0 B9R1.6 C1=C(C(=O)C)C=CN=C1 AK-65203 [0,0,0,0,0,0|1,0,2]=3 1 B9R1.6 C1=C(C(C)=O)N=CC=C1 AK-53417 [0,0,0,0,0,0|1,0,2]=3 2 B9R1.6 C1=C(C(N)=O)C=CN=C1 AK-47864 [0,0,0,0,0,0|2,0,2]=4 3 B9R1.6 C1=C(C=CC=C1)B(O)O AK-50285 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.6 C1=C(C=CN=C1)B(O)O AK-26762 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.6 C1=C(N=CC=N1)C(=O)C AK-16901 [0,0,0,0,0,0|2,0,2]=4 6 B9R1.6 C1=C(N=NC=C1)C(O)=O AK-28139 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.6 C1=CN=CN=C1C(=O)O AK-23926 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.6 C1=NC(=CC=C1)C(C)C AK-46532 [0,0,0,0,0,0|2,0,0]=2 9 B9R1.6 C1=NC=C(B(O)O)C=N1 AK-25129 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.6 C1=NC=CN=C1C(O)=O AK-47505 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.6 C1=NC=NC=C1C(=O)O AK-24470 [0,0,0,0,0,0|3,0,1]=4 12 B9R1.6 CC(=O)C1=CC=CN=N1 AK-83539 [0,0,0,0,0,0|2,0,2]=4 13 B9R1.6 CC(=O)C1=CC=NN=C1 AK-30816 [0,0,0,0,0,0|2,0,2]=4 14 B9R1.6 CC(=O)C1=NC=CC=N1 AK-35526 [0,0,0,0,0,0|2,0,2]=4 15 B9R1.6 CC(C1=CN=CN=C1)=O AK-32388 [0,0,0,0,0,0|2,0,2]=4 16 B9R1.6 CC(C1=NC=NC=C1)=O AK-40767 [0,0,0,0,0,0|2,0,2]=4 17 B9R1.6 CC(N)C1=CC=CN=C1 AK-35649 [0,0,0,0,0,0|2,0,0]=2 18 B9R1.6 CC(N)C1=CN=CC=N1 AK-31016 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.6 CC(N)C1=NC=CC=N1 AK162973 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.6 CC(O)C1=NC=CC=C1 AK-53453 [0,0,0,0,0,0|1,0,0]=1 21 B9R1.6 CN(C)C1=NC=CC=C1 AK-78706 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.6 C[C@@H](N)C1=CC=CC=C1 AK668263 [0,0,0,0,0,0|1,0,0]=1 23 B9R1.6 C[C@@H](N)C1=CC=CN=C1 AK152012 [0,0,0,0,0,0|2,0,0]=2 24 B9R1.6 C[C@@H](N)C1=NC=CC=C1 AK122419 [0,0,0,0,0,0|2,0,0]=2 25 B9R1.6 C[C@@H](O)C1=CC=CC=C1 AK-79205 [0,0,0,0,0,0|0,0,0]=0 26 B9R1.6 C[C@@H](O)C1=CC=NC=C1 AK-45022 [0,0,0,0,0,0|1,0,0]=1 27 B9R1.6 C[C@@H](O)C1=NC=CC=C1 AK-79201 [0,0,0,0,0,0|1,0,0]=1 28 B9R1.6 C[C@H](N)C1=CC=CN=C1 AK151271 [0,0,0,0,0,0|2,0,0]=2 29 B9R1.6 C[C@H](O)C1=CC=NC=C1 AK-79199 [0,0,0,0,0,0|1,0,0]=1 30 B9R1.6 N1=C(C=CC=C1)C(N)=S AK-65332 [0,0,0,0,0,0|2,1,1]=4 31 B9R1.6 N1=C(C=CC=C1)[C@@H](C)N AK-37082 [0,0,0,0,0,0|2,0,0]=2 32 B9R1.6 N1=C(N=CC=C1)C(=O)O AK-24353 [0,0,0,0,0,0|3,0,1]=4 33 B9R1.6 N1=NC=C(C=C1)C(=O)O AK-26044 [0,0,0,0,0,0|3,0,1]=4 34 B9R1.6 N=C(N)C1=CC=CC=C1 AK-47930 [0,0,0,0,0,0|2,0,1]=3 35 B9R1.6 N=C(N)C1=CC=NC=C1 AK-84875 [0,0,0,0,0,0|3,0,1]=4 36 B9R1.6 N=C(N)C1=CC=NC=C1 AK546382 [0,0,0,0,0,0|3,0,1]=4 37 B9R1.6 N=C(N)C1=CN=CC=C1 AK-76662 [0,0,0,0,0,0|3,0,1]=4 38 B9R1.6 N=C(N)C1=NC=CC=C1 AK-26055 [0,0,0,0,0,0|3,0,1]=4 39 B9R1.6 NC(=N)C1=CC=CC=C1 AK-48017 [0,0,0,0,0,0|2,0,1]=3 40 B9R1.6 NC(C1=CC=CC=C1)=S AK-46849 [0,0,0,0,0,0|1,1,1]=3 41 B9R1.6 N[C@@H](C1=CC=NC=C1)C AK202973 [0,0,0,0,0,0|2,0,0]=2 42 B9R1.6 N[C@H](C1=NC=CC=C1)C AK-37110 [0,0,0,0,0,0|2,0,0]=2 43 B9R1.6 O=C(Cl)C1=NC=CC=C1 AK-49118 [0,0,0,0,0,0|2,0,2]=4 44 B9R1.6 O=C(N)C1=CC=CC=C1 AK-77684 [0,0,0,0,0,0|1,0,2]=3 45 B9R1.6 O=C(N)C1=CN=CC=C1 AK112769 [0,0,0,0,0,0|2,0,2]=4 46 B9R1.6 O=C(N)C1=NC=CC=C1 AK106190 [0,0,0,0,0,0|2,0,2]=4 47 B9R1.6 O=C(O)C1=CN=CC=C1 AK-46486 [0,0,0,0,0,0|2,0,1]=3 48 B9R1.6 O=C(O)C1=NC=CC=C1 AK-50286 [0,0,0,0,0,0|2,0,1]=3 49 B9R1.6 O=S(C1=CC=CC=C1)[O-] AK162411 [0,0,0,0,0,0|2,0,1]=3 50 B9R1.6 OB(C1=CC=CN=C1)O AK-26799 [0,0,0,0,0,0|3,0,0]=3 51 B9R1.6 OB(C1=NC=CC=C1)O AK-26642 [0,0,0,0,0,0|3,0,0]=3 52 B9R1.6 OB(C1=NC=NC=C1)O AK187804 [0,0,0,0,0,0|4,0,0]=4 53 B9R1.6 OC(=O)C1=CC=NC=C1 AK-49896 [0,0,0,0,0,0|2,0,1]=3 54 B8R1.2 BrCC1=CC=CN=C1 AK-44682 [1,0,0,0,0,0|2,0,0]=3 55 B8R1.2 BrCC1=CC=NC=C1 AK-40271 [1,0,0,0,0,0|2,0,0]=3 56 B8R1.2 BrCC1=CN=CN=C1 AK150782 [1,0,0,0,0,0|3,0,0]=4 57 B8R1.2 BrCC1=NC=CC=C1 AK-78919 [1,0,0,0,0,0|2,0,0]=3 58 B8R1.2 BrCC1=NC=CN=C1 AK143784 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.2 BrCC1=NC=NC=C1 AK109329 [1,0,0,0,0,0|3,0,0]=4 60 B8R1.2 BrCC1=NN=CC=C1 AK-77169 [1,0,0,0,0,0|3,0,0]=4 61 B8R1.2 C#CC1=CC=CN=C1 AK-39524 [1,0,0,0,0,0|1,0,2]=4 62 B8R1.2 C#CC1=CC=NC=C1 AK-32285 [1,0,0,0,0,0|1,0,2]=4 63 B8R1.2 C#CC1=CC=NC=C1 AK-61719 [1,0,0,0,0,0|1,0,2]=4 64 B8R1.2 C1=C(N=CC=C1)C#C AK-39840 [1,0,0,0,0,0|1,0,2]=4 65 B8R1.2 C1=C(N=CC=N1)CN AK-23965 [1,0,0,0,0,0|3,0,0]=4 66 B8R1.2 C1=CN=CC=C1OC AK-54547 [1,0,0,0,0,0|2,0,0]=3 67 B8R1.2 C1=NC=C(N=C1)CO AK-45812 [1,0,0,0,0,0|2,0,0]=3 68 B8R1.2 CC[N+]1=CC=CC=C1 AK607939 [1,0,0,0,0,0|1,0,0]=2 69 B8R1.2 CNC1=CC=CN=C1 AK-72893 [1,0,0,0,0,0|2,0,0]=3 70 B8R1.2 CNC1=CC=NN=C1 AK545083 [1,0,0,0,0,0|3,0,0]=4 71 B8R1.2 CNC1=NC=CC=N1 AK-27708 [1,0,0,0,0,0|3,0,0]=4 72 B8R1.2 COC1=CC=CN=C1 AK-76565 [1,0,0,0,0,0|2,0,0]=3 73 B8R1.2 COC1=CC=CN=N1 AK-28954 [1,0,0,0,0,0|3,0,0]=4 74 B8R1.2 COC1=CN=CN=C1 AK-31068 [1,0,0,0,0,0|3,0,0]=4 75 B8R1.2 CSC1=NC=CN=C1 AK-41535 [1,0,0,0,0,0|3,0,0]=4 76 B8R1.2 ClCC1=NC=CC=N1 AK-29240 [1,0,0,0,0,0|3,0,0]=4 77 B8R1.2 ICC1=CC=CC=C1 AK-54444 [1,0,0,0,0,0|1,0,0]=2 78 B8R1.2 N#CC1=CC=CC=C1 AK-49389 [1,0,0,0,0,0|1,0,1]=3 79 B8R1.2 N#CC1=CC=NC=C1 AK-76782 [1,0,0,0,0,0|2,0,1]=4 80 B8R1.2 N#CC1=CN=CC=C1 AK-76753 [1,0,0,0,0,0|2,0,1]=4 81 B8R1.2 N#CC1=NC=CC=C1 AK-76752 [1,0,0,0,0,0|2,0,1]=4 82 B8R1.2 N1=C(N=CC=C1)CN AK-23656 [1,0,0,0,0,0|3,0,0]=4 83 B8R1.2 NCC1=CC=NC=C1 AK-25866 [1,0,0,0,0,0|2,0,0]=3 84 B8R1.2 NCC1=CC=NC=C1 AK-50006 [1,0,0,0,0,0|2,0,0]=3 85 B8R1.2 NCC1=CC=NN=C1 AK-23789 [1,0,0,0,0,0|3,0,0]=4 86 B8R1.2 NCC1=CN=CN=C1 AK164227 [1,0,0,0,0,0|3,0,0]=4 87 B8R1.2 NCC1=NC=CC=N1 AK-73144 [1,0,0,0,0,0|3,0,0]=4 88 B8R1.2 NCC1=NC=CN=C1 AK-50813 [1,0,0,0,0,0|3,0,0]=4 89 B8R1.2 NCC1=NC=NC=C1 AK-23966 [1,0,0,0,0,0|3,0,0]=4 90 B8R1.2 NNC1=CC=CC=C1 AK114548 [1,0,0,0,0,0|2,0,0]=3 91 B8R1.2 NNC1=CC=CN=C1 AK-40869 [1,0,0,0,0,0|3,0,0]=4 92 B8R1.2 NNC1=CC=CN=C1 AK-75799 [1,0,0,0,0,0|3,0,0]=4 93 B8R1.2 NNC1=CC=NC=C1 AK-51295 [1,0,0,0,0,0|3,0,0]=4 94 B8R1.2 NNC1=NC=CC=C1 AK-26026 [1,0,0,0,0,0|3,0,0]=4 95 B8R1.2 NOC1=CC=CC=C1 AK-77703 [1,0,0,0,0,0|2,0,0]=3 96 B8R1.2 O=CC1=CC=NC=C1 AK-50192 [1,0,0,0,0,0|1,0,2]=4 97 B8R1.2 OCC1=CC=CN=C1 AK-46173 [1,0,0,0,0,0|1,0,0]=2 98 B8R1.2 OCC1=CC=NC=C1 AK-44706 [1,0,0,0,0,0|1,0,0]=2 99 B8R1.2 OCC1=CC=NC=C1 AK175384 [1,0,0,0,0,0|1,0,0]=2 100 B8R1.2 OCC1=CN=CN=C1 AK-32022 [1,0,0,0,0,0|2,0,0]=3 101 B8R1.2 OCC1=NC=CC=C1 AK-53905 [1,0,0,0,0,0|1,0,0]=2 102 B8R1.2 OCC1=NC=CC=N1 AK-25156 [1,0,0,0,0,0|2,0,0]=3 103 B8R1.2 OCC1=NC=NC=C1 AK-31889 [1,0,0,0,0,0|2,0,0]=3 104 B8R1.2 ONC1=CC=CC=C1 AK139965 [1,0,0,0,0,0|1,0,0]=2 105 B10R1.13 C(C)(=O)C1=CC=C(N=C1)Br AK-25404 [0,1,0,0,0,0|1,0,2]=4 106 B10R1.13 C1=C(B(O)O)C=CC(=C1)C AK-39805 [0,1,0,0,0,0|2,0,0]=3 107 B10R1.13 C1=C(C(=N)N)C=CC(=C1)Cl AK-49053 [0,1,0,0,0,0|2,0,1]=4 108 B10R1.13 C1=C(C(C)C)C=CC(=C1)Br AK-47451 [0,1,0,0,0,0|1,0,0]=2 109 B10R1.13 C1=C(C=CC(=C1)Br)B(O)O AK-44722 [0,1,0,0,0,0|2,0,0]=3 110 B10R1.13 C1=C(C=CC(=C1)F)B(O)O AK-46490 [0,1,0,0,0,0|2,0,0]=3 111 B10R1.13 C1=C(C=CC(=C1)O)B(O)O AK-44804 [0,1,0,0,0,0|2,0,0]=3 112 B10R1.13 C1=C(C=CC(=N1)Cl)B(O)O AK-29256 [0,1,0,0,0,0|3,0,0]=4 113 B10R1.13 C1=C(C=CC(=N1)F)B(O)O AK-29209 [0,1,0,0,0,0|3,0,0]=4 114 B10R1.13 C1=C(C=NC(=C1)N)C(=O)O AK-25111 [0,1,0,0,0,0|2,0,1]=4 115 B10R1.13 C1=C(N(C)C)C=CC(=C1)Br AK-47628 [0,1,0,0,0,0|2,0,0]=3 116 B10R1.13 C1=C(N=CC(=C1)C(C)=O)C AK-25853 [0,1,0,0,0,0|1,0,2]=4 117 B10R1.13 C1=CC(=CC=C1C(C)=O)F AK-41690 [0,1,0,0,0,0|0,0,2]=3 118 B10R1.13 C1=CC(=CC=C1C(N)=O)F AK-47676 [0,1,0,0,0,0|1,0,2]=4 119 B10R1.13 C1=CC(=CC=C1C(O)=O)Br AK-50463 [0,1,0,0,0,0|1,0,1]=3 120 B10R1.13 C1=CC(=CC=C1C(O)=O)F AK-73077 [0,1,0,0,0,0|1,0,1]=3 121 B10R1.13 C1=CC(=CN=C1C(O)=O)C AK-27814 [0,1,0,0,0,0|2,0,1]=4 122 B10R1.13 C1=NC(=CC=C1C(=O)O)F AK-25936 [0,1,0,0,0,0|2,0,1]=4 123 B10R1.13 CC(=O)C1=CC=C(N)N=C1 AK-67650 [0,1,0,0,0,0|1,0,2]=4 124 B10R1.13 CC(Br)C1=CC=C(F)C=C1 AK-94758 [0,1,0,0,0,0|1,0,0]=2 125 B10R1.13 CC(C1=CC=C(Br)C=C1)=O AK124422 [0,1,0,0,0,0|0,0,2]=3 126 B10R1.13 CC(C1=CC=C(C)C=C1)=O AK-41305 [0,1,0,0,0,0|0,0,2]=3 127 B10R1.13 CC(C1=CC=C(F)N=C1)=O AK-29672 [0,1,0,0,0,0|1,0,2]=4 128 B10R1.13 CC(C1=CC=C(N)C=C1)=O AK110424 [0,1,0,0,0,0|0,0,2]=3 129 B10R1.13 CC(C1=CC=C(O)C=C1)=O AK-86441 [0,1,0,0,0,0|0,0,2]=3 130 B10R1.13 CC(C1=CC=C(O)N=C1)=O AK-40333 [0,1,0,0,0,0|1,0,2]=4 131 B10R1.13 CC(C1=CN=C(N)C=C1)C AK-81363 [0,1,0,0,0,0|2,0,0]=3 132 B10R1.13 CC(C1=NC=C(Br)C=C1)=O AK-28454 [0,1,0,0,0,0|1,0,2]=4 133 B10R1.13 CC(C1=NC=C(Br)C=N1)C AK173649 [0,1,0,0,0,0|3,0,0]=4 134 B10R1.13 CC(C1=NC=C(Cl)C=C1)=O AK-77099 [0,1,0,0,0,0|1,0,2]=4 135 B10R1.13 CC(C1=NC=C(O)C=C1)=O AK116053 [0,1,0,0,0,0|1,0,2]=4 136 B10R1.13 CC(N)C1=CC=C(C)N=C1 AK684509 [0,1,0,0,0,0|2,0,0]=3 137 B10R1.13 CC(N)C1=CC=C(I)C=C1 AK-77292 [0,1,0,0,0,0|1,0,0]=2 138 B10R1.13 CC(N)C1=NC=C(C)C=C1 AK158768 [0,1,0,0,0,0|2,0,0]=3 139 B10R1.13 CC(O)C1=CC=C(Br)C=C1 AK117026 [0,1,0,0,0,0|0,0,0]=1 140 B10R1.13 CC(O)C1=CC=C(N)C=C1 AK109742 [0,1,0,0,0,0|0,0,0]=1 141 B10R1.13 CC(O)C1=CN=C(C)C=C1 AK-32149 [0,1,0,0,0,0|1,0,0]=2 142 B10R1.13 CC1=CC=C(S(O)=O)C=C1 AK-46949 [0,1,0,0,0,0|2,0,0]=3 143 B10R1.13 CC1=NC=C(C=C1)B(O)O AK-27039 [0,1,0,0,0,0|3,0,0]=4 144 B10R1.13 CN(C)C1=CC=C(C=C1)I AK101968 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 AK136579 [0,1,0,0,0,0|2,0,0]=3 146 B10R1.13 CN(C)C1=CC=C(O)C=C1 AK-64702 [0,1,0,0,0,0|2,0,0]=3 147 B10R1.13 CN(C)C1=NC=C(Br)C=C1 AK-25675 [0,1,0,0,0,0|3,0,0]=4 148 B10R1.13 CN(C)C1=NC=C(I)C=C1 AK117849 [0,1,0,0,0,0|3,0,0]=4 149 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 AK-45030 [0,1,0,0,0,0|1,0,0]=2 150 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 AK-89611 [0,1,0,0,0,0|1,0,0]=2 151 B10R1.13 C[C@@H](N)C1=CC=C(I)C=C1 AK-43006 [0,1,0,0,0,0|1,0,0]=2 152 B10R1.13 C[C@@H](N)C1=NC=C(F)C=C1 AK204056 [0,1,0,0,0,0|2,0,0]=3 153 B10R1.13 C[C@@H](O)C1=CC=C(Br)C=C1 AK-79215 [0,1,0,0,0,0|0,0,0]=1 154 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 AK-34471 [0,1,0,0,0,0|1,0,0]=2 155 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 AK548805 [0,1,0,0,0,0|1,0,0]=2 156 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 AK173009 [0,1,0,0,0,0|2,0,0]=3 157 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 AK321169 [0,1,0,0,0,0|2,0,0]=3 158 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 AK668421 [0,1,0,0,0,0|2,0,0]=3 159 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 AK-79189 [0,1,0,0,0,0|0,0,0]=1 160 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 AK-79216 [0,1,0,0,0,0|0,0,0]=1 161 B10R1.13 ClC1=CC=C(B(O)O)C=C1 AK-26616 [0,1,0,0,0,0|2,0,0]=3 162 B10R1.13 ClC1=CC=C(C(C)=O)C=N1 AK-26129 [0,1,0,0,0,0|1,0,2]=4 163 B10R1.13 ClC1=CC=C(N=C1)C(=O)O AK-26702 [0,1,0,0,0,0|2,0,1]=4 164 B10R1.13 ClC1=CN=C(C=C1)B(O)O AK-24785 [0,1,0,0,0,0|3,0,0]=4 165 B10R1.13 ClC1=NC=C(C=N1)C(C)C AK-25128 [0,1,0,0,0,0|3,0,0]=4 166 B10R1.13 FC(C1=CC=C(Cl)C=C1)F AK-77798 [0,1,0,0,0,0|2,0,0]=3 167 B10R1.13 FC(C1=NC=C(Br)C=C1)F AK103226 [0,1,0,0,0,0|3,0,0]=4 168 B10R1.13 FC1=CC=C(N=C1)C(=O)O AK-28724 [0,1,0,0,0,0|2,0,1]=4 169 B10R1.13 IC1=CC=C(B(O)O)C=C1 AK-24763 [0,1,0,0,0,0|2,0,0]=3 170 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 AK-89169 [0,1,0,0,0,0|2,0,1]=4 171 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 AK107083 [0,1,0,0,0,0|2,0,1]=4 172 B10R1.13 N=C(N)C1=CC=C(F)C=C1 AK-35244 [0,1,0,0,0,0|2,0,1]=4 173 B10R1.13 N=C(N)C1=CC=C(N)C=C1 AK-34349 [0,1,0,0,0,0|2,0,1]=4 174 B10R1.13 N=C(N)C1=CC=C(O)C=C1 AK-16801 [0,1,0,0,0,0|2,0,1]=4 175 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 AK-76760 [0,1,0,0,0,0|1,0,2]=4 176 B10R1.13 NC1=CC=C(B(O)O)C=C1 AK-44817 [0,1,0,0,0,0|2,0,0]=3 177 B10R1.13 NC1=CC=C(C(C)C)N=C1 AK-30855 [0,1,0,0,0,0|2,0,0]=3 178 B10R1.13 NC1=CC=C(C(F)F)N=C1 AK143270 [0,1,0,0,0,0|3,0,0]=4 179 B10R1.13 NC1=CC=C(N=C1)C(F)F AK104590 [0,1,0,0,0,0|3,0,0]=4 180 B10R1.13 NC1=CC=C([N+]([O-])=O)C=C1 AK136006 [0,1,0,0,0,0|2,0,1]=4 181 B10R1.13 NC1=CN=C(C=C1)C(=O)O AK-25651 [0,1,0,0,0,0|2,0,1]=4 182 B10R1.13 NC1=NC=C(C=C1)B(O)O AK-36570 [0,1,0,0,0,0|3,0,0]=4 183 B10R1.13 N[C@@H](C1=CC=C(Br)C=C1)C AK-35249 [0,1,0,0,0,0|1,0,0]=2 184 B10R1.13 N[C@@H](C1=CC=C(C)C=C1)C AK-45033 [0,1,0,0,0,0|1,0,0]=2 185 B10R1.13 N[C@H](C1=CC=C(F)C=C1)C AK-98664 [0,1,0,0,0,0|1,0,0]=2 186 B10R1.13 O=C(C1=NC=C(Br)C=C1)O AK-25747 [0,1,0,0,0,0|2,0,1]=4 187 B10R1.13 O=C(N)C1=CC=C(Cl)C=C1 AK113058 [0,1,0,0,0,0|1,0,2]=4 188 B10R1.13 O=C(N)C1=CC=C(N)C=C1 AK151254 [0,1,0,0,0,0|1,0,2]=4 189 B10R1.13 O=C(N)C1=CC=C(O)C=C1 AK151255 [0,1,0,0,0,0|1,0,2]=4 190 B10R1.13 O=C(O)C1=CC=C(C)C=C1 AK106262 [0,1,0,0,0,0|1,0,1]=3 191 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 AK-44086 [0,1,0,0,0,0|1,0,1]=3 192 B10R1.13 O=C(O)C1=CC=C(I)C=C1 AK-73094 [0,1,0,0,0,0|1,0,1]=3 193 B10R1.13 O=C(O)C1=CC=C(N)C=C1 AK-41178 [0,1,0,0,0,0|1,0,1]=3 194 B10R1.13 O=C(O)C1=CC=C(O)C=C1 AK106263 [0,1,0,0,0,0|1,0,1]=3 195 B10R1.13 O=C(O)C1=CN=C(C)C=C1 AK-29149 [0,1,0,0,0,0|2,0,1]=4 196 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 AK-26081 [0,1,0,0,0,0|2,0,1]=4 197 B10R1.13 O=C(O)C1=CNC(C=C1)=O AK-26034 [0,1,0,0,0,0|2,0,1]=4 198 B10R1.13 O=C(O)C1=NC=C(O)C=C1 AK-24769 [0,1,0,0,0,0|2,0,1]=4 199 B10R1.13 O=C([O-])C1=CC=C(N)C=C1 AK116649 [0,1,0,0,0,0|1,0,2]=4 200 B10R1.13 O=C([O-])C1=CC=C(O)C=C1 AK306852 [0,1,0,0,0,0|1,0,2]=4 201 B10R1.13 O=C1C=CC(C(O)=O)=CO1 AK-46024 [0,1,0,0,0,0|2,0,1]=4 202 B10R1.13 O=S(C1=CC=C(C)C=C1)O AK143296 [0,1,0,0,0,0|2,0,0]=3 203 B10R1.13 O=S(C1=CC=C(C)C=C1)[O-] AK106973 [0,1,0,0,0,0|2,0,1]=4 204 B10R1.13 O=S(C1=CC=C(F)C=C1)[O-] AK114760 [0,1,0,0,0,0|2,0,1]=4 205 B10R1.13 O=[S@@](C1=CC=C(C)C=C1)N AK-81446 [0,1,0,0,0,0|2,0,1]=4 206 B10R1.13 OB(C1=CC=C(O)N=C1)O AK-40749 [0,1,0,0,0,0|3,0,0]=4 207 B10R1.13 OB(C1=CC=C(S)C=C1)O AK-41540 [0,1,0,0,0,0|2,0,0]=3 208 B10R1.13 OB(C1=CN=C(Br)C=C1)O AK-27206 [0,1,0,0,0,0|3,0,0]=4 209 B10R1.13 OC(=O)C1=CC=C(Br)N=C1 AK-26208 [0,1,0,0,0,0|2,0,1]=4 210 B10R1.13 OC(=O)C1=NC=C(I)C=C1 AK-29144 [0,1,0,0,0,0|2,0,1]=4 211 B10R1.13 OC1=CC=C(C(=S)N)C=C1 AK-21819 [0,1,0,0,0,0|1,1,1]=4 212 B10R1.13 OC1=CC=C(C(C)=C)C=C1 AK117164 [0,1,0,0,0,0|1,0,1]=3 213 B10R1.13 OC1=CC=C(C(O)C)C=C1 AK-45202 [0,1,0,0,0,0|0,0,0]=1 214 B10R1.13 OC1=CC=C(C=C1)C(F)F AK-76781 [0,1,0,0,0,0|2,0,0]=3 215 B10R1.13 OC1=CC=C(N(C)C)C=C1 AK103764 [0,1,0,0,0,0|2,0,0]=3 216 B10R1.13 OC1=CC=C([C@H](N)C)C=C1 AK608003 [0,1,0,0,0,0|1,0,0]=2 217 B10R1.15 C1=C(C(OC)=O)C=CN=C1 AK-46755 [0,1,0,0,0,0|1,0,2]=4 218 B10R1.15 C1=C(C(OC)=O)N=CC=C1 AK-46574 [0,1,0,0,0,0|1,0,2]=4 219 B10R1.15 C1=CC=NC=C1C(OC)=O AK-47410 [0,1,0,0,0,0|1,0,2]=4 220 B10R1.15 CC(C1=CC=CC=C1)CN AK-67959 [0,1,0,0,0,0|1,0,0]=2 221 B10R1.15 CC[C@@H](C1=NC=CC=C1)N AK544238 [0,1,0,0,0,0|2,0,0]=3 222 B10R1.15 CC[C@H](C1=NC=CC=C1)N AK668420 [0,1,0,0,0,0|2,0,0]=3 223 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 AK-47624 [0,1,0,0,0,0|1,0,0]=2 224 B10R1.15 C[C@@H](NC)C1=CC=CC=C1 AK140531 [0,1,0,0,0,0|1,0,0]=2 225 B10R1.15 ClC(C=C)C1=CC=CC=C1 AK173991 [0,1,0,0,0,0|1,0,1]=3 226 B10R1.15 FC(C1=CC=CC=C1)CBr AK-93540 [0,1,0,0,0,0|1,0,0]=2 227 B10R1.15 NCC(C1=CC=CC=C1)=O AK-26107 [0,1,0,0,0,0|0,0,2]=3 228 B10R1.15 NCC(O)C1=NC=CC=C1 AK157200 [0,1,0,0,0,0|1,0,0]=2 229 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 AK-45230 [0,1,0,0,0,0|0,0,0]=1 230 B10R1.15 NC[C@@H](O)C1=CC=CN=C1 AK-96401 [0,1,0,0,0,0|1,0,0]=2 231 B10R1.15 N[C@H](C1=CC=CC=C1)CO AK-41249 [0,1,0,0,0,0|1,0,0]=2 232 B10R1.15 O=C(C1=NC=CC=C1)CBr AK-44981 [0,1,0,0,0,0|1,0,2]=4 233 B10R1.15 O=C(NC)C1=CC=CC=C1 AK323662 [0,1,0,0,0,0|0,0,2]=3 234 B10R1.15 O=CN(C)C1=CC=CC=C1 AK-48601 [0,1,0,0,0,0|1,0,1]=3 235 B10R1.15 O=S(C1=CC=CC=C1)OC AK109245 [0,1,0,0,0,0|1,0,1]=3 236 B10R1.15 OC(C1=CC=CC=C1)CBr AK-76552 [0,1,0,0,0,0|0,0,0]=1 237 B10R1.15 OC(C1=CC=CC=C1)CO AK117070 [0,1,0,0,0,0|0,0,0]=1 238 B10R1.15 OCC(=O)C1=CC=CC=C1 AK-94786 [0,1,0,0,0,0|0,0,2]=3 239 B10R1.15 OCC(N)C1=CC=CC=C1 AK-47370 [0,1,0,0,0,0|1,0,0]=2 240 B10R1.15 O[C@@H](C1=CC=CC=C1)CO AK-45210 [0,1,0,0,0,0|0,0,0]=1 241 B10R1.15 O[C@H](C1=CC=CC=C1)CO AK-33573 [0,1,0,0,0,0|0,0,0]=1 242 B10R1.15 [C@H](N)(C1=CC=CC=C1)CO AK-41260 [0,1,0,0,0,0|1,0,0]=2 243 B10R1.28 C1=C([S](O)(=O)=O)C=CC=C1 AK-51336 [0,1,0,0,0,0|2,0,0]=3 244 B10R1.28 CC(C)(C)C1=CC=NC=C1 AK-88357 [0,1,0,0,0,0|2,0,0]=3 245 B10R1.28 CC(C)(O)C1=NC=CC=C1 AK111321 [0,1,0,0,0,0|1,0,0]=2 246 B10R1.28 CC(N)(C1=CC=CC=C1)C AK116559 [0,1,0,0,0,0|1,0,0]=2 247 B10R1.28 CC(N)(C1=CC=CN=C1)C AK-86166 [0,1,0,0,0,0|2,0,0]=3 248 B10R1.28 CC(N)(C1=NC=CC=C1)C AK-64527 [0,1,0,0,0,0|2,0,0]=3 249 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 AK-59630 [0,1,0,0,0,0|2,0,0]=3 250 B10R1.28 C[Si](C)(C)C1=CC=CC=N1 AK-47822 [0,1,0,0,0,0|2,1,0]=4 251 B10R1.28 ClC(C1=CC=CN=C1)(Cl)Cl AK198586 [0,1,0,0,0,0|3,0,0]=4 252 B10R1.28 FC(F)(F)C1=CC=CC=N1 AK-27001 [0,1,0,0,0,0|3,0,0]=4 253 B10R1.28 F[B-](F)(F)C1=CC=CC=C1 AK105337 [0,1,0,0,0,0|3,0,0]=4 254 B10R1.28 O=S(C1=CC=CC=C1)(N)=O AK-77414 [0,1,0,0,0,0|2,0,1]=4 255 B10R1.28 O=S(C1=CC=CN=C1)(O)=O AK-47361 [0,1,0,0,0,0|3,0,0]=4 256 B10R1.61 BrC1=C(C=CN=C1)C(=O)O AK-23517 [0,1,0,0,0,0|2,0,1]=4 257 B10R1.61 BrC1=CC=CN=C1C(=O)O AK-25745 [0,1,0,0,0,0|2,0,1]=4 258 B10R1.61 C1=C(C(=CC=C1)B(O)O)O AK-45876 [0,1,0,0,0,0|2,0,0]=3 259 B10R1.61 C1=C(C(=NC=C1)Cl)C(O)=O AK-27015 [0,1,0,0,0,0|2,0,1]=4 260 B10R1.61 C1=C(C(=NC=C1)F)C(O)=O AK-25163 [0,1,0,0,0,0|2,0,1]=4 261 B10R1.61 C1=CC(=C(C=C1)N(C)C)N AK-65098 [0,1,0,0,0,0|2,0,0]=3 262 B10R1.61 C1=CC=CC(=C1B(O)O)Br AK-34317 [0,1,0,0,0,0|2,0,0]=3 263 B10R1.61 C1=CC=CC(=C1B(O)O)C AK-33581 [0,1,0,0,0,0|2,0,0]=3 264 B10R1.61 C1=CC=CC(=C1C(C)=O)Br AK-48030 [0,1,0,0,0,0|0,0,2]=3 265 B10R1.61 C1=CC=CC(=C1C(C)=O)N AK-27106 [0,1,0,0,0,0|0,0,2]=3 266 B10R1.61 C1=CC=CC(=C1C(O)=O)F AK-40433 [0,1,0,0,0,0|1,0,1]=3 267 B10R1.61 C1=CC=CC(=C1O)C(=O)C AK-44482 [0,1,0,0,0,0|0,0,2]=3 268 B10R1.61 C1=CC=NC(=C1C)C(O)=O AK-26613 [0,1,0,0,0,0|2,0,1]=4 269 B10R1.61 C1=CN=CC(=C1C(=O)O)F AK-25903 [0,1,0,0,0,0|2,0,1]=4 270 B10R1.61 C1=NC=CC(=C1C(O)=O)C AK-34679 [0,1,0,0,0,0|2,0,1]=4 271 B10R1.61 CC(=O)C1=C(I)C=CC=C1 AK-84650 [0,1,0,0,0,0|0,0,2]=3 272 B10R1.61 CC(=O)C1=CC=CN=C1F AK-36408 [0,1,0,0,0,0|1,0,2]=4 273 B10R1.61 CC(=O)C1=CC=CN=C1N AK-61895 [0,1,0,0,0,0|1,0,2]=4 274 B10R1.61 CC(=O)C1=NC=CC=C1F AK-36671 [0,1,0,0,0,0|1,0,2]=4 275 B10R1.61 CC(C)C1=C(Cl)N=CN=C1 AK110098 [0,1,0,0,0,0|3,0,0]=4 276 B10R1.61 CC(C1=C(O)C=NC=C1)=O AK-68365 [0,1,0,0,0,0|1,0,2]=4 277 B10R1.61 CC(C1=CC=CC=C1Br)C AK-80369 [0,1,0,0,0,0|1,0,0]=2 278 B10R1.61 CC(C1=CC=CC=C1C)=O AK-76969 [0,1,0,0,0,0|0,0,2]=3 279 B10R1.61 CC(C1=CC=CC=C1F)=O AK-44672 [0,1,0,0,0,0|0,0,2]=3 280 B10R1.61 CC(C1=CC=CC=C1I)C AK113600 [0,1,0,0,0,0|1,0,0]=2 281 B10R1.61 CC(C1=CC=CN=C1C)=O AK-60286 [0,1,0,0,0,0|1,0,2]=4 282 B10R1.61 CC(C1=NC=CC=C1Br)=O AK-91392 [0,1,0,0,0,0|1,0,2]=4 283 B10R1.61 CC(C1=NC=CC=C1Cl)=O AK128527 [0,1,0,0,0,0|1,0,2]=4 284 B10R1.61 CC(C1=NC=CC=C1O)=O AK-57786 [0,1,0,0,0,0|1,0,2]=4 285 B10R1.61 CC(N)C1=CC=CC=C1Br AK548207 [0,1,0,0,0,0|1,0,0]=2 286 B10R1.61 CC(N)C1=CC=CC=C1Cl AK-78769 [0,1,0,0,0,0|1,0,0]=2 287 B10R1.61 CC(N)C1=CC=CC=C1Cl AK133214 [0,1,0,0,0,0|1,0,0]=2 288 B10R1.61 CC(N)C1=CC=CC=C1F AK-78757 [0,1,0,0,0,0|1,0,0]=2 289 B10R1.61 CC(N)C1=NC=CC=C1C AK670791 [0,1,0,0,0,0|2,0,0]=3 290 B10R1.61 CC(O)C1=C(F)C=NC=C1 AK174609 [0,1,0,0,0,0|1,0,0]=2 291 B10R1.61 CC(O)C1=CC=CN=C1Cl AK118779 [0,1,0,0,0,0|1,0,0]=2 292 B10R1.61 CC1=C(C(=O)O)C=CC=N1 AK-25768 [0,1,0,0,0,0|2,0,1]=4 293 B10R1.61 CC1=C(C=CN=C1)B(O)O AK-36777 [0,1,0,0,0,0|3,0,0]=4 294 B10R1.61 CC1=NC=CC=C1B(O)O AK142095 [0,1,0,0,0,0|3,0,0]=4 295 B10R1.61 CN(C)C1=C(Br)C=NC=C1 AK113556 [0,1,0,0,0,0|3,0,0]=4 296 B10R1.61 CN(C)C1=C(O)C=CC=C1 AK-49738 [0,1,0,0,0,0|2,0,0]=3 297 B10R1.61 CN(C)C1=CC=CC=C1Br AK-86039 [0,1,0,0,0,0|2,0,0]=3 298 B10R1.61 C[C@@H](N)C1=CC=CC=C1Br AK114068 [0,1,0,0,0,0|1,0,0]=2 299 B10R1.61 C[C@@H](N)C1=CC=CC=C1Br AK155333 [0,1,0,0,0,0|1,0,0]=2 300 B10R1.61 C[C@@H](N)C1=CC=CC=C1C AK-45079 [0,1,0,0,0,0|1,0,0]=2 301 B10R1.61 C[C@@H](N)C1=CC=CC=C1Cl AK-42131 [0,1,0,0,0,0|1,0,0]=2 302 B10R1.61 C[C@@H](N)C1=CC=CC=C1F AK-33841 [0,1,0,0,0,0|1,0,0]=2 303 B10R1.61 C[C@@H](O)C1=CC=CC=C1Cl AK-49059 [0,1,0,0,0,0|0,0,0]=1 304 B10R1.61 C[C@H](N)C1=CC=CC=C1Br AK-59163 [0,1,0,0,0,0|1,0,0]=2 305 B10R1.61 C[C@H](N)C1=CC=CC=C1Br AK174547 [0,1,0,0,0,0|1,0,0]=2 306 B10R1.61 C[C@H](N)C1=CC=CC=C1C AK162902 [0,1,0,0,0,0|1,0,0]=2 307 B10R1.61 C[C@H](N)C1=CC=CC=C1F AK-36100 [0,1,0,0,0,0|1,0,0]=2 308 B10R1.61 C[C@H](N)C1=CC=CC=C1F AK162903 [0,1,0,0,0,0|1,0,0]=2 309 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl AK-57726 [0,1,0,0,0,0|0,0,0]=1 310 B10R1.61 C[C@H](O)C1=CC=CC=C1F AK114295 [0,1,0,0,0,0|0,0,0]=1 311 B10R1.61 ClC1=C(B(O)O)C=CN=C1 AK-93757 [0,1,0,0,0,0|3,0,0]=4 312 B10R1.61 ClC1=C(C(=O)O)C=CN=C1 AK-26411 [0,1,0,0,0,0|2,0,1]=4 313 B10R1.61 ClC1=C(C=CC=C1)B(O)O AK-34973 [0,1,0,0,0,0|2,0,0]=3 314 B10R1.61 ClC1=CC=CN=C1C(=O)O AK-23699 [0,1,0,0,0,0|2,0,1]=4 315 B10R1.61 ClC1=CC=NC=C1C(=O)O AK-25252 [0,1,0,0,0,0|2,0,1]=4 316 B10R1.61 ClC1=NC=CC=C1B(O)O AK-29980 [0,1,0,0,0,0|3,0,0]=4 317 B10R1.61 FC1=C(C(=N)N)C=CC=C1 AK-16801-8 [0,1,0,0,0,0|2,0,1]=4 318 B10R1.61 FC1=C(C=CN=C1)C(C)=O AK-37142 [0,1,0,0,0,0|1,0,2]=4 319 B10R1.61 FC1=C(N=CC=C1)C(=O)O AK-28801 [0,1,0,0,0,0|2,0,1]=4 320 B10R1.61 FC1=CC=CC=C1B(O)O AK-45733 [0,1,0,0,0,0|2,0,0]=3 321 B10R1.61 NC(C1=CC=CC=C1Br)C AK-50562 [0,1,0,0,0,0|1,0,0]=2 322 B10R1.61 NC1=C(C(C)C)C=NC=C1 AK349169 [0,1,0,0,0,0|2,0,0]=3 323 B10R1.61 NC1=C(C=NC=C1)C(O)=O AK-27731 [0,1,0,0,0,0|2,0,1]=4 324 B10R1.61 NC1=CC=CC=C1B(O)O AK-77788 [0,1,0,0,0,0|2,0,0]=3 325 B10R1.61 N[C@@H](C1=CC=CC=C1F)C AK-42098 [0,1,0,0,0,0|1,0,0]=2 326 B10R1.61 O=C(C1=NC=CC=C1N)O AK-25432 [0,1,0,0,0,0|2,0,1]=4 327 B10R1.61 O=C(N)C1=CC=CC=C1Br AK-47071 [0,1,0,0,0,0|1,0,2]=4 328 B10R1.61 O=C(N)C1=CC=CC=C1Cl AK128986 [0,1,0,0,0,0|1,0,2]=4 329 B10R1.61 O=C(N)C1=CC=CC=C1F AK161780 [0,1,0,0,0,0|1,0,2]=4 330 B10R1.61 O=C(N)C1=CC=CC=C1I AK115884 [0,1,0,0,0,0|1,0,2]=4 331 B10R1.61 O=C(N)C1=CC=CC=C1N AK109256 [0,1,0,0,0,0|1,0,2]=4 332 B10R1.61 O=C(O)C1=C(N)N=CC=C1 AK-26982 [0,1,0,0,0,0|2,0,1]=4 333 B10R1.61 O=C(O)C1=C(S)N=CC=C1 AK-48961 [0,1,0,0,0,0|2,0,1]=4 334 B10R1.61 O=C(O)C1=CC=CC=C1Br AK-77301 [0,1,0,0,0,0|1,0,1]=3 335 B10R1.61 O=C(O)C1=CC=CC=C1C AK116916 [0,1,0,0,0,0|1,0,1]=3 336 B10R1.61 O=C(O)C1=CC=CC=C1Cl AK-44481 [0,1,0,0,0,0|1,0,1]=3 337 B10R1.61 O=C(O)C1=CC=CC=C1I AK-73132 [0,1,0,0,0,0|1,0,1]=3 338 B10R1.61 O=C(O)C1=CC=NC=C1C AK-30383 [0,1,0,0,0,0|2,0,1]=4 339 B10R1.61 O=C(O)C1=CC=NC=C1N AK-23678 [0,1,0,0,0,0|2,0,1]=4 340 B10R1.61 O=C(O)C1=CC=NC=C1O AK-23523 [0,1,0,0,0,0|2,0,1]=4 341 B10R1.61 O=C(O)C1=CN=CC=C1Br AK-25100 [0,1,0,0,0,0|2,0,1]=4 342 B10R1.61 O=C(O)C1=CN=CC=C1C AK-75600 [0,1,0,0,0,0|2,0,1]=4 343 B10R1.61 O=C(O)C1=NC=CC=C1I AK-29488 [0,1,0,0,0,0|2,0,1]=4 344 B10R1.61 O=C(O)C1=NC=CC=C1O AK-26380 [0,1,0,0,0,0|2,0,1]=4 345 B10R1.61 O=C1C(=CC=CN1)C(O)=O AK-47329 [0,1,0,0,0,0|2,0,1]=4 346 B10R1.61 O=C1C(=CNC=C1)C(=O)O AK-26174 [0,1,0,0,0,0|2,0,1]=4 347 B10R1.61 O=C1C(C(C)=O)=CC=CN1 AK-35911 [0,1,0,0,0,0|1,0,2]=4 348 B10R1.61 O=C1C(C(C)=O)=CNC=C1 AK501394 [0,1,0,0,0,0|1,0,2]=4 349 B10R1.61 OB(C1=C(F)C=NC=C1)O AK-26936 [0,1,0,0,0,0|3,0,0]=4 350 B10R1.61 OB(C1=CC=CC=C1N)O AK-35638 [0,1,0,0,0,0|2,0,0]=3 351 B10R1.61 OB(C1=CC=CN=C1Br)O AK-27205 [0,1,0,0,0,0|3,0,0]=4 352 B10R1.61 OB(C1=CC=CN=C1F)O AK-27647 [0,1,0,0,0,0|3,0,0]=4 353 B10R1.61 OB(C1=NC=CC=C1C)O AK-36898 [0,1,0,0,0,0|3,0,0]=4 354 B10R1.61 OC(=O)C1=CC=CN=C1Br AK-25846 [0,1,0,0,0,0|2,0,1]=4 355 B10R1.61 OC1=CC=CC=C1C(N)=O AK-81394 [0,1,0,0,0,0|1,0,2]=4 356 B10R1.61 OC1=CC=CC=C1C(O)=O AK397674 [0,1,0,0,0,0|1,0,1]=3 357 B10R1.61 [O-]C1=CC=CC=C1[N+]([O-])=O AK135512 [0,1,0,0,0,0|2,0,1]=4 358 B10R1.113 BrC1=CC(=CC=C1)C(F)F AK-50673 [0,1,0,0,0,0|2,0,0]=3 359 B10R1.113 BrC1=CC(=CN=C1)C(=C)C AK-40102 [0,1,0,0,0,0|2,0,1]=4 360 B10R1.113 BrC1=CC(=NC=C1)N(C)C AK-49151 [0,1,0,0,0,0|3,0,0]=4 361 B10R1.113 BrC1=NC=CC(=C1)N(C)C AK-49139 [0,1,0,0,0,0|3,0,0]=4 362 B10R1.113 C(C)(=O)C1=CC(=CN=C1)Br AK-25899 [0,1,0,0,0,0|1,0,2]=4 363 B10R1.113 C(C)(=O)C1=CC(=NC=C1)C AK-26955 [0,1,0,0,0,0|1,0,2]=4 364 B10R1.113 C(C)(=O)C1=NC(=CC=C1)Br AK-30565 [0,1,0,0,0,0|1,0,2]=4 365 B10R1.113 C1=C(C(C)=O)C=C(C=C1)O AK-46681 [0,1,0,0,0,0|0,0,2]=3 366 B10R1.113 C1=C(C=C(C=N1)B(O)O)C AK-27227 [0,1,0,0,0,0|3,0,0]=4 367 B10R1.113 C1=C(C=C(N=C1)N)C(=O)O AK-25375 [0,1,0,0,0,0|2,0,1]=4 368 B10R1.113 C1=C(C=CC=C1Br)B(O)O AK-23693 [0,1,0,0,0,0|2,0,0]=3 369 B10R1.113 C1=C(C=CC=C1Cl)C(O)=O AK-43975 [0,1,0,0,0,0|1,0,1]=3 370 B10R1.113 C1=C(C=CC=C1F)C(O)=O AK-53854 [0,1,0,0,0,0|1,0,1]=3 371 B10R1.113 C1=C(C=NC=C1C(O)=O)F AK-25931 [0,1,0,0,0,0|2,0,1]=4 372 B10R1.113 C1=C(C=NC=C1C)C(O)=O AK-23837 [0,1,0,0,0,0|2,0,1]=4 373 B10R1.113 C1=C(C=NC=C1Cl)C(O)=O AK-25160 [0,1,0,0,0,0|2,0,1]=4 374 B10R1.113 C1=C(Cl)N=CC=C1B(O)O AK-26000 [0,1,0,0,0,0|3,0,0]=4 375 B10R1.113 C1=CC=C(F)N=C1C(=O)O AK-30385 [0,1,0,0,0,0|2,0,1]=4 376 B10R1.113 C1=CC=C(N=C1C(O)=O)C AK-27736 [0,1,0,0,0,0|2,0,1]=4 377 B10R1.113 C1=CN=C(C=C1B(O)O)F AK-30379 [0,1,0,0,0,0|3,0,0]=4 378 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 AK-34279 [0,1,0,0,0,0|1,0,2]=4 379 B10R1.113 CC(C1=CC(Br)=CC=C1)C AK-61854 [0,1,0,0,0,0|1,0,0]=2 380 B10R1.113 CC(C1=CC(F)=CN=C1)=O AK101043 [0,1,0,0,0,0|1,0,2]=4 381 B10R1.113 CC(C1=CC(N)=NC=C1)=O AK134215 [0,1,0,0,0,0|1,0,2]=4 382 B10R1.113 CC(C1=CC=CC(Br)=C1)=O AK-44590 [0,1,0,0,0,0|0,0,2]=3 383 B10R1.113 CC(C1=CC=CC(C)=C1)=O AK143347 [0,1,0,0,0,0|0,0,2]=3 384 B10R1.113 CC(C1=NC(Cl)=CC=C1)=O AK-29671 [0,1,0,0,0,0|1,0,2]=4 385 B10R1.113 CC(C1=NC(F)=CC=C1)=O AK-74181 [0,1,0,0,0,0|1,0,2]=4 386 B10R1.113 CC(C1=NC=CC(C)=C1)=O AK-61872 [0,1,0,0,0,0|1,0,2]=4 387 B10R1.113 CC(C1=NC=CC(Cl)=C1)=O AK-30041 [0,1,0,0,0,0|1,0,2]=4 388 B10R1.113 CC(N)C1=CC=CC(C)=C1 AK-95787 [0,1,0,0,0,0|1,0,0]=2 389 B10R1.113 CC(O)C1=CC(N)=NC=C1 AK109512 [0,1,0,0,0,0|1,0,0]=2 390 B10R1.113 CC(O)C1=NC(Br)=CC=C1 AK-58995 [0,1,0,0,0,0|1,0,0]=2 391 B10R1.113 CC1=CC(B(O)O)=CC=C1 AK-41078 [0,1,0,0,0,0|2,0,0]=3 392 B10R1.113 CC1=CC=CC(=C1)C(N)=N AK-45199 [0,1,0,0,0,0|2,0,1]=4 393 B10R1.113 CC1=CC=CC(B(O)O)=N1 AK-25864 [0,1,0,0,0,0|3,0,0]=4 394 B10R1.113 CC1=CC=CC(C(C)=O)=N1 AK-30134 [0,1,0,0,0,0|1,0,2]=4 395 B10R1.113 CC1=CC=NC(=C1)C(=O)O AK-30381 [0,1,0,0,0,0|2,0,1]=4 396 B10R1.113 CC1=NC=CC(B(O)O)=C1 AK-35728 [0,1,0,0,0,0|3,0,0]=4 397 B10R1.113 CN(C)C1=CC(F)=NC=C1 AK141581 [0,1,0,0,0,0|3,0,0]=4 398 B10R1.113 CN(C)C1=CC=CC(Br)=C1 AK-63444 [0,1,0,0,0,0|2,0,0]=3 399 B10R1.113 C[C@@H](C1=CC=CC(N)=C1)N AK326677 [0,1,0,0,0,0|1,0,0]=2 400 B10R1.113 C[C@@H](N)C1=CC(Br)=NC=C1 AK608012 [0,1,0,0,0,0|2,0,0]=3 401 B10R1.113 C[C@@H](N)C1=CC(Cl)=CN=C1 AK668419 [0,1,0,0,0,0|2,0,0]=3 402 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=C1 AK-33750 [0,1,0,0,0,0|1,0,0]=2 403 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=C1 AK338979 [0,1,0,0,0,0|1,0,0]=2 404 B10R1.113 C[C@@H](N)C1=CC=CC(C)=C1 AK-45077 [0,1,0,0,0,0|1,0,0]=2 405 B10R1.113 C[C@@H](N)C1=CC=CC(C)=C1 AK133442 [0,1,0,0,0,0|1,0,0]=2 406 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 AK-29516 [0,1,0,0,0,0|1,0,0]=2 407 B10R1.113 C[C@@H](N)C1=NC(F)=CC=C1 AK668445 [0,1,0,0,0,0|2,0,0]=3 408 B10R1.113 C[C@@H](O)C1=CC=CC(Cl)=C1 AK103057 [0,1,0,0,0,0|0,0,0]=1 409 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 AK335908 [0,1,0,0,0,0|2,0,0]=3 410 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 AK-33217 [0,1,0,0,0,0|1,0,0]=2 411 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 AK338984 [0,1,0,0,0,0|1,0,0]=2 412 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 AK-35182 [0,1,0,0,0,0|1,0,0]=2 413 B10R1.113 C[C@H](O)C1=CC=CC(Br)=C1 AK-58281 [0,1,0,0,0,0|0,0,0]=1 414 B10R1.113 ClC1=CC(B(O)O)=NC=C1 AK-81399 [0,1,0,0,0,0|3,0,0]=4 415 B10R1.113 ClC1=CC=CC(=C1)B(O)O AK-47360 [0,1,0,0,0,0|2,0,0]=3 416 B10R1.113 FC(C1=CC(Cl)=NC=C1)F AK162317 [0,1,0,0,0,0|3,0,0]=4 417 B10R1.113 FC(C1=NC=CC(Br)=C1)F AK123527 [0,1,0,0,0,0|3,0,0]=4 418 B10R1.113 FC1=CC(B(O)O)=CC=C1 AK-45904 [0,1,0,0,0,0|2,0,0]=3 419 B10R1.113 IC1=CC=CC(=C1)B(O)O AK-45910 [0,1,0,0,0,0|2,0,0]=3 420 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 AK-16801-7 [0,1,0,0,0,0|2,0,1]=4 421 B10R1.113 NC1=CC(C(C)=O)=CC=C1 AK-83273 [0,1,0,0,0,0|0,0,2]=3 422 B10R1.113 NC1=CC(C(F)F)=NC=C1 AK549120 [0,1,0,0,0,0|3,0,0]=4 423 B10R1.113 NC1=CC(N(C)C)=CC=C1 AK162007 [0,1,0,0,0,0|2,0,0]=3 424 B10R1.113 NC1=CC=NC(=C1)C(=O)O AK-72771 [0,1,0,0,0,0|2,0,1]=4 425 B10R1.113 NC1=CN=CC(=C1)B(O)O AK-75513 [0,1,0,0,0,0|3,0,0]=4 426 B10R1.113 NC1=CN=CC(=C1)C(O)=O AK-34306 [0,1,0,0,0,0|2,0,1]=4 427 B10R1.113 NC1=CN=CC(B(O)O)=C1 AK-32936 [0,1,0,0,0,0|3,0,0]=4 428 B10R1.113 NC1=NC(C(C)C)=CC=C1 AK-29534 [0,1,0,0,0,0|2,0,0]=3 429 B10R1.113 NC1=NC=CC(C(F)F)=C1 AK161272 [0,1,0,0,0,0|3,0,0]=4 430 B10R1.113 N[C@@H](C1=CC=CC(F)=C1)C AK-45028 [0,1,0,0,0,0|1,0,0]=2 431 B10R1.113 N[C@H](C1=CC=CC(F)=C1)C AK-42995 [0,1,0,0,0,0|1,0,0]=2 432 B10R1.113 O=C(C1=CC=CC(Cl)=N1)O AK-26005 [0,1,0,0,0,0|2,0,1]=4 433 B10R1.113 O=C(C1=CC=CC(N1)=O)O AK-25557 [0,1,0,0,0,0|2,0,1]=4 434 B10R1.113 O=C(C1=NC=CC(Br)=C1)O AK-23753 [0,1,0,0,0,0|2,0,1]=4 435 B10R1.113 O=C(C=1C=CNC(C1)=O)O AK-75663 [0,1,0,0,0,0|2,0,1]=4 436 B10R1.113 O=C(C=1C=CNC(C1)=S)O AK161760 [0,1,0,0,0,0|2,0,1]=4 437 B10R1.113 O=C(N)C1=CC=CC(Br)=C1 AK-61366 [0,1,0,0,0,0|1,0,2]=4 438 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 AK-77039 [0,1,0,0,0,0|1,0,1]=3 439 B10R1.113 O=C(O)C1=CC=CC(C)=C1 AK116994 [0,1,0,0,0,0|1,0,1]=3 440 B10R1.113 O=C(O)C1=CC=CC(I)=C1 AK-40488 [0,1,0,0,0,0|1,0,1]=3 441 B10R1.113 O=C(O)C1=CC=CC(N)=C1 AK-41177 [0,1,0,0,0,0|1,0,1]=3 442 B10R1.113 O=C(O)C1=CC=CC(O)=C1 AK-50288 [0,1,0,0,0,0|1,0,1]=3 443 B10R1.113 O=C(O)C1=CC=NC(Br)=C1 AK-26241 [0,1,0,0,0,0|2,0,1]=4 444 B10R1.113 O=C(O)C1=CC=NC(C)=C1 AK-23516 [0,1,0,0,0,0|2,0,1]=4 445 B10R1.113 O=C(O)C1=CC=NC(O)=C1 AK-27187 [0,1,0,0,0,0|2,0,1]=4 446 B10R1.113 O=C(O)C1=CN=CC(Br)=C1 AK-25583 [0,1,0,0,0,0|2,0,1]=4 447 B10R1.113 O=C(O)C1=CN=CC(I)=C1 AK-28811 [0,1,0,0,0,0|2,0,1]=4 448 B10R1.113 O=C(O)C1=CN=CC(O)=C1 AK-25698 [0,1,0,0,0,0|2,0,1]=4 449 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 AK-23768 [0,1,0,0,0,0|2,0,1]=4 450 B10R1.113 O=C(O)C1=NC=CC(I)=C1 AK-30405 [0,1,0,0,0,0|2,0,1]=4 451 B10R1.113 OB(C1=CC(F)=CN=C1)O AK-36635 [0,1,0,0,0,0|3,0,0]=4 452 B10R1.113 OB(C1=CC=CC(N)=C1)O AK-27034 [0,1,0,0,0,0|2,0,0]=3 453 B10R1.113 OB(C1=CC=CC(N)=C1)O AK-43360 [0,1,0,0,0,0|2,0,0]=3 454 B10R1.113 OB(C1=CC=CC(N)=C1)O AK-44816 [0,1,0,0,0,0|2,0,0]=3 455 B10R1.113 OB(C1=CC=CC(O)=C1)O AK-44803 [0,1,0,0,0,0|2,0,0]=3 456 B10R1.113 OB(O)C1=CC(Br)=NC=C1 AK-45672 [0,1,0,0,0,0|3,0,0]=4 457 B10R1.113 OB(O)C1=CC(Cl)=CN=C1 AK-26378 [0,1,0,0,0,0|3,0,0]=4 458 B10R1.113 OC(=O)C1=CC(Cl)=NC=C1 AK-26209 [0,1,0,0,0,0|2,0,1]=4 459 B10R1.113 OC(=O)C1=CC(F)=NC=C1 AK-25930 [0,1,0,0,0,0|2,0,1]=4 460 B10R1.113 OC(=O)C1=NC(Br)=CC=C1 AK-25597 [0,1,0,0,0,0|2,0,1]=4 461 B10R1.113 OC1=CC=CC(N(C)C)=C1 AK-51741 [0,1,0,0,0,0|2,0,0]=3 462 B10R1.113 OC1=CC=CC([C@H](N)C)=C1 AK-77840 [0,1,0,0,0,0|1,0,0]=2 463 B10R2.320 BrC1C2=CC=CC=C2C1 AK163275 [0,0,0,1,0,0|1,0,0]=2 464 B10R2.320 C1=CC=CC2=C1CC2=O AK-72898 [0,0,0,1,0,0|0,0,2]=3 465 B8R1.7 C1=C(B(O)O)OC=C1 AK-47548 [0,0,0,0,1,0|3,0,0]=4 466 B8R1.7 C1=COC=C1C(O)=O AK-32276 [0,0,0,0,1,0|2,0,1]=4 467 B8R1.7 CC(=O)C1=CC=CN1 AK-53458 [0,0,0,0,1,0|1,0,2]=4 468 B8R1.7 CC(=O)C1=CSC=C1 AK-44537 [0,0,0,0,1,0|1,0,2]=4 469 B8R1.7 CC(C1=CC=CO1)C AK120816 [0,0,0,0,1,0|2,0,0]=3 470 B8R1.7 CC(C1=NC=CN1)C AK106223 [0,0,0,0,1,0|3,0,0]=4 471 B8R1.7 CC(N)C1=NC=CS1 AK-77903 [0,0,0,0,1,0|3,0,0]=4 472 B8R1.7 CC(N)C1=NC=CS1 AK-77904 [0,0,0,0,1,0|3,0,0]=4 473 B8R1.7 CC(N1C=CN=C1)C AK-79287 [0,0,0,0,1,0|3,0,0]=4 474 B8R1.7 CC(N1N=CC=C1)C AK-61646 [0,0,0,0,1,0|3,0,0]=4 475 B8R1.7 C[C@@H](N)C1=NC=CS1 AK153996 [0,0,0,0,1,0|3,0,0]=4 476 B8R1.7 C[C@H](N)C1=CC=CO1 AK544263 [0,0,0,0,1,0|2,0,0]=3 477 B8R1.7 C[C@H](N)C1=CC=CS1 AK486945 [0,0,0,0,1,0|2,0,0]=3 478 B8R1.7 C[C@H](N)C1=NC=CS1 AK153993 [0,0,0,0,1,0|3,0,0]=4 479 B8R1.7 O=C(C1=CC=CN1)O AK-44225 [0,0,0,0,1,0|2,0,1]=4 480 B8R1.7 O=C(C1=CC=CO1)O AK-72863 [0,0,0,0,1,0|2,0,1]=4 481 B8R1.7 O=C(C1=CNC=C1)C AK-45953 [0,0,0,0,1,0|1,0,2]=4 482 B8R1.7 O=C(C1=CSC=C1)O AK-46373 [0,0,0,0,1,0|2,0,1]=4 483 B8R1.7 OB(C1=CC=CS1)O AK-46314 [0,0,0,0,1,0|3,0,0]=4 484 B8R1.7 OB(C1=COC=C1)O AK-44100 [0,0,0,0,1,0|3,0,0]=4 485 B8R1.7 OB(C1=CSC=C1)O AK-26187 [0,0,0,0,1,0|3,0,0]=4 486 B8R1.7 OC(=O)C1=CNC=C1 AK-26450 [0,0,0,0,1,0|2,0,1]=4 487 B10R1.18 C1=C(C=CN=C1)CC(C)=O AK-47657 [0,0,0,0,0,1|1,0,2]=4 488 B10R1.18 C1=C(C=CN=C1)CC(O)=O AK-45111 [0,0,0,0,0,1|2,0,1]=4 489 B10R1.18 C1=NC=CC=C1CC(O)=O AK-26036 [0,0,0,0,0,1|2,0,1]=4 490 B10R1.18 CC(C)OC1=CC=CC=C1 AK110874 [0,0,0,0,0,1|1,0,0]=2 491 B10R1.18 CC(CC1=NC=CC=C1)=O AK-32596 [0,0,0,0,0,1|1,0,2]=4 492 B10R1.18 CC(OC1=CC=CN=C1)C AK167273 [0,0,0,0,0,1|2,0,0]=3 493 B10R1.18 CC(OC1=NC=CC=C1)C AK-47912 [0,0,0,0,0,1|2,0,0]=3 494 B10R1.18 C\C(C)=C/C1=CC=CC=C1 AK113914 [0,0,0,0,0,1|1,0,1]=3 495 B10R1.18 FC(F)OC1=CC=CC=C1 AK161726 [0,0,0,0,0,1|2,0,0]=3 496 B10R1.18 N=C(N)CC1=CC=CC=C1 AK-77604 [0,0,0,0,0,1|2,0,1]=4 497 B10R1.18 NC(NC1=CC=CC=C1)=N AK117130 [0,0,0,0,0,1|2,0,1]=4 498 B10R1.18 O=C(N)CC1=CC=CC=C1 AK-45803 [0,0,0,0,0,1|1,0,2]=4 499 B10R1.18 O=C(O)CC1=CC=CN=C1 AK-26773 [0,0,0,0,0,1|2,0,1]=4 500 B10R1.18 OC(=N)NC1=CC=CC=C1 AK-65147 [0,0,0,0,0,1|1,0,1]=3 501 B10R1.18 OC(=O)CC1=CC=CC=N1 AK-45110 [0,0,0,0,0,1|2,0,1]=4 502 B10R1.18 S=C(Cl)OC1=CC=CC=C1 AK163079 [0,0,0,0,0,1|1,1,1]=4 503 B10R1.18 S=C(N)NC1=CC=CC=C1 AK305328 [0,0,0,0,0,1|1,1,1]=4 504 B7R1.3 BrC1=CC=NC=C1 AK-47562 [2,0,0,0,0,0|2,0,0]=4 505 B7R1.3 C1=C(C)C=NC=N1 AK-30562 [2,0,0,0,0,0|2,0,0]=4 506 B7R1.3 C1=C(C)C=NN=C1 AK-30760 [2,0,0,0,0,0|2,0,0]=4 507 B7R1.3 C1=C(Cl)C=CN=C1 AK-50078 [2,0,0,0,0,0|2,0,0]=4 508 B7R1.3 CC1=CN=CC=N1 AK-88672 [2,0,0,0,0,0|2,0,0]=4 509 B7R1.3 CC1=NC=NC=C1 AK-34763 [2,0,0,0,0,0|2,0,0]=4 510 B7R1.3 FC1=CC=NC=C1 AK-61793 [2,0,0,0,0,0|2,0,0]=4 511 B7R1.3 IC1=CC=CC=C1 AK-88660 [2,0,0,0,0,0|1,0,0]=3 512 B7R1.3 IC1=CC=CN=C1 AK-46371 [2,0,0,0,0,0|2,0,0]=4 513 B7R1.3 IC1=CC=NC=C1 AK-47904 [2,0,0,0,0,0|2,0,0]=4 514 B7R1.3 IC1=NC=CC=C1 AK-43060 [2,0,0,0,0,0|2,0,0]=4 515 B7R1.3 N1=CN=C(C=C1)O AK-25153 [2,0,0,0,0,0|2,0,0]=4 516 B7R1.3 O=C1C=COC=C1 AK110934 [2,0,0,0,0,0|1,0,1]=4 517 B7R1.3 OC1=CC=CN=C1 AK-44238 [2,0,0,0,0,0|1,0,0]=3 518 B7R1.3 OC1=CC=NC=C1 AK110406 [2,0,0,0,0,0|1,0,0]=3 519 B7R1.3 OC1=CN=CN=C1 AK-28351 [2,0,0,0,0,0|2,0,0]=4 520 B7R1.3 OC1=CN=NC=C1 AK-28962 [2,0,0,0,0,0|2,0,0]=4 521 B7R1.3 OC1=NC=CC=N1 AK-41674 [2,0,0,0,0,0|2,0,0]=4 522 B7R1.3 OC1=NC=CC=N1 AK-49044 [2,0,0,0,0,0|2,0,0]=4 523 B7R1.3 [S-]C1=CC=CC=C1 AK316593 [2,0,0,0,0,0|0,1,0]=3 524 B9R1.1 BrC1=CN=C(C=C1)CC AK-34965 [1,1,0,0,0,0|1,0,0]=3 525 B9R1.1 BrC1=CN=C(C=C1)NC AK-46585 [1,1,0,0,0,0|2,0,0]=4 526 B9R1.1 BrC1=NC=C(C=C1)OC AK-25274 [1,1,0,0,0,0|2,0,0]=4 527 B9R1.1 BrCC1=CN=C(C=C1)Cl AK-28919 [1,1,0,0,0,0|2,0,0]=4 528 B9R1.1 C1=C(C=CC(=C1)Br)C#C AK-39898 [1,1,0,0,0,0|0,0,2]=4 529 B9R1.1 C1=C(C=CC(=C1)CN)O AK-47356 [1,1,0,0,0,0|1,0,0]=3 530 B9R1.1 C1=C(C=CC(=C1)F)C#N AK-44484 [1,1,0,0,0,0|1,0,1]=4 531 B9R1.1 C1=C(C=CC(=C1)I)C=O AK-75599 [1,1,0,0,0,0|0,0,2]=4 532 B9R1.1 C1=C(C=NC(=C1)CO)Br AK-26386 [1,1,0,0,0,0|1,0,0]=3 533 B9R1.1 C1=C(NN)C=CC(=C1)C AK-47398 [1,1,0,0,0,0|2,0,0]=4 534 B9R1.1 C1=CC(=CC=C1Br)CC AK-47528 [1,1,0,0,0,0|0,0,0]=2 535 B9R1.1 C1=CC(=CC=C1CO)O AK-47325 [1,1,0,0,0,0|0,0,0]=2 536 B9R1.1 C1=CC(=CC=C1I)NC AK-39846 [1,1,0,0,0,0|1,0,0]=3 537 B9R1.1 C1=CC(=CN=C1OC)Br AK-32435 [1,1,0,0,0,0|2,0,0]=4 538 B9R1.1 C1=CC(=CN=C1OC)N AK-24754 [1,1,0,0,0,0|2,0,0]=4 539 B9R1.1 C1=CC(=NC=C1CO)Cl AK-28987 [1,1,0,0,0,0|1,0,0]=3 540 B9R1.1 CC1=CC=C(C=O)C=C1 AK-65210 [1,1,0,0,0,0|0,0,2]=4 541 B9R1.1 CC1=CC=C(CO)C=N1 AK-78311 [1,1,0,0,0,0|1,0,0]=3 542 B9R1.1 CC1=CN=C(C=N1)CO AK-24727 [1,1,0,0,0,0|2,0,0]=4 543 B9R1.1 CC1=CN=C(OC)C=C1 AK-58301 [1,1,0,0,0,0|2,0,0]=4 544 B9R1.1 CC1=NC=C(CBr)C=C1 AK139052 [1,1,0,0,0,0|2,0,0]=4 545 B9R1.1 CC1=NC=C(CCl)C=C1 AK123163 [1,1,0,0,0,0|2,0,0]=4 546 B9R1.1 CCC1=CN=C(C=N1)C AK-58106 [1,1,0,0,0,0|2,0,0]=4 547 B9R1.1 CCC1=CN=C(Cl)C=C1 AK-48582 [1,1,0,0,0,0|1,0,0]=3 548 B9R1.1 CCC1=CN=C(N)N=C1 AK-31902 [1,1,0,0,0,0|2,0,0]=4 549 B9R1.1 CCC1=NC=C(Cl)C=C1 AK134672 [1,1,0,0,0,0|1,0,0]=3 550 B9R1.1 CNC1=CC=C(Cl)C=C1 AK129065 [1,1,0,0,0,0|1,0,0]=3 551 B9R1.1 CNC1=CC=C(F)C=C1 AK-87253 [1,1,0,0,0,0|1,0,0]=3 552 B9R1.1 CNC1=NC=C(Cl)C=C1 AK123580 [1,1,0,0,0,0|2,0,0]=4 553 B9R1.1 COC1=CC=C(Cl)C=C1 AK116963 [1,1,0,0,0,0|1,0,0]=3 554 B9R1.1 COC1=CC=C(I)C=C1 AK-44747 [1,1,0,0,0,0|1,0,0]=3 555 B9R1.1 COC1=CC=C(O)C=C1 AK-46469 [1,1,0,0,0,0|1,0,0]=3 556 B9R1.1 COC1=CN=C(Cl)C=C1 AK-33219 [1,1,0,0,0,0|2,0,0]=4 557 B9R1.1 COC1=CN=C(F)C=C1 AK-61561 [1,1,0,0,0,0|2,0,0]=4 558 B9R1.1 COC1=NC=C(Cl)C=C1 AK-44270 [1,1,0,0,0,0|2,0,0]=4 559 B9R1.1 COC1=NC=C(F)C=C1 AK-27023 [1,1,0,0,0,0|2,0,0]=4 560 B9R1.1 COC1=NC=C(I)C=C1 AK-58302 [1,1,0,0,0,0|2,0,0]=4 561 B9R1.1 CSC1=CN=C(N)C=C1 AK-40039 [1,1,0,0,0,0|2,0,0]=4 562 B9R1.1 ClC1=CC=C(C=C1)C#N AK-54448 [1,1,0,0,0,0|1,0,1]=4 563 B9R1.1 ClC1=CN=C(CBr)C=C1 AK164355 [1,1,0,0,0,0|2,0,0]=4 564 B9R1.1 ClC1=NC=C(C=N1)CC AK-32848 [1,1,0,0,0,0|2,0,0]=4 565 B9R1.1 ClCC1=NC=C(Br)C=C1 AK-47143 [1,1,0,0,0,0|2,0,0]=4 566 B9R1.1 IC1=CC=C(CBr)C=C1 AK-54650 [1,1,0,0,0,0|1,0,0]=3 567 B9R1.1 IC1=CC=C(CC)C=C1 AK121966 [1,1,0,0,0,0|0,0,0]=2 568 B9R1.1 N#CC1=CC=C(I)C=C1 AK-45950 [1,1,0,0,0,0|1,0,1]=4 569 B9R1.1 N#CC1=CC=C(N)C=C1 AK-41176 [1,1,0,0,0,0|1,0,1]=4 570 B9R1.1 NC1=CC=C(C#C)C=C1 AK-59413 [1,1,0,0,0,0|0,0,2]=4 571 B9R1.1 NC1=CC=C(C=N1)CO AK-29786 [1,1,0,0,0,0|1,0,0]=3 572 B9R1.1 NC1=CC=C(CC)N=C1 AK-78651 [1,1,0,0,0,0|1,0,0]=3 573 B9R1.1 NC1=CC=C(NC)C=C1 AK-86240 [1,1,0,0,0,0|1,0,0]=3 574 B9R1.1 NC1=CN=C(NC)C=C1 AK-75542 [1,1,0,0,0,0|2,0,0]=4 575 B9R1.1 NC1=CN=C(NC)C=C1 AK141591 [1,1,0,0,0,0|2,0,0]=4 576 B9R1.1 NC1=NC=C(C=C1)OC AK-27987 [1,1,0,0,0,0|2,0,0]=4 577 B9R1.1 NC1=NC=C(N=C1)CC AK-26631 [1,1,0,0,0,0|2,0,0]=4 578 B9R1.1 NCC1=CC=C(Br)C=C1 AK-46356 [1,1,0,0,0,0|1,0,0]=3 579 B9R1.1 NCC1=CC=C(Br)C=C1 AK-49170 [1,1,0,0,0,0|1,0,0]=3 580 B9R1.1 NCC1=CC=C(Br)N=C1 AK-27657 [1,1,0,0,0,0|2,0,0]=4 581 B9R1.1 NCC1=CC=C(Cl)C=C1 AK-44456 [1,1,0,0,0,0|1,0,0]=3 582 B9R1.1 NCC1=CC=C(F)N=C1 AK-67908 [1,1,0,0,0,0|2,0,0]=4 583 B9R1.1 NCC1=CC=C(I)C=C1 AK-81624 [1,1,0,0,0,0|1,0,0]=3 584 B9R1.1 NCC1=NC=C(Br)C=C1 AK-31901 [1,1,0,0,0,0|2,0,0]=4 585 B9R1.1 NCC1=NC=C(Br)C=C1 AK142316 [1,1,0,0,0,0|2,0,0]=4 586 B9R1.1 NCC1=NC=C(C)C=C1 AK150805 [1,1,0,0,0,0|2,0,0]=4 587 B9R1.1 NCC1=NC=C(Cl)C=C1 AK105180 [1,1,0,0,0,0|2,0,0]=4 588 B9R1.1 NCC1=NC=C(Cl)C=C1 AK145140 [1,1,0,0,0,0|2,0,0]=4 589 B9R1.1 NCC1=NC=C(F)C=C1 AK145177 [1,1,0,0,0,0|2,0,0]=4 590 B9R1.1 NNC1=CC=C(Br)C=C1 AK-26194 [1,1,0,0,0,0|2,0,0]=4 591 B9R1.1 NNC1=CC=C(Cl)C=C1 AK-41259 [1,1,0,0,0,0|2,0,0]=4 592 B9R1.1 NNC1=CC=C(Cl)C=C1 AK132992 [1,1,0,0,0,0|2,0,0]=4 593 B9R1.1 NNC1=CC=C(F)C=C1 AK-85652 [1,1,0,0,0,0|2,0,0]=4 594 B9R1.1 NNC1=CC=C(I)C=C1 AK-64633 [1,1,0,0,0,0|2,0,0]=4 595 B9R1.1 O=C1C=CC(CO)=CN1 AK-29768 [1,1,0,0,0,0|1,0,0]=3 596 B9R1.1 O=CC1=CC=C(Br)C=C1 AK-80048 [1,1,0,0,0,0|0,0,2]=4 597 B9R1.1 O=CC1=CC=C(Cl)C=C1 AK-76679 [1,1,0,0,0,0|0,0,2]=4 598 B9R1.1 O=CC1=CC=C(F)C=C1 AK-84401 [1,1,0,0,0,0|0,0,2]=4 599 B9R1.1 O=CC1=CC=C(O)C=C1 AK-77323 [1,1,0,0,0,0|0,0,2]=4 600 B9R1.1 OC1=CC=C(C=C)C=C1 AK113778 [1,1,0,0,0,0|0,0,2]=4 601 B9R1.1 OC1=CC=C(C=C1)C#N AK-44095 [1,1,0,0,0,0|1,0,1]=4 602 B9R1.1 OC1=CC=C(CO)N=C1 AK-68040 [1,1,0,0,0,0|1,0,0]=3 603 B9R1.1 OC1=CN=C(C=C1)OC AK-26060 [1,1,0,0,0,0|2,0,0]=4 604 B9R1.1 OCC1=CC=C(Br)C=C1 AK-93775 [1,1,0,0,0,0|0,0,0]=2 605 B9R1.1 OCC1=CC=C(Br)N=C1 AK-28751 [1,1,0,0,0,0|1,0,0]=3 606 B9R1.1 OCC1=CC=C(C)C=C1 AK-92302 [1,1,0,0,0,0|0,0,0]=2 607 B9R1.1 OCC1=CC=C(Cl)C=C1 AK-94754 [1,1,0,0,0,0|0,0,0]=2 608 B9R1.1 OCC1=CC=C(Cl)N=N1 AK100622 [1,1,0,0,0,0|2,0,0]=4 609 B9R1.1 OCC1=CC=C(F)N=C1 AK-76831 [1,1,0,0,0,0|1,0,0]=3 610 B9R1.1 OCC1=CC=C(I)C=C1 AK-72872 [1,1,0,0,0,0|0,0,0]=2 611 B9R1.1 OCC1=CC=C(N)C=C1 AK-51503 [1,1,0,0,0,0|0,0,0]=2 612 B9R1.1 OCC1=CN=C(C)N=C1 AK-25033 [1,1,0,0,0,0|2,0,0]=4 613 B9R1.1 OCC1=CN=C(Cl)N=C1 AK-64258 [1,1,0,0,0,0|2,0,0]=4 614 B9R1.1 OCC1=CN=C(N)N=C1 AK117617 [1,1,0,0,0,0|2,0,0]=4 615 B9R1.1 OCC1=NC=C(Br)C=N1 AK-78448 [1,1,0,0,0,0|2,0,0]=4 616 B9R1.1 OCC1=NC=C(Cl)C=C1 AK136128 [1,1,0,0,0,0|1,0,0]=3 617 B9R1.1 OCC1=NC=C(Cl)N=C1 AK-43110 [1,1,0,0,0,0|2,0,0]=4 618 B9R1.1 OCC1=NC=C(F)C=C1 AK-36421 [1,1,0,0,0,0|1,0,0]=3 619 B9R1.2 BrC1=CC(=CN=C1)CC AK-54800 [1,1,0,0,0,0|1,0,0]=3 620 B9R1.2 BrC1=CC(=NC=C1)CN AK-30719 [1,1,0,0,0,0|2,0,0]=4 621 B9R1.2 BrC1=CC(C=C)=CC=C1 AK-76367 [1,1,0,0,0,0|0,0,2]=4 622 B9R1.2 BrC1=CN=CC(=C1)CO AK-29246 [1,1,0,0,0,0|1,0,0]=3 623 B9R1.2 BrC1=NC=CC(=C1)CO AK-25314 [1,1,0,0,0,0|1,0,0]=3 624 B9R1.2 BrCC1=CC(Br)=NC=C1 AK-53557 [1,1,0,0,0,0|2,0,0]=4 625 B9R1.2 BrCC1=CC(I)=CC=C1 AK-54649 [1,1,0,0,0,0|1,0,0]=3 626 B9R1.2 BrCC1=CC=CC(Br)=N1 AK-48524 [1,1,0,0,0,0|2,0,0]=4 627 B9R1.2 C#CC1=CC=CC(Br)=C1 AK-45287 [1,1,0,0,0,0|0,0,2]=4 628 B9R1.2 C1=C(C=CC=C1Br)C#N AK-47279 [1,1,0,0,0,0|1,0,1]=4 629 B9R1.2 C1=C(C=CC=C1C#C)N AK-27092 [1,1,0,0,0,0|0,0,2]=4 630 B9R1.2 C1=C(C=CC=C1C#N)O AK-47400 [1,1,0,0,0,0|1,0,1]=4 631 B9R1.2 C1=C(C=CC=C1Cl)C#C AK-47344 [1,1,0,0,0,0|0,0,2]=4 632 B9R1.2 C1=C(C=CC=C1F)NN AK-47492 [1,1,0,0,0,0|2,0,0]=4 633 B9R1.2 C1=C(C=CN=C1OC)N AK-28456 [1,1,0,0,0,0|2,0,0]=4 634 B9R1.2 C1=C(CO)C=CC=C1N AK-50595 [1,1,0,0,0,0|0,0,0]=2 635 B9R1.2 C1=C(NN)C=CC=C1Br AK-25693 [1,1,0,0,0,0|2,0,0]=4 636 B9R1.2 C1=C(NN)C=CC=C1C AK-47381 [1,1,0,0,0,0|2,0,0]=4 637 B9R1.2 C1=CC=C(N=C1OC)Br AK-25939 [1,1,0,0,0,0|2,0,0]=4 638 B9R1.2 C1=CC=C(N=C1OC)C AK-44038 [1,1,0,0,0,0|2,0,0]=4 639 B9R1.2 C1=CC=C(N=C1OC)Cl AK-25492 [1,1,0,0,0,0|2,0,0]=4 640 B9R1.2 CC1=CC(CCl)=NC=C1 AK-74194 [1,1,0,0,0,0|2,0,0]=4 641 B9R1.2 CC1=CC(CO)=NC=C1 AK-74173 [1,1,0,0,0,0|1,0,0]=3 642 B9R1.2 CC1=CC(OC)=NC=C1 AK-39493 [1,1,0,0,0,0|2,0,0]=4 643 B9R1.2 