0 B13R2.369 BrC1=CC2=CC=CC=C2C=C1Br NO11242 [0,0,0,0,0,0|3,0,0]=3 1 B13R2.369 CC1=C(Br)C=C2C=NC=CC2=C1 DY514017 [0,0,0,0,0,0|4,0,0]=4 2 B13R2.369 CC1=C(N)C=C2N=CC=CC2=C1 DY690503 [0,0,0,0,0,0|4,0,0]=4 3 B13R2.369 CC1NC2=C(C=NC=C2)NC1=O DY585879 [0,0,0,0,0,0|3,0,1]=4 4 B13R2.369 ClC1=C(Br)C=C2C=CC=NC2=C1 DY690111 [0,0,0,0,0,0|4,0,0]=4 5 B13R2.369 ClC1=CC2=CC=CC=C2N=C1Cl NO15838 [0,0,0,0,0,0|2,0,1]=3 6 B13R2.369 ClC1=NC2=CC=CC=C2N=C1Cl DY434068 [0,0,0,0,0,0|3,0,1]=4 7 B13R2.369 FC1=C(Br)C=C2C=CC=NC2=C1 NO14503 [0,0,0,0,0,0|4,0,0]=4 8 B13R2.369 FC1=CC2=CC=CC=C2C=C1Br DY764663 [0,0,0,0,0,0|3,0,0]=3 9 B13R2.369 FC1=CC2=CC=CC=C2C=C1F DY764669 [0,0,0,0,0,0|3,0,0]=3 10 B13R2.369 NC1=CC2=CC=CC=C2C=C1Cl DY763148 [0,0,0,0,0,0|3,0,0]=3 11 B13R2.369 NC1=CC2=CC=CC=C2N=C1Br DY688191 [0,0,0,0,0,0|2,0,1]=3 12 B13R2.369 O=C1OC2=CC=CC=C2C=C1O DY581331 [0,0,0,0,0,0|1,0,0]=1 13 B13R2.369 OC1=NC2=CC=CC=C2N=C1F DY783850 [0,0,0,0,0,0|2,0,1]=3 14 B12R2.24 BrC1=CC2=CC=CC=C2C=C1 NO19153 [1,0,0,0,0,0|2,0,0]=3 15 B12R2.24 BrC1=CC2=CC=CC=C2C=N1 NO22177 [1,0,0,0,0,0|3,0,0]=4 16 B12R2.24 BrC1=CC2=CC=CC=C2N=C1 NO21394 [1,0,0,0,0,0|1,0,1]=3 17 B12R2.24 BrC1=CC2=NC=CC=C2N=C1 NO22124 [1,0,0,0,0,0|2,0,1]=4 18 B12R2.24 BrC1=CC=C2C=CC=NC2=C1 NO19085 [1,0,0,0,0,0|3,0,0]=4 19 B12R2.24 BrC1=CC=C2C=CN=CC2=C1 NO19165 [1,0,0,0,0,0|3,0,0]=4 20 B12R2.24 BrC1=CC=C2C=NC=CC2=C1 NO21398 [1,0,0,0,0,0|3,0,0]=4 21 B12R2.24 BrC1=CC=C2N=CC=CC2=C1 DY690135 [1,0,0,0,0,0|3,0,0]=4 22 B12R2.24 BrC1=CC=C2N=CC=CC2=C1 NO10941 [1,0,0,0,0,0|3,0,0]=4 23 B12R2.24 BrC1=NC2=CC=CC=C2C=C1 NO21392 [1,0,0,0,0,0|1,0,1]=3 24 B12R2.24 BrC1=NC2=CC=CC=C2N=C1 NO19018 [1,0,0,0,0,0|2,0,1]=4 25 B12R2.24 CC1=CC2=CC=CC=C2C=N1 NO19703 [1,0,0,0,0,0|3,0,0]=4 26 B12R2.24 CC1=CC2=CC=CC=C2N=C1 NO11336 [1,0,0,0,0,0|1,0,1]=3 27 B12R2.24 CC1=CC=C2C=CC=NC2=C1 DY20324 [1,0,0,0,0,0|3,0,0]=4 28 B12R2.24 CC1=CC=C2C=NC=CC2=C1 NO10742 [1,0,0,0,0,0|3,0,0]=4 29 B12R2.24 CC1=CC=C2N=CC=CC2=C1 NO10066 [1,0,0,0,0,0|3,0,0]=4 30 B12R2.24 CC1=NC2=CC=CC=C2C=C1 NO11335 [1,0,0,0,0,0|1,0,1]=3 31 B12R2.24 CC1=NC2=CC=CC=C2N=C1 DY569061 [1,0,0,0,0,0|2,0,1]=4 32 B12R2.24 CC1=NC2=NC=CC=C2C=C1 NO18023 [1,0,0,0,0,0|2,0,1]=4 33 B12R2.24 ClC1=CC2=CC=CC=C2C=N1 NO22238 [1,0,0,0,0,0|3,0,0]=4 34 B12R2.24 ClC1=CC2=CC=CC=C2N=C1 NO22245 [1,0,0,0,0,0|1,0,1]=3 35 B12R2.24 ClC1=CC2=CC=CN=C2N=C1 DY769119 [1,0,0,0,0,0|2,0,1]=4 36 B12R2.24 ClC1=CC=C2C=CC=NC2=C1 NO10811 [1,0,0,0,0,0|3,0,0]=4 37 B12R2.24 ClC1=CC=C2C=NC=CC2=C1 NO11526 [1,0,0,0,0,0|3,0,0]=4 38 B12R2.24 ClC1=CC=C2N=CC=CC2=C1 NO21425 [1,0,0,0,0,0|3,0,0]=4 39 B12R2.24 ClC1=NC2=CC=CC=C2C=C1 NO21419 [1,0,0,0,0,0|1,0,1]=3 40 B12R2.24 ClC1=NC2=CC=CC=C2C=N1 NO19965 [1,0,0,0,0,0|2,0,1]=4 41 B12R2.24 ClC1=NC2=CC=CN=C2C=C1 NO16799 [1,0,0,0,0,0|2,0,1]=4 42 B12R2.24 ClC1=NC2=NC=CC=C2C=C1 DY528207 [1,0,0,0,0,0|2,0,1]=4 43 B12R2.24 FC1=CC2=NC=CC=C2N=C1 DY769191 [1,0,0,0,0,0|2,0,1]=4 44 B12R2.24 FC1=CC=C2C=NC=CC2=C1 NO14751 [1,0,0,0,0,0|3,0,0]=4 45 B12R2.24 FC1=CC=C2N=CC=CC2=C1 NO12098 [1,0,0,0,0,0|3,0,0]=4 46 B12R2.24 IC1=CC=C2C=CC=NC2=C1 DY690830 [1,0,0,0,0,0|3,0,0]=4 47 B12R2.24 IC1=CC=C2N=CC=CC2=C1 DY30340 [1,0,0,0,0,0|3,0,0]=4 48 B12R2.24 NC1=CC2=CC=CC=C2C=N1 NO21593 [1,0,0,0,0,0|3,0,0]=4 49 B12R2.24 NC1=CC2=CC=CC=C2N=C1 NO11010 [1,0,0,0,0,0|1,0,1]=3 50 B12R2.24 NC1=CC2=CC=NC=C2N=C1 DY561939 [1,0,0,0,0,0|2,0,1]=4 51 B12R2.24 NC1=CC=C2C=CN=CC2=C1 NO18893 [1,0,0,0,0,0|3,0,0]=4 52 B12R2.24 NC1=CC=C2C=NC=CC2=C1 NO18181 [1,0,0,0,0,0|3,0,0]=4 53 B12R2.24 NC1=CC=C2N=CC=CC2=C1 DY692079 [1,0,0,0,0,0|3,0,0]=4 54 B12R2.24 NC1=CC=C2N=CC=CC2=C1 NO11016 [1,0,0,0,0,0|3,0,0]=4 55 B12R2.24 NC1=NC2=CC=CC=C2C=C1 NO11009 [1,0,0,0,0,0|1,0,1]=3 56 B12R2.24 NC1=NC2=NC=CC=C2C=C1 DY715460 [1,0,0,0,0,0|2,0,1]=4 57 B12R2.24 NC1=NC2=NC=CC=C2C=C1 NO20558 [1,0,0,0,0,0|2,0,1]=4 58 B12R2.24 O=C1C=C2C=CC=CC2=NN1 NO16596 [1,0,0,0,0,0|1,0,2]=4 59 B12R2.24 O=C1C=CC2=CC=CC=C2O1 