0 B12R1.125 O=C(O)CCC1=C(O)C=CC=C1 27370 [0,0,0,0,0,0|0,0,2]=2 1 B11R1.91 CC(=O)NCC1=CC=CC=C1 24146 [1,0,0,0,0,0|2,0,1]=4 2 B11R1.91 CC(=O)OCC1=CC=CC=C1 27188 [1,0,0,0,0,0|2,0,1]=4 3 B11R1.91 NC(=O)OCC1=CC=CC=C1 27153 [1,0,0,0,0,0|2,0,1]=4 4 B11R1.91 O=C(O)C#CC1=CC=CC=C1 22061 [1,0,0,0,0,0|0,0,2]=3 5 B11R1.91 O=C(O)CCC1=CC=CC=C1 25774 [1,0,0,0,0,0|0,0,2]=3 6 B11R1.91 O=C(O)CNC1=CC=CC=C1 03076 [1,0,0,0,0,0|1,0,1]=3 7 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 01532 [1,0,0,0,0,0|0,0,0]=1 8 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 27055 [1,0,0,0,0,0|1,0,0]=2 9 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 28730 [1,0,0,0,0,0|1,0,0]=2 10 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 28144 [1,0,0,0,0,0|1,0,0]=2 11 B11R1.91 O=C([O-])COC1=CC=CC=C1 01413 [1,0,0,0,0,0|1,0,2]=4 12 B13R1.90 COC1=C(CCC(=O)O)C=CC=C1 26845 [0,1,0,0,0,0|0,0,2]=3 13 B13R1.164 O=C(O)CCC1=CC=C(Cl)C=C1Cl 25779 [0,1,0,0,0,0|1,0,2]=4 14 B13R1.164 O=C(O)COC1=C(Cl)C=C(Cl)C=C1 01472 [0,1,0,0,0,0|2,0,1]=4 15 B13R1.201 CC1=C([C@@H](N)CC(=O)O)C=CC=C1 15618 [0,1,0,0,0,0|1,0,2]=4 16 B13R1.201 CC1=C([C@H](N)CC(=O)O)C=CC=C1 15617 [0,1,0,0,0,0|1,0,2]=4 17 B13R1.201 N[C@@H](CC(=O)O)C1=C(Br)C=CC=C1 15428 [0,1,0,0,0,0|1,0,2]=4 18 B13R1.201 N[C@@H](CC(=O)O)C1=C(Cl)C=CC=C1 15550 [0,1,0,0,0,0|1,0,2]=4 19 B13R1.201 N[C@@H](CC(=O)O)C1=C(F)C=CC=C1 15218 [0,1,0,0,0,0|1,0,2]=4 20 B13R1.201 N[C@H](CC(=O)O)C1=C(Br)C=CC=C1 15560 [0,1,0,0,0,0|1,0,2]=4 21 B13R1.201 N[C@H](CC(=O)O)C1=C(Cl)C=CC=C1 15549 [0,1,0,0,0,0|1,0,2]=4 22 B13R1.201 N[C@H](CC(=O)O)C1=C(F)C=CC=C1 15216 [0,1,0,0,0,0|1,0,2]=4 23 B13R1.201 N[C@H](CC(=O)O)C1=C(O)C=CC=C1 15647 [0,1,0,0,0,0|0,0,2]=3 24 B13R1.202 CC(OC1=C(Cl)C=CC=C1)C(=O)O 23229 [0,1,0,0,0,0|2,0,1]=4 25 B13R1.202 CC1=C(C[C@@H](N)C(=O)O)C=CC=C1 07427 [0,1,0,0,0,0|1,0,2]=4 26 B13R1.202 CC1=CC=CC=C1C[C@H](N)C(=O)O 07426 [0,1,0,0,0,0|1,0,2]=4 27 B13R1.202 NC(CC1=C(Cl)C=CC=C1)C(=O)O 14391 [0,1,0,0,0,0|1,0,2]=4 28 B13R1.202 NC(CC1=C(O)C=CC=C1)C(=O)O 21532 [0,1,0,0,0,0|0,0,2]=3 29 B13R1.202 N[C@@H](CC1=C(F)C=CC=C1)C(=O)O 02570 [0,1,0,0,0,0|1,0,2]=4 30 B13R1.202 N[C@@H](CC1=CC=CC=C1Br)C(=O)O 07428 [0,1,0,0,0,0|1,0,2]=4 31 B13R1.202 N[C@@H](CC1=CC=CC=C1Cl)C(=O)O 04092 [0,1,0,0,0,0|1,0,2]=4 32 B13R1.202 