0 B10R1.61 C1=C(C(=CC=C1)B(O)O)O AK-45876 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.61 C1=CC(=C(C=C1)N(C)C)N AK-65098 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.61 C1=CC=CC(=C1B(O)O)Br AK-34317 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.61 C1=CC=CC(=C1B(O)O)C AK-33581 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.61 C1=CC=CC(=C1C(C)=O)Br AK-48030 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.61 C1=CC=CC(=C1C(C)=O)N AK-27106 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.61 C1=CC=CC(=C1C(O)=O)F AK-40433 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.61 C1=CC=CC(=C1O)C(=O)C AK-44482 [0,0,0,0,0,0|1,0,1]=2 8 B10R1.61 CC(=O)C1=C(I)C=CC=C1 AK-84650 [0,0,0,0,0,0|2,0,1]=3 9 B10R1.61 CC(=O)C1=CC=CN=C1F AK-36408 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.61 CC(=O)C1=CC=CN=C1N AK-61895 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.61 CC(=O)C1=NC=CC=C1F AK-36671 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.61 CC(C)C1=C(Cl)N=CN=C1 AK110098 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.61 CC(C1=C(O)C=NC=C1)=O AK-68365 [0,0,0,0,0,0|2,0,1]=3 14 B10R1.61 CC(C1=CC=CC=C1Br)C AK-80369 [0,0,0,0,0,0|1,0,0]=1 15 B10R1.61 CC(C1=CC=CC=C1C)=O AK-76969 [0,0,0,0,0,0|2,0,1]=3 16 B10R1.61 CC(C1=CC=CC=C1F)=O AK-44672 [0,0,0,0,0,0|2,0,1]=3 17 B10R1.61 CC(C1=CC=CC=C1I)C AK113600 [0,0,0,0,0,0|1,0,0]=1 18 B10R1.61 CC(C1=CC=CN=C1C)=O AK-60286 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.61 CC(C1=NC=CC=C1Br)=O AK-91392 [0,0,0,0,0,0|3,0,1]=4 20 B10R1.61 CC(C1=NC=CC=C1Cl)=O AK128527 [0,0,0,0,0,0|3,0,1]=4 21 B10R1.61 CC(C1=NC=CC=C1O)=O AK-57786 [0,0,0,0,0,0|2,0,1]=3 22 B10R1.61 CC(N)C1=CC=CC=C1Br AK548207 [0,0,0,0,0,0|2,0,0]=2 23 B10R1.61 CC(N)C1=CC=CC=C1Cl AK-78769 [0,0,0,0,0,0|2,0,0]=2 24 B10R1.61 CC(N)C1=CC=CC=C1Cl AK133214 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.61 CC(N)C1=CC=CC=C1F AK-78757 [0,0,0,0,0,0|2,0,0]=2 26 B10R1.61 CC(N)C1=NC=CC=C1C AK670791 [0,0,0,0,0,0|3,0,0]=3 27 B10R1.61 CC(O)C1=C(F)C=NC=C1 AK174609 [0,0,0,0,0,0|3,0,0]=3 28 B10R1.61 CC(O)C1=CC=CN=C1Cl AK118779 [0,0,0,0,0,0|3,0,0]=3 29 B10R1.61 CN(C)C1=C(Br)C=NC=C1 AK113556 [0,0,0,0,0,0|3,0,0]=3 30 B10R1.61 CN(C)C1=C(O)C=CC=C1 AK-49738 [0,0,0,0,0,0|1,0,0]=1 31 B10R1.61 CN(C)C1=CC=CC=C1Br AK-86039 [0,0,0,0,0,0|2,0,0]=2 32 B10R1.61 CN(C)C1=NC=CN=C1Cl AK124994 [0,0,0,0,0,0|4,0,0]=4 33 B10R1.61 C[C@@H](N)C1=CC=CC=C1Br AK114068 [0,0,0,0,0,0|2,0,0]=2 34 B10R1.61 C[C@@H](N)C1=CC=CC=C1Br AK155333 [0,0,0,0,0,0|2,0,0]=2 35 B10R1.61 C[C@@H](N)C1=CC=CC=C1C AK-45079 [0,0,0,0,0,0|2,0,0]=2 36 B10R1.61 C[C@@H](N)C1=CC=CC=C1Cl AK-42131 [0,0,0,0,0,0|2,0,0]=2 37 B10R1.61 C[C@@H](N)C1=CC=CC=C1F AK-33841 [0,0,0,0,0,0|2,0,0]=2 38 B10R1.61 C[C@@H](O)C1=CC=CC=C1Cl AK-49059 [0,0,0,0,0,0|2,0,0]=2 39 B10R1.61 C[C@H](N)C1=CC=CC=C1Br AK-59163 [0,0,0,0,0,0|2,0,0]=2 40 B10R1.61 C[C@H](N)C1=CC=CC=C1Br AK174547 [0,0,0,0,0,0|2,0,0]=2 41 B10R1.61 C[C@H](N)C1=CC=CC=C1C AK162902 [0,0,0,0,0,0|2,0,0]=2 42 B10R1.61 C[C@H](N)C1=CC=CC=C1F AK-36100 [0,0,0,0,0,0|2,0,0]=2 43 B10R1.61 C[C@H](N)C1=CC=CC=C1F AK162903 [0,0,0,0,0,0|2,0,0]=2 44 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl AK-57726 [0,0,0,0,0,0|2,0,0]=2 45 B10R1.61 C[C@H](O)C1=CC=CC=C1F AK114295 [0,0,0,0,0,0|2,0,0]=2 46 B10R1.61 ClC1=C(C=CC=C1)B(O)O AK-34973 [0,0,0,0,0,0|4,0,0]=4 47 B10R1.61 FC1=C(C(=N)N)C=CC=C1 AK-16801-8 [0,0,0,0,0,0|3,0,1]=4 48 B10R1.61 FC1=C(C=CN=C1)C(C)=O AK-37142 [0,0,0,0,0,0|3,0,1]=4 49 B10R1.61 FC1=CC=CC=C1B(O)O AK-45733 [0,0,0,0,0,0|4,0,0]=4 50 B10R1.61 NC(C1=CC=CC=C1Br)C AK-50562 [0,0,0,0,0,0|2,0,0]=2 51 B10R1.61 NC1=C(C(C)C)C=NC=C1 AK349169 [0,0,0,0,0,0|2,0,0]=2 52 B10R1.61 NC1=CC=CC=C1B(O)O AK-77788 [0,0,0,0,0,0|4,0,0]=4 53 B10R1.61 NC1=NC=CN=C1N(C)C AK-23941 [0,0,0,0,0,0|4,0,0]=4 54 B10R1.61 N[C@@H](C1=CC=CC=C1F)C AK-42098 [0,0,0,0,0,0|2,0,0]=2 55 B10R1.61 O=C(N)C1=CC=CC=C1Br AK-47071 [0,0,0,0,0,0|3,0,1]=4 56 B10R1.61 O=C(N)C1=CC=CC=C1Cl AK128986 [0,0,0,0,0,0|3,0,1]=4 57 B10R1.61 O=C(N)C1=CC=CC=C1F AK161780 [0,0,0,0,0,0|3,0,1]=4 58 B10R1.61 O=C(N)C1=CC=CC=C1I AK115884 [0,0,0,0,0,0|3,0,1]=4 59 B10R1.61 O=C(N)C1=CC=CC=C1N AK109256 [0,0,0,0,0,0|3,0,1]=4 60 B10R1.61 O=C(O)C1=CC=CC=C1Br AK-77301 [0,0,0,0,0,0|3,0,1]=4 61 B10R1.61 O=C(O)C1=CC=CC=C1C AK116916 [0,0,0,0,0,0|3,0,1]=4 62 B10R1.61 O=C(O)C1=CC=CC=C1Cl AK-44481 [0,0,0,0,0,0|3,0,1]=4 63 B10R1.61 O=C(O)C1=CC=CC=C1I AK-73132 [0,0,0,0,0,0|3,0,1]=4 64 B10R1.61 O=C(O)C1=CC=NC=C1O AK-23523 [0,0,0,0,0,0|3,0,1]=4 65 B10R1.61 O=C(O)C1=NC=CC=C1O AK-26380 [0,0,0,0,0,0|3,0,1]=4 66 B10R1.61 O=C1C(C(C)=O)=CC=CN1 AK-35911 [0,0,0,0,0,0|2,0,2]=4 67 B10R1.61 O=C1C(C(C)=O)=CNC=C1 AK501394 [0,0,0,0,0,0|2,0,2]=4 68 B10R1.61 OB(C1=CC=CC=C1N)O AK-35638 [0,0,0,0,0,0|4,0,0]=4 69 B10R1.61 OC1=C([N+]([O-])=O)C=CN=C1 AK-28776 [0,0,0,0,0,0|4,0,0]=4 70 B10R1.61 OC1=CC=CC=C1C(N)=O AK-81394 [0,0,0,0,0,0|2,0,1]=3 71 B10R1.61 OC1=CC=CC=C1C(O)=O AK397674 [0,0,0,0,0,0|2,0,1]=3 72 B10R1.61 OC1=CC=CN=C1[N+]([O-])=O AK-28551 [0,0,0,0,0,0|4,0,0]=4 73 B10R1.61 [O-]C1=CC=CC=C1[N+]([O-])=O AK135512 [0,0,0,0,0,0|3,0,1]=4 74 B9R1.6 C1=C(C(=O)C)C=CN=C1 AK-65203 [1,0,0,0,0,0|2,0,1]=4 75 B9R1.6 C1=C(C(C)=O)N=CC=C1 AK-53417 [1,0,0,0,0,0|2,0,1]=4 76 B9R1.6 C1=C(C=CC=C1)B(O)O AK-50285 [1,0,0,0,0,0|3,0,0]=4 77 B9R1.6 C1=NC(=CC=C1)C(C)C AK-46532 [1,0,0,0,0,0|1,0,0]=2 78 B9R1.6 CC(N)C1=CC=CN=C1 AK-35649 [1,0,0,0,0,0|2,0,0]=3 79 B9R1.6 CC(N)C1=CN=CC=N1 AK-31016 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.6 CC(N)C1=NC=CC=N1 AK162973 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.6 CC(O)C1=NC=CC=C1 AK-53453 [1,0,0,0,0,0|2,0,0]=3 82 B9R1.6 CN(C)C1=NC=CC=C1 AK-78706 [1,0,0,0,0,0|2,0,0]=3 83 B9R1.6 C[C@@H](N)C1=CC=CC=C1 AK668263 [1,0,0,0,0,0|1,0,0]=2 84 B9R1.6 C[C@@H](N)C1=CC=CN=C1 AK152012 [1,0,0,0,0,0|2,0,0]=3 85 B9R1.6 C[C@@H](N)C1=NC=CC=C1 AK122419 [1,0,0,0,0,0|2,0,0]=3 86 B9R1.6 C[C@@H](O)C1=CC=CC=C1 AK-79205 [1,0,0,0,0,0|1,0,0]=2 87 B9R1.6 C[C@@H](O)C1=CC=NC=C1 AK-45022 [1,0,0,0,0,0|2,0,0]=3 88 B9R1.6 C[C@@H](O)C1=NC=CC=C1 AK-79201 [1,0,0,0,0,0|2,0,0]=3 89 B9R1.6 C[C@H](N)C1=CC=CN=C1 AK151271 [1,0,0,0,0,0|2,0,0]=3 90 B9R1.6 C[C@H](O)C1=CC=NC=C1 AK-79199 [1,0,0,0,0,0|2,0,0]=3 91 B9R1.6 N1=C(C=CC=C1)[C@@H](C)N AK-37082 [1,0,0,0,0,0|2,0,0]=3 92 B9R1.6 N=C(N)C1=CC=CC=C1 AK-47930 [1,0,0,0,0,0|2,0,1]=4 93 B9R1.6 NC(=N)C1=CC=CC=C1 AK-48017 [1,0,0,0,0,0|2,0,1]=4 94 B9R1.6 NC(C1=CC=CC=C1)=S AK-46849 [1,0,0,0,0,0|2,0,1]=4 95 B9R1.6 N[C@@H](C1=CC=NC=C1)C AK202973 [1,0,0,0,0,0|2,0,0]=3 96 B9R1.6 N[C@H](C1=NC=CC=C1)C AK-37110 [1,0,0,0,0,0|2,0,0]=3 97 B9R1.6 O=C(N)C1=CC=CC=C1 AK-77684 [1,0,0,0,0,0|2,0,1]=4 98 B9R1.6 O=S(C1=CC=CC=C1)[O-] AK162411 [1,0,0,0,0,0|3,0,0]=4 99 B9R1.15 BrC1=C(C=NC=C1)OC AK-46696 [1,0,0,0,0,0|3,0,0]=4 100 B9R1.15 BrC1=CC=CN=C1OC AK-33153 [1,0,0,0,0,0|3,0,0]=4 101 B9R1.15 BrCC1=C(I)C=CC=C1 AK-54648 [1,0,0,0,0,0|2,0,0]=3 102 B9R1.15 BrCC1=NC=CC=C1Br AK158877 [1,0,0,0,0,0|3,0,0]=4 103 B9R1.15 C#CC1=CC=CC=C1Br AK-45286 [1,0,0,0,0,0|1,0,2]=4 104 B9R1.15 C(C)C1=NC=NC=C1F AK-23771 [1,0,0,0,0,0|3,0,0]=4 105 B9R1.15 C1=C(C(=CC=C1)Br)CC AK-46714 [1,0,0,0,0,0|1,0,0]=2 106 B9R1.15 C1=C(C(=CC=C1)Br)CN AK-73129 [1,0,0,0,0,0|2,0,0]=3 107 B9R1.15 C1=C(C(=CC=C1)Cl)CO AK-46748 [1,0,0,0,0,0|2,0,0]=3 108 B9R1.15 C1=C(C(=CN=C1)O)C=O AK-23522 [1,0,0,0,0,0|2,0,1]=4 109 B9R1.15 C1=C(I)C(=NC=C1)OC AK-25295 [1,0,0,0,0,0|3,0,0]=4 110 B9R1.15 C1=CC=CC(=C1C#N)Br AK-46715 [1,0,0,0,0,0|2,0,1]=4 111 B9R1.15 C1=CC=CC(=C1C#N)O AK-47282 [1,0,0,0,0,0|1,0,1]=3 112 B9R1.15 C1=CC=CC(=C1CO)Br AK-51234 [1,0,0,0,0,0|2,0,0]=3 113 B9R1.15 C1=CC=CC(=C1NN)Br AK-35375 [1,0,0,0,0,0|3,0,0]=4 114 B9R1.15 C1=CC=CC(=C1NN)C AK-46554 [1,0,0,0,0,0|3,0,0]=4 115 B9R1.15 C1=CC=CC(=C1NN)Cl AK-37033 [1,0,0,0,0,0|3,0,0]=4 116 B9R1.15 C1=CC=CC(=C1O)CO AK-47595 [1,0,0,0,0,0|1,0,0]=2 117 B9R1.15 C1=CC=CC(=C1OC)F AK-46555 [1,0,0,0,0,0|2,0,0]=3 118 B9R1.15 C1=NC(=C(C=C1)CO)N AK-23581 [1,0,0,0,0,0|3,0,0]=4 119 B9R1.15 C=CC1=CC=CC=C1Cl AK114259 [1,0,0,0,0,0|1,0,2]=4 120 B9R1.15 CC1=C(CBr)C=NC=C1 AK137963 [1,0,0,0,0,0|3,0,0]=4 121 B9R1.15 CC1=C(CCl)C=NC=C1 AK143692 [1,0,0,0,0,0|3,0,0]=4 122 B9R1.15 CC1=CC=CC=C1CC AK-49977 [1,0,0,0,0,0|1,0,0]=2 123 B9R1.15 CC1=CC=CN=C1CCl AK-77025 [1,0,0,0,0,0|3,0,0]=4 124 B9R1.15 CC1=CC=CN=C1OC AK126197 [1,0,0,0,0,0|3,0,0]=4 125 B9R1.15 CC1=NC=CN=C1CC AK114356 [1,0,0,0,0,0|3,0,0]=4 126 B9R1.15 CCC1=C(Br)C=CN=C1 AK328293 [1,0,0,0,0,0|2,0,0]=3 127 B9R1.15 CCC1=C(Br)C=NC=C1 AK-81618 [1,0,0,0,0,0|2,0,0]=3 128 B9R1.15 