CC1=CC=CC(CBr)=N1 AK-44889 [1,1,0,0,0,0|2,0,0]=4 644 B9R1.2 CC1=CC=CC(CCl)=N1 AK-40015 [1,1,0,0,0,0|2,0,0]=4 645 B9R1.2 CC1=CN=CC(CBr)=C1 AK-56105 [1,1,0,0,0,0|2,0,0]=4 646 B9R1.2 CCC1=CC(N)=NC=C1 AK-29170 [1,1,0,0,0,0|1,0,0]=3 647 B9R1.2 CCC1=CC=CC(Br)=C1 AK111102 [1,1,0,0,0,0|0,0,0]=2 648 B9R1.2 CCC1=CC=CC(Br)=N1 AK-65167 [1,1,0,0,0,0|1,0,0]=3 649 B9R1.2 CCC1=NC=CC(Br)=C1 AK129552 [1,1,0,0,0,0|1,0,0]=3 650 B9R1.2 CNC1=CC(Br)=NC=C1 AK161537 [1,1,0,0,0,0|2,0,0]=4 651 B9R1.2 CNC1=CC=CC(Br)=C1 AK112706 [1,1,0,0,0,0|1,0,0]=3 652 B9R1.2 CNC1=NC(Cl)=CC=C1 AK-48574 [1,1,0,0,0,0|2,0,0]=4 653 B9R1.2 CNC1=NC=CC(Br)=C1 AK141589 [1,1,0,0,0,0|2,0,0]=4 654 B9R1.2 COC1=CC(Br)=CC=C1 AK-76817 [1,1,0,0,0,0|1,0,0]=3 655 B9R1.2 COC1=CC(Br)=NC=C1 AK-36780 [1,1,0,0,0,0|2,0,0]=4 656 B9R1.2 COC1=CC(C)=NC=C1 AK-67862 [1,1,0,0,0,0|2,0,0]=4 657 B9R1.2 COC1=CC(Cl)=CC=C1 AK106212 [1,1,0,0,0,0|1,0,0]=3 658 B9R1.2 COC1=CC(Cl)=NC=C1 AK-25114 [1,1,0,0,0,0|2,0,0]=4 659 B9R1.2 COC1=CC=CC(F)=N1 AK130132 [1,1,0,0,0,0|2,0,0]=4 660 B9R1.2 COC1=CN=CC(=C1)O AK-28499 [1,1,0,0,0,0|2,0,0]=4 661 B9R1.2 COC1=CN=CC(Br)=C1 AK-26045 [1,1,0,0,0,0|2,0,0]=4 662 B9R1.2 COC1=NC=CC(Br)=C1 AK-47404 [1,1,0,0,0,0|2,0,0]=4 663 B9R1.2 COC1=NC=CC(F)=C1 AK-77188 [1,1,0,0,0,0|2,0,0]=4 664 B9R1.2 COC1=NC=CC(I)=C1 AK-37008 [1,1,0,0,0,0|2,0,0]=4 665 B9R1.2 CSC1=CC=CC(Br)=N1 AK159822 [1,1,0,0,0,0|2,0,0]=4 666 B9R1.2 ClC1=CC(=NC=C1)CN AK-28137 [1,1,0,0,0,0|2,0,0]=4 667 B9R1.2 ClC1=CC(=NC=C1)CO AK-27991 [1,1,0,0,0,0|1,0,0]=3 668 B9R1.2 ClC1=CC(=NC=C1)OC AK-26290 [1,1,0,0,0,0|2,0,0]=4 669 B9R1.2 ClC1=CC(=NC=C1)SC AK-25786 [1,1,0,0,0,0|2,0,0]=4 670 B9R1.2 ClC1=CC(CO)=CC=C1 AK-51231 [1,1,0,0,0,0|0,0,0]=2 671 B9R1.2 ClC1=CC=CC(=N1)CO AK-28428 [1,1,0,0,0,0|1,0,0]=3 672 B9R1.2 ClC1=CN=CC(=C1)CO AK-23534 [1,1,0,0,0,0|1,0,0]=3 673 B9R1.2 ClC1=NC=CC(CBr)=C1 AK-50155 [1,1,0,0,0,0|2,0,0]=4 674 B9R1.2 ClC1=NC=CC(CBr)=C1 AK163959 [1,1,0,0,0,0|2,0,0]=4 675 B9R1.2 ClCC1=CC(=CN=C1)C AK-33495 [1,1,0,0,0,0|2,0,0]=4 676 B9R1.2 ClCC1=CC(I)=CC=C1 AK-94390 [1,1,0,0,0,0|1,0,0]=3 677 B9R1.2 ClCC1=CC=CC(Br)=N1 AK151971 [1,1,0,0,0,0|2,0,0]=4 678 B9R1.2 ClCC1=CN=CC(Br)=C1 AK-88388 [1,1,0,0,0,0|2,0,0]=4 679 B9R1.2 ClCC1=NC=CC(Cl)=C1 AK-46990 [1,1,0,0,0,0|2,0,0]=4 680 B9R1.2 FC1=CC(CO)=CC=C1 AK-51232 [1,1,0,0,0,0|0,0,0]=2 681 B9R1.2 FC1=CC=CC(CBr)=N1 AK-77216 [1,1,0,0,0,0|2,0,0]=4 682 B9R1.2 FC1=CC=CC(CCl)=N1 AK137993 [1,1,0,0,0,0|2,0,0]=4 683 B9R1.2 N#CC1=CC=CC(I)=C1 AK-76942 [1,1,0,0,0,0|1,0,1]=4 684 B9R1.2 NC1=CC(=CN=C1)OC AK-27775 [1,1,0,0,0,0|2,0,0]=4 685 B9R1.2 NC1=CC(NC)=NC=C1 AK118733 [1,1,0,0,0,0|2,0,0]=4 686 B9R1.2 NC1=CC=CC(C#C)=C1 AK119642 [1,1,0,0,0,0|0,0,2]=4 687 B9R1.2 NC1=CC=CC(CN)=C1 AK-76655 [1,1,0,0,0,0|1,0,0]=3 688 B9R1.2 NC1=CC=CC(CO)=N1 AK-85732 [1,1,0,0,0,0|1,0,0]=3 689 B9R1.2 NC1=CC=CC(OC)=C1 AK309398 [1,1,0,0,0,0|1,0,0]=3 690 B9R1.2 NC1=CC=CC(SC)=C1 AK162933 [1,1,0,0,0,0|1,0,0]=3 691 B9R1.2 NC1=NC(=CC=C1)OC AK-27734 [1,1,0,0,0,0|2,0,0]=4 692 B9R1.2 NC1=NC(CC)=CC=C1 AK-28992 [1,1,0,0,0,0|1,0,0]=3 693 B9R1.2 NC1=NC=CC(=C1)CN AK-28487 [1,1,0,0,0,0|2,0,0]=4 694 B9R1.2 NC1=NC=CC(=C1)OC AK-25255 [1,1,0,0,0,0|2,0,0]=4 695 B9R1.2 NCC1=CC(Br)=NC=C1 AK111031 [1,1,0,0,0,0|2,0,0]=4 696 B9R1.2 NCC1=CC(C)=NC=C1 AK130210 [1,1,0,0,0,0|2,0,0]=4 697 B9R1.2 NCC1=CC(Cl)=NC=C1 AK-90264 [1,1,0,0,0,0|2,0,0]=4 698 B9R1.2 NCC1=CC(F)=CC=C1 AK-80195 [1,1,0,0,0,0|1,0,0]=3 699 B9R1.2 NCC1=CC(F)=NC=C1 AK186950 [1,1,0,0,0,0|2,0,0]=4 700 B9R1.2 NCC1=CC=CC(Br)=C1 AK-49144 [1,1,0,0,0,0|1,0,0]=3 701 B9R1.2 NCC1=CC=CC(C)=C1 AK-98167 [1,1,0,0,0,0|1,0,0]=3 702 B9R1.2 NCC1=CC=CC(Cl)=C1 AK-89641 [1,1,0,0,0,0|1,0,0]=3 703 B9R1.2 NCC1=CC=CC(I)=C1 AK-46127 [1,1,0,0,0,0|1,0,0]=3 704 B9R1.2 NCC1=NC(Br)=CC=C1 AK-39249 [1,1,0,0,0,0|2,0,0]=4 705 B9R1.2 NCC1=NC(Br)=CC=C1 AK-79055 [1,1,0,0,0,0|2,0,0]=4 706 B9R1.2 NCC1=NC(Cl)=CC=C1 AK105012 [1,1,0,0,0,0|2,0,0]=4 707 B9R1.2 NCC1=NC(F)=CC=C1 AK112462 [1,1,0,0,0,0|2,0,0]=4 708 B9R1.2 NCC1=NC=CC(Br)=C1 AK-76280 [1,1,0,0,0,0|2,0,0]=4 709 B9R1.2 NCC1=NC=CC(Cl)=C1 AK164315 [1,1,0,0,0,0|2,0,0]=4 710 B9R1.2 NCC1=NC=CC(F)=C1 AK133025 [1,1,0,0,0,0|2,0,0]=4 711 B9R1.2 NNC1=CC=CC(Cl)=C1 AK-46617 [1,1,0,0,0,0|2,0,0]=4 712 B9R1.2 O=C1C=C(CC)C=NN1 AK132530 [1,1,0,0,0,0|2,0,0]=4 713 B9R1.2 O=C1C=C(OC)C=CN1 AK-35484 [1,1,0,0,0,0|2,0,0]=4 714 B9R1.2 O=C1NC=NC(CC)=C1 AK100022 [1,1,0,0,0,0|2,0,0]=4 715 B9R1.2 O=CC1=CC=CC(Br)=C1 AK-77027 [1,1,0,0,0,0|0,0,2]=4 716 B9R1.2 O=CC1=CC=CC(Cl)=C1 AK-68812 [1,1,0,0,0,0|0,0,2]=4 717 B9R1.2 O=CC1=CC=CC(F)=C1 AK112743 [1,1,0,0,0,0|0,0,2]=4 718 B9R1.2 O=CC1=CC=CC(I)=C1 AK-50045 [1,1,0,0,0,0|0,0,2]=4 719 B9R1.2 O=CC1=CC=CC(N)=C1 AK121859 [1,1,0,0,0,0|0,0,2]=4 720 B9R1.2 O=CC1=CC=CC(O)=C1 AK-77369 [1,1,0,0,0,0|0,0,2]=4 721 B9R1.2 OC1=CC(=CC=C1)C#C AK111295 [1,1,0,0,0,0|0,0,2]=4 722 B9R1.2 OC1=CC(CBr)=CC=C1 AK-99880 [1,1,0,0,0,0|1,0,0]=3 723 B9R1.2 OC1=CC(OC)=NC=C1 AK-68345 [1,1,0,0,0,0|2,0,0]=4 724 B9R1.2 OCC1=CC(=O)NC=C1 AK-72519 [1,1,0,0,0,0|1,0,0]=3 725 B9R1.2 OCC1=CC(C)=CN=C1 AK130310 [1,1,0,0,0,0|1,0,0]=3 726 B9R1.2 OCC1=CC(C)=NC=C1 AK-32751 [1,1,0,0,0,0|1,0,0]=3 727 B9R1.2 OCC1=CC(Cl)=NC=C1 AK-32643 [1,1,0,0,0,0|1,0,0]=3 728 B9R1.2 OCC1=CC(F)=NC=C1 AK-57689 [1,1,0,0,0,0|1,0,0]=3 729 B9R1.2 OCC1=CC(N)=CN=C1 AK135137 [1,1,0,0,0,0|1,0,0]=3 730 B9R1.2 OCC1=CC(N)=NC=C1 AK-25275 [1,1,0,0,0,0|1,0,0]=3 731 B9R1.2 OCC1=CC=CC(Br)=C1 AK110441 [1,1,0,0,0,0|0,0,0]=2 732 B9R1.2 OCC1=CC=CC(Br)=N1 AK-34739 [1,1,0,0,0,0|1,0,0]=3 733 B9R1.2 OCC1=CN=CC(Br)=N1 AK-68017 [1,1,0,0,0,0|2,0,0]=4 734 B9R1.2 OCC1=NC(C)=CC=C1 AK-47726 [1,1,0,0,0,0|1,0,0]=3 735 B9R1.2 OCC1=NC(Cl)=CC=C1 AK-29179 [1,1,0,0,0,0|1,0,0]=3 736 B9R1.2 OCC1=NC(Cl)=CN=C1 AK-98157 [1,1,0,0,0,0|2,0,0]=4 737 B9R1.2 OCC1=NC(N)=NC=C1 AK116314 [1,1,0,0,0,0|2,0,0]=4 738 B9R1.2 OCC1=NC=CC(Br)=C1 AK-25360 [1,1,0,0,0,0|1,0,0]=3 739 B9R1.8 BrCCC1=CC=CC=C1 AK-54085 [1,1,0,0,0,0|0,0,0]=2 740 B9R1.8 C1=C(C=CC=C1)CON AK-49180 [1,1,0,0,0,0|0,0,0]=2 741 B9R1.8 C1=C(CCN)N=CC=C1 AK-73075 [1,1,0,0,0,0|1,0,0]=3 742 B9R1.8 C1=C(CNN)C=CC=C1 AK-72938 [1,1,0,0,0,0|1,0,0]=3 743 B9R1.8 C1=C(N=CC=C1)COC AK-32294 [1,1,0,0,0,0|1,0,0]=3 744 B9R1.8 C1=CC=NN=C1OCC AK-50551 [1,1,0,0,0,0|2,0,0]=4 745 B9R1.8 CCCC1=CC=NC=C1 AK109267 [1,1,0,0,0,0|1,0,0]=3 746 B9R1.8 CCCC1=NC=CN=C1 AK305719 [1,1,0,0,0,0|2,0,0]=4 747 B9R1.8 CCNC1=CC=CN=C1 AK126739 [1,1,0,0,0,0|1,0,0]=3 748 B9R1.8 CCNC1=NC=CN=C1 AK159718 [1,1,0,0,0,0|2,0,0]=4 749 B9R1.8 CCOC1=NC=CC=C1 AK-88755 [1,1,0,0,0,0|1,0,0]=3 750 B9R1.8 CCOC1=NN=CC=C1 AK-50365 [1,1,0,0,0,0|2,0,0]=4 751 B9R1.8 CNCC1=CC=CN=C1 AK-77094 [1,1,0,0,0,0|1,0,0]=3 752 B9R1.8 CNCC1=CC=NC=C1 AK-36140 [1,1,0,0,0,0|1,0,0]=3 753 B9R1.8 CNCC1=NC=CC=C1 AK-82805 [1,1,0,0,0,0|1,0,0]=3 754 B9R1.8 CNCC1=NC=CC=N1 AK-26868 [1,1,0,0,0,0|2,0,0]=4 755 B9R1.8 CNCC1=NC=CN=C1 AK-32984 [1,1,0,0,0,0|2,0,0]=4 756 B9R1.8 CNNC1=CC=CC=C1 AK119038 [1,1,0,0,0,0|1,0,0]=3 757 B9R1.8 N#CCC1=CC=CN=C1 AK-44402 [1,1,0,0,0,0|1,0,1]=4 758 B9R1.8 NCCC1=CC=CN=C1 AK-45879 [1,1,0,0,0,0|1,0,0]=3 759 B9R1.8 NNCC1=CC=CN=C1 AK-50063 [1,1,0,0,0,0|2,0,0]=4 760 B9R1.8 NOCC1=CC=CC=C1 AK-82317 [1,1,0,0,0,0|0,0,0]=2 761 B9R1.8 OCCC1=CN=CN=C1 AK-32465 [1,1,0,0,0,0|2,0,0]=4 762 B9R1.8 OCCC1=NC=CN=C1 AK-45393 [1,1,0,0,0,0|2,0,0]=4 763 B9R1.8 ONCC1=CC=CC=C1 AK-49662 [1,1,0,0,0,0|0,0,0]=2 764 B9R1.8 ONCC1=CC=CC=C1 AK110567 [1,1,0,0,0,0|0,0,0]=2 765 B9R1.15 BrC1=C(C=NC=C1)OC AK-46696 [1,1,0,0,0,0|2,0,0]=4 766 B9R1.15 BrC1=CC=CN=C1OC AK-33153 [1,1,0,0,0,0|2,0,0]=4 767 B9R1.15 BrCC1=C(I)C=CC=C1 AK-54648 [1,1,0,0,0,0|1,0,0]=3 768 B9R1.15 BrCC1=NC=CC=C1Br AK158877 [1,1,0,0,0,0|2,0,0]=4 769 B9R1.15 C#CC1=CC=CC=C1Br AK-45286 [1,1,0,0,0,0|0,0,2]=4 770 B9R1.15 C(C)C1=NC=NC=C1F AK-23771 [1,1,0,0,0,0|2,0,0]=4 771 B9R1.15 C1=C(C(=CC=C1)Br)CC AK-46714 [1,1,0,0,0,0|0,0,0]=2 772 B9R1.15 C1=C(C(=CC=C1)Br)CN AK-73129 [1,1,0,0,0,0|1,0,0]=3 773 B9R1.15 C1=C(C(=CC=C1)Cl)CO AK-46748 [1,1,0,0,0,0|0,0,0]=2 774 B9R1.15 C1=C(I)C(=NC=C1)OC AK-25295 [1,1,0,0,0,0|2,0,0]=4 775 B9R1.15 C1=CC=CC(=C1C#N)Br AK-46715 [1,1,0,0,0,0|1,0,1]=4 776 B9R1.15 C1=CC=CC(=C1C#N)O AK-47282 [1,1,0,0,0,0|1,0,1]=4 777 B9R1.15 C1=CC=CC(=C1CO)Br AK-51234 [1,1,0,0,0,0|0,0,0]=2 778 B9R1.15 C1=CC=CC(=C1NN)Br AK-35375 [1,1,0,0,0,0|2,0,0]=4 779 B9R1.15 C1=CC=CC(=C1NN)C AK-46554 [1,1,0,0,0,0|2,0,0]=4 780 B9R1.15 C1=CC=CC(=C1NN)Cl AK-37033 [1,1,0,0,0,0|2,0,0]=4 781 B9R1.15 C1=CC=CC(=C1O)CO AK-47595 [1,1,0,0,0,0|0,0,0]=2 782 B9R1.15 C1=CC=CC(=C1OC)F AK-46555 [1,1,0,0,0,0|1,0,0]=3 783 B9R1.15 C1=NC(=C(C=C1)CO)N AK-23581 [1,1,0,0,0,0|1,0,0]=3 784 B9R1.15 C=CC1=CC=CC=C1Cl AK114259 [1,1,0,0,0,0|0,0,2]=4 785 B9R1.15 CC1=C(CBr)C=NC=C1 AK137963 [1,1,0,0,0,0|2,0,0]=4 786 B9R1.15 CC1=C(CCl)C=NC=C1 AK143692 [1,1,0,0,0,0|2,0,0]=4 787 B9R1.15 CC1=CC=CC=C1CC AK-49977 [1,1,0,0,0,0|0,0,0]=2 788 B9R1.15 CC1=CC=CN=C1CCl AK-77025 [1,1,0,0,0,0|2,0,0]=4 789 B9R1.15 CC1=CC=CN=C1OC AK126197 [1,1,0,0,0,0|2,0,0]=4 790 B9R1.15 CC1=NC=CN=C1CC AK114356 [1,1,0,0,0,0|2,0,0]=4 791 B9R1.15 CCC1=C(Br)C=CN=C1 AK328293 [1,1,0,0,0,0|1,0,0]=3 792 B9R1.15 CCC1=C(Br)C=NC=C1 AK-81618 [1,1,0,0,0,0|1,0,0]=3 793 B9R1.15 CCC1=C(Cl)N=CC=N1 AK-54851 [1,1,0,0,0,0|2,0,0]=4 794 B9R1.15 CCC1=CN=CN=C1Cl AK-25151 [1,1,0,0,0,0|2,0,0]=4 795 B9R1.15 CCC1=NC=CC=C1Br AK128590 [1,1,0,0,0,0|1,0,0]=3 796 B9R1.15 CCC1=NC=NC=C1Br AK105597 [1,1,0,0,0,0|2,0,0]=4 797 B9R1.15 CNC1=CC=CC=C1Cl AK163346 [1,1,0,0,0,0|1,0,0]=3 798 B9R1.15 CNC1=CC=CC=C1F AK-48931 [1,1,0,0,0,0|1,0,0]=3 799 B9R1.15 CNC1=CC=CN=C1Cl AK115045 [1,1,0,0,0,0|2,0,0]=4 800 B9R1.15 CNC1=NC=CC=C1Cl AK140218 [1,1,0,0,0,0|2,0,0]=4 801 B9R1.15 COC1=C(Br)C=NC=C1 AK-36460 [1,1,0,0,0,0|2,0,0]=4 802 B9R1.15 COC1=C(I)C=NC=C1 AK-26421 [1,1,0,0,0,0|2,0,0]=4 803 B9R1.15 COC1=CC=CC=C1Br AK-76806 [1,1,0,0,0,0|1,0,0]=3 804 B9R1.15 COC1=CC=CN=C1Br AK-29048 [1,1,0,0,0,0|2,0,0]=4 805 B9R1.15 COC1=CC=CN=C1F AK-63160 [1,1,0,0,0,0|2,0,0]=4 806 B9R1.15 COC1=NC=CC=C1Cl AK-33154 [1,1,0,0,0,0|2,0,0]=4 807 B9R1.15 COC1=NC=CC=C1F AK-33314 [1,1,0,0,0,0|2,0,0]=4 808 B9R1.15 ClC1=C(C=CC=C1)C#C AK-30160 [1,1,0,0,0,0|0,0,2]=4 809 B9R1.15 ClC1=CC=CN=C1CBr AK138503 [1,1,0,0,0,0|2,0,0]=4 810 B9R1.15 ClCC1=NC=CC=C1Cl AK109982 [1,1,0,0,0,0|2,0,0]=4 811 B9R1.15 ClCC1=NC=CC=C1Cl AK138192 [1,1,0,0,0,0|2,0,0]=4 812 B9R1.15 FC1=C(C=CN=C1)CN AK-49033 [1,1,0,0,0,0|2,0,0]=4 813 B9R1.15 FC1=CC=CN=C1CBr AK128379 [1,1,0,0,0,0|2,0,0]=4 814 B9R1.15 FC1=CC=CN=C1CCl AK109609 [1,1,0,0,0,0|2,0,0]=4 815 B9R1.15 FC1=CC=CN=C1CO AK-29127 [1,1,0,0,0,0|1,0,0]=3 816 B9R1.15 FC1=NC=CC=C1CN AK-30140 [1,1,0,0,0,0|2,0,0]=4 817 B9R1.15 N#CC1=CC=CC=C1Cl AK-44438 [1,1,0,0,0,0|1,0,1]=4 818 B9R1.15 N#CC1=CC=CC=C1F AK-88419 [1,1,0,0,0,0|1,0,1]=4 819 B9R1.15 N#CC1=CC=CC=C1I AK-76636 [1,1,0,0,0,0|1,0,1]=4 820 B9R1.15 NC1=C(C=CN=C1)OC AK-27262 [1,1,0,0,0,0|2,0,0]=4 821 B9R1.15 NC1=C(C=O)C=CC=C1 AK-45623 [1,1,0,0,0,0|0,0,2]=4 822 B9R1.15 NC1=C(OC)C=NC=C1 AK-46304 [1,1,0,0,0,0|2,0,0]=4 823 B9R1.15 NC1=CC=CC=C1C#C AK-45718 [1,1,0,0,0,0|0,0,2]=4 824 B9R1.15 NC1=CC=CC=C1C=C AK100084 [1,1,0,0,0,0|0,0,2]=4 825 B9R1.15 NC1=CC=CC=C1NC AK-35283 [1,1,0,0,0,0|1,0,0]=3 826 B9R1.15 NC1=CC=CN=C1OC AK-28363 [1,1,0,0,0,0|2,0,0]=4 827 B9R1.15 NC1=NC=CC=C1OC AK-25256 [1,1,0,0,0,0|2,0,0]=4 828 B9R1.15 NC1=NC=CN=C1CC AK-30572 [1,1,0,0,0,0|2,0,0]=4 829 B9R1.15 NCC1=CC=CC=C1C AK-89642 [1,1,0,0,0,0|1,0,0]=3 830 B9R1.15 NCC1=CC=CC=C1Cl AK-78184 [1,1,0,0,0,0|1,0,0]=3 831 B9R1.15 NCC1=CC=CC=C1F AK-88519 [1,1,0,0,0,0|1,0,0]=3 832 B9R1.15 NCC1=CC=CC=C1I AK-94126 [1,1,0,0,0,0|1,0,0]=3 833 B9R1.15 NCC1=NC=CC=C1C AK122548 [1,1,0,0,0,0|2,0,0]=4 834 B9R1.15 NCC1=NC=CC=C1Cl AK-41569 [1,1,0,0,0,0|2,0,0]=4 835 B9R1.15 NNC1=CC=CC=C1Br AK-33609 [1,1,0,0,0,0|2,0,0]=4 836 B9R1.15 NNC1=CC=CC=C1F AK-78527 [1,1,0,0,0,0|2,0,0]=4 837 B9R1.15 NNC1=CC=CC=C1I AK198825 [1,1,0,0,0,0|2,0,0]=4 838 B9R1.15 O=C1C(CC)=CC=NN1 AK132188 [1,1,0,0,0,0|2,0,0]=4 839 B9R1.15 O=C1C(CC)=NC=CN1 AK198883 [1,1,0,0,0,0|2,0,0]=4 840 B9R1.15 O=C1C(CN)=CC=CN1 AK-76048 [1,1,0,0,0,0|2,0,0]=4 841 B9R1.15 O=CC1=CC=CC=C1Br AK-50022 [1,1,0,0,0,0|0,0,2]=4 842 B9R1.15 O=CC1=CC=CC=C1F AK-88670 [1,1,0,0,0,0|0,0,2]=4 843 B9R1.15 O=CC1=CC=CC=C1I AK-94125 [1,1,0,0,0,0|0,0,2]=4 844 B9R1.15 O=CC1=CC=CC=C1N AK550048 [1,1,0,0,0,0|0,0,2]=4 845 B9R1.15 OC1=CC=CC=C1CN AK-49022 [1,1,0,0,0,0|1,0,0]=3 846 B9R1.15 OC1=CC=CC=C1CN AK167666 [1,1,0,0,0,0|1,0,0]=3 847 B9R1.15 OC1=CC=CC=C1OC AK114448 [1,1,0,0,0,0|1,0,0]=3 848 B9R1.15 OC1=CC=CN=C1CN AK-82086 [1,1,0,0,0,0|2,0,0]=4 849 B9R1.15 OC1=CC=CN=C1OC AK261041 [1,1,0,0,0,0|2,0,0]=4 850 B9R1.15 OCC1=C(Br)C=CN=C1 AK-86110 [1,1,0,0,0,0|1,0,0]=3 851 B9R1.15 OCC1=C(Br)C=NC=C1 AK-38288 [1,1,0,0,0,0|1,0,0]=3 852 B9R1.15 OCC1=C(Cl)C=CN=C1 AK124400 [1,1,0,0,0,0|1,0,0]=3 853 B9R1.15 OCC1=C(Cl)N=CC=N1 AK-39229 [1,1,0,0,0,0|2,0,0]=4 854 B9R1.15 OCC1=C(F)C=NC=C1 AK-90171 [1,1,0,0,0,0|1,0,0]=3 855 B9R1.15 OCC1=C(N)C=CN=C1 AK-58822 [1,1,0,0,0,0|1,0,0]=3 856 B9R1.15 OCC1=C(N)C=NC=C1 AK-74165 [1,1,0,0,0,0|1,0,0]=3 857 B9R1.15 OCC1=CC=CC=C1I AK-77177 [1,1,0,0,0,0|0,0,0]=2 858 B9R1.15 OCC1=CC=CC=C1N AK-49868 [1,1,0,0,0,0|0,0,0]=2 859 B9R1.15 OCC1=CC=CN=C1Cl AK-23619 [1,1,0,0,0,0|1,0,0]=3 860 B9R1.15 OCC1=CC=CN=C1F AK-33110 [1,1,0,0,0,0|1,0,0]=3 861 B9R1.15 OCC1=NC=CC=C1Cl AK133056 [1,1,0,0,0,0|1,0,0]=3 862 B9R1.11 NC(C1=CC=CS1)CO AK684513 [0,1,0,0,1,0|2,0,0]=4 863 B11R1.20 C1=C(C=CC(=C1)F)CC(O)=O AK-49121 [0,1,0,0,0,1|1,0,1]=4 864 B11R1.20 C1=CC(=CC=C1CC(C)=O)F AK-50578 [0,1,0,0,0,1|0,0,2]=4 865 B11R1.20 C1=CC(=CC=C1N)CC(O)=O AK-47573 [0,1,0,0,0,1|1,0,1]=4 866 B11R1.20 CC(NC1=CC=C(C)C=C1)=O AK208638 [0,1,0,0,0,1|0,0,2]=4 867 B11R1.20 CC(NC1=CC=C(F)C=C1)C AK-53729 [0,1,0,0,0,1|1,0,0]=3 868 B11R1.20 CC(NC1=CC=C(I)C=C1)=O AK115722 [0,1,0,0,0,1|0,0,2]=4 869 B11R1.20 CC(OC1=CN=C(Cl)C=C1)C AK143478 [0,1,0,0,0,1|2,0,0]=4 870 B11R1.20 NC1=CC=C(CN(C)C)C=C1 AK-35964 [0,1,0,0,0,1|2,0,0]=4 871 B11R1.20 NC1=CC=C(OC(C)C)C=C1 AK-42665 [0,1,0,0,0,1|1,0,0]=3 872 B11R1.20 O=C(O)CC1=CC=C(C)C=C1 AK-45538 [0,1,0,0,0,1|1,0,1]=4 873 