0 B12R1.77 C1=CC=CC(=C1C(OC)=O)CBr AK-34305 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.77 COC(=O)C1=C(C=CC=C1)C#N AK-82518 [0,0,0,0,0,0|2,0,0]=2 2 B12R1.77 COC1=CC=CC=C1C(CBr)=O AK114423 [0,0,0,0,0,0|2,0,0]=2 3 B12R1.77 COC1=CC=CC=C1C(CN)=O AK141727 [0,0,0,0,0,0|2,0,0]=2 4 B12R1.77 COC1=CC=CC=C1C(N)CO AK687507 [0,0,0,0,0,0|3,0,1]=4 5 B12R1.77 COC1=CC=CN=C1C(=O)OC AK-29044 [0,0,0,0,0,0|1,0,0]=1 6 B12R1.77 O=C(OC)C1=C(C#N)N=CC=C1 AK-83585 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.77 O=C(OC)C1=C(CBr)N=CC=C1 AK128701 [0,0,0,0,0,0|3,0,0]=3 8 B12R1.77 O=C(OC)C1=C(CN)N=CC=C1 AK173154 [0,0,0,0,0,0|3,0,0]=3 9 B12R1.77 O=C(OC)C1=C(OC)N=CC=C1 AK-47108 [0,0,0,0,0,0|1,0,0]=1 10 B12R1.77 O=C(OC)C1=CC=CC=C1C#C AK-64821 [0,0,0,0,0,0|1,0,1]=2 11 B12R1.77 O=C(OC)C1=CC=CC=C1C=O AK-49779 [0,0,0,0,0,0|2,0,0]=2 12 B12R1.77 O=C(OC)C1=CC=CC=C1OC AK-94060 [0,0,0,0,0,0|0,0,0]=0 13 B12R1.77 O=C(OC)C1=NC=CC=C1CBr AK143067 [0,0,0,0,0,0|3,0,0]=3 14 B12R1.77 OC[C@@H](N)C1=CC=CC=C1OC AK340715 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.41 CNCC1=CC=CC=C1OC AK-89681 [1,0,0,0,0,0|1,0,1]=3 16 B11R1.41 CNCC1=CC=CC=C1OC AK161757 [1,0,0,0,0,0|1,0,1]=3 17 B11R1.41 COC1=CC=CC=C1CCBr AK-77286 [1,0,0,0,0,0|2,0,1]=4 18 B11R1.41 COC1=CC=CC=C1CCO AK118734 [1,0,0,0,0,0|2,0,1]=4 19 B11R1.53 C1=C(C(=NC=C1)OC)B(O)O AK-26792 [1,0,0,0,0,0|2,0,1]=4 20 B11R1.53 C1=CC=CC(=C1C#N)C(C)=O AK-50565 [1,0,0,0,0,0|2,0,0]=3 21 B11R1.53 C1=CC=CC(=C1C=O)C(O)=O AK-46701 [1,0,0,0,0,0|2,0,0]=3 22 B11R1.53 C1=CC=CC(=C1CCl)C(O)=O AK-44122 [1,0,0,0,0,0|2,0,0]=3 23 B11R1.53 CC(C1=CC=CC=C1NC)=O AK135397 [1,0,0,0,0,0|1,0,0]=2 24 B11R1.53 CCC1=C(N=CC=N1)C(C)=O AK-89658 [1,0,0,0,0,0|3,0,0]=4 25 B11R1.53 CCC1=NC=CC=C1C(O)=O AK111206 [1,0,0,0,0,0|2,0,0]=3 26 B11R1.53 COC1=C(C(=O)O)C=CN=C1 AK-30272 [1,0,0,0,0,0|1,0,0]=2 27 B11R1.53 COC1=C(C=CN=C1)B(O)O AK-40400 [1,0,0,0,0,0|2,0,1]=4 28 B11R1.53 COC1=C(C=CN=C1)C(C)=O AK-99909 [1,0,0,0,0,0|1,0,0]=2 29 B11R1.53 COC1=C(C=NC=C1)[N+](=O)[O-] AK-25761 [1,0,0,0,0,0|2,0,1]=4 30 B11R1.53 COC1=C(N=CC=N1)C(O)=O AK102764 [1,0,0,0,0,0|2,0,0]=3 31 B11R1.53 COC1=CC=CN=C1C(=O)O AK-63990 [1,0,0,0,0,0|1,0,0]=2 