0 B14R2.112 C1=CC(=NC2=C1C=CC=C2)CCO AK-28366 [0,0,0,0,0,0|3,0,0]=3 1 B14R2.112 CNCC1=CC=C2C=CC=CC2=C1 AK115895 [0,0,0,0,0,0|2,0,0]=2 2 B14R2.112 NCCC1=CC=C2C=CC=CC2=C1 AK-79279 [0,0,0,0,0,0|2,0,0]=2 3 B13R2.57 BrCC1=CC=C2C=CC=CC2=C1 AK-48607 [1,0,0,0,0,0|1,0,0]=2 4 B13R2.57 BrCC1=CC=C2N=CC=CC2=C1 AK199207 [1,0,0,0,0,0|2,0,0]=3 5 B13R2.57 BrCC1=CC=C2N=CC=NC2=C1 AK136052 [1,0,0,0,0,0|3,0,0]=4 6 B13R2.57 BrCC1=NC2=CC=CC=C2C=C1 AK-35655 [1,0,0,0,0,0|2,0,0]=3 7 B13R2.57 C#CC1=CC=C2C=CC=CC2=C1 AK-48123 [1,0,0,0,0,0|0,0,2]=3 8 B13R2.57 C1=C(C=CC2=NC=CC=C12)C=O AK-25085 [1,0,0,0,0,0|2,0,1]=4 9 B13R2.57 C1=C(C=CC2=NC=CC=C12)CO AK-25097 [1,0,0,0,0,0|2,0,0]=3 10 B13R2.57 C1=C(NN)C=CC2=CC=CC=C12 AK-30555 [1,0,0,0,0,0|2,0,0]=3 11 B13R2.57 C1=C2C(=CC=C1)C=C(C=C2)CO AK-48971 [1,0,0,0,0,0|1,0,0]=2 12 B13R2.57 C1=NC(=CC2=C1C=CC=C2)C=O AK-24631 [1,0,0,0,0,0|2,0,1]=4 13 B13R2.57 C1=NC(=CC2=CC=CC=C12)CN AK-39317 [1,0,0,0,0,0|2,0,0]=3 14 B13R2.57 C1=NC(=CC2=CC=CC=C12)CO AK-24630 [1,0,0,0,0,0|2,0,0]=3 15 B13R2.57 COC1=CC2=C(C=C1)C=CN=C2 AK-35027 [1,0,0,0,0,0|1,0,0]=2 16 B13R2.57 COC1=CC2=C(C=C1)N=CC=C2 AK-39658 [1,0,0,0,0,0|1,0,0]=2 17 B13R2.57 COC1=CC2=C(C=CC=C2)C=C1 AK110812 [1,0,0,0,0,0|0,0,0]=1 18 B13R2.57 COC1=CC2=C(C=NC=C2)C=C1 AK-35505 [1,0,0,0,0,0|1,0,0]=2 19 B13R2.57 COC1=CC2=CC=CC=C2N=C1 AK-39637 [1,0,0,0,0,0|1,0,0]=2 20 B13R2.57 COC1=CC=C2C=CC=NC2=C1 AK-35323 [1,0,0,0,0,0|1,0,0]=2 21 B13R2.57 COC1=NC2=CC=CC=C2C=C1 AK-94453 [1,0,0,0,0,0|1,0,0]=2 22 B13R2.57 ClCC1=CC2=C(C=N1)C=CC=C2 AK-47007 [1,0,0,0,0,0|2,0,0]=3 23 B13R2.57 ClCC1=CC2=C(C=N1)C=CC=C2 AK-47121 [1,0,0,0,0,0|2,0,0]=3 24 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 AK-77406 [1,0,0,0,0,0|2,0,0]=3 25 B13R2.57 N#CC1=CC2=C(C=C1)C=CN=C2 AK-54885 [1,0,0,0,0,0|2,0,1]=4 26 B13R2.57 N#CC1=CC2=C(C=C1)C=NC=C2 AK-74313 [1,0,0,0,0,0|2,0,1]=4 