DY507548 [1,0,0,0,0,0|1,0,0]=2 60 B12R2.24 O=C1C=CC2=CC=NC=C2N1 DY796323 [1,0,0,0,0,0|1,0,0]=2 61 B12R2.24 O=C1C=CC2=NC=CN=C2N1 NO12516 [1,0,0,0,0,0|2,0,0]=3 62 B12R2.24 O=C1C=NC2=C(C=NC=C2)N1 DY716732 [1,0,0,0,0,0|2,0,0]=3 63 B12R2.24 O=C1C=NC2=C(N=CC=C2)N1 NO17925 [1,0,0,0,0,0|2,0,0]=3 64 B12R2.24 O=C1CCC2=CC=CC=C2N1 NO11038 [1,0,0,0,0,0|0,0,2]=3 65 B12R2.24 O=C1CNC2=C(C=CC=N2)N1 DY566469 [1,0,0,0,0,0|2,0,1]=4 66 B12R2.24 O=C1COC2=C(C=CC=C2)N1 NO21568 [1,0,0,0,0,0|1,0,1]=3 67 B12R2.24 O=C1COC2=C(C=NC=C2)N1 DY425642 [1,0,0,0,0,0|2,0,1]=4 68 B12R2.24 O=C1COC2=CC=CC=C2C1 DY681882 [1,0,0,0,0,0|2,0,1]=4 69 B12R2.24 O=C1CSC2=C(C=CC=C2)N1 DY558855 [1,0,0,0,0,0|1,0,1]=3 70 B12R2.24 O=C1N=CC2=CC=CC=C2N1 DY782536 [1,0,0,0,0,0|1,0,0]=2 71 B12R2.24 OC1=CC2=C(C=CC=C2)OC1 DY673380 [1,0,0,0,0,0|1,0,1]=3 72 B12R2.24 OC1=CC2=CC=CC=C2C=C1 NO21708 [1,0,0,0,0,0|1,0,0]=2 73 B12R2.24 OC1=CC2=CC=CC=C2N=C1 NO19154 [1,0,0,0,0,0|0,0,1]=2 74 B12R2.24 OC1=CC=C2C=CC=NC2=C1 NO10982 [1,0,0,0,0,0|2,0,0]=3 75 B12R2.24 OC1=CC=C2N=CC=CC2=C1 DY561585 [1,0,0,0,0,0|2,0,0]=3 76 B12R2.24 OC1=CC=C2OC=CCC2=C1 DY755551 [1,0,0,0,0,0|2,0,1]=4 77 B12R2.24 OC1=NC2=CC=CC=C2N=C1 NO21605 [1,0,0,0,0,0|1,0,1]=3 78 B12R2.24 OC1=NC2=CC=CN=C2C=C1 DY442462 [1,0,0,0,0,0|1,0,2]=4 79 B12R2.24 SC1=NC2=CC=CC=C2C=C1 DY545253 [1,0,0,0,0,0|0,1,1]=3 80 B12R2.24 [O-][N+]1=CC2=CC=CC=C2C=C1 NO21529 [1,0,0,0,0,0|2,0,1]=4 81 B14R2.1128 CC1=CC2=CC=CC=C2N=C1CN DY586442 [0,1,0,0,0,0|2,0,1]=4 82 B14R2.1128 COC1=CC2=CC=CC=C2N=C1Cl DY688227 [0,1,0,0,0,0|1,0,1]=3 83 B14R2.1128 COC1=CC2=CC=CN=C2NC1=O DY790695 [0,1,0,0,0,0|1,0,0]=2 84 B14R2.1128 COC1=NC2=CC=CC=C2N=C1Cl NO21502 [0,1,0,0,0,0|2,0,1]=4 85 B14R2.1128 N#CC1=CC2=CC=CC=C2C=C1I DY764819 [0,1,0,0,0,0|3,0,0]=4 86 B14R2.1128 NCC1=CC2=CC=CC=C2N=C1Cl DY687181 [0,1,0,0,0,0|2,0,1]=4 87 B14R2.1128 NCC1=NC2=CC=CC=C2N=C1O DY783982 [0,1,0,0,0,0|2,0,1]=4 88 B14R2.1128 NNC1=NC2=CC=CC=C2N=C1O DY548175 [0,1,0,0,0,0|2,0,1]=4 89 B14R2.1128 O=C1OC2=C(C=CC=C2)N\C1=N/O DY772893 [0,1,0,0,0,0|2,0,0]=3 90 B14R2.1128 O=CC1=CC2=CC=CC=C2N=C1Cl NO11246 [0,1,0,0,0,0|1,0,2]=4 91 B14R2.1128 OCC1=CC2=CC=CC=C2C=C1F DY765647 [0,1,0,0,0,0|2,0,0]=3 92 B14R2.8188 CC1=C(Br)C(=O)C2=CC=CC=C2O1 DY755131 [0,1,0,0,0,0|3,0,0]=4 93 B14R2.8188 CC1=C(O)C2=CC=CC=C2OC1=O DY676664 [0,1,0,0,0,0|2,0,0]=3 94 B14R2.8188 CC1=NC2=CC=CC=C2C(Cl)=C1I DY689288 [0,1,0,0,0,0|2,0,1]=4 95 B14R2.8188 CC1=NC2=CC=CC=C2N(O)C1=O DY783910 [0,1,0,0,0,0|2,0,0]=3 96 B14R2.8188 CC1NC2=CC=CC=C2N(C)C1=O DY783904 [0,1,0,0,0,0|2,0,1]=4 97 B14R2.8188 CN1C(=O)C(=O)NC2=C1N=CC=C2 DY107830 [0,1,0,0,0,0|2,0,1]=4 98 B14R2.8188 CN1C(=O)C(O)=CC2=CC=CC=C21 DY688854 [0,1,0,0,0,0|0,0,0]=1 99 B14R2.8188 NC1=C(Cl)OC2=CC=CC=C2C1=O DY755119 [0,1,0,0,0,0|3,0,0]=4 100 B14R2.8188 O=C1C(O)OC2=C(C=CC=C2)N1O DY772905 [0,1,0,0,0,0|1,0,1]=3 101 B14R2.8239 CC1=CC2=CC(Br)=CC=C2N=C1N DY690075 [0,1,0,0,0,0|2,0,1]=4 102 B14R2.8239 CC1=CC=C2N=C(C)C(=O)NC2=C1 DY783820 [0,1,0,0,0,0|2,0,0]=3 103 B14R2.8239 CC1=CC=C2N=C(N)C(Br)=CC2=C1 DY688733 [0,1,0,0,0,0|2,0,1]=4 104 B14R2.8239 CC1NC2=CC=C(F)C=C2NC1=O DY783778 [0,1,0,0,0,0|2,0,1]=4 105 B14R2.8239 CC1OC2=C(C=CC(Cl)=C2)NC1=O DY680613 [0,1,0,0,0,0|2,0,1]=4 106 B14R2.8239 CC1SC2=C(C=C(Br)C=C2)NC1=O DY568077 [0,1,0,0,0,0|2,0,1]=4 107 B14R2.8239 OC1=CC=C2C=C(Br)C(O)=CC2=C1 DY103324 [0,1,0,0,0,0|2,0,0]=3 108 B14R2.8239 OC1=NC2=CC=C(Cl)C=C2N=C1O NO10664 [0,1,0,0,0,0|1,0,2]=4 109 B14R2.28472 CC1=C2C=C(O)C(=O)NC2=CC=C1 DY688860 [0,1,0,0,0,0|0,0,0]=1 110 B14R2.28472 C[C@@H]1NC2=C(F)C=CC=C2NC1=O DY625429 [0,1,0,0,0,0|2,0,1]=4 111 B14R2.28472 C[C@@H]1OC2=C(C=CC=C2F)NC1=O DY625513 [0,1,0,0,0,0|2,0,1]=4 112 B14R2.28472 ClC1=CC2=CC=CC(Cl)=C2N=C1Cl DY687561 [0,1,0,0,0,0|2,0,1]=4 113 B14R2.28472 ClC1=NC2=C(Br)C=CC=C2C=C1Br DY688480 [0,1,0,0,0,0|2,0,1]=4 114 B14R2.28472 O=C1NC2=CC=CC(O)=C2NC1=O DY783292 [0,1,0,0,0,0|1,0,1]=3 115 B12R1.43 