32 B11R1.53 COC1=CC=CN=C1C(C)=O AK-80679 [1,0,0,0,0,0|1,0,0]=2 33 B11R1.53 COC1=CC=CN=C1[N+](=O)[O-] AK-47507 [1,0,0,0,0,0|2,0,1]=4 34 B11R1.53 COC1=NC=CC=C1C(C)=O AK110016 [1,0,0,0,0,0|1,0,0]=2 35 B11R1.53 N=C(N)C1=CC=CC=C1OC AK156708 [1,0,0,0,0,0|2,0,0]=3 36 B11R1.53 O=C(O)C1=C(OC)N=CC=C1 AK-45121 [1,0,0,0,0,0|1,0,0]=2 37 B11R1.53 O=C(O)C1=CC=CC=C1C#C AK129466 [1,0,0,0,0,0|1,0,1]=3 38 B11R1.53 O=C(O)C1=CC=CC=C1CC AK-77452 [1,0,0,0,0,0|1,0,0]=2 39 B11R1.53 O=C(O)C1=CC=CC=C1CO AK-35845 [1,0,0,0,0,0|2,0,0]=3 40 B11R1.53 O=C(O)C1=CC=CC=C1OC AK-77451 [1,0,0,0,0,0|0,0,0]=1 41 B11R1.53 O=C(O)C1=CN=CC=C1CC AK452545 [1,0,0,0,0,0|2,0,0]=3 42 B11R1.53 O=[N+](C1=CC=CC=C1SC)[O-] AK-39306 [1,0,0,0,0,0|1,1,1]=4 43 B11R1.53 O=[N+](C1=CC=CN=C1OC)[O-] AK-29926 [1,0,0,0,0,0|2,0,1]=4 44 B11R1.53 OB(C1=CC=CC=C1CC)O AK-48806 [1,0,0,0,0,0|2,0,1]=4 45 B11R1.53 OB(C1=CC=CC=C1OC)O AK-25218 [1,0,0,0,0,0|1,0,1]=3 46 B11R1.53 OB(C1=CC=CC=C1SC)O AK-47931 [1,0,0,0,0,0|1,1,1]=4 47 B11R1.222 BrC1=CN=CN=C1C(=O)OC AK-25053 [1,0,0,0,0,0|3,0,0]=4 48 B11R1.222 BrC1=NC=CN=C1C(=O)OC AK-30735 [1,0,0,0,0,0|3,0,0]=4 49 B11R1.222 C1=C(C(=O)OC)C(=NC=C1)F AK-25162 [1,0,0,0,0,0|2,0,0]=3 50 B11R1.222 C1=CC=CC(=C1C(OC)=O)Br AK-72980 [1,0,0,0,0,0|1,0,0]=2 51 B11R1.222 C1=CC=NC(=C1C(OC)=O)Cl AK-44999 [1,0,0,0,0,0|2,0,0]=3 52 B11R1.222 C1=CC=NC(=C1C(OC)=O)N AK-27747 [1,0,0,0,0,0|2,0,0]=3 53 B11R1.222 C1=CN=C(C(=N1)C(OC)=O)N AK-29912 [1,0,0,0,0,0|3,0,0]=4 54 B11R1.222 CC1=C(C(=O)OC)C=CC=N1 AK-27990 [1,0,0,0,0,0|1,0,0]=2 55 B11R1.222 CCC(C1=CC=CC=C1Cl)=O AK-86142 [1,0,0,0,0,0|2,0,0]=3 56 B11R1.222 COC(=O)C1=C(C)N=CC=N1 AK-97091 [1,0,0,0,0,0|2,0,0]=3 57 B11R1.222 COC(=O)C1=C(C=NC=C1)I AK-23705 [1,0,0,0,0,0|2,0,0]=3 58 B11R1.222 COC(=O)C1=C(N)C=CC=C1 AK-41339 [1,0,0,0,0,0|1,0,0]=2 59 B11R1.222 COC(=O)C1=CC=NNC1=O AK100226 [1,0,0,0,0,0|2,0,1]=4 60 B11R1.222 COC(=O)C1=CN=CN=C1O AK-26014 [1,0,0,0,0,0|2,0,0]=3 61 B11R1.222 COC(=O)C1=NC=CC=C1C AK-61199 [1,0,0,0,0,0|1,0,0]=2 62 B11R1.222 ClC1=C(N=CC=C1)C(=O)OC AK-23912 [1,0,0,0,0,0|2,0,0]=3 63 B11R1.222 ClC1=NC=CN=C1C(=O)OC AK-39173 [1,0,0,0,0,0|3,0,0]=4 64 B11R1.222 FC1=CC=CC=C1C(CF)=O AK198962 [1,0,0,0,0,0|3,0,0]=4 