NN=C(C)C=C1 29806 [0,2,0,0,0,0|1,0,1]=4 1010 B11R1.22 C[C@@H](CN)C1=CC=C(Br)C=C1 84993 [0,2,0,0,0,0|2,0,0]=4 1011 B11R1.22 NC[C@H](O)C1=CC=C(Cl)C=C1 C78214 [0,2,0,0,0,0|2,0,0]=4 1012 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 D83092 [0,2,0,0,0,0|2,0,0]=4 1013 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 I11041 [0,2,0,0,0,0|2,0,0]=4 1014 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 I11043 [0,2,0,0,0,0|2,0,0]=4 1015 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 I11713 [0,2,0,0,0,0|2,0,0]=4 1016 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 Y11114 [0,2,0,0,0,0|2,0,0]=4 1017 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 N10527 [0,2,0,0,0,0|2,0,0]=4 1018 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 N10528 [0,2,0,0,0,0|2,0,0]=4 1019 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 Y10651 [0,2,0,0,0,0|2,0,0]=4 1020 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 Y10776 [0,2,0,0,0,0|2,0,0]=4 1021 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 F16942 [0,2,0,0,0,0|2,0,0]=4 1022 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 I11004 [0,2,0,0,0,0|2,0,0]=4 1023 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 I11005 [0,2,0,0,0,0|2,0,0]=4 1024 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 I11499 [0,2,0,0,0,0|2,0,0]=4 1025 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 Y10343 [0,2,0,0,0,0|2,0,0]=4 1026 B11R1.22 N[C@@H](CO)C1=CC=C(I)C=C1 N10665 [0,2,0,0,0,0|2,0,0]=4 1027 B11R1.22 N[C@@H](CO)C1=CC=C(I)C=C1 Y12067 [0,2,0,0,0,0|2,0,0]=4 1028 B11R1.22 N[C@@H](CO)C1=CC=C(I)C=C1 Y12960 [0,2,0,0,0,0|2,0,0]=4 1029 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 Y10690 [0,2,0,0,0,0|2,0,0]=4 1030 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 Y10915 [0,2,0,0,0,0|2,0,0]=4 1031 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 Y11472 [0,2,0,0,0,0|2,0,0]=4 1032 B11R1.22 N[C@@H](CO)C1=CN=C(Cl)C=C1 F16973 [0,2,0,0,0,0|1,0,0]=3 1033 B11R1.22 N[C@@H](CO)C1=CN=C(Cl)C=C1 N11110 [0,2,0,0,0,0|1,0,0]=3 1034 B11R1.22 N[C@@H](CO)C1=CN=C(Cl)C=C1 Y11040 [0,2,0,0,0,0|1,0,0]=3 1035 B11R1.22 O=C(CBr)C1=CN=C(Br)C=C1 D94486 [0,2,0,0,0,0|1,0,1]=4 1036 B11R1.22 O=C(CCl)C1=CN=C(Cl)C=C1 83967 [0,2,0,0,0,0|1,0,1]=4 1037 B11R1.22 OC[C@H](O)C1=CC=C(Br)C=C1 11739 [0,2,0,0,0,0|2,0,0]=4 1038 B11R1.81 CCCC1=C(O)C=C(O)C=C1 C73634 [0,2,0,0,0,0|2,0,0]=4 1039 B11R1.81 CCOC1=C(C)N=C(N)C=C1 O11421 [0,2,0,0,0,0|1,0,0]=3 1040 B11R1.81 CCOC1=C(Cl)C=C(N)C=C1 C75445 [0,2,0,0,0,0|2,0,0]=4 1041 B11R1.81 CCOC1=C(Cl)N=C(Cl)N=C1 I10147 [0,2,0,0,0,0|2,0,0]=4 1042 B11R1.81 CCOC1=C(F)C=C(O)C=C1 36938 [0,2,0,0,0,0|2,0,0]=4 1043 B11R1.81 COCC1=C(Br)C=C(F)C=C1 N11828 [0,2,0,0,0,0|2,0,0]=4 1044 B11R1.81 COCC1=C(F)C=C(N)C=C1 I10129 [0,2,0,0,0,0|2,0,0]=4 1045 B11R1.81 COCC1=C(N)C=C(Br)C=C1 CL9392 [0,2,0,0,0,0|2,0,0]=4 1046 B11R1.81 COCC1=CC=C(Cl)N=C1Cl W10447 [0,2,0,0,0,0|1,0,0]=3 1047 B11R1.81 ClC1=CC(Br)=C(CCBr)C=C1 O10665 [0,2,0,0,0,0|2,0,0]=4 1048 B11R1.81 ClC1=CC(Cl)=C(CCBr)C=C1 C77752 [0,2,0,0,0,0|2,0,0]=4 1049 B11R1.81 N#CCC1=CN=C(Cl)C=C1Cl A11213 [0,2,0,0,0,0|1,0,1]=4 1050 B11R1.81 OCCC1=C(Cl)C=C(Br)C=C1 F50644 [0,2,0,0,0,0|2,0,0]=4 1051 B11R1.81 OCCC1=C(Cl)C=C(F)C=C1 CL8845 [0,2,0,0,0,0|2,0,0]=4 1052 B11R1.83 CCCC1=CC=C(CN)C=C1 35547 [0,2,0,0,0,0|1,0,0]=3 1053 B11R1.83 CCCC1=CC=C(CN)C=C1 Y14555 [0,2,0,0,0,0|1,0,0]=3 1054 B11R1.83 CCOC1=NC=C(CCl)C=C1 AB10985 [0,2,0,0,0,0|1,0,0]=3 1055 B11R1.83 CCOC1=NC=C(CO)C=C1 20990 [0,2,0,0,0,0|1,0,0]=3 1056 B11R1.83 CNC1=CC=C(CCO)C=C1 AB11620 [0,2,0,0,0,0|1,0,0]=3 1057 B11R1.83 CNCC1=CC=C(C#N)C=C1 C74766 [0,2,0,0,0,0|1,0,1]=4 