CC(Cl)C(=O)NC1=CC=CC=C1 DY605141 [0,0,1,0,0,0|1,0,2]=4 116 B12R1.43 CC(NC1=CC=CC=C1)C(=O)O DY20809 [0,0,1,0,0,0|2,0,1]=4 117 B12R1.43 NC(=O)C(N)Cc1ccccc1 DY438080 [0,0,1,0,0,0|1,0,2]=4 118 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 NO21095 [0,0,1,0,0,0|1,0,2]=4 119 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 NO15800 [0,0,1,0,0,0|1,0,2]=4 120 B12R1.371 CC1=C(NC(=O)CN)C=CC=C1 DY612894 [0,0,1,0,0,0|1,0,2]=4 121 B12R2.18 C=C1C(=O)NC2=CC=CC=C12 DY800619 [0,0,0,0,1,0|1,0,0]=2 122 B12R2.18 CC1=C(Br)C2=C(C=CC=C2)S1 NO22136 [0,0,0,0,1,0|3,0,0]=4 123 B12R2.18 CC1=CC2=CC=CC=C2N1C NO10010 [0,0,0,0,1,0|3,0,0]=4 124 B12R2.18 CN1C(N)=CC2=CC=CC=C21 DY106654 [0,0,0,0,1,0|3,0,0]=4 125 B12R2.18 O=C1C2=CC=CC=C2CC1Br DY772371 [0,0,0,0,1,0|1,0,2]=4 126 B12R2.18 O=C1NC2=CC=CC=C2C1=O NO11506 [0,0,0,0,1,0|0,0,1]=2 127 B12R2.18 O=C1SC2=C(C=CC=C2)C1=O DY556599 [0,0,0,0,1,0|1,0,1]=3 128 B14R2.741 O=C1NC2=C(C=CC=C2)CCC1Br NO10004 [0,0,0,0,0,1|1,0,2]=4 129 B11R1.40 C=CC(=O)NC1=NC=CC=N1 DY695993 [1,0,1,0,0,0|2,0,0]=4 130 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 NO21725 [1,0,1,0,0,0|0,0,0]=2 131 B11R1.91 O=C(O)CNc1ccccc1 DY439073 [1,0,1,0,0,0|1,0,1]=4 132 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 DY20186 [1,0,1,0,0,0|2,0,0]=4 133 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 DY20799 [1,0,1,0,0,0|2,0,0]=4 134 B11R1.17 O=C\C=C\C1=C(Br)C=CC=C1 DY566061 [1,0,1,0,0,0|1,0,0]=3 135 B11R1.86 CC(=O)NC1=C(Br)C=CC=C1 DY427446 [1,0,1,0,0,0|1,0,1]=4 136 B11R1.86 CC(=O)NC1=C(C)C=CC=C1 DY744961 [1,0,1,0,0,0|0,0,2]=4 137 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 NO21203 [1,0,1,0,0,0|1,0,1]=4 138 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 NO21083 [1,0,1,0,0,0|1,0,1]=4 139 B11R1.86 NC(=O)NC1=C(Br)C=CC=C1 DY789621 [1,0,1,0,0,0|2,0,0]=4 140 B11R1.86 NC1=C(CC(=O)O)C=CC=C1 NO20995 [1,0,1,0,0,0|0,0,1]=3 141 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 NO20809 [1,0,1,0,0,0|1,0,1]=4 142 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 NO20826 [1,0,1,0,0,0|1,0,1]=4 143 B11R1.86 O=C(O)CC1=C(I)C=CC=C1 NO20849 [1,0,1,0,0,0|1,0,1]=4 144 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 NO20941 [1,0,1,0,0,0|1,0,1]=4 145 B11R2.20 C1=CC=C2C=NC=CC2=C1 NO19770 [2,0,0,0,0,0|2,0,0]=4 146 B11R2.20 C1=CC=C2N=CC=CC2=C1 NO11929 [2,0,0,0,0,0|0,0,1]=3 147 B11R2.20 C1=CC=C2N=CC=NC2=C1 NO11932 [2,0,0,0,0,0|1,0,1]=4 148 B11R2.20 C1=CC=C2N=CN=CC2=C1 NO11926 [2,0,0,0,0,0|1,0,1]=4 149 B11R2.20 C1=CC=C2N=NC=CC2=C1 NO11145 [2,0,0,0,0,0|1,0,1]=4 150 B11R2.20 C1=CN=C2C=CC=NC2=C1 NO20548 [2,0,0,0,0,0|1,0,1]=4 151 B13R1.133 C\C(=C/C1=CC=C(F)C=C1)C(=O)O DY541833 [0,1,1,0,0,0|2,0,0]=4 152 B13R1.133 O=C(O)C(=O)CC1=CC=C(Cl)C=C1 DY551097 [0,1,1,0,0,0|2,0,0]=4 153 B13R1.202 O=C(O)C(=O)NC1=C(Cl)C=CC=C1 DY605327 [0,1,1,0,0,0|1,0,0]=3 154 B13R1.418 N#C\C(=C/C1=CC=CC=C1)C(=O)[O-] DY790101 [0,1,1,0,0,0|2,0,0]=4 155 B13R1.91 COC1=C(\C=C(/C)C=O)C=CC=C1 DY788673 [0,1,1,0,0,0|2,0,0]=4 156 B13R1.4928 CC1=CC=CC(C)=C1NC(=O)CO DY584427 [0,1,1,0,0,0|0,0,2]=4 157 B13R2.32 CC1=C(Cl)C2=CC=CC=C2N=C1 DY689294 [1,1,0,0,0,0|1,0,1]=4 158 B13R2.32 CC1=C(N)C2=CC=CC=C2C=C1 DY447699 [1,1,0,0,0,0|2,0,0]=4 159 B13R2.32 CC1=C(N)C=CC2=CC=CC=C21 DY768787 [1,1,0,0,0,0|2,0,0]=4 160 B13R2.32 CC1=C(O)C2=CC=CC=C2C=C1 NO11396 [1,1,0,0,0,0|2,0,0]=4 161 B13R2.32 CN1C(=O)N=CC2=CC=CC=C21 DY781468 [1,1,0,0,0,0|1,0,0]=3 162 B13R2.32 ClC1=C(Br)C2=CC=CC=C2C=C1 DY764063 [1,1,0,0,0,0|2,0,0]=4 163 B13R2.32 FC1=C(I)C2=CC=CC=C2N=C1 DY688830 [1,1,0,0,0,0|1,0,1]=4 164 B13R2.32 NC1=C(Br)C=NC2=CC=CC=C21 NO18266 [1,1,0,0,0,0|1,0,1]=4 165 B13R2.32 NC1=C(I)C=CC2=CC=CC=C21 DY768955 [1,1,0,0,0,0|2,0,0]=4 166 B13R2.32 NC1=C(O)C=CC2=CC=CC=C21 NO20594 [1,1,0,0,0,0|1,0,0]=3 167 B13R2.32 OC1=C(Br)C2=CC=CC=C2C=C1 NO11263 [1,1,0,0,0,0|1,0,0]=3 168 B13R2.32 OC1=CC=C2C=CN=CC2=C1Br DY443700 [1,1,0,0,0,0|2,0,0]=4 169 B13R2.57 