N[C@@H](CC1=CC=CC=C1I)C(=O)O 14501 [0,1,0,0,0,0|1,0,2]=4 33 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O 05225 [0,1,0,0,0,0|0,0,2]=3 34 B13R1.202 N[C@H](CC1=C(F)C=CC=C1)C(=O)O 04135 [0,1,0,0,0,0|1,0,2]=4 35 B13R1.202 N[C@H](CC1=CC=CC=C1Br)C(=O)O 07429 [0,1,0,0,0,0|1,0,2]=4 36 B13R1.202 N[C@H](CC1=CC=CC=C1Cl)C(=O)O 04093 [0,1,0,0,0,0|1,0,2]=4 37 B13R1.202 N[C@H](CC1=CC=CC=C1I)C(=O)O 14502 [0,1,0,0,0,0|1,0,2]=4 38 B13R1.528 COC(=O)\C=C\C1=CC=CC=C1Cl 23862 [0,1,0,0,0,0|1,0,0]=2 39 B13R2.435 CC(=O)C1=CC2=C(C=CC=C2)O1 30353 [0,0,0,1,0,0|1,0,0]=2 40 B13R2.435 NC(=O)C1=NN2C=CC=CC2=C1 20857 [0,0,0,1,0,0|3,0,0]=4 41 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)N1 21846 [0,0,0,1,0,0|1,0,0]=2 42 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 17072 [0,0,0,1,0,0|2,0,0]=3 43 B13R2.435 O=C(O)C1=CN2N=CC=CC2=N1 26245 [0,0,0,1,0,0|3,0,0]=4 44 B13R2.435 O=C(O)C1=NN2C=CC=CC2=C1 17810 [0,0,0,1,0,0|2,0,0]=3 45 B13R2.435 O=C(O)C1=NN2C=CC=NC2=C1 17367 [0,0,0,1,0,0|3,0,0]=4 46 B13R2.435 O=C(O)C1CC2=C(C=CC=C2)N1 21815 [0,0,0,1,0,0|1,0,2]=4 47 B13R2.435 O=C(O)[C@@H]1CC2=C(C=CC=C2)N1 06890 [0,0,0,1,0,0|1,0,2]=4 48 B13R2.435 O=C(O)[C@H]1CC2=C(C=CC=C2)N1 16595 [0,0,0,1,0,0|1,0,2]=4 49 B13R2.435 O=C([O-])C1=NC2=CC=CC=C2O1 18170 [0,0,0,1,0,0|1,0,1]=3 50 B13R2.435 OB(O)C1=CC2=C(C=CC=C2)S1 31056 [0,0,0,1,0,0|1,1,1]=4 51 B13R2.5179 OC1=CC2=CC=CC(Br)=C2C=N1 26377 [0,0,0,1,0,0|3,0,0]=4 52 B13R2.5179 OC1=CC2=CC=CC(O)=C2C=C1 31514 [0,0,0,1,0,0|1,0,0]=2 53 B11R1.86 CC(=O)NC1=C(I)C=CC=C1 23255 [0,0,0,0,1,0|3,0,0]=4 54 B11R1.86 O=C(O)CC1=C(F)C=CC=C1 21246 [0,0,0,0,1,0|1,0,1]=3 55 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 21887 [0,0,0,0,1,0|0,0,1]=2 56 B10R1.4 O\N=C\C1=C(Cl)C=CC=C1 24130 [2,0,0,0,0,0|2,0,0]=4 57 B10R1.4 O\N=C\C1=C(O)C=CC=C1 22050 [2,0,0,0,0,0|1,0,0]=3 58 B10R1.17 N#C\C=C\C1=CC=CC=C1 30870 [2,0,0,0,0,0|1,0,1]=4 59 B10R1.17 O=C\C=C\C1=CC=CC=C1 24523 [2,0,0,0,0,0|0,0,0]=2 60 B12R1.21 CC(=O)\C=C\C1=CC=C(Cl)C=C1 26066 [1,1,0,0,0,0|1,0,0]=3 61 B12R1.21 CC1=CC=C(CCC(=O)O)C=C1 25777 [1,1,0,0,0,0|0,0,2]=4 62 B12R1.21 NC1=CC=C(OCC(=O)O)C=C1 29066 [1,1,0,0,0,0|1,0,1]=4 63 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 25775 [1,1,0,0,0,0|0,0,2]=4 64 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 