0 B13R2.369 BrC1=C(Br)C=C2C=CC=CC2=C1 SY050486 [0,0,0,0,0,0|3,0,0]=3 1 B13R2.369 CC1=C(Br)C=C2C=CC=NC2=C1 SY041623 [0,0,0,0,0,0|4,0,0]=4 2 B13R2.369 CC1=C(C)C=C2N=CC=CC2=C1 SY295179 [0,0,0,0,0,0|4,0,0]=4 3 B13R2.369 CC1=CC2=CC=CC=C2N=C1Cl SY040433 [0,0,0,0,0,0|3,0,0]=3 4 B13R2.369 CC1=NC2=CC=CC=C2N=C1Br SY034839 [0,0,0,0,0,0|4,0,0]=4 5 B13R2.369 CC1=NC2=CC=CC=C2N=C1Cl SY017612 [0,0,0,0,0,0|4,0,0]=4 6 B13R2.369 ClC1=C(Cl)C=C2C=CC=CC2=C1 SY272623 [0,0,0,0,0,0|3,0,0]=3 7 B13R2.369 ClC1=NC2=CC=CC=C2N=C1Cl SY019476 [0,0,0,0,0,0|4,0,0]=4 8 B13R2.369 ClC1=NC2=NC=CC=C2C=C1Br SY262286 [0,0,0,0,0,0|4,0,0]=4 9 B13R2.369 FC1=CC2=C(C=NC=C2)C=C1Br SY023347 [0,0,0,0,0,0|4,0,0]=4 10 B13R2.369 FC1=CC2=NC=CC=C2C=C1Br SY009673 [0,0,0,0,0,0|4,0,0]=4 11 B13R2.369 NC1=C(I)C=C2C=CC=CC2=C1 SY045819 [0,0,0,0,0,0|3,0,0]=3 12 B13R2.369 NC1=C(N)C=C2C=CC=CC2=C1 SY010815 [0,0,0,0,0,0|3,0,0]=3 13 B13R2.369 NC1=CC2=C(C=CC=C2)C=C1O SY020106 [0,0,0,0,0,0|2,0,0]=2 14 B13R2.369 NC1=CC2=C(C=CC=C2)NC1=O SY254129 [0,0,0,0,0,0|2,0,0]=2 15 B13R2.369 NC1=CC2=CC=CC=C2N=C1Cl SY034210 [0,0,0,0,0,0|3,0,0]=3 16 B13R2.369 OC1=C(Br)C=C2C=CC=CC2=C1 SY055576 [0,0,0,0,0,0|2,0,0]=2 17 B13R2.369 OC1=CC2=C(C=CC=C2)C=C1O SY015230 [0,0,0,0,0,0|1,0,1]=2 18 B13R2.369 OC1=NC2=CC=CC=C2N=C1Cl SY098102 [0,0,0,0,0,0|3,0,0]=3 19 B12R2.24 BrC1=CC2=C(C=C1)C=NC=C2 SY004580 [1,0,0,0,0,0|3,0,0]=4 20 B12R2.24 BrC1=CC2=C(C=CC=C2)C=N1 SY009417 [1,0,0,0,0,0|3,0,0]=4 21 B12R2.24 BrC1=CC2=C(C=CN=C2)C=C1 SY014834 [1,0,0,0,0,0|3,0,0]=4 22 B12R2.24 BrC1=CC2=CC=CN=C2N=C1 SY025496 [1,0,0,0,0,0|3,0,0]=4 23 B12R2.24 BrC1=CC2=CN=CC=C2N=C1 SY025501 [1,0,0,0,0,0|3,0,0]=4 24 B12R2.24 BrC1=CC=C2C=CC=NC2=C1 SY017164 [1,0,0,0,0,0|3,0,0]=4 25 B12R2.24 BrC1=CC=C2N=CC=CC2=C1 SY004614 [1,0,0,0,0,0|3,0,0]=4 26 B12R2.24 BrC1=CC=C2N=CC=CC2=C1 SY025844 [1,0,0,0,0,0|3,0,0]=4 27 B12R2.24 BrC1=NC2=C(C=CC=C2)C=C1 SY019854 [1,0,0,0,0,0|2,0,0]=3 28 B12R2.24 BrC1=NC2=CC=CC=C2N=C1 SY021711 [1,0,0,0,0,0|3,0,0]=4 29 B12R2.24 BrC1=NC2=CC=CN=C2C=C1 SY280063 [1,0,0,0,0,0|3,0,0]=4 30 B12R2.24 BrC1=NC2=NC=CC=C2C=C1 SY262277 [1,0,0,0,0,0|3,0,0]=4 31 B12R2.24 CC1=CC2=CC=CC=C2N=C1 SY048469 [1,0,0,0,0,0|2,0,0]=3 32 B12R2.24 CC1=NC2=CC=CN=C2C=C1 SY098561 [1,0,0,0,0,0|3,0,0]=4 33 B12R2.24 CC1=NC2=NC=CC=C2C=C1 SY017550 [1,0,0,0,0,0|3,0,0]=4 34 B12R2.24 ClC1=CC2=C(C=CC=C2)C=N1 SY005184 [1,0,0,0,0,0|3,0,0]=4 35 B12R2.24 ClC1=CC2=C(C=CC=N2)C=C1 SY021162 [1,0,0,0,0,0|3,0,0]=4 36 B12R2.24 ClC1=CC2=C(C=CN=C2)C=C1 SY065588 [1,0,0,0,0,0|3,0,0]=4 37 B12R2.24 ClC1=CC2=CC=CC=C2N=C1 SY021114 [1,0,0,0,0,0|2,0,0]=3 38 B12R2.24 ClC1=CC=C2C=CC=CC2=C1 SY055345 [1,0,0,0,0,0|2,0,0]=3 39 B12R2.24 ClC1=CC=C2C=NC=CC2=C1 SY021135 [1,0,0,0,0,0|3,0,0]=4 40 B12R2.24 ClC1=CC=C2N=CC=CC2=C1 SY021132 [1,0,0,0,0,0|3,0,0]=4 41 B12R2.24 ClC1=CN=C2C=CC=CC2=N1 SY014068 [1,0,0,0,0,0|3,0,0]=4 42 B12R2.24 ClC1=NC2=CC=CC=C2C=C1 SY001152 [1,0,0,0,0,0|2,0,0]=3 43 B12R2.24 ClC1=NC2=CC=CN=C2C=C1 SY027090 [1,0,0,0,0,0|3,0,0]=4 44 B12R2.24 ClC1=NC2=CC=NC=C2C=C1 SY031685 [1,0,0,0,0,0|3,0,0]=4 45 B12R2.24 ClC1=NC2=NC=CC=C2C=C1 SY114251 [1,0,0,0,0,0|3,0,0]=4 46 B12R2.24 ClC1=NC=C2C=CC=CC2=N1 SY004996 [1,0,0,0,0,0|3,0,0]=4 47 B12R2.24 FC1=CC2=C(C=C1)N=CC=C2 SY004609 [1,0,0,0,0,0|3,0,0]=4 48 B12R2.24 FC1=CC2=CC=CC=C2N=C1 SY260141 [1,0,0,0,0,0|2,0,0]=3 49 B12R2.24 IC1=CC2=CC=CC=C2N=C1 SY191981 [1,0,0,0,0,0|2,0,0]=3 50 B12R2.24 IC1=CC=C2C=CC=CC2=C1 SY103936 [1,0,0,0,0,0|2,0,0]=3 51 B12R2.24 IC1=CC=C2N=CC=CC2=C1 SY030914 [1,0,0,0,0,0|3,0,0]=4 52 B12R2.24 NC1=CC2=C(C=C1)C=NC=C2 SY021134 [1,0,0,0,0,0|3,0,0]=4 53 B12R2.24 NC1=CC2=C(C=C1)N=CC=C2 SY021131 [1,0,0,0,0,0|3,0,0]=4 54 B12R2.24 NC1=CC2=C(C=CC=C2)C=N1 SY030951 [1,0,0,0,0,0|3,0,0]=4 55 B12R2.24 NC1=CC2=C(C=CC=N2)C=C1 SY021315 [1,0,0,0,0,0|3,0,0]=4 56 B12R2.24 NC1=CC2=C(C=CN=C2)C=C1 SY020017 [1,0,0,0,0,0|3,0,0]=4 57 B12R2.24 NC1=CC=C2C=CC=NC2=C1 SY021164 [1,0,0,0,0,0|3,0,0]=4 58 B12R2.24 NC1=NC=C2C=CC=CC2=N1 SY109190 [1,0,0,0,0,0|3,0,0]=4 59 B12R2.24 O=C1C=CC2=C(C=CN=C2)N1 SY129309 [1,0,0,0,0,0|2,0,0]=3 60 B12R2.24 