CCC1=C(Cl)N=CC=N1 AK-54851 [1,0,0,0,0,0|3,0,0]=4 129 B9R1.15 CCC1=CN=CN=C1Cl AK-25151 [1,0,0,0,0,0|3,0,0]=4 130 B9R1.15 CCC1=NC=CC=C1Br AK128590 [1,0,0,0,0,0|2,0,0]=3 131 B9R1.15 CCC1=NC=NC=C1Br AK105597 [1,0,0,0,0,0|3,0,0]=4 132 B9R1.15 CNC1=CC=CC=C1Cl AK163346 [1,0,0,0,0,0|2,0,0]=3 133 B9R1.15 CNC1=CC=CC=C1F AK-48931 [1,0,0,0,0,0|2,0,0]=3 134 B9R1.15 CNC1=CC=CN=C1Cl AK115045 [1,0,0,0,0,0|3,0,0]=4 135 B9R1.15 CNC1=NC=CC=C1Cl AK140218 [1,0,0,0,0,0|3,0,0]=4 136 B9R1.15 COC1=C(Br)C=NC=C1 AK-36460 [1,0,0,0,0,0|3,0,0]=4 137 B9R1.15 COC1=C(I)C=NC=C1 AK-26421 [1,0,0,0,0,0|3,0,0]=4 138 B9R1.15 COC1=CC=CC=C1Br AK-76806 [1,0,0,0,0,0|2,0,0]=3 139 B9R1.15 COC1=CC=CN=C1Br AK-29048 [1,0,0,0,0,0|3,0,0]=4 140 B9R1.15 COC1=CC=CN=C1F AK-63160 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.15 COC1=NC=CC=C1Cl AK-33154 [1,0,0,0,0,0|3,0,0]=4 142 B9R1.15 COC1=NC=CC=C1F AK-33314 [1,0,0,0,0,0|3,0,0]=4 143 B9R1.15 ClC1=C(C=CC=C1)C#C AK-30160 [1,0,0,0,0,0|1,0,2]=4 144 B9R1.15 ClC1=CC=CN=C1CBr AK138503 [1,0,0,0,0,0|3,0,0]=4 145 B9R1.15 ClCC1=NC=CC=C1Cl AK109982 [1,0,0,0,0,0|3,0,0]=4 146 B9R1.15 ClCC1=NC=CC=C1Cl AK138192 [1,0,0,0,0,0|3,0,0]=4 147 B9R1.15 FC1=C(C=CN=C1)CN AK-49033 [1,0,0,0,0,0|3,0,0]=4 148 B9R1.15 FC1=CC=CN=C1CBr AK128379 [1,0,0,0,0,0|3,0,0]=4 149 B9R1.15 FC1=CC=CN=C1CCl AK109609 [1,0,0,0,0,0|3,0,0]=4 150 B9R1.15 FC1=CC=CN=C1CO AK-29127 [1,0,0,0,0,0|3,0,0]=4 151 B9R1.15 FC1=NC=CC=C1CN AK-30140 [1,0,0,0,0,0|3,0,0]=4 152 B9R1.15 N#CC1=CC=CC=C1Cl AK-44438 [1,0,0,0,0,0|2,0,1]=4 153 B9R1.15 N#CC1=CC=CC=C1F AK-88419 [1,0,0,0,0,0|2,0,1]=4 154 B9R1.15 N#CC1=CC=CC=C1I AK-76636 [1,0,0,0,0,0|2,0,1]=4 155 B9R1.15 NC1=C(C=CN=C1)OC AK-27262 [1,0,0,0,0,0|3,0,0]=4 156 B9R1.15 NC1=C(C=O)C=CC=C1 AK-45623 [1,0,0,0,0,0|2,0,1]=4 157 B9R1.15 NC1=C(OC)C=NC=C1 AK-46304 [1,0,0,0,0,0|3,0,0]=4 158 B9R1.15 NC1=CC=CC=C1C#C AK-45718 [1,0,0,0,0,0|1,0,2]=4 159 B9R1.15 NC1=CC=CC=C1C=C AK100084 [1,0,0,0,0,0|1,0,2]=4 160 B9R1.15 NC1=CC=CC=C1NC AK-35283 [1,0,0,0,0,0|2,0,0]=3 161 B9R1.15 NC1=CC=CN=C1OC AK-28363 [1,0,0,0,0,0|3,0,0]=4 162 B9R1.15 NC1=NC=CC=C1OC AK-25256 [1,0,0,0,0,0|3,0,0]=4 163 B9R1.15 NC1=NC=CN=C1CC AK-30572 [1,0,0,0,0,0|3,0,0]=4 164 B9R1.15 NCC1=CC=CC=C1C AK-89642 [1,0,0,0,0,0|2,0,0]=3 165 B9R1.15 NCC1=CC=CC=C1Cl AK-78184 [1,0,0,0,0,0|2,0,0]=3 166 B9R1.15 NCC1=CC=CC=C1F AK-88519 [1,0,0,0,0,0|2,0,0]=3 167 B9R1.15 NCC1=CC=CC=C1I AK-94126 [1,0,0,0,0,0|2,0,0]=3 168 B9R1.15 NCC1=NC=CC=C1C AK122548 [1,0,0,0,0,0|3,0,0]=4 169 B9R1.15 NCC1=NC=CC=C1Cl AK-41569 [1,0,0,0,0,0|3,0,0]=4 170 B9R1.15 NNC1=CC=CC=C1Br AK-33609 [1,0,0,0,0,0|3,0,0]=4 171 B9R1.15 NNC1=CC=CC=C1F AK-78527 [1,0,0,0,0,0|3,0,0]=4 172 B9R1.15 NNC1=CC=CC=C1I AK198825 [1,0,0,0,0,0|3,0,0]=4 173 B9R1.15 O=C1C(CC)=CC=NN1 AK132188 [1,0,0,0,0,0|2,0,1]=4 174 B9R1.15 O=C1C(CC)=NC=CN1 AK198883 [1,0,0,0,0,0|2,0,1]=4 175 B9R1.15 O=C1C(CN)=CC=CN1 AK-76048 [1,0,0,0,0,0|2,0,1]=4 176 B9R1.15 O=CC1=CC=CC=C1Br AK-50022 [1,0,0,0,0,0|2,0,1]=4 177 B9R1.15 O=CC1=CC=CC=C1F AK-88670 [1,0,0,0,0,0|2,0,1]=4 178 B9R1.15 O=CC1=CC=CC=C1I AK-94125 [1,0,0,0,0,0|2,0,1]=4 179 B9R1.15 O=CC1=CC=CC=C1N AK550048 [1,0,0,0,0,0|2,0,1]=4 180 B9R1.15 OC1=C(C=O)N=CC=C1 AK-47968 [1,0,0,0,0,0|2,0,1]=4 181 B9R1.15 OC1=CC=CC=C1CN AK-49022 [1,0,0,0,0,0|1,0,0]=2 182 B9R1.15 OC1=CC=CC=C1CN AK167666 [1,0,0,0,0,0|1,0,0]=2 183 B9R1.15 OC1=CC=CC=C1OC AK114448 [1,0,0,0,0,0|1,0,0]=2 184 B9R1.15 OC1=CC=CN=C1C#N AK-28336 [1,0,0,0,0,0|2,0,1]=4 185 B9R1.15 OC1=CC=CN=C1CN AK-82086 [1,0,0,0,0,0|2,0,0]=3 186 B9R1.15 OC1=CC=CN=C1OC AK261041 [1,0,0,0,0,0|2,0,0]=3 187 B9R1.15 OC1=NC=CC=C1C#C AK-78040 [1,0,0,0,0,0|1,0,2]=4 188 B9R1.15 OCC1=C(Br)C=CN=C1 AK-86110 [1,0,0,0,0,0|3,0,0]=4 189 B9R1.15 OCC1=C(Br)C=NC=C1 AK-38288 [1,0,0,0,0,0|3,0,0]=4 190 B9R1.15 OCC1=C(Cl)C=CN=C1 AK124400 [1,0,0,0,0,0|3,0,0]=4 191 B9R1.15 OCC1=C(F)C=NC=C1 AK-90171 [1,0,0,0,0,0|3,0,0]=4 192 B9R1.15 OCC1=C(N)C=CN=C1 AK-58822 [1,0,0,0,0,0|3,0,0]=4 193 B9R1.15 OCC1=C(N)C=NC=C1 AK-74165 [1,0,0,0,0,0|3,0,0]=4 194 B9R1.15 OCC1=CC=CC=C1I AK-77177 [1,0,0,0,0,0|2,0,0]=3 195 B9R1.15 OCC1=CC=CC=C1N AK-49868 [1,0,0,0,0,0|2,0,0]=3 196 B9R1.15 OCC1=CC=CN=C1Cl AK-23619 [1,0,0,0,0,0|3,0,0]=4 197 B9R1.15 OCC1=CC=CN=C1F AK-33110 [1,0,0,0,0,0|3,0,0]=4 198 B9R1.15 OCC1=NC=CC=C1Cl AK133056 [1,0,0,0,0,0|3,0,0]=4 199 B11R1.53 C1=CC=CC(=C1C#N)C(C)=O AK-50565 [0,1,0,0,0,0|2,0,1]=4 200 B11R1.53 C1=CC=CC(=C1CO)[N+](=O)[O-] AK-47358 [0,1,0,0,0,0|3,0,0]=4 201 B11R1.53 CC(C1=CC=CC=C1NC)=O AK135397 [0,1,0,0,0,0|2,0,1]=4 202 B11R1.53 COC1=C(C=CN=C1)C(C)=O AK-99909 [0,1,0,0,0,0|2,0,1]=4 203 B11R1.53 COC1=CC=CN=C1C(C)=O AK-80679 [0,1,0,0,0,0|2,0,1]=4 204 B11R1.53 COC1=NC=CC=C1C(C)=O AK110016 [0,1,0,0,0,0|2,0,1]=4 205 B11R1.53 COC1=NC=CN=C1C(C)C AK116762 [0,1,0,0,0,0|2,0,0]=3 206 B11R1.53 N#CC1=CC=CC=C1C(O)C AK144989 [0,1,0,0,0,0|2,0,0]=3 207 B11R1.53 N=C(N)C1=CC=CC=C1OC AK156708 [0,1,0,0,0,0|2,0,1]=4 208 B11R1.53 O=C(O)C1=CC=CC=C1CO AK-35845 [0,1,0,0,0,0|2,0,1]=4 209 B11R1.53 O=C(O)C1=CC=CC=C1OC AK-77451 [0,1,0,0,0,0|2,0,1]=4 210 B11R1.53 OB(C1=CC=CC=C1OC)O AK-25218 [0,1,0,0,0,0|3,0,0]=4 211 B11R1.53 OCC1=CC=CC=C1B(O)O AK-36634 [0,1,0,0,0,0|3,0,0]=4 212 B11R1.87 C1=CC(=C(N=C1)O)C(F)(F)F AK-32430 [0,1,0,0,0,0|3,0,0]=4 213 B11R1.87 C1=CC=CC(=C1C(F)(F)F)O AK-50536 [0,1,0,0,0,0|2,0,0]=3 214 B11R1.87 CC(C)(O)C1=C(Br)C=CC=C1 AK-38217 [0,1,0,0,0,0|1,0,0]=2 215 B11R1.87 CC(C1=CC=CC=C1Br)(C)C AK148384 [0,1,0,0,0,0|1,0,0]=2 216 B11R1.87 CC(C1=NC=NC=C1Br)(C)C AK132495 [0,1,0,0,0,0|3,0,0]=4 217 B11R1.87 CC(N)(C1=CC=CC=C1Br)C AK122030 [0,1,0,0,0,0|1,0,0]=2 218 B11R1.87 CC(O)(C1=CC=CC=C1N)C AK125202 [0,1,0,0,0,0|1,0,0]=2 219 B11R1.87 CC(O)(C1=NC=CC=C1Br)C AK167904 [0,1,0,0,0,0|2,0,0]=3 220 B11R1.87 CP(C)(=O)C1=C(N)C=CC=C1 AK103382 [0,1,0,0,0,0|2,0,0]=3 221 B11R1.87 FC(C1=CC=CC=C1C)(F)F AK-53820 [0,1,0,0,0,0|3,0,0]=4 222 B11R1.87 FC(C1=CC=CC=C1I)(F)F AK142843 [0,1,0,0,0,0|3,0,0]=4 223 B11R1.87 NC1=CC=CC=C1C(C)(C)C AK-77148 [0,1,0,0,0,0|1,0,0]=2 224 B11R1.156 C1=C(C(=C(C=C1)Cl)C(O)=O)O AK-39316 [0,1,0,0,0,0|2,0,1]=4 225 B11R1.156 C1=C(C(=C(C=C1)O)[N+](=O)[O-])C AK-35313 [0,1,0,0,0,0|3,0,0]=4 226 B11R1.156 C1=CC(=C(C(=O)O)C(=C1)C)O AK-35673 [0,1,0,0,0,0|2,0,1]=4 227 B11R1.156 CC(=O)C1=C(C)C=CC=C1C AK110169 [0,1,0,0,0,0|2,0,1]=4 228 B11R1.156 CC(=O)C1=C(N)C=CC=C1Br AK-99977 [0,1,0,0,0,0|2,0,1]=4 229 B11R1.156 CC(C1=C(C)C=CC=C1O)=O AK-64408 [0,1,0,0,0,0|1,0,1]=3 230 B11R1.156 CC(C1=C(Cl)C=CC=C1Cl)=O AK-51041 [0,1,0,0,0,0|2,0,1]=4 231 B11R1.156 CC(C1=C(F)C=CC=C1Br)=O AK-31670 [0,1,0,0,0,0|2,0,1]=4 232 B11R1.156 CC(C1=C(F)C=CC=C1Cl)=O AK-77336 [0,1,0,0,0,0|2,0,1]=4 233 B11R1.156 CC(C1=C(F)C=CC=C1F)=O AK-33179 [0,1,0,0,0,0|2,0,1]=4 234 B11R1.156 CC(C1=C(F)C=CC=C1N)=O AK145194 [0,1,0,0,0,0|2,0,1]=4 235 B11R1.156 CC(C1=C(O)C=CC=C1Br)=O AK-31671 [0,1,0,0,0,0|1,0,1]=3 236 B11R1.156 CC(C1=C(O)C=CC=C1Cl)=O AK-29397 [0,1,0,0,0,0|1,0,1]=3 237 B11R1.156 CC(C1=C(O)C=CC=C1F)=O AK-86499 [0,1,0,0,0,0|1,0,1]=3 238 B11R1.156 CC(C1=C(O)C=CC=C1O)=O AK-47368 [0,1,0,0,0,0|1,0,1]=3 239 B11R1.156 CC(N)C1=C(Cl)C=CC=C1Cl AK-68659 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.156 CC(N)C1=C(F)C=CC=C1Cl AK607949 [0,1,0,0,0,0|2,0,0]=3 241 B11R1.156 CC(O)C1=C(Cl)C=NC=C1Cl AK544619 [0,1,0,0,0,0|3,0,0]=4 242 B11R1.156 CC(O)C1=C(F)C=CC=C1Br AK144493 [0,1,0,0,0,0|2,0,0]=3 243 B11R1.156 C[C@@H](N)C1=C(C)C=CC=C1C AK-42481 [0,1,0,0,0,0|2,0,0]=3 244 B11R1.156 C[C@@H](N)C1=C(Cl)C=CC=C1Cl AK-93232 [0,1,0,0,0,0|2,0,0]=3 245 B11R1.156 C[C@@H](N)C1=C(F)C=CC=C1Cl AK134065 [0,1,0,0,0,0|2,0,0]=3 246 B11R1.156 C[C@@H](N)C1=C(F)C=CC=C1F AK-42489 [0,1,0,0,0,0|2,0,0]=3 247 B11R1.156 C[C@H](N)C1=C(C)C=CC=C1C AK-42483 [0,1,0,0,0,0|2,0,0]=3 248 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1Cl AK607972 [0,1,0,0,0,0|2,0,0]=3 249 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1Cl AK134087 [0,1,0,0,0,0|2,0,0]=3 250 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1F AK-42490 [0,1,0,0,0,0|2,0,0]=3 251 B11R1.156 C[C@H](O)C1=C(Cl)C=NC=C1Cl AK104658 [0,1,0,0,0,0|3,0,0]=4 252 B11R1.156 FC1=CC=CC(=C1[N+](=O)[O-])O AK-25894 [0,1,0,0,0,0|3,0,0]=4 253 B11R1.156 NC(C1=C(F)C=CC=C1F)C AK405737 [0,1,0,0,0,0|2,0,0]=3 254 B11R1.156 O=C(O)C1=C(O)C=CC=C1F AK-36077 [0,1,0,0,0,0|2,0,1]=4 255 B11R1.156 O=C(O)C1=C(O)C=CC=C1N AK-76027 [0,1,0,0,0,0|2,0,1]=4 256 B11R1.156 OC1=CC=CC(Br)=C1[N+]([O-])=O AK-36320 [0,1,0,0,0,0|3,0,0]=4 257 B11R1.156 OC1=CC=CC(O)=C1[N+]([O-])=O AK-72878 [0,1,0,0,0,0|3,0,0]=4 258 B11R1.159 BrC1=CC=CC(=C1F)C(C)=O AK-33547 [0,1,0,0,0,0|2,0,1]=4 259 