27 B13R2.57 N#CC1=CC2=C(C=N1)C=CC=C2 AK-34461 [1,0,0,0,0,0|2,0,1]=4 28 B13R2.57 N1=CC=CC2=CC(=CC=C12)C#N AK-25091 [1,0,0,0,0,0|2,0,1]=4 29 B13R2.57 NCC1=CC2=C(C=CC=C2)C=C1 AK-33985 [1,0,0,0,0,0|1,0,0]=2 30 B13R2.57 NCC1=CC2=C(C=N1)C=CC=C2 AK162840 [1,0,0,0,0,0|2,0,0]=3 31 B13R2.57 NCC1=CC=C2C=CC=CC2=C1 AK-49046 [1,0,0,0,0,0|1,0,0]=2 32 B13R2.57 NCC1=CC=C2N=CC=CC2=C1 AK-24967 [1,0,0,0,0,0|2,0,0]=3 33 B13R2.57 NNC1=CC2=C(C=CC=C2)N=C1 AK-82067 [1,0,0,0,0,0|3,0,0]=4 34 B13R2.57 NNC1=CC=C2C=CC=NC2=C1 AK123011 [1,0,0,0,0,0|3,0,0]=4 35 B13R2.57 O=CC1=CC2=CC=CC=C2N=C1 AK-30242 [1,0,0,0,0,0|2,0,1]=4 36 B13R2.57 OCC1=CC2=C(C=C1)N=CC=N2 AK110758 [1,0,0,0,0,0|3,0,0]=4 37 B13R2.57 OCC1=CC2=NC=CC=C2N=C1 AK470825 [1,0,0,0,0,0|3,0,0]=4 38 B15R2.1282 C(C)OC1=CC=C2C(=C1)C=C(C=C2)O AK-28273 [0,1,0,0,0,0|0,0,0]=1 39 B15R2.1601 C1=C(C=CC2=CC=CC=C12)C(=O)C=O AK-10003 [0,1,0,0,0,0|2,0,1]=4 40 B15R2.1601 CC[C@@H](C1=CC=C2C=CC=CC2=C1)N AK172717 [0,1,0,0,0,0|1,0,0]=2 41 B15R2.1601 CC[C@H](C1=CC=C2C=CC=CC2=C1)N AK172719 [0,1,0,0,0,0|1,0,0]=2 42 B15R2.1601 COC(=O)C1=NC2=C(C=CC=C2)C=C1 AK-49531 [0,1,0,0,0,0|3,0,0]=4 43 B15R2.1601 N[C@H](C1=CC=C2C=CC=CC2=C1)CO AK544217 [0,1,0,0,0,0|2,0,0]=3 44 B15R2.1601 O=C(C1=CC2=C(C=N1)C=CC=C2)OC AK-29972 [0,1,0,0,0,0|3,0,0]=4 45 B15R2.1601 O=C(C1=CC2=CC=CC=C2N=C1)OC AK130436 [0,1,0,0,0,0|3,0,0]=4 46 B15R2.1601 O=C(C1=CC=C2N=CC=CC2=C1)OC AK-39659 [0,1,0,0,0,0|3,0,0]=4 47 B15R2.1601 O=C(OC)C1=CC=C2C=CC=CC2=C1 AK309188 [0,1,0,0,0,0|2,0,0]=3 48 B15R2.1668 CC(NC1=CC=C2N=CC=CC2=C1)=O AK162745 [0,1,0,0,0,0|2,0,1]=4 49 B15R2.1668 FC(F)OC1=CC=C2C=CC=CC2=C1 AK-62201 [0,1,0,0,0,0|1,0,0]=2 50 B15R2.1668 O=C(O)CC1=CC=C2C=CC=CC2=C1 AK-88438 [0,1,0,0,0,0|2,0,1]=4 51 B13R1.42 CCOC(=O)C=CC1=CC=NC=C1 AK-49599 [0,0,1,0,0,0|2,0,0]=3 52 B13R1.470 CCOC(=O)CC1=C(Cl)C=CC=C1 AK-40513 [0,0,1,0,0,0|2,0,1]=4 53 B13R1.470 O=C(OCC)CC1=CC=CC=C1I AK146854 [0,0,1,0,0,0|2,0,1]=4 54 B13R2.1 NCCC1=COC2=CC=CC=C12 AK-32065 [0,0,0,0,1,0|3,0,0]=4 55 B13R2.26 C1=CC=CC2=C1[NH]C(=N2)CCC AK-31915 [0,0,0,0,1,0|3,0,0]=4 56 B13R2.449 C1=C(C=C2C(=C1)C=C[NH]2)OCC AK-39304 [0,0,0,0,1,0|1,0,0]=2 57 B13R2.449 CCOC1=CC2=C(NC=C2)C=C1 AK-21810 [0,0,0,0,1,0|1,0,0]=2 58 B12R1.27 O=C(OC)\C=C\C1=CC=CC=C1 AK-93451 [1,0,1,0,0,0|1,0,0]=3 59 B12R1.32 O=C(OCC)CC1=CC=CC=C1 AK116248 [1,0,1,0,0,0|1,0,1]=4 60 B12R2.24 BrC1=CC2=CC=CC=C2C=N1 AK-23692 [2,0,0,0,0,0|2,0,0]=4 61 B12R2.24 BrC1=CC2=CC=CC=C2N=C1 AK-27162 [2,0,0,0,0,0|2,0,0]=4 62 B12R2.24 BrC1=CC=C2C(=C1)C=NC=C2 AK-26157 [2,0,0,0,0,0|2,0,0]=4 63 B12R2.24 BrC1=CC=C2C=CC=NC2=C1 AK-26028 [2,0,0,0,0,0|2,0,0]=4 64 B12R2.24 C1=C(Br)C=CC2=C1C=CN=C2 AK-23508 [2,0,0,0,0,0|2,0,0]=4 65 B12R2.24 C1=C(C=C2C(=C1)N=CC=C2)Cl AK-26786 [2,0,0,0,0,0|2,0,0]=4 66 B12R2.24 C1=C(F)C=CC2=C1C=CC=N2 AK-30337 [2,0,0,0,0,0|2,0,0]=4 67 B12R2.24 C1=C(N)C=CC2=C1N=CC=C2 AK-23984 [2,0,0,0,0,0|2,0,0]=4 68 B12R2.24 C1=C(N)N=CC2=CC=CC=C12 AK-27774 [2,0,0,0,0,0|2,0,0]=4 69 B12R2.24 C1=C(O)C=CC2=NC=CC=C12 AK-26149 [2,0,0,0,0,0|1,0,0]=3 70 B12R2.24 C1=C2C(=CC=C1Br)C=CC=C2 AK-35732 [2,0,0,0,0,0|1,0,0]=3 71 B12R2.24 C1=C2C(=NC=C1Cl)C=CC=C2 AK-39638 [2,0,0,0,0,0|2,0,0]=4 72 B12R2.24 C1=C2C(=NC=C1O)C=CC=C2 AK-26151 [2,0,0,0,0,0|1,0,0]=3 73 B12R2.24 C1=CC(=CC2=C1C=CC=N2)Cl AK-39660 [2,0,0,0,0,0|2,0,0]=4 74 B12R2.24 C1=CC2=C(N=C1N)C=CC=C2 AK-26798 [2,0,0,0,0,0|2,0,0]=4 75 B12R2.24 C1=CC=C2C(=N1)C=CC(=C2)Br AK-26082 [2,0,0,0,0,0|2,0,0]=4 76 B12R2.24 C1=CC=CC2=CC=C(N=C12)Br AK-24234 [2,0,0,0,0,0|2,0,0]=4 77 B12R2.24 C1=CC=CC2=CC=C(N=C12)Cl AK-27768 [2,0,0,0,0,0|2,0,0]=4 78 B12R2.24 C1=NC=CC2=CC=C(C=C12)N AK-25639 [2,0,0,0,0,0|2,0,0]=4 79 B12R2.24 CC1=CC2=CC=CC=C2N=C1 AK-72496 [2,0,0,0,0,0|1,0,0]=3 