O=C1C=CC2=C(N=CC=C2)N1 SY241058 [1,0,0,0,0,0|2,0,0]=3 61 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 SY036247 [1,0,0,0,0,0|2,0,1]=4 62 B12R2.24 O=C1CNC2=C(C=CC=C2)C1 SY292612 [1,0,0,0,0,0|2,0,1]=4 63 B12R2.24 O=C1CNC2=C(C=CC=C2)N1 SY018411 [1,0,0,0,0,0|2,0,1]=4 64 B12R2.24 O=C1CNC2=CC=CC=C2O1 SY292600 [1,0,0,0,0,0|1,0,1]=3 65 B12R2.24 O=C1COC2=C(C=CC=C2)N1 SY007578 [1,0,0,0,0,0|1,0,2]=4 66 B12R2.24 O=C1CSC2=C(C=CC=C2)C1 SY033162 [1,0,0,0,0,0|2,0,1]=4 67 B12R2.24 O=C1NC2=CC=CC=C2CO1 SY129148 [1,0,0,0,0,0|2,0,1]=4 68 B12R2.24 OC1=CC2=C(C=C1)C=NC=C2 SY020019 [1,0,0,0,0,0|2,0,0]=3 69 B12R2.24 OC1=CC2=C(C=CC=C2)N=C1 SY009024 [1,0,0,0,0,0|1,0,0]=2 70 B12R2.24 OC1=CC2=CC=CC=C2C=N1 SY005563 [1,0,0,0,0,0|2,0,0]=3 71 B12R2.24 OC1=CC=C2C=CC=NC2=C1 SY025837 [1,0,0,0,0,0|2,0,0]=3 72 B12R2.24 OC1=CC=C2C=CN=CC2=C1 SY020018 [1,0,0,0,0,0|2,0,0]=3 73 B12R2.24 OC1=CC=C2N=CC=CC2=C1 SY003116 [1,0,0,0,0,0|2,0,0]=3 74 B12R2.24 OC1=CC=C2N=CC=NC2=C1 SY046618 [1,0,0,0,0,0|3,0,0]=4 75 B12R2.24 OC1=NC2=C(C=CC=C2)C=C1 SY003693 [1,0,0,0,0,0|1,0,1]=3 76 B12R2.24 OC1=NC2=C(C=CC=C2)N=C1 SY013680 [1,0,0,0,0,0|2,0,0]=3 77 B12R2.24 OC1=NC2=CC=CN=C2C=C1 SY116568 [1,0,0,0,0,0|2,0,1]=4 78 B12R2.24 [O-][N+]1=CC=C2C=CC=CC2=C1 SY024667 [1,0,0,0,0,0|2,0,1]=4 79 B14R2.1128 COC1=C(Br)C=C2C=CC=NC2=C1 SY260171 [0,1,0,0,0,0|3,0,0]=4 80 B14R2.1128 COC1=C(C)C=C2C=CC=NC2=C1 SY030009 [0,1,0,0,0,0|3,0,0]=4 81 B14R2.1128 COC1=C(N)C=C2C=CC=NC2=C1 SY244446 [0,1,0,0,0,0|3,0,0]=4 82 B14R2.1128 ClCC1=CC2=C(C=CC=C2)N=C1Cl SY019483 [0,1,0,0,0,0|3,0,0]=4 83 B14R2.1128 N#CC1=C(O)C=C2C=CC=CC2=C1 SY028476 [0,1,0,0,0,0|2,0,0]=3 84 B14R2.1128 N#CC1=NC2=C(C=CC=C2)NC1=O SY268150 [0,1,0,0,0,0|3,0,0]=4 85 B14R2.1128 NCC1=C(O)C=C2C=CC=CC2=C1 SY027128 [0,1,0,0,0,0|2,0,0]=3 86 B14R2.1128 O=CC1=C(F)C=C2C=CC=CC2=C1 SY275318 [0,1,0,0,0,0|2,0,0]=3 87 B14R2.1128 O=CC1=C(O)C=C2C=CC=CC2=C1 SY028654 [0,1,0,0,0,0|1,0,0]=2 88 B14R2.1128 O=CC1=NC2=CC=CC=C2C=C1Cl SY034207 [0,1,0,0,0,0|2,0,0]=3 89 B14R2.1128 O=CC1=NC2=CC=CC=C2N=C1Br SY034213 [0,1,0,0,0,0|3,0,0]=4 90 B14R2.1128 OCC1=C(F)C=C2C=CC=CC2=C1 SY280119 [0,1,0,0,0,0|2,0,0]=3 91 B14R2.8239 NC1=NC2=CC(I)=CC=C2C=C1Br SY288771 [0,1,0,0,0,0|3,0,0]=4 92 B14R2.8239 O=C1C=CC2=C(C=C(O)C(O)=C2)O1 SY036794 [0,1,0,0,0,0|2,0,1]=4 93 B12R1.43 C=C(C)C(=O)NC1=CC=CC=C1 SY051128 [0,0,1,0,0,0|2,0,0]=3 94 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O SY006039 [0,0,1,0,0,0|1,0,1]=3 95 B12R1.43 CC(CC1=CC=CC=C1)C(=O)O SY185587 [0,0,1,0,0,0|1,0,2]=4 96 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O SY001531 [0,0,1,0,0,0|1,0,2]=4 97 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O SY005120 [0,0,1,0,0,0|1,0,2]=4 98 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 SY103074 [0,0,1,0,0,0|1,0,2]=4 99 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 SY036063 [0,0,1,0,0,0|0,0,2]=3 100 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 SY020879 [0,0,1,0,0,0|0,0,2]=3 101 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 SY021341 [0,0,1,0,0,0|0,0,2]=3 102 B12R2.18 BrC1=C(Br)C2=CC=CC=C2S1 SY076565 [0,0,0,0,1,0|2,1,0]=4 103 B12R2.18 CC1=CC2=C(C=CC=C2)N1C SY004658 [0,0,0,0,1,0|3,0,0]=4 104 B12R2.18 CC1CC2=C(C=CC=C2)C1=O SY081370 [0,0,0,0,1,0|1,0,2]=4 105 B12R2.18 CN1C(=O)CC2=C1C=CC=C2 SY042826 [0,0,0,0,1,0|3,0,0]=4 106 B12R2.18 CN1C(=O)NC2=CC=CC=C21 SY045893 [0,0,0,0,1,0|3,0,0]=4 107 B12R2.18 CN1C(Br)=CC2=C1C=CC=C2 SY247582 [0,0,0,0,1,0|3,0,0]=4 108 B12R2.18 NN1SC2=CC=CC=C2C1=O SY294805 [0,0,0,0,1,0|3,0,0]=4 109 B12R2.18 O=C1CC2=C(C=CC=C2)C1=O SY016747 [0,0,0,0,1,0|0,0,2]=3 110 B12R2.18 O=C1NC2=CC=CC=C2C1=O SY005277 [0,0,0,0,1,0|1,0,1]=3 111 B12R2.18 O=C1NC2=NC=CC=C2C1=O SY107993 [0,0,0,0,1,0|2,0,1]=4 112 B12R2.18 O=C1OC2=CC=CC=C2C1=O SY023499 [0,0,0,0,1,0|0,0,1]=2 113 B12R2.100 OC1=CC2=C(C=C1O)NC=C2 SY041253 [0,0,0,0,1,0|2,0,1]=4 114 B11R1.40 C=CC(=O)NC1=CC=CC=C1 SY052499 [1,0,1,0,0,0|1,0,0]=3 115 B11R1.40 C=CC(=O)OC1=CC=CC=C1 SY050025 [1,0,1,0,0,0|0,0,0]=2 116 B11R1.40 NNC(=O)OC1=CC=CC=C1 SY262826 [1,0,1,0,0,0|2,0,0]=4 117 B11R1.40 