B11R1.159 BrC1=CC=CC(=C1O)C(=O)O AK-24666 [0,1,0,0,0,0|2,0,1]=4 260 B11R1.159 C1=C([N+]([O-])=O)C(=C(Br)C=C1)O AK-25354 [0,1,0,0,0,0|3,0,0]=4 261 B11R1.159 C1=CC=C(C(=C1C(O)=O)O)F AK-34755 [0,1,0,0,0,0|2,0,1]=4 262 B11R1.159 C1=CC=C(C(=C1[N+]([O-])=O)O)C AK-40877 [0,1,0,0,0,0|3,0,0]=4 263 B11R1.159 CC(C)C1=CC=CC(O)=C1O AK109526 [0,1,0,0,0,0|0,0,0]=1 264 B11R1.159 CC(C1=CC=CC(Br)=C1O)=O AK-33819 [0,1,0,0,0,0|1,0,1]=3 265 B11R1.159 CC(C1=CC=CC(C)=C1F)=O AK327202 [0,1,0,0,0,0|2,0,1]=4 266 B11R1.159 CC(C1=CC=CC(Cl)=C1Cl)=O AK-75733 [0,1,0,0,0,0|2,0,1]=4 267 B11R1.159 CC(C1=CC=CC(Cl)=C1O)=O AK-34682 [0,1,0,0,0,0|1,0,1]=3 268 B11R1.159 CC(C1=CC=CC(F)=C1Br)=O AK145989 [0,1,0,0,0,0|2,0,1]=4 269 B11R1.159 CC(C1=CC=CC(F)=C1Cl)=O AK-94336 [0,1,0,0,0,0|2,0,1]=4 270 B11R1.159 CC(C1=CC=CC(N)=C1O)=O AK-26283 [0,1,0,0,0,0|1,0,1]=3 271 B11R1.159 CC(C1=CC=CC(O)=C1N)=O AK-80116 [0,1,0,0,0,0|2,0,1]=4 272 B11R1.159 CC(C1=CC=CC(O)=C1O)=O AK-33157 [0,1,0,0,0,0|1,0,1]=3 273 B11R1.159 CC(N)C1=CC=CC(Cl)=C1F AK338219 [0,1,0,0,0,0|2,0,0]=3 274 B11R1.159 C[C@@H](N)C1=CC=CC(Cl)=C1F AK-42505 [0,1,0,0,0,0|2,0,0]=3 275 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1F AK151381 [0,1,0,0,0,0|2,0,0]=3 276 B11R1.159 NC(C)C1=CC=CC(Cl)=C1Cl AK555588 [0,1,0,0,0,0|2,0,0]=3 277 B11R1.159 NC1=C(O)C(=CC=C1)[N+]([O-])=O AK-67577 [0,1,0,0,0,0|3,0,0]=4 278 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1O AK-75898 [0,1,0,0,0,0|2,0,1]=4 279 B11R1.159 O=C(O)C1=CC=CC(O)=C1O AK-24541 [0,1,0,0,0,0|2,0,1]=4 280 B11R1.159 OC1=C([N+]([O-])=O)C=CC=C1Cl AK-35809 [0,1,0,0,0,0|3,0,0]=4 281 B11R1.166 BrC1=CC(=C(C=C1)[N+](=O)[O-])O AK-29073 [0,1,0,0,0,0|3,0,0]=4 282 B11R1.166 C1=C(C(=CC=C1Cl)C(C)=O)Cl AK-47301 [0,1,0,0,0,0|2,0,1]=4 283 B11R1.166 C1=CC(=CC(=C1C(C)=O)F)F AK-46615 [0,1,0,0,0,0|2,0,1]=4 284 B11R1.166 C1=CC(=CC(=C1C(C)=O)F)O AK-49094 [0,1,0,0,0,0|2,0,1]=4 285 B11R1.166 C1=CC(=CC(=C1C(O)=O)O)C AK-73066 [0,1,0,0,0,0|2,0,1]=4 286 B11R1.166 C1=CC(=CC(=C1C(O)=O)O)Cl AK-47585 [0,1,0,0,0,0|2,0,1]=4 287 B11R1.166 C1=CC(=CC(=C1C(O)=O)O)F AK-29195 [0,1,0,0,0,0|2,0,1]=4 288 B11R1.166 C1=CC(=CC(=C1[N+]([O-])=O)O)Cl AK-30056 [0,1,0,0,0,0|3,0,0]=4 289 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 AK-75553 [0,1,0,0,0,0|2,0,1]=4 290 B11R1.166 CC(C1=CC=C(Br)C=C1Cl)=O AK-77175 [0,1,0,0,0,0|2,0,1]=4 291 B11R1.166 CC(C1=CC=C(Br)C=C1F)=O AK-46535 [0,1,0,0,0,0|2,0,1]=4 292 B11R1.166 CC(C1=CC=C(Br)C=C1N)=O AK-38008 [0,1,0,0,0,0|2,0,1]=4 293 B11R1.166 CC(C1=CC=C(Br)C=C1O)=O AK-40002 [0,1,0,0,0,0|1,0,1]=3 294 B11R1.166 CC(C1=CC=C(C)C=C1F)=O AK115609 [0,1,0,0,0,0|2,0,1]=4 295 B11R1.166 CC(C1=CC=C(Cl)C=C1Br)=O AK-75637 [0,1,0,0,0,0|2,0,1]=4 296 B11R1.166 CC(C1=CC=C(F)C=C1Cl)=O AK-53695 [0,1,0,0,0,0|2,0,1]=4 297 B11R1.166 CC(C1=CC=C(O)C=C1Br)=O AK-75734 [0,1,0,0,0,0|2,0,1]=4 298 B11R1.166 CC(C1=CC=C(O)C=C1C)=O AK-50197 [0,1,0,0,0,0|2,0,1]=4 299 B11R1.166 CC(C1=CC=C(O)C=C1Cl)=O AK-36102 [0,1,0,0,0,0|2,0,1]=4 300 B11R1.166 CC(C1=CC=C(O)C=C1O)=O AK-50224 [0,1,0,0,0,0|1,0,1]=3 301 B11R1.166 CC1=CC=C(C(Br)=C1)N(C)C AK136564 [0,1,0,0,0,0|2,0,0]=3 302 B11R1.166 C[C@@H](N)C1=CC=C(Br)C=C1F AK544258 [0,1,0,0,0,0|2,0,0]=3 303 B11R1.166 C[C@@H](N)C1=CC=C(Cl)C=C1C AK134023 [0,1,0,0,0,0|2,0,0]=3 304 B11R1.166 C[C@@H](N)C1=CC=C(F)C=C1F AK-45015 [0,1,0,0,0,0|2,0,0]=3 305 B11R1.166 C[C@H](N)C1=CC=C(Br)C=C1F AK189376 [0,1,0,0,0,0|2,0,0]=3 306 B11R1.166 C[C@H](N)C1=CC=C(Cl)C=C1C AK134048 [0,1,0,0,0,0|2,0,0]=3 307 B11R1.166 C[C@H](N)C1=CC=C(Cl)C=C1Cl AK130493 [0,1,0,0,0,0|2,0,0]=3 308 B11R1.166 C[C@H](N)C1=CC=C(F)C=C1F AK-73153 [0,1,0,0,0,0|2,0,0]=3 309 B11R1.166 ClC1=CC(=C(C=C1)C(C)=O)F AK-46375 [0,1,0,0,0,0|2,0,1]=4 310 B11R1.166 FC1=C(C=CC(=C1)F)[C@H](C)N AK-42963 [0,1,0,0,0,0|2,0,0]=3 311 B11R1.166 NC1=CC(=C(C=C1)C(C)=O)O AK-34336 [0,1,0,0,0,0|1,0,1]=3 312 B11R1.166 N[C@H](C1=CC=C(C)C=C1C)C AK477325 [0,1,0,0,0,0|2,0,0]=3 313 B11R1.166 O=C(O)C1=CC=C(Br)C=C1O AK-44937 [0,1,0,0,0,0|2,0,1]=4 314 B11R1.166 O=C(O)C1=CC=C(N)C=C1O AK-46320 [0,1,0,0,0,0|2,0,1]=4 315 B11R1.166 O=C(O)C1=CC=C(O)C=C1O AK-88714 [0,1,0,0,0,0|2,0,1]=4 316 B11R1.166 O=C([O-])C1=CC=C(N)C=C1O AK154081 [0,1,0,0,0,0|2,0,1]=4 317 B11R1.166 OB(C1=CC=C(F)C=C1O)O AK-46419 [0,1,0,0,0,0|3,0,0]=4 318 B11R1.166 OC1=C(C=CC(I)=C1)[N+]([O-])=O AK-80852 [0,1,0,0,0,0|3,0,0]=4 319 B11R1.166 OC1=CC(C)=CC=C1[N+]([O-])=O AK-29443 [0,1,0,0,0,0|3,0,0]=4 320 B11R1.166 OC1=CC=C(C(C)C)C(C)=C1 AK113729 [0,1,0,0,0,0|1,0,0]=2 321 B11R1.166 OC1=CC=C(C(C)C)C(O)=C1 AK-81550 [0,1,0,0,0,0|0,0,0]=1 322 B11R1.167 C1=C(Br)C=CC(=C1C(=O)C)O AK-47862 [0,1,0,0,0,0|1,0,1]=3 323 B11R1.167 C1=C(Cl)C=CC(=C1C(C)=O)Cl AK-73074 [0,1,0,0,0,0|2,0,1]=4 324 B11R1.167 C1=C(Cl)C=CC(=C1C(N)=O)O AK-44071 [0,1,0,0,0,0|2,0,1]=4 325 B11R1.167 C1=C(N)C=CC(=C1C(O)=O)O AK-72925 [0,1,0,0,0,0|2,0,1]=4 326 B11R1.167 CC(=O)C1=C(F)C=CC(N)=C1 AK-68014 [0,1,0,0,0,0|2,0,1]=4 327 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=C1 AK-28102 [0,1,0,0,0,0|2,0,1]=4 328 B11R1.167 CC(=O)C1=C(N)C=CC(F)=C1 AK109676 [0,1,0,0,0,0|2,0,1]=4 329 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 AK-30761 [0,1,0,0,0,0|1,0,1]=3 330 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 AK-30762 [0,1,0,0,0,0|1,0,1]=3 331 B11R1.167 CC(C1=C(C=CC(=C1)F)Cl)=O AK-48949 [0,1,0,0,0,0|2,0,1]=4 332 B11R1.167 CC(C1=CC(Br)=CC=C1C)=O AK147547 [0,1,0,0,0,0|2,0,1]=4 333 B11R1.167 CC(C1=CC(Br)=CC=C1Cl)=O AK109534 [0,1,0,0,0,0|2,0,1]=4 334 B11R1.167 CC(C1=CC(Br)=CC=C1F)=O AK-28059 [0,1,0,0,0,0|2,0,1]=4 335 B11R1.167 CC(C1=CC(Br)=CC=C1N)=O AK-28616 [0,1,0,0,0,0|2,0,1]=4 336 B11R1.167 CC(C1=CC(Cl)=CC=C1Br)=O AK-51654 [0,1,0,0,0,0|2,0,1]=4 337 B11R1.167 CC(C1=CC(Cl)=CC=C1F)=O AK-76691 [0,1,0,0,0,0|2,0,1]=4 338 B11R1.167 CC(C1=CC(F)=CC=C1Br)=O AK-45663 [0,1,0,0,0,0|2,0,1]=4 339 B11R1.167 CC(C1=CC(F)=CC=C1I)=O AK136027 [0,1,0,0,0,0|2,0,1]=4 340 B11R1.167 CC(C1=CC(F)=CC=C1O)=O AK-45396 [0,1,0,0,0,0|1,0,1]=3 341 B11R1.167 CC(C1=CC(I)=CC=C1F)C AK685324 [0,1,0,0,0,0|1,0,0]=2 342 B11R1.167 CC(C1=CC(N)=CC=C1O)=O AK116395 [0,1,0,0,0,0|1,0,1]=3 343 B11R1.167 CC(C1=CC(O)=CC=C1O)=O AK-51301 [0,1,0,0,0,0|1,0,1]=3 344 B11R1.167 CC(N)C1=CC(Cl)=CC=C1F AK338981 [0,1,0,0,0,0|2,0,0]=3 345 B11R1.167 CC(O)C1=C(C)C=CC(Cl)=C1 AK425566 [0,1,0,0,0,0|2,0,0]=3 346 B11R1.167 CC(O)C1=CC(Br)=CC=C1F AK-28060 [0,1,0,0,0,0|2,0,0]=3 347 B11R1.167 CC1=CC=C(O)C(B(O)O)=C1 AK-61725 [0,1,0,0,0,0|3,0,0]=4 348 B11R1.167 O=C(N)C1=CC(Br)=CC=C1O AK-25187 [0,1,0,0,0,0|2,0,1]=4 349 B11R1.167 O=C(O)C1=CC(Br)=CC=C1O AK-44136 [0,1,0,0,0,0|2,0,1]=4 350 B11R1.167 O=C(O)C1=CC(F)=CC=C1O AK-49710 [0,1,0,0,0,0|2,0,1]=4 351 B11R1.167 O=C([O-])C1=CC(N)=CC=C1O AK-88387 [0,1,0,0,0,0|2,0,1]=4 352 B11R1.167 OC(=O)C1=C(O)C=CC(O)=C1 AK-49825 [0,1,0,0,0,0|2,0,1]=4 353 B11R1.167 OC1=CC=C(C)C=C1C(C)C AK126296 [0,1,0,0,0,0|0,0,0]=1 354 B11R1.167 OC1=CC=C(C)C=C1C(O)=O AK-48577 [0,1,0,0,0,0|2,0,1]=4 355 B11R1.167 OC1=CC=C(F)C=C1B(O)O AK-34401 [0,1,0,0,0,0|3,0,0]=4 356 B11R1.167 OC1=CC=C(F)C=C1N(=O)=O AK-46467 [0,1,0,0,0,0|3,0,0]=4 357 B11R1.167 OC1=CC=C(I)C(N(C)C)=C1 AK549977 [0,1,0,0,0,0|2,0,0]=3 358 B11R1.222 C1=CC=CC(=C1C(OC)=O)Br AK-72980 [0,1,0,0,0,0|2,0,1]=4 359 B11R1.222 CC(C1=CC=CC=C1C)C#N AK165081 [0,1,0,0,0,0|1,0,1]=3 360 B11R1.222 CCC(C1=CC=CC=C1Cl)=O AK-86142 [0,1,0,0,0,0|2,0,1]=4 361 B11R1.222 CCC(C1=CC=CC=C1F)N AK544261 [0,1,0,0,0,0|2,0,0]=3 362 B11R1.222 CCC(C1=NC=CC=C1C)N AK670798 [0,1,0,0,0,0|3,0,0]=4 363 B11R1.222 CC[C@@H](C1=CC=CC=C1F)N AK134089 [0,1,0,0,0,0|2,0,0]=3 364 B11R1.222 COC(=O)C1=C(N)C=CC=C1 AK-41339 [0,1,0,0,0,0|2,0,1]=4 365 B11R1.222 ClC1=C(C(N)CO)C=CN=C1 AK501386 [0,1,0,0,0,0|3,0,0]=4 366 B11R1.222 ClC1=CC=CC=C1[C@H](N)CO AK548235 [0,1,0,0,0,0|2,0,0]=3 367 B11R1.222 FC1=CC=CC=C1C(CF)=O AK198962 [0,1,0,0,0,0|2,0,1]=4 368 B11R1.222 NC1=CC=CC=C1C(C)CC AK122191 [0,1,0,0,0,0|1,0,0]=2 369 B11R1.222 NCC(=O)C1=C(C=CC=C1)F AK-70904 [0,1,0,0,0,0|2,0,1]=4 370 B11R1.222 N[C@@H](C1=CC=CC=C1C)CC AK-42242 [0,1,0,0,0,0|2,0,0]=3 371 B11R1.222 N[C@H](C1=CC=CC=C1Cl)CC AK-42248 [0,1,0,0,0,0|2,0,0]=3 372 B11R1.222 O=C(C1=NC=CC=C1O)OC AK-26201 [0,1,0,0,0,0|2,0,1]=4 373 B11R1.222 O=C(NC)C1=CC=CC=C1N AK-26614 [0,1,0,0,0,0|2,0,1]=4 374 B11R1.222 O=C(NN)C1=CC=CC=C1O AK167835 [0,1,0,0,0,0|2,0,1]=4 375 B11R1.222 O=C(OC)C1=C(O)N=CC=C1 AK-54451 [0,1,0,0,0,0|2,0,1]=4 376 B11R1.222 O=C(OC)C1=CC=CC=C1C AK174020 [0,1,0,0,0,0|2,0,1]=4 377 B11R1.222 O=C(OC)C1=CC=CC=C1Cl AK161838 [0,1,0,0,0,0|2,0,1]=4 378 B11R1.222 O=C(OC)C1=CC=CC=C1I AK-76653 [0,1,0,0,0,0|2,0,1]=4 379 B11R1.222 