1058 B11R1.83 COC1=CC=C(CC=O)C=C1 F11615 [0,2,0,0,0,0|1,0,1]=4 1059 B11R1.83 COC1=CC=C(CSC)C=C1 W18269 [0,2,0,0,0,0|1,0,0]=3 1060 B11R1.83 COC1=CN=C(CC#N)C=C1 81752 [0,2,0,0,0,0|1,0,0]=3 1061 B11R1.83 COC1=NC=C(CCN)C=C1 72625 [0,2,0,0,0,0|0,0,0]=2 1062 B11R1.83 N#CC1=CC=C(CCBr)C=C1 26978 [0,2,0,0,0,0|1,0,1]=4 1063 B11R1.83 N#CC1=CC=C(CCO)C=C1 30197 [0,2,0,0,0,0|1,0,1]=4 1064 B11R1.83 NCCC1=CC=C(C=O)C=C1 51618 [0,2,0,0,0,0|1,0,1]=4 1065 B11R1.83 O=CC1=CC=C(CCO)C=C1 CK2095 [0,2,0,0,0,0|1,0,1]=4 1066 B11R1.83 OCCC1=CC=C(CO)C=C1 D82395 [0,2,0,0,0,0|1,0,0]=3 1067 B11R1.192 CC1=C(Br)C=CC(CCN)=C1 AB8409 [0,2,0,0,0,0|2,0,0]=4 1068 B11R1.192 CC1=C(F)C=C(CC#N)C=C1 75825 [0,2,0,0,0,0|1,0,1]=4 1069 B11R1.192 CCCC1=CC(F)=C(Br)C=C1 A12131 [0,2,0,0,0,0|2,0,0]=4 1070 B11R1.192 CCNC1=CC(Cl)=C(Cl)C=C1 AB1379 [0,2,0,0,0,0|2,0,0]=4 1071 B11R1.192 CCOC1=CC(F)=C(N)C=C1 A12546 [0,2,0,0,0,0|2,0,0]=4 1072 B11R1.192 CNCC1=CC(F)=C(F)C=C1 36786 [0,2,0,0,0,0|2,0,0]=4 1073 B11R1.192 CNCC1=CC(O)=C(O)C=C1 31716 [0,2,0,0,0,0|2,0,0]=4 1074 B11R1.192 COCC1=CC(Br)=C(F)C=C1 N10448 [0,2,0,0,0,0|2,0,0]=4 1075 B11R1.192 COCC1=CC(N)=C(Br)C=C1 CL9396 [0,2,0,0,0,0|2,0,0]=4 1076 B11R1.192 NCCC1=CC(F)=C(Cl)C=C1 D79909 [0,2,0,0,0,0|2,0,0]=4 1077 B11R1.192 OCCC1=CC(F)=C(F)C=C1 CL9076 [0,2,0,0,0,0|2,0,0]=4 1078 B11R1.192 OCCC1=CC(O)=C(O)C=C1 68063 [0,2,0,0,0,0|2,0,0]=4 1079 B11R1.3 C#CC1=CN=C(N(C)C)C=C1 AC6759 [0,2,0,0,0,0|0,0,2]=4 1080 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 AC1342 [0,2,0,0,0,0|1,0,1]=4 1081 B11R1.3 C=CC1=CC=C([C@H](C)N)C=C1 Y12652 [0,2,0,0,0,0|1,0,1]=4 1082 B11R1.3 C=CC1=CC=C([C@H](C)N)C=C1 Y12653 [0,2,0,0,0,0|1,0,1]=4 1083 B11R1.3 C=CC1=CC=C([C@H](C)N)C=C1 Y13029 [0,2,0,0,0,0|1,0,1]=4 1084 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 CL9316 [0,2,0,0,0,0|1,0,1]=4 1085 B11R1.3 CC(=O)C1=NC=C(C#N)C=C1 W17133 [0,2,0,0,0,0|1,0,1]=4 1086 B11R1.3 CCC1=CC=C([C@H](C)N)C=C1 D81145 [0,2,0,0,0,0|1,0,0]=3 1087 B11R1.3 CCC1=CC=C([C@H](C)N)C=C1 Y13670 [0,2,0,0,0,0|1,0,0]=3 1088 B11R1.3 CCC1=CN=C(C(=O)O)C=C1 S10908 [0,2,0,0,0,0|0,0,1]=3 1089 B11R1.3 CCC1=NC=C(B(O)O)C=C1 FD10251 [0,2,0,0,0,0|2,0,0]=4 1090 B11R1.3 CCC1=NC=C(C(=O)O)C=C1 W10833 [0,2,0,0,0,0|1,0,1]=4 1091 B11R1.3 CCC1=NC=C(C(C)=O)C=N1 D81149 [0,2,0,0,0,0|1,0,1]=4 1092 B11R1.3 CN(C)C1=CN=C(C=O)C=C1 94043 [0,2,0,0,0,0|1,0,1]=4 1093 B11R1.3 CN(C)C1=NC=C(C=O)C=C1 78785 [0,2,0,0,0,0|1,0,1]=4 1094 B11R1.3 CNC1=CC=C(C(C)C)C=C1 D95133 [0,2,0,0,0,0|1,0,0]=3 1095 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 C72879 [0,2,0,0,0,0|1,0,0]=3 1096 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 C72977 [0,2,0,0,0,0|1,0,0]=3 1097 B11R1.3 COC1=CN=C(C(=N)N)C=C1 66227 [0,2,0,0,0,0|1,0,1]=4 1098 B11R1.3 COC1=CN=C(C(C)=O)C=N1 S10058 [0,2,0,0,0,0|1,0,1]=4 1099 B11R1.3 COC1=CN=C(C(C)=O)N=C1 97279 [0,2,0,0,0,0|2,0,0]=4 1100 B11R1.3 COC1=NC=C(C(C)=O)C=N1 C71224 [0,2,0,0,0,0|1,0,1]=4 1101 B11R1.3 COC1=NC=C([C@H](C)N)C=C1 Y13388 [0,2,0,0,0,0|0,0,0]=2 1102 B11R1.3 CSC1=CC=C([C@H](C)N)C=C1 AT20995 [0,2,0,0,0,0|1,0,0]=3 1103 B11R1.3 CSC1=CC=C([C@H](C)N)C=C1 AT20996 [0,2,0,0,0,0|1,0,0]=3 1104 B11R1.3 CSC1=CC=C([C@H](C)N)C=C1 D81124 [0,2,0,0,0,0|1,0,0]=3 1105 B11R1.3 CSC1=NC=C(B(O)O)C=C1 FD10014 [0,2,0,0,0,0|2,0,0]=4 1106 B11R1.3 C[C@H](N)C1=CC=C(C#N)C=C1 50211 [0,2,0,0,0,0|1,0,1]=4 1107 B11R1.3 C[C@H](N)C1=CC=C(C#N)C=C1 72478 [0,2,0,0,0,0|1,0,1]=4 1108 B11R1.3 C[C@H](N)C1=CC=C(C#N)C=C1 F16907 [0,2,0,0,0,0|1,0,1]=4 1109 B11R1.3 C[C@H](N)C1=CC=C(CO)C=C1 33613 [0,2,0,0,0,0|1,0,0]=3 1110 B11R1.3 C[C@H](N)C1=CC=C(CO)C=C1 33618 [0,2,0,0,0,0|1,0,0]=3 1111 B11R1.3 C[C@H](N)C1=CC=C(CO)C=C1 