O=C(CBr)OC1=CC=CC=C1 SY036432 [1,0,1,0,0,0|1,0,1]=4 118 B11R1.40 O=C\C(Br)=C\C1=CC=CC=C1 SY048553 [1,0,1,0,0,0|1,0,0]=3 119 B11R1.91 O=C(O)C#CC1=CC=CC=C1 SY023402 [1,0,1,0,0,0|0,0,2]=4 120 B11R1.91 O=C(O)C=CC1=CC=NC=C1 SY036404 [1,0,1,0,0,0|1,0,0]=3 121 B11R1.91 O=C(O)CCC1=CC=CC=C1 SY001654 [1,0,1,0,0,0|0,0,2]=4 122 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 SY009573 [1,0,1,0,0,0|1,0,0]=3 123 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 SY016110 [1,0,1,0,0,0|1,0,0]=3 124 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CC=C1 SY020168 [1,0,1,0,0,0|1,0,1]=4 125 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 SY012158 [1,0,1,0,0,0|1,0,1]=4 126 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 SY004721 [1,0,1,0,0,0|2,0,0]=4 127 B11R1.86 CC(=O)OC1=CC=CC=C1Br SY265515 [1,0,1,0,0,0|1,0,1]=4 128 B11R1.86 CC(=O)OC1=CC=CC=C1C SY052277 [1,0,1,0,0,0|0,0,2]=4 129 B11R1.86 CC(=O)OC1=CC=CC=C1F SY224313 [1,0,1,0,0,0|1,0,1]=4 130 B11R1.86 CC1=C(OC(=O)Cl)C=CC=C1 SY296811 [1,0,1,0,0,0|1,0,1]=4 131 B11R1.86 CC1=CC=CC=C1CC(=O)O SY003130 [1,0,1,0,0,0|1,0,1]=4 132 B11R1.86 NC1=CC=CC=C1CC(=O)O SY101243 [1,0,1,0,0,0|1,0,1]=4 133 B11R1.86 O=C(Cl)OC1=CC=CC=C1Br SY296808 [1,0,1,0,0,0|2,0,0]=4 134 B11R1.86 O=C(Cl)OC1=CC=CC=C1F SY202667 [1,0,1,0,0,0|2,0,0]=4 135 B11R1.86 O=C(Cl)OC1=CC=CC=C1I SY296904 [1,0,1,0,0,0|2,0,0]=4 136 B11R1.86 O=C(O)CC1=CC=CC=C1Br SY003588 [1,0,1,0,0,0|1,0,1]=4 137 B11R1.86 O=C(O)CC1=CC=CC=C1F SY003125 [1,0,1,0,0,0|1,0,1]=4 138 B11R1.86 O=C(O)CC1=CC=CC=C1I SY035508 [1,0,1,0,0,0|1,0,1]=4 139 B11R1.1 C=C\C=C\C1=CC=C(F)C=C1 SY277860 [1,0,1,0,0,0|2,0,0]=4 140 B11R2.20 C1=C2C=CC=NC2=CC=C1 SY246331 [2,0,0,0,0,0|1,0,0]=3 141 B11R2.20 C1=C2N=CC=CC2=CC=C1 SY246333 [2,0,0,0,0,0|1,0,0]=3 142 B11R2.20 C1=CC2=C(C=C1)CCC=C2 SY050004 [2,0,0,0,0,0|1,0,1]=4 143 B11R2.20 C1=CC2=C(C=C1)N=CC=N2 SY005377 [2,0,0,0,0,0|2,0,0]=4 144 B11R2.20 C1=CC2=C(C=C1)N=CN=C2 SY006075 [2,0,0,0,0,0|2,0,0]=4 145 B11R2.20 C1=CC2=C(C=CC=N2)N=C1 SY006006 [2,0,0,0,0,0|2,0,0]=4 146 B11R2.20 C1=CC2=CC=CC=C2N=C1 SY246329 [2,0,0,0,0,0|1,0,0]=3 147 B11R2.20 C1=CC2=CN=CC=C2N=C1 SY022984 [2,0,0,0,0,0|2,0,0]=4 148 B11R2.20 C1=CC=C2C=CC=NC2=C1 SY246281 [2,0,0,0,0,0|1,0,0]=3 149 B11R2.20 C1=CC=C2N=CC=CC2=C1 SY246332 [2,0,0,0,0,0|1,0,0]=3 150 B11R2.20 C1=CC=CC2=C1C=CN=C2 SY246282 [2,0,0,0,0,0|2,0,0]=4 151 B11R2.20 C1=CC=NC2=CC=CC=C12 SY246330 [2,0,0,0,0,0|1,0,0]=3 152 B11R2.20 C1=CN=C2N=CC=CC2=C1 SY021105 [2,0,0,0,0,0|2,0,0]=4 153 B11R2.20 C1=NC2=CC=CC=C2C=C1 SY246328 [2,0,0,0,0,0|1,0,0]=3 154 B13R1.133 O=C(O)C(=O)CC1=CC=C(F)C=C1 SY235376 [0,1,1,0,0,0|0,0,2]=4 155 B13R1.133 O=C(O)C(O)CC1=CC=C(Cl)C=C1 SY036070 [0,1,1,0,0,0|0,0,2]=4 156 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(Br)C=C1 SY058958 [0,1,1,0,0,0|0,0,2]=4 157 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(F)C=C1 SY036072 [0,1,1,0,0,0|0,0,2]=4 158 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(Br)C=C1 SY036071 [0,1,1,0,0,0|0,0,2]=4 159 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(F)C=C1 SY008377 [0,1,1,0,0,0|0,0,2]=4 160 B13R1.135 COC(=O)C(O)CC1=CC=CC=C1 SY112626 [0,1,1,0,0,0|0,0,2]=4 161 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 SY033782 [0,1,1,0,0,0|0,0,2]=4 162 B13R1.135 COC(=O)[C@H](O)CC1=CC=CC=C1 SY033769 [0,1,1,0,0,0|0,0,2]=4 163 B13R1.148 O=C(O)C(O)CC1=CC=CC(F)=C1 SY036074 [0,1,1,0,0,0|0,0,2]=4 164 B13R1.148 O=C(O)C(O)CC1=CC=CC(O)=C1 SY225438 [0,1,1,0,0,0|0,0,2]=4 165 B13R1.148 O=C(O)[C@@H](O)CC1=CC=CC(F)=C1 SY036066 [0,1,1,0,0,0|0,0,2]=4 166 B13R1.148 O=C(O)[C@H](O)CC1=CC=CC(Br)=C1 SY036067 [0,1,1,0,0,0|0,0,2]=4 167 B13R1.470 O=C(C=NO)NC1=CC=CC=C1F SY092509 [0,1,1,0,0,0|2,0,0]=4 168 B13R2.32 CC1=C(Br)C=NC2=CC=CC=C21 SY272016 [1,1,0,0,0,0|2,0,0]=4 169 B13R2.32 CC1=C(Cl)C2=CC=CC=C2N=C1 SY003960 [1,1,0,0,0,0|2,0,0]=4 170 B13R2.32 CC1=C(O)C2=CC=CC=C2N=C1 SY238243 [1,1,0,0,0,0|2,0,0]=4 171 B13R2.32 CC1=CC=C2C=CC=CC2=C1Br SY012657 [1,1,0,0,0,0|2,0,0]=4 172 B13R2.32 CC1=CC=C2C=CC=CC2=C1N SY050539 [1,1,0,0,0,0|2,0,0]=4 173 B13R2.32 