80 B12R2.24 CC1=NC2=NC=CC=C2C=C1 AK-44284 [2,0,0,0,0,0|2,0,0]=4 81 B12R2.24 ClC1=CC2=C(C=C1)C=CN=C2 AK-39352 [2,0,0,0,0,0|2,0,0]=4 82 B12R2.24 ClC1=CC2=C(C=NC=C2)C=C1 AK-35918 [2,0,0,0,0,0|2,0,0]=4 83 B12R2.24 ClC1=CC2=CC=CC=C2C=N1 AK-24474 [2,0,0,0,0,0|2,0,0]=4 84 B12R2.24 FC1=CC2=C(C=CN=C2)C=C1 AK-54877 [2,0,0,0,0,0|2,0,0]=4 85 B12R2.24 FC1=CC2=C(C=NC=C2)C=C1 AK-47714 [2,0,0,0,0,0|2,0,0]=4 86 B12R2.24 IC1=CC2=C(C=CC=C2)C=C1 AK110894 [2,0,0,0,0,0|1,0,0]=3 87 B12R2.24 IC1=CC=C2N=CC=CC2=C1 AK-28766 [2,0,0,0,0,0|2,0,0]=4 88 B12R2.24 NC1=CC=C2C=CC=NC2=C1 AK173105 [2,0,0,0,0,0|2,0,0]=4 89 B12R2.24 NC1=CC=C2C=NC=CC2=C1 AK-27243 [2,0,0,0,0,0|2,0,0]=4 90 B12R2.24 NC1=CC=C2N=CC=CC2=C1 AK-29433 [2,0,0,0,0,0|2,0,0]=4 91 B12R2.24 OC1=CC2=C(C=NC=C2)C=C1 AK-24368 [2,0,0,0,0,0|1,0,0]=3 92 B12R2.24 OC1=CC=C2C=CC=NC2=C1 AK-24768 [2,0,0,0,0,0|1,0,0]=3 93 B12R2.24 OC1=CC=C2N=CC=NC2=C1 AK112533 [2,0,0,0,0,0|2,0,0]=4 94 B12R2.24 OC1=NC2=C(C=CC=C2)C=C1 AK100046 [2,0,0,0,0,0|1,0,0]=3 95 B12R2.24 OC1=NC2=C(C=CC=C2)N=C1 AK-28738 [2,0,0,0,0,0|2,0,0]=4 96 B14R1.29 O=C(OCC)CC(C1=CC=CC=C1)=O AK-72988 [0,1,1,0,0,0|1,0,1]=4 97 B14R1.156 O=C(OCC=C)\C=C\C1=CC=CC=C1 AK114249 [0,1,1,0,0,0|1,0,1]=4 98 B14R1.502 CCOC(=O)/C=C/C1=CC=C(O)C=C1 AK104398 [0,1,1,0,0,0|1,0,0]=3 99 B14R1.502 O=C(OCC)\C=C\C1=CC=C(Br)C=C1 AK112240 [0,1,1,0,0,0|1,0,0]=3 100 B14R2.92 COC1=C(Br)C2=C(C=CC=C2)C=C1 AK-61767 [1,1,0,0,0,0|0,0,0]=2 101 B14R2.92 COC1=CC=C2C=CC=NC2=C1Br AK-39623 [1,1,0,0,0,0|1,0,0]=3 102 B14R2.92 N#CC1=CC=C2C=CC=CC2=C1N AK198913 [1,1,0,0,0,0|1,0,1]=4 103 B14R2.92 O=CC1=CC=C2C=CC=CC2=C1Br AK309830 [1,1,0,0,0,0|1,0,1]=4 104 B14R2.134 CC1=CC2=C(C=N1)C=CC(OC)=C2 AK141571 [1,1,0,0,0,0|1,0,0]=3 105 B14R2.134 COC1=CC2=C(C=C1)C=NC(=O)C2 AK-89477 [1,1,0,0,0,0|1,0,1]=4 106 B14R2.134 COC1=CC=C2C=CC(C)=NC2=C1 AK101790 [1,1,0,0,0,0|1,0,0]=3 