33808 [0,2,0,0,0,0|1,0,0]=3 1112 B11R1.3 C[C@H](O)C1=CC=C(C#N)C=C1 C13986 [0,2,0,0,0,0|1,0,1]=4 1113 B11R1.3 C[S@](=O)C1=CC=C(CN)C=C1 AR2414 [0,2,0,0,0,0|2,0,0]=4 1114 B11R1.3 FC(F)C1=CC=C(CBr)C=C1 72621 [0,2,0,0,0,0|2,0,0]=4 1115 B11R1.3 N#CC1=CN=C(C(Br)Br)C=C1 AB10252 [0,2,0,0,0,0|1,0,1]=4 1116 B11R1.3 N#CC1=NC=C(C(Br)Br)C=C1 AB2801 [0,2,0,0,0,0|1,0,1]=4 1117 B11R1.3 N#CC1=NC=C(C(F)F)C=C1 87747 [0,2,0,0,0,0|1,0,1]=4 1118 B11R1.3 NCC1=CC=C(C(F)F)C=C1 71247 [0,2,0,0,0,0|2,0,0]=4 1119 B11R1.3 NCC1=CN=C(C(=O)O)C=C1 N14194 [0,2,0,0,0,0|1,0,1]=4 1120 B11R1.3 NCC1=NC=C(C(=O)O)C=C1 51960 [0,2,0,0,0,0|1,0,1]=4 1121 B11R1.3 NCC1=NC=C(C(F)F)C=C1 D78995 [0,2,0,0,0,0|1,0,0]=3 1122 B11R1.3 O=C(O)C1=CN=C(CO)C=C1 P18087 [0,2,0,0,0,0|1,0,1]=4 1123 B11R1.3 O=C(O)C1=NC=C(CO)C=C1 C75020 [0,2,0,0,0,0|1,0,1]=4 1124 B11R1.3 O=CC1=NC=C(C(F)F)C=C1 97703 [0,2,0,0,0,0|1,0,1]=4 1125 B11R1.3 O=[N+]([O-])C1=NC=C(CBr)C=C1 O11297 [0,2,0,0,0,0|2,0,0]=4 1126 B11R1.3 OCC1=CN=C(C(F)F)C=C1 P18143 [0,2,0,0,0,0|1,0,0]=3 1127 B11R1.3 OCC1=NC=C(B(O)O)C=C1 FD10242 [0,2,0,0,0,0|2,0,0]=4 1128 B11R1.279 CCC1=CC(Br)=C(C#N)C=C1 Y11007 [0,2,0,0,0,0|1,0,1]=4 1129 B11R1.279 CCC1=CC(F)=C(C=O)C=C1 36776 [0,2,0,0,0,0|1,0,1]=4 1130 B11R1.279 CCC1=CC(N)=C(OC)C=C1 W16778 [0,2,0,0,0,0|1,0,0]=3 1131 B11R1.279 CCC1=CC(O)=C(OC)C=C1 O11426 [0,2,0,0,0,0|1,0,0]=3 1132 B11R1.279 CCC1=CC=C(C#N)C(O)=N1 C90475 [0,2,0,0,0,0|1,0,1]=4 1133 B11R1.279 CCC1=NC(N)=C(CO)C=N1 C76882 [0,2,0,0,0,0|2,0,0]=4 1134 B11R1.279 CNC1=C(Br)C=C(C#N)C=N1 Y13593 [0,2,0,0,0,0|1,0,1]=4 1135 B11R1.279 COC1=C(Br)C=C(C=O)C=N1 F12246 [0,2,0,0,0,0|1,0,1]=4 1136 B11R1.279 COC1=C(C)C=C(CO)C=C1 D87344 [0,2,0,0,0,0|2,0,0]=4 1137 B11R1.279 COC1=C(Cl)C=C(CCl)C=C1 N12801 [0,2,0,0,0,0|2,0,0]=4 1138 B11R1.279 COC1=C(F)C=C(C=O)C=N1 24822 [0,2,0,0,0,0|1,0,1]=4 1139 B11R1.279 COC1=C(N)C=C(CO)C=C1 74962 [0,2,0,0,0,0|2,0,0]=4 1140 B11R1.279 COC1=C(O)C=C(CO)N=C1 79208 [0,2,0,0,0,0|1,0,0]=3 1141 B11R1.279 COC1=C(O)N=C(SC)N=C1 H10142 [0,2,0,0,0,0|2,0,0]=4 1142 B11R1.279 COC1=CC(Br)=C(CO)C=C1 96401 [0,2,0,0,0,0|2,0,0]=4 1143 B11R1.279 COC1=CC(Br)=C(OC)C=N1 W13564 [0,2,0,0,0,0|1,0,0]=3 1144 B11R1.279 COC1=CC(C)=C(CN)C=C1 N16939 [0,2,0,0,0,0|2,0,0]=4 1145 B11R1.279 COC1=CC(Cl)=C(C#N)C=N1 W10460 [0,2,0,0,0,0|1,0,1]=4 1146 B11R1.279 COC1=CC(Cl)=C(CO)C=C1 W19191 [0,2,0,0,0,0|2,0,0]=4 1147 B11R1.279 COC1=CC(F)=C(CBr)C=C1 CL9274 [0,2,0,0,0,0|2,0,0]=4 1148 B11R1.279 COC1=CC(F)=C(CN)C=C1 CK2394 [0,2,0,0,0,0|2,0,0]=4 1149 B11R1.279 COC1=CC(F)=C(CN)C=C1 Y11728 [0,2,0,0,0,0|2,0,0]=4 1150 B11R1.279 COC1=CC(I)=C(CO)C=N1 64882 [0,2,0,0,0,0|1,0,0]=3 1151 B11R1.279 COC1=CC(N)=C(CO)C=C1 F15701 [0,2,0,0,0,0|2,0,0]=4 1152 B11R1.279 COC1=CC(O)=C(OC)C=C1 25077 [0,2,0,0,0,0|2,0,0]=4 1153 B11R1.279 COC1=CC=C(C#N)C(Br)=N1 FD10641 [0,2,0,0,0,0|1,0,1]=4 1154 B11R1.279 COC1=CC=C(C=O)C(Cl)=N1 W17184 [0,2,0,0,0,0|1,0,1]=4 1155 B11R1.279 COC1=CC=C(C=O)N=C1Br W17199 [0,2,0,0,0,0|1,0,1]=4 1156 B11R1.279 COC1=CC=C(CN)C(Br)=N1 D82704 [0,2,0,0,0,0|1,0,0]=3 1157 B11R1.279 COC1=CC=C(CO)N=C1Cl W17845 [0,2,0,0,0,0|1,0,0]=3 1158 B11R1.279 COC1=CN=C(C#N)C(C)=C1 82258 [0,2,0,0,0,0|1,0,1]=4 1159 B11R1.279 COC1=CN=C(CN)C(C)=C1 D83514 [0,2,0,0,0,0|1,0,0]=3 1160 B11R1.279 COC1=CN=C(OC)N=C1Cl C74910 [0,2,0,0,0,0|2,0,0]=4 1161 B11R1.279 COC1=CN=C(SC)N=C1Cl C76843 [0,2,0,0,0,0|2,0,0]=4 1162 B11R1.279 COC1=NC(C)=C(C#N)C=C1 85188 [0,2,0,0,0,0|1,0,1]=4 1163 B11R1.279 COC1=NC=C(C#N)C(C)=C1 C11019 [0,2,0,0,0,0|1,0,1]=4 1164 B11R1.279 COC1=NC=C(C=O)C=C1C 72229 [0,2,0,0,0,0|1,0,1]=4 1165 B11R1.279 COC1=NC=C(CO)C=C1C 72276 [0,2,0,0,0,0|1,0,0]=3 1166 B11R1.279 