65 B11R1.222 NC1=NC=NC=C1C(=O)OC AK-30806 [1,0,0,0,0,0|3,0,0]=4 66 B11R1.222 NCC(=O)C1=C(C=CC=C1)F AK-70904 [1,0,0,0,0,0|3,0,0]=4 67 B11R1.222 N[C@@H](C1=CC=CC=C1C)CC AK-42242 [1,0,0,0,0,0|2,0,1]=4 68 B11R1.222 O=C(C#N)C1=CC=CC=C1F AK154692 [1,0,0,0,0,0|3,0,0]=4 69 B11R1.222 O=C(C1=CC=CNC1=O)OC AK-28355 [1,0,0,0,0,0|1,0,1]=3 70 B11R1.222 O=C(C1=NC=CC=C1Br)OC AK-28556 [1,0,0,0,0,0|2,0,0]=3 71 B11R1.222 O=C(C1=NC=CC=C1F)OC AK-30151 [1,0,0,0,0,0|2,0,0]=3 72 B11R1.222 O=C(C1=NC=CC=C1O)OC AK-26201 [1,0,0,0,0,0|1,0,0]=2 73 B11R1.222 O=C(C1=NC=CN=C1I)OC AK-30597 [1,0,0,0,0,0|3,0,0]=4 74 B11R1.222 O=C(NC)C1=CC=CC=C1N AK-26614 [1,0,0,0,0,0|2,0,0]=3 75 B11R1.222 O=C(NN)C1=CC=CC=C1O AK167835 [1,0,0,0,0,0|2,0,0]=3 76 B11R1.222 O=C(OC)C1=C(O)N=CC=C1 AK-54451 [1,0,0,0,0,0|1,0,0]=2 77 B11R1.222 O=C(OC)C1=CC=CC=C1C AK174020 [1,0,0,0,0,0|0,0,0]=1 78 B11R1.222 O=C(OC)C1=CC=CC=C1Cl AK161838 [1,0,0,0,0,0|1,0,0]=2 79 B11R1.222 O=C(OC)C1=CC=CC=C1I AK-76653 [1,0,0,0,0,0|1,0,0]=2 80 B11R1.222 O=C(OC)C1=CC=CC=C1S AK554462 [1,0,0,0,0,0|0,1,0]=2 81 B11R1.222 O=C(OC)C1=CC=NC=C1Br AK-46004 [1,0,0,0,0,0|2,0,0]=3 82 B11R1.222 O=C(OC)C1=CC=NC=C1N AK-28029 [1,0,0,0,0,0|2,0,0]=3 83 B11R1.222 O=C(OC)C1=CC=NC=C1O AK-49202 [1,0,0,0,0,0|1,0,0]=2 84 B11R1.222 O=C(OC)C1=CN=CC=C1C AK-39773 [1,0,0,0,0,0|1,0,0]=2 85 B11R1.222 O=C(OC)C1=CN=CC=C1N AK-25475 [1,0,0,0,0,0|2,0,0]=3 86 B11R1.222 O=C(OC)C1=NC=CC=C1N AK-29219 [1,0,0,0,0,0|2,0,0]=3 87 B11R1.222 OC1=CC=CC=C1C(NO)=O AK-48843 [1,0,0,0,0,0|2,0,0]=3 88 B11R1.222 OC1=NC=CN=C1C(=O)OC AK-39232 [1,0,0,0,0,0|2,0,0]=3 89 B13R1.107 CCC1=C(C=CC=C1O)C(=O)OC AK100902 [0,1,0,0,0,0|1,0,0]=2 90 B13R1.107 COC(=O)C1=C(OC)C(Br)=CC=C1 AK100685 [0,1,0,0,0,0|0,0,0]=1 91 B13R1.107 COC(C1=C(C(=CC=C1)Cl)CBr)=O AK-48996 [0,1,0,0,0,0|2,0,0]=3 92 B13R1.107 O=C(OC)C1=CC=CC(C)=C1C#N AK167211 [0,1,0,0,0,0|2,0,0]=3 93 B13R1.382 O=C(NN)C1=CC=CC=C1OCC AK161818 [0,1,0,0,0,0|2,0,0]=3 94 B13R1.382 O=C(OC)C1=CC=CC=C1CCBr AK130276 [0,1,0,0,0,0|1,0,0]=2 95 B13R1.464 C1=CC=CC(=C1NC)C(=O)OCC AK-64767 [0,1,0,0,0,0|1,0,0]=2 96 B13R1.464 O=C(OCC)C1=C(C#N)N=CC=C1 AK-53948 [0,1,0,0,0,0|3,0,0]=4 97 B13R1.464 O=C(OCC)C1=CC=CC=C1C#N