BrCC1=NC2=CC=CC=C2C=C1 DY560661 [1,1,0,0,0,0|1,0,1]=4 170 B13R2.57 Br[Mg]c1ccc2ccccc2c1 DY121324 [1,1,0,0,0,0|2,0,0]=4 171 B13R2.57 C#CC1=CC2=CC=CC=C2C=C1 NO18943 [1,1,0,0,0,0|2,0,0]=4 172 B13R2.57 COC1=CC2=CC=CC=C2C=C1 DY10259 [1,1,0,0,0,0|1,0,0]=3 173 B13R2.57 COC1=CC2=CC=CC=C2N=C1 NO13082 [1,1,0,0,0,0|0,0,1]=3 174 B13R2.57 COC1=CC2=NC=CC=C2N=C1 DY515205 [1,1,0,0,0,0|1,0,1]=4 175 B13R2.57 COC1=CC=C2C=NC=CC2=C1 NO18348 [1,1,0,0,0,0|2,0,0]=4 176 B13R2.57 COC1=CC=C2N=CC=CC2=C1 NO22118 [1,1,0,0,0,0|2,0,0]=4 177 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 NO10061 [1,1,0,0,0,0|1,0,1]=4 178 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 NO20903 [1,1,0,0,0,0|1,0,1]=4 179 B13R2.57 N#CC1=CNC2=C(C=CC=C2)S1 DY676899 [1,1,0,0,0,0|2,0,0]=4 180 B13R2.57 NCC1=CC2=CC=CC=C2C=C1 NO20395 [1,1,0,0,0,0|2,0,0]=4 181 B13R2.57 NCC1=NC2=CC=CC=C2C=C1 NO18374 [1,1,0,0,0,0|1,0,1]=4 182 B13R2.57 NNC1=CC2=CC=CC=C2C=C1 NO13970 [1,1,0,0,0,0|2,0,0]=4 183 B13R2.57 O=CC1=CC2=CC=CC=C2N=C1 NO10059 [1,1,0,0,0,0|0,0,2]=4 184 B13R2.57 O=CC1=CC=C2C=CN=CC2=C1 DY576207 [1,1,0,0,0,0|2,0,0]=4 185 B13R2.57 O=CC1=CC=C2N=CC=CC2=C1 NO10500 [1,1,0,0,0,0|2,0,0]=4 186 B13R2.57 OCC1=CC2=CC=CC=C2C=C1 NO13773 [1,1,0,0,0,0|1,0,0]=3 187 B13R2.57 OCC1=CC=C2C=CC=NC2=C1 DY795357 [1,1,0,0,0,0|2,0,0]=4 188 B13R2.57 OCC1=CC=C2C=NC=CC2=C1 DY535293 [1,1,0,0,0,0|2,0,0]=4 189 B13R2.57 [C-]#[N+]c1ccc2ccccc2c1 DY10341 [1,1,0,0,0,0|2,0,0]=4 190 B13R2.155 BrC1=CC=C2C=CC(Br)=CC2=C1 NO19954 [1,1,0,0,0,0|2,0,0]=4 191 B13R2.155 BrC1=CC=C2N=CC(I)=CC2=C1 NO18141 [1,1,0,0,0,0|1,0,1]=4 192 B13R2.155 CC1=CC2=CC(F)=CC=C2N=C1 DY690333 [1,1,0,0,0,0|1,0,1]=4 193 B13R2.155 CC1=CC=C2C=CC(=O)NC2=C1 DY456478 [1,1,0,0,0,0|0,0,0]=2 194 B13R2.155 CC1=CC=C2C=CC(Br)=CC2=C1 NO16063 [1,1,0,0,0,0|2,0,0]=4 195 B13R2.155 CC1=CC=C2C=CC(C)=CC2=C1 DY561699 [1,1,0,0,0,0|2,0,0]=4 196 B13R2.155 CC1=CC=C2C=CC(C)=NC2=C1 DY580671 [1,1,0,0,0,0|1,0,1]=4 197 B13R2.155 CC1=NC2=CC(Cl)=CC=C2C=C1 NO11293 [1,1,0,0,0,0|1,0,1]=4 198 B13R2.155 ClC1=CC2=CC(Br)=CC=C2N=C1 DY690063 [1,1,0,0,0,0|1,0,1]=4 199 B13R2.155 ClC1=CC2=CC(I)=CC=C2C=C1 DY764891 [1,1,0,0,0,0|2,0,0]=4 200 B13R2.155 FC1=CC=C2N=CC(Cl)=CC2=C1 DY688781 [1,1,0,0,0,0|1,0,1]=4 201 B13R2.155 NC1=CC=C2C=CC(=O)N=C2N1 DY425450 [1,1,0,0,0,0|1,0,1]=4 202 B13R2.155 NC1=CC=C2CCC(=O)NC2=C1 NO10778 [1,1,0,0,0,0|0,0,2]=4 203 B13R2.155 NC1=CC=C2CNC(=O)NC2=C1 DY783166 [1,1,0,0,0,0|1,0,1]=4 204 B13R2.155 NC1=CC=C2NCC(=O)NC2=C1 DY784444 [1,1,0,0,0,0|1,0,1]=4 205 B13R2.155 NC1=NC2=C(C=C1)N=CC(=O)N2 DY678827 [1,1,0,0,0,0|2,0,0]=4 206 B13R2.155 NC1=NC2=CC(Br)=CC=C2C=C1 NO17134 [1,1,0,0,0,0|1,0,1]=4 207 B13R2.155 Nc1ccc2c(c1)NC(=O)CO2 DY41745 [1,1,0,0,0,0|1,0,1]=4 208 B13R2.155 O=C1C=CC2=CC=C(Br)C=C2N1 NO14788 [1,1,0,0,0,0|0,0,0]=2 209 B13R2.155 O=C1C=CC2=CC=C(O)C=C2O1 NO16303 [1,1,0,0,0,0|1,0,0]=3 210 B13R2.155 O=C1C=CC2=CC=C(O)OC2=C1 DY771363 [1,1,0,0,0,0|1,0,1]=4 211 B13R2.155 O=C1C=NC2=CC=C(Cl)C=C2N1 DY783280 [1,1,0,0,0,0|1,0,0]=3 212 B13R2.155 O=C1CCC2=CC=C(O)C=C2N1 NO21727 [1,1,0,0,0,0|0,0,2]=4 213 B13R2.155 O=C1COC2=C(C=C(Br)C=C2)N1 NO10626 [1,1,0,0,0,0|1,0,1]=4 214 B13R2.155 OC1=CC2=CC(Br)=CC=C2C=C1 NO18626 [1,1,0,0,0,0|1,0,0]=3 215 B13R2.155 OC1=CC2=CC(Br)=CC=C2C=N1 NO14588 [1,1,0,0,0,0|2,0,0]=4 216 B13R2.155 OC1=CC2=CC(Cl)=CC=C2C=C1 DY765677 [1,1,0,0,0,0|1,0,0]=3 217 B13R2.155 OC1=CC2=CC(F)=CC=C2C=N1 NO16284 [1,1,0,0,0,0|2,0,0]=4 218 B13R2.155 OC1=CC=C2C=CC(Cl)=NC2=C1 DY551883 [1,1,0,0,0,0|1,0,1]=4 219 B13R2.155 OC1=CC=C2C=CC(O)=NC2=C1 NO18652 [1,1,0,0,0,0|0,0,2]=4 220 B13R2.155 OC1=CC=C2N=CC(Br)=CC2=C1 NO16651 [1,1,0,0,0,0|1,0,1]=4 221 B13R2.162 CC1=CC=C2C=CC=C(Cl)C2=C1 DY763841 [1,1,0,0,0,0|2,0,0]=4 222 B13R2.162 CC1=NC2=C(Br)C=CC=C2C=C1 DY563169 [1,1,0,0,0,0|1,0,1]=4 223 B13R2.162 CC1=NC2=C(N)C=CC=C2C=C1 NO10006 [1,1,0,0,0,0|1,0,1]=4 224 B13R2.162 CC1=NC2=C(O)C=CC=C2C=C1 NO16057 [1,1,0,0,0,0|1,0,1]=4 