CSC1=NC(C)=C(CO)C=N1 D84352 [0,2,0,0,0,0|2,0,0]=4 1167 B11R1.279 CSC1=NC=C(CO)C(Cl)=N1 P11247 [0,2,0,0,0,0|2,0,0]=4 1168 B11R1.19 CC(C)(C)C1=CN=C(Br)C=C1 P18025 [0,2,0,0,0,0|1,0,0]=3 1169 B11R1.19 CC(C)(C)C1=CN=C(Cl)C=C1 P18762 [0,2,0,0,0,0|1,0,0]=3 1170 B11R1.19 CC(C)(C)C1=CN=C(N)C=C1 D95143 [0,2,0,0,0,0|1,0,0]=3 1171 B11R1.19 CC(C)(C)C1=CN=C(N)N=C1 F30951 [0,2,0,0,0,0|2,0,0]=4 1172 B11R1.19 CC(C)(C)C1=CN=C(N)N=C1 F51929 [0,2,0,0,0,0|2,0,0]=4 1173 B11R1.19 CC(C)(F)C1=CC=C(Br)C=C1 F51874 [0,2,0,0,0,0|2,0,0]=4 1174 B11R1.19 CC(C)(N)C1=CC=C(Br)C=C1 91218 [0,2,0,0,0,0|2,0,0]=4 1175 B11R1.19 CC(C)(N)C1=CC=C(F)C=C1 W17967 [0,2,0,0,0,0|2,0,0]=4 1176 B11R1.19 CC(C)(O)C1=CN=C(N)C=C1 W17246 [0,2,0,0,0,0|1,0,0]=3 1177 B11R1.19 CC1=NC=C(S(=O)(=O)Cl)C=C1 P20210 [0,2,0,0,0,0|2,0,0]=4 1178 B11R1.19 CS(=O)(=O)C1=CN=C(Cl)C=C1 91182 [0,2,0,0,0,0|2,0,0]=4 1179 B11R1.21 CC(=O)C1=CC(N)=C(C)C=C1 C73283 [0,2,0,0,0,0|1,0,1]=4 1180 B11R1.21 CC(=O)C1=CN=C(C)C(C)=C1 D93974 [0,2,0,0,0,0|0,0,1]=3 1181 B11R1.21 CC(=O)C1=CN=C(Cl)C(C)=C1 C72016 [0,2,0,0,0,0|1,0,1]=4 1182 B11R1.21 CC(=O)C1=CN=C(N)C(C)=C1 D80389 [0,2,0,0,0,0|1,0,1]=4 1183 B11R1.21 CC(C)C1=CC(F)=C(Br)C=C1 D93757 [0,2,0,0,0,0|2,0,0]=4 1184 B11R1.21 CC(C)C1=CC(I)=C(N)C=C1 F11367 [0,2,0,0,0,0|2,0,0]=4 1185 B11R1.21 CC(C)C1=CC(N)=C(N)C=C1 D78649 [0,2,0,0,0,0|2,0,0]=4 1186 B11R1.21 CC1=C(Br)C=CC([C@H](C)N)=C1 Y11738 [0,2,0,0,0,0|2,0,0]=4 1187 B11R1.21 CC1=C(Br)C=CC([C@H](C)N)=C1 Y12483 [0,2,0,0,0,0|2,0,0]=4 1188 B11R1.21 CC1=C(Br)C=CC([C@H](C)N)=C1 Y12484 [0,2,0,0,0,0|2,0,0]=4 1189 B11R1.21 CC1=C(Br)C=CC([C@H](C)N)=C1 Y13421 [0,2,0,0,0,0|2,0,0]=4 1190 B11R1.21 CC1=C(Br)C=CC([C@H](C)N)=C1 Y13422 [0,2,0,0,0,0|2,0,0]=4 1191 B11R1.21 CC1=C(C)C=C([C@H](C)N)C=C1 Y10159 [0,2,0,0,0,0|1,0,0]=3 1192 B11R1.21 CC1=C(C)C=C([C@H](C)N)C=C1 Y11763 [0,2,0,0,0,0|1,0,0]=3 1193 B11R1.21 CC1=C(C)C=C([C@H](C)N)C=C1 Y13629 [0,2,0,0,0,0|1,0,0]=3 1194 B11R1.21 CC1=C(C)C=C([C@H](C)N)C=C1 Y13905 [0,2,0,0,0,0|1,0,0]=3 1195 B11R1.21 CC1=C(Cl)C=C([C@H](C)N)C=C1 F16970 [0,2,0,0,0,0|1,0,0]=3 1196 B11R1.21 CC1=C(Cl)C=C([C@H](C)N)C=C1 Y11029 [0,2,0,0,0,0|1,0,0]=3 1197 B11R1.21 CC1=C(Cl)C=C([C@H](C)N)C=C1 Y11059 [0,2,0,0,0,0|1,0,0]=3 1198 B11R1.21 CC1=C(Cl)C=C([C@H](C)N)C=C1 Y11531 [0,2,0,0,0,0|1,0,0]=3 1199 B11R1.21 CC1=C(Cl)C=CC([C@H](C)N)=C1 F16962 [0,2,0,0,0,0|2,0,0]=4 1200 B11R1.21 CC1=C(Cl)C=CC([C@H](C)N)=C1 Y10261 [0,2,0,0,0,0|2,0,0]=4 1201 B11R1.21 CC1=C(Cl)C=CC([C@H](C)N)=C1 Y10483 [0,2,0,0,0,0|2,0,0]=4 1202 B11R1.21 CC1=C(Cl)C=CC([C@H](C)N)=C1 Y10896 [0,2,0,0,0,0|2,0,0]=4 1203 B11R1.21 CC1=C(Cl)C=CC([C@H](C)O)=C1 W19076 [0,2,0,0,0,0|2,0,0]=4 1204 B11R1.21 CC1=C(F)C=C(B(O)O)C=N1 D96927 [0,2,0,0,0,0|2,0,0]=4 1205 B11R1.21 CC1=C(F)C=C(C(=O)O)C=N1 C10557 [0,2,0,0,0,0|1,0,1]=4 1206 B11R1.21 CC1=C(F)C=C([C@H](C)N)C=C1 N10471 [0,2,0,0,0,0|1,0,0]=3 1207 B11R1.21 CC1=C(F)C=C([C@H](C)N)C=C1 Y10777 [0,2,0,0,0,0|1,0,0]=3 1208 B11R1.21 CC1=C(F)C=C([C@H](C)N)C=C1 Y14522 [0,2,0,0,0,0|1,0,0]=3 1209 B11R1.21 CC1=C(F)C=C([C@H](C)N)C=C1 Y14600 [0,2,0,0,0,0|1,0,0]=3 1210 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 20091 [0,2,0,0,0,0|2,0,0]=4 1211 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 20093 [0,2,0,0,0,0|2,0,0]=4 1212 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 F16977 [0,2,0,0,0,0|2,0,0]=4 1213 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 N14192 [0,2,0,0,0,0|2,0,0]=4 1214 B11R1.21 CC1=C(N)C=C(C(C)C)C=C1 34381 [0,2,0,0,0,0|1,0,0]=3 1215 B11R1.21 CC1=C(N)C=C([C@H](C)N)C=C1 Y11247 [0,2,0,0,0,0|1,0,0]=3 1216 B11R1.21 CC1=C(N)C=C([C@H](C)N)C=C1 Y11248 [0,2,0,0,0,0|1,0,0]=3 1217 B11R1.21 