CC1=CC=C2C=CC=CC2=C1O SY045991 [1,1,0,0,0,0|2,0,0]=4 174 B13R2.32 ClC1=C(I)C=NC2=CC=CC=C21 SY029139 [1,1,0,0,0,0|2,0,0]=4 175 B13R2.32 NC1=C(Br)C=NC2=C1C=CC=C2 SY021107 [1,1,0,0,0,0|2,0,0]=4 176 B13R2.32 NC1=C(Cl)C2=CC=CC=C2N=C1 SY041633 [1,1,0,0,0,0|2,0,0]=4 177 B13R2.32 NC1=CC=C2C=CC=CC2=C1Cl SY129327 [1,1,0,0,0,0|2,0,0]=4 178 B13R2.32 O=C1C2=C(C=CC=C2)C=CN1O SY292856 [1,1,0,0,0,0|2,0,0]=4 179 B13R2.32 OC1=C(Cl)C=NC2=CC=CC=C21 SY268163 [1,1,0,0,0,0|2,0,0]=4 180 B13R2.32 OC1=C(I)C=NC2=CC=CC=C21 SY029159 [1,1,0,0,0,0|2,0,0]=4 181 B13R2.32 OC1=C2C=CC=CC2=CC=C1Br SY021885 [1,1,0,0,0,0|2,0,0]=4 182 B13R2.32 OC1=CC=C2C=CC=CC2=C1Br SY020306 [1,1,0,0,0,0|1,0,0]=3 183 B13R2.32 OC1=CC=C2C=CC=CC2=C1Cl SY055883 [1,1,0,0,0,0|1,0,0]=3 184 B13R2.32 OC1=CC=C2C=CC=CC2=C1I SY019655 [1,1,0,0,0,0|1,0,0]=3 185 B13R2.57 BrCC1=NC2=C(C=CC=C2)C=C1 SY018619 [1,1,0,0,0,0|2,0,0]=4 186 B13R2.57 C#CC1=CC=C2C=CC=CC2=C1 SY050708 [1,1,0,0,0,0|2,0,0]=4 187 B13R2.57 C1=C2C=CC=CC2=CC=C1OC SY246289 [1,1,0,0,0,0|1,0,0]=3 188 B13R2.57 C1=CC2=CC=C(OC)C=C2C=C1 SY246288 [1,1,0,0,0,0|1,0,0]=3 189 B13R2.57 C=CC1=CC=C2C=CC=CC2=C1 SY106378 [1,1,0,0,0,0|2,0,0]=4 190 B13R2.57 COC1=CC2=C(C=C1)C=NC=C2 SY013880 [1,1,0,0,0,0|2,0,0]=4 191 B13R2.57 COC1=CC2=C(C=C1)N=CC=C2 SY012831 [1,1,0,0,0,0|2,0,0]=4 192 B13R2.57 COC1=CC2=C(C=CN=C2)C=C1 SY021161 [1,1,0,0,0,0|2,0,0]=4 193 B13R2.57 COC1=CC2=CC=CC=C2N=C1 SY021113 [1,1,0,0,0,0|1,0,0]=3 194 B13R2.57 COC1=CC=C2C=CC=NC2=C1 SY021166 [1,1,0,0,0,0|2,0,0]=4 195 B13R2.57 COC1=CC=C2C=CC=NC2=C1 SY021167 [1,1,0,0,0,0|2,0,0]=4 196 B13R2.57 COC1=NC2=CC=CC=C2C=C1 SY034140 [1,1,0,0,0,0|1,0,1]=4 197 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 SY018308 [1,1,0,0,0,0|2,0,0]=4 198 B13R2.57 N#CC1=CC=C2C=CC=CC2=C1 SY049690 [1,1,0,0,0,0|2,0,0]=4 199 B13R2.57 NCC1=CC=C2C=CC=CC2=C1 SY023509 [1,1,0,0,0,0|2,0,0]=4 200 B13R2.57 NCC1=CC=C2C=CC=CC2=C1 SY032005 [1,1,0,0,0,0|2,0,0]=4 201 B13R2.57 NCC1=NC2=CC=CC=C2C=C1 SY034716 [1,1,0,0,0,0|2,0,0]=4 202 B13R2.57 NNC1=CC=C2C=CC=CC2=C1 SY047024 [1,1,0,0,0,0|2,0,0]=4 203 B13R2.57 NNC1=NC2=CC=CC=C2C=C1 SY049526 [1,1,0,0,0,0|2,0,0]=4 204 B13R2.57 NOC1=CC2=CC=CC=C2N=C1 SY282520 [1,1,0,0,0,0|1,0,0]=3 205 B13R2.57 NOC1=CC2=CC=CC=C2N=C1 SY282521 [1,1,0,0,0,0|1,0,0]=3 206 B13R2.57 NOC1=CC=C2C=CC=CC2=C1 SY282068 [1,1,0,0,0,0|1,0,0]=3 207 B13R2.57 NOC1=CC=C2C=CC=CC2=C1 SY282069 [1,1,0,0,0,0|1,0,0]=3 208 B13R2.57 NOC1=CC=C2N=CC=CC2=C1 SY282276 [1,1,0,0,0,0|2,0,0]=4 209 B13R2.57 NOC1=CC=C2N=CC=CC2=C1 SY282277 [1,1,0,0,0,0|2,0,0]=4 210 B13R2.57 O=CC1=CC2=CC=CC=C2N=C1 SY002981 [1,1,0,0,0,0|1,0,1]=4 211 B13R2.57 O=CC1=CC2=CC=CN=C2C=C1 SY006068 [1,1,0,0,0,0|2,0,0]=4 212 B13R2.57 O=CC1=CC=C2C=CC=NC2=C1 SY050688 [1,1,0,0,0,0|2,0,0]=4 213 B13R2.57 O=CC1=NC2=CC=CC=C2C=C1 SY019180 [1,1,0,0,0,0|1,0,0]=3 214 B13R2.57 OCC1=CC2=CC=CC=C2C=C1 SY021110 [1,1,0,0,0,0|1,0,0]=3 215 B13R2.57 OCC1=CC=C2N=CC=CC2=C1 SY003114 [1,1,0,0,0,0|2,0,0]=4 216 B13R2.57 OCC1=NC2=CC=CC=C2N=C1 SY024806 [1,1,0,0,0,0|2,0,0]=4 217 B13R2.155 BrC1=CC=C2C=CC(Br)=CC2=C1 SY043343 [1,1,0,0,0,0|2,0,0]=4 218 B13R2.155 BrC1=CC=C2N=CC(Br)=CC2=C1 SY157076 [1,1,0,0,0,0|2,0,0]=4 219 B13R2.155 BrC1=CC=C2N=CC(I)=CC2=C1 SY117333 [1,1,0,0,0,0|2,0,0]=4 220 B13R2.155 CC1=CC2=C(C=CC(=O)O2)C=C1 SY051344 [1,1,0,0,0,0|0,0,0]=2 221 B13R2.155 CC1=CC2=CC(Br)=CC=C2N=C1 SY227329 [1,1,0,0,0,0|2,0,0]=4 222 B13R2.155 CC1=CC=C2C=CC(C)=CC2=C1 SY049119 [1,1,0,0,0,0|2,0,0]=4 223 B13R2.155 CC1=NC2=CC(Br)=CC=C2C=C1 SY041594 [1,1,0,0,0,0|2,0,0]=4 224 B13R2.155 CC1=NC2=CC(Cl)=CC=C2C=C1 SY015399 [1,1,0,0,0,0|2,0,0]=4 225 B13R2.155 CC1=NC2=CC(F)=CC=C2C=C1 SY018300 [1,1,0,0,0,0|2,0,0]=4 226 B13R2.155 CC1=NC2=CC(O)=CC=C2C=C1 SY026831 [1,1,0,0,0,0|2,0,0]=4 227 B13R2.155 ClC1=CC=C2N=CC(Br)=CC2=C1 SY258425 [1,1,0,0,0,0|2,0,0]=4 228 B13R2.155 ClC1=NC2=CC(Br)=CC=C2C=C1 SY022624 [1,1,0,0,0,0|2,0,0]=4 229 B13R2.155 FC1=CC2=CC(Br)=CC=C2N=C1 SY226057 [1,1,0,0,0,0|2,0,0]=4 230 B13R2.155 NC1=CC2=C(C=CC(=O)N2)C=C1 SY025890 [1,1,0,0,0,0|1,0,0]=3 231 B13R2.155 NC1=CC2=C(C=CC(=O)O2)C=C1 SY286160 [1,1,0,0,0,0|0,0,0]=2 232 B13R2.155 NC1=CC2=CC(F)=CC=C2N=C1 SY241282 [1,1,0,0,0,0|2,0,0]=4 233 B13R2.155 NC1=CC2=CC(O)=CC=C2N=C1 SY241258 [1,1,0,0,0,0|2,0,0]=4 234 B13R2.155 NC1=CC=C2C=CC(N)=CC2=C1 SY281266 [1,1,0,0,0,0|2,0,0]=4 235 B13R2.155 NC1=CC=C2N=CC(Br)=CC2=C1 SY017643 [1,1,0,0,0,0|2,0,0]=4 236 B13R2.155 NC1=CC=C2N=CC(O)=CC2=C1 SY265403 [1,1,0,0,0,0|1,0,0]=3 237 B13R2.155 NC1=NC2=CC(Br)=CC=C2C=C1 SY111832 [1,1,0,0,0,0|2,0,0]=4 238 B13R2.155 O=C1C=CC2=C(C=C(Br)C=C2)N1 SY022625 [1,1,0,0,0,0|1,0,0]=3 239 B13R2.155 O=C1C=CC2=C(C=C(Cl)C=C2)O1 SY036154 [1,1,0,0,0,0|0,0,0]=2 240 B13R2.155 O=C1C=CC2=C(C=C(Cl)N=C2)N1 SY267403 [1,1,0,0,0,0|2,0,0]=4 241 B13R2.155 O=C1C=CC2=C(C=C(I)C=C2)N1 SY294241 [1,1,0,0,0,0|1,0,0]=3 242 B13R2.155 O=C1C=CC2=C(C=C(O)C=C2)N1 SY047363 [1,1,0,0,0,0|1,0,0]=3 243 B13R2.155 O=C1C=CC2=C(C=C(O)C=C2)O1 SY001924 [1,1,0,0,0,0|0,0,0]=2 244 B13R2.155 O=C1C=CC2=NC=C(Cl)C=C2N1 SY270898 [1,1,0,0,0,0|2,0,0]=4 245 B13R2.155 O=C1C=NC2=C(C=C(Br)C=C2)N1 SY112246 [1,1,0,0,0,0|2,0,0]=4 246 B13R2.155 O=C1CCC2=C(C=C(Br)C=C2)O1 SY289389 [1,1,0,0,0,0|0,0,2]=4 247 B13R2.155 OC1=CC2=C(C=C1)C=CC(O)=C2 SY006498 [1,1,0,0,0,0|1,0,0]=3 248 B13R2.155 OC1=CC=C2C=CC(Br)=CC2=C1 SY006503 [1,1,0,0,0,0|1,0,0]=3 249 B13R2.155 OC1=CN=C2C=CC(Br)=CC2=C1 SY011719 [1,1,0,0,0,0|1,0,0]=3 250 B13R2.162 BrC1=CC2=C(Br)C=CC=C2C=C1 SY288545 [1,1,0,0,0,0|2,0,0]=4 251 B13R2.162 CC1=CC2=C(Br)C=CC=C2N=C1 SY247812 [1,1,0,0,0,0|2,0,0]=4 252 B13R2.162 CC1=CC2=C(N)C=CC=C2N=C1 SY271601 [1,1,0,0,0,0|2,0,0]=4 253 B13R2.162 CC1=CC=CC2=C1NC(=O)C=C2 SY021046 [1,1,0,0,0,0|1,0,0]=3 254 B13R2.162 CC1=NC2=C(Br)C=CC=C2C=C1 SY021112 [1,1,0,0,0,0|2,0,0]=4 255 B13R2.162 CC1=NC2=C(C)C=CC=C2C=C1 SY041606 [1,1,0,0,0,0|2,0,0]=4 256 B13R2.162 CC1=NC2=C(N)C=CC=C2C=C1 SY020984 [1,1,0,0,0,0|2,0,0]=4 257 B13R2.162 ClC1=CC2=C(Br)C=CC=C2C=C1 SY288544 [1,1,0,0,0,0|2,0,0]=4 258 B13R2.162 ClC1=NC2=C(Cl)C=CC=C2C=C1 SY013566 [1,1,0,0,0,0|2,0,0]=4 259 B13R2.162 FC1=CC2=C(Br)C=CC=C2N=C1 SY241193 [1,1,0,0,0,0|2,0,0]=4 260 B13R2.162 NC1=C2C=C(Cl)C=NC2=CC=C1 SY271598 [1,1,0,0,0,0|2,0,0]=4 261 B13R2.162 NC1=C2C=C(F)C=NC2=CC=C1 SY259064 [1,1,0,0,0,0|2,0,0]=4 262 B13R2.162 NC1=C2C=C(O)C=NC2=CC=C1 SY241181 [1,1,0,0,0,0|1,0,0]=3 263 B13R2.162 NC1=CC2=C(Br)C=CC=C2N=C1 SY241250 [1,1,0,0,0,0|2,0,0]=4 264 B13R2.162 NC1=CC=CC2=C1C=C(O)C=C2 SY011420 [1,1,0,0,0,0|1,0,0]=3 265 B13R2.162 O=C1C=CC2=C(N1)C(Br)=CC=C2 SY122943 [1,1,0,0,0,0|1,0,0]=3 266 B13R2.162 OC1=C2C=C(Br)C=NC2=CC=C1 SY034699 [1,1,0,0,0,0|2,0,0]=4 267 B13R2.162 OC1=CC2=C(Br)C=CC=C2N=C1 SY265098 [1,1,0,0,0,0|1,0,0]=3 268 B13R2.162 OC1=CC2=C(C=CC=C2I)C=C1 SY294388 [1,1,0,0,0,0|1,0,0]=3 269 B13R2.162 OC1=NC2=C(O)C=CC=C2C=C1 SY014374 [1,1,0,0,0,0|1,0,1]=4 270 B13R2.222 O=S1(=O)C=CC2=CC=CC=C2N1 SY295192 [1,1,0,0,0,0|2,0,0]=4 271 B13R2.328 BrC1=CC(I)=C2C=CC=CC2=C1 SY129739 [1,1,0,0,0,0|2,0,0]=4 272 B13R2.328 CC1=CC(Cl)=NC2=CC=CC=C12 SY035548 [1,1,0,0,0,0|2,0,0]=4 273 B13R2.328 CC1=NC2=CC=CC=C2C(Cl)=C1 SY057052 [1,1,0,0,0,0|2,0,0]=4 274 B13R2.328 CC1=NC2=CC=CC=C2C(N)=C1 SY020334 [1,1,0,0,0,0|2,0,0]=4 275 B13R2.328 CC1=NC2=CC=CC=C2C(O)=C1 SY048580 [1,1,0,0,0,0|2,0,0]=4 276 B13R2.328 ClC1=C2C=CC=CC2=CC(Br)=C1 SY283525 [1,1,0,0,0,0|2,0,0]=4 277 B13R2.328 ClC1=CC(Cl)=NC2=CC=CC=C12 SY047605 [1,1,0,0,0,0|2,0,0]=4 278 B13R2.328 FC1=CC(Cl)=NC2=CC=CC=C12 SY301197 [1,1,0,0,0,0|2,0,0]=4 279 B13R2.328 NC1=C2C=CC=CC2=CC(O)=C1 SY271721 [1,1,0,0,0,0|1,0,0]=3 280 B13R2.328 NC1=CC(Cl)=NC2=CC=CC=C12 SY037385 [1,1,0,0,0,0|2,0,0]=4 281 B13R2.328 O=C1C=C(Br)C2=C(N=CC=C2)N1 SY224760 [1,1,0,0,0,0|2,0,0]=4 282 B13R2.328 O=C1C=C(Br)C2=CC=CC=C2O1 SY026916 [1,1,0,0,0,0|0,0,0]=2 283 B13R2.328 O=C1C=C(Cl)C2=C(N=CC=C2)N1 SY033533 [1,1,0,0,0,0|2,0,0]=4 284 B13R2.328 O=C1C=C(O)C2=C(C=CC=C2)O1 SY001614 [1,1,0,0,0,0|0,0,0]=2 285 B13R2.328 O=C1NC(=O)C2=C(C=CC=C2)N1 SY003536 [1,1,0,0,0,0|2,0,0]=4 286 B13R2.328 OC1=C2C=CC=CC2=CC(Br)=C1 SY060750 [1,1,0,0,0,0|2,0,0]=4 287 B13R2.328 OC1=CC(Br)=C2C=CC=CC2=C1 SY029500 [1,1,0,0,0,0|1,0,0]=3 288 B13R2.328 OC1=CC(O)=NC2=CC=CC=C12 