225 B13R2.162 ClC1=CC=C2C=CC=C(I)C2=C1 DY764873 [1,1,0,0,0,0|2,0,0]=4 226 B13R2.162 NC1=C2C=C(O)C=CC2=CC=C1 DY509420 [1,1,0,0,0,0|1,0,0]=3 227 B13R2.162 NC1=C2N=C(Br)C=CC2=CC=C1 DY688197 [1,1,0,0,0,0|1,0,1]=4 228 B13R2.162 NC1=CC2=C(Cl)C=CC=C2N=C1 DY689751 [1,1,0,0,0,0|1,0,1]=4 229 B13R2.162 NC1=NC2=C(Br)C=CC=C2C=C1 DY442437 [1,1,0,0,0,0|1,0,1]=4 230 B13R2.162 O=C1C=CC2=C(O1)C(Br)=CC=C2 NO12344 [1,1,0,0,0,0|1,0,0]=3 231 B13R2.162 O=C1CCC2=CC=CC(F)=C2N1 DY523533 [1,1,0,0,0,0|0,0,2]=4 232 B13R2.162 OC1=CC=CC2=C1C=C(Br)C=N2 NO15353 [1,1,0,0,0,0|1,0,1]=4 233 B13R2.162 OC1=CC=CC2=C1C=C(Cl)C=N2 DY688800 [1,1,0,0,0,0|1,0,1]=4 234 B13R2.162 OC1=NC2=C(F)C=CC=C2N=C1 DY783868 [1,1,0,0,0,0|1,0,1]=4 235 B13R2.328 BrC1=CC(I)=CC2=CC=CC=C12 DY431929 [1,1,0,0,0,0|2,0,0]=4 236 B13R2.328 CC1=CC(Br)=NC2=CC=CC=C12 DY440080 [1,1,0,0,0,0|1,0,1]=4 237 B13R2.328 CC1=CC(N)=NC2=CC=CC=C12 DY689517 [1,1,0,0,0,0|1,0,1]=4 238 B13R2.328 CC1=CC(O)=NC2=CC=CC=C12 NO10067 [1,1,0,0,0,0|0,0,2]=4 239 B13R2.328 CC1=CC2=CC=CC=C2C(Br)=C1 NO17170 [1,1,0,0,0,0|2,0,0]=4 240 B13R2.328 CC1=NC2=CC=CC=C2C(Br)=C1 NO22654 [1,1,0,0,0,0|1,0,1]=4 241 B13R2.328 CC1=NC2=CC=CC=C2C(O)=C1 DY562977 [1,1,0,0,0,0|1,0,1]=4 242 B13R2.328 ClC1=CC(Cl)=NC2=CC=CC=C12 NO10935 [1,1,0,0,0,0|1,0,1]=4 243 B13R2.328 NC1=CC(=O)NC2=CC=CC=C12 NO22591 [1,1,0,0,0,0|0,0,0]=2 244 B13R2.328 NC1=CC(Cl)=NC2=CC=CC=C12 NO22546 [1,1,0,0,0,0|1,0,1]=4 245 B13R2.328 NC1=CC(O)=CC2=CC=CC=C12 DY768431 [1,1,0,0,0,0|1,0,0]=3 246 B13R2.328 NC1=CC2=CC=CC=C2C(Br)=C1 NO17133 [1,1,0,0,0,0|2,0,0]=4 247 B13R2.328 NC1=CC2=CC=CC=C2C(O)=C1 DY579147 [1,1,0,0,0,0|2,0,0]=4 248 B13R2.328 NC1=NC2=CC=CC=C2C(Cl)=C1 NO21246 [1,1,0,0,0,0|1,0,1]=4 249 B13R2.328 O=C1C=C(Cl)NC2=CC=CC=C12 DY688323 [1,1,0,0,0,0|1,0,0]=3 250 B13R2.328 O=C1C=C(O)C2=NC=CC=C2N1 NO17474 [1,1,0,0,0,0|1,0,0]=3 251 B13R2.328 O=C1CC2=CC=CC=C2C(=O)N1 DY33305 [1,1,0,0,0,0|2,0,0]=4 252 B13R2.328 O=C1CC2=CC=CC=C2C(=O)O1 DY568083 [1,1,0,0,0,0|2,0,0]=4 253 B13R2.328 O=C1NC(=O)C2=CC=CC=C2N1 NO10996 [1,1,0,0,0,0|1,0,0]=3 254 B13R2.328 O=C1NC2=C(C=CC=C2)C(=O)O1 NO11507 [1,1,0,0,0,0|1,0,0]=3 255 B13R2.328 OC1=CC(Cl)=NC2=CC=CC=C12 NO21445 [1,1,0,0,0,0|1,0,1]=4 256 B13R2.328 [O-]C1=CC(O)=NC2=CC=CC=C12 DY692121 [1,1,0,0,0,0|0,0,2]=4 257 B13R2.3683 CC1=CC2=CC=C(F)C=C2N=C1 DY690782 [1,1,0,0,0,0|1,0,1]=4 258 B13R2.3683 CC1=CC=C2C=C(O)C=CC2=C1 NO10734 [1,1,0,0,0,0|1,0,0]=3 259 B13R2.3683 CC1=CC=C2N=C(N)C=CC2=C1 DY690497 [1,1,0,0,0,0|1,0,1]=4 260 B13R2.3683 CC1=CC=C2OC(=O)C=CC2=C1 NO10739 [1,1,0,0,0,0|1,0,0]=3 261 B13R2.3683 CC1=NC2=CC=C(Br)C=C2C=C1 NO11285 [1,1,0,0,0,0|1,0,1]=4 262 B13R2.3683 ClC1=CC=C2C=C(Cl)C=CC2=C1 DY769083 [1,1,0,0,0,0|2,0,0]=4 263 B13R2.3683 ClC1=NC2=CC=C(Br)C=C2C=C1 NO21349 [1,1,0,0,0,0|1,0,1]=4 264 B13R2.3683 FC1=CC=C2C=C(Br)C=NC2=C1 DY585364 [1,1,0,0,0,0|1,0,1]=4 265 B13R2.3683 NC1=CC2=C(C=C1)NC(=O)CO2 DY680271 [1,1,0,0,0,0|1,0,1]=4 266 B13R2.3683 NC1=CC2=CC=C(Br)C=C2C=C1 DY568653 [1,1,0,0,0,0|2,0,0]=4 267 B13R2.3683 NC1=CC2=CC=C(Br)C=C2N=C1 DY515559 [1,1,0,0,0,0|1,0,1]=4 268 B13R2.3683 NC1=CC2=CC=C(I)C=C2C=C1 DY764897 [1,1,0,0,0,0|2,0,0]=4 269 B13R2.3683 NC1=CC=C2N=C(Cl)C=CC2=C1 NO16608 [1,1,0,0,0,0|1,0,1]=4 270 B13R2.3683 O=C1C=CC2=CC(Br)=CC=C2N1 NO18810 [1,1,0,0,0,0|0,0,0]=2 271 B13R2.3683 O=C1C=CC2=CC(Br)=CC=C2O1 NO12500 [1,1,0,0,0,0|1,0,0]=3 272 B13R2.3683 O=C1C=CC2=CC(Cl)=NC=C2N1 DY799107 [1,1,0,0,0,0|1,0,0]=3 273 B13R2.3683 O=C1C=NC2=CC(Br)=CC=C2N1 NO13132 [1,1,0,0,0,0|1,0,0]=3 274 B13R2.3683 O=C1C=NC2=CC(Cl)=CC=C2N1 NO13992 [1,1,0,0,0,0|1,0,0]=3 275 B13R2.3683 O=C1C=NC2=CC(O)=CC=C2N1 DY783760 [1,1,0,0,0,0|1,0,0]=3 276 B13R2.3683 O=C1CCC2=CC(Br)=CC=C2N1 NO14148 [1,1,0,0,0,0|0,0,2]=4 277 B13R2.3683 O=C1CCC2=CC(O)=CC=C2N1 NO22115 [1,1,0,0,0,0|0,0,2]=4 278 B13R2.3683 O=C1COC2=C(C=CC(I)=C2)N1 NO15735 [1,1,0,0,0,0|1,0,1]=4 279 B13R2.3683 O=C1N=CC2=CC(Cl)=CC=C2N1 DY585518 [1,1,0,0,0,0|1,0,0]=3 