AK-82519 [0,1,0,0,0,0|2,0,0]=3 98 B13R1.464 O=C(OCC)C1=CC=CC=C1C=O AK139973 [0,1,0,0,0,0|2,0,0]=3 99 B13R1.547 O=C(O)C1=CC=CC=C1C(OC)=O AK-48250 [0,1,0,0,0,0|2,0,0]=3 100 B13R1.547 O=C(OC)C1=CC=NC=C1[N+]([O-])=O AK-90207 [0,1,0,0,0,0|3,0,0]=4 101 B13R1.547 O=C(OC)C1=NC=CC=C1C(Br)Br AK151957 [0,1,0,0,0,0|3,0,0]=4 102 B13R1.547 OB(C1=CC=CC=C1C(OC)=O)O AK-34910 [0,1,0,0,0,0|2,0,0]=3 103 B13R1.2065 BrC1=CC(=C(C(=O)OC)C=C1)CBr AK-26333 [0,1,0,0,0,0|2,0,0]=3 104 B13R1.2065 COC(=O)C1=C(C=C(Cl)C=C1)C#N AK-46968 [0,1,0,0,0,0|2,0,0]=3 105 B13R1.2065 COC(=O)C1=C(OC)C=C(Br)C=C1 AK-41376 [0,1,0,0,0,0|0,0,0]=1 106 B13R1.2065 COC(=O)C1=CC=C(O)C=C1OC AK-46436 [0,1,0,0,0,0|0,0,0]=1 107 B13R1.2065 COC(C1=C(C=C(C=C1)Cl)CBr)=O AK-48994 [0,1,0,0,0,0|2,0,0]=3 108 B13R1.2065 O=C(OC)C1=C(OC)N=C(Br)C=C1 AK138895 [0,1,0,0,0,0|1,0,0]=2 109 B13R1.2065 O=C(OC)C1=C(OC)N=C(Cl)C=C1 AK-51086 [0,1,0,0,0,0|1,0,0]=2 110 B13R1.2065 O=C(OC)C1=CC=C(Br)C=C1C#N AK204322 [0,1,0,0,0,0|2,0,0]=3 111 B13R1.2065 O=C(OC)C1=CC=C(C)C=C1OC AK-38348 [0,1,0,0,0,0|0,0,0]=1 112 B13R1.2065 O=C(OC)C1=CC=C(N)C=C1OC AK-61740 [0,1,0,0,0,0|0,0,0]=1 113 B13R1.2209 CNC1=C(C=C(Br)C=C1)C(=O)OC AK-26829 [0,1,0,0,0,0|1,0,0]=2 114 B13R1.2209 O=C(C1=NC(Br)=CN=C1NC)OC AK146561 [0,1,0,0,0,0|3,0,0]=4 115 B13R1.2209 O=C(OC)C1=CC(Br)=CC=C1CC AK133837 [0,1,0,0,0,0|1,0,0]=2 116 B13R1.2209 O=C(OC)C1=CC(Br)=CC=C1CN AK159138 [0,1,0,0,0,0|2,0,0]=3 117 B13R1.2209 O=C(OC)C1=CC(Cl)=CC=C1C#N AK-47029 [0,1,0,0,0,0|2,0,0]=3 118 B13R1.2209 O=C(OC)C1=CC(Cl)=CC=C1CBr AK-48995 [0,1,0,0,0,0|2,0,0]=3 119 B13R1.2209 O=C(OC)C1=CC(Cl)=CC=C1NC AK174196 [0,1,0,0,0,0|1,0,0]=2 120 B13R1.2209 O=C(OC)C1=CC(F)=CC=C1C#N AK167256 [0,1,0,0,0,0|2,0,0]=3 121 B13R1.2209 O=C(OC)C1=CC(N)=CC=C1C#N AK174329 [0,1,0,0,0,0|2,0,0]=3 122 B13R1.2209 O=C(OC)C1=NC(Br)=CC=C1OC AK-80756 [0,1,0,0,0,0|1,0,0]=2 123 B13R1.2357 O=C(OC)C1=C(Cl)N=CC=C1OC AK167714 [0,1,0,0,0,0|1,0,0]=2 124 B13R1.2357 O=C(OC)C1=C(OC)C=CC=C1O AK148376 [0,1,0,0,0,0|0,0,0]=1 125 B13R1.2357 O=C(OC)C1=C(OC)N=CC=C1Cl AK109712 [0,1,0,0,0,0|1,0,0]=2 126 B11R0.41 O=C(OC)C(CC=C)C(OC)=O AK307265 [0,0,1,0,0,0|1,0,2]=4 127 B13R2.32 CC1CCC2=C(C=CC=C2)C1=O