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 AK-45403 [0,1,0,0,0,1|1,0,1]=4 874 B11R1.20 OC(=O)CC1=CC=C(Br)C=C1 AK-45378 [0,1,0,0,0,1|1,0,1]=4 875 B11R1.20 OC(=O)CC1=CC=C(Cl)C=C1 AK-76702 [0,1,0,0,0,1|1,0,1]=4 876 B11R1.20 OC(=O)CC1=CC=C(O)C=C1 AK101098 [0,1,0,0,0,1|1,0,1]=4 877 B11R1.20 OC1=CC=C(OC(F)F)C=C1 AK116337 [0,1,0,0,0,1|2,0,0]=4 878 B11R1.36 C1=C(C(C(O)=O)Br)C=CC=C1 AK-47433 [0,1,0,0,0,1|1,0,1]=4 879 B11R1.36 C1=C(C(C(O)=O)C)C=CC=C1 AK-50598 [0,1,0,0,0,1|1,0,1]=4 880 B11R1.36 C1=CC=CC=C1C(C(O)=O)O AK-54084 [0,1,0,0,0,1|1,0,1]=4 881 B11R1.36 CC(C(C1=CC=CC=C1)=O)=O AK116651 [0,1,0,0,0,1|0,0,2]=4 882 B11R1.36 CC(C)[C@@H](C1=CC=CC=C1)N AK-42222 [0,1,0,0,0,1|1,0,0]=3 883 B11R1.36 CC(C)[C@H](C1=CC=CC=C1)N AK-41685 [0,1,0,0,0,1|1,0,0]=3 884 B11R1.36 C[C@@H](C1=CC=CC=C1)C(O)=O AK-42526 [0,1,0,0,0,1|1,0,1]=4 885 B11R1.36 C[C@@H](O)[C@H](N)C1=CC=CC=C1 AK608029 [0,1,0,0,0,1|0,0,0]=2 886 B11R1.36 C[C@H](C1=CC=CC=C1)C(O)=O AK-42515 [0,1,0,0,0,1|1,0,1]=4 887 B11R1.36 C[C@H](O)[C@H](N)C1=CC=CC=C1 AK608030 [0,1,0,0,0,1|0,0,0]=2 888 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 AK107681 [0,1,0,0,0,1|1,0,1]=4 889 B11R1.36 O=C(O)C(N)C1=CC=CC=C1 AK-46549 [0,1,0,0,0,1|1,0,1]=4 890 B11R1.36 O=C(O)[C@@H](N)C1=CC=CC=C1 AK-48119 [0,1,0,0,0,1|1,0,1]=4 891 B11R1.36 O=C(O)[C@H](N)C1=CC=CC=C1 AK-44130 [0,1,0,0,0,1|1,0,1]=4 892 B11R1.36 O=C(O)[C@H](N)C1=CC=CC=C1 AK105883 [0,1,0,0,0,1|1,0,1]=4 893 B11R1.36 [C@@H](O)(C1=CC=CC=C1)C(=O)O AK-47567 [0,1,0,0,0,1|1,0,1]=4 894 B11R1.36 [C@H](C1=CC=CC=C1)(C(O)=O)O AK-42339 [0,1,0,0,0,1|1,0,1]=4 895 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 AK142273 [0,1,0,0,0,1|1,0,1]=4 896 B11R1.40 O=C(NC1=CC=CC=C1)CCl AK-95957 [0,1,0,0,0,1|0,0,2]=4 897 B11R1.40 O=C(OC)CC1=CC=CC=C1 AK163377 [0,1,0,0,0,1|0,0,2]=4 898 B11R1.40 O=C(OC)OC1=CC=CC=C1 AK600729 [0,1,0,0,0,1|0,0,2]=4 899 B11R1.40 O=C(OC1=CC=CC=C1)CBr AK105971 [0,1,0,0,0,1|0,0,2]=4 900 B11R1.40 OCC(N)CC1=CC=CC=C1 AK-33528 [0,1,0,0,0,1|1,0,0]=3 901 B11R1.40 OC[C@@H](N)CC1=CC=CC=C1 AK-46725 [0,1,0,0,0,1|1,0,0]=3 902 B11R1.40 OC[C@H](N)CC1=CC=CC=C1 AK-45609 [0,1,0,0,0,1|1,0,0]=3 903 B11R1.86 C1=C(CC(=O)C)C(=CC=C1)Br AK-47295 [0,1,0,0,0,1|0,0,2]=4 904 B11R1.86 C1=C(OC(C)C)C(=CC=C1)N AK-39887 [0,1,0,0,0,1|1,0,0]=3 905 B11R1.86 C1=CC=CC(=C1CC(O)=O)C AK-45537 [0,1,0,0,0,1|1,0,1]=4 906 B11R1.86 C1=CC=CC(=C1CC(O)=O)O AK-47284 [0,1,0,0,0,1|1,0,1]=4 907 B11R1.86 CC(C)OC1=CC=CC=C1Br AK-45390 [0,1,0,0,0,1|1,0,0]=3 908 B11R1.86 CC(CC1=CC=CC=C1F)=O AK117069 [0,1,0,0,0,1|0,0,2]=4 909 B11R1.86 CC(NC1=CC=CC=C1N)=O AK112083 [0,1,0,0,0,1|0,0,2]=4 910 B11R1.86 CC(NC1=CC=CC=C1O)=O AK116958 [0,1,0,0,0,1|0,0,2]=4 911 B11R1.86 CC(OC1=NC=CC=C1Br)C AK127008 [0,1,0,0,0,1|2,0,0]=4 912 B11R1.86 FC(F)OC1=CC=CC=C1Br AK-61615 [0,1,0,0,0,1|2,0,0]=4 913 B11R1.86 IC1=C(C=CC=C1)CC(=O)O AK-73107 [0,1,0,0,0,1|1,0,1]=4 914 B11R1.86 IC1=CC=CC=C1OC(F)F AK136295 [0,1,0,0,0,1|2,0,0]=4 915 B11R1.86 O=C(O)CC1=CC=CC=C1Br AK-45376 [0,1,0,0,0,1|1,0,1]=4 916 B11R1.86 O=C(O)CC1=CC=CC=C1F AK-29262 [0,1,0,0,0,1|1,0,1]=4 917 B11R1.86 OC1=CC=CC=C1OC(F)F AK135667 [0,1,0,0,0,1|2,0,0]=4 918 B11R1.157 C1=C(C=CC=C1Cl)CC(O)=O AK-47464 [0,1,0,0,0,1|1,0,1]=4 919 B11R1.157 C1=C(C=CC=C1F)CC(O)=O AK-72993 [0,1,0,0,0,1|1,0,1]=4 920 B11R1.157 C1=C(C=CC=C1O)CC(O)=O AK-48396 [0,1,0,0,0,1|1,0,1]=4 921 B11R1.157 CC(=O)CC1=CC(F)=CC=C1 AK-60937 [0,1,0,0,0,1|0,0,2]=4 922 B11R1.157 CC(C)CC1=CC(Br)=CC=C1 AK148389 [0,1,0,0,0,1|1,0,0]=3 923 B11R1.157 CC(CC1=CC=CC(Br)=C1)=O AK-94137 [0,1,0,0,0,1|0,0,2]=4 924 B11R1.157 CC(NC1=CC=CC(N)=C1)=O AK-76549 [0,1,0,0,0,1|0,0,2]=4 925 B11R1.157 CC(NC1=CC=CC(O)=C1)=O AK-84439 [0,1,0,0,0,1|0,0,2]=4 926 B11R1.157 CC(OC1=CC=CC(Br)=C1)=O AK-80146 [0,1,0,0,0,1|0,0,2]=4 927 B11R1.157 CC(OC1=CC=CC(F)=C1)=O AK135677 [0,1,0,0,0,1|0,0,2]=4 928 B11R1.157 CN(C)CC1=CC=CC(Br)=C1 AK130105 [0,1,0,0,0,1|2,0,0]=4 929 B11R1.157 FC(F)OC1=CC(Br)=CC=C1 AK-87088 [0,1,0,0,0,1|2,0,0]=4 930 B11R1.157 FC(OC1=CC=CC(=C1)N)F AK-34187 [0,1,0,0,0,1|2,0,0]=4 931 B11R1.157 O=C(O)CC1=CC=CC(Br)=C1 AK-42053 [0,1,0,0,0,1|1,0,1]=4 932 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 AK-61642 [0,1,0,0,0,1|1,0,1]=4 933 B11R1.509 CC(OC1=CC=CN=C1)(C)C AK167270 [0,1,0,0,0,1|2,0,0]=4 934 B11R1.509 CC(OC1=NC=CC=C1)(C)C AK161535 [0,1,0,0,0,1|2,0,0]=4 935 B11R1.509 CS(=O)(NC1=CC=CC=C1)=O AK-51764 [0,1,0,0,0,1|1,0,1]=4 936 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 AK106161 [0,1,0,0,0,1|2,0,0]=4 937 B11R1.509 C[N+](C)(CC1=CC=CC=C1)C AK-76496 [0,1,0,0,0,1|2,0,0]=4 938 B11R1.509 C[N+](CC1=CC=CC=C1)(C)C AK-44880 [0,1,0,0,0,1|2,0,0]=4 939 B11R1.3 BrCC1=CC=C(C=C1)B(O)O AK-32249 [0,2,0,0,0,0|2,0,0]=4 940 B11R1.3 C(#C)C1=CC=C(C(=O)O)C=C1 AK-44236 [0,2,0,0,0,0|1,0,1]=4 941 B11R1.3 C1=C(C=CC(=C1)C#N)B(O)O AK-44971 [0,2,0,0,0,0|2,0,0]=4 942 B11R1.3 C1=C(C=CC(=C1)C=O)C(O)=O AK-45367 [0,2,0,0,0,0|1,0,1]=4 943 B11R1.3 C1=C(C=CC(=C1)CN)C(O)=O AK-35678 [0,2,0,0,0,0|1,0,1]=4 944 B11R1.3 C1=C(C=CC(=C1)CO)B(O)O AK-47289 [0,2,0,0,0,0|2,0,0]=4 945 B11R1.3 C1=C(C=CC(=C1)OC)B(O)O AK-39804 [0,2,0,0,0,0|2,0,0]=4 946 B11R1.3 C1=C(N(C)C)C=CC(=C1)C=O AK-72833 [0,2,0,0,0,0|2,0,0]=4 947 B11R1.3 C1=CC(=CC=C1C(O)=O)CO AK-25734 [0,2,0,0,0,0|1,0,1]=4 948 B11R1.3 CC(C)C1=CC=C(CN)C=C1 AK-61820 [0,2,0,0,0,0|1,0,0]=3 949 B11R1.3 CC(C1=CC=C(CBr)C=C1)=O AK-35404 [0,2,0,0,0,0|0,0,2]=4 950 B11R1.3 CC(C1=CC=C(CN)C=C1)=O AK158889 [0,2,0,0,0,0|0,0,2]=4 951 B11R1.3 CC(C1=CC=C(NC)C=C1)=O AK145581 [0,2,0,0,0,0|0,0,2]=4 952 B11R1.3 CC(C1=CC=C(SC)C=C1)=O AK164075 [0,2,0,0,0,0|0,0,2]=4 953 B11R1.3 CN(C)C1=CC=C(OC)C=C1 AK136005 [0,2,0,0,0,0|2,0,0]=4 954 B11R1.3 COC1=CC=C(C=C1)[C@@H](C)N AK-34162 [0,2,0,0,0,0|1,0,0]=3 955 B11R1.3 COC1=CC=C(C=C1)[C@@H](C)O AK103062 [0,2,0,0,0,0|0,0,0]=2 956 B11R1.3 COC1=CC=C(C=C1)[C@H](C)O AK103063 [0,2,0,0,0,0|0,0,0]=2 957 B11R1.3 N#CC1=CC=C(C(C)=O)C=C1 AK-44531 [0,2,0,0,0,0|0,0,2]=4 958 B11R1.3 N#CC1=CC=C([C@@H](N)C)C=C1 AK133451 [0,2,0,0,0,0|1,0,0]=3 959 B11R1.3 N#CC1=CC=C([C@H](N)C)C=C1 AK133444 [0,2,0,0,0,0|1,0,0]=3 960 B11R1.3 O=C(O)C1=CC=C(C=C)C=C1 AK-45760 [0,2,0,0,0,0|1,0,1]=4 961 B11R1.3 O=C(O)C1=CC=C(CC)C=C1 AK114313 [0,2,0,0,0,0|1,0,1]=4 962 B11R1.3 O=C(O)C1=CC=C(NN)C=C1 AK-79152 [0,2,0,0,0,0|1,0,1]=4 963 B11R1.3 O=C(O)C1=CC=C(NN)C=C1 AK-88500 [0,2,0,0,0,0|1,0,1]=4 964 B11R1.3 O=C(O)C1=CC=C(OC)C=C1 AK-41188 [0,2,0,0,0,0|1,0,1]=4 965 B11R1.3 OB(C1=CC=C(C=C)C=C1)O AK-45734 [0,2,0,0,0,0|2,0,0]=4 966 B11R1.3 OB(C1=CC=C(C=O)C=C1)O AK-45038 [0,2,0,0,0,0|2,0,0]=4 967 B11R1.3 [C@@H](C)(N)C1=CC=C(OC)C=C1 AK-41700 [0,2,0,0,0,0|1,0,0]=3 968 B11R1.19 C1=C(C(F)(F)F)C=CC(=C1)I AK-25993 [0,2,0,0,0,0|2,0,0]=4 969 B11R1.19 C1=C(C(F)(F)F)C=CC(=C1)N AK-46769 [0,2,0,0,0,0|2,0,0]=4 970 B11R1.19 C1=C([S](C)(=O)=O)C=CC(=C1)Cl AK-50496 [0,2,0,0,0,0|1,0,1]=4 971 B11R1.19 C1=C([S](C)(=O)=O)C=CC(=C1)O AK-73113 [0,2,0,0,0,0|1,0,1]=4 972 B11R1.19 CC(C1=CC=C(Br)C=C1)(C)C AK-88487 [0,2,0,0,0,0|1,0,0]=3 973 B11R1.19 CC(F)(F)C1=CC=C(Br)C=C1 AK-67199 [0,2,0,0,0,0|1,0,0]=3 974 B11R1.19 CC(O)(C1=CC=C(Br)C=C1)C AK-41776 [0,2,0,0,0,0|0,0,0]=2 975 B11R1.19 CC1=CC=C(C=C1)C(F)(F)F AK-72556 [0,2,0,0,0,0|2,0,0]=4 976 B11R1.19 CC1=CC=C(C=C1)P(=O)(O)O AK-80283 [0,2,0,0,0,0|2,0,0]=4 977 B11R1.19 CC1=CC=C(C=C1)S(O)(=O)=O AK-93752 [0,2,0,0,0,0|2,0,0]=4 978 B11R1.19 C[Si](C)(C)C1=CC=C(Br)C=C1 AK-82203 [0,2,0,0,0,0|1,1,0]=4 979 B11R1.19 IC1=CC=C(C(C)(C)C)C=C1 AK-80497 [0,2,0,0,0,0|1,0,0]=3 980 B11R1.19 NC1=CC=C(C(C)(C)C)C=C1 AK136142 [0,2,0,0,0,0|1,0,0]=3 981 B11R1.19 NC1=CC=C(S(=O)(C)=O)C=C1 AK-32256 [0,2,0,0,0,0|1,0,1]=4 982 B11R1.19 O=S(C1=CC=C(Br)C=C1)(C)=O AK-76561 [0,2,0,0,0,0|1,0,1]=4 983 B11R1.19 O=S(C1=CC=C(C)C=C1)(C)=O AK-94753 [0,2,0,0,0,0|1,0,1]=4 984 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O AK-45062 [0,2,0,0,0,0|2,0,0]=4 985 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O AK-77681 [0,2,0,0,0,0|2,0,0]=4 986 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O AK101690 [0,2,0,0,0,0|2,0,0]=4 987 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O AK150790 [0,2,0,0,0,0|2,0,0]=4 988 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O AK164877 [0,2,0,0,0,0|2,0,0]=4 989 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O AK311262 [0,2,0,0,0,0|2,0,0]=4 990 B11R1.19 OC1=CC=C(C(F)(F)F)C=C1 AK-40084 [0,2,0,0,0,0|2,0,0]=4 991 B11R1.21 BrC1=C(C=C(C(=O)O)C=C1)O AK-39977 [0,2,0,0,0,0|1,0,1]=4 992 B11R1.21 BrC1=C(C=C(C=C1)C(C)=O)F AK-34604 [0,2,0,0,0,0|0,0,2]=4 993 B11R1.21 BrC1=C(C=CC(=C1)C(=O)O)Cl AK-30019 [0,2,0,0,0,0|1,0,1]=4 994 B11R1.21 C1=C(B(O)O)C=CC(=C1Cl)F AK-28494 [0,2,0,0,0,0|2,0,0]=4 995 B11R1.21 C1=C(C(=CC(=C1)B(O)O)Cl)Cl AK-33407 [0,2,0,0,0,0|2,0,0]=4 996 B11R1.21 C1=C(C(=CC=C1C(=O)C)F)C AK-48194 [0,2,0,0,0,0|0,0,2]=4 997 B11R1.21 C1=C(C(=CC=C1C(=O)O)C)N AK-34321 [0,2,0,0,0,0|1,0,1]=4 998 B11R1.21 C1=C(C(=CC=C1C(=O)O)N)C AK-34339 [0,2,0,0,0,0|1,0,1]=4 999 B11R1.21 C1=C(C(=CC=C1C(C)=O)F)Br AK-50601 [0,2,0,0,0,0|0,0,2]=4 1000 B11R1.21 C1=C(C(=CC=C1C(O)=O)Cl)O AK-25796 [0,2,0,0,0,0|1,0,1]=4 1001 B11R1.21 C1=C(C(=CC=C1C(O)=O)O)C AK-46719 [0,2,0,0,0,0|1,0,1]=4 1002 B11R1.21 C1=C(C=CC(=C1Br)C)C(O)=O AK-36339 [0,2,0,0,0,0|1,0,1]=4 1003 B11R1.21 C1=C(C=CC(=C1C)Cl)C(O)=O AK-47580 [0,2,0,0,0,0|1,0,1]=4 1004 B11R1.21 C1=C(C=CC(=C1Cl)Cl)C(O)=O AK-46631 [0,2,0,0,0,0|1,0,1]=4 1005 B11R1.21 C1=C(C=CC(=C1F)C)C(O)=O AK-34796 [0,2,0,0,0,0|1,0,1]=4 1006 B11R1.21 C1=C(C=CC(=C1F)F)B(O)O AK-33624 [0,2,0,0,0,0|2,0,0]=4 1007 B11R1.21 C1=C(C=CC(=C1F)F)C(O)=O AK-47373 [0,2,0,0,0,0|1,0,1]=4 1008 B11R1.21 C1=C(C=CC(=C1F)O)C(C)=O AK-42173 [0,2,0,0,0,0|0,0,2]=4 1009 B11R1.21 C1=C(C=CC(=C1O)O)C(O)=O AK-47644 [0,2,0,0,0,0|1,0,1]=4 1010 B11R1.21 C1=C(F)C(=CC=C1B(O)O)C AK-26865 [0,2,0,0,0,0|2,0,0]=4 1011 B11R1.21 C1=C(O)C(=CC=C1C(=O)O)N AK-34278 [0,2,0,0,0,0|1,0,1]=4 1012 B11R1.21 C1=CC(=C(C=C1C(=O)O)I)F AK-35058 [0,2,0,0,0,0|1,0,1]=4 1013 B11R1.21 C1=CC(=C(C=C1C(O)=O)F)N AK-35239 [0,2,0,0,0,0|1,0,1]=4 1014 B11R1.21 C1=CC(=CC(=C1F)Cl)C(=O)C AK-49084 [0,2,0,0,0,0|0,0,2]=4 1015 B11R1.21 CC(C1=CC=C(Br)C(C)=C1)=O AK-65018 [0,2,0,0,0,0|0,0,2]=4 1016 B11R1.21 CC(C1=CC=C(Br)C(Cl)=C1)=O AK114290 [0,2,0,0,0,0|0,0,2]=4 1017 B11R1.21 CC(C1=CC=C(Cl)C(C)=C1)=O AK-51511 [0,2,0,0,0,0|0,0,2]=4 1018 B11R1.21 CC(C1=CC=C(Cl)C(Cl)=C1)=O AK-41915 [0,2,0,0,0,0|0,0,2]=4 1019 B11R1.21 CC(C1=CC=C(Cl)C(N)=C1)=O AK-45178 [0,2,0,0,0,0|0,0,2]=4 1020 B11R1.21 CC(C1=CC=C(F)C(F)=C1)=O AK-53703 [0,2,0,0,0,0|0,0,2]=4 1021 B11R1.21 CC(C1=CC=C(I)C(Br)=C1)=O AK482929 [0,2,0,0,0,0|0,0,2]=4 1022 B11R1.21 CC(C1=CC=C(N)C(F)=C1)=O AK-94340 [0,2,0,0,0,0|0,0,2]=4 1023 B11R1.21 CC(C1=CC=C(O)C(Br)=C1)=O AK201265 [0,2,0,0,0,0|0,0,2]=4 1024 B11R1.21 CC(C1=CC=C(O)C(C)=C1)=O AK-41189 [0,2,0,0,0,0|0,0,2]=4 1025 B11R1.21 CC(C1=CC=C(O)C(O)=C1)=O AK-42350 [0,2,0,0,0,0|0,0,2]=4 1026 B11R1.21 CC1=CC(B(O)O)=CC=C1O AK-85496 [0,2,0,0,0,0|2,0,0]=4 1027 B11R1.21 C[C@@H](N)C1=CC=C(C)C(Cl)=C1 AK134018 [0,2,0,0,0,0|1,0,0]=3 1028 B11R1.21 C[C@@H](N)C1=CC=C(Cl)C(C)=C1 AK-42499 [0,2,0,0,0,0|1,0,0]=3 1029 B11R1.21 C[C@@H](N)C1=CC=C(Cl)C(Cl)=C1 AK172663 [0,2,0,0,0,0|1,0,0]=3 1030 B11R1.21 C[C@@H](N)C1=CC=C(Cl)C(F)=C1 AK-42083 [0,2,0,0,0,0|1,0,0]=3 1031 B11R1.21 C[C@@H](N)C1=CC=C(F)C(Cl)=C1 AK-42066 [0,2,0,0,0,0|1,0,0]=3 1032 B11R1.21 C[C@@H](N)C1=CC=C(F)C(F)=C1 AK-42176 [0,2,0,0,0,0|1,0,0]=3 1033 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Cl)C=C1 AK110178 [0,2,0,0,0,0|1,0,0]=3 1034 B11R1.21 C[C@H](N)C1=CC=C(Br)C(Cl)=C1 AK172718 [0,2,0,0,0,0|1,0,0]=3 1035 B11R1.21 C[C@H](N)C1=CC=C(C)C(Cl)=C1 AK-42498 [0,2,0,0,0,0|1,0,0]=3 1036 B11R1.21 C[C@H](N)C1=CC=C(C)C(F)=C1 AK544256 [0,2,0,0,0,0|1,0,0]=3 1037 B11R1.21 C[C@H](N)C1=CC=C(Cl)C(F)=C1 AK-42082 [0,2,0,0,0,0|1,0,0]=3 1038 B11R1.21 C[C@H](N)C1=CC=C(F)C(Br)=C1 AK338978 [0,2,0,0,0,0|1,0,0]=3 1039 B11R1.21 C[C@H](N)C1=CC=C(F)C(C)=C1 AK-42488 [0,2,0,0,0,0|1,0,0]=3 1040 B11R1.21 C[C@H](N)C1=CC=C(F)C(C)=C1 AK119914 [0,2,0,0,0,0|1,0,0]=3 1041 B11R1.21 C[C@H](N)C1=CC=C(F)C(Cl)=C1 AK-42507 [0,2,0,0,0,0|1,0,0]=3 1042 B11R1.21 C[C@H](N)C1=CC=C(F)C(F)=C1 AK160111 [0,2,0,0,0,0|1,0,0]=3 1043 B11R1.21 FC1=C(C=C(C=C1)B(O)O)O AK-36847 [0,2,0,0,0,0|2,0,0]=4 1044 B11R1.21 FC1=C(C=CC(=C1)C(=O)O)I AK-36475 [0,2,0,0,0,0|1,0,1]=4 1045 B11R1.21 NC1=C(F)C=CC(=C1)B(O)O AK-36640 [0,2,0,0,0,0|2,0,0]=4 1046 B11R1.21 NC1=C(I)C=CC(=C1)C(O)=O AK-82318 [0,2,0,0,0,0|1,0,1]=4 1047 B11R1.21 NC1=C(O)C=CC(=C1)C(O)=O AK-33476 [0,2,0,0,0,0|1,0,1]=4 1048 B11R1.21 NC1=CC(=CC=C1Cl)C(O)=O AK-73058 [0,2,0,0,0,0|1,0,1]=4 1049 B11R1.21 O=C(O)C1=CC=C(Br)C(Br)=C1 AK-64921 [0,2,0,0,0,0|1,0,1]=4 1050 B11R1.21 O=C(O)C1=CC=C(Br)C(C)=C1 AK-26325 [0,2,0,0,0,0|1,0,1]=4 1051 B11R1.21 O=C(O)C1=CC=C(Br)C(Cl)=C1 AK-86432 [0,2,0,0,0,0|1,0,1]=4 1052 B11R1.21 O=C(O)C1=CC=C(Br)C(F)=C1 AK-50383 [0,2,0,0,0,0|1,0,1]=4 1053 B11R1.21 O=C(O)C1=CC=C(Br)C(N)=C1 AK-34514 [0,2,0,0,0,0|1,0,1]=4 1054 B11R1.21 O=C(O)C1=CC=C(C)C(Cl)=C1 AK-73060 [0,2,0,0,0,0|1,0,1]=4 1055 B11R1.21 O=C(O)C1=CC=C(C)C(I)=C1 AK-51540 [0,2,0,0,0,0|1,0,1]=4 1056 B11R1.21 O=C(O)C1=CC=C(C)C(O)=C1 AK-61869 [0,2,0,0,0,0|1,0,1]=4 1057 B11R1.21 O=C(O)C1=CC=C(Cl)C(F)=C1 AK-35057 [0,2,0,0,0,0|1,0,1]=4 1058 B11R1.21 O=C(O)C1=CC=C(F)C(Br)=C1 AK-32644 [0,2,0,0,0,0|1,0,1]=4 1059 B11R1.21 O=C(O)C1=CC=C(F)C(C)=C1 AK-35056 [0,2,0,0,0,0|1,0,1]=4 1060 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 AK-53849 [0,2,0,0,0,0|1,0,1]=4 1061 B11R1.21 O=C(O)C1=CC=C(F)C(N)=C1 AK-34274 [0,2,0,0,0,0|1,0,1]=4 1062 B11R1.21 O=C(O)C1=CC=C(F)C(O)=C1 AK-35418 [0,2,0,0,0,0|1,0,1]=4 1063 B11R1.21 O=C(O)C1=CC=C(I)C(Cl)=C1 AK174208 [0,2,0,0,0,0|1,0,1]=4 1064 B11R1.21 O=C(O)C1=CC=C(I)C(O)=C1 AK-44390 [0,2,0,0,0,0|1,0,1]=4 1065 B11R1.21 O=C(O)C1=CC=C(N)C(Br)=C1 AK-35930 [0,2,0,0,0,0|1,0,1]=4 1066 B11R1.21 O=C(O)C1=CC=C(N)C(Cl)=C1 AK-34340 [0,2,0,0,0,0|1,0,1]=4 1067 B11R1.21 O=C(O)C1=CC=C(N)C(N)=C1 AK-45165 [0,2,0,0,0,0|1,0,1]=4 1068 B11R1.21 O=C(O)C1=CC=C(O)C(F)=C1 AK-34797 [0,2,0,0,0,0|1,0,1]=4 1069 B11R1.21 OB(C1=CC=C(C)C(C)=C1)O