280 B13R2.3683 O=C1NC2=C(C=C(Br)C=C2)CO1 DY10146 [1,1,0,0,0,0|1,0,1]=4 281 B13R2.3683 O=C1NCC2=CC(Br)=CC=C2N1 DY115916 [1,1,0,0,0,0|1,0,1]=4 282 B13R2.3683 OC1=CC2=CC=C(Br)C=C2C=C1 NO13742 [1,1,0,0,0,0|1,0,0]=3 283 B13R2.3683 OC1=CC2=CC=C(Cl)C=C2C=C1 DY441106 [1,1,0,0,0,0|1,0,0]=3 284 B13R2.3683 OC1=CC2=CC=C(F)C=C2C=C1 DY441035 [1,1,0,0,0,0|1,0,0]=3 285 B13R2.3683 OC1=CC=C2N=C(Cl)C=CC2=C1 DY561477 [1,1,0,0,0,0|1,0,1]=4 286 B13R2.3683 OC1=CC=C2N=C(O)C=CC2=C1 NO10985 [1,1,0,0,0,0|0,0,2]=4 287 B13R2.3683 OC1=NC2=CC=C(Cl)C=C2C=C1 DY533403 [1,1,0,0,0,0|0,0,2]=4 288 B13R2.3683 SC1=CC2=CC=C(Cl)C=C2C=C1 DY768925 [1,1,0,0,0,0|1,1,0]=4 289 B13R2.3683 SC1=CC=C2C=C(S)C=CC2=C1 DY768913 [1,1,0,0,0,0|1,1,0]=4 290 B13R2.5179 CC1=C2C=CC(N)=CC2=CC=C1 DY768733 [1,1,0,0,0,0|2,0,0]=4 291 B13R2.5179 CC1=C2N=CC(Br)=CC2=CC=C1 DY566175 [1,1,0,0,0,0|1,0,1]=4 292 B13R2.5179 CC1=C2N=CC(O)=NC2=CC=C1 DY783928 [1,1,0,0,0,0|1,0,1]=4 293 B13R2.5179 CC1=CC=C2C(N)=CC=CC2=C1 DY443731 [1,1,0,0,0,0|2,0,0]=4 294 B13R2.5179 CC1=CC=CC2=CC(Cl)=CC=C12 DY763811 [1,1,0,0,0,0|2,0,0]=4 295 B13R2.5179 CC1=CC=NC2=CC(O)=CC=C12 DY689523 [1,1,0,0,0,0|2,0,0]=4 296 B13R2.5179 CC1=NC2=CC=CC(N)=C2C=C1 DY41751 [1,1,0,0,0,0|1,0,1]=4 297 B13R2.5179 FC1=C2N=CC(Br)=CC2=CC=C1 DY429330 [1,1,0,0,0,0|1,0,1]=4 298 B13R2.5179 FC1=CC=CC2=CC(I)=CC=C12 DY764903 [1,1,0,0,0,0|2,0,0]=4 299 B13R2.5179 NC1=C2CCC(=O)NC2=CC=C1 DY456430 [1,1,0,0,0,0|0,0,2]=4 300 B13R2.5179 NC1=C2N=CC(F)=CC2=CC=C1 DY688842 [1,1,0,0,0,0|1,0,1]=4 301 B13R2.5179 NC1=CC2=CC=CC(Br)=C2C=C1 DY763277 [1,1,0,0,0,0|2,0,0]=4 302 B13R2.5179 NC1=NC2=CC=CC(Cl)=C2C=C1 DY566961 [1,1,0,0,0,0|1,0,1]=4 303 B13R2.5179 O=C1C=C2C=CC=C(Cl)C2=CN1 DY557793 [1,1,0,0,0,0|2,0,0]=4 304 B13R2.5179 O=C1C=CC2=C(Cl)C=CC=C2O1 DY677772 [1,1,0,0,0,0|1,0,0]=3 305 B13R2.5179 O=C1C=CC2=C(O)C=CC=C2N1 DY548157 [1,1,0,0,0,0|0,0,0]=2 306 B13R2.5179 O=C1C=NC2=C(N=CC=C2Cl)N1 DY534351 [1,1,0,0,0,0|2,0,0]=4 307 B13R2.5179 OC1=C2N=CC(Cl)=CC2=CC=C1 DY688806 [1,1,0,0,0,0|1,0,1]=4 308 B13R2.5179 OC1=CC=C2C(F)=CC=CC2=C1 DY765533 [1,1,0,0,0,0|1,0,0]=3 309 B13R2.5179 OC1=CC=C2C(O)=CC=CC2=C1 NO15075 [1,1,0,0,0,0|1,0,0]=3 310 B13R2.5179 OC1=CC=CC2=CC(Br)=CC=C12 NO16736 [1,1,0,0,0,0|2,0,0]=4 311 B13R2.45 CC1=C(C=O)OC2=C1C=CC=C2 DY510753 [0,1,0,0,1,0|2,0,0]=4 312 B13R2.45 Cc1c(CO)oc2ccccc12 DY560265 [0,1,0,0,1,0|2,0,0]=4 313 B13R2.45 O=CC1=C(Br)C2=C(C=CC=C2)S1 DY449848 [0,1,0,0,1,0|2,0,0]=4 314 B13R2.45 O=CC1=C(Br)C2=CC=CC=C2N1 DY578985 [0,1,0,0,1,0|1,0,0]=3 315 B13R2.135 CC1=C(C#N)C2=CC=CC=C2N1 DY731425 [0,1,0,0,1,0|2,0,0]=4 316 B13R2.135 CC1=C(C=O)C2=CC=CC=C2N1 NO10068 [0,1,0,0,1,0|1,0,1]=4 317 B13R2.135 CC1=C(CN)C2=CC=CC=C2N1 DY728281 [0,1,0,0,1,0|2,0,0]=4 318 B13R2.3028 CC1=C(Br)NC2=CC=C(Cl)C=C21 DY727333 [0,1,0,0,1,0|2,0,0]=4 319 B13R2.3028 CC1=CC=C2NC(=O)C(=O)C2=C1 NO10988 [0,1,0,0,1,0|0,0,1]=3 320 B13R2.3028 CC1=CC=C2NC(Cl)=C(C)C2=C1 DY727423 [0,1,0,0,1,0|2,0,0]=4 321 B13R2.3028 CC1C(=O)NC2=CC=C(Br)C=C21 NO14604 [0,1,0,0,1,0|1,0,1]=4 322 B13R2.3028 CN1C(=O)NC2=C1C=C(Br)C=C2 DY547539 [0,1,0,0,1,0|2,0,0]=4 323 B13R2.3028 O=C1NC2=CC=C(Br)C=C2C1=O NO22039 [0,1,0,0,1,0|0,0,1]=3 324 B13R2.3028 O=C1NC2=CC=C(Cl)C=C2C1=O NO10615 [0,1,0,0,1,0|0,0,1]=3 325 B13R2.3028 O=C1NC2=NC=C(Br)C=C2C1=O NO16002 [0,1,0,0,1,0|1,0,1]=4 326 B13R2.3085 CN1C(=O)C(=O)C2=CC=CC=C21 DY538653 [0,1,0,0,1,0|0,0,1]=3 327 B13R2.3085 CN1C(=O)C(N)C2=CC=CC=C21 DY629948 [0,1,0,0,1,0|1,0,1]=4 328 B13R2.3085 NN1C(=O)C2=CC=CC=C2C1=O DY510711 [0,1,0,0,1,0|2,0,0]=4 329 B13R2.3085 O=C1C2=CC=CC=C2C(=O)N1Cl NO10531 [0,1,0,0,1,0|2,0,0]=4 330 B13R2.3085 O=C1C2=CC=CC=C2C(=O)N1O NO11782 [0,1,0,0,1,0|1,0,0]=3 331 B13R2.4825 CC1C(=O)NC2=C(F)C=CC=C21 DY520137 [0,1,0,0,1,0|1,0,1]=4 332 B13R2.4825 NC1C(=O)NC2=C(Br)C=CC=C21 DY629954 [0,1,0,0,1,0|1,0,1]=4 333 B13R2.4825 O=C1NC2=C(Br)C=CC=C2C1=O NO13925 [0,1,0,0,1,0|0,0,1]=3 334 B13R2.4825 