CC1=C(O)C=CC(C(C)C)=C1 F14410 [0,2,0,0,0,0|2,0,0]=4 1218 B11R1.21 CC1=CC(B(O)O)=CN=C1C 70908 [0,2,0,0,0,0|2,0,0]=4 1219 B11R1.21 CC1=CC(C(=O)O)=CN=C1C D86774 [0,2,0,0,0,0|1,0,1]=4 1220 B11R1.21 CC1=CC(C(F)F)=CN=C1Cl 55146 [0,2,0,0,0,0|2,0,0]=4 1221 B11R1.21 CC1=CC(C(N)=O)=CN=C1C D93908 [0,2,0,0,0,0|1,0,1]=4 1222 B11R1.21 CC1=NC=C(C(=O)O)C=C1N 38876 [0,2,0,0,0,0|1,0,1]=4 1223 B11R1.21 CC1=NC=C([N+](=O)[O-])C=C1N 38949 [0,2,0,0,0,0|2,0,0]=4 1224 B11R1.21 C[C@H](Br)C1=CC(F)=C(F)C=C1 C77557 [0,2,0,0,0,0|2,0,0]=4 1225 B11R1.21 C[C@H](N)C1=CC(Br)=C(F)C=C1 N10463 [0,2,0,0,0,0|2,0,0]=4 1226 B11R1.21 C[C@H](N)C1=CC(Br)=C(F)C=C1 Y10442 [0,2,0,0,0,0|2,0,0]=4 1227 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Br)C=C1 N10743 [0,2,0,0,0,0|2,0,0]=4 1228 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Br)C=C1 Y10815 [0,2,0,0,0,0|2,0,0]=4 1229 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Cl)C=C1 I11039 [0,2,0,0,0,0|2,0,0]=4 1230 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Cl)C=C1 N10849 [0,2,0,0,0,0|2,0,0]=4 1231 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Cl)C=C1 Y10524 [0,2,0,0,0,0|2,0,0]=4 1232 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Cl)C=C1 Y10673 [0,2,0,0,0,0|2,0,0]=4 1233 B11R1.21 C[C@H](N)C1=CC(Cl)=C(F)C=C1 N10467 [0,2,0,0,0,0|2,0,0]=4 1234 B11R1.21 C[C@H](N)C1=CC(Cl)=C(F)C=C1 N10948 [0,2,0,0,0,0|2,0,0]=4 1235 B11R1.21 C[C@H](N)C1=CC(Cl)=C(F)C=C1 Y10300 [0,2,0,0,0,0|2,0,0]=4 1236 B11R1.21 C[C@H](N)C1=CC(F)=C(Br)C=C1 Y11210 [0,2,0,0,0,0|2,0,0]=4 1237 B11R1.21 C[C@H](N)C1=CC(F)=C(Br)C=C1 Y11211 [0,2,0,0,0,0|2,0,0]=4 1238 B11R1.21 C[C@H](N)C1=CC(F)=C(Br)C=C1 Y12971 [0,2,0,0,0,0|2,0,0]=4 1239 B11R1.21 C[C@H](N)C1=CC(F)=C(Cl)C=C1 20137 [0,2,0,0,0,0|2,0,0]=4 1240 B11R1.21 C[C@H](N)C1=CC(F)=C(Cl)C=C1 F16865 [0,2,0,0,0,0|2,0,0]=4 1241 B11R1.21 C[C@H](N)C1=CC(F)=C(Cl)C=C1 N10497 [0,2,0,0,0,0|2,0,0]=4 1242 B11R1.21 C[C@H](N)C1=CC(F)=C(F)C=C1 73374 [0,2,0,0,0,0|2,0,0]=4 1243 B11R1.21 C[C@H](N)C1=CC(F)=C(F)C=C1 Y10166 [0,2,0,0,0,0|2,0,0]=4 1244 B11R1.21 C[C@H](N)C1=CC(F)=C(F)C=C1 Y10893 [0,2,0,0,0,0|2,0,0]=4 1245 B11R1.21 FC(F)C1=CN=C(Cl)C(Cl)=C1 97699 [0,2,0,0,0,0|2,0,0]=4 1246 B11R1.166 CC(=O)C1=C(Br)C=C(C)C=C1 77817 [0,2,0,0,0,0|1,0,1]=4 1247 B11R1.166 CC(=O)C1=C(C)C=C(C)N=C1 79163 [0,2,0,0,0,0|0,0,1]=3 1248 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 W18192 [0,2,0,0,0,0|1,0,1]=4 1249 B11R1.166 CC(=O)C1=CC=C(F)N=C1F O10255 [0,2,0,0,0,0|1,0,1]=4 1250 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1Cl 86422 [0,2,0,0,0,0|1,0,1]=4 1251 B11R1.166 CC(C)C1=C(O)C=C(N)C=C1 F51191 [0,2,0,0,0,0|2,0,0]=4 1252 B11R1.166 CC1=C(C(C)C)C=CC(N)=C1 A12536 [0,2,0,0,0,0|2,0,0]=4 1253 B11R1.166 CC1=C([C@H](C)N)C=CC(Cl)=C1 Y10861 [0,2,0,0,0,0|2,0,0]=4 1254 B11R1.166 CC1=C([C@H](C)N)C=CC(Cl)=C1 Y10895 [0,2,0,0,0,0|2,0,0]=4 1255 B11R1.166 CC1=C([C@H](C)N)C=CC(Cl)=C1 Y11476 [0,2,0,0,0,0|2,0,0]=4 1256 B11R1.166 CC1=C([C@H](C)N)C=CC(Cl)=C1 Y11477 [0,2,0,0,0,0|2,0,0]=4 1257 B11R1.166 CC1=C([C@H](C)N)C=CC(F)=C1 Y11919 [0,2,0,0,0,0|2,0,0]=4 1258 B11R1.166 CC1=C([C@H](C)N)C=CC(F)=C1 Y11920 [0,2,0,0,0,0|2,0,0]=4 1259 B11R1.166 CC1=C([C@H](C)N)C=CC(F)=C1 Y12621 [0,2,0,0,0,0|2,0,0]=4 1260 B11R1.166 CC1=CC(Br)=NC=C1C(F)F C73455 [0,2,0,0,0,0|2,0,0]=4 1261 B11R1.166 CC1=CC(C)=C([C@H](C)N)C=C1 Y11487 [0,2,0,0,0,0|1,0,0]=3 1262 B11R1.166 CC1=CC(Cl)=C([C@H](C)N)C=C1 D81528 [0,2,0,0,0,0|1,0,0]=3 1263 B11R1.166 CC1=CN=C(C(C)C)C(Cl)=N1 W17934 [0,2,0,0,0,0|1,0,0]=3 1264 B11R1.166 CC1=NC(C)=C(B(O)O)C=C1 FD10078 [0,2,0,0,0,0|2,0,0]=4 1265 B11R1.166 CC1=NC(N)=C(C(N)=O)C=C1 D83361 [0,2,0,0,0,0|1,0,1]=4 