O=C(OC)C1=CC=CC=C1S AK554462 [0,1,0,0,0,0|1,1,1]=4 380 B11R1.222 O=C(OC)C1=CC=NC=C1O AK-49202 [0,1,0,0,0,0|2,0,1]=4 381 B11R1.222 OC1=CC=CC=C1C(NO)=O AK-48843 [0,1,0,0,0,0|2,0,1]=4 382 B11R1.222 O[C@@H](C1=CC=CC=C1Cl)CO AK-44949 [0,1,0,0,0,0|2,0,0]=3 383 B11R2.1 BrC1=COC2=C1C=CC=C2 AK-90311 [0,0,0,1,0,0|1,0,2]=4 384 B11R2.1 C1=C(C2=CC=CC=C2[NH]1)C AK-68243 [0,0,0,1,0,0|1,0,2]=4 385 B11R2.1 C1=CC=CC2=C1C(CC2)=O AK-44115 [0,0,0,1,0,0|2,0,1]=4 386 B11R2.1 C1=CC=CC2=C1C(CO2)=O AK-45365 [0,0,0,1,0,0|1,0,1]=3 387 B11R2.1 CC1=CCC2=CC=CC=C12 AK-79878 [0,0,0,1,0,0|1,0,2]=4 388 B11R2.1 CC1=N[NH]C2=CC=CC=C12 AK-24403 [0,0,0,1,0,0|2,0,1]=4 389 B11R2.1 CC1CCC2=NC=CN=C21 AK116760 [0,0,0,1,0,0|3,0,0]=4 390 B11R2.1 CN1C=CC2=C1C=CC=C2 AK-84423 [0,0,0,1,0,0|2,0,1]=4 391 B11R2.1 CN1C=NC2=C1C=CC=C2 AK-51670 [0,0,0,1,0,0|2,0,1]=4 392 B11R2.1 ClC1=NOC2=C1C=CC=C2 AK-24058 [0,0,0,1,0,0|2,0,1]=4 393 B11R2.1 NC1CCC2=C1C=CC=C2 AK-44750 [0,0,0,1,0,0|2,0,0]=3 394 B11R2.1 NC1CCC2=CC=CC=C12 AK-96028 [0,0,0,1,0,0|2,0,0]=3 395 B11R2.1 NC1CCC2=CC=CN=C21 AK-75878 [0,0,0,1,0,0|3,0,0]=4 396 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 AK-44891 [0,0,0,1,0,0|2,0,0]=3 397 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 AK-89530 [0,0,0,1,0,0|2,0,0]=3 398 B11R2.1 N[C@H]1COC2=CC=CC=C12 AK172653 [0,0,0,1,0,0|1,0,0]=2 399 B11R2.1 O1C2=C(C(=N1)N)C=CC=C2 AK-23544 [0,0,0,1,0,0|2,0,1]=4 400 B11R2.1 O=C1C2=CC=CC=C2SC1 AK-29817 [0,0,0,1,0,0|1,1,1]=4 401 B11R2.1 OC1CCC2=C1C=CC=C2 AK151987 [0,0,0,1,0,0|2,0,0]=3 402 B11R2.1 OC1CCC2=CC=CN=C21 AK-72486 [0,0,0,1,0,0|3,0,0]=4 403 B11R2.55 BrC1=CN=CN=C1C2CC2 AK132493 [0,0,0,1,0,0|3,0,0]=4 404 B11R2.55 ClC1=C(C2CC2)C=NC=C1 AK543867 [0,0,0,1,0,0|2,0,0]=3 405 B11R2.55 FC1=NC=CC=C1C2CC2 AK131938 [0,0,0,1,0,0|2,0,0]=3 406 B11R2.55 NC1=CC=CC=C1C2CC2 AK142855 [0,0,0,1,0,0|1,0,0]=2 407 B11R2.55 NC1=NC=CC=C1C2CC2 AK131946 [0,0,0,1,0,0|2,0,0]=3 408 B11R2.55 O=C1C(C2CC2)=CC=CN1 AK131947 [0,0,0,1,0,0|1,0,1]=3 409 B11R1.86 C1=C(CC(=O)C)C(=CC=C1)Br AK-47295 [0,0,0,0,0,1|2,0,1]=4 410 B11R1.86 C1=C(OC(C)C)C(=CC=C1)N AK-39887 [0,0,0,0,0,1|1,0,0]=2 411 B11R1.86 C1=CC=CC(=C1CC(O)=O)O AK-47284 [0,0,0,0,0,1|2,0,1]=4 412 B11R1.86 CC(C)CC1=NC=CN=C1C AK-59003 [0,0,0,0,0,1|3,0,0]=4 413 B11R1.86 CC(C)OC1=CC=CC=C1Br AK-45390 [0,0,0,0,0,1|1,0,0]=2 414 B11R1.86 CC(CC1=CC=CC=C1F)=O AK117069 [0,0,0,0,0,1|2,0,1]=4 415 B11R1.86 CC(NC1=CC=CC=C1N)=O AK112083 [0,0,0,0,0,1|2,0,1]=4 416 B11R1.86 CC(NC1=CC=CC=C1O)=O AK116958 [0,0,0,0,0,1|1,0,1]=3 417 B11R1.86 CC(NC1=NC=CC=C1O)=O AK124571 [0,0,0,0,0,1|2,0,1]=4 418 B11R1.86 CC(OC1=NC=CC=C1Br)C AK127008 [0,0,0,0,0,1|2,0,0]=3 419 B11R1.86 FC(F)OC1=CC=CC=C1Br AK-61615 [0,0,0,0,0,1|3,0,0]=4 420 B11R1.86 IC1=CC=CC=C1OC(F)F AK136295 [0,0,0,0,0,1|3,0,0]=4 421 B11R1.86 OC1=CC=CC=C1OC(F)F AK135667 [0,0,0,0,0,1|2,0,0]=3 422 B11R1.86 OC1=CC=CN=C1CN(C)C AK-34123 [0,0,0,0,0,1|2,0,0]=3 423 B8R0.4 CCC\C=C\C=C\C=O AK-88482 [1,0,1,0,0,0|0,0,2]=4 424 B8R1.2 BrCC1=CC=CN=C1 AK-44682 [2,0,0,0,0,0|2,0,0]=4 425 B8R1.2 BrCC1=CC=NC=C1 AK-40271 [2,0,0,0,0,0|2,0,0]=4 426 B8R1.2 BrCC1=NC=CC=C1 AK-78919 [2,0,0,0,0,0|2,0,0]=4 427 B8R1.2 C1=CN=CC=C1OC AK-54547 [2,0,0,0,0,0|2,0,0]=4 428 B8R1.2 CC[N+]1=CC=CC=C1 AK607939 [2,0,0,0,0,0|1,0,0]=3 429 B8R1.2 CNC1=CC=CN=C1 AK-72893 [2,0,0,0,0,0|2,0,0]=4 430 B8R1.2 COC1=CC=CN=C1 AK-76565 [2,0,0,0,0,0|2,0,0]=4 431 B8R1.2 ICC1=CC=CC=C1 AK-54444 [2,0,0,0,0,0|1,0,0]=3 432 B8R1.2 N#CC1=CC=CC=C1 AK-49389 [2,0,0,0,0,0|1,0,1]=4 433 B8R1.2 NCC1=CC=NC=C1 AK-25866 [2,0,0,0,0,0|2,0,0]=4 434 B8R1.2 NCC1=CC=NC=C1 AK-50006 [2,0,0,0,0,0|2,0,0]=4 435 B8R1.2 NNC1=CC=CC=C1 AK114548 [2,0,0,0,0,0|2,0,0]=4 436 B8R1.2 NOC1=CC=CC=C1 AK-77703 [2,0,0,0,0,0|2,0,0]=4 437 B8R1.2 OCC1=CC=CN=C1 AK-46173 [2,0,0,0,0,0|2,0,0]=4 438 B8R1.2 OCC1=CC=NC=C1 AK-44706 [2,0,0,0,0,0|2,0,0]=4 439 B8R1.2 OCC1=CC=NC=C1 AK175384 [2,0,0,0,0,0|2,0,0]=4 440 B8R1.2 OCC1=NC=CC=C1 AK-53905 [2,0,0,0,0,0|2,0,0]=4 441 B8R1.2 ONC1=CC=CC=C1 AK139965 [2,0,0,0,0,0|2,0,0]=4 442 B8R1.5 BrC1=C(C=CN=C1)O AK-18201 [2,0,0,0,0,0|2,0,0]=4 443 B8R1.5 BrC1=C(C=NC=C1)O AK-23750 [2,0,0,0,0,0|2,0,0]=4 444 B8R1.5 BrC1=CC=CN=C1C AK-25896 [2,0,0,0,0,0|2,0,0]=4 445 B8R1.5 C1=C(C(=NC=C1)Br)O AK-30294 [2,0,0,0,0,0|2,0,0]=4 446 B8R1.5 C1=C(C(=NC=C1)Cl)O AK-30100 [2,0,0,0,0,0|2,0,0]=4 447 B8R1.5 C1=C(C(=NC=C1)F)C AK-34277 [2,0,0,0,0,0|2,0,0]=4 448 B8R1.5 C1=CC=CC(=C1Cl)Br AK-47441 [2,0,0,0,0,0|2,0,0]=4 449 B8R1.5 C1=CC=CC(=C1N)I AK-46500 [2,0,0,0,0,0|2,0,0]=4 450 B8R1.5 C1=CC=C[N+](=C1Cl)C AK-44806 [2,0,0,0,0,0|2,0,0]=4 451 B8R1.5 C1=CC=NC(=C1C)Cl AK-25527 [2,0,0,0,0,0|2,0,0]=4 452 B8R1.5 C1=CC=NC(=C1O)I AK-25929 [2,0,0,0,0,0|2,0,0]=4 453 B8R1.5 C1=CC=NC(=C1O)N AK-32377 [2,0,0,0,0,0|2,0,0]=4 454 B8R1.5 C1=CN=CC(=C1C)Br AK-25806 [2,0,0,0,0,0|2,0,0]=4 455 B8R1.5 C1=CN=CC(=C1C)N AK-27057 [2,0,0,0,0,0|2,0,0]=4 456 B8R1.5 CC1=C(Br)C=CN=C1 AK-50602 [2,0,0,0,0,0|2,0,0]=4 457 B8R1.5 CC1=C(Cl)C=CN=C1 AK-25556 [2,0,0,0,0,0|2,0,0]=4 458 B8R1.5 CC1=C(F)C=CN=C1 AK-87891 [2,0,0,0,0,0|2,0,0]=4 459 B8R1.5 CC1=C(F)C=CN=C1 AK132194 [2,0,0,0,0,0|2,0,0]=4 460 B8R1.5 CC1=C(F)C=NC=C1 AK-28364 [2,0,0,0,0,0|2,0,0]=4 461 B8R1.5 CC1=C(O)C=NC=C1 AK-29776 [2,0,0,0,0,0|1,0,0]=3 462 B8R1.5 CC1=CC=CC=C1I AK-77011 [2,0,0,0,0,0|1,0,0]=3 463 B8R1.5 CC1=CC=CN=C1Br AK-23603 [2,0,0,0,0,0|2,0,0]=4 464 B8R1.5 CC1=CC=CN=C1O AK-75629 [2,0,0,0,0,0|1,0,0]=3 465 B8R1.5 CC1=CC=CNC1=O AK-32442 [2,0,0,0,0,0|1,0,1]=4 466 B8R1.5 CC1=CN=CN=C1O AK-27176 [2,0,0,0,0,0|2,0,0]=4 467 B8R1.5 CC1=NC=CC=C1F AK-33505 [2,0,0,0,0,0|2,0,0]=4 468 B8R1.5 CN1C=CC=CC1=O AK-48448 [2,0,0,0,0,0|1,0,1]=4 469 B8R1.5 ClC1=C(C=CN=C1)O AK-23518 [2,0,0,0,0,0|2,0,0]=4 470 B8R1.5 ClC1=C(C=NC=C1)O AK-25094 [2,0,0,0,0,0|2,0,0]=4 471 B8R1.5 ClC1=C(I)C=CC=C1 AK-77000 [2,0,0,0,0,0|2,0,0]=4 472 B8R1.5 FC1=CC=CC=C1Br AK-88413 [2,0,0,0,0,0|2,0,0]=4 473 B8R1.5 FC1=CC=CN=C1O AK-28818 [2,0,0,0,0,0|2,0,0]=4 474 B8R1.5 FC1=NC=CC=C1O AK-24443 [2,0,0,0,0,0|2,0,0]=4 475 B8R1.5 IC1=C(C=NC=C1)O AK-23780 [2,0,0,0,0,0|2,0,0]=4 476 B8R1.5 IC1=CC=CC=C1Br AK-48364 [2,0,0,0,0,0|2,0,0]=4 477 B8R1.5 IC1=CC=CC=C1I AK-88372 [2,0,0,0,0,0|2,0,0]=4 478 B8R1.5 NC1=C(C)C=NC=C1 AK-25562 [2,0,0,0,0,0|2,0,0]=4 479 B8R1.5 NC1=C(C=NC=C1)O AK-23732 [2,0,0,0,0,0|2,0,0]=4 480 B8R1.5 NC1=CC=CN=C1C AK-28661 [2,0,0,0,0,0|2,0,0]=4 481 B8R1.5 O=C1C(O)=CC=CO1 AK-77266 [2,0,0,0,0,0|2,0,0]=4 482 B8R1.5 O=C1C(O)=COC=C1 AK109540 [2,0,0,0,0,0|2,0,0]=4 483 B8R1.5 OC1=C(F)C=NC=C1 AK-23520 [2,0,0,0,0,0|2,0,0]=4 484 B8R1.5 OC1=C(I)C=NC=C1 AK-89378 [2,0,0,0,0,0|2,0,0]=4 485 B8R1.5 OC1=C(O)C=CN=C1 AK-45917 [2,0,0,0,0,0|2,0,0]=4 486 B8R1.5 OC1=C(O)N=CC=C1 AK-46383 [2,0,0,0,0,0|2,0,0]=4 487 B8R1.5 OC1=CC=CN=C1C AK-29777 [2,0,0,0,0,0|1,0,0]=3 488 B8R1.5 OC1=NC=CC=C1Cl AK-27733 [2,0,0,0,0,0|2,0,0]=4 489 B10R1.13 C1=C(C(C)C)C=CC(=C1)Br AK-47451 [1,1,0,0,0,0|0,0,0]=2 490 B10R1.13 C1=C(N(C)C)C=CC(=C1)Br AK-47628 [1,1,0,0,0,0|1,0,0]=3 491 B10R1.13 C1=CC(=CC=C1C(C)=O)F AK-41690 [1,1,0,0,0,0|1,0,1]=4 492 B10R1.13 CC(Br)C1=CC=C(F)C=C1 AK-94758 [1,1,0,0,0,0|1,0,0]=3 493 B10R1.13 CC(C1=CC=C(Br)C=C1)=O AK124422 [1,1,0,0,0,0|1,0,1]=4 494 B10R1.13 CC(C1=CC=C(C)C=C1)=O AK-41305 [1,1,0,0,0,0|1,0,1]=4 495 B10R1.13 CC(C1=CC=C(N)C=C1)=O AK110424 [1,1,0,0,0,0|1,0,1]=4 496 B10R1.13 CC(C1=CC=C(O)C=C1)=O AK-86441 [1,1,0,0,0,0|1,0,1]=4 497 B10R1.13 CC(C1=CN=C(N)C=C1)C AK-81363 [1,1,0,0,0,0|1,0,0]=3 498 B10R1.13 CC(C1=NC=C(Br)C=N1)C AK173649 [1,1,0,0,0,0|2,0,0]=4 499 B10R1.13 CC(N)C1=CC=C(C)N=C1 AK684509 [1,1,0,0,0,0|2,0,0]=4 500 B10R1.13 CC(N)C1=CC=C(I)C=C1 AK-77292 [1,1,0,0,0,0|1,0,0]=3 501 B10R1.13 CC(N)C1=NC=C(C)C=C1 AK158768 [1,1,0,0,0,0|2,0,0]=4 502 B10R1.13 CC(O)C1=CC=C(Br)C=C1 AK117026 [1,1,0,0,0,0|1,0,0]=3 503 B10R1.13 CC(O)C1=CC=C(N)C=C1 AK109742 [1,1,0,0,0,0|1,0,0]=3 504 B10R1.13 CC(O)C1=CN=C(C)C=C1 AK-32149 [1,1,0,0,0,0|2,0,0]=4 505 B10R1.13 CN(C)C1=CC=C(C=C1)I AK101968 [1,1,0,0,0,0|1,0,0]=3 506 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 AK136579 [1,1,0,0,0,0|1,0,0]=3 507 B10R1.13 CN(C)C1=CC=C(O)C=C1 AK-64702 [1,1,0,0,0,0|1,0,0]=3 508 B10R1.13 CN(C)C1=NC=C(Br)C=C1 AK-25675 [1,1,0,0,0,0|2,0,0]=4 509 B10R1.13 CN(C)C1=NC=C(I)C=C1 AK117849 [1,1,0,0,0,0|2,0,0]=4 510 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 AK-45030 [1,1,0,0,0,0|1,0,0]=3 511 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 AK-89611 [1,1,0,0,0,0|1,0,0]=3 512 B10R1.13 C[C@@H](N)C1=CC=C(I)C=C1 AK-43006 [1,1,0,0,0,0|1,0,0]=3 513 B10R1.13 C[C@@H](N)C1=NC=C(F)C=C1 AK204056 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.13 