O=C1NC2=C(Cl)C=CC=C2C1=O NO20590 [0,1,0,0,1,0|0,0,1]=3 335 B13R2.4825 O=C1NC2=C(F)C=CC=C2C1=O NO10646 [0,1,0,0,1,0|0,0,1]=3 336 B13R2.4856 O=C1NC2=CC=CC(Br)=C2C1=O NO13924 [0,1,0,0,1,0|0,0,1]=3 337 B13R2.4856 O=C1NC2=CC=CC(Cl)=C2C1=O NO22789 [0,1,0,0,1,0|0,0,1]=3 338 B13R2.4856 O=C1NC2=CC=CC(F)=C2C1=O NO22839 [0,1,0,0,1,0|0,0,1]=3 339 B13R2.4856 O=C1NC2=CC=CC(I)=C2C1=O DY538959 [0,1,0,0,1,0|0,0,1]=3 340 B13R2.5190 CC1C(=O)NC2=CC(F)=CC=C21 DY520155 [0,1,0,0,1,0|1,0,1]=4 341 B13R2.5190 NC1=CC=C2C(=O)C(=O)NC2=C1 DY630509 [0,1,0,0,1,0|0,0,1]=3 342 B13R2.5190 O=C1NC2=CC(Cl)=CC=C2C1=O NO10616 [0,1,0,0,1,0|0,0,1]=3 343 B13R2.5190 O=C1NC2=CC(F)=CC=C2C1=O NO10704 [0,1,0,0,1,0|0,0,1]=3 344 B15R2.117 COC1=CC2=CC=CC=C2C=C1CN DY764189 [0,2,0,0,0,0|2,0,0]=4 345 B15R2.274 CNN1C(=O)NC2=CC=CC=C2C1=O DY781258 [0,2,0,0,0,0|2,0,0]=4 346 B15R2.274 N#CC1=C(Cl)C2=CC=CC=C2OC1=O DY755863 [0,2,0,0,0,0|2,0,0]=4 347 B15R2.274 O=CC1=C(O)C2=CC=CC=C2OC1=O DY676658 [0,2,0,0,0,0|1,0,1]=4 348 B15R2.984 CC(=O)C1=CC2=CC=CC=C2NC1=O DY557067 [0,2,0,0,0,0|0,0,1]=3 349 B15R2.984 NC(=O)C1=CC2=CC=CC=C2C=C1O DY794769 [0,2,0,0,0,0|1,0,0]=3 350 B15R2.984 O=C(O)C1=CC2=CC=CC=C2C=C1O NO16286 [0,2,0,0,0,0|1,0,0]=3 351 B15R2.984 O=C(O)C1=NC2=CC=CC=C2NC1=O DY511125 [0,2,0,0,0,0|1,0,0]=3 352 B15R2.984 O=C([O-])C1=CC2=CC=CC=C2C=C1O DY768149 [0,2,0,0,0,0|1,0,0]=3 353 B15R2.1754 CCC1=CC2=CN=C(Br)C=C2NC1=O DY586225 [0,2,0,0,0,0|2,0,0]=4 354 B15R2.1754 NCC1=CC2=CC=C(F)C=C2NC1=O DY431500 [0,2,0,0,0,0|1,0,0]=3 355 B15R2.1754 O=CC1=C(O)C=C2OC(=O)C=CC2=C1 DY755971 [0,2,0,0,0,0|2,0,0]=4 356 B15R2.1754 O=CC1=CC2=CC=C(O)C=C2OC1=O DY545979 [0,2,0,0,0,0|1,0,1]=4 357 B15R2.1824 CC1=CC=C2NC(=O)C(CO)=CC2=C1 DY688571 [0,2,0,0,0,0|0,0,0]=2 358 B15R2.21243 CN1C(=O)C(CN)=CC2=CC=CC=C21 DY533181 [0,2,0,0,0,0|1,0,0]=3 359 B15R2.1007 CC1=C(I)C(=O)C2=CC(F)=CC=C2N1 DY690327 [0,2,0,0,0,0|2,0,0]=4 360 B15R2.1007 O=C1NC2=CC=C(Br)C=C2C(O)=C1Br DY688468 [0,2,0,0,0,0|1,0,0]=3 361 B15R2.6237 CC1=NC2=CC=CC=C2N(CN)C1=O DY784390 [0,2,0,0,0,0|2,0,0]=4 362 B15R2.9032 CN1C(=O)C(Cl)=C(O)C2=CC=CC=C21 DY688775 [0,2,0,0,0,0|1,0,0]=3 363 B15R2.63893 CC1=C(C)C2=CC=C(O)C=C2OC1=O DY680853 [0,2,0,0,0,0|2,0,0]=4 364 B15R2.63893 CC1=C(Cl)C(=O)OC2=CC(O)=CC=C21 NO11268 [0,2,0,0,0,0|2,0,0]=4 365 B15R2.63893 CC1=CC2=CC(N)=CC=C2N(C)C1=O DY586082 [0,2,0,0,0,0|1,0,0]=3 366 B15R2.13981 O=C1NC2=NC=C(F)C(Cl)=C2C=C1O DY508442 [0,2,0,0,0,0|1,0,0]=3 367 B15R2.21336 COC1=CC=C2C=C(Br)C(=O)OC2=C1 DY674685 [0,2,0,0,0,0|2,0,0]=4 368 B15R2.59733 O=C1NC2=C(Cl)C=C(Cl)C=C2C=C1Cl DY688462 [0,2,0,0,0,0|1,0,0]=3 369 B15R2.59733 O=C1NC2=CC(Cl)=CC(Br)=C2NC1=O DY783628 [0,2,0,0,0,0|1,0,1]=4 370 B15R2.62227 O=C1NC2=CC(Br)=C(Br)C=C2NC1=O DY578553 [0,2,0,0,0,0|1,0,1]=4 371 B15R2.63633 O=C1NC2=C(Cl)C=CC(Cl)=C2C=C1Br DY688703 [0,2,0,0,0,0|1,0,0]=3 372 B13R2.435 CC(=O)C1=CC2=CC=CC=C2N1 NO21212 [0,0,1,1,0,0|2,0,0]=4 373 B13R2.435 CC(=O)C1=NC2=C(C=CC=C2)O1 NO12977 [0,0,1,1,0,0|2,0,0]=4 374 B13R2.435 NC(=O)C1=CC2=C(C=CN=C2)N1 DY670474 [0,0,1,1,0,0|2,0,0]=4 375 B13R2.435 NC(=O)C1=CC2=CC=CN=C2N1 DY458747 [0,0,1,1,0,0|2,0,0]=4 376 B13R2.435 NC(=O)C1=NC2=C(C=CC=C2)N1 NO16659 [0,0,1,1,0,0|2,0,0]=4 377 B13R2.435 NC(=S)C1=CC2=CC=CC=C2N1 DY731437 [0,0,1,1,0,0|1,1,0]=4 378 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)O1 NO21478 [0,0,1,1,0,0|1,0,0]=3 379 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)S1 NO21476 [0,0,1,1,0,0|1,1,0]=4 380 B13R2.435 O=C(O)C1=CC2=CC=CC=C2N1 NO22268 [0,0,1,1,0,0|2,0,0]=4 381 B13R2.435 O=C(O)C1=CC2=NC=CC=C2O1 DY509336 [0,0,1,1,0,0|2,0,0]=4 382 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)N1 DY750679 [0,0,1,1,0,0|2,0,0]=4 383 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)N1 NO18211 [0,0,1,1,0,0|2,0,0]=4 384 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)O1 DY442734 [0,0,1,1,0,0|2,0,0]=4 385 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 