AK-45214 [0,2,0,0,0,0|2,0,0]=4 1070 B11R1.21 OB(C1=CC=C(Cl)C(C)=C1)O AK-33546 [0,2,0,0,0,0|2,0,0]=4 1071 B11R1.21 OB(C1=CC=C(F)C(C)=C1)O AK-33223 [0,2,0,0,0,0|2,0,0]=4 1072 B11R1.21 OB(C1=CC=C(O)C(F)=C1)O AK-33809 [0,2,0,0,0,0|2,0,0]=4 1073 B11R1.21 OB(O)C1=CC(F)=C(Cl)C=C1 AK-33192 [0,2,0,0,0,0|2,0,0]=4 1074 B11R1.21 OC(=O)C1=CC(Br)=C(I)C=C1 AK-80847 [0,2,0,0,0,0|1,0,1]=4 1075 B11R1.21 OC(=O)C1=CC(I)=C(Br)C=C1 AK-64714 [0,2,0,0,0,0|1,0,1]=4 1076 B11R1.21 OC(=O)C1=CC(I)=C(Cl)C=C1 AK-35135 [0,2,0,0,0,0|1,0,1]=4 1077 B11R1.21 OC1=CC(B(O)O)=CC=C1Cl AK-93984 [0,2,0,0,0,0|2,0,0]=4 1078 B11R1.21 OC1=CC=C(B(O)O)C=C1Cl AK-61628 [0,2,0,0,0,0|2,0,0]=4 1079 B11R1.22 BrC1=CC=C(C(N)CO)C=C1 AK607944 [0,2,0,0,0,0|1,0,0]=3 1080 B11R1.22 BrC1=CC=C([C@@H](N)CO)C=C1 AK172682 [0,2,0,0,0,0|1,0,0]=3 1081 B11R1.22 C1=C(C=CC(=C1)Br)C(OC)=O AK-47340 [0,2,0,0,0,0|0,0,2]=4 1082 B11R1.22 C1=C(C=CC(=C1)C)C(CBr)=O AK-73063 [0,2,0,0,0,0|0,0,2]=4 1083 B11R1.22 C1=C(C=CC(=C1)Cl)C(CC)=O AK-47430 [0,2,0,0,0,0|0,0,2]=4 1084 B11R1.22 C1=C(C=CC(=C1)N)C(OC)=O AK-48394 [0,2,0,0,0,0|0,0,2]=4 1085 B11R1.22 CC1=CC=C([C@H](N)CO)C=C1 AK544255 [0,2,0,0,0,0|1,0,0]=3 1086 B11R1.22 CCC(C1=CC=C(Br)C=C1)=O AK133038 [0,2,0,0,0,0|0,0,2]=4 1087 B11R1.22 CCC(C1=CC=C(Br)C=C1)N AK116183 [0,2,0,0,0,0|1,0,0]=3 1088 B11R1.22 CCC(C1=CC=C(F)C=C1)=O AK-77665 [0,2,0,0,0,0|0,0,2]=4 1089 B11R1.22 CCC(C1=CC=C(I)C=C1)=O AK149241 [0,2,0,0,0,0|0,0,2]=4 1090 B11R1.22 CCC(C1=CC=C(O)C=C1)=O AK-44068 [0,2,0,0,0,0|0,0,2]=4 1091 B11R1.22 CC[C@@H](C1=CC=C(Br)C=C1)N AK607954 [0,2,0,0,0,0|1,0,0]=3 1092 B11R1.22 CC[C@@H](C1=CC=C(Cl)C=C1)N AK-53923 [0,2,0,0,0,0|1,0,0]=3 1093 B11R1.22 CC[C@H](C1=CC=C(Br)C=C1)N AK172711 [0,2,0,0,0,0|1,0,0]=3 1094 B11R1.22 CC[C@H](C1=CC=C(C)C=C1)N AK-93290 [0,2,0,0,0,0|1,0,0]=3 1095 B11R1.22 CC[C@H](C1=CC=C(Cl)C=C1)N AK133438 [0,2,0,0,0,0|1,0,0]=3 1096 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 AK-42930 [0,2,0,0,0,0|0,0,2]=4 1097 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 AK-57163 [0,2,0,0,0,0|0,0,2]=4 1098 B11R1.22 C[C@@H](NC)C1=CC=C(Cl)C=C1 AK607981 [0,2,0,0,0,0|1,0,0]=3 1099 B11R1.22 C[C@H](NC)C1=CC=C(Br)C=C1 AK172763 [0,2,0,0,0,0|1,0,0]=3 1100 B11R1.22 C[C@H](NC)C1=CC=C(Cl)C=C1 AK607980 [0,2,0,0,0,0|1,0,0]=3 1101 B11R1.22 ClC1=CC=C(C(CN)=O)C=C1 AK-27718 [0,2,0,0,0,0|0,0,2]=4 1102 B11R1.22 ClC1=CC=C([C@@H](N)CO)C=C1 AK486779 [0,2,0,0,0,0|1,0,0]=3 1103 B11R1.22 ClC1=CC=C([C@@H](N)CO)C=N1 AK684516 [0,2,0,0,0,0|2,0,0]=4 1104 B11R1.22 ClC1=CC=C([C@H](N)CO)C=C1 AK607971 [0,2,0,0,0,0|1,0,0]=3 1105 B11R1.22 FC1=CC=C([C@@H](N)CO)C=C1 AK117861 [0,2,0,0,0,0|1,0,0]=3 1106 B11R1.22 FC1=CC=C([C@H](N)CO)C=C1 AK117823 [0,2,0,0,0,0|1,0,0]=3 1107 B11R1.22 FC1=CC=C([C@H](N)CO)C=C1 AK117858 [0,2,0,0,0,0|1,0,0]=3 1108 B11R1.22 IC1=CC=C(C(CBr)=O)C=C1 AK-25760 [0,2,0,0,0,0|0,0,2]=4 1109 B11R1.22 NC(C1=CC=C(F)C=C1)CC AK470003 [0,2,0,0,0,0|1,0,0]=3 1110 B11R1.22 NC1=CC=C(C(C)CC)C=C1 AK-76838 [0,2,0,0,0,0|1,0,0]=3 1111 B11R1.22 NCC(=O)C1=CC=C(C=C1)F AK-32227 [0,2,0,0,0,0|0,0,2]=4 1112 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 AK101127 [0,2,0,0,0,0|0,0,2]=4 1113 B11R1.22 NCC(C1=CC=C(Br)C=C1)=O AK-42272 [0,2,0,0,0,0|0,0,2]=4 1114 B11R1.22 NCC(O)C1=CC=C(O)C=C1 AK163650 [0,2,0,0,0,0|0,0,0]=2 1115 B11R1.22 N[C@@H](C1=CC=C(F)C=C1)CC AK-42100 [0,2,0,0,0,0|1,0,0]=3 1116 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 AK101499 [0,2,0,0,0,0|1,0,0]=3 1117 B11R1.22 N[C@H](C1=CC=C(F)C=C1)CC AK-42091 [0,2,0,0,0,0|1,0,0]=3 1118 B11R1.22 O=C(C1=CC=C(Br)C=C1)CCl AK-41703 [0,2,0,0,0,0|0,0,2]=4 1119 B11R1.22 O=C(NC)C1=CC=C(Br)C=C1 AK-86242 [0,2,0,0,0,0|0,0,2]=4 1120 B11R1.22 O=C(OC)C1=CC=C(C)C=C1 AK110414 [0,2,0,0,0,0|0,0,2]=4 1121 B11R1.22 O=C(OC)C1=CC=C(F)C=C1 AK-45398 [0,2,0,0,0,0|0,0,2]=4 1122 B11R1.22 O=C(OC)C1=CC=C(I)C=C1 AK-45406 [0,2,0,0,0,0|0,0,2]=4 1123 B11R1.22 O=C(OC)C1=CC=C(O)C=C1 AK-54335 [0,2,0,0,0,0|0,0,2]=4 1124 B11R1.22 OC1=CC=C(C(C)CN)C=C1 AK-47813 [0,2,0,0,0,0|1,0,0]=3 1125 B11R1.22 OC1=CC=C(C=C1)C(=O)CBr AK-34343 [0,2,0,0,0,0|0,0,2]=4 1126 B11R1.22 OC1=CC=C([C@@H](N)CO)C=C1 AK544250 [0,2,0,0,0,0|1,0,0]=3 1127 B11R1.22 OC1=CC=C([C@H](N)CO)C=C1 AK608028 [0,2,0,0,0,0|1,0,0]=3 1128 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 AK110007 [0,2,0,0,0,0|0,0,0]=2 1129 B11R1.22 OC[C@@H](N)C1=CC=C(Br)C=C1 AK338220 [0,2,0,0,0,0|1,0,0]=3 1130 B11R1.22 OC[C@H](N)C1=CC=C(Br)C=C1 AK202041 [0,2,0,0,0,0|1,0,0]=3 1131 B11R1.166 BrC1=C(C(=O)O)C=CC(=C1)Cl AK-36919 [0,2,0,0,0,0|1,0,1]=4 1132 B11R1.166 C1=C(C(=CC(=C1)Br)N)C(=O)O AK-34046 [0,2,0,0,0,0|1,0,1]=4 1133 B11R1.166 C1=C(C(=CC(=C1)Cl)I)C(O)=O AK-46379 [0,2,0,0,0,0|1,0,1]=4 1134 B11R1.166 C1=C(C(=CC(=C1)Cl)N)C(O)=O AK-36798 [0,2,0,0,0,0|1,0,1]=4 1135 B11R1.166 C1=C(C(=CC=C1C)B(O)O)Cl AK-39980 [0,2,0,0,0,0|2,0,0]=4 1136 B11R1.166 C1=C(C(=CC=C1C)C(=O)O)N AK-25621 [0,2,0,0,0,0|1,0,1]=4 1137 B11R1.166 C1=C(C(=CC=C1Cl)C(C)=O)Cl AK-47301 [0,2,0,0,0,0|0,0,2]=4 1138 B11R1.166 C1=C(C(=CC=C1N)C(=O)O)C AK-27038 [0,2,0,0,0,0|1,0,1]=4 1139 B11R1.166 C1=C(Cl)C=CC(=C1F)B(O)O AK-33526 [0,2,0,0,0,0|2,0,0]=4 1140 B11R1.166 C1=C(F)C=CC(=C1F)B(O)O AK-33282 [0,2,0,0,0,0|2,0,0]=4 1141 B11R1.166 C1=CC(=C(C=C1N)Cl)C(O)=O AK-29059 [0,2,0,0,0,0|1,0,1]=4 1142 B11R1.166 C1=CC(=CC(=C1B(O)O)Cl)Cl AK-36109 [0,2,0,0,0,0|2,0,0]=4 1143 B11R1.166 C1=CC(=CC(=C1C(C)=O)F)F AK-46615 [0,2,0,0,0,0|0,0,2]=4 1144 B11R1.166 C1=CC(=CC(=C1C(C)=O)F)O AK-49094 [0,2,0,0,0,0|0,0,2]=4 1145 B11R1.166 C1=CC(=CC(=C1C(O)=O)Br)Br AK-45532 [0,2,0,0,0,0|1,0,1]=4 1146 B11R1.166 C1=CC(=CC(=C1C(O)=O)C)Br AK-26260 [0,2,0,0,0,0|1,0,1]=4 1147 B11R1.166 C1=CC(=CC(=C1C(O)=O)C)C AK-47303 [0,2,0,0,0,0|1,0,1]=4 1148 B11R1.166 C1=CC(=CC(=C1C(O)=O)C)Cl AK-32606 [0,2,0,0,0,0|1,0,1]=4 1149 B11R1.166 C1=CC(=CC(=C1C(O)=O)Cl)Cl AK-46538 [0,2,0,0,0,0|1,0,1]=4 1150 B11R1.166 C1=CC(=CC(=C1C(O)=O)F)C AK-26324 [0,2,0,0,0,0|1,0,1]=4 1151 B11R1.166 C1=CC(=CC(=C1C(O)=O)F)F AK-49138 [0,2,0,0,0,0|1,0,1]=4 1152 B11R1.166 C1=CC(=CC(=C1C(O)=O)F)N AK-25984 [0,2,0,0,0,0|1,0,1]=4 1153 B11R1.166 C1=CC(=CC(=C1C(O)=O)O)C AK-73066 [0,2,0,0,0,0|1,0,1]=4 1154 B11R1.166 C1=CC(=CC(=C1C(O)=O)O)Cl AK-47585 [0,2,0,0,0,0|1,0,1]=4 1155 B11R1.166 C1=CC(=CC(=C1C(O)=O)O)F AK-29195 [0,2,0,0,0,0|1,0,1]=4 1156 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 AK-75553 [0,2,0,0,0,0|0,0,2]=4 1157 B11R1.166 CC(C1=CC=C(Br)C=C1Cl)=O AK-77175 [0,2,0,0,0,0|0,0,2]=4 1158 B11R1.166 CC(C1=CC=C(Br)C=C1F)=O AK-46535 [0,2,0,0,0,0|0,0,2]=4 1159 B11R1.166 CC(C1=CC=C(Br)C=C1N)=O AK-38008 [0,2,0,0,0,0|0,0,2]=4 1160 B11R1.166 CC(C1=CC=C(Br)C=C1O)=O AK-40002 [0,2,0,0,0,0|0,0,2]=4 1161 B11R1.166 CC(C1=CC=C(C)C=C1F)=O AK115609 [0,2,0,0,0,0|0,0,2]=4 1162 B11R1.166 CC(C1=CC=C(Cl)C=C1Br)=O AK-75637 [0,2,0,0,0,0|0,0,2]=4 1163 B11R1.166 CC(C1=CC=C(F)C=C1Cl)=O AK-53695 [0,2,0,0,0,0|0,0,2]=4 1164 B11R1.166 CC(C1=CC=C(O)C=C1Br)=O AK-75734 [0,2,0,0,0,0|0,0,2]=4 1165 B11R1.166 CC(C1=CC=C(O)C=C1C)=O AK-50197 [0,2,0,0,0,0|0,0,2]=4 1166 B11R1.166 CC(C1=CC=C(O)C=C1Cl)=O AK-36102 [0,2,0,0,0,0|0,0,2]=4 1167 B11R1.166 CC(C1=CC=C(O)C=C1O)=O AK-50224 [0,2,0,0,0,0|0,0,2]=4 1168 B11R1.166 CC1=C(C=CC(=C1)C)B(O)O AK-35632 [0,2,0,0,0,0|2,0,0]=4 1169 B11R1.166 CC1=CC=C(C(Br)=C1)N(C)C AK136564 [0,2,0,0,0,0|2,0,0]=4 1170 B11R1.166 C[C@@H](N)C1=CC=C(Br)C=C1F AK544258 [0,2,0,0,0,0|1,0,0]=3 1171 B11R1.166 C[C@@H](N)C1=CC=C(Cl)C=C1C AK134023 [0,2,0,0,0,0|1,0,0]=3 1172 B11R1.166 C[C@@H](N)C1=CC=C(F)C=C1F AK-45015 [0,2,0,0,0,0|1,0,0]=3 1173 B11R1.166 C[C@H](N)C1=CC=C(Br)C=C1F AK189376 [0,2,0,0,0,0|1,0,0]=3 1174 B11R1.166 C[C@H](N)C1=CC=C(Cl)C=C1C AK134048 [0,2,0,0,0,0|1,0,0]=3 1175 B11R1.166 C[C@H](N)C1=CC=C(Cl)C=C1Cl AK130493 [0,2,0,0,0,0|1,0,0]=3 1176 B11R1.166 C[C@H](N)C1=CC=C(F)C=C1F AK-73153 [0,2,0,0,0,0|1,0,0]=3 1177 B11R1.166 ClC1=CC(=C(C=C1)B(O)O)C AK-28971 [0,2,0,0,0,0|2,0,0]=4 1178 B11R1.166 ClC1=CC(=C(C=C1)C(C)=O)F AK-46375 [0,2,0,0,0,0|0,0,2]=4 1179 B11R1.166 FC1=C(C(=O)O)C=CC(=C1)I AK-33039 [0,2,0,0,0,0|1,0,1]=4 1180 B11R1.166 FC1=C(C=CC(=C1)C)B(O)O AK-27195 [0,2,0,0,0,0|2,0,0]=4 1181 B11R1.166 FC1=C(C=CC(=C1)F)[C@H](C)N AK-42963 [0,2,0,0,0,0|1,0,0]=3 1182 B11R1.166 NC1=CC(=C(C=C1)C(C)=O)O AK-34336 [0,2,0,0,0,0|0,0,2]=4 1183 B11R1.166 N[C@H](C1=CC=C(C)C=C1C)C AK477325 [0,2,0,0,0,0|1,0,0]=3 1184 B11R1.166 O=C(O)C1=CC=C(Br)C=C1Cl AK-40035 [0,2,0,0,0,0|1,0,1]=4 1185 B11R1.166 O=C(O)C1=CC=C(Br)C=C1F AK-45932 [0,2,0,0,0,0|1,0,1]=4 1186 B11R1.166 O=C(O)C1=CC=C(Br)C=C1I AK-73142 [0,2,0,0,0,0|1,0,1]=4 1187 B11R1.166 O=C(O)C1=CC=C(Br)C=C1O AK-44937 [0,2,0,0,0,0|1,0,1]=4 1188 B11R1.166 O=C(O)C1=CC=C(C)C=C1Br AK-36340 [0,2,0,0,0,0|1,0,1]=4 1189 B11R1.166 O=C(O)C1=CC=C(C)C=C1Cl AK-36338 [0,2,0,0,0,0|1,0,1]=4 1190 B11R1.166 O=C(O)C1=CC=C(C)C=C1I AK201253 [0,2,0,0,0,0|1,0,1]=4 1191 B11R1.166 O=C(O)C1=CC=C(F)C=C1Br AK-32641 [0,2,0,0,0,0|1,0,1]=4 1192 B11R1.166 O=C(O)C1=CC=C(F)C=C1C AK-34672 [0,2,0,0,0,0|1,0,1]=4 1193 B11R1.166 O=C(O)C1=CC=C(F)C=C1I AK-29400 [0,2,0,0,0,0|1,0,1]=4 1194 B11R1.166 O=C(O)C1=CC=C(F)C=C1N AK-25985 [0,2,0,0,0,0|1,0,1]=4 1195 B11R1.166 O=C(O)C1=CC=C(I)C=C1N AK-34047 [0,2,0,0,0,0|1,0,1]=4 1196 B11R1.166 O=C(O)C1=CC=C(N)C=C1O AK-46320 [0,2,0,0,0,0|1,0,1]=4 1197 B11R1.166 O=C(O)C1=CC=C(O)C=C1C AK-40693 [0,2,0,0,0,0|1,0,1]=4 1198 B11R1.166 O=C(O)C1=CC=C(O)C=C1F AK-35989 [0,2,0,0,0,0|1,0,1]=4 1199 B11R1.166 O=C(O)C1=CC=C(O)C=C1O AK-88714 [0,2,0,0,0,0|1,0,1]=4 1200 B11R1.166 OB(C1=CC=C(F)C=C1C)O AK-33224 [0,2,0,0,0,0|2,0,0]=4 1201 B11R1.166 OB(C1=CC=C(F)C=C1Cl)O AK-34635 [0,2,0,0,0,0|2,0,0]=4 1202 B11R1.166 OB(C1=CC=C(F)C=C1O)O AK-46419 [0,2,0,0,0,0|2,0,0]=4 1203 B11R1.166 OB(C1=CC=C(O)C=C1C)O AK-29297 [0,2,0,0,0,0|2,0,0]=4 1204 B11R1.166 OB(C1=CC=C(O)C=C1Cl)O AK-43746 [0,2,0,0,0,0|2,0,0]=4 1205 B11R1.166 OB(O)C1=C(F)C=C(I)C=C1 AK-25870 [0,2,0,0,0,0|2,0,0]=4 1206 B11R1.166 OC(=O)C1=C(Br)C=C(I)C=C1 AK-61744 [0,2,0,0,0,0|1,0,1]=4 1207 B11R1.166 OC1=CC=C(B(O)O)C(F)=C1 AK-62257 [0,2,0,0,0,0|2,0,0]=4 1208 B11R1.166 OC1=CC=C(C(C)C)C(C)=C1 AK113729 [0,2,0,0,0,0|1,0,0]=3 1209 B11R1.166 OC1=CC=C(C(C)C)C(O)=C1 AK-81550 [0,2,0,0,0,0|1,0,0]=3 1210 B11R1.7 CC(C1=CC=CC=C1)(C)CN AK117158 [0,2,0,0,0,0|1,0,0]=3 1211 B11R1.7 CC(O)(C1=CC=CC=C1)C#C AK305661 [0,2,0,0,0,0|0,0,0]=2 1212 B11R1.7 CCC(C1=CC=CC=C1)(C)C AK-96688 [0,2,0,0,0,0|1,0,0]=3 1213 B11R1.7 O=S(C1=CC=CC=C1)(CCl)=O AK116676 [0,2,0,0,0,0|1,0,1]=4 1214 B11R1.12 COC(C1=CC=CC=C1)CO AK-49663 [0,2,0,0,0,0|0,0,0]=2 1215 B11R1.12 COC(C1=NC=NC=C1)OC AK-26885 [0,2,0,0,0,0|2,0,0]=4 1216 B11R1.12 OCC(C1=CC=CC=C1)CO AK-39914 [0,2,0,0,0,0|0,0,0]=2 1217 B11R1.16 C=CC[C@H](C1=CC=CC=C1)N AK172643 [0,2,0,0,0,0|1,0,0]=3 1218 B11R1.16 CCCC(C1=CC=CC=C1)=O AK164430 [0,2,0,0,0,0|0,0,2]=4 1219 B11R1.16 CCCC(C1=CC=NC=C1)N AK687508 [0,2,0,0,0,0|2,0,0]=4 1220 B11R1.16 ClCCC(O)C1=CC=CC=C1 AK-40050 [0,2,0,0,0,0|0,0,0]=2 1221 B11R1.16 N#CCC(C1=CC=CC=C1)=O AK-43072 [0,2,0,0,0,0|0,0,2]=4 1222 B11R1.16 N#CCC(O)C1=CC=CC=C1 AK-63411 [0,2,0,0,0,0|0,0,0]=2 1223 B11R1.16 N[C@@H](C1=CC=CC=C1)CCO AK-33656 [0,2,0,0,0,0|1,0,0]=3 1224 B11R1.16 O=C(OCCl)C1=CC=CC=C1 AK-86220 [0,2,0,0,0,0|0,0,2]=4 1225 B11R1.16 OC(C1=CC=CC=C1)CCN AK206233 [0,2,0,0,0,0|0,0,0]=2 1226 B11R1.16 OCCC(N)C1=CC=CC=C1 AK-33310 [0,2,0,0,0,0|1,0,0]=3 1227 B11R1.16 OCC[C@H](N)C1=CC=CC=C1 AK-36482 [0,2,0,0,0,0|1,0,0]=3 1228 B11R1.16 O[C@@H](C1=CC=CC=C1)CCCl AK-25234 [0,2,0,0,0,0|0,0,0]=2 1229 B11R1.16 O[C@H](C1=CC=CC=C1)CCCl AK-31989 [0,2,0,0,0,0|0,0,0]=2 1230 B11R1.23 BrC1=CC(C(N)CO)=CC=C1 AK321205 [0,2,0,0,0,0|1,0,0]=3 1231 B11R1.23 BrC1=CC([C@@H](N)CO)=CC=C1 AK160001 [0,2,0,0,0,0|1,0,0]=3 1232 B11R1.23 BrC1=CC([C@H](N)CO)=CC=C1 AK167556 [0,2,0,0,0,0|1,0,0]=3 1233 B11R1.23 C1=C(C=CC=C1C(OC)=O)O AK-47384 [0,2,0,0,0,0|0,0,2]=4 1234 B11R1.23 C1=C(C=CC=C1F)C(CBr)=O AK-45729 [0,2,0,0,0,0|0,0,2]=4 1235 B11R1.23 CC(NC)C1=CC=CC(Br)=C1 AK608016 [0,2,0,0,0,0|1,0,0]=3 1236 B11R1.23 CC1=CC(C(CBr)=O)=CC=C1 AK-43564 [0,2,0,0,0,0|0,0,2]=4 1237 B11R1.23 CC1=CC([C@H](N)CO)=CC=C1 AK548236 [0,2,0,0,0,0|1,0,0]=3 1238 B11R1.23 CCC(=O)C1=CC=CC(Cl)=C1 AK101591 [0,2,0,0,0,0|0,0,2]=4 1239 B11R1.23 CCC(C1=CC=CC(F)=C1)=O AK548314 [0,2,0,0,0,0|0,0,2]=4 1240 B11R1.23 CCC(C1=CC=CC(O)=C1)=O AK-45536 [0,2,0,0,0,0|0,0,2]=4 1241 B11R1.23 CC[C@@H](C1=CC=CC(Br)=C1)N AK687502 [0,2,0,0,0,0|1,0,0]=3 1242 B11R1.23 CC[C@@H](C1=CC=CC(F)=C1)N AK134091 [0,2,0,0,0,0|1,0,0]=3 1243 B11R1.23 CC[C@H](C1=CC=CC(C)=C1)N AK134022 [0,2,0,0,0,0|1,0,0]=3 1244 B11R1.23 CC[C@H](C1=CC=CC(Cl)=C1)N AK153385 [0,2,0,0,0,0|1,0,0]=3 1245 B11R1.23 CC[C@H](C1=CC=CC(F)=C1)N AK-42095 [0,2,0,0,0,0|1,0,0]=3 1246 B11R1.23 ClC1=CC(C(CBr)=O)=CC=C1 AK-47073 [0,2,0,0,0,0|0,0,2]=4 1247 B11R1.23 ClC1=CC([C@@H](N)CO)=CC=C1 AK143424 [0,2,0,0,0,0|1,0,0]=3 1248 B11R1.23 ClC1=CC([C@H](N)CO)=CC=C1 AK143359 [0,2,0,0,0,0|1,0,0]=3 1249 B11R1.23 ClC1=CC([C@H](N)CO)=CC=C1 AK172770 [0,2,0,0,0,0|1,0,0]=3 1250 B11R1.23 FC1=CC([C@@H](N)CO)=CC=C1 AK607953 [0,2,0,0,0,0|1,0,0]=3 1251 B11R1.23 FC1=CC([C@H](N)CO)=CC=C1 AK159103 [0,2,0,0,0,0|1,0,0]=3 1252 B11R1.23 FC1=CC([C@H](N)CO)=CC=C1 AK548219 [0,2,0,0,0,0|1,0,0]=3 1253 B11R1.23 FC1=CC=CC(=C1)C(=O)OC AK-47674 [0,2,0,0,0,0|0,0,2]=4 1254 B11R1.23 FC1=CC=CC(C(N)CO)=N1 AK543202 [0,2,0,0,0,0|2,0,0]=4 1255 B11R1.23 O=C(NC)C1=CC=CC(N)=C1 AK-34399 [0,2,0,0,0,0|0,0,2]=4 1256 B11R1.23 O=C(OC)C1=CC=CC(Br)=C1 AK-73031 [0,2,0,0,0,0|0,0,2]=4 1257 B11R1.23 O=C(OC)C1=CC=CC(Cl)=C1 AK117218 [0,2,0,0,0,0|0,0,2]=4 1258 B11R1.23 O=C(OC)C1=CC=CC(I)=C1 AK-81947 [0,2,0,0,0,0|0,0,2]=4 1259 B11R1.23 O=C(OC)C1=CC=CC(N)=C1 AK-43961 [0,2,0,0,0,0|0,0,2]=4 1260 B11R1.23 OC1=CC=CC(C(N)CO)=C1 AK608024 [0,2,0,0,0,0|1,0,0]=3 1261 B11R1.23 OC[C@H](O)C1=CC(Cl)=CC=C1 AK-45027 [0,2,0,0,0,0|0,0,0]=2 1262 B11R1.23 O[C@@H](CCl)C1=CC(Cl)=CC=C1 AK-79203 [0,2,0,0,0,0|0,0,0]=2 1263 B11R1.222 C1=CC=CC(=C1C(OC)=O)Br AK-72980 [0,2,0,0,0,0|0,0,2]=4 1264 B11R1.222 CC(C1=CC=CC=C1C)C#N AK165081 [0,2,0,0,0,0|1,0,0]=3 1265 B11R1.222 CCC(C1=CC=CC=C1Cl)=O AK-86142 [0,2,0,0,0,0|0,0,2]=4 1266 B11R1.222 