C[C@@H](O)C1=CC=C(Br)C=C1 AK-79215 [1,1,0,0,0,0|1,0,0]=3 515 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 AK-34471 [1,1,0,0,0,0|1,0,0]=3 516 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 AK548805 [1,1,0,0,0,0|1,0,0]=3 517 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 AK173009 [1,1,0,0,0,0|2,0,0]=4 518 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 AK321169 [1,1,0,0,0,0|2,0,0]=4 519 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 AK668421 [1,1,0,0,0,0|2,0,0]=4 520 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 AK-79189 [1,1,0,0,0,0|1,0,0]=3 521 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 AK-79216 [1,1,0,0,0,0|1,0,0]=3 522 B10R1.13 ClC1=NC=C(C=N1)C(C)C AK-25128 [1,1,0,0,0,0|2,0,0]=4 523 B10R1.13 FC(C1=CC=C(Cl)C=C1)F AK-77798 [1,1,0,0,0,0|2,0,0]=4 524 B10R1.13 NC1=CC=C(C(C)C)N=C1 AK-30855 [1,1,0,0,0,0|1,0,0]=3 525 B10R1.13 N[C@@H](C1=CC=C(Br)C=C1)C AK-35249 [1,1,0,0,0,0|1,0,0]=3 526 B10R1.13 N[C@@H](C1=CC=C(C)C=C1)C AK-45033 [1,1,0,0,0,0|1,0,0]=3 527 B10R1.13 N[C@H](C1=CC=C(F)C=C1)C AK-98664 [1,1,0,0,0,0|1,0,0]=3 528 B10R1.13 OC1=CC=C(C(C)=C)C=C1 AK117164 [1,1,0,0,0,0|0,0,2]=4 529 B10R1.13 OC1=CC=C(C(O)C)C=C1 AK-45202 [1,1,0,0,0,0|1,0,0]=3 530 B10R1.13 OC1=CC=C(C=C1)C(F)F AK-76781 [1,1,0,0,0,0|2,0,0]=4 531 B10R1.13 OC1=CC=C(N(C)C)C=C1 AK103764 [1,1,0,0,0,0|1,0,0]=3 532 B10R1.13 OC1=CC=C([C@H](N)C)C=C1 AK608003 [1,1,0,0,0,0|1,0,0]=3 533 B10R1.15 CC(C1=CC=CC=C1)CN AK-67959 [1,1,0,0,0,0|0,0,0]=2 534 B10R1.15 CC[C@@H](C1=NC=CC=C1)N AK544238 [1,1,0,0,0,0|2,0,0]=4 535 B10R1.15 CC[C@H](C1=NC=CC=C1)N AK668420 [1,1,0,0,0,0|2,0,0]=4 536 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 AK-47624 [1,1,0,0,0,0|0,0,0]=2 537 B10R1.15 C[C@@H](NC)C1=CC=CC=C1 AK140531 [1,1,0,0,0,0|0,0,0]=2 538 B10R1.15 ClC(C=C)C1=CC=CC=C1 AK173991 [1,1,0,0,0,0|1,0,1]=4 539 B10R1.15 FC(C1=CC=CC=C1)CBr AK-93540 [1,1,0,0,0,0|1,0,0]=3 540 B10R1.15 NCC(C1=CC=CC=C1)=O AK-26107 [1,1,0,0,0,0|1,0,1]=4 541 B10R1.15 NCC(O)C1=NC=CC=C1 AK157200 [1,1,0,0,0,0|2,0,0]=4 542 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 AK-45230 [1,1,0,0,0,0|1,0,0]=3 543 B10R1.15 NC[C@@H](O)C1=CC=CN=C1 AK-96401 [1,1,0,0,0,0|2,0,0]=4 544 B10R1.15 N[C@H](C1=CC=CC=C1)CO AK-41249 [1,1,0,0,0,0|1,0,0]=3 545 B10R1.15 O=C(NC)C1=CC=CC=C1 AK323662 [1,1,0,0,0,0|1,0,1]=4 546 B10R1.15 O=CN(C)C1=CC=CC=C1 AK-48601 [1,1,0,0,0,0|1,0,1]=4 547 B10R1.15 O=S(C1=CC=CC=C1)OC AK109245 [1,1,0,0,0,0|2,0,0]=4 548 B10R1.15 OC(C1=CC=CC=C1)CBr AK-76552 [1,1,0,0,0,0|1,0,0]=3 549 B10R1.15 OC(C1=CC=CC=C1)CO AK117070 [1,1,0,0,0,0|1,0,0]=3 550 B10R1.15 OCC(=O)C1=CC=CC=C1 AK-94786 [1,1,0,0,0,0|1,0,1]=4 551 B10R1.15 OCC(N)C1=CC=CC=C1 AK-47370 [1,1,0,0,0,0|1,0,0]=3 552 B10R1.15 O[C@@H](C1=CC=CC=C1)CO AK-45210 [1,1,0,0,0,0|1,0,0]=3 553 B10R1.15 O[C@H](C1=CC=CC=C1)CO AK-33573 [1,1,0,0,0,0|1,0,0]=3 554 B10R1.15 [C@H](N)(C1=CC=CC=C1)CO AK-41260 [1,1,0,0,0,0|1,0,0]=3 555 B10R1.28 CC(C)(C)C1=CC=NC=C1 AK-88357 [1,1,0,0,0,0|1,0,0]=3 556 B10R1.28 CC(C)(O)C1=NC=CC=C1 AK111321 [1,1,0,0,0,0|1,0,0]=3 557 B10R1.28 CC(N)(C1=CC=CC=C1)C AK116559 [1,1,0,0,0,0|0,0,0]=2 558 B10R1.28 CC(N)(C1=CC=CN=C1)C AK-86166 [1,1,0,0,0,0|1,0,0]=3 559 B10R1.28 CC(N)(C1=NC=CC=C1)C AK-64527 [1,1,0,0,0,0|1,0,0]=3 560 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 AK-59630 [1,1,0,0,0,0|1,0,0]=3 561 B10R1.28 C[Si](C)(C)C1=CC=CC=N1 AK-47822 [1,1,0,0,0,0|1,1,0]=4 562 B10R1.113 BrC1=CC(=CC=C1)C(F)F AK-50673 [1,1,0,0,0,0|2,0,0]=4 563 B10R1.113 BrC1=CC(=NC=C1)N(C)C AK-49151 [1,1,0,0,0,0|2,0,0]=4 564 B10R1.113 BrC1=NC=CC(=C1)N(C)C AK-49139 [1,1,0,0,0,0|2,0,0]=4 565 B10R1.113 C1=C(C(C)=O)C=C(C=C1)O AK-46681 [1,1,0,0,0,0|1,0,1]=4 566 B10R1.113 CC(C1=CC(Br)=CC=C1)C AK-61854 [1,1,0,0,0,0|0,0,0]=2 567 B10R1.113 CC(C1=CC=CC(Br)=C1)=O AK-44590 [1,1,0,0,0,0|1,0,1]=4 568 B10R1.113 CC(C1=CC=CC(C)=C1)=O AK143347 [1,1,0,0,0,0|1,0,1]=4 569 B10R1.113 CC(N)C1=CC=CC(C)=C1 AK-95787 [1,1,0,0,0,0|1,0,0]=3 570 B10R1.113 CC(O)C1=CC(N)=NC=C1 AK109512 [1,1,0,0,0,0|2,0,0]=4 571 B10R1.113 CC(O)C1=NC(Br)=CC=C1 AK-58995 [1,1,0,0,0,0|2,0,0]=4 572 B10R1.113 CN(C)C1=CC(F)=NC=C1 AK141581 [1,1,0,0,0,0|2,0,0]=4 573 B10R1.113 CN(C)C1=CC=CC(Br)=C1 AK-63444 [1,1,0,0,0,0|1,0,0]=3 574 B10R1.113 C[C@@H](C1=CC=CC(N)=C1)N AK326677 [1,1,0,0,0,0|1,0,0]=3 575 B10R1.113 C[C@@H](N)C1=CC(Br)=NC=C1 AK608012 [1,1,0,0,0,0|2,0,0]=4 576 B10R1.113 C[C@@H](N)C1=CC(Cl)=CN=C1 AK668419 [1,1,0,0,0,0|2,0,0]=4 577 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=C1 AK-33750 [1,1,0,0,0,0|1,0,0]=3 578 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=C1 AK338979 [1,1,0,0,0,0|1,0,0]=3 579 B10R1.113 C[C@@H](N)C1=CC=CC(C)=C1 AK-45077 [1,1,0,0,0,0|1,0,0]=3 580 B10R1.113 C[C@@H](N)C1=CC=CC(C)=C1 AK133442 [1,1,0,0,0,0|1,0,0]=3 581 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 AK-29516 [1,1,0,0,0,0|1,0,0]=3 582 B10R1.113 C[C@@H](N)C1=NC(F)=CC=C1 AK668445 [1,1,0,0,0,0|2,0,0]=4 583 B10R1.113 C[C@@H](O)C1=CC=CC(Cl)=C1 AK103057 [1,1,0,0,0,0|1,0,0]=3 584 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 AK335908 [1,1,0,0,0,0|2,0,0]=4 585 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 AK-33217 [1,1,0,0,0,0|1,0,0]=3 586 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 AK338984 [1,1,0,0,0,0|1,0,0]=3 587 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 AK-35182 [1,1,0,0,0,0|1,0,0]=3 588 B10R1.113 C[C@H](O)C1=CC=CC(Br)=C1 AK-58281 [1,1,0,0,0,0|1,0,0]=3 589 B10R1.113 NC1=CC(C(C)=O)=CC=C1 AK-83273 [1,1,0,0,0,0|1,0,1]=4 590 B10R1.113 NC1=CC(N(C)C)=CC=C1 AK162007 [1,1,0,0,0,0|1,0,0]=3 591 B10R1.113 NC1=NC(C(C)C)=CC=C1 AK-29534 [1,1,0,0,0,0|1,0,0]=3 592 B10R1.113 N[C@@H](C1=CC=CC(F)=C1)C AK-45028 [1,1,0,0,0,0|1,0,0]=3 593 B10R1.113 N[C@H](C1=CC=CC(F)=C1)C AK-42995 [1,1,0,0,0,0|1,0,0]=3 594 B10R1.113 OC1=CC=CC(N(C)C)=C1 AK-51741 [1,1,0,0,0,0|1,0,0]=3 595 B10R1.113 OC1=CC=CC([C@H](N)C)=C1 AK-77840 [1,1,0,0,0,0|1,0,0]=3 596 B10R1.2 BrC1=CC=CC(=C1C)OC AK-34653 [1,1,0,0,0,0|2,0,0]=4 597 B10R1.2 BrCC1=C(C(=CC=C1)C)C AK-36442 [1,1,0,0,0,0|2,0,0]=4 598 B10R1.2 C1=CC=C(C(=C1C=O)O)Br AK-23681 [1,1,0,0,0,0|1,0,1]=4 599 B10R1.2 C1=CC=C(C(=C1OC)F)F AK-47470 [1,1,0,0,0,0|2,0,0]=4 600 B10R1.2 CC1=C(C)C(OC)=CC=C1 AK117499 [1,1,0,0,0,0|2,0,0]=4 601 B10R1.2 CC1=CC=CC(CO)=C1C AK-58580 [1,1,0,0,0,0|2,0,0]=4 602 B10R1.2 CC1=CC=CC(OC)=C1O AK390061 [1,1,0,0,0,0|1,0,0]=3 603 B10R1.2 CCC1=CC=CC(O)=C1O AK103077 [1,1,0,0,0,0|0,0,0]=2 604 B10R1.2 COC1=C(Br)C(Br)=CC=C1 AK135817 [1,1,0,0,0,0|2,0,0]=4 605 B10R1.2 COC1=C(Cl)C(Cl)=CC=C1 AK-87701 [1,1,0,0,0,0|2,0,0]=4 606 B10R1.2 COC1=CC=CC(=C1Br)F AK-35197 [1,1,0,0,0,0|2,0,0]=4 607 B10R1.2 COC1=CC=CC(=C1C)N AK-25555 [1,1,0,0,0,0|2,0,0]=4 608 B10R1.2 COC1=CC=CC(Br)=C1F AK-34561 [1,1,0,0,0,0|2,0,0]=4 609 B10R1.2 COC1=CC=CC(Cl)=C1N AK109648 [1,1,0,0,0,0|2,0,0]=4 610 B10R1.2 COC1=CC=CC(O)=C1Br AK-58508 [1,1,0,0,0,0|2,0,0]=4 611 B10R1.2 COC1=CC=CC(O)=C1N AK104920 [1,1,0,0,0,0|2,0,0]=4 612 B10R1.2 ClC1=C(C=CC=C1OC)O AK-21964 [1,1,0,0,0,0|2,0,0]=4 613 B10R1.2 ClC1=C(N)C=CC=C1OC AK-24860 [1,1,0,0,0,0|2,0,0]=4 614 B10R1.2 ClC1=CC=CC(=C1F)OC AK-70913 [1,1,0,0,0,0|2,0,0]=4 615 B10R1.2 FC1=C(Br)C(CBr)=CC=C1 AK-53660 [1,1,0,0,0,0|2,0,0]=4 616 B10R1.2 FC1=C(C(=CC=C1)C=O)O AK-24776 [1,1,0,0,0,0|1,0,1]=4 617 B10R1.2 FC1=C(Cl)C(CBr)=CC=C1 AK-80100 [1,1,0,0,0,0|2,0,0]=4 618 B10R1.2 FC1=C(F)C(CO)=CC=C1 AK-48486 [1,1,0,0,0,0|2,0,0]=4 619 B10R1.2 FC1=C(N)C=CC=C1OC AK-36420 [1,1,0,0,0,0|2,0,0]=4 620 B10R1.2 N#CC1=CC=CC(C)=C1O AK158041 [1,1,0,0,0,0|1,0,1]=4 621 B10R1.2 N#CC1=CC=CC(O)=C1O AK-84464 [1,1,0,0,0,0|1,0,1]=4 622 B10R1.2 NC1=C(C)C=CC=C1OC AK-35383 [1,1,0,0,0,0|2,0,0]=4 623 B10R1.2 NC1=C(C=CC=C1Cl)CO AK-31075 [1,1,0,0,0,0|2,0,0]=4 624 B10R1.2 NC1=C(OC)C=CC=C1F AK-35198 [1,1,0,0,0,0|2,0,0]=4 625 B10R1.2 NC1=C(OC)C=CC=C1I AK-76986 [1,1,0,0,0,0|2,0,0]=4 626 B10R1.2 NC1=CC=CC(=C1F)CO AK-27097 [1,1,0,0,0,0|2,0,0]=4 627 B10R1.2 NC1=CC=CC(OC)=C1Br AK-45647 [1,1,0,0,0,0|2,0,0]=4 628 B10R1.2 NCC1=CC=CC(Br)=C1F AK-43191 [1,1,0,0,0,0|2,0,0]=4 629 B10R1.2 O=CC1=CC=CC(O)=C1O AK-49602 [1,1,0,0,0,0|1,0,1]=4 630 B10R1.2 OC1=C(C)C=CC=C1C=O AK-45464 [1,1,0,0,0,0|1,0,1]=4 631 B10R1.2 OC1=C(C)C=CC=C1CN AK338973 [1,1,0,0,0,0|1,0,0]=3 632 B10R1.2 OC1=C(C=O)C=CC=C1Cl AK-47189 [1,1,0,0,0,0|1,0,1]=4 633 B10R1.2 OC1=C(OC)C=CC=C1Br AK-93007 [1,1,0,0,0,0|1,0,0]=3 634 B10R1.2 OC1=C(OC)C=CC=C1I AK113106 [1,1,0,0,0,0|1,0,0]=3 635 B10R1.2 OC1=C(OC)C=CC=C1N AK128378 [1,1,0,0,0,0|1,0,0]=3 636 B10R1.2 OCC1=C(F)C(Br)=CC=C1 AK-48980 [1,1,0,0,0,0|2,0,0]=4 637 B10R1.2 