SY037068 [1,1,0,0,0,0|1,0,1]=4 289 B13R2.328 OC1=CC2=C(C=CC=C2)C(O)=C1 SY010964 [1,1,0,0,0,0|1,0,0]=3 290 B13R2.3683 BrC1=CC2=C(C=C1)C=C(Br)C=C2 SY014695 [1,1,0,0,0,0|2,0,0]=4 291 B13R2.3683 CC1=CC2=C(C=C1)N=C(C)C=C2 SY016998 [1,1,0,0,0,0|2,0,0]=4 292 B13R2.3683 CC1=CC=C2OC(=O)C=CC2=C1 SY012943 [1,1,0,0,0,0|0,0,0]=2 293 B13R2.3683 CC1=NC2=CC=C(Br)C=C2C=C1 SY017380 [1,1,0,0,0,0|2,0,0]=4 294 B13R2.3683 CC1=NC2=CC=C(F)C=C2C=C1 SY046958 [1,1,0,0,0,0|2,0,0]=4 295 B13R2.3683 ClC1=CC2=CC=C(Br)C=C2C=C1 SY244176 [1,1,0,0,0,0|2,0,0]=4 296 B13R2.3683 ClC1=CC=C2C=C(Br)C=CC2=N1 SY006768 [1,1,0,0,0,0|2,0,0]=4 297 B13R2.3683 ClC1=CC=C2N=C(Cl)C=CC2=C1 SY024410 [1,1,0,0,0,0|2,0,0]=4 298 B13R2.3683 FC1=CC=C2C=C(Br)C=NC2=C1 SY129390 [1,1,0,0,0,0|2,0,0]=4 299 B13R2.3683 FC1=CC=C2N=C(Cl)C=CC2=C1 SY103126 [1,1,0,0,0,0|2,0,0]=4 300 B13R2.3683 NC1=CC=C2C=C(Br)C=CC2=C1 SY030186 [1,1,0,0,0,0|2,0,0]=4 301 B13R2.3683 NC1=NC2=CC=C(Cl)C=C2C=C1 SY031686 [1,1,0,0,0,0|2,0,0]=4 302 B13R2.3683 O=C1C=CC2=C(C=CC(Br)=C2)O1 SY112628 [1,1,0,0,0,0|0,0,0]=2 303 B13R2.3683 O=C1C=CC2=C(C=CC(Cl)=C2)O1 SY036153 [1,1,0,0,0,0|0,0,0]=2 304 B13R2.3683 O=C1C=CC2=C(C=CC(I)=C2)N1 SY033794 [1,1,0,0,0,0|1,0,0]=3 305 B13R2.3683 O=C1C=CC2=CC(Br)=CC=C2N1 SY006761 [1,1,0,0,0,0|1,0,0]=3 306 B13R2.3683 O=C1C=CC2=CC(Cl)=NC=C2N1 SY128421 [1,1,0,0,0,0|2,0,0]=4 307 B13R2.3683 O=C1C=NC2=C(C=CC(Br)=C2)N1 SY031934 [1,1,0,0,0,0|2,0,0]=4 308 B13R2.3683 O=C1CCC2=CC(Br)=CC=C2O1 SY108538 [1,1,0,0,0,0|0,0,2]=4 309 B13R2.3683 O=C1N=CC2=C(C=CC(Br)=C2)N1 SY047984 [1,1,0,0,0,0|2,0,0]=4 310 B13R2.3683 OC1=CC2=C(C=C1)C=C(Br)C=C2 SY006200 [1,1,0,0,0,0|1,0,0]=3 311 B13R2.3683 OC1=CC2=C(C=C1)C=C(O)C=C2 SY014758 [1,1,0,0,0,0|1,0,0]=3 312 B13R2.3683 OC1=CC=C2C=C(F)C=CC2=C1 SY261520 [1,1,0,0,0,0|1,0,0]=3 313 B13R2.3683 OC1=CC=C2N=C(Cl)C=CC2=C1 SY111868 [1,1,0,0,0,0|2,0,0]=4 314 B13R2.5179 CC1=CC2=CC=CC(F)=C2C=C1 SY274216 [1,1,0,0,0,0|2,0,0]=4 315 B13R2.5179 CC1=CC2=CC=CC(N)=C2C=C1 SY121421 [1,1,0,0,0,0|2,0,0]=4 316 B13R2.5179 CC1=CC2=CC=CC(N)=C2N=C1 SY273599 [1,1,0,0,0,0|2,0,0]=4 317 B13R2.5179 CC1=CC2=CC=CC(O)=C2C=C1 SY268176 [1,1,0,0,0,0|2,0,0]=4 318 B13R2.5179 CC1=CC=CC2=C1C=CC(=O)N2 SY295224 [1,1,0,0,0,0|1,0,0]=3 319 B13R2.5179 CC1=NC2=CC=CC(Br)=C2C=C1 SY019640 [1,1,0,0,0,0|2,0,0]=4 320 B13R2.5179 NC1=C2C=CC(F)=NC2=CC=C1 SY271603 [1,1,0,0,0,0|2,0,0]=4 321 B13R2.5179 O=C1C=CC2=C(C=CC=C2Br)O1 SY269658 [1,1,0,0,0,0|0,0,0]=2 322 B13R2.5179 O=C1C=CC2=C(C=CC=C2O)N1 SY110039 [1,1,0,0,0,0|1,0,0]=3 323 B13R2.5179 O=C1C=CC2=C(N=CC=C2Cl)N1 SY036680 [1,1,0,0,0,0|2,0,0]=4 324 B13R2.5179 O=C1C=COC2=C1C=CC(O)=C2 SY233998 [1,1,0,0,0,0|2,0,0]=4 325 B13R2.5179 OC1=CC2=C(C=C1)C(O)=CC=C2 SY015233 [1,1,0,0,0,0|1,0,0]=3 326 B13R2.5179 OC1=CC=C2C(Br)=CC=CC2=N1 SY016638 [1,1,0,0,0,0|1,0,1]=4 327 B13R2.5179 OC1=CC=C2C(F)=CC=CC2=C1 SY278234 [1,1,0,0,0,0|1,0,0]=3 328 B13R2.5179 OC1=CC=CC2=CC(Br)=CC=C12 SY259898 [1,1,0,0,0,0|2,0,0]=4 329 B13R2.5179 [O-][N+]1=C2C=CC(O)=CC2=CC=C1 SY251128 [1,1,0,0,0,0|2,0,0]=4 330 B13R2.45 CC1=C(CO)OC2=CC=CC=C21 SY045663 [0,1,0,0,1,0|1,0,1]=4 331 B13R2.45 N#CC1=C(N)C2=CC=CC=C2O1 SY021446 [0,1,0,0,1,0|2,0,0]=4 332 B13R2.45 O=CC1=C(Cl)C2=C(C=CC=C2)C1 SY264217 [0,1,0,0,1,0|2,0,0]=4 333 B13R2.135 CC1=C(C=O)C2=C(C=CC=C2)N1 SY018466 [0,1,0,0,1,0|2,0,0]=4 334 B13R2.135 O=CC1=C(Cl)CC2=C1C=CC=C2 SY264310 [0,1,0,0,1,0|1,0,1]=4 335 B13R2.3028 CC1=CC=C2NC(=O)C(=O)C2=C1 SY007230 [0,1,0,0,1,0|1,0,1]=4 336 B13R2.3028 O=C1NC2=C(C=C(Cl)C=C2)C1=O SY001523 [0,1,0,0,1,0|1,0,1]=4 337 B13R2.3028 O=C1NC2=C(C=C(F)C=C2)C1=O SY001816 [0,1,0,0,1,0|1,0,1]=4 338 B13R2.3085 CN1C(=O)C(=O)C2=C1C=CC=C2 SY048456 [0,1,0,0,1,0|1,0,1]=4 339 B13R2.3085 CN1C(=O)C(=O)C2=C1C=CC=C2 SY293688 [0,1,0,0,1,0|1,0,1]=4 340 B13R2.3085 CN1C(=O)C2=C(C=CC=C2)C1=O SY017788 [0,1,0,0,1,0|2,0,0]=4 341 B13R2.3085 NN1C(=O)C2=C(C=CC=C2)C1=O SY031980 [0,1,0,0,1,0|2,0,0]=4 342 B13R2.3085 O=C1C2=CC=CC=C2C(=O)N1Br SY048359 [0,1,0,0,1,0|2,0,0]=4 343 B13R2.4825 CC1=CC=CC2=C1NC(=O)C2=O SY081570 [0,1,0,0,1,0|1,0,1]=4 344 B13R2.4825 