107 B14R2.134 COC1=CC=C2N=CC(Br)=CC2=C1 AK-37986 [1,1,0,0,0,0|1,0,0]=3 108 B14R2.134 COC1=NC2=CC(Br)=CC=C2C=C1 AK120135 [1,1,0,0,0,0|1,0,0]=3 109 B14R2.134 N#CC1=CC=C2C=CC(O)=CC2=C1 AK-57326 [1,1,0,0,0,0|1,0,1]=4 110 B14R2.142 COC1=CC=C2N=CC=C(Cl)C2=C1 AK-25214 [1,1,0,0,0,0|1,0,0]=3 111 B14R2.142 COC1=NC2=C(Br)C=CN=C2C=C1 AK126152 [1,1,0,0,0,0|2,0,0]=4 112 B14R2.142 COC1=NC2=C(Cl)C=CN=C2C=C1 AK-39909 [1,1,0,0,0,0|2,0,0]=4 113 B14R2.142 ClC1=NC=NC2=CC=C(C=C12)OC AK-26698 [1,1,0,0,0,0|2,0,0]=4 114 B14R2.142 O=C1C=CNC2=C1C=C(OC)C=C2 AK-51079 [1,1,0,0,0,0|1,0,0]=3 115 B14R2.142 OC1=C2C=C(OC)C=CC2=NC=N1 AK-26701 [1,1,0,0,0,0|2,0,0]=4 116 B14R2.142 OC1=CC=NC2=CC=C(OC)C=C12 AK-26934 [1,1,0,0,0,0|1,0,0]=3 117 B14R2.781 C1=CC2=C(C=C1)C=C(C=C2)B(O)O AK-29150 [1,1,0,0,0,0|2,0,0]=4 118 B14R2.781 CC(C1=CC=C2C=CC=CC2=C1)=O AK-41057 [1,1,0,0,0,0|0,0,1]=3 119 B14R2.781 O=C(N)C1=CC=C2C=CC=CC2=C1 AK126301 [1,1,0,0,0,0|1,0,1]=4 120 B14R2.781 O=C(O)C1=CC=C2C=CC=CC2=C1 AK-44143 [1,1,0,0,0,0|1,0,1]=4 121 B14R2.1019 COC1=CC(Cl)=C2N=CC=CC2=C1 AK-31837 [1,1,0,0,0,0|1,0,0]=3 122 B14R2.1019 COC1=CC(N)=C2N=CC=CC2=C1 AK-27173 [1,1,0,0,0,0|1,0,0]=3 123 B14R2.1128 COC1=NC2=CC=CC=C2N=C1Cl AK-53465 [1,1,0,0,0,0|2,0,0]=4 124 B14R2.1801 CC1=CC=NC2=CC(OC)=CC=C12 AK-83171 [1,1,0,0,0,0|1,0,0]=3 125 B14R2.1801 CC1=CC=NC2=CC(OC)=CC=C12 AK172810 [1,1,0,0,0,0|1,0,0]=3 126 B14R2.1801 COC1=CC2=C(C=C1)C(=O)NC=C2 AK-76130 [1,1,0,0,0,0|1,0,0]=3 127 B14R2.1801 COC1=CC2=NC=CC(Cl)=C2N=C1 AK127237 [1,1,0,0,0,0|2,0,0]=4 128 B14R2.1801 COC1=CC2=NC=NC(Cl)=C2C=C1 AK-29394 [1,1,0,0,0,0|2,0,0]=4 129 B14R2.1801 COC1=CC=C2C(Cl)=CC=NC2=C1 AK-26257 [1,1,0,0,0,0|1,0,0]=3 130 B14R2.1801 O=C1C=COC2=C1C=CC(OC)=C2 AK104798 [1,1,0,0,0,0|1,0,0]=3 131 B14R2.1801 OC1=C2C=CC(OC)=CC2=CC=C1 AK-81857 [1,1,0,0,0,0|0,0,0]=2 132 B14R2.2332 