OCC1=CC=CC(Br)=C1N AK-47203 [1,1,0,0,0,0|2,0,0]=4 638 B10R1.2 OCC1=CC=CC(Cl)=C1Cl AK-94212 [1,1,0,0,0,0|2,0,0]=4 639 B10R1.2 OCC1=CC=CC(I)=C1Br AK-94351 [1,1,0,0,0,0|2,0,0]=4 640 B10R1.2 OCC1=CC=CC(N)=C1N AK402049 [1,1,0,0,0,0|2,0,0]=4 641 B10R1.4 BrC1=CC=CC=C1CCO AK-70908 [1,1,0,0,0,0|1,0,0]=3 642 B10R1.4 C1=C(C(=CC=C1)CC#N)Br AK-45669 [1,1,0,0,0,0|1,0,1]=4 643 B10R1.4 CC1=CC=CC=C1CCO AK117334 [1,1,0,0,0,0|1,0,0]=3 644 B10R1.4 CC1=CC=CC=C1CNC AK-89673 [1,1,0,0,0,0|1,0,0]=3 645 B10R1.4 CCOC1=C(N)C=CN=C1 AK100670 [1,1,0,0,0,0|2,0,0]=4 646 B10R1.4 CCOC1=NC=CC=C1Br AK-45982 [1,1,0,0,0,0|2,0,0]=4 647 B10R1.4 CNCC1=CC=CC=C1Br AK-16712 [1,1,0,0,0,0|1,0,0]=3 648 B10R1.4 CNCC1=CC=CC=C1F AK-16716 [1,1,0,0,0,0|1,0,0]=3 649 B10R1.4 ClC1=CC=CC=C1CCO AK-45697 [1,1,0,0,0,0|1,0,0]=3 650 B10R1.4 FC1=CC=CC=C1CCN AK-98141 [1,1,0,0,0,0|1,0,0]=3 651 B10R1.4 N#CCC1=CC=CC=C1F AK-48152 [1,1,0,0,0,0|1,0,1]=4 652 B10R1.4 N#CCC1=CC=CC=C1N AK-88479 [1,1,0,0,0,0|1,0,1]=4 653 B10R1.4 NC1=C(OCC)C=CN=C1 AK-59659 [1,1,0,0,0,0|2,0,0]=4 654 B10R1.4 NC1=CC=CC=C1CCN AK-88349 [1,1,0,0,0,0|1,0,0]=3 655 B10R1.4 NCCC1=C(Cl)C=CC=C1 AK-57465 [1,1,0,0,0,0|1,0,0]=3 656 B10R1.4 NCCC1=CC=CC=C1Br AK-47292 [1,1,0,0,0,0|1,0,0]=3 657 B10R1.4 NNCC1=CC=CC=C1F AK-35444 [1,1,0,0,0,0|2,0,0]=4 658 B10R1.4 NOCC1=CC=CC=C1F AK-69176 [1,1,0,0,0,0|2,0,0]=4 659 B10R1.4 O=C1C(OCC)=CC=CN1 AK130647 [1,1,0,0,0,0|1,0,1]=4 660 B10R1.4 OC1=CC=CC=C1CCN AK114741 [1,1,0,0,0,0|0,0,0]=2 661 B10R1.4 OC1=CC=CC=C1COC AK151421 [1,1,0,0,0,0|0,0,0]=2 662 B10R1.4 OC1=CC=CC=C1OCC AK-94233 [1,1,0,0,0,0|0,0,0]=2 663 B10R1.4 OCCC1=CC=CC=C1I AK149280 [1,1,0,0,0,0|1,0,0]=3 664 B10R1.4 OCCC1=CC=CC=C1N AK-35531 [1,1,0,0,0,0|1,0,0]=3 665 B10R1.20 BrCC1=CC=CC=C1CBr AK-48586 [1,1,0,0,0,0|2,0,0]=4 666 B10R1.20 C1=C(C(=CC=C1)OC)NN AK-36141 [1,1,0,0,0,0|2,0,0]=4 667 B10R1.20 C1=CC=CC(=C1C#N)OC AK-44736 [1,1,0,0,0,0|1,0,1]=4 668 B10R1.20 CCC1=C(OC)N=CC=N1 AK-61723 [1,1,0,0,0,0|2,0,0]=4 669 B10R1.20 CNC1=NC=CC=C1CO AK-34687 [1,1,0,0,0,0|2,0,0]=4 670 B10R1.20 COC1=C(C=CC=C1)C#C AK-45758 [1,1,0,0,0,0|0,0,2]=4 671 B10R1.20 COC1=C(OC)C=NC=C1 AK-40220 [1,1,0,0,0,0|2,0,0]=4 672 B10R1.20 COC1=CC=CC=C1OC AK-48587 [1,1,0,0,0,0|1,0,0]=3 673 B10R1.20 COC1=CC=CN=C1OC AK-43966 [1,1,0,0,0,0|2,0,0]=4 674 B10R1.20 COC1=NC=CC=C1CBr AK-99893 [1,1,0,0,0,0|2,0,0]=4 675 B10R1.20 COC1=NC=CC=C1CN AK133079 [1,1,0,0,0,0|2,0,0]=4 676 B10R1.20 ClCC1=C(C=CC=C1)C#N AK-53415 [1,1,0,0,0,0|2,0,0]=4 677 B10R1.20 N#CC1=CC=CC=C1CN AK-76272 [1,1,0,0,0,0|2,0,0]=4 678 B10R1.20 NCC1=C(CO)C=CC=C1 AK-41063 [1,1,0,0,0,0|1,0,0]=3 679 B10R1.20 NCC1=C(OC)C=NC=C1 AK174736 [1,1,0,0,0,0|2,0,0]=4 680 B10R1.20 NCC1=CC=CN=C1OC AK-49721 [1,1,0,0,0,0|2,0,0]=4 681 B10R1.20 NCC1=NC=CC=C1OC AK142747 [1,1,0,0,0,0|2,0,0]=4 682 B10R1.20 O=CC1=CC=CC=C1CC AK-51264 [1,1,0,0,0,0|0,0,1]=3 683 B10R1.20 O=CC1=CC=CC=C1NC AK120939 [1,1,0,0,0,0|1,0,1]=4 684 B10R1.20 O=CC1=CC=CC=C1OC AK116922 [1,1,0,0,0,0|1,0,1]=4 685 B10R1.20 OCC1=C(C=CC=C1)C#N AK-81801 [1,1,0,0,0,0|1,0,1]=4 686 B10R1.20 OCC1=C(CO)C=CN=C1 AK171924 [1,1,0,0,0,0|2,0,0]=4 687 B10R1.20 OCC1=CC=CC=C1C=C AK165517 [1,1,0,0,0,0|0,0,2]=4 688 B10R1.20 OCC1=CC=CC=C1CC AK153193 [1,1,0,0,0,0|0,0,0]=2 689 B10R1.20 OCC1=CC=CN=C1OC AK-46985 [1,1,0,0,0,0|2,0,0]=4 690 B10R1.20 OCC1=NC=CC=C1OC AK-35452 [1,1,0,0,0,0|2,0,0]=4 691 B10R1.25 BrC1=C(C=CC(=C1)O)OC AK-25497 [1,1,0,0,0,0|2,0,0]=4 692 B10R1.25 BrC1=C(CBr)C=CC(=C1)F AK-35842 [1,1,0,0,0,0|2,0,0]=4 693 B10R1.25 BrC1=CC(=C(C=C1)OC)C AK-54791 [1,1,0,0,0,0|2,0,0]=4 694 B10R1.25 CC1=CC(Br)=CC=C1CBr AK-59622 [1,1,0,0,0,0|2,0,0]=4 695 B10R1.25 CC1=CC(Br)=CC=C1CF AK687461 [1,1,0,0,0,0|2,0,0]=4 696 B10R1.25 CC1=CC(Cl)=C(CN)C=C1 AK-76787 [1,1,0,0,0,0|2,0,0]=4 697 B10R1.25 CC1=CC(I)=CC=C1OC AK135933 [1,1,0,0,0,0|2,0,0]=4 698 B10R1.25 CC1=CC=C(C(Br)=C1)NC AK189204 [1,1,0,0,0,0|2,0,0]=4 699 B10R1.25 COC1=C(F)C=C(Br)C=C1 AK-34268 [1,1,0,0,0,0|2,0,0]=4 700 B10R1.25 COC1=C(N)C=C(I)C=C1 AK-36369 [1,1,0,0,0,0|2,0,0]=4 701 B10R1.25 COC1=C(O)C=C(Cl)C=C1 AK-81614 [1,1,0,0,0,0|1,0,0]=3 702 B10R1.25 COC1=C(O)C=C(N)C=C1 AK-63517 [1,1,0,0,0,0|1,0,0]=3 703 B10R1.25 COC1=CC=C(Br)C=C1I AK120134 [1,1,0,0,0,0|2,0,0]=4 704 B10R1.25 COC1=CC=C(Cl)C=C1Br AK-35821 [1,1,0,0,0,0|2,0,0]=4 705 B10R1.25 COC1=CC=C(Cl)C=C1I AK-26072 [1,1,0,0,0,0|2,0,0]=4 706 B10R1.25 COC1=CC=C(F)C=C1Br AK-35213 [1,1,0,0,0,0|2,0,0]=4 707 B10R1.25 COC1=CC=C(I)C=C1F AK143337 [1,1,0,0,0,0|2,0,0]=4 708 B10R1.25 ClC1=CC(=C(C=O)C=C1)O AK-23506 [1,1,0,0,0,0|1,0,1]=4 709 B10R1.25 FC1=CC(=C(C=C1)OC)O AK-36233 [1,1,0,0,0,0|1,0,0]=3 710 B10R1.25 FC1=CC=C(C(=C1)O)C=O AK-25824 [1,1,0,0,0,0|1,0,1]=4 711 B10R1.25 FC1=CC=C(CBr)C(Cl)=C1 AK-86341 [1,1,0,0,0,0|2,0,0]=4 712 B10R1.25 N#CC1=CC=C(Br)C=C1O AK-68396 [1,1,0,0,0,0|1,0,1]=4 713 B10R1.25 N#CC1=CC=C(Cl)C=C1O AK-68106 [1,1,0,0,0,0|1,0,1]=4 714 B10R1.25 N#CC1=CC=C(F)C=C1O AK158554 [1,1,0,0,0,0|1,0,1]=4 715 B10R1.25 N#CC1=CC=C(N)C=C1O AK321552 [1,1,0,0,0,0|1,0,1]=4 716 B10R1.25 N#CC1=CC=C(O)C=C1O AK-86504 [1,1,0,0,0,0|1,0,1]=4 717 B10R1.25 NC1=CC(Br)=CC=C1CC AK153468 [1,1,0,0,0,0|1,0,0]=3 718 B10R1.25 NC1=CC(Br)=CC=C1NC AK149385 [1,1,0,0,0,0|2,0,0]=4 719 B10R1.25 NC1=CC(Br)=CC=C1OC AK-39543 [1,1,0,0,0,0|2,0,0]=4 720 B10R1.25 NC1=CC(Cl)=CC=C1CC AK476943 [1,1,0,0,0,0|1,0,0]=3 721 B10R1.25 NC1=CC(Cl)=CC=C1NC AK138294 [1,1,0,0,0,0|2,0,0]=4 722 B10R1.25 NC1=CC(F)=CC=C1OC AK-33948 [1,1,0,0,0,0|2,0,0]=4 723 B10R1.25 NC1=CC=C(OC)C(Br)=C1 AK-33883 [1,1,0,0,0,0|2,0,0]=4 724 B10R1.25 NC1=CC=C(OC)C(C)=C1 AK-33185 [1,1,0,0,0,0|2,0,0]=4 725 B10R1.25 NC1=CC=C(OC)C(F)=C1 AK-25856 [1,1,0,0,0,0|2,0,0]=4 726 B10R1.25 NC1=CC=C(OC)C(I)=C1 AK-39498 [1,1,0,0,0,0|2,0,0]=4 727 B10R1.25 NC1=CC=C(OC)C(I)=C1 AK-61933 [1,1,0,0,0,0|2,0,0]=4 728 B10R1.25 NC1=CC=C(OC)C(N)=C1 AK-93491 [1,1,0,0,0,0|2,0,0]=4 729 B10R1.25 NCC1=C(Cl)C=C(Cl)C=C1 AK-89648 [1,1,0,0,0,0|2,0,0]=4 730 B10R1.25 NCC1=CC=C(Br)C=C1C AK156403 [1,1,0,0,0,0|2,0,0]=4 731 B10R1.25 NCC1=CC=C(Br)C=C1C AK431800 [1,1,0,0,0,0|2,0,0]=4 732 B10R1.25 NCC1=CC=C(Br)C=C1F AK-40759 [1,1,0,0,0,0|2,0,0]=4 733 B10R1.25 NCC1=CC=C(Cl)C=C1Br AK601695 [1,1,0,0,0,0|2,0,0]=4 734 B10R1.25 NCC1=CC=C(F)C=C1F AK-61922 [1,1,0,0,0,0|2,0,0]=4 735 B10R1.25 O=CC1=CC=C(Br)C=C1O AK-24055 [1,1,0,0,0,0|1,0,1]=4 736 B10R1.25 O=CC1=CC=C(C)C=C1O AK-30310 [1,1,0,0,0,0|1,0,1]=4 737 B10R1.25 O=CC1=CC=C(I)C=C1O AK137741 [1,1,0,0,0,0|1,0,1]=4 738 B10R1.25 O=CC1=CC=C(O)C=C1O AK-50262 [1,1,0,0,0,0|1,0,1]=4 739 B10R1.25 OC1=C(C#N)C=CC(=C1)C AK-33832 [1,1,0,0,0,0|1,0,1]=4 740 B10R1.25 OC1=CC(Br)=CC=C1CN AK154932 [1,1,0,0,0,0|1,0,0]=3 741 B10R1.25 OC1=CC(Br)=CC=C1OC AK159188 [1,1,0,0,0,0|1,0,0]=3 742 B10R1.25 OC1=CC=C(OC)C(F)=C1 AK-35214 [1,1,0,0,0,0|2,0,0]=4 743 B10R1.25 OC1=CC=C(OC)C(O)=C1 AK114475 [1,1,0,0,0,0|1,0,0]=3 744 B10R1.25 OCC1=C(Br)C=C(Br)C=C1 AK-76830 [1,1,0,0,0,0|2,0,0]=4 745 B10R1.25 OCC1=C(F)C=C(Cl)C=C1 AK-46376 [1,1,0,0,0,0|2,0,0]=4 746 B10R1.25 OCC1=CC=C(Br)C=C1C AK-59623 [1,1,0,0,0,0|2,0,0]=4 747 B10R1.25 OCC1=CC=C(Br)C=C1N AK-30952 [1,1,0,0,0,0|2,0,0]=4 748 B10R1.25 OCC1=CC=C(C)C=C1C AK-61593 [1,1,0,0,0,0|2,0,0]=4 749 B10R1.25 OCC1=CC=C(Cl)C=C1Cl AK-86288 [1,1,0,0,0,0|2,0,0]=4 750 B10R1.25 OCC1=CC=C(N)C=C1C AK143112 [1,1,0,0,0,0|2,0,0]=4 751 B10R1.30 BrC1=C(C=C(C=C1)Cl)OC AK-33708 [1,1,0,0,0,0|2,0,0]=4 752 B10R1.30 BrC1=C(C=C(C=C1)F)CO AK-37845 [1,1,0,0,0,0|2,0,0]=4 753 B10R1.30 BrC1=C(C=C(N)C=C1)OC AK-33882 [1,1,0,0,0,0|2,0,0]=4 754 B10R1.30 C1=C(Br)C=CC(=C1CO)O AK-34249 [1,1,0,0,0,0|1,0,0]=3 755 B10R1.30 C1=C(C(=CC=C1F)O)C=O AK-24761 [1,1,0,0,0,0|1,0,1]=4 756 B10R1.30 C1=C(C(=CC=C1N)F)OC AK-23774 [1,1,0,0,0,0|2,0,0]=4 757 B10R1.30 C1=C(N)C=CC(=C1OC)C AK-33584 [1,1,0,0,0,0|2,0,0]=4 758 B10R1.30 CC1=CC=C(Br)C=C1OC AK-65070 [1,1,0,0,0,0|2,0,0]=4 759 B10R1.30 CC1=CC=C(O)C(CC)=N1 AK-28571 [1,1,0,0,0,0|1,0,0]=3 760 B10R1.30 CCC1=NC(C)=CC=C1O AK-57887 [1,1,0,0,0,0|1,0,0]=3 761 B10R1.30 COC1=C(Br)C=CC(C)=C1 AK-81015 [1,1,0,0,0,0|2,0,0]=4 762 B10R1.30 COC1=C(C)C=CC(C)=C1 AK-60854 [1,1,0,0,0,0|2,0,0]=4 763 B10R1.30 COC1=C(Cl)C=CC(F)=C1 AK-35210 [1,1,0,0,0,0|2,0,0]=4 764 B10R1.30 COC1=C(I)C=CC(N)=C1 AK109901 [1,1,0,0,0,0|2,0,0]=4 765 B10R1.30 COC1=CC(Br)=CC=C1Br AK-36985 [1,1,0,0,0,0|2,0,0]=4 766 B10R1.30 COC1=CC(Br)=CC=C1Cl AK-33621 [1,1,0,0,0,0|2,0,0]=4 767 B10R1.30 COC1=CC(Br)=CC=C1I AK-64617 [1,1,0,0,0,0|2,0,0]=4 768 B10R1.30 COC1=CC(F)=CC=C1Br AK-35209 [1,1,0,0,0,0|2,0,0]=4 769 B10R1.30 COC1=CC(I)=CC=C1Br AK-72575 [1,1,0,0,0,0|2,0,0]=4 770 B10R1.30 COC1=CC(I)=CC=C1Cl AK-33545 [1,1,0,0,0,0|2,0,0]=4 