25776 [1,1,0,0,0,0|0,0,2]=4 65 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 05284 [1,1,0,0,0,0|0,0,2]=4 66 B12R1.21 O=C(O)COC1=CC=C(Cl)C=C1 01471 [1,1,0,0,0,0|1,0,1]=4 67 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 24940 [1,1,0,0,0,0|0,0,0]=2 68 B12R1.27 COC(=O)\C=C\C1=CC=CC=C1 30865 [1,1,0,0,0,0|0,0,0]=2 69 B12R1.27 O=C(NO)OCC1=CC=CC=C1 31324 [1,1,0,0,0,0|1,0,1]=4 70 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O 23228 [1,1,0,0,0,0|1,0,1]=4 71 B12R1.43 C\C(=C/C1=CC=CC=C1)[N+](=O)[O-] 24128 [1,1,0,0,0,0|1,0,1]=4 72 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O 00710 [1,1,0,0,0,0|0,0,2]=4 73 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O 00243 [1,1,0,0,0,0|0,0,2]=4 74 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O 00244 [1,1,0,0,0,0|0,0,2]=4 75 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 08027 [1,1,0,0,0,0|0,0,2]=4 76 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 09427 [1,1,0,0,0,0|0,0,2]=4 77 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 08031 [1,1,0,0,0,0|0,0,2]=4 78 B12R1.43 O=C([O-])C(=O)CC1=CC=CC=C1 21660 [1,1,0,0,0,0|0,0,2]=4 79 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 02274 [1,1,0,0,0,0|1,0,1]=4 80 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 29996 [1,1,0,0,0,0|0,0,2]=4 81 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 15326 [1,1,0,0,0,0|0,0,2]=4 82 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 15327 [1,1,0,0,0,0|0,0,2]=4 83 B12R1.226 O=C(O)COC1=CC(Cl)=CC=C1 17094 [1,1,0,0,0,0|1,0,1]=4 84 B12R1.124 O=C(O)C(Br)C1=C(Cl)C=CC=C1 28774 [0,1,0,0,1,0|1,0,1]=4 85 B12R1.124 O=C(O)[C@H](O)C1=CC=CC=C1Cl 31723 [0,1,0,0,1,0|1,0,1]=4 86 B12R1.127 CC1=CC(CC(=O)O)=C(C)C=C1 27375 [0,1,0,0,1,0|1,0,1]=4 87 B12R1.233 O=C(O)CC1=C(Br)C=C(Cl)C=C1 29150 [0,1,0,0,1,0|1,0,1]=4 88 B12R1.233 O=C(O)CC1=C(Br)C=C(O)C=C1 28993 [0,1,0,0,1,0|1,0,1]=4 89 B12R1.233 O=C(O)CC1=C(Cl)C=C(Cl)C=C1 31182 [0,1,0,0,1,0|1,0,1]=4 90 B14R1.160 CC1=CC=CC=C1C(=O)NCC(=O)O 21218 [0,1,0,0,0,1|1,0,1]=4 91 B14R1.160 NC1=C(C(=O)NCC(=O)O)C=CC=C1 10652 [0,1,0,0,0,1|1,0,1]=4 92 B14R1.482 CCOC1=C(\C=C\C(=O)O)C=CC=C1 27419 [0,2,0,0,0,0|0,0,0]=2 93 B14R1.840 COC1=C([C@@H](N)CC(=O)O)C=CC=C1 15632 [0,2,0,0,0,0|0,0,2]=4 94 B14R1.3135 