CCC(C1=CC=CC=C1F)N AK544261 [0,2,0,0,0,0|1,0,0]=3 1267 B11R1.222 CCC(C1=NC=CC=C1C)N AK670798 [0,2,0,0,0,0|2,0,0]=4 1268 B11R1.222 CC[C@@H](C1=CC=CC=C1F)N AK134089 [0,2,0,0,0,0|1,0,0]=3 1269 B11R1.222 COC(=O)C1=C(N)C=CC=C1 AK-41339 [0,2,0,0,0,0|0,0,2]=4 1270 B11R1.222 ClC1=C(C(N)CO)C=CN=C1 AK501386 [0,2,0,0,0,0|2,0,0]=4 1271 B11R1.222 ClC1=CC=CC=C1[C@H](N)CO AK548235 [0,2,0,0,0,0|1,0,0]=3 1272 B11R1.222 FC1=CC=CC=C1C(CF)=O AK198962 [0,2,0,0,0,0|0,0,2]=4 1273 B11R1.222 NC1=CC=CC=C1C(C)CC AK122191 [0,2,0,0,0,0|1,0,0]=3 1274 B11R1.222 NCC(=O)C1=C(C=CC=C1)F AK-70904 [0,2,0,0,0,0|0,0,2]=4 1275 B11R1.222 N[C@@H](C1=CC=CC=C1C)CC AK-42242 [0,2,0,0,0,0|1,0,0]=3 1276 B11R1.222 N[C@H](C1=CC=CC=C1Cl)CC AK-42248 [0,2,0,0,0,0|1,0,0]=3 1277 B11R1.222 O=C(NC)C1=CC=CC=C1N AK-26614 [0,2,0,0,0,0|0,0,2]=4 1278 B11R1.222 O=C(OC)C1=CC=CC=C1C AK174020 [0,2,0,0,0,0|0,0,2]=4 1279 B11R1.222 O=C(OC)C1=CC=CC=C1Cl AK161838 [0,2,0,0,0,0|0,0,2]=4 1280 B11R1.222 O=C(OC)C1=CC=CC=C1I AK-76653 [0,2,0,0,0,0|0,0,2]=4 1281 B11R1.222 O=C(OC)C1=CC=CC=C1S AK554462 [0,2,0,0,0,0|0,0,2]=4 1282 B11R1.222 OC1=CC=CC=C1C(NO)=O AK-48843 [0,2,0,0,0,0|1,0,1]=4 1283 B11R1.222 O[C@@H](C1=CC=CC=C1Cl)CO AK-44949 [0,2,0,0,0,0|0,0,0]=2 1284 B11R1.87 C1(=CC=CC=C1[S](=O)(=O)O)C AK-37104 [0,2,0,0,0,0|2,0,0]=4 1285 B11R1.87 C1=CC=CC(=C1C(F)(F)F)O AK-50536 [0,2,0,0,0,0|2,0,0]=4 1286 B11R1.87 CC(C)(O)C1=C(Br)C=CC=C1 AK-38217 [0,2,0,0,0,0|0,0,0]=2 1287 B11R1.87 CC(C1=CC=CC=C1Br)(C)C AK148384 [0,2,0,0,0,0|1,0,0]=3 1288 B11R1.87 CC(N)(C1=CC=CC=C1Br)C AK122030 [0,2,0,0,0,0|1,0,0]=3 1289 B11R1.87 CC(O)(C1=CC=CC=C1N)C AK125202 [0,2,0,0,0,0|0,0,0]=2 1290 B11R1.87 CC(O)(C1=NC=CC=C1Br)C AK167904 [0,2,0,0,0,0|1,0,0]=3 1291 B11R1.87 CP(C)(=O)C1=C(N)C=CC=C1 AK103382 [0,2,0,0,0,0|1,0,1]=4 1292 B11R1.87 FC(C1=CC=CC=C1C)(F)F AK-53820 [0,2,0,0,0,0|2,0,0]=4 1293 B11R1.87 FC(C1=CC=CC=C1I)(F)F AK142843 [0,2,0,0,0,0|2,0,0]=4 1294 B11R1.87 NC1=C(C=CC=C1)S(O)(=O)=O AK-53459 [0,2,0,0,0,0|2,0,0]=4 1295 B11R1.87 NC1=CC=CC=C1C(C)(C)C AK-77148 [0,2,0,0,0,0|1,0,0]=3 1296 B11R1.87 O=S(C1=CC=CC=C1C)(O)=O AK305179 [0,2,0,0,0,0|2,0,0]=4 1297 B11R1.155 CC(N)(C1=CC=CC(F)=C1)C AK164905 [0,2,0,0,0,0|1,0,0]=3 1298 B11R1.155 CC(O)(C1=CC(Br)=NC=C1)C AK167907 [0,2,0,0,0,0|1,0,0]=3 1299 B11R1.155 CC(O)(C1=CC=CC(Br)=C1)C AK-41777 [0,2,0,0,0,0|0,0,0]=2 1300 B11R1.155 CC(O)(C1=NC=CC(Br)=C1)C AK123539 [0,2,0,0,0,0|1,0,0]=3 1301 B11R1.155 ClC1=NC=CC(C(C)(C)C)=C1 AK155433 [0,2,0,0,0,0|2,0,0]=4 1302 B11R1.155 FC(F)(F)C1=CC=CC(Br)=C1 AK-44666 [0,2,0,0,0,0|2,0,0]=4 1303 B11R1.155 NC1=CC=CC(C(C)(C)C)=C1 AK-39836 [0,2,0,0,0,0|1,0,0]=3 1304 B11R1.155 O=S(C1=CC(Br)=CC=C1)(C)=O AK-49145 [0,2,0,0,0,0|1,0,1]=4 1305 B11R1.155 OC1=CC=CC(C(C)(O)C)=C1 AK116134 [0,2,0,0,0,0|0,0,0]=2 1306 B11R1.155 OC1=CC=CC(C(F)(F)F)=C1 AK-44156 [0,2,0,0,0,0|2,0,0]=4 1307 B11R1.53 C1=C(C(=CC=C1)CBr)B(O)O AK-32248 [0,2,0,0,0,0|2,0,0]=4 1308 B11R1.53 C1=CC=CC(=C1C#N)C(C)=O AK-50565 [0,2,0,0,0,0|0,0,2]=4 1309 B11R1.53 C1=CC=CC(=C1C=O)C(O)=O AK-46701 [0,2,0,0,0,0|1,0,1]=4 1310 B11R1.53 C1=CC=CC(=C1CCl)C(O)=O AK-44122 [0,2,0,0,0,0|1,0,1]=4 1311 B11R1.53 CC(C1=CC=CC=C1NC)=O AK135397 [0,2,0,0,0,0|0,0,2]=4 1312 B11R1.53 N#CC1=CC=CC=C1C(O)C AK144989 [0,2,0,0,0,0|0,0,0]=2 1313 B11R1.53 NCC1=CC=CC=C1B(O)O AK115627 [0,2,0,0,0,0|2,0,0]=4 1314 B11R1.53 O=C(O)C1=CC=CC=C1C#C AK129466 [0,2,0,0,0,0|1,0,1]=4 1315 B11R1.53 O=C(O)C1=CC=CC=C1CC AK-77452 [0,2,0,0,0,0|1,0,1]=4 1316 B11R1.53 O=C(O)C1=CC=CC=C1CO AK-35845 [0,2,0,0,0,0|1,0,1]=4 1317 B11R1.53 O=C(O)C1=CC=CC=C1OC AK-77451 [0,2,0,0,0,0|1,0,1]=4 1318 B11R1.53 O=CC1=CC=CC=C1B(O)O AK-40715 [0,2,0,0,0,0|2,0,0]=4 1319 B11R1.53 OB(C1=CC=CC=C1CC)O AK-48806 [0,2,0,0,0,0|2,0,0]=4 1320 B11R1.53 OB(C1=CC=CC=C1OC)O AK-25218 [0,2,0,0,0,0|2,0,0]=4 1321 B11R1.53 OB(C1=CC=CC=C1SC)O AK-47931 [0,2,0,0,0,0|2,0,0]=4 1322 B11R1.53 OB(O)C1=C(C=C)C=CC=C1 AK-45480 [0,2,0,0,0,0|2,0,0]=4 1323 B11R1.53 OCC1=CC=CC=C1B(O)O AK-36634 [0,2,0,0,0,0|2,0,0]=4 1324 B11R1.156 BrC1=C(C(=O)O)C(=CC=C1)C AK-29573 [0,2,0,0,0,0|1,0,1]=4 1325 B11R1.156 C1=C(C(=C(C=C1)Cl)C(O)=O)C AK-24771 [0,2,0,0,0,0|1,0,1]=4 1326 B11R1.156 C1=C(C(=C(C=C1)Cl)C(O)=O)F AK-27185 [0,2,0,0,0,0|1,0,1]=4 1327 B11R1.156 C1=C(C(=C(C=C1)Cl)C(O)=O)O AK-39316 [0,2,0,0,0,0|1,0,1]=4 1328 B11R1.156 C1=CC(=C(C(=O)O)C(=C1)C)O AK-35673 [0,2,0,0,0,0|1,0,1]=4 1329 B11R1.156 CC(=O)C1=C(C)C=CC=C1C AK110169 [0,2,0,0,0,0|0,0,2]=4 1330 B11R1.156 CC(=O)C1=C(N)C=CC=C1Br AK-99977 [0,2,0,0,0,0|0,0,2]=4 1331 B11R1.156 CC(C1=C(C)C=CC=C1O)=O AK-64408 [0,2,0,0,0,0|0,0,2]=4 1332 B11R1.156 CC(C1=C(Cl)C=CC=C1Cl)=O AK-51041 [0,2,0,0,0,0|0,0,2]=4 1333 B11R1.156 CC(C1=C(F)C=CC=C1Br)=O AK-31670 [0,2,0,0,0,0|0,0,2]=4 1334 B11R1.156 CC(C1=C(F)C=CC=C1Cl)=O AK-77336 [0,2,0,0,0,0|0,0,2]=4 1335 B11R1.156 CC(C1=C(F)C=CC=C1F)=O AK-33179 [0,2,0,0,0,0|0,0,2]=4 1336 B11R1.156 CC(C1=C(F)C=CC=C1N)=O AK145194 [0,2,0,0,0,0|0,0,2]=4 1337 B11R1.156 CC(C1=C(O)C=CC=C1Br)=O AK-31671 [0,2,0,0,0,0|0,0,2]=4 1338 B11R1.156 CC(C1=C(O)C=CC=C1Cl)=O AK-29397 [0,2,0,0,0,0|0,0,2]=4 1339 B11R1.156 CC(C1=C(O)C=CC=C1F)=O AK-86499 [0,2,0,0,0,0|0,0,2]=4 1340 B11R1.156 CC(C1=C(O)C=CC=C1O)=O AK-47368 [0,2,0,0,0,0|0,0,2]=4 1341 B11R1.156 CC(N)C1=C(Cl)C=CC=C1Cl AK-68659 [0,2,0,0,0,0|1,0,0]=3 1342 B11R1.156 CC(N)C1=C(F)C=CC=C1Cl AK607949 [0,2,0,0,0,0|1,0,0]=3 1343 B11R1.156 CC(O)C1=C(Cl)C=NC=C1Cl AK544619 [0,2,0,0,0,0|1,0,0]=3 1344 B11R1.156 CC(O)C1=C(F)C=CC=C1Br AK144493 [0,2,0,0,0,0|0,0,0]=2 1345 B11R1.156 CC1=C(B(O)O)C(C)=CC=C1 AK-32626 [0,2,0,0,0,0|2,0,0]=4 1346 B11R1.156 C[C@@H](N)C1=C(C)C=CC=C1C AK-42481 [0,2,0,0,0,0|1,0,0]=3 1347 B11R1.156 C[C@@H](N)C1=C(Cl)C=CC=C1Cl AK-93232 [0,2,0,0,0,0|1,0,0]=3 1348 B11R1.156 C[C@@H](N)C1=C(F)C=CC=C1Cl AK134065 [0,2,0,0,0,0|1,0,0]=3 1349 B11R1.156 C[C@@H](N)C1=C(F)C=CC=C1F AK-42489 [0,2,0,0,0,0|1,0,0]=3 1350 B11R1.156 C[C@H](N)C1=C(C)C=CC=C1C AK-42483 [0,2,0,0,0,0|1,0,0]=3 1351 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1Cl AK607972 [0,2,0,0,0,0|1,0,0]=3 1352 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1Cl AK134087 [0,2,0,0,0,0|1,0,0]=3 1353 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1F AK-42490 [0,2,0,0,0,0|1,0,0]=3 1354 B11R1.156 C[C@H](O)C1=C(Cl)C=NC=C1Cl AK104658 [0,2,0,0,0,0|1,0,0]=3 1355 B11R1.156 FC1=C(B(O)O)C(Br)=CC=C1 AK-62111 [0,2,0,0,0,0|2,0,0]=4 1356 B11R1.156 FC1=C(C(=O)O)C(=CC=C1)C AK-23633 [0,2,0,0,0,0|1,0,1]=4 1357 B11R1.156 NC(C1=C(F)C=CC=C1F)C AK405737 [0,2,0,0,0,0|1,0,0]=3 1358 B11R1.156 NC1=C(C(=O)O)C(=CC=C1)Br AK-30472 [0,2,0,0,0,0|1,0,1]=4 1359 B11R1.156 NC1=C(C(O)=O)C(Cl)=CC=C1 AK-34098 [0,2,0,0,0,0|1,0,1]=4 1360 B11R1.156 O=C(O)C1=C(C)C=CC=C1C AK-26211 [0,2,0,0,0,0|1,0,1]=4 1361 B11R1.156 O=C(O)C1=C(C)C=CC=C1N AK-35168 [0,2,0,0,0,0|1,0,1]=4 1362 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1Br AK-26454 [0,2,0,0,0,0|1,0,1]=4 1363 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1Cl AK-57133 [0,2,0,0,0,0|1,0,1]=4 1364 B11R1.156 O=C(O)C1=C(F)C=CC=C1Br AK-25617 [0,2,0,0,0,0|1,0,1]=4 1365 B11R1.156 O=C(O)C1=C(F)C=CC=C1F AK-25893 [0,2,0,0,0,0|1,0,1]=4 1366 B11R1.156 O=C(O)C1=C(F)C=CC=C1N AK-35156 [0,2,0,0,0,0|1,0,1]=4 1367 B11R1.156 O=C(O)C1=C(I)C=CC=C1Cl AK128439 [0,2,0,0,0,0|1,0,1]=4 1368 B11R1.156 O=C(O)C1=C(I)C=CC=C1F AK-73092 [0,2,0,0,0,0|1,0,1]=4 1369 B11R1.156 O=C(O)C1=C(I)C=CC=C1N AK-79473 [0,2,0,0,0,0|1,0,1]=4 1370 B11R1.156 O=C(O)C1=C(O)C=CC=C1F AK-36077 [0,2,0,0,0,0|1,0,1]=4 1371 B11R1.156 O=C(O)C1=C(O)C=CC=C1N AK-76027 [0,2,0,0,0,0|1,0,1]=4 1372 B11R1.156 OB(C1=C(F)C=CC=C1Cl)O AK-34633 [0,2,0,0,0,0|2,0,0]=4 1373 B11R1.156 OB(C1=C(F)C=CC=C1F)O AK-33551 [0,2,0,0,0,0|2,0,0]=4 1374 B11R1.156 OB(O)C1=C(Cl)C=CC=C1Cl AK-36251 [0,2,0,0,0,0|2,0,0]=4 1375 B11R1.156 OC(=O)C1=C(Br)C=CC=C1Br AK-86840 [0,2,0,0,0,0|1,0,1]=4 1376 B11R1.159 BrC1=C(C(=O)O)C=CC=C1C AK-28470 [0,2,0,0,0,0|1,0,1]=4 1377 B11R1.159 BrC1=C(C(=O)O)C=CC=C1F AK-25368 [0,2,0,0,0,0|1,0,1]=4 1378 B11R1.159 BrC1=CC=CC(=C1Cl)C(=O)O AK-41763 [0,2,0,0,0,0|1,0,1]=4 1379 B11R1.159 BrC1=CC=CC(=C1F)C(C)=O AK-33547 [0,2,0,0,0,0|0,0,2]=4 1380 B11R1.159 BrC1=CC=CC(=C1O)C(=O)O AK-24666 [0,2,0,0,0,0|1,0,1]=4 1381 B11R1.159 C1=C(C(=C(C=C1)C)N)C(O)=O AK-35167 [0,2,0,0,0,0|1,0,1]=4 1382 B11R1.159 C1=C(C(=C(C=C1)F)C)C(O)=O AK-26272 [0,2,0,0,0,0|1,0,1]=4 1383 B11R1.159 C1=C(C(=C(C=C1)O)N)C(O)=O AK-35611 [0,2,0,0,0,0|1,0,1]=4 1384 B11R1.159 C1=CC=C(C(=C1C(O)=O)C)C AK-26167 [0,2,0,0,0,0|1,0,1]=4 1385 B11R1.159 C1=CC=C(C(=C1C(O)=O)C)Cl AK-29499 [0,2,0,0,0,0|1,0,1]=4 1386 B11R1.159 C1=CC=C(C(=C1C(O)=O)N)F AK-29556 [0,2,0,0,0,0|1,0,1]=4 1387 B11R1.159 C1=CC=C(C(=C1C(O)=O)O)F AK-34755 [0,2,0,0,0,0|1,0,1]=4 1388 B11R1.159 CC(C)C1=CC=CC(O)=C1O AK109526 [0,2,0,0,0,0|1,0,0]=3 1389 B11R1.159 CC(C1=CC=CC(Br)=C1O)=O AK-33819 [0,2,0,0,0,0|0,0,2]=4 1390 B11R1.159 CC(C1=CC=CC(C)=C1F)=O AK327202 [0,2,0,0,0,0|0,0,2]=4 1391 B11R1.159 CC(C1=CC=CC(Cl)=C1Cl)=O AK-75733 [0,2,0,0,0,0|0,0,2]=4 1392 B11R1.159 CC(C1=CC=CC(Cl)=C1O)=O AK-34682 [0,2,0,0,0,0|0,0,2]=4 1393 B11R1.159 CC(C1=CC=CC(F)=C1Br)=O AK145989 [0,2,0,0,0,0|0,0,2]=4 1394 B11R1.159 CC(C1=CC=CC(F)=C1Cl)=O AK-94336 [0,2,0,0,0,0|0,0,2]=4 1395 B11R1.159 CC(C1=CC=CC(N)=C1O)=O AK-26283 [0,2,0,0,0,0|0,0,2]=4 1396 B11R1.159 CC(C1=CC=CC(O)=C1N)=O AK-80116 [0,2,0,0,0,0|0,0,2]=4 1397 B11R1.159 CC(C1=CC=CC(O)=C1O)=O AK-33157 [0,2,0,0,0,0|0,0,2]=4 1398 B11R1.159 CC(N)C1=CC=CC(Cl)=C1F AK338219 [0,2,0,0,0,0|1,0,0]=3 1399 B11R1.159 CC1=C(C=CC=C1F)B(O)O AK-33571 [0,2,0,0,0,0|2,0,0]=4 1400 B11R1.159 CC1=C(Cl)C=CC=C1B(O)O AK-61755 [0,2,0,0,0,0|2,0,0]=4 1401 B11R1.159 CC1=C(N)C=CC=C1B(O)O AK607675 [0,2,0,0,0,0|2,0,0]=4 1402 B11R1.159 CC1=C(O)C=CC=C1C(O)=O AK-45470 [0,2,0,0,0,0|1,0,1]=4 1403 B11R1.159 CC1=CC=CC(C(O)=O)=C1I AK-61437 [0,2,0,0,0,0|1,0,1]=4 1404 B11R1.159 C[C@@H](N)C1=CC=CC(Cl)=C1F AK-42505 [0,2,0,0,0,0|1,0,0]=3 1405 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1F AK151381 [0,2,0,0,0,0|1,0,0]=3 1406 B11R1.159 FC1=C(Br)C=CC=C1B(O)O AK-54283 [0,2,0,0,0,0|2,0,0]=4 1407 B11R1.159 FC1=C(C(=O)O)C=CC=C1I AK-35201 [0,2,0,0,0,0|1,0,1]=4 1408 B11R1.159 FC1=C(C=CC=C1I)B(O)O AK-54284 [0,2,0,0,0,0|2,0,0]=4 1409 B11R1.159 FC1=C(Cl)C(B(O)O)=CC=C1 AK-62022 [0,2,0,0,0,0|2,0,0]=4 1410 B11R1.159 FC1=C(Cl)C=CC=C1B(O)O AK-44630 [0,2,0,0,0,0|2,0,0]=4 1411 B11R1.159 FC1=CC=CC(=C1I)C(=O)O AK-34964 [0,2,0,0,0,0|1,0,1]=4 1412 B11R1.159 NC(C)C1=CC=CC(Cl)=C1Cl AK555588 [0,2,0,0,0,0|1,0,0]=3 1413 B11R1.159 NC1=C(Cl)C=CC=C1C(O)=O AK-31072 [0,2,0,0,0,0|1,0,1]=4 1414 B11R1.159 NC1=CC=CC(=C1Cl)C(=O)O AK-32822 [0,2,0,0,0,0|1,0,1]=4 1415 B11R1.159 O=C(O)C1=CC=CC(Br)=C1C AK-27090 [0,2,0,0,0,0|1,0,1]=4 1416 B11R1.159 O=C(O)C1=CC=CC(Br)=C1F AK-23680 [0,2,0,0,0,0|1,0,1]=4 1417 B11R1.159 O=C(O)C1=CC=CC(Br)=C1I AK-73145 [0,2,0,0,0,0|1,0,1]=4 1418 B11R1.159 O=C(O)C1=CC=CC(Br)=C1N AK-28094 [0,2,0,0,0,0|1,0,1]=4 1419 B11R1.159 O=C(O)C1=CC=CC(C)=C1F AK-34640 [0,2,0,0,0,0|1,0,1]=4 1420 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1Cl AK-48292 [0,2,0,0,0,0|1,0,1]=4 1421 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1F AK-29899 [0,2,0,0,0,0|1,0,1]=4 1422 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1I AK-68531 [0,2,0,0,0,0|1,0,1]=4 1423 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1O AK-75898 [0,2,0,0,0,0|1,0,1]=4 1424 B11R1.159 O=C(O)C1=CC=CC(F)=C1Cl AK-32695 [0,2,0,0,0,0|1,0,1]=4 1425 B11R1.159 O=C(O)C1=CC=CC(F)=C1F AK-48902 [0,2,0,0,0,0|1,0,1]=4 1426 B11R1.159 O=C(O)C1=CC=CC(I)=C1N AK-64570 [0,2,0,0,0,0|1,0,1]=4 1427 B11R1.159 O=C(O)C1=CC=CC(N)=C1C AK-45495 [0,2,0,0,0,0|1,0,1]=4 1428 B11R1.159 O=C(O)C1=CC=CC(N)=C1F AK-36851 [0,2,0,0,0,0|1,0,1]=4 1429 B11R1.159 O=C(O)C1=CC=CC(O)=C1O AK-24541 [0,2,0,0,0,0|1,0,1]=4 1430 B11R1.159 OB(C1=CC=CC(C)=C1C)O AK-33817 [0,2,0,0,0,0|2,0,0]=4 1431 B11R1.159 OB(C1=CC=CC(Cl)=C1Cl)O AK-33406 [0,2,0,0,0,0|2,0,0]=4 1432 B11R1.159 OC(=O)C1=C(Br)C(Cl)=CC=C1 AK-35679 [0,2,0,0,0,0|1,0,1]=4 1433 B11R1.159 OC(=O)C1=C(Br)C(I)=CC=C1 AK-28155 [0,2,0,0,0,0|1,0,1]=4 1434 B11R1.159 OC1=C(F)C(B(O)O)=CC=C1 AK-93591 [0,2,0,0,0,0|2,0,0]=4 1435 B11R1.167 BrC1=C(C=C(C=C1)Br)B(O)O AK-45824 [0,2,0,0,0,0|2,0,0]=4 1436 B11R1.167 C1=C(Br)C=CC(=C1C(=O)C)O AK-47862 [0,2,0,0,0,0|0,0,2]=4 1437 B11R1.167 C1=C(Br)C=CC(=C1C(O)=O)Br AK-26176 [0,2,0,0,0,0|1,0,1]=4 1438 B11R1.167 C1=C(C(=CC=C1Br)C)C(O)=O AK-26338 [0,2,0,0,0,0|1,0,1]=4 1439 B11R1.167 C1=C(C(=CC=C1C)Br)C(O)=O AK-30136 [0,2,0,0,0,0|1,0,1]=4 1440 B11R1.167 C1=C(C(=CC=C1C)F)C(O)=O AK-34671 [0,2,0,0,0,0|1,0,1]=4 1441 B11R1.167 C1=C(C(=CC=C1Cl)Br)C(O)=O AK-28994 [0,2,0,0,0,0|1,0,1]=4 1442 B11R1.167 C1=C(C(=CC=C1Cl)C)C(O)=O AK-32605 [0,2,0,0,0,0|1,0,1]=4 1443 B11R1.167 C1=C(C(=CC=C1F)N)C(O)=O AK-35193 [0,2,0,0,0,0|1,0,1]=4 1444 B11R1.167 C1=C(C(=CC=C1O)C)C(=O)O AK-40532 [0,2,0,0,0,0|1,0,1]=4 1445 B11R1.167 C1=C(C)C=CC(=C1C(O)=O)C AK-48911 [0,2,0,0,0,0|1,0,1]=4 1446 B11R1.167 C1=C(C)C=CC(=C1C(O)=O)N AK-34555 [0,2,0,0,0,0|1,0,1]=4 1447 B11R1.167 C1=C(C=CC(=C1B(O)O)C)C AK-36572 [0,2,0,0,0,0|2,0,0]=4 1448 B11R1.167 C1=C(C=CC(=C1B(O)O)F)F AK-25550 [0,2,0,0,0,0|2,0,0]=4 1449 B11R1.167 C1=C(Cl)C=CC(=C1C(C)=O)Cl AK-73074 [0,2,0,0,0,0|0,0,2]=4 1450 B11R1.167 C1=C(Cl)C=CC(=C1C(O)=O)Cl AK-47665 [0,2,0,0,0,0|1,0,1]=4 1451 B11R1.167 C1=C(Cl)C=CC(=C1C(O)=O)N AK-26989 [0,2,0,0,0,0|1,0,1]=4 1452 B11R1.167 C1=C(I)C=CC(=C1C(O)=O)N AK-35517 [0,2,0,0,0,0|1,0,1]=4 1453 B11R1.167 C1=C(N)C=CC(=C1C(O)=O)Cl AK-36786 [0,2,0,0,0,0|1,0,1]=4 1454 B11R1.167 C1=C(N)C=CC(=C1C(O)=O)O AK-72925 [0,2,0,0,0,0|1,0,1]=4 1455 B11R1.167 CC(=O)C1=C(F)C=CC(N)=C1 AK-68014 [0,2,0,0,0,0|0,0,2]=4 1456 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=C1 AK-28102 [0,2,0,0,0,0|0,0,2]=4 1457 B11R1.167 CC(=O)C1=C(N)C=CC(F)=C1 AK109676 [0,2,0,0,0,0|0,0,2]=4 1458 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 AK-30761 [0,2,0,0,0,0|0,0,2]=4 1459 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 AK-30762 [0,2,0,0,0,0|0,0,2]=4 1460 B11R1.167 CC(C1=C(C=CC(=C1)F)Cl)=O AK-48949 [0,2,0,0,0,0|0,0,2]=4 1461 B11R1.167 