771 B10R1.30 ClC1=C(C=C(N)C=C1)OC AK-46519 [1,1,0,0,0,0|2,0,0]=4 772 B10R1.30 ClC1=CC=C(Br)C(CBr)=C1 AK-86621 [1,1,0,0,0,0|2,0,0]=4 773 B10R1.30 FC1=C(C=C(C=C1)Br)OC AK-44892 [1,1,0,0,0,0|2,0,0]=4 774 B10R1.30 FC1=CC(=C(N)C=C1)OC AK-28545 [1,1,0,0,0,0|2,0,0]=4 775 B10R1.30 FC1=CC=C(Br)C=C1CC AK136297 [1,1,0,0,0,0|1,0,0]=3 776 B10R1.30 N#CC1=CC(Br)=CC=C1O AK-35071 [1,1,0,0,0,0|1,0,1]=4 777 B10R1.30 N#CC1=CC(F)=CC=C1O AK-98170 [1,1,0,0,0,0|1,0,1]=4 778 B10R1.30 N#CC1=CC(O)=CC=C1O AK383593 [1,1,0,0,0,0|1,0,1]=4 779 B10R1.30 NC1=CC(CO)=C(F)C=C1 AK-80394 [1,1,0,0,0,0|2,0,0]=4 780 B10R1.30 NC1=CC=C(Br)C=C1CN AK144545 [1,1,0,0,0,0|2,0,0]=4 781 B10R1.30 NC1=CC=C(Br)C=C1NC AK-38065 [1,1,0,0,0,0|2,0,0]=4 782 B10R1.30 NC1=CC=C(Br)C=C1OC AK-48941 [1,1,0,0,0,0|2,0,0]=4 783 B10R1.30 NC1=CC=C(C)C=C1NC AK127230 [1,1,0,0,0,0|2,0,0]=4 784 B10R1.30 NC1=CC=C(Cl)C=C1CC AK-41750 [1,1,0,0,0,0|1,0,0]=3 785 B10R1.30 NC1=CC=C(Cl)C=C1NC AK-68011 [1,1,0,0,0,0|2,0,0]=4 786 B10R1.30 NC1=CC=C(N)C=C1OC AK-93492 [1,1,0,0,0,0|2,0,0]=4 787 B10R1.30 NCC1=C(Cl)C=CC(Cl)=C1 AK-77471 [1,1,0,0,0,0|2,0,0]=4 788 B10R1.30 NCC1=C(F)C=CC(Cl)=C1 AK-34410 [1,1,0,0,0,0|2,0,0]=4 789 B10R1.30 NCC1=C(N)C=CC(Br)=C1 AK-45441 [1,1,0,0,0,0|2,0,0]=4 790 B10R1.30 NCC1=CC(Br)=CC=C1Cl AK-39330 [1,1,0,0,0,0|2,0,0]=4 791 B10R1.30 O=C1C=CC(Br)=CN1CC AK156669 [1,1,0,0,0,0|1,0,1]=4 792 B10R1.30 O=CC1=CC(C)=CC=C1O AK-30554 [1,1,0,0,0,0|1,0,1]=4 793 B10R1.30 OC1=C(C=C(Cl)C=C1)C#N AK-25390 [1,1,0,0,0,0|1,0,1]=4 794 B10R1.30 OC1=CC=C(Br)C(CC)=C1 AK207125 [1,1,0,0,0,0|1,0,0]=3 795 B10R1.30 OC1=CC=C(Br)C(OC)=C1 AK-49206 [1,1,0,0,0,0|2,0,0]=4 796 B10R1.30 OC1=CC=C(Br)C=C1C=O AK-49497 [1,1,0,0,0,0|1,0,1]=4 797 B10R1.30 OC1=CC=C(Br)C=C1OC AK-79389 [1,1,0,0,0,0|1,0,0]=3 798 B10R1.30 OC1=CC=C(C)C=C1OC AK-75601 [1,1,0,0,0,0|1,0,0]=3 799 B10R1.30 OC1=CC=C(C)N=C1CC AK-41005 [1,1,0,0,0,0|1,0,0]=3 800 B10R1.30 OC1=CC=C(F)C(OC)=C1 AK-94399 [1,1,0,0,0,0|2,0,0]=4 801 B10R1.30 OC1=CC=C(N)C=C1OC AK-79118 [1,1,0,0,0,0|1,0,0]=3 802 B10R1.30 OCC1=C(Cl)C=CC(F)=C1 AK-34414 [1,1,0,0,0,0|2,0,0]=4 803 B10R1.30 OCC1=CC(Br)=CC=C1Br AK103133 [1,1,0,0,0,0|2,0,0]=4 804 B10R1.30 OCC1=CC(Br)=CC=C1Cl AK-33393 [1,1,0,0,0,0|2,0,0]=4 805 B10R1.30 OCC1=CC(Br)=CC=C1F AK-37019 [1,1,0,0,0,0|2,0,0]=4 806 B10R1.30 OCC1=CC(Br)=CC=C1N AK-26716 [1,1,0,0,0,0|2,0,0]=4 807 B10R1.30 OCC1=CC(Cl)=CC=C1Br AK-35824 [1,1,0,0,0,0|2,0,0]=4 808 B10R1.30 OCC1=CC(Cl)=CC=C1Cl AK135145 [1,1,0,0,0,0|2,0,0]=4 809 B10R1.30 OCC1=CC(Cl)=CC=C1N AK116363 [1,1,0,0,0,0|2,0,0]=4 810 B10R1.30 OCC1=CC(F)=CC=C1I AK-61202 [1,1,0,0,0,0|2,0,0]=4 811 B10R1.30 OCC1=CC(I)=CC=C1Br AK158350 [1,1,0,0,0,0|2,0,0]=4 812 B10R1.30 OCC1=CC(I)=CC=C1C AK544172 [1,1,0,0,0,0|2,0,0]=4 813 B10R1.245 BrC1=C(C=O)C(=CC=C1)O AK-24392 [1,1,0,0,0,0|1,0,1]=4 814 B10R1.245 C1=C(C(=C(C=C1)Cl)OC)F AK-48967 [1,1,0,0,0,0|2,0,0]=4 815 B10R1.245 CC1=C(CBr)C(=CC=C1)C AK-54987 [1,1,0,0,0,0|2,0,0]=4 816 B10R1.245 CC1=CC=CC(C)=C1CN AK-45585 [1,1,0,0,0,0|2,0,0]=4 817 B10R1.245 COC1=C(Br)C=CC=C1Br AK-81617 [1,1,0,0,0,0|2,0,0]=4 818 B10R1.245 COC1=C(Br)C=CC=C1Cl AK-98526 [1,1,0,0,0,0|2,0,0]=4 819 B10R1.245 ClC1=C(C=O)C(=CC=C1)O AK-23502 [1,1,0,0,0,0|1,0,1]=4 820 B10R1.245 ClC1=CC=CC(Br)=C1CBr AK-53894 [1,1,0,0,0,0|2,0,0]=4 821 B10R1.245 FC1=C(C#N)C(=CC=C1)O AK-26967 [1,1,0,0,0,0|1,0,1]=4 822 B10R1.245 FC1=C(C=O)C(=CC=C1)O AK-34940 [1,1,0,0,0,0|1,0,1]=4 823 B10R1.245 FC1=C(CCl)C(Br)=CC=C1 AK-93632 [1,1,0,0,0,0|2,0,0]=4 824 B10R1.245 N#CC1=C(O)C=CC=C1Cl AK-36806 [1,1,0,0,0,0|1,0,1]=4 825 B10R1.245 NC1=C(CO)C(F)=CC=C1 AK-76960 [1,1,0,0,0,0|2,0,0]=4 826 B10R1.245 NC1=CC=CC(Br)=C1NC AK150917 [1,1,0,0,0,0|2,0,0]=4 827 B10R1.245 NC1=CC=CC(Br)=C1OC AK-82282 [1,1,0,0,0,0|2,0,0]=4 828 B10R1.245 NC1=CC=CC(Cl)=C1OC AK-80504 [1,1,0,0,0,0|2,0,0]=4 829 B10R1.245 NC1=CC=CC(F)=C1OC AK-30546 [1,1,0,0,0,0|2,0,0]=4 830 B10R1.245 NCC1=C(Cl)C=CC=C1Cl AK121945 [1,1,0,0,0,0|2,0,0]=4 831 B10R1.245 O=CC1=C(O)C=CC=C1O AK-78056 [1,1,0,0,0,0|1,0,1]=4 832 B10R1.245 OC1=C(C#N)C(=CC=C1)C AK-36241 [1,1,0,0,0,0|1,0,1]=4 833 B10R1.245 OC1=CC=CC(C)=C1C=O AK-67925 [1,1,0,0,0,0|1,0,1]=4 834 B10R1.245 OCC1=C(Br)C=CC=C1F AK-79647 [1,1,0,0,0,0|2,0,0]=4 835 B10R1.245 OCC1=C(C)C=CC=C1C AK117453 [1,1,0,0,0,0|2,0,0]=4 836 B10R1.245 OCC1=C(C)C=CC=C1F AK145170 [1,1,0,0,0,0|2,0,0]=4 837 B10R1.245 OCC1=C(Cl)C=CC=C1N AK117321 [1,1,0,0,0,0|2,0,0]=4 838 B12R1.75 COC1=NC=CN=C1CC(C)C AK116596 [0,1,0,0,0,1|2,0,0]=4 839 B12R1.75 O=CC1=C(OC(C)C)N=CC=C1 AK154317 [0,1,0,0,0,1|1,0,1]=4 840 B12R1.124 CC(Br)C(C1=CC=CC=C1Cl)=O AK208953 [0,1,0,0,0,1|2,0,0]=4 841 B12R1.127 CC(OC1=CC(Br)=CC=C1Cl)C AK167908 [0,1,0,0,0,1|1,0,0]=3 842 B12R1.127 NC1=CC=C(F)C=C1OC(C)C AK158053 [0,1,0,0,0,1|1,0,0]=3 843 B12R1.151 C1=C(C(=CC=C1)O)OC(F)(F)F AK-34708 [0,1,0,0,0,1|2,0,0]=4 844 B12R1.151 NC1=CC=CC=C1NC(C)(C)C AK548921 [0,1,0,0,0,1|1,0,0]=3 845 B12R1.151 NC1=CC=CC=C1SC(C)(C)C AK340253 [0,1,0,0,0,1|1,0,0]=3 846 B12R1.233 CC(OC1=CC=C(Br)C=C1Cl)C AK-61659 [0,1,0,0,0,1|1,0,0]=3 847 B12R1.371 COC(=O)CC1=C(O)C=CC=C1 AK-76378 [0,1,0,0,0,1|1,0,1]=4 848 B12R1.371 OCC(N)CC1=CC=CC=C1Cl AK158852 [0,1,0,0,0,1|2,0,0]=4 849 B12R1.46 CC(C1=CC(Br)=CC=C1OC)=O AK-40233 [0,2,0,0,0,0|1,0,1]=4 850 B12R1.46 CC(C1=CC(F)=CC=C1OC)=O AK126688 [0,2,0,0,0,0|1,0,1]=4 851 B12R1.46 CC1=CC=C(OC)C(C(C)C)=C1 AK127708 [0,2,0,0,0,0|0,0,0]=2 852 B12R1.46 NC1=CC=C(OC)C(C(C)C)=C1 AK140561 [0,2,0,0,0,0|0,0,0]=2 853 B12R1.57 CC(C1=CC=C(Br)C=C1OC)=O AK104826 [0,2,0,0,0,0|1,0,1]=4 854 B12R1.57 COC1=C(C=CC(N)=C1)C(C)=O AK-86813 [0,2,0,0,0,0|1,0,1]=4 855 B12R1.76 OCC1=C(C=CC=C1)C(F)(F)F AK-34772 [0,2,0,0,0,0|2,0,0]=4 856 B12R1.77 CCC(C)C1=C(OC)N=CC=N1 AK-89666 [0,2,0,0,0,0|2,0,0]=4 857 B12R1.77 COC1=CC=CC=C1C(CBr)=O AK114423 [0,2,0,0,0,0|1,0,1]=4 858 B12R1.77 COC1=CC=CC=C1C(CN)=O AK141727 [0,2,0,0,0,0|1,0,1]=4 859 B12R1.77 COC1=CC=CC=C1C(N)CO AK687507 [0,2,0,0,0,0|1,0,0]=3 860 B12R1.77 O=C(OC)C1=CC=CC=C1OC AK-94060 [0,2,0,0,0,0|1,0,1]=4 861 B12R1.77 OC[C@@H](N)C1=CC=CC=C1OC AK340715 [0,2,0,0,0,0|1,0,0]=3 862 B12R1.87 CC(C1=CC=CC(F)=C1OC)=O AK-68623 [0,2,0,0,0,0|1,0,1]=4 863 B12R1.87 COC1=C(C=CC=C1Br)C(C)=O AK100687 [0,2,0,0,0,0|1,0,1]=4 864 B12R1.261 CC(C)C1=C(C=CC=C1)C(C)C AK102959 [0,2,0,0,0,0|1,0,0]=3 865 B12R1.261 CC(C1=CC=CC=C1B(O)O)C AK-45594 [0,2,0,0,0,0|0,0,0]=2 866 B12R1.261 CC(O)C1=CC=CC=C1[N+]([O-])=O AK-82388 [0,2,0,0,0,0|1,0,1]=4 867 B12R1.261 CN(C)C1=C(C=CC=C1)C(O)=O AK-77302 [0,2,0,0,0,0|1,0,0]=3 868 B12R1.261 C[C@@H](N)C1=CC=CC=C1[N+]([O-])=O AK173156 [0,2,0,0,0,0|1,0,1]=4 869 B12R1.261 C[SiH](C1=CC=CC=C1[SiH](C)C)C AK126571 [0,2,0,0,0,0|1,1,0]=4 870 B12R1.261 O=[N+](C1=CC=CC=C1N(C)C)[O-] AK105907 [0,2,0,0,0,0|1,0,1]=4 871 B12R1.261 OB(C1=CC=CC=C1N(C)C)O AK-36766 [0,2,0,0,0,0|1,0,0]=3 872 B12R1.437 CC(C1=C(C)C=CC=C1OC)=O AK145156 [0,2,0,0,0,0|1,0,1]=4 873 B12R1.437 CC(C1=C(OC)C=CC=C1Br)=O AK144491 [0,2,0,0,0,0|1,0,1]=4 874 B12R1.437 CC(C1=C(OC)C=CC=C1Cl)=O AK128371 [0,2,0,0,0,0|1,0,1]=4 875 B12R1.437 CC(C1=C(OC)C=CC=C1F)=O AK-44489 [0,2,0,0,0,0|1,0,1]=4 876 B12R1.437 CC(C1=C(OC)C=CC=C1O)=O AK-76818 [0,2,0,0,0,0|1,0,1]=4 877 B12R1.437 N#CC1=CC=CC(O)=C1C(C)C AK175328 [0,2,0,0,0,0|0,0,0]=2 878 B12R1.126 CC(N)(C1=CC=C(Cl)C=C1Cl)C AK164911 [0,2,0,0,0,0|1,0,0]=3 879 B12R1.126 NC1=CC=C(C(C)(C)C)C(Br)=C1 AK130597 [0,2,0,0,0,0|1,0,0]=3 880 B12R1.128 OC1=CC=C(Br)C=C1C(F)(F)F AK-35381 [0,2,0,0,0,0|2,0,0]=4 881 B12R1.128 OC1=CC=C(Cl)C=C1C(C)(C)C AK101481 [0,2,0,0,0,0|0,0,0]=2 882 B12R1.195 CC(C)(C1=CC=CC=C1Br)C#N AK197950 [0,2,0,0,0,0|1,0,0]=3 883 B12R1.228 OC1=C(C(F)(F)F)C=CC=C1Br AK-49649 [0,2,0,0,0,0|2,0,0]=4 884 B12R1.228 OC1=C(Cl)C=CC=C1C(F)(F)F AK-61415 [0,2,0,0,0,0|2,0,0]=4 885 B12R1.894 C[C@H](O)C1=C(Cl)C=CC(F)=C1Cl AK-36674 [0,2,0,0,0,0|2,0,0]=4 886 B12R1.894 ClC1=C(C(=CC=C1F)Cl)[C@@H](C)O AK-34720 [0,2,0,0,0,0|2,0,0]=4 887 B12R1.1000 CC(=O)C1=C(O)C=C(O)C=C1O AK-96677 [0,2,0,0,0,0|1,0,1]=4 888 B12R1.1000 CC(O)C1=C(F)C=C(Br)C=C1F AK167902 [0,2,0,0,0,0|2,0,0]=4 889 B12R1.3441 COC(=O)C1=C(O)C=CC=C1C AK-72747 [0,2,0,0,0,0|1,0,1]=4 890 B12R1.3441 O=C(OC)C1=C(O)C=CC=C1F AK-80495 [0,2,0,0,0,0|1,0,1]=4 891 B12R1.3441 O=C(OC)C1=C(O)C=CC=C1O AK-64730 [0,2,0,0,0,0|1,0,1]=4 892 B12R1.24 C1=C(C(=C(Cl)C=C1)O)C(=O)OC AK-40718 [0,2,0,0,0,0|1,0,1]=4 893 B12R1.24 CC1=C(F)C=CC=C1[C@@H](N)CO AK335746 [0,2,0,0,0,0|2,0,0]=4 894 B12R1.24 CC1=C(F)C=CC=C1[C@H](N)CO AK335745 [0,2,0,0,0,0|2,0,0]=4 895 B12R1.24 FC1=C(Cl)C=CC=C1[C@H](N)CO AK607991 [0,2,0,0,0,0|2,0,0]=4 896 B12R1.24 O=C(OC)C1=CC=CC(Br)=C1O AK136127 [0,2,0,0,0,0|1,0,1]=4 897 B12R1.24 O=C(OC)C1=CC=CC(F)=C1O AK116128 [0,2,0,0,0,0|1,0,1]=4 898 B12R1.232 CC(C1=CC(F)=C(Br)C=C1O)=O AK252572 [0,2,0,0,0,0|1,0,1]=4 899 B12R1.232 CC(C1=CC(O)=C(O)C=C1O)=O AK153502 [0,2,0,0,0,0|1,0,1]=4 900 B12R1.232 O=C1C(C(C)C)=CC(C(C)=C1)=O AK101679 [0,2,0,0,0,0|0,0,1]=3 901 B12R1.452 CC(C1=CC=C(OC)C=C1O)=O AK-79421 [0,2,0,0,0,0|1,0,1]=4 902 B12R1.452 C[C@H](N)C1=CC=C(OC)C=C1F AK133432 [0,2,0,0,0,0|2,0,0]=4 903 B12R1.452 O=CC1=CC=C(N(C)C)C(C)=C1 AK-57047 [0,2,0,0,0,0|2,0,0]=4 904 B12R1.1703 C1=C(C(=CC(=C1)O)O)C(OC)=O AK-50554 [0,2,0,0,0,0|1,0,1]=4 905 B12R1.1703 C1=CC(=CC(=C1C(OC)=O)O)N AK-45502 [0,2,0,0,0,0|1,0,1]=4 906 B12R1.1703 CC[C@@H](C1=CC=C(C)C=C1C)N AK134037 [0,2,0,0,0,0|2,0,0]=4 907 B12R1.1703 COC(=O)C1=C(O)C=C(C)C=C1 AK-82342 [0,2,0,0,0,0|1,0,1]=4 908 B12R1.1703 ClC1=CC=C(C(N)CO)C(Cl)=C1 AK523897 [0,2,0,0,0,0|2,0,0]=4 909 B12R1.1703 ClC1=CC=C(C(N)CO)C(Cl)=C1 AK670792 [0,2,0,0,0,0|2,0,0]=4 910 B12R1.1703 FC1=CC(=C(C(=O)OC)C=C1)O AK-49085 [0,2,0,0,0,0|1,0,1]=4 911 B12R1.1703 O=C(OC)C1=CC=C(Br)C=C1O AK-88441 [0,2,0,0,0,0|1,0,1]=4 912 B12R1.1703 O=C(OC)C1=CC=C(Cl)C=C1O AK-46989 [0,2,0,0,0,0|1,0,1]=4 913 B12R1.1703 O=C(OC)C1=CC=C(I)C=C1O AK144550 [0,2,0,0,0,0|1,0,1]=4 914 B12R1.354 C1=C(O)C=CC(=C1C(OC)=O)O AK-46580 [0,2,0,0,0,0|1,0,1]=4 915 B12R1.354 CC[C@@H](C1=CC(F)=CC=C1F)N AK134085 [0,2,0,0,0,0|2,0,0]=4 916 B12R1.354 COC(=O)C1=C(O)C=CC(Br)=C1 AK-59850 [0,2,0,0,0,0|1,0,1]=4 917 B12R1.354 COC(=O)C1=C(O)C=CC(N)=C1 AK-82780 [0,2,0,0,0,0|1,0,1]=4 918 B12R1.354 FC1=CC=C(F)C([C@H](N)CO)=C1 AK172746 [0,2,0,0,0,0|2,0,0]=4 919 B12R1.354 O=C(OC)C1=CC(Cl)=CC=C1O AK-80153 [0,2,0,0,0,0|1,0,1]=4 920 B12R1.354 O=C(OC)C1=CC(F)=CC=C1O AK-81427 [0,2,0,0,0,0|1,0,1]=4 921 B12R1.453 C(C)(=O)C1=C(C=CC(=C1)C#N)O AK-34831 [0,2,0,0,0,0|1,0,1]=4 922 B12R1.308 CCC[C@H](C1=CC=CC=C1C)N AK683690 [0,2,0,0,0,0|2,0,0]=4 923 B12R1.308 O=C(OCC)C1=CC=CC=C1O AK114211 [0,2,0,0,0,0|1,0,1]=4 924 B10R1.18 CC(C)OC1=CC=CC=C1 AK110874 [0,0,1,1,0,0|2,0,0]=4 925 B10R1.18 CC(OC1=NC=CC=C1)C AK-47912 [0,0,1,1,0,0|2,0,0]=4 926 B10R1.18 C\C(C)=C/C1=CC=CC=C1 AK113914 [0,0,1,1,0,0|1,0,1]=4 927 B10R2.320 BrC1C2=CC=CC=C2C1 AK163275 [1,0,0,1,0,0|1,0,0]=3 928 B10R2.320 C1=CC=CC2=C1CC2=O AK-72898 [1,0,0,1,0,0|1,0,1]=4 929 B10R2.7 C12=C(CNC1)C=CC=C2 AK-46308 [1,0,0,1,0,0|2,0,0]=4 930 B10R2.7 C12=C(NCC1)C=CC=C2 AK-49832 [1,0,0,1,0,0|1,0,0]=3 931 B10R2.7 C12=CC=CC=C1OCO2 AK-48090 [1,0,0,1,0,0|1,0,0]=3 932 B10R2.7 C12=NC=CC=C1CCN2 AK-23969 [1,0,0,1,0,0|2,0,0]=4 933 B10R2.7 C1=CC=CC2=C1CCO2 AK-35322 [1,0,0,1,0,0|0,0,0]=2 934 B10R2.7 C1=CC=CC2=C1N=CO2 AK-47416 [1,0,0,1,0,0|1,0,1]=4 935 B10R2.7 C=12NCCC1C=CN=C2 AK-76917 [1,0,0,1,0,0|2,0,0]=4 936 B10R2.7 C=12NCCC1C=CN=C2 AK138671 [1,0,0,1,0,0|2,0,0]=4 937 B12R2.24 C1=CC=CC2=C1NC(=O)CO2 AK-46795 [0,0,0,1,0,1|1,0,1]=4 938 B12R2.24 CC1CC2=C(CN1)C=CC=C2 AK-77462 [0,0,0,1,0,1|2,0,0]=4 939 B12R2.24 CC1CCC2=CC=CC=C2N1 AK-33768 [0,0,0,1,0,1|1,0,0]=3 940 B12R2.24 CC1CNC2=C(C=CC=C2)C1 AK146007 [0,0,0,1,0,1|1,0,0]=3 941 B12R2.24 NC1CC2=C(C=CC=C2)CC1 AK-33697 [0,0,0,1,0,1|2,0,0]=4 942 B12R2.24 NC1CNC2=C(C=CC=C2)C1 AK-78514 [0,0,0,1,0,1|2,0,0]=4 943 B12R2.24 NC1CNC2=CC=CC=C2C1 AK-68575 [0,0,0,1,0,1|2,0,0]=4 944 B12R2.24 N[C@@H]1CC2=C(C=CC=C2)CC1 AK-25606 [0,0,0,1,0,1|2,0,0]=4 945 B12R2.24 N[C@H]1CC2=C(C=CC=C2)CC1 AK128431 [0,0,0,1,0,1|2,0,0]=4 946 B12R2.24 O=C1COC2=CC=CC=C2C1 AK-96048 [0,0,0,1,0,1|1,0,1]=4 947 B12R2.24 OC1CC2=C(C=CC=C2)CC1 AK324558 [0,0,0,1,0,1|2,0,0]=4 948 B12R2.95 FC1(F)OC2=CC=CC=C2O1 AK-53693 [0,0,0,1,0,1|2,0,0]=4 949 B12R2.202 OC1=CC=CC2=C1C=C(C)N2 AK-23777 [0,0,0,1,0,1|1,0,1]=4 950 B12R2.202 OC1CC2=C(C(Br)=CC=C2)C1 AK146728 [0,0,0,1,0,1|2,0,0]=4 951 B12R2.1081 C1=CC=CC2=C1CCNC2C AK-29302 [0,1,0,1,0,0|1,0,0]=3 952 B12R2.1081 CC1C2=CC=CC=C2CCN1 AK-57161 [0,1,0,1,0,0|1,0,0]=3 953 B12R2.1081 CC1CCNC2=C1C=CC=C2 AK139156 [0,1,0,1,0,0|1,0,0]=3 954 B12R2.1081 CC1CNCC2=C1C=CC=C2 AK130522 [0,1,0,1,0,0|1,0,0]=3 955 B12R2.1081 CN1CCNC2=C1C=CC=C2 AK-39613 [0,1,0,1,0,0|2,0,0]=4 956 B12R2.1081 NC1CCCC2=C1C=CC=C2 AK-31970 [0,1,0,1,0,0|2,0,0]=4 957 B12R2.1081 NC1CCCC2=C1C=CC=C2 AK-81453 [0,1,0,1,0,0|2,0,0]=4 958 B12R2.1081 NC1CCNC2=C1C=CC=C2 AK128627 [0,1,0,1,0,0|2,0,0]=4 959 B12R2.1081 NC1CCOC2=C1C=CC=C2 AK-32488 [0,1,0,1,0,0|1,0,0]=3 960 B12R2.1081 NC1CCOC2=C1C=CC=C2 AK-43439 [0,1,0,1,0,0|1,0,0]=3 961 B12R2.1081 N[C@@H]1CCCC2=C1C=CC=C2 AK105266 [0,1,0,1,0,0|2,0,0]=4 962 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 AK-54431 [0,1,0,1,0,0|1,0,0]=3 963 B12R2.1081 O=C1CCOC2=C1C=CC=C2 AK-46406 [0,1,0,1,0,0|1,0,1]=4 964 B12R2.1081 OC1CCCC2=C1C=CC=C2 AK-50542 [0,1,0,1,0,0|2,0,0]=4 965 B12R2.1081 OC1CCNC2=C1C=CC=C2 AK-87029 [0,1,0,1,0,0|2,0,0]=4 966 B12R2.1081 OC1COCC2=C1C=CC=C2 AK-76197 [0,1,0,1,0,0|1,0,0]=3 967 B12R2.1081 [C@H]1(C2=CC=CC=C2CCC1)N AK-34256 [0,1,0,1,0,0|2,0,0]=4 968 B12R2.2028 BrC1CC(=O)C2=C1C=CC=C2 AK-32505 [0,1,0,1,0,0|1,0,1]=4 969 B12R2.2048 OCC1=C(C=CC=C1)C2CC2 AK-90254 [0,1,0,1,0,0|0,0,0]=2 970 B12R2.2403 CC1(C)CNC2=C1C=CC=C2 AK139225 [0,1,0,1,0,0|1,0,0]=3 971 B12R2.88 NC1(C2=CC=CC=C2F)CC1 AK-90843 [0,1,0,1,0,0|1,0,0]=3 972 B12R2.203 FC1=C2C(=O)COC2=CC=C1 AK100224 [0,1,0,1,0,0|1,0,1]=4 973 B12R2.203 NC1CCC2=C1C(Br)=CC=C2 AK608488 [0,1,0,1,0,0|2,0,0]=4 974 B12R2.203 N[C@H]1CCC2=C1C(F)=CC=C2 AK608001 [0,1,0,1,0,0|2,0,0]=4 975 B12R2.203 O=C1CCC2=C1C(O)=CC=C2 AK-36137 [0,1,0,1,0,0|1,0,1]=4 976 B12R2.196 NC1CCC2=C(F)C=CC=C12 AK-80219 [0,1,0,1,0,0|2,0,0]=4 977 B12R2.196 NC1CCC2=C1C=CC=C2Br AK174612 [0,1,0,1,0,0|2,0,0]=4 978 B12R2.196 NC1CCC2=C1C=CC=C2Cl AK164257 [0,1,0,1,0,0|2,0,0]=4 979 B12R2.196 NC1COC2=C(Br)C=CC=C12 AK684522 [0,1,0,1,0,0|1,0,0]=3 980 B12R2.196 N[C@@H]1CCC2=C1C=CC=C2Br AK-42512 [0,1,0,1,0,0|2,0,0]=4 981 B12R2.196 N[C@@H]1COC2=C(Br)C=CC=C12 AK677834 [0,1,0,1,0,0|1,0,0]=3 982 B12R2.196 N[C@@H]1COC2=C(Cl)C=CC=C12 AK677835 [0,1,0,1,0,0|1,0,0]=3 983 B12R2.196 N[C@H]1CCC2=C1C=CC=C2Br AK-42513 [0,1,0,1,0,0|2,0,0]=4 984 B12R2.196 N[C@H]1CCC2=C1C=CC=C2F AK-42269 [0,1,0,1,0,0|2,0,0]=4 985 B12R2.196 O=C1COC2=C(Br)C=CC=C12 AK-49048 [0,1,0,1,0,0|1,0,1]=4 986 B12R2.612 CC1=CC=C2C(N)CCC2=C1 AK-60573 [0,1,0,1,0,0|2,0,0]=4 987 B12R2.612 CC1=NOC2=C1C=CC(=C2)O AK-24401 [0,1,0,1,0,0|1,0,1]=4 988 B12R2.612 CC1=NOC2=CC(Br)=CC=C12 AK-80171 [0,1,0,1,0,0|1,0,1]=4 989 B12R2.612 NC1CCC2=C1C=CC(Cl)=C2 AK-31447 [0,1,0,1,0,0|2,0,0]=4 990 B12R2.612 NC1COC2=CC(Br)=CC=C12 AK-27555 [0,1,0,1,0,0|1,0,0]=3 991 B12R2.612 N[C@@H]1CCC2=C1C=CC(Br)=C2 AK175313 [0,1,0,1,0,0|2,0,0]=4 992 B12R2.612 N[C@@H]1CCC2=C1C=CC(Cl)=C2 AK-76304 [0,1,0,1,0,0|2,0,0]=4 993 B12R2.612 N[C@@H]1CCC2=C1C=CC(Cl)=C2 AK544242 [0,1,0,1,0,0|2,0,0]=4 994 B12R2.612 N[C@@H]1CCC2=C1C=CC(F)=C2 AK-42485 [0,1,0,1,0,0|2,0,0]=4 995 B12R2.612 N[C@H]1CCC2=C1C=CC(Br)=C2 AK-51085 [0,1,0,1,0,0|2,0,0]=4 996 B12R2.612 N[C@H]1CCC2=C1C=CC(Cl)=C2 AK-76305 [0,1,0,1,0,0|2,0,0]=4 997 B12R2.612 N[C@H]1CCC2=C1C=CC(Cl)=C2 AK544243 [0,1,0,1,0,0|2,0,0]=4 998 B12R2.612 O=C1COC2=CC(Br)=CC=C12 AK-33982 [0,1,0,1,0,0|1,0,1]=4 999 B12R2.612 O=C1COC2=CC(Cl)=CC=C12 AK-25773 [0,1,0,1,0,0|1,0,1]=4 1000 B12R2.612 O=C1COC2=CC(O)=CC=C12 AK-27229 [0,1,0,1,0,0|1,0,1]=4 1001 B12R2.612 OC1CCC2=C1C=CC(Cl)=C2 AK109538 [0,1,0,1,0,0|2,0,0]=4 1002 B12R2.132 BrC1=CC2=C(C=C1)OCC2=O AK-28271 [0,1,0,1,0,0|1,0,1]=4 1003 B12R2.132 CC1=NOC2=C1C=C(N)C=C2 AK104938 [0,1,0,1,0,0|1,0,1]=4 1004 B12R2.132 NC1CCC2=C1C=C(Cl)C=C2 AK-36062 [0,1,0,1,0,0|2,0,0]=4 1005 B12R2.132 NC1CCC2=C1C=C(F)C=C2 AK164000 [0,1,0,1,0,0|2,0,0]=4 1006 B12R2.132 N[C@@H]1CCC2=C1C=C(F)C=C2 AK-42229 [0,1,0,1,0,0|2,0,0]=4 1007 B12R2.132 N[C@H]1CCC2=C1C=C(F)C=C2 AK-42484 [0,1,0,1,0,0|2,0,0]=4 1008 B12R2.132 OC1CCC2=C1C=C(Br)C=C2 AK146224 [0,1,0,1,0,0|2,0,0]=4 1009 B12R2.1 N#CC1CCC2=C1C=CC=C2 AK-68472 [0,1,0,1,0,0|1,0,1]=4 1010 B12R2.18 C1=C([N](C2=CC=CC=C12)C)C AK-47660 [0,1,0,1,0,0|2,0,0]=4 1011 B12R2.18 CC1C(C)NC2=C1C=CC=C2 AK115892 [0,1,0,1,0,0|1,0,0]=3 1012 B12R2.18 O[C@@H]1[C@H](N)C2=C(C=CC=C2)C1 AK-27059 [0,1,0,1,0,0|2,0,0]=4 1013 B12R2.18 O[C@H]1[C@@H](N)C2=C(C=CC=C2)C1 AK-25342 [0,1,0,1,0,0|2,0,0]=4 1014 B8R1.7 CC(C1=CC=CO1)C AK120816 [1,0,0,0,1,0|1,0,0]=3 1015 B8R1.7 CC(C1=NC=CN1)C AK106223 [1,0,0,0,1,0|2,0,0]=4 1016 B8R1.7 CC(N1C=CN=C1)C AK-79287 [1,0,0,0,1,0|2,0,0]=4 1017 B8R1.7 CC(N1N=CC=C1)C AK-61646 [1,0,0,0,1,0|2,0,0]=4 1018 B8R1.7 C[C@H](N)C1=CC=CO1 AK544263 [1,0,0,0,1,0|2,0,0]=4 1019 B8R1.7 C[C@H](N)C1=CC=CS1 AK486945 [1,0,0,0,1,0|2,0,0]=4 1020 B12R1.125 CC(NCC1=CC=CC=C1O)=O AK596956 [0,0,0,0,0,2|1,0,1]=4