NC1=CC=CC2=C1NC(=O)C2=O SY058415 [0,1,0,0,1,0|1,0,1]=4 345 B13R2.4825 O=C1NC2=C(C=CC=C2Br)C1=O SY002925 [0,1,0,0,1,0|1,0,1]=4 346 B13R2.4825 O=C1NC2=C(C=CC=C2Cl)C1=O SY008499 [0,1,0,0,1,0|1,0,1]=4 347 B13R2.4825 O=C1NC2=C(C=CC=C2F)C1=O SY009282 [0,1,0,0,1,0|1,0,1]=4 348 B13R2.4825 O=C1NC2=C(C=CC=C2I)C1=O SY033891 [0,1,0,0,1,0|1,0,1]=4 349 B13R2.4825 O=C1NC2=C(C=CC=C2O)C1=O SY058417 [0,1,0,0,1,0|1,0,1]=4 350 B13R2.4856 CC1=CC=CC2=C1C(=O)C(=O)N2 SY015146 [0,1,0,0,1,0|1,0,1]=4 351 B13R2.4856 O=C1NC2=C(C1=O)C(Cl)=CC=C2 SY005279 [0,1,0,0,1,0|1,0,1]=4 352 B13R2.4856 O=C1NC2=C(C1=O)C(I)=CC=C2 SY033894 [0,1,0,0,1,0|1,0,1]=4 353 B13R2.4856 O=C1NC2=CC=CC(Br)=C2C1=O SY004146 [0,1,0,0,1,0|1,0,1]=4 354 B13R2.5190 CC1=CC=C2C(=O)C(=O)NC2=C1 SY016308 [0,1,0,0,1,0|1,0,1]=4 355 B13R2.5190 O=C1NC2=C(C=CC(Cl)=C2)C1=O SY015997 [0,1,0,0,1,0|1,0,1]=4 356 B13R2.5190 O=C1NC2=C(C=CC(F)=C2)C1=O SY009562 [0,1,0,0,1,0|1,0,1]=4 357 B13R2.5190 O=C1NC2=CC(Br)=CC=C2C1=O SY004824 [0,1,0,0,1,0|1,0,1]=4 358 B13R2.5190 O=C1NC2=CC(I)=CC=C2C1=O SY059763 [0,1,0,0,1,0|1,0,1]=4 359 B15R2.117 COC1=C(C=O)C=C2C=CC=CC2=C1 SY028653 [0,2,0,0,0,0|1,0,0]=3 360 B15R2.117 COC1=C(CO)C=C2C=CC=CC2=C1 SY267136 [0,2,0,0,0,0|1,0,1]=4 361 B15R2.888 O=C1NC2=C(C=CC=C2)C=C1CCBr SY291099 [0,2,0,0,0,0|2,0,0]=4 362 B15R2.984 NC1=C(C(=O)O)C=C2C=CC=CC2=C1 SY049342 [0,2,0,0,0,0|2,0,0]=4 363 B15R2.984 NC1=NC2=CC=CC=C2C=C1C(=O)O SY041506 [0,2,0,0,0,0|2,0,0]=4 364 B15R2.984 O=C(O)C1=CC2=CC=CC=C2N=C1Cl SY034199 [0,2,0,0,0,0|2,0,0]=4 365 B15R2.984 O=C(O)C1=CC2=CC=CC=C2N=C1O SY033881 [0,2,0,0,0,0|1,0,1]=4 366 B15R2.1754 O=CC1=CC2=C(C=C(O)C=C2)OC1=O SY282634 [0,2,0,0,0,0|0,0,1]=3 367 B15R2.59733 OC1=C(Br)C=C2C=C(Br)C=C(Cl)C2=C1 SY254095 [0,2,0,0,0,0|2,0,0]=4 368 B15R2.62227 OC1=CC2=CC(Br)=C(O)C=C2C=C1Br SY035972 [0,2,0,0,0,0|2,0,0]=4 369 B13R2.435 CC(=O)C1=CC2=CC=CC=C2O1 SY045444 [0,0,1,1,0,0|1,0,0]=3 370 B13R2.435 CC(=O)C1=CC2=CC=CC=C2S1 SY001822 [0,0,1,1,0,0|1,1,0]=4 371 B13R2.435 NC(=O)C1=CC2=C(C=CC=C2)N1 SY225211 [0,0,1,1,0,0|2,0,0]=4 372 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)C1 SY024866 [0,0,1,1,0,0|1,0,0]=3 373 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)N1 SY003715 [0,0,1,1,0,0|1,0,0]=3 374 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)O1 SY005603 [0,0,1,1,0,0|0,0,0]=2 375 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)S1 SY003106 [0,0,1,1,0,0|0,1,0]=3 376 B13R2.435 O=C(O)C1=CC2=C(C=CN=C2)N1 SY016149 [0,0,1,1,0,0|2,0,0]=4 377 B13R2.435 O=C(O)C1=CC2=CC=CN=C2N1 SY004412 [0,0,1,1,0,0|2,0,0]=4 378 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 SY004051 [0,0,1,1,0,0|2,0,0]=4 379 B13R2.435 O=C(O)C1=NC2=CC=CC=C2S1 SY042596 [0,0,1,1,0,0|1,1,0]=4 380 B13R2.435 O=C(O)C1=NN2C=CC=CC2=C1 SY004701 [0,0,1,1,0,0|2,0,0]=4 381 B13R2.435 O=C(O)C1CC2=CC=CC=C2O1 SY064576 [0,0,1,1,0,0|0,0,2]=4 382 B13R2.435 OB(O)C1=CC2=CC=CC=C2O1 SY022298 [0,0,1,1,0,0|1,0,1]=4 383 B13R2.163 O=C1CC2=CC=CC=C2C=CN1 SY018989 [0,0,1,1,0,0|2,0,0]=4 384 B13R2.1613 O=CC1=NC=CC2=C1C=CC=C2 SY025670 [0,0,1,1,0,0|2,0,0]=4 385 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 SY051220 [0,0,1,0,1,0|1,0,0]=3 386 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 SY036428 [0,0,1,0,1,0|0,0,2]=4 387 B11R1.36 CC(=O)C(O)C1=CC=CC=C1 SY028287 [0,0,1,0,1,0|1,0,1]=4 388 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 SY004963 [0,0,1,0,1,0|1,0,1]=4 389 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 SY020842 [0,0,1,0,1,0|1,0,1]=4 390 B11R1.36 C[C@H](C(=O)O)C1=CC=CC=C1 SY021075 [0,0,1,0,1,0|1,0,1]=4 391 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 SY006358 [0,0,1,0,1,0|1,0,1]=4 392 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 SY006196 [0,0,1,0,1,0|1,0,1]=4 393 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 SY005672 [0,0,1,0,1,0|1,0,1]=4 394 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 SY004129 [0,0,1,0,1,0|0,0,1]=3 395 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 SY110356 [0,0,1,0,1,0|1,0,1]=4 396 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 