CC(C1=CC(Br)=CC=C1C)=O AK147547 [0,2,0,0,0,0|0,0,2]=4 1462 B11R1.167 CC(C1=CC(Br)=CC=C1Cl)=O AK109534 [0,2,0,0,0,0|0,0,2]=4 1463 B11R1.167 CC(C1=CC(Br)=CC=C1F)=O AK-28059 [0,2,0,0,0,0|0,0,2]=4 1464 B11R1.167 CC(C1=CC(Br)=CC=C1N)=O AK-28616 [0,2,0,0,0,0|0,0,2]=4 1465 B11R1.167 CC(C1=CC(Cl)=CC=C1Br)=O AK-51654 [0,2,0,0,0,0|0,0,2]=4 1466 B11R1.167 CC(C1=CC(Cl)=CC=C1F)=O AK-76691 [0,2,0,0,0,0|0,0,2]=4 1467 B11R1.167 CC(C1=CC(F)=CC=C1Br)=O AK-45663 [0,2,0,0,0,0|0,0,2]=4 1468 B11R1.167 CC(C1=CC(F)=CC=C1I)=O AK136027 [0,2,0,0,0,0|0,0,2]=4 1469 B11R1.167 CC(C1=CC(F)=CC=C1O)=O AK-45396 [0,2,0,0,0,0|0,0,2]=4 1470 B11R1.167 CC(C1=CC(I)=CC=C1F)C AK685324 [0,2,0,0,0,0|1,0,0]=3 1471 B11R1.167 CC(C1=CC(N)=CC=C1O)=O AK116395 [0,2,0,0,0,0|0,0,2]=4 1472 B11R1.167 CC(C1=CC(O)=CC=C1O)=O AK-51301 [0,2,0,0,0,0|0,0,2]=4 1473 B11R1.167 CC(N)C1=CC(Cl)=CC=C1F AK338981 [0,2,0,0,0,0|1,0,0]=3 1474 B11R1.167 CC(O)C1=C(C)C=CC(Cl)=C1 AK425566 [0,2,0,0,0,0|0,0,0]=2 1475 B11R1.167 CC(O)C1=CC(Br)=CC=C1F AK-28060 [0,2,0,0,0,0|0,0,0]=2 1476 B11R1.167 CC1=CC=C(O)C(B(O)O)=C1 AK-61725 [0,2,0,0,0,0|2,0,0]=4 1477 B11R1.167 FC1=CC(=C(C=C1)I)C(=O)O AK-26068 [0,2,0,0,0,0|1,0,1]=4 1478 B11R1.167 IC1=CC(=C(C=C1)C)C(=O)O AK-23836 [0,2,0,0,0,0|1,0,1]=4 1479 B11R1.167 NC1=CC(=C(C=C1)Br)C(=O)O AK-34512 [0,2,0,0,0,0|1,0,1]=4 1480 B11R1.167 NC1=CC(=C(C=C1)C)C(=O)O AK-24895 [0,2,0,0,0,0|1,0,1]=4 1481 B11R1.167 NC1=CC=C(O)C=C1C(O)=O AK-45120 [0,2,0,0,0,0|1,0,1]=4 1482 B11R1.167 O=C(O)C1=CC(Br)=CC=C1Cl AK-28993 [0,2,0,0,0,0|1,0,1]=4 1483 B11R1.167 O=C(O)C1=CC(Br)=CC=C1F AK-33317 [0,2,0,0,0,0|1,0,1]=4 1484 B11R1.167 O=C(O)C1=CC(Br)=CC=C1I AK-25605 [0,2,0,0,0,0|1,0,1]=4 1485 B11R1.167 O=C(O)C1=CC(Br)=CC=C1N AK-25578 [0,2,0,0,0,0|1,0,1]=4 1486 B11R1.167 O=C(O)C1=CC(Br)=CC=C1O AK-44136 [0,2,0,0,0,0|1,0,1]=4 1487 B11R1.167 O=C(O)C1=CC(Br)=CC=C1S AK116283 [0,2,0,0,0,0|1,0,1]=4 1488 B11R1.167 O=C(O)C1=CC(C)=CC=C1Cl AK-35943 [0,2,0,0,0,0|1,0,1]=4 1489 B11R1.167 O=C(O)C1=CC(C)=CC=C1I AK-35485 [0,2,0,0,0,0|1,0,1]=4 1490 B11R1.167 O=C(O)C1=CC(Cl)=CC=C1F AK-30325 [0,2,0,0,0,0|1,0,1]=4 1491 B11R1.167 O=C(O)C1=CC(F)=CC=C1Br AK-35001 [0,2,0,0,0,0|1,0,1]=4 1492 B11R1.167 O=C(O)C1=CC(F)=CC=C1C AK-34724 [0,2,0,0,0,0|1,0,1]=4 1493 B11R1.167 O=C(O)C1=CC(F)=CC=C1F AK-29107 [0,2,0,0,0,0|1,0,1]=4 1494 B11R1.167 O=C(O)C1=CC(F)=CC=C1O AK-49710 [0,2,0,0,0,0|1,0,1]=4 1495 B11R1.167 O=C(O)C1=CC(I)=CC=C1Br AK-40149 [0,2,0,0,0,0|1,0,1]=4 1496 B11R1.167 O=C(O)C1=CC(I)=CC=C1Cl AK-33887 [0,2,0,0,0,0|1,0,1]=4 1497 B11R1.167 O=C(O)C1=CC(I)=CC=C1F AK-28758 [0,2,0,0,0,0|1,0,1]=4 1498 B11R1.167 O=C(O)C1=CC(N)=CC=C1F AK-35670 [0,2,0,0,0,0|1,0,1]=4 1499 B11R1.167 O=C(O)C1=CC(O)=CC=C1Br AK-77223 [0,2,0,0,0,0|1,0,1]=4 1500 B11R1.167 O=C(O)C1=CC(O)=CC=C1Cl AK-35680 [0,2,0,0,0,0|1,0,1]=4 1501 B11R1.167 O=C(O)C1=CC(O)=CC=C1F AK-35417 [0,2,0,0,0,0|1,0,1]=4 1502 B11R1.167 OB(C1=CC(C)=CC=C1F)O AK-27198 [0,2,0,0,0,0|2,0,0]=4 1503 B11R1.167 OB(C1=CC(Cl)=CC=C1F)O AK-34816 [0,2,0,0,0,0|2,0,0]=4 1504 B11R1.167 OB(C1=CC(F)=CC=C1Cl)O AK-35183 [0,2,0,0,0,0|2,0,0]=4 1505 B11R1.167 OC(=O)C1=C(O)C=CC(O)=C1 AK-49825 [0,2,0,0,0,0|1,0,1]=4 1506 B11R1.167 OC1=CC=C(C)C=C1C(C)C AK126296 [0,2,0,0,0,0|1,0,0]=3 1507 B11R1.167 OC1=CC=C(C)C=C1C(O)=O AK-48577 [0,2,0,0,0,0|1,0,1]=4 1508 B11R1.167 OC1=CC=C(Cl)C(B(O)O)=C1 AK-93982 [0,2,0,0,0,0|2,0,0]=4 1509 B11R1.167 OC1=CC=C(F)C(B(O)O)=C1 AK-93592 [0,2,0,0,0,0|2,0,0]=4 1510 B11R1.167 OC1=CC=C(F)C=C1B(O)O AK-34401 [0,2,0,0,0,0|2,0,0]=4 1511 B11R1.167 OC1=CC=C(I)C(N(C)C)=C1 AK549977 [0,2,0,0,0,0|2,0,0]=4 1512 B11R1.74 BrC1=CC(=CC(=C1)C(=O)O)C AK-35753 [0,2,0,0,0,0|1,0,1]=4 1513 B11R1.74 C1=C(C=C(C=C1C(O)=O)C)C AK-45888 [0,2,0,0,0,0|1,0,1]=4 1514 B11R1.74 C1=C(C=C(C=C1C(O)=O)Cl)Cl AK-47334 [0,2,0,0,0,0|1,0,1]=4 1515 B11R1.74 C1=C(C=C(C=C1C(O)=O)F)C AK-35437 [0,2,0,0,0,0|1,0,1]=4 1516 B11R1.74 C1=C(C=C(C=C1C(O)=O)F)F AK-29265 [0,2,0,0,0,0|1,0,1]=4 1517 B11R1.74 C1=C(C=C(C=C1C)C)B(O)O AK-33683 [0,2,0,0,0,0|2,0,0]=4 1518 B11R1.74 C1=C(C=C(Cl)C=C1Cl)B(O)O AK-36073 [0,2,0,0,0,0|2,0,0]=4 1519 B11R1.74 C1=C(C=C(F)C=C1F)B(O)O AK-33468 [0,2,0,0,0,0|2,0,0]=4 1520 B11R1.74 CC(=O)C1=CC(Br)=CC(Cl)=C1 AK-88050 [0,2,0,0,0,0|0,0,2]=4 1521 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 AK-43858 [0,2,0,0,0,0|0,0,2]=4 1522 B11R1.74 CC(C1=CC(Br)=CC(Br)=C1)=O AK-87691 [0,2,0,0,0,0|0,0,2]=4 1523 B11R1.74 CC(C1=CC(C)=CC(Br)=C1)=O AK143673 [0,2,0,0,0,0|0,0,2]=4 1524 B11R1.74 CC(C1=CC(Cl)=CC(Cl)=C1)=O AK-86403 [0,2,0,0,0,0|0,0,2]=4 1525 B11R1.74 CC(C1=CC(F)=CC(F)=C1)=O AK-44507 [0,2,0,0,0,0|0,0,2]=4 1526 B11R1.74 CC(C1=CC(O)=CC(O)=C1)=O AK-45934 [0,2,0,0,0,0|0,0,2]=4 1527 B11R1.74 CC1=CC(=CC(N)=C1)C(O)=O AK-34242 [0,2,0,0,0,0|1,0,1]=4 1528 B11R1.74 CC1=CC(Cl)=CC(B(O)O)=C1 AK-78611 [0,2,0,0,0,0|2,0,0]=4 1529 B11R1.74 CC1=CC(F)=CC(B(O)O)=C1 AK-26364 [0,2,0,0,0,0|2,0,0]=4 1530 B11R1.74 C[C@@H](N)C1=CC(F)=CC(Cl)=C1 AK134026 [0,2,0,0,0,0|1,0,0]=3 1531 B11R1.74 C[C@@H](N)C1=CC(F)=CC(F)=C1 AK-42228 [0,2,0,0,0,0|1,0,0]=3 1532 B11R1.74 C[C@H](N)C1=CC(F)=CC(Cl)=C1 AK544244 [0,2,0,0,0,0|1,0,0]=3 1533 B11R1.74 C[C@H](N)C1=CC(F)=CC(F)=C1 AK-42191 [0,2,0,0,0,0|1,0,0]=3 1534 B11R1.74 ClC1=CC(=CC(=C1)B(O)O)F AK-34716 [0,2,0,0,0,0|2,0,0]=4 1535 B11R1.74 NC1=CC(=CC(=C1)C(=O)O)F AK-37396 [0,2,0,0,0,0|1,0,1]=4 1536 B11R1.74 NC1=CC(Cl)=CC(=C1)C(O)=O AK-45965 [0,2,0,0,0,0|1,0,1]=4 1537 B11R1.74 NC1=CC(O)=CC(=C1)C(O)=O AK-59360 [0,2,0,0,0,0|1,0,1]=4 1538 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 AK-73084 [0,2,0,0,0,0|1,0,1]=4 1539 B11R1.74 O=C(O)C1=CC(Br)=CC(N)=C1 AK-61316 [0,2,0,0,0,0|1,0,1]=4 1540 B11R1.74 O=C(O)C1=CC(C)=CC(Cl)=C1 AK-75961 [0,2,0,0,0,0|1,0,1]=4 1541 B11R1.74 O=C(O)C1=CC(C)=CC(O)=C1 AK-47209 [0,2,0,0,0,0|1,0,1]=4 1542 B11R1.74 O=C(O)C1=CC(Cl)=CC(Br)=C1 AK-76578 [0,2,0,0,0,0|1,0,1]=4 1543 B11R1.74 O=C(O)C1=CC(I)=CC(Br)=C1 AK-33873 [0,2,0,0,0,0|1,0,1]=4 1544 B11R1.74 O=C(O)C1=CC(N)=CC(N)=C1 AK-41179 [0,2,0,0,0,0|1,0,1]=4 1545 B11R1.74 O=C(O)C1=CC(O)=CC(Cl)=C1 AK107678 [0,2,0,0,0,0|1,0,1]=4 1546 B11R1.74 O=C(O)C1=CC(O)=CC(F)=C1 AK-67889 [0,2,0,0,0,0|1,0,1]=4 1547 B11R1.74 O=C(O)C1=CC(O)=CC(N)=C1 AK-36312 [0,2,0,0,0,0|1,0,1]=4 1548 B11R1.74 O=C(O)C1=CC(O)=CC(O)=C1 AK-44160 [0,2,0,0,0,0|1,0,1]=4 1549 B11R1.74 OB(C1=CC(O)=CC(F)=C1)O AK-36629 [0,2,0,0,0,0|2,0,0]=4 1550 B11R1.74 OB(O)C1=CC(Br)=CC(Br)=C1 AK-44622 [0,2,0,0,0,0|2,0,0]=4 1551 B11R1.74 OC(=O)C1=CC(Cl)=CC(I)=C1 AK-34536 [0,2,0,0,0,0|1,0,1]=4 1552 B11R1.74 OC(=O)C1=CC(I)=CC(F)=C1 AK-36219 [0,2,0,0,0,0|1,0,1]=4 1553 B11R1.74 OC(=O)C1=CC(I)=CC(I)=C1 AK-79041 [0,2,0,0,0,0|1,0,1]=4 1554 B11R1.266 C1=C(C(=O)O)C=CC=C1CCl AK-34651 [0,2,0,0,0,0|1,0,1]=4 1555 B11R1.266 C1=C(C=CC=C1C(O)=O)C=O AK-45897 [0,2,0,0,0,0|1,0,1]=4 1556 B11R1.266 C1=C(C=CC=C1C=O)B(O)O AK-45037 [0,2,0,0,0,0|2,0,0]=4 1557 B11R1.266 C1=C(C=CC=C1CBr)B(O)O AK-32247 [0,2,0,0,0,0|2,0,0]=4 1558 B11R1.266 C1=C(C=CC=C1CO)B(O)O AK-39213 [0,2,0,0,0,0|2,0,0]=4 1559 B11R1.266 C1=C(C=CC=C1OC)B(O)O AK-45174 [0,2,0,0,0,0|2,0,0]=4 1560 B11R1.266 C=CC1=CC(B(O)O)=CC=C1 AK101141 [0,2,0,0,0,0|2,0,0]=4 1561 B11R1.266 CC(C1=CC=CC(CCl)=C1)=O AK-86175 [0,2,0,0,0,0|0,0,2]=4 1562 B11R1.266 C[C@@H](N)C1=CC(OC)=NC=C1 AK188001 [0,2,0,0,0,0|2,0,0]=4 1563 B11R1.266 C[C@@H](N)C1=CC=CC(OC)=C1 AK-36684 [0,2,0,0,0,0|1,0,0]=3 1564 B11R1.266 C[C@H](N)C1=CC(OC)=NC=C1 AK174211 [0,2,0,0,0,0|2,0,0]=4 1565 B11R1.266 N#CC1=CC=CC([C@@H](N)C)=C1 AK-28670 [0,2,0,0,0,0|1,0,0]=3 1566 B11R1.266 NCC1=CC=CC(=C1)C(=O)O AK-36663 [0,2,0,0,0,0|1,0,1]=4 1567 B11R1.266 O=C(O)C1=CC=CC(C#N)=C1 AK-68392 [0,2,0,0,0,0|1,0,1]=4 1568 B11R1.266 O=C(O)C1=CC=CC(CBr)=C1 AK-35991 [0,2,0,0,0,0|1,0,1]=4 1569 B11R1.266 O=C(O)C1=CC=CC(NC)=C1 AK164024 [0,2,0,0,0,0|1,0,1]=4 1570 B11R1.266 O=C(O)C1=CC=CC(OC)=C1 AK159192 [0,2,0,0,0,0|1,0,1]=4 1571 B11R1.266 O=CC1=CC=CC(N(C)C)=C1 AK-45861 [0,2,0,0,0,0|2,0,0]=4 1572 B11R1.266 OB(C1=CC=CC(CC)=C1)O AK-38410 [0,2,0,0,0,0|2,0,0]=4 1573 B11R1.266 OB(O)C1=CC(=CC=C1)C#N AK-44970 [0,2,0,0,0,0|2,0,0]=4 1574 B11R1.266 OCC1=CC=CC(=C1)C(O)=O AK-34506 [0,2,0,0,0,0|1,0,1]=4 1575 B9R1.13 CN(C)C=C1C=CC=C1 AK-79365 [0,0,1,1,0,0|2,0,0]=4 1576 B9R2.50 C1CC2=CC=CC=C12 AK109544 [1,0,0,1,0,0|0,0,0]=2 1577 B11R2.4 N[C@H]1[C@H](C2=CC=CC=C2)C1 AK142856 [0,0,0,1,0,1|1,0,0]=3 1578 B11R2.10 C1=C([NH]C2=CC=CC=C12)C AK-44448 [0,0,0,1,0,1|1,0,1]=4 1579 B11R2.10 C1=CC=CC2=C1C=C(Br)C2 AK-47275 [0,0,0,1,0,1|1,0,1]=4 1580 B11R2.10 CC1=CC2=C(S1)C=CC=C2 AK110745 [0,0,0,1,0,1|0,1,1]=4 1581 B11R2.10 CC1=CC2=CC=CC=C2C1 AK-79371 [0,0,0,1,0,1|1,0,1]=4 1582 B11R2.10 CC1=NC2=C(S1)C=CC=C2 AK-45781 [0,0,0,1,0,1|0,1,1]=4 1583 B11R2.10 CC1=NC2=CC=CC=C2N1 AK-44028 [0,0,0,1,0,1|1,0,1]=4 1584 B11R2.10 CC1=NC2=CC=CC=C2O1 AK161761 [0,0,0,1,0,1|0,0,1]=3 1585 B11R2.10 CC1=NC2=NC=CC=C2O1 AK-30675 [0,0,0,1,0,1|1,0,1]=4 1586 B11R2.10 NC1=NC2=CC=CC=C2O1 AK-35247 [0,0,0,1,0,1|1,0,1]=4 1587 B11R2.10 NC1CC2=C(C=CC=C2)C1 AK-51756 [0,0,0,1,0,1|1,0,0]=3 1588 B11R2.10 O=C1NC2=C(C=CC=C2)C1 AK-49964 [0,0,0,1,0,1|0,0,2]=4 1589 B11R2.10 O=C1OC2=CC=CC=C2C1 AK-77806 [0,0,0,1,0,1|0,0,2]=4 1590 B11R2.10 OC1=NC2=CC=CC=C2O1 AK-35787 [0,0,0,1,0,1|1,0,1]=4 1591 B11R2.10 OC1CC2=C(C=CC=C2)C1 AK-94248 [0,0,0,1,0,1|0,0,0]=2 1592 B11R2.10 SC1=NC2=CC=CC=C2O1 AK161762 [0,0,0,1,0,1|1,0,1]=4 1593 B11R2.34 BrC1=CC=C(C=C1)C2CC2 AK-76692 [0,1,0,1,0,0|1,0,0]=3 1594 B11R2.34 BrC1=CN=C(C2CC2)C=C1 AK-83540 [0,1,0,1,0,0|2,0,0]=4 1595 B11R2.34 BrC1=NC=C(C2CC2)C=C1 AK131652 [0,1,0,1,0,0|2,0,0]=4 1596 B11R2.34 FC1=NC=C(C2CC2)C=C1 AK132519 [0,1,0,1,0,0|2,0,0]=4 1597 B11R2.34 NC1=CC=C(C2CC2)C=C1 AK124361 [0,1,0,1,0,0|1,0,0]=3 1598 B11R2.34 NC1=CC=C(C2CC2)N=C1 AK-64994 [0,1,0,1,0,0|2,0,0]=4 1599 B11R2.34 NC1=NC=C(C2CC2)C=C1 AK129592 [0,1,0,1,0,0|2,0,0]=4 1600 B11R2.34 O=C1C=CC(C2CC2)=CN1 AK132527 [0,1,0,1,0,0|2,0,0]=4 1601 B11R2.34 OC1=CC=C(C2CC2)C=C1 AK-80032 [0,1,0,1,0,0|1,0,0]=3 1602 B11R2.1 BrC1=COC2=C1C=CC=C2 AK-90311 [0,1,0,1,0,0|1,0,1]=4 1603 B11R2.1 C1=C(C2=CC=CC=C2[NH]1)C AK-68243 [0,1,0,1,0,0|1,0,1]=4 1604 B11R2.1 C1=CC=CC2=C1C(CC2)=O AK-44115 [0,1,0,1,0,0|0,0,2]=4 1605 B11R2.1 C1=CC=CC2=C1C(CO2)=O AK-45365 [0,1,0,1,0,0|0,0,2]=4 1606 B11R2.1 CC1=CCC2=CC=CC=C12 AK-79878 [0,1,0,1,0,0|1,0,1]=4 1607 B11R2.1 CC1=N[NH]C2=CC=CC=C12 AK-24403 [0,1,0,1,0,0|1,0,1]=4 1608 B11R2.1 CN1C=CC2=C1C=CC=C2 AK-84423 [0,1,0,1,0,0|2,0,0]=4 1609 B11R2.1 CN1C=NC2=C1C=CC=C2 AK-51670 [0,1,0,1,0,0|2,0,0]=4 1610 B11R2.1 ClC1=NOC2=C1C=CC=C2 AK-24058 [0,1,0,1,0,0|1,0,1]=4 1611 B11R2.1 NC1=NCC2=C1C=CC=C2 AK166973 [0,1,0,1,0,0|1,0,1]=4 1612 B11R2.1 NC1CCC2=C1C=CC=C2 AK-44750 [0,1,0,1,0,0|1,0,0]=3 1613 B11R2.1 NC1CCC2=CC=CC=C12 AK-96028 [0,1,0,1,0,0|1,0,0]=3 1614 B11R2.1 NC1CCC2=CC=CN=C21 AK-75878 [0,1,0,1,0,0|2,0,0]=4 1615 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 AK-44891 [0,1,0,1,0,0|1,0,0]=3 1616 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 AK-89530 [0,1,0,1,0,0|1,0,0]=3 1617 B11R2.1 N[C@H]1COC2=CC=CC=C12 AK172653 [0,1,0,1,0,0|1,0,0]=3 1618 B11R2.1 O1C2=C(C(=N1)N)C=CC=C2 AK-23544 [0,1,0,1,0,0|1,0,1]=4 1619 B11R2.1 O=C1C2=CC=CC=C2SC1 AK-29817 [0,1,0,1,0,0|0,0,2]=4 1620 B11R2.1 O=C1NCC2=C1C=CC=C2 AK-68456 [0,1,0,1,0,0|0,0,2]=4 1621 B11R2.1 O=C1OCC2=C1C=CC=C2 AK-78719 [0,1,0,1,0,0|0,0,2]=4 1622 B11R2.1 OC1=NNC2=C1C=CC=C2 AK136349 [0,1,0,1,0,0|1,0,1]=4 1623 B11R2.1 OC1CCC2=C1C=CC=C2 AK151987 [0,1,0,1,0,0|0,0,0]=2 1624 B11R2.1 OC1CCC2=CC=CN=C21 AK-72486 [0,1,0,1,0,0|1,0,0]=3 1625 B11R2.40 NC1(C2=CC=CC=C2)CC1 AK-30570 [0,1,0,1,0,0|1,0,0]=3 1626 B11R2.40 NC1(C2=CC=CN=C2)CC1 AK-68608 [0,1,0,1,0,0|2,0,0]=4 1627 B11R2.239 C1(C2=CC=CC=C2)CNC1 AK-36313 [0,1,0,1,0,0|1,0,0]=3 1628 B11R2.239 C1NCC1C2=CC=CN=C2 AK103500 [0,1,0,1,0,0|2,0,0]=4 1629 B11R2.988 OCC1C2=CC=CC=C2C1 AK550201 [0,1,0,1,0,0|0,0,0]=2 1630 B11R2.55 ClC1=C(C2CC2)C=NC=C1 AK543867 [0,1,0,1,0,0|2,0,0]=4 1631 B11R2.55 FC1=NC=CC=C1C2CC2 AK131938 [0,1,0,1,0,0|2,0,0]=4 1632 B11R2.55 NC1=CC=CC=C1C2CC2 AK142855 [0,1,0,1,0,0|1,0,0]=3 1633 B11R2.55 NC1=NC=CC=C1C2CC2 AK131946 [0,1,0,1,0,0|2,0,0]=4 1634 B11R2.55 O=C1C(C2CC2)=CC=CN1 AK131947 [0,1,0,1,0,0|2,0,0]=4 1635 B11R2.35 BrC1=CC(=CC=C1)C2CC2 AK-81509 [0,1,0,1,0,0|1,0,0]=3 1636 B11R2.35 BrC1=CC(C2CC2)=NC=C1 AK123378 [0,1,0,1,0,0|2,0,0]=4 1637 B11R2.35 NC1=CC=CC(C2CC2)=C1 AK112946 [0,1,0,1,0,0|1,0,0]=3 1638 B7R1.1 C1=C(SC=N1)CO AK-23792 [1,0,0,0,1,0|2,0,0]=4 1639 B7R1.1 C1=CC=N[N]1CO AK-21910 [1,0,0,0,1,0|2,0,0]=4 1640 B7R1.1 C1=NC(=CS1)CO AK-23714 [1,0,0,0,1,0|2,0,0]=4 1641 B7R1.1 C1=N[NH]C=C1CO AK-29936 [1,0,0,0,1,0|2,0,0]=4 1642 B7R1.1 CCC1=CC=CS1 AK-76635 [1,0,0,0,1,0|1,0,0]=3 1643 B7R1.1 CCC1=NC=CN1 AK161825 [1,0,0,0,1,0|2,0,0]=4 1644 B7R1.1 CCN1C=CN=C1 AK-47598 [1,0,0,0,1,0|2,0,0]=4 1645 B7R1.1 CCN1N=CC=C1 AK-39994 [1,0,0,0,1,0|2,0,0]=4 1646 B7R1.1 COC1=CC=CS1 AK-60885 [1,0,0,0,1,0|2,0,0]=4 1647 B7R1.1 COC1=CSC=C1 AK-60944 [1,0,0,0,1,0|2,0,0]=4 1648 B7R1.1 NCC1=CC=CN1 AK-39872 [1,0,0,0,1,0|2,0,0]=4 1649 B7R1.1 NCC1=CC=CS1 AK-46394 [1,0,0,0,1,0|2,0,0]=4 1650 B7R1.1 NCC1=CNC=C1 AK-67638 [1,0,0,0,1,0|2,0,0]=4 1651 B7R1.1 NCC1=CSC=C1 AK-28306 [1,0,0,0,1,0|2,0,0]=4 1652 B7R1.1 NCC1=CSC=C1 AK-48092 [1,0,0,0,1,0|2,0,0]=4 1653 B7R1.1 OCC1=CC=CS1 AK-93468 [1,0,0,0,1,0|1,0,0]=3 1654 B7R1.1 OCC1=CC=NO1 AK-68490 [1,0,0,0,1,0|2,0,0]=4 1655 B7R1.1 OCC1=CN=CO1 AK-25343 [1,0,0,0,1,0|2,0,0]=4 1656 B7R1.1 OCC1=COC=C1 AK-46116 [1,0,0,0,1,0|1,0,0]=3 1657 B7R1.1 OCC1=CSC=C1 AK-36199 [1,0,0,0,1,0|1,0,0]=3 1658 B7R1.1 OCC1=NC=CN1 AK-44944 [1,0,0,0,1,0|2,0,0]=4 1659 B7R1.1 OCC1=NC=CO1 AK-29821 [1,0,0,0,1,0|2,0,0]=4 1660 B7R1.1 OCC1=NOC=C1 AK-25087 [1,0,0,0,1,0|2,0,0]=4 1661 B11R1.91 CC(\C=C\C1=CC=CC=C1)=O AK107621 [0,0,0,0,0,2|0,0,2]=4 1662 B11R1.91 O=C(O)C#CC1=CC=CC=C1 AK-86834 [0,0,0,0,0,2|1,0,1]=4 1663 B11R1.91 O=C(O)CCC1=CC=CC=C1 AK-94756 [0,0,0,0,0,2|1,0,1]=4 1664 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 AK114507 [0,0,0,0,0,2|1,0,1]=4 1665 B11R1.91 OB(CCC1=CC=CC=C1)O AK-61775 [0,0,0,0,0,2|2,0,0]=4 1666 B11R1.91 OC(=O)COC1=CC=CC=C1 AK-76874 [0,0,0,0,0,2|1,0,1]=4