1266 B11R1.166 C[C@H](N)C1=C(Br)C=C(F)C=C1 20177 [0,2,0,0,0,0|2,0,0]=4 1267 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Cl)C=C1 D81223 [0,2,0,0,0,0|2,0,0]=4 1268 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Cl)C=C1 Y10218 [0,2,0,0,0,0|2,0,0]=4 1269 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Cl)C=C1 Y10360 [0,2,0,0,0,0|2,0,0]=4 1270 B11R1.166 C[C@H](N)C1=C(Cl)C=C(F)C=C1 D80666 [0,2,0,0,0,0|2,0,0]=4 1271 B11R1.166 C[C@H](N)C1=C(Cl)C=C(F)C=C1 D81664 [0,2,0,0,0,0|2,0,0]=4 1272 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 41021 [0,2,0,0,0,0|2,0,0]=4 1273 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 41031 [0,2,0,0,0,0|2,0,0]=4 1274 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 N10675 [0,2,0,0,0,0|2,0,0]=4 1275 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 N10686 [0,2,0,0,0,0|2,0,0]=4 1276 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 Y10648 [0,2,0,0,0,0|2,0,0]=4 1277 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 Y11061 [0,2,0,0,0,0|2,0,0]=4 1278 B11R1.166 C[C@H](N)C1=C(F)C=C(Cl)C=C1 N16827 [0,2,0,0,0,0|2,0,0]=4 1279 B11R1.166 C[C@H](N)C1=C(F)C=C(Cl)C=C1 N16937 [0,2,0,0,0,0|2,0,0]=4 1280 B11R1.166 C[C@H](N)C1=C(F)C=C(Cl)C=C1 N17056 [0,2,0,0,0,0|2,0,0]=4 1281 B11R1.166 C[C@H](N)C1=C(F)C=C(F)C=C1 N10465 [0,2,0,0,0,0|2,0,0]=4 1282 B11R1.37 CCC1=C(C=O)C=C(Br)C=C1 CL9497 [0,2,0,0,0,0|2,0,0]=4 1283 B11R1.37 CCC1=C(CO)C=C(Br)C=C1 C13891 [0,2,0,0,0,0|2,0,0]=4 1284 B11R1.37 COC1=C(C#N)N=C(C)C=C1 F50991 [0,2,0,0,0,0|1,0,0]=3 1285 B11R1.37 COC1=C(C=O)N=C(Br)C=C1 36281 [0,2,0,0,0,0|2,0,0]=4 1286 B11R1.37 COC1=C(CBr)C=CC(Br)=N1 D80185 [0,2,0,0,0,0|2,0,0]=4 1287 B11R1.37 COC1=C(CN)C=CC(Br)=N1 N10742 [0,2,0,0,0,0|2,0,0]=4 1288 B11R1.37 COC1=C(CN)C=CC(Br)=N1 Y11170 [0,2,0,0,0,0|2,0,0]=4 1289 B11R1.37 COC1=C(CO)C=C(C)C=C1 A12781 [0,2,0,0,0,0|2,0,0]=4 1290 B11R1.37 COC1=C(CO)C=CC(Br)=N1 N10745 [0,2,0,0,0,0|2,0,0]=4 1291 B11R1.37 COC1=C(OC)C=C(N)N=C1 S10461 [0,2,0,0,0,0|2,0,0]=4 1292 B11R1.37 COC1=CC(Cl)=NC=C1CO D75692 [0,2,0,0,0,0|2,0,0]=4 1293 B11R1.37 OCC1=C(CO)N=C(Cl)C=C1 N12730 [0,2,0,0,0,0|2,0,0]=4 1294 B11R1.277 CC1=C(C)N=C(Br)C(C#N)=C1 72565 [0,2,0,0,0,0|1,0,1]=4 1295 B11R1.277 CC1=C(C)N=C(Cl)C(C=O)=C1 O10730 [0,2,0,0,0,0|1,0,1]=4 1296 B11R1.277 CC1=C(F)C=C(C#N)C(Cl)=N1 81870 [0,2,0,0,0,0|1,0,1]=4 1297 B11R1.277 CC1=CC(I)=C(CI)C=C1C 21230 [0,2,0,0,0,0|2,0,0]=4 1298 B11R1.277 CC1=CC(I)=C(CO)C=C1C AB9476 [0,2,0,0,0,0|2,0,0]=4 1299 B11R1.277 CC1=NC(C)=C(C)N=C1CBr S11280 [0,2,0,0,0,0|2,0,0]=4 1300 B11R1.277 CCC1=CC(F)=C(F)C=C1N 75978 [0,2,0,0,0,0|2,0,0]=4 1301 B11R1.277 CCC1=NC(C)=C(C)N=C1C C73333 [0,2,0,0,0,0|1,0,0]=3 1302 B11R1.277 COC1=C(Cl)C=C(C)C(N)=C1 F51099 [0,2,0,0,0,0|2,0,0]=4 1303 B11R1.277 COC1=CC(Br)=C(C)N=C1N 84361 [0,2,0,0,0,0|1,0,0]=3 1304 B11R1.278 CC1=C(O)C(C)=C(CO)C=N1 AC4357 [0,2,0,0,0,0|1,0,0]=3 1305 B11R1.464 CC1=CC(C)=C(CBr)C(C)=C1 S10850 [0,2,0,0,0,0|2,0,0]=4 1306 B11R1.464 CC1=CC(Cl)=C(C#N)C(Cl)=N1 90397 [0,2,0,0,0,0|1,0,1]=4 1307 B11R1.464 CC1=CC(Cl)=C(C=O)C(Cl)=N1 D79309 [0,2,0,0,0,0|1,0,1]=4 1308 B11R1.464 CC1=CC(Cl)=C(CO)C(Cl)=N1 C90466 [0,2,0,0,0,0|1,0,0]=3 1309 B11R1.464 CC1=CC(O)=C(C#N)C(O)=N1 89365 [0,2,0,0,0,0|1,0,1]=4 1310 B11R1.464 CCC1=C(Cl)N=C(N)N=C1Cl C10763 [0,2,0,0,0,0|2,0,0]=4 1311 B11R1.464 CCC1=C(O)N=C(N)N=C1O C74549 [0,2,0,0,0,0|2,0,0]=4 1312 B11R1.464 COC1=C(C)N=C(Cl)C=C1Cl P11221 [0,2,0,0,0,0|2,0,0]=4 1313 B11R1.464 COC1=C(Cl)N=C(Br)C=C1C C72603 [0,2,0,0,0,0|2,0,0]=4 1314 B11R1.464 COC1=C(Cl)N=C(C)N=C1Cl H11873 [0,2,0,0,0,0|2,0,0]=4 1315 B11R1.14 CCC1=CC(F)=C(O)C(F)=C1 36959 [0,2,0,0,0,0|2,0,0]=4 1316 