AK110949 [0,0,0,1,0,0|2,0,0]=3 128 B13R2.32 O=C1C(Br)CCC2=C1C=CC=C2 AK-44524 [0,0,0,1,0,0|3,0,0]=4 129 B13R2.32 O=C1N(C)C=CC2=C1C=CC=C2 AK118859 [0,0,0,1,0,0|2,0,1]=4 130 B13R2.91 NC1(C2=CC=CC=C2OC)CC1 AK401290 [0,0,0,1,0,0|2,0,1]=4 131 B13R2.371 O=C1CCC(C)C2=C1C=CC=C2 AK-80112 [0,0,0,1,0,0|2,0,0]=3 132 B13R2.371 O=C1CCC(O)C2=C1C=CC=C2 AK-40574 [0,0,0,1,0,0|3,0,0]=4 133 B13R2.371 O=C1NCC(C2=C1C=CC=C2)=O AK157604 [0,0,0,1,0,0|3,0,0]=4 134 B13R2.371 O=C1OCC(C2=C1C=CC=C2)=O AK241901 [0,0,0,1,0,0|2,0,0]=3 135 B13R2.582 O=C1CCC2=C1C(OC)=CC=C2 AK-79402 [0,0,0,1,0,0|1,0,0]=2 136 B13R2.1613 COC1=C2C=CC=CC2=CC=C1 AK105904 [0,0,0,1,0,0|2,0,1]=4 137 B13R2.1613 COC1=CN=CC2=CC=CC=C12 AK-39644 [0,0,0,1,0,0|3,0,0]=4 138 B13R2.3085 CN1C(=O)C2=C(C=CC=C2)C1=O AK-81927 [0,0,0,1,0,0|3,0,0]=4 139 B13R2.5252 C1=C2C(=CC=C1)NCCCC2=O AK-29782 [0,0,0,1,0,0|2,0,0]=3 140 B13R2.5252 NC1C2=CC=CC=C2OCCC1 AK544241 [0,0,0,1,0,0|2,0,1]=4 141 B13R2.5252 O=C1C2=CC=CC=C2NCCN1 AK-86067 [0,0,0,1,0,0|2,0,0]=3 142 B13R2.5252 O=C1NCCCC2=CC=CC=C12 AK-36067 [0,0,0,1,0,0|2,0,0]=3 143 B11R1.59 O=C(C1=C(CC)NC=C1)OC AK173442 [0,0,0,0,1,0|2,0,0]=3 144 B13R1.91 O=C(NC1=CC=CC=C1OC)CCl AK-98212 [0,0,0,0,0,1|2,0,0]=3 145 B13R1.91 O=C(OC)CC1=C(C#N)C=NC=C1 AK-59656 [0,0,0,0,0,1|3,0,0]=4 146 B10R1.4 CC1=CC=CC=C1CNC AK-89673 [2,0,0,0,0,0|1,0,1]=4 147 B10R1.4 OC1=CC=CC=C1COC AK151421 [2,0,0,0,0,0|0,0,1]=3 148 B10R1.4 OC1=CC=CC=C1OCC AK-94233 [2,0,0,0,0,0|2,0,0]=4 149 B10R1.20 C1=C(C(=CC=C1)OC)NN AK-36141 [2,0,0,0,0,0|2,0,0]=4 150 B10R1.20 C1=CC=CC(=C1C#N)C=O AK-44087 [2,0,0,0,0,0|2,0,0]=4 151 B10R1.20 C1=CC=CC(=C1C#N)OC AK-44736 [2,0,0,0,0,0|1,0,1]=4 152 B10R1.20 COC1=C(C=CC=C1)C#C AK-45758 [2,0,0,0,0,0|0,0,2]=4 153 B10R1.20 COC1=C(C=O)C=CN=C1 AK-76614 [2,0,0,0,0,0|1,0,0]=3 154 B10R1.20 COC1=C(OC)C=NC=C1 AK-40220 [2,0,0,0,0,0|1,0,0]=3 155 B10R1.20 COC1=CC=CC=C1OC AK-48587 [2,0,0,0,0,0|0,0,0]=2 156 B10R1.20 COC1=CC=CN=C1OC AK-43966 [2,0,0,0,0,0|1,0,0]=3 157 B10R1.20 COC1=CN=CN=C1OC AK340266 [2,0,0,0,0,0|2,0,0]=4 158 B10R1.20 O=CC1=C(NC)N=CC=C1 AK106308 [2,0,0,0,0,0|2,0,0]=4 159 B10R1.20 O=CC1=C(OC)C=CN=C1 AK-29552 [2,0,0,0,0,0|1,0,0]=3 160 B10R1.20 