C(#N)C1=CC=C2C=C(C=CC2=C1)O AK-27052 [1,1,0,0,0,0|1,0,1]=4 133 B14R2.2332 C1=C2C(=CC=C1OC)C=C(Br)C=C2 AK-35398 [1,1,0,0,0,0|0,0,0]=2 134 B14R2.2332 CCC1=CC2=C(C=C1)C=C(O)C=C2 AK-33971 [1,1,0,0,0,0|0,0,0]=2 135 B14R2.2332 COC1=CC2=C(C=C1)C=C(Br)C=N2 AK-38059 [1,1,0,0,0,0|1,0,0]=3 136 B14R2.2332 COC1=CC2=C(C=C1)N=C(C)C=C2 AK-86842 [1,1,0,0,0,0|1,0,0]=3 137 B14R2.2332 COC1=CC=C2N=C(Cl)C=CC2=C1 AK-33182 [1,1,0,0,0,0|1,0,0]=3 138 B14R2.2332 COC1=CC=C2N=C(Cl)C=NC2=C1 AK-37322 [1,1,0,0,0,0|2,0,0]=4 139 B14R2.2332 NC1=CC2=CC=C(OC)C=C2N=C1 AK-37578 [1,1,0,0,0,0|1,0,0]=3 140 B14R2.2332 O=CC1=CC=C2C=C(O)C=CC2=C1 AK-23863 [1,1,0,0,0,0|1,0,1]=4 141 B14R2.2332 OCC1=CC2=C(C=C1)C=C(Br)C=C2 AK-41145 [1,1,0,0,0,0|1,0,0]=3 142 B14R2.3 C1=CC=CC2=C1C(=C[NH]2)CCCN AK-22164 [0,1,0,0,1,0|2,0,0]=4 143 B16R2.767 C1=CC2=NC=CC=C2C=C1C(OCC)=O AK-39579 [0,2,0,0,0,0|1,0,0]=3 144 B16R2.767 C1=NC(=CC2=CC=CC=C12)C(=O)OCC AK-24629 [0,2,0,0,0,0|1,0,0]=3 145 B16R2.767 CCOC(=O)C1=CC2=C(C=CN=C2)C=C1 AK100920 [0,2,0,0,0,0|1,0,0]=3 146 B16R2.767 CCOC(=O)C1=NC2=C(C=CC=C2)C=C1 AK-99966 [0,2,0,0,0,0|1,0,0]=3 147 B16R2.767 O=C(C1=CC2=C(C=NC=C2)C=C1)OCC AK-76194 [0,2,0,0,0,0|1,0,0]=3 148 B16R2.767 O=C(C1=CC=C2N=CC=NC2=C1)OCC AK143367 [0,2,0,0,0,0|2,0,0]=4 149 B16R2.2441 CCCCOC1=CC=C2C=CC=CC2=C1 AK122146 [0,2,0,0,0,0|0,0,0]=2 150 B16R2.1205 O=C(OC)C1=CC=C2C=CC(O)=CC2=C1 AK151546 [0,2,0,0,0,0|2,0,0]=4 151 B16R2.33799 O=C(NC)C1=CC=C2C=C(Br)C=CC2=C1 AK-86964 [0,2,0,0,0,0|2,0,0]=4 152 B16R2.33799 O=C(OC)C1=CC=C2C=C(Br)C=CC2=C1 AK-86846 [0,2,0,0,0,0|2,0,0]=4 153 B16R2.33799 O=C(OC)C1=CC=C2C=C(O)C=CC2=C1 AK-62924 [0,2,0,0,0,0|2,0,0]=4 154 B16R2.173132 O=C(OC)C1=CC=C2C(Br)=CC=CC2=C1 AK174815 [0,2,0,0,0,0|2,0,0]=4 155 B14R2.1072 O=CC1=CC=CC2=C1C=CN2CC AK121010 [0,0,1,1,0,0|2,0,0]=4 156 B14R2.7150 C1=CC=CC2=C1C(=CC=C2)CNC AK-73008 [0,0,1,1,0,0|2,0,0]=4 