NO19083 [0,0,1,0,1,0|2,0,0]=4 386 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 NO15488 [0,0,1,0,1,0|1,0,1]=4 387 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 NO15279 [0,0,1,0,1,0|1,0,1]=4 388 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 NO10862 [0,0,1,0,1,0|1,0,1]=4 389 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 NO10861 [0,0,1,0,1,0|1,0,1]=4 390 B11R1.222 O=C(NO)C1=C(O)C=CC=C1 NO11942 [0,0,1,0,1,0|2,0,0]=4 391 B11R2.1 BrC1=CC=C2C=CC=CN12 DY674727 [1,0,0,0,1,0|2,0,0]=4 392 B11R2.1 BrC1=CNC2=CC=CN=C12 NO13195 [1,0,0,0,1,0|2,0,0]=4 393 B11R2.1 BrC1=CNC2=CN=CC=C12 NO18417 [1,0,0,0,1,0|2,0,0]=4 394 B11R2.1 BrC1=COC2=C1C=CC=C2 NO20626 [1,0,0,0,1,0|2,0,0]=4 395 B11R2.1 CC1=CCC2=CC=CC=C12 DY106180 [1,0,0,0,1,0|1,0,1]=4 396 B11R2.1 CC1=CNC2=CC=CC=C12 NO11030 [1,0,0,0,1,0|1,0,0]=3 397 B11R2.1 CC1=CNC2=NC=CC=C12 NO22368 [1,0,0,0,1,0|2,0,0]=4 398 B11R2.1 CC1=NNC2=CC=CC=C21 NO17372 [1,0,0,0,1,0|2,0,0]=4 399 B11R2.1 CN1C=CC2=CC=CC=C21 NO11026 [1,0,0,0,1,0|2,0,0]=4 400 B11R2.1 IC1=CNC2=CC=CN=C12 NO15332 [1,0,0,0,1,0|2,0,0]=4 401 B11R2.1 IC1=CNC2=CN=CC=C12 NO15083 [1,0,0,0,1,0|2,0,0]=4 402 B11R2.1 IC1=CSC2=C1C=CC=C2 NO22329 [1,0,0,0,1,0|2,0,0]=4 403 B11R2.1 NC1=CNC2=CC=CC=C12 DY585665 [1,0,0,0,1,0|1,0,0]=3 404 B11R2.1 NC1=CNC2=CC=CC=C12 DY585666 [1,0,0,0,1,0|1,0,0]=3 405 B11R2.1 NC1=CNC2=NC=CC=C12 DY535557 [1,0,0,0,1,0|2,0,0]=4 406 B11R2.1 NC1=CSC2=C1C=CC=C2 NO13998 [1,0,0,0,1,0|2,0,0]=4 407 B11R2.1 NC1=NNC2=CC=CC=C21 NO20708 [1,0,0,0,1,0|2,0,0]=4 408 B11R2.1 NN1C=CC2=CC=CC=C21 NO19942 [1,0,0,0,1,0|2,0,0]=4 409 B11R2.1 O=C1CCC2=CC=CC=C12 NO18668 [1,0,0,0,1,0|0,0,2]=4 410 B11R2.1 O=C1CSC2=C1C=CC=C2 NO20606 [1,0,0,0,1,0|1,0,1]=4 411 B11R2.1 O=C1N=NC2=CC=CC=C12 DY762524 [1,0,0,0,1,0|2,0,0]=4 412 B11R2.1 O=C1NCC2=CC=CC=C12 NO11515 [1,0,0,0,1,0|1,0,1]=4 413 B11R2.1 O=C1NSC2=C1C=CC=C2 NO14057 [1,0,0,0,1,0|2,0,0]=4 414 B11R2.1 O=C1OCC2=CC=CC=C12 NO11853 [1,0,0,0,1,0|1,0,1]=4 415 B11R2.1 O=S1C=CC2=C1C=CC=N2 DY502185 [1,0,0,0,1,0|2,0,0]=4 416 B11R2.10 BrC1=CC2=CC=CC=C2C1 NO21490 [1,0,0,0,1,0|1,0,1]=4 417 B11R2.10 BrC1=NC2=C(C=CC=C2)N1 NO21331 [1,0,0,0,1,0|2,0,0]=4 418 B11R2.10 CC1=CC2=C(C=CN=C2)N1 NO15018 [1,0,0,0,1,0|2,0,0]=4 419 B11R2.10 CC1=CC2=CC=CC=C2N1 NO18563 [1,0,0,0,1,0|1,0,0]=3 420 B11R2.10 CC1=CC2=CC=CN=C2N1 NO19733 [1,0,0,0,1,0|2,0,0]=4 421 B11R2.10 CC1=CC2=NC=CC=C2N1 NO15017 [1,0,0,0,1,0|2,0,0]=4 422 B11R2.10 CC1=NC2=C(C=CC=C2)N1 NO15288 [1,0,0,0,1,0|2,0,0]=4 423 B11R2.10 ClC1=NC2=C(C=CC=C2)N1 NO21427 [1,0,0,0,1,0|2,0,0]=4 424 B11R2.10 IC1=CC2=CC=CN=C2N1 NO15616 [1,0,0,0,1,0|2,0,0]=4 425 B11R2.10 NC1=NC2=C(C=CC=C2)N1 NO16315 [1,0,0,0,1,0|2,0,0]=4 426 B11R2.10 O=C1CC2=C(C=CC=C2)O1 DY20944 [1,0,0,0,1,0|1,0,1]=4 427 B11R2.10 O=C1CC2=CC=CC=C2C1 NO16080 [1,0,0,0,1,0|1,0,1]=4 428 B11R2.10 O=C1CC2=CC=CC=C2N1 NO15184 [1,0,0,0,1,0|0,0,1]=3 429 B11R2.10 O=C1CC2=CC=CN=C2N1 DY523179 [1,0,0,0,1,0|1,0,1]=4 430 B11R2.10 O=C1NC2=C(C=CC=C2)O1 NO15190 [1,0,0,0,1,0|1,0,0]=3 431 B11R2.10 O=C1NC2=NC=CC=C2O1 NO18902 [1,0,0,0,1,0|2,0,0]=4 432 B11R2.10 O=C1OC2=C(C=CC=C2)O1 NO10973 [1,0,0,0,1,0|2,0,0]=4 433 B11R2.10 OC1=CC2=C(C=CC=C2)O1 DY751579 [1,0,0,0,1,0|1,0,0]=3 434 B11R2.10 OC1=CC2=CC=CC=C2N1 DY726793 [1,0,0,0,1,0|0,0,0]=2 435 B11R2.10 OC1=CC2=NC=CC=C2N1 DY670456 [1,0,0,0,1,0|1,0,0]=3 436 B11R2.10 OC1=CN2C=CC=CC2=N1 NO15598 [1,0,0,0,1,0|1,0,1]=4 437 B11R2.10 OC1=NC2=C(C=CC=C2)N1 NO20242 [1,0,0,0,1,0|1,0,0]=3 438 B11R2.10 SC1=NC2=C(C=CC=C2)N1 DY20678 [1,0,0,0,1,0|1,1,0]=4 439 B11R2.36 O=C1C=CN2N=CC=C2N1 NO12623 [1,0,0,0,1,0|2,0,0]=4 440 B11R2.36 OC1=CC2=C(C=CO2)C=C1 NO20605 [1,0,0,0,1,0|2,0,0]=4 441 B11R2.36 OC1=CC=C2NC=CC2=C1 NO20861 [1,0,0,0,1,0|2,0,0]=4 442 B11R2.36 OC1=CN=C2C=CSC2=C1 NO12905 [1,0,0,0,1,0|1,0,1]=4 443 B11R2.36 OC1=CN=C2NC=CC2=C1 NO18571 [1,0,0,0,1,0|1,0,1]=4 444 B13R1.351 O=C(O)C(=O)\C=C\C1=CC=CC=C1 DY585153 [0,0,1,0,0,1|1,0,1]=4