B11R1.14 COC1=CC(Br)=C(C)C(Br)=C1 36153 [0,2,0,0,0,0|2,0,0]=4 1317 B11R1.280 CC1=C(CO)C=C(C#N)C=N1 D80262 [0,2,0,0,0,0|1,0,1]=4 1318 B11R1.280 COC1=C(C)C=CC(CN)=C1 78978 [0,2,0,0,0,0|2,0,0]=4 1319 B11R1.280 COC1=C(C)C=CC(CN)=C1 N12583 [0,2,0,0,0,0|2,0,0]=4 1320 B11R1.280 COC1=CC(OC)=C(N)N=C1 28153 [0,2,0,0,0,0|2,0,0]=4 1321 B11R1.280 COC1=CN=C(Br)C(C=O)=C1 79577 [0,2,0,0,0,0|2,0,0]=4 1322 B11R1.280 COC1=CN=C(Cl)C(C#N)=C1 38952 [0,2,0,0,0,0|2,0,0]=4 1323 B11R1.280 COC1=CN=C(F)C(C=O)=C1 F31130 [0,2,0,0,0,0|2,0,0]=4 1324 B9R1.3 CC1=CC=NC(C)=C1Br C10200 [0,0,1,1,0,0|1,0,1]=4 1325 B11R2.34 BrC1=NC=C(C2CC2)C=C1 81857 [0,1,0,1,0,0|1,0,0]=3 1326 B11R2.34 BrC1=NC=C(C2CC2)N=C1 81856 [0,1,0,1,0,0|2,0,0]=4 1327 B11R2.34 BrC1=NN=C(C2CC2)C=C1 F52113 [0,1,0,1,0,0|2,0,0]=4 1328 B11R2.34 ClC1=NC=C(C2CC2)C=C1 81869 [0,1,0,1,0,0|1,0,0]=3 1329 B11R2.34 ClC1=NC=C(C2CC2)C=N1 VT1061 [0,1,0,1,0,0|2,0,0]=4 1330 B11R2.34 ClC1=NN=C(C2CC2)C=C1 59624 [0,1,0,1,0,0|2,0,0]=4 1331 B11R2.34 NC1=CC=C(C2CC2)C=C1 26267 [0,1,0,1,0,0|2,0,0]=4 1332 B11R2.34 NC1=CC=C(C2CC2)C=C1 33400 [0,1,0,1,0,0|2,0,0]=4 1333 B11R2.34 NC1=NC=C(C2CC2)C=C1 94373 [0,1,0,1,0,0|1,0,0]=3 1334 B11R2.34 NC1=NC=C(C2CC2)C=N1 AT18404 [0,1,0,1,0,0|2,0,0]=4 1335 B11R2.34 OC1=NC=C(C2CC2)C=C1 C71515 [0,1,0,1,0,0|1,0,0]=3 1336 B11R2.36 BrC1=CC2=C(C=C1)CCC2 Y10449 [0,1,0,1,0,0|2,0,0]=4 1337 B11R2.36 BrC1=CC2=C(C=C1)CCN2 73495 [0,1,0,1,0,0|2,0,0]=4 1338 B11R2.36 BrC1=CC2=C(C=C1)COC2 71931 [0,1,0,1,0,0|2,0,0]=4 1339 B11R2.36 BrC1=NC2=C(C=C1)NCC2 C72057 [0,1,0,1,0,0|1,0,0]=3 1340 B11R2.36 BrC1=NC=C2CNCC2=C1 P17924 [0,1,0,1,0,0|1,0,0]=3 1341 B11R2.36 CC1=CC2=C(C=C1)CCC2 Y11729 [0,1,0,1,0,0|1,0,0]=3 1342 B11R2.36 CC1=NC2=C(C=C1)C=NN2 CL3535 [0,1,0,1,0,0|1,0,1]=4 1343 B11R2.36 CC1=NC2=C(C=C1)N=CN2 C74433 [0,1,0,1,0,0|1,0,1]=4 1344 B11R2.36 CC1=NC2=C(C=C1)NC=C2 82266 [0,1,0,1,0,0|0,0,2]=4 1345 B11R2.36 CC1=NC2=C(C=C1)NN=C2 79023 [0,1,0,1,0,0|1,0,1]=4 1346 B11R2.36 CC1=NC2=C(C=N1)CSC2 C74866 [0,1,0,1,0,0|1,0,0]=3 1347 B11R2.36 CC1=NC=C2C=CNC2=C1 76378 [0,1,0,1,0,0|0,0,2]=4 1348 B11R2.36 CC1=NC=C2NC=CC2=C1 76311 [0,1,0,1,0,0|0,0,2]=4 1349 B11R2.36 CC1=NC=C2NN=CC2=C1 74056 [0,1,0,1,0,0|1,0,1]=4 1350 B11R2.36 ClC1=CC2=C(C=C1)CCC2 N12723 [0,1,0,1,0,0|2,0,0]=4 1351 B11R2.36 ClC1=CC2=C(C=C1)CCN2 F11859 [0,1,0,1,0,0|2,0,0]=4 1352 B11R2.36 ClC1=CC2=C(C=C1)CNC2 AB6849 [0,1,0,1,0,0|2,0,0]=4 1353 B11R2.36 ClC1=CC2=C(C=C1)OCC2 W17536 [0,1,0,1,0,0|2,0,0]=4 1354 B11R2.36 ClC1=NC2=C(C=C1)CCO2 D78959 [0,1,0,1,0,0|1,0,0]=3 1355 B11R2.36 ClC1=NC2=C(C=C1)CNC2 FD7109 [0,1,0,1,0,0|1,0,0]=3 1356 B11R2.36 ClC1=NC2=C(C=C1)CNC2 P12647 [0,1,0,1,0,0|1,0,0]=3 1357 B11R2.36 ClC1=NC2=C(C=N1)CCC2 P18611 [0,1,0,1,0,0|2,0,0]=4 1358 B11R2.36 ClC1=NC2=C(C=N1)CCN2 D84325 [0,1,0,1,0,0|2,0,0]=4 1359 B11R2.36 ClC1=NC=C2CCNC2=C1 87198 [0,1,0,1,0,0|1,0,0]=3 1360 B11R2.36 ClC1=NC=C2CNCC2=C1 P16613 [0,1,0,1,0,0|1,0,0]=3 1361 B11R2.36 ClC1=NC=C2NCCC2=C1 F18600 [0,1,0,1,0,0|1,0,0]=3 1362 B11R2.36 FC1=CC2=C(C=C1)CCN2 F21334 [0,1,0,1,0,0|2,0,0]=4 1363 B11R2.36 FC1=CC2=C(C=C1)CCO2 Y13232 [0,1,0,1,0,0|2,0,0]=4 1364 B11R2.36 NC1=CC2=C(C=C1)CCO2 F12399 [0,1,0,1,0,0|2,0,0]=4 1365 B11R2.36 NC1=CC2=C(C=C1)CNC2 AB9521 [0,1,0,1,0,0|2,0,0]=4 1366 B11R2.36 NC1=NC2=C(C=N1)CNC2 F17464 [0,1,0,1,0,0|2,0,0]=4 1367 B11R2.36 O=C1C=CC2=C(CCC2)N1 83506 [0,1,0,1,0,0|1,0,1]=4 1368 B11R2.36 OC1=CC2=C(C=C1)CCN2 C75271 [0,1,0,1,0,0|2,0,0]=4 1369 B11R2.36 OC1=CC2=C(C=C1)CCO2 27138 [0,1,0,1,0,0|2,0,0]=4 1370 B11R2.36 OC1=CC2=C(C=C1)CNC2 20927 [0,1,0,1,0,0|2,0,0]=4 1371 B11R2.36 OC1=CC2=C(C=C1)CNC2 52281 [0,1,0,1,0,0|2,0,0]=4 1372 B11R2.36 OC1=CC2=C(C=C1)CNC2 