SY001670 [0,0,1,0,1,0|0,0,1]=3 397 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 SY289327 [0,0,1,0,1,0|0,0,1]=3 398 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 SY001645 [0,0,1,0,1,0|0,0,1]=3 399 B11R1.222 CC1=CC=CC=C1C(=O)CO SY130976 [0,0,1,0,1,0|0,0,2]=4 400 B11R1.222 O=C(CO)C1=CC=CC=C1Br SY130966 [0,0,1,0,1,0|1,0,1]=4 401 B11R1.222 O=C(CO)C1=CC=CC=C1Cl SY032642 [0,0,1,0,1,0|1,0,1]=4 402 B11R1.222 O=C(CO)C1=CC=CC=C1F SY130968 [0,0,1,0,1,0|1,0,1]=4 403 B11R1.222 O=C(CO)C1=CC=CC=C1I SY130988 [0,0,1,0,1,0|1,0,1]=4 404 B11R1.222 O=C(NO)C1=CC=CC=C1O SY046520 [0,0,1,0,1,0|2,0,0]=4 405 B11R2.1 BrC1=COC2=C1C=CC=C2 SY004448 [1,0,0,0,1,0|1,0,0]=3 406 B11R2.1 BrC1=COC2=C1C=CN=C2 SY059186 [1,0,0,0,1,0|2,0,0]=4 407 B11R2.1 BrC1=COC2=NC=CC=C12 SY059185 [1,0,0,0,1,0|2,0,0]=4 408 B11R2.1 BrC1=CSC2=CC=CC=C12 SY062543 [1,0,0,0,1,0|1,1,0]=4 409 B11R2.1 C1=CC2=C(C=C1)C=CN2C SY246326 [1,0,0,0,1,0|2,0,0]=4 410 B11R2.1 C1=CC2=C(C=C1)N(C)C=C2 SY246277 [1,0,0,0,1,0|2,0,0]=4 411 B11R2.1 C1=CC2=C(C=CC=C2)N1C SY246324 [1,0,0,0,1,0|2,0,0]=4 412 B11R2.1 C1=CC=CC2=C1C=CN2C SY246325 [1,0,0,0,1,0|2,0,0]=4 413 B11R2.1 C1=CC=CC2=C1N(C)C=C2 SY246327 [1,0,0,0,1,0|2,0,0]=4 414 B11R2.1 CC1=COC2=CC=CC=C12 SY028461 [1,0,0,0,1,0|1,0,0]=3 415 B11R2.1 ClC1=NOC2=CC=CC=C21 SY042811 [1,0,0,0,1,0|2,0,0]=4 416 B11R2.1 NC1=CNC2=C1C=CC=C2 SY236577 [1,0,0,0,1,0|2,0,0]=4 417 B11R2.1 NC1=CSC2=CC=CC=C12 SY151802 [1,0,0,0,1,0|1,1,0]=4 418 B11R2.1 NC1=NOC2=CC=CC=C21 SY034280 [1,0,0,0,1,0|2,0,0]=4 419 B11R2.1 NN1C=CC2=C1C=CC=C2 SY024456 [1,0,0,0,1,0|2,0,0]=4 420 B11R2.1 O=C1CCC2=C1C=CC=C2 SY001380 [1,0,0,0,1,0|0,0,2]=4 421 B11R2.1 O=C1COC2=C1C=CC=C2 SY011530 [1,0,0,0,1,0|0,0,2]=4 422 B11R2.1 O=C1CSC2=CC=CC=C12 SY030591 [1,0,0,0,1,0|1,0,1]=4 423 B11R2.1 O=C1NCC2=C1C=CC=C2 SY020116 [1,0,0,0,1,0|1,0,1]=4 424 B11R2.1 O=C1NNC2=C1C=CC=C2 SY051085 [1,0,0,0,1,0|2,0,0]=4 425 B11R2.1 O=C1OCC2=C1C=CC=C2 SY001701 [1,0,0,0,1,0|1,0,1]=4 426 B11R2.1 O=C1SSC2=CC=CC=C12 SY123412 [1,0,0,0,1,0|2,0,0]=4 427 B11R2.1 OC1=NOC2=CC=CC=C21 SY031398 [1,0,0,0,1,0|1,0,0]=3 428 B11R2.10 BrC1=CC2=C(C=CC=C2)C1 SY004720 [1,0,0,0,1,0|1,0,1]=4 429 B11R2.10 BrC1=CC2=CC=CC=C2O1 SY101367 [1,0,0,0,1,0|1,0,0]=3 430 B11R2.10 BrC1=NC2=CC=CC=C2O1 SY192184 [1,0,0,0,1,0|2,0,0]=4 431 B11R2.10 CC1=CC2=C(C=CC=C2)C1 SY037985 [1,0,0,0,1,0|1,0,1]=4 432 B11R2.10 CC1=CC2=CC=CC=C2O1 SY039830 [1,0,0,0,1,0|1,0,0]=3 433 B11R2.10 CC1=CN2C=CC=CC2=C1 SY261692 [1,0,0,0,1,0|2,0,0]=4 434 B11R2.10 CC1=NC2=CC=CC=C2O1 SY048477 [1,0,0,0,1,0|2,0,0]=4 435 B11R2.10 ClC1=CC2=C(C=CC=C2)N1 SY115626 [1,0,0,0,1,0|2,0,0]=4 436 B11R2.10 ClC1=CC2=CC=CC=C2O1 SY045676 [1,0,0,0,1,0|1,0,0]=3 437 B11R2.10 ClC1=NC2=C(C=CC=C2)O1 SY010741 [1,0,0,0,1,0|2,0,0]=4 438 B11R2.10 NC1=NC2=C(C=CC=C2)O1 SY010713 [1,0,0,0,1,0|2,0,0]=4 439 B11R2.10 O=C1CC2=C(C=CC=C2)C1 SY001481 [1,0,0,0,1,0|1,0,1]=4 440 B11R2.10 O=C1CC2=C(C=CC=C2)O1 SY038967 [1,0,0,0,1,0|0,0,1]=3 441 B11R2.10 O=C1CC2=CC=CC=C2N1 SY004718 [1,0,0,0,1,0|1,0,1]=4 442 B11R2.10 O=C1NC2=C(C=CC=C2)O1 SY007021 [1,0,0,0,1,0|1,0,0]=3 443 B11R2.10 O=C1NC2=C(C=CN=C2)O1 SY130167 [1,0,0,0,1,0|2,0,0]=4 444 B11R2.10 O=C1NC2=CC=CN=C2O1 SY116296 [1,0,0,0,1,0|2,0,0]=4 445 B11R2.10 O=C1NC2=NC=CC=C2O1 SY007988 [1,0,0,0,1,0|2,0,0]=4 446 B11R2.10 OC1=NC2=CC=CC=C2N1 SY033248 [1,0,0,0,1,0|2,0,0]=4 447 B11R2.10 OC1=NC2=CC=CC=C2S1 SY003005 [1,0,0,0,1,0|1,1,0]=4 448 B11R2.10 OC1=NN2C=CC=CC2=C1 SY116654 [1,0,0,0,1,0|2,0,0]=4 449 B11R2.10 SC1=NC2=CC=CC=C2O1 SY048415 [1,0,0,0,1,0|1,1,0]=4 450 B11R2.36 OC1=CC=C2C=CNC2=C1 SY003879 [1,0,0,0,1,0|2,0,0]=4 451 B11R2.36 OC1=CC=C2C=COC2=C1 SY045698 [1,0,0,0,1,0|2,0,0]=4 452 B11R2.36 OC1=CC=C2C=CSC2=C1 SY222429 [1,0,0,0,1,0|2,0,0]=4 453 B11R2.36 OC1=CC=C2NC=CC2=C1 SY008069 [1,0,0,0,1,0|2,0,0]=4 454 B11R2.36 OC1=CC=C2OC=CC2=C1 SY234089 [1,0,0,0,1,0|2,0,0]=4 455 B11R2.36 OC1=CN=C2NC=CC2=C1 SY006369 [1,0,0,0,1,0|2,0,0]=4 456 B13R1.351 C[C@H](O)C(=O)OCC1=CC=CC=C1 SY059510 [0,0,1,0,0,1|0,0,2]=4 457 B13R1.351 O=C(Cl)C(=O)OCC1=CC=CC=C1 SY292158 [0,0,1,0,0,1|1,0,1]=4