O=CC1=C(OC)N=CC=C1 AK-36180 [2,0,0,0,0,0|1,0,0]=3 161 B10R1.20 O=CC1=CC=CC=C1C#C AK157709 [2,0,0,0,0,0|1,0,1]=4 162 B10R1.20 O=CC1=CC=CC=C1CC AK-51264 [2,0,0,0,0,0|1,0,0]=3 163 B10R1.20 O=CC1=CC=CC=C1NC AK120939 [2,0,0,0,0,0|1,0,0]=3 164 B10R1.20 O=CC1=CC=CC=C1OC AK116922 [2,0,0,0,0,0|0,0,0]=2 165 B10R1.20 OCC1=CC=CC=C1CC AK153193 [2,0,0,0,0,0|1,0,1]=4 166 B10R1.20 OCC1=CC=CN=C1OC AK-46985 [2,0,0,0,0,0|1,0,1]=4 167 B10R1.20 OCC1=NC=CC=C1OC AK-35452 [2,0,0,0,0,0|1,0,1]=4 168 B10R1.61 BrC1=C(C=CN=C1)C(=O)O AK-23517 [2,0,0,0,0,0|2,0,0]=4 169 B10R1.61 BrC1=CC=CN=C1C(=O)O AK-25745 [2,0,0,0,0,0|2,0,0]=4 170 B10R1.61 C1=C(C(=CC=C1)B(O)O)O AK-45876 [2,0,0,0,0,0|1,0,1]=4 171 B10R1.61 C1=C(C(=NC=C1)Cl)C(O)=O AK-27015 [2,0,0,0,0,0|2,0,0]=4 172 B10R1.61 C1=C(C(=NC=C1)F)C(O)=O AK-25163 [2,0,0,0,0,0|2,0,0]=4 173 B10R1.61 C1=CC=CC(=C1B(O)O)C AK-33581 [2,0,0,0,0,0|1,0,1]=4 174 B10R1.61 C1=CC=CC(=C1C(C)=O)Br AK-48030 [2,0,0,0,0,0|1,0,0]=3 175 B10R1.61 C1=CC=CC(=C1C(C)=O)N AK-27106 [2,0,0,0,0,0|1,0,0]=3 176 B10R1.61 C1=CC=CC(=C1C(O)=O)F AK-40433 [2,0,0,0,0,0|1,0,0]=3 177 B10R1.61 C1=CC=CC(=C1O)C(=O)C AK-44482 [2,0,0,0,0,0|0,0,0]=2 178 B10R1.61 C1=CC=NC(=C1C)C(O)=O AK-26613 [2,0,0,0,0,0|1,0,0]=3 179 B10R1.61 C1=CN=CC(=C1C(=O)O)F AK-25903 [2,0,0,0,0,0|2,0,0]=4 180 B10R1.61 C1=NC=CC(=C1C(O)=O)C AK-34679 [2,0,0,0,0,0|1,0,0]=3 181 B10R1.61 CC(=O)C1=C(C)N=CC=N1 AK-89662 [2,0,0,0,0,0|2,0,0]=4 182 B10R1.61 CC(=O)C1=C(I)C=CC=C1 AK-84650 [2,0,0,0,0,0|1,0,0]=3 183 B10R1.61 CC(=O)C1=CC=CN=C1F AK-36408 [2,0,0,0,0,0|2,0,0]=4 184 B10R1.61 CC(=O)C1=CC=CN=C1N AK-61895 [2,0,0,0,0,0|2,0,0]=4 185 B10R1.61 CC(=O)C1=NC=CC=C1F AK-36671 [2,0,0,0,0,0|2,0,0]=4 186 B10R1.61 CC(C1=C(O)C=NC=C1)=O AK-68365 [2,0,0,0,0,0|1,0,0]=3 187 B10R1.61 CC(C1=CC=CC=C1C)=O AK-76969 [2,0,0,0,0,0|0,0,0]=2 188 B10R1.61 CC(C1=CC=CC=C1F)=O AK-44672 [2,0,0,0,0,0|1,0,0]=3 189 B10R1.61 CC(C1=CC=CN=C1C)=O AK-60286 [2,0,0,0,0,0|1,0,0]=3 190 B10R1.61 CC(C1=NC=CC=C1Br)=O AK-91392 [2,0,0,0,0,0|2,0,0]=4 191 B10R1.61 CC(C1=NC=CC=C1Cl)=O AK128527 [2,0,0,0,0,0|2,0,0]=4 192 B10R1.61 CC(C1=NC=CC=C1O)=O AK-57786 [2,0,0,0,0,0|1,0,0]=3 193 B10R1.61 CC1=C(C(=O)N)C=CC=N1 AK-39636 [2,0,0,0,0,0|2,0,0]=4 194 B10R1.61 CC1=C(C(=O)O)C=CC=N1 AK-25768 [2,0,0,0,0,0|1,0,0]=3 195 B10R1.61 CC1=C(C=NC=N1)C(O)=O AK-32530 [2,0,0,0,0,0|2,0,0]=4 196 B10R1.61 CC1=NC=CN=C1C(=O)O AK-25946 [2,0,0,0,0,0|2,0,0]=4 197 B10R1.61 CN(C)C1=C(O)C=CC=C1 AK-49738 [2,0,0,0,0,0|2,0,0]=4 198 B10R1.61 C[C@@H](N)C1=CC=CC=C1C AK-45079 [2,0,0,0,0,0|1,0,1]=4 199 B10R1.61 C[C@H](N)C1=CC=CC=C1C AK162902 [2,0,0,0,0,0|1,0,1]=4 200 B10R1.61 ClC1=C(C(=O)O)C=CN=C1 AK-26411 [2,0,0,0,0,0|2,0,0]=4 201 B10R1.61 ClC1=CC=CN=C1C(=O)O AK-23699 [2,0,0,0,0,0|2,0,0]=4 202 B10R1.61 ClC1=CC=NC=C1C(=O)O AK-25252 [2,0,0,0,0,0|2,0,0]=4 203 B10R1.61 FC1=C(C=CN=C1)C(C)=O AK-37142 [2,0,0,0,0,0|2,0,0]=4 204 B10R1.61 FC1=C(N=CC=C1)C(=O)O AK-28801 [2,0,0,0,0,0|2,0,0]=4 205 B10R1.61 NC1=C(C=NC=C1)C(O)=O AK-27731 [2,0,0,0,0,0|2,0,0]=4 206 B10R1.61 O=C(C1=NC=CC=C1N)O AK-25432 [2,0,0,0,0,0|2,0,0]=4 207 B10R1.61 O=C(C1=NC=NC=C1C)O AK140920 [2,0,0,0,0,0|2,0,0]=4 208 B10R1.61 O=C(N)C1=CC=CC=C1Br AK-47071 [2,0,0,0,0,0|2,0,0]=4 209 B10R1.61 O=C(N)C1=CC=CC=C1Cl AK128986 [2,0,0,0,0,0|2,0,0]=4 210 B10R1.61 O=C(N)C1=CC=CC=C1F AK161780 [2,0,0,0,0,0|2,0,0]=4 211 B10R1.61 O=C(N)C1=CC=CC=C1I AK115884 [2,0,0,0,0,0|2,0,0]=4 212 B10R1.61 O=C(N)C1=CC=CC=C1N AK109256 [2,0,0,0,0,0|2,0,0]=4 213 B10R1.61 O=C(N)C1=CC=NC=C1C AK-29933 [2,0,0,0,0,0|2,0,0]=4 214 B10R1.61 O=C(N)C1=NC=CC=C1C AK-48603 [2,0,0,0,0,0|2,0,0]=4 215 B10R1.61 O=C(O)C1=C(N)N=CC=C1 AK-26982 [2,0,0,0,0,0|2,0,0]=4 216 B10R1.61 O=C(O)C1=C(S)N=CC=C1 AK-48961 [2,0,0,0,0,0|1,1,0]=4 217 B10R1.61 O=C(O)C1=CC=CC=C1Br AK-77301 [2,0,0,0,0,0|1,0,0]=3 218 B10R1.61 O=C(O)C1=CC=CC=C1C AK116916 [2,0,0,0,0,0|0,0,0]=2 219 B10R1.61 O=C(O)C1=CC=CC=C1Cl AK-44481 [2,0,0,0,0,0|1,0,0]=3 220 B10R1.61 O=C(O)C1=CC=CC=C1I AK-73132 [2,0,0,0,0,0|1,0,0]=3 221 B10R1.61 O=C(O)C1=CC=NC=C1C AK-30383 [2,0,0,0,0,0|1,0,0]=3 222 B10R1.61 O=C(O)C1=CC=NC=C1N AK-23678 [2,0,0,0,0,0|2,0,0]=4 223 B10R1.61 O=C(O)C1=CC=NC=C1O AK-23523 [2,0,0,0,0,0|1,0,0]=3 224 B10R1.61 O=C(O)C1=CN=CC=C1Br AK-25100 [2,0,0,0,0,0|2,0,0]=4 225 B10R1.61 O=C(O)C1=CN=CC=C1C AK-75600 [2,0,0,0,0,0|1,0,0]=3 226 B10R1.61 O=C(O)C1=NC=CC=C1I AK-29488 [2,0,0,0,0,0|2,0,0]=4 