COC1=C(C[C@@H](N)C(=O)O)C=CC=C1 07200 [0,2,0,0,0,0|0,0,2]=4 95 B14R1.3135 COC1=CC=CC=C1C[C@H](N)C(=O)O 05233 [0,2,0,0,0,0|0,0,2]=4 96 B12R1.232 O=C(O)C1=C(O)C=C(O)C(Br)=C1 26823 [0,0,1,1,0,0|2,0,0]=4 97 B12R1.258 CC(=O)C1=CC=CC(C(=O)O)=C1 27652 [0,0,1,1,0,0|0,0,2]=4 98 B12R1.258 O=C(O)C1=CC(B(O)O)=CC=C1 24576 [0,0,1,1,0,0|2,0,0]=4 99 B12R1.258 O=C(O)C1=CC(C(=O)O)=NC=C1 28020 [0,0,1,1,0,0|2,0,0]=4 100 B12R1.252 O=C(O)C\C=C\C1=CC=CC=C1 22384 [0,0,1,1,0,0|1,0,1]=4 101 B12R2.24 BrC1=CC=C2C=CC=CC2=C1 31005 [1,0,0,1,0,0|2,0,0]=4 102 B12R2.24 CC1=CC=C2C=CC=CC2=N1 29988 [1,0,0,1,0,0|2,0,0]=4 103 B12R2.24 NC1=CC=C2C=CC=CC2=N1 22501 [1,0,0,1,0,0|2,0,0]=4 104 B12R2.24 OC1=CC2=C(C=C1)C=NC=C2 19215 [1,0,0,1,0,0|2,0,0]=4 105 B12R2.32 CCC1=CC2=C(C=CC=C2)O1 30354 [1,0,0,1,0,0|1,0,1]=4 106 B12R2.32 O=CC1=CC2=C(C=CC=C2)N1 17607 [1,0,0,1,0,0|1,0,0]=3 107 B12R2.32 O=CC1=CC2=CN=CC=C2N1 18516 [1,0,0,1,0,0|2,0,0]=4 108 B12R2.32 O=CC1=CN2C=CC=CC2=N1 19406 [1,0,0,1,0,0|2,0,0]=4 109 B12R2.32 O=CC1=NC2=C(C=CC=C2)N1 17138 [1,0,0,1,0,0|2,0,0]=4 110 B12R2.32 O=CC1=NC2=C(C=CC=C2)S1 17164 [1,0,0,1,0,0|1,1,0]=4 111 B12R2.1081 BrC1=C2C=CC=CC2=CC=C1 31004 [1,0,0,1,0,0|2,0,0]=4 112 B12R2.1081 BrC1=CC=CC2=NC=CC=C12 28274 [1,0,0,1,0,0|2,0,0]=4 113 B12R2.1081 FC1=C2C=CC=CC2=CC=C1 26902 [1,0,0,1,0,0|2,0,0]=4 114 B12R2.1081 NC1=C2C=CC=CC2=CC=C1 01579 [1,0,0,1,0,0|2,0,0]=4 115 B12R2.1081 NC1=CC=CC2=NC=CC=C12 29948 [1,0,0,1,0,0|2,0,0]=4 116 B12R2.1081 OC1=C2C=CC=CC2=CC=C1 00844 [1,0,0,1,0,0|1,0,0]=3 117 B12R2.1081 OC1=C2C=CC=CC2=CN=C1 26114 [1,0,0,1,0,0|2,0,0]=4 118 B12R2.1081 OC1=C2C=CC=CC2=NC=C1 24649 [1,0,0,1,0,0|2,0,0]=4 119 B12R2.1081 OC1=CC=CC2=C1C=NC=C2 23179 [1,0,0,1,0,0|2,0,0]=4 120 B12R2.1081 OC1=CC=CC2=CC=CN=C12 00372 [1,0,0,1,0,0|2,0,0]=4 121 B12R2.1081 OC1=CC=CC2=CC=CN=C12 22079 [1,0,0,1,0,0|2,0,0]=4 122 B12R2.202 CC1=CC2=C(C=CC=C2O)N1 21519 [0,0,0,1,1,0|2,0,0]=4 123 B14R2.768 O=C(O)CC1=CN2C=CC=CC2=N1 18192 [0,0,0,1,0,1|2,0,0]=4 124 B14R2.768 O=C(O)CC1=NC2=CC=CC=C2N1 17130 [0,0,0,1,0,1|1,0,1]=4 125 B14R2.768 O=C(O)CN1C=C2C=CC=CC2=N1 18196 [0,0,0,1,0,1|1,0,1]=4 126 B14R2.768 O=C([O-])CC1=NC2=CC=CC=C2O1 17520 [0,0,0,1,0,1|0,0,2]=4 127 B14R2.781 CC(=O)C1=CC=C2C=CC=CC2=C1 26904 [0,0,0,1,0,1|2,0,0]=4 128 B14R2.781 CC(=O)C1=NC=C2C=CC=CC2=C1 18518 [0,0,0,1,0,1|2,0,0]=4 129 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)OC1 17110 [0,0,0,1,0,1|1,0,1]=4 130 B14R2.781 O=C(O)C1=CC2=CC=CN=C2C=C1 27668 [0,0,0,1,0,1|2,0,0]=4 131 B14R2.781 O=C(O)C1=CC=C2C=NC=CC2=N1 17374 [0,0,0,1,0,1|2,0,0]=4 132 B14R2.8032 O=C(O)C1=NNC2=C(Br)C=CC=C12 20582 [0,0,0,1,0,1|2,0,0]=4 133 B14R2.8032 O=C(O)C1=NNC2=C1C=CC=C2Cl 20586 [0,0,0,1,0,1|2,0,0]=4 134 B14R2.2 O=C(O)CC1=CNC2=C1C=CC=C2 00188 [0,1,0,1,0,0|1,0,1]=4 135 B14R2.450 CC1=C(C(=O)O)OC2=C1C=CC=C2 27749 [0,1,0,1,0,0|0,0,0]=2 136 B14R2.450 CN1C(C(=O)O)=CC2=C1C=CC=C2 21571 [0,1,0,1,0,0|1,0,0]=3 137 B14R2.450 NC(=O)C1=C(N)C2=C(C=CC=C2)O1 28329 [0,1,0,1,0,0|1,0,0]=3 138 B14R2.450 O=C(Cl)C1=C(Cl)C2=C(C=CC=C2)S1 24942 [0,1,0,1,0,0|1,1,0]=4 139 B14R2.450 O=C(O)C1=C(Cl)C2=C(C=CC=C2)S1 25642 [0,1,0,1,0,0|0,1,0]=3 140 B14R2.7969 CC1=CC=CC2=C1NC(C(=O)O)=C2 21579 [0,1,0,1,0,0|1,0,0]=3 141 B14R2.7969 CC1=CC=CC2=NC(C(=O)O)=CN12 17217 [0,1,0,1,0,0|2,0,0]=4 142 B14R2.7969 CC1=CC=CN2C=C(C(=O)O)N=C12 17162 [0,1,0,1,0,0|2,0,0]=4 143 B14R2.7969 O=C(O)C1=CC2=C(F)C=CC=C2N1 21167 [0,1,0,1,0,0|1,0,0]=3 144 B14R2.7969 O=C(O)C1=CC2=CC=CC(Br)=C2N1 20896 [0,1,0,1,0,0|1,0,0]=3 145 B14R2.4529 CC1=CC2=C(C=C1)NC(C(=O)O)=C2 21546 [0,1,0,1,0,0|1,0,0]=3 146 B14R2.4529 CC1=CC2=NC(C(=O)O)=CN2C=C1 17124 [0,1,0,1,0,0|2,0,0]=4 147 B14R2.4529 CC1=CN2C=C(C(=O)O)N=C2C=C1 17160 [0,1,0,1,0,0|2,0,0]=4 148 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)N1 21839 [0,1,0,1,0,0|1,0,0]=3 149 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=C2)N1 21995 [0,1,0,1,0,0|1,0,0]=3 150 B14R2.4529 O=C(O)C1=CC2=C(C=CC(F)=C2)N1 21996 [0,1,0,1,0,0|1,0,0]=3 151 B14R2.4529 O=C(O)C1=CC2=C(C=CC(F)=C2)S1 19119 [0,1,0,1,0,0|0,1,0]=3 152 B14R2.4529 O=C(O)C1=CC2=C(C=CC(O)=C2)N1 21566 [0,1,0,1,0,0|1,0,0]=3 153 B14R2.4529 O=C(O)C1=CC2=CC=C(Br)C=C2N1 24200 [0,1,0,1,0,0|1,0,0]=3 154 B14R2.4529 O=C(O)C1=CC2=CC=C(Br)C=C2S1 19191 [0,1,0,1,0,0|0,1,0]=3 155 B14R2.4529 O=C(O)C1=CN2C=C(Cl)C=CC2=N1 17012 [0,1,0,1,0,0|2,0,0]=4 156 B14R2.4529 O=C(O)C1=NC2=C(C=C(F)C=C2)N1 17760 [0,1,0,1,0,0|2,0,0]=4 157 B14R2.4529 O=C(O)C1=NC2=C(C=CC(Br)=C2)N1 18101 [0,1,0,1,0,0|2,0,0]=4 158 B14R2.4529 O=C(O)C1=NC2=CC=C(Cl)C=C2N1 17757 [0,1,0,1,0,0|2,0,0]=4 159 B14R2.972 COC(=O)C1=CC2=C(C=CC=C2)N1 