52301 [0,1,0,1,0,0|2,0,0]=4 1373 B11R2.36 OC1=CC2=C(C=C1)OCC2 24188 [0,1,0,1,0,0|2,0,0]=4 1374 B11R2.190 C=CC1=CC2=C(C=C1)CC2 67824 [0,1,0,1,0,0|1,0,1]=4 1375 B7R1.1 BrCC1=CC=NO1 33595 [1,0,0,0,1,0|2,0,0]=4 1376 B7R1.1 BrCC1=CN=CO1 92893 [1,0,0,0,1,0|2,0,0]=4 1377 B7R1.1 BrCC1=COC=N1 70925 [1,0,0,0,1,0|2,0,0]=4 1378 B7R1.1 BrCC1=CON=C1 95088 [1,0,0,0,1,0|2,0,0]=4 1379 B7R1.1 BrCC1=CSC=N1 73558 [1,0,0,0,1,0|2,0,0]=4 1380 B7R1.1 BrCC1=NC=CO1 92941 [1,0,0,0,1,0|2,0,0]=4 1381 B7R1.1 BrCC1=NC=CS1 73557 [1,0,0,0,1,0|2,0,0]=4 1382 B7R1.1 BrCC1=NOC=C1 71749 [1,0,0,0,1,0|2,0,0]=4 1383 B7R1.1 CCC1=CNN=C1 72604 [1,0,0,0,1,0|1,0,0]=3 1384 B7R1.1 CCC1=NN=CO1 C10407 [1,0,0,0,1,0|2,0,0]=4 1385 B7R1.1 CCN1C=NC=N1 29522 [1,0,0,0,1,0|2,0,0]=4 1386 B7R1.1 CNC1=NC=CO1 71780 [1,0,0,0,1,0|2,0,0]=4 1387 B7R1.1 CNC1=NC=CS1 26158 [1,0,0,0,1,0|2,0,0]=4 1388 B7R1.1 CNC1=NNC=C1 72540 [1,0,0,0,1,0|2,0,0]=4 1389 B7R1.1 CNC1=NOC=C1 72015 [1,0,0,0,1,0|2,0,0]=4 1390 B7R1.1 CNC1=NOC=C1 72539 [1,0,0,0,1,0|2,0,0]=4 1391 B7R1.1 COC1=CNN=C1 79311 [1,0,0,0,1,0|2,0,0]=4 1392 B7R1.1 COC1=NNC=C1 D79536 [1,0,0,0,1,0|2,0,0]=4 1393 B7R1.1 CSC1=CN=CN1 W17049 [1,0,0,0,1,0|2,0,0]=4 1394 B7R1.1 CSC1=CNN=C1 W10958 [1,0,0,0,1,0|2,0,0]=4 1395 B7R1.1 CSC1=NC=CN1 AC1458 [1,0,0,0,1,0|2,0,0]=4 1396 B7R1.1 CSC1=NC=CO1 O10533 [1,0,0,0,1,0|2,0,0]=4 1397 B7R1.1 ClCC1=CC=CS1 79790 [1,0,0,0,1,0|2,0,0]=4 1398 B7R1.1 ClCC1=CC=NO1 33348 [1,0,0,0,1,0|2,0,0]=4 1399 B7R1.1 ClCC1=CN=CO1 RB3366 [1,0,0,0,1,0|2,0,0]=4 1400 B7R1.1 ClCC1=COC=N1 D97597 [1,0,0,0,1,0|2,0,0]=4 1401 B7R1.1 ClCC1=NC=CS1 BL005472 [1,0,0,0,1,0|2,0,0]=4 1402 B7R1.1 ClCC1=NOC=C1 F13567 [1,0,0,0,1,0|2,0,0]=4 1403 B7R1.1 NCC1=CC=CN1 25931 [1,0,0,0,1,0|1,0,1]=4 1404 B7R1.1 NCC1=CC=NO1 33343 [1,0,0,0,1,0|2,0,0]=4 1405 B7R1.1 NCC1=CC=NO1 33364 [1,0,0,0,1,0|2,0,0]=4 1406 B7R1.1 NCC1=CN=CS1 24148 [1,0,0,0,1,0|2,0,0]=4 1407 B7R1.1 NCC1=CNC=C1 F12967 [1,0,0,0,1,0|1,0,1]=4 1408 B7R1.1 NCC1=CNC=N1 26566 [1,0,0,0,1,0|2,0,0]=4 1409 B7R1.1 NCC1=CNN=C1 37585 [1,0,0,0,1,0|2,0,0]=4 1410 B7R1.1 NCC1=CNN=C1 37586 [1,0,0,0,1,0|2,0,0]=4 1411 B7R1.1 NCC1=COC=N1 25090 [1,0,0,0,1,0|2,0,0]=4 1412 B7R1.1 NCC1=CON=C1 55763 [1,0,0,0,1,0|2,0,0]=4 1413 B7R1.1 NCC1=CSC=N1 24147 [1,0,0,0,1,0|2,0,0]=4 1414 B7R1.1 NCC1=CSC=N1 Y14444 [1,0,0,0,1,0|2,0,0]=4 1415 B7R1.1 NCC1=NC=CN1 C72548 [1,0,0,0,1,0|2,0,0]=4 1416 B7R1.1 NCC1=NNC=C1 36190 [1,0,0,0,1,0|2,0,0]=4 1417 B7R1.1 NCC1=NOC=C1 W10075 [1,0,0,0,1,0|2,0,0]=4 1418 B7R1.1 OCC1=CC=NO1 33580 [1,0,0,0,1,0|2,0,0]=4 1419 B7R1.1 OCC1=CC=NS1 53001 [1,0,0,0,1,0|2,0,0]=4 1420 B7R1.1 OCC1=CON=C1 73633 [1,0,0,0,1,0|2,0,0]=4 1421 B7R1.1 OCC1=CSN=C1 83209 [1,0,0,0,1,0|2,0,0]=4 1422 B7R1.1 OCN1C=CN=C1 F11598 [1,0,0,0,1,0|2,0,0]=4 1423 B7R1.2 CC1=CC=C(Br)O1 C71939 [1,0,0,0,1,0|2,0,0]=4 1424 B7R1.2 CC1=CN(C)C=N1 11615 [1,0,0,0,1,0|1,0,0]=3 1425 B7R1.2 CC1=CN(C)N=N1 O10352 [1,0,0,0,1,0|2,0,0]=4 1426 B7R1.2 CC1=CN=C(N)O1 80158 [1,0,0,0,1,0|2,0,0]=4 1427 B7R1.2 CC1=CN=C(N)S1 C13827 [1,0,0,0,1,0|2,0,0]=4 1428 B7R1.2 CC1=COC(Br)=N1 S10976 [1,0,0,0,1,0|2,0,0]=4 1429 B7R1.2 CC1=COC(S)=N1 W16843 [1,0,0,0,1,0|2,0,0]=4 1430 B7R1.2 CC1=CSC(Br)=C1 C15930 [1,0,0,0,1,0|2,0,0]=4 1431 B7R1.2 CC1=CSC(C)=C1 O10605 [1,0,0,0,1,0|1,0,0]=3 1432 B7R1.2 CC1=CSC(I)=N1 W17362 [1,0,0,0,1,0|2,0,0]=4 1433 B7R1.2 CC1=NC=C(Br)S1 29668 [1,0,0,0,1,0|2,0,0]=4 1434 B7R1.2 CC1=NC=C(N)S1 80222 [1,0,0,0,1,0|2,0,0]=4 1435 B7R1.2 CC1=NN=C(C)C1 N10051 [1,0,0,0,1,0|1,0,1]=4 1436 B7R1.2 CN1C=C(O)C=N1 W16286 [1,0,0,0,1,0|2,0,0]=4 1437 B7R1.2 CN1C=CC(N)=C1 O10425 [1,0,0,0,1,0|2,0,0]=4 1438 B7R1.2 CN1C=N[N+](C)=C1 T70137 [1,0,0,0,1,0|2,0,0]=4