157 B14R2.7150 C1=CC=CC2=CC=CC(=C12)CCO AK-36353 [0,0,1,1,0,0|2,0,0]=4 158 B14R2.7150 CNCC1=CC=CC2=C1C=CC=C2 AK111097 [0,0,1,1,0,0|2,0,0]=4 159 B14R3.164 C1CN2C=CC3=C2C(C1)=CC=C3 AK-51547 [0,0,0,1,1,0|2,0,0]=4 160 B14R3.3022 C12=C(NC=C1)C=C3OCOC3=C2 AK105876 [0,0,0,1,1,0|2,0,0]=4 161 B16R3.335 CC1=NC2=C3C=CC=CC3=CC=C2S1 AK403344 [0,1,0,1,0,0|0,1,1]=4 162 B16R3.335 CC1=NC2=CC=C3C=CC=CC3=C2O1 AK112342 [0,1,0,1,0,0|1,0,1]=4 163 B12R1.308 C1=CC=CC(=C1C(OCC)=O)F AK-46540 [0,0,1,0,1,0|2,0,0]=4 164 B12R1.308 O=C(OCC)C1=CC=CC=C1Cl AK117233 [0,0,1,0,1,0|2,0,0]=4 165 B12R1.308 O=C(OCC)C1=CC=CC=C1I AK-94262 [0,0,1,0,1,0|2,0,0]=4 166 B12R1.308 O=C(OCC)C1=CC=CC=C1O AK114211 [0,0,1,0,1,0|2,0,0]=4 167 B12R2.1 NCC1=CNC2=C1C=CC=C2 AK-22163 [1,0,0,0,1,0|2,0,0]=4 168 B12R2.32 CCC1=CC2=C(N1)C=CC=C2 AK-29204 [1,0,0,0,1,0|1,0,0]=3 169 B12R2.32 CCC1=NC2=CC=CC=C2N1 AK-31912 [1,0,0,0,1,0|2,0,0]=4 170 B12R2.32 CCC1=NC2=CC=CC=C2O1 AK551044 [1,0,0,0,1,0|2,0,0]=4 171 B12R2.32 NCC=1NC2=C(C1)C=CC=C2 AK-27799 [1,0,0,0,1,0|2,0,0]=4 172 B12R2.32 OCC1=CC2=CC=CC=C2S1 AK-48826 [1,0,0,0,1,0|2,0,0]=4 173 B12R2.32 OCC=1NC2=C(C1)C=CC=C2 AK-86119 [1,0,0,0,1,0|2,0,0]=4 174 B12R2.44 C1=C(C=C2C(=C1)C=C[NH]2)OC AK-16433 [1,0,0,0,1,0|1,0,0]=3 175 B12R2.44 COC1=CC2=C(NC=C2)C=C1 AK-45962 [1,0,0,0,1,0|1,0,0]=3 176 B12R2.44 COC1=CC2=C(NC=C2)C=N1 AK165287 [1,0,0,0,1,0|2,0,0]=4 177 B12R2.44 COC1=CC=2NC=CC2C=N1 AK-59581 [1,0,0,0,1,0|2,0,0]=4 178 B12R2.44 COC1=CC=C2C(=C1)[NH]N=C2 AK-23867 [1,0,0,0,1,0|2,0,0]=4 179 B12R2.44 COC1=CC=C2C=CCC2=C1 AK-99957 [1,0,0,0,1,0|0,0,1]=3 180 B12R2.44 COC1=CC=C2C=COC2=C1 AK103188 [1,0,0,0,1,0|1,0,0]=3 181 B12R2.44 COC1=CC=C2N=CSC2=C1 AK-24193 [1,0,0,0,1,0|2,0,0]=4 182 B12R2.44 COC1=CN2C(C=C1)=NC=C2 AK-93100 [1,0,0,0,1,0|2,0,0]=4 183 B12R2.44 COC1=CN=C2[NH]C=CC2=C1 AK-24543 [1,0,0,0,1,0|2,0,0]=4