21561 [0,1,0,1,0,0|1,0,0]=3 160 B14R2.1801 COC1=CC=C2C(O)=CC=NC2=C1 17360 [0,1,0,1,0,0|2,0,0]=4 161 B10R1.18 CC(=O)NC1=CC=CC=C1 06813 [1,0,0,0,1,0|2,0,0]=4 162 B10R1.18 O=C(O)CC1=CC=CN=C1 27783 [1,0,0,0,1,0|1,0,1]=4 163 B10R1.18 O=C(O)CC1=CC=NC=C1 28780 [1,0,0,0,1,0|1,0,1]=4 164 B10R1.66 CC(=O)\C=C/C1=CC=CO1 25734 [1,0,0,0,1,0|2,0,0]=4 165 B10R1.66 CC(=O)\C=C\C1=CC=CS1 25725 [1,0,0,0,1,0|2,0,0]=4 166 B10R1.61 CC(=O)C1=C(C)C=CC=C1 30419 [0,0,0,0,2,0|2,0,0]=4 167 B10R1.61 CC(=O)C1=C(Cl)C=CC=C1 26752 [0,0,0,0,2,0|2,0,0]=4 168 B10R1.61 CC(=O)C1=C(F)C=CC=C1 26745 [0,0,0,0,2,0|2,0,0]=4 169 B10R1.61 CC1=C(C(=O)O)C=CN=C1 17262 [0,0,0,0,2,0|2,0,0]=4 170 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 27155 [0,0,0,0,2,0|2,0,0]=4 171 B10R1.61 NC(=O)C1=C(N)C=CC=C1 24534 [0,0,0,0,2,0|2,0,0]=4 172 B10R1.61 NC(=S)C1=C(O)C=CC=C1 28538 [0,0,0,0,2,0|1,1,0]=4 173 B10R1.61 NC1=CC=CN=C1C(=O)O 17022 [0,0,0,0,2,0|2,0,0]=4 174 B10R1.61 NC1=CC=NC=C1C(=O)O 16977 [0,0,0,0,2,0|2,0,0]=4 175 B10R1.61 NC1=CN=CC=C1C(=O)O 16979 [0,0,0,0,2,0|2,0,0]=4 176 B10R1.61 NC1=NC=CC=C1C(=O)O 27030 [0,0,0,0,2,0|2,0,0]=4 177 B10R1.61 O=C(O)C1=C(Br)C=CC=N1 28502 [0,0,0,0,2,0|2,0,0]=4 178 B10R1.61 O=C(O)C1=C(Br)C=CN=C1 18059 [0,0,0,0,2,0|2,0,0]=4 179 B10R1.61 O=C(O)C1=C(Cl)C=CC=C1 31560 [0,0,0,0,2,0|1,0,0]=3 180 B10R1.61 O=C(O)C1=C(Cl)C=CC=N1 28530 [0,0,0,0,2,0|2,0,0]=4 181 B10R1.61 O=C(O)C1=C(Cl)C=CN=C1 27926 [0,0,0,0,2,0|2,0,0]=4 182 B10R1.61 O=C(O)C1=C(F)C=CC=C1 30015 [0,0,0,0,2,0|1,0,0]=3 183 B10R1.61 O=C(O)C1=C(I)C=CC=C1 24457 [0,0,0,0,2,0|1,0,0]=3 184 B10R1.61 O=C(O)C1=C(I)C=CC=N1 28576 [0,0,0,0,2,0|2,0,0]=4 185 B10R1.61 O=C(O)C1=C(O)C=CC=C1 01498 [0,0,0,0,2,0|0,0,0]=2 186 B10R1.61 O=C(O)C1=C(O)C=CC=C1 30167 [0,0,0,0,2,0|0,0,0]=2 187 B10R1.61 O=C(O)C1=C(S)C=CC=C1 24480 [0,0,0,0,2,0|0,1,0]=3 188 B10R1.61 O=C(O)C1=CC=CN=C1Cl 31902 [0,0,0,0,2,0|2,0,0]=4 189 B10R1.61 O=C(O)C1=CC=CN=C1F 27581 [0,0,0,0,2,0|2,0,0]=4 190 B10R1.61 O=C(O)C1=CC=NC=C1Br 17194 [0,0,0,0,2,0|2,0,0]=4 191 B10R1.61 O=C(O)C1=CC=NC=C1I 26142 [0,0,0,0,2,0|2,0,0]=4 192 B10R1.61 O=C(O)C1=NC=CC=C1O 24514 [0,0,0,0,2,0|1,0,0]=3 193 B10R1.61 O=C([O-])C1=C(O)C=CC=C1 26494 [0,0,0,0,2,0|0,0,1]=3 194 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=C1 02339 [0,0,0,0,2,0|1,0,1]=4