227 B10R1.61 O=C(O)C1=NC=CC=C1O AK-26380 [2,0,0,0,0,0|1,0,0]=3 228 B10R1.61 O=C1C(=CC=CN1)C(O)=O AK-47329 [2,0,0,0,0,0|1,0,1]=4 229 B10R1.61 O=C1C(=CNC=C1)C(=O)O AK-26174 [2,0,0,0,0,0|1,0,1]=4 230 B10R1.61 O=C1C(C(C)=O)=CC=CN1 AK-35911 [2,0,0,0,0,0|1,0,1]=4 231 B10R1.61 O=C1C(C(C)=O)=CNC=C1 AK501394 [2,0,0,0,0,0|1,0,1]=4 232 B10R1.61 OC(=O)C1=CC=CN=C1Br AK-25846 [2,0,0,0,0,0|2,0,0]=4 233 B10R1.61 OC1=CC=CC=C1C(N)=O AK-81394 [2,0,0,0,0,0|1,0,0]=3 234 B10R1.61 OC1=CC=CC=C1C(O)=O AK397674 [2,0,0,0,0,0|0,0,0]=2 235 B10R1.15 C1=C(C(OC)=O)C=CN=C1 AK-46755 [2,0,0,0,0,0|1,0,0]=3 236 B10R1.15 C1=C(C(OC)=O)N=CC=C1 AK-46574 [2,0,0,0,0,0|1,0,0]=3 237 B10R1.15 C1=CC=NC=C1C(OC)=O AK-47410 [2,0,0,0,0,0|1,0,0]=3 238 B10R1.15 C1=NC=CN=C1C(OC)=O AK-47365 [2,0,0,0,0,0|2,0,0]=4 239 B10R1.15 N1=NC=C(C=C1)C(=O)OC AK-48857 [2,0,0,0,0,0|2,0,0]=4 240 B10R1.15 NCC(C1=CC=CC=C1)=O AK-26107 [2,0,0,0,0,0|2,0,0]=4 241 B10R1.15 O=C(C1=NC=CC=N1)OC AK-24352 [2,0,0,0,0,0|2,0,0]=4 242 B10R1.15 O=C(C1=NN=CC=C1)OC AK-68100 [2,0,0,0,0,0|2,0,0]=4 243 B10R1.15 O=C(NC)C1=CC=CC=C1 AK323662 [2,0,0,0,0,0|1,0,0]=3 244 B10R1.15 O=S(C1=CC=CC=C1)OC AK109245 [2,0,0,0,0,0|1,0,0]=3 245 B10R1.15 OCC(=O)C1=CC=CC=C1 AK-94786 [2,0,0,0,0,0|2,0,0]=4 246 B12R1.121 COC1=C(OCCBr)C=CC=C1 AK-89644 [1,1,0,0,0,0|2,0,0]=4 247 B12R1.121 COC1=C(OCCN)C=CC=C1 AK-50535 [1,1,0,0,0,0|2,0,0]=4 248 B12R1.121 OCCCC1=CC=CC=C1OC AK129494 [1,1,0,0,0,0|1,0,1]=4 249 B12R1.169 CCOC1=CC=CC=C1OCC AK-94234 [1,1,0,0,0,0|2,0,0]=4 250 B12R1.46 BrC1=CC(=C(N=C1)OC)C(=O)O AK-27745 [1,1,0,0,0,0|1,0,0]=3 251 B12R1.46 CC(C1=CC(Br)=CC=C1OC)=O AK-40233 [1,1,0,0,0,0|0,0,0]=2 252 B12R1.46 CC(C1=CC(F)=CC=C1OC)=O AK126688 [1,1,0,0,0,0|0,0,0]=2 253 B12R1.46 CC1=CC=C(OC)C(C(C)C)=C1 AK127708 [1,1,0,0,0,0|1,0,1]=4 254 B12R1.46 COC1=C(C=C(C)C=C1)C(O)=O AK-89618 [1,1,0,0,0,0|0,0,0]=2 255 B12R1.46 COC1=CC=C(Br)C=C1[N+]([O-])=O AK-34740 [1,1,0,0,0,0|1,0,1]=4 256 B12R1.46 COC1=CC=C(Cl)C=C1B(O)O AK-36797 [1,1,0,0,0,0|1,0,1]=4 257 B12R1.46 NC1=CC=C(OC)C(C(C)C)=C1 AK140561 [1,1,0,0,0,0|1,0,1]=4 258 B12R1.46 NC1=CC=C(OC)C([N+]([O-])=O)=C1 AK-35719 [1,1,0,0,0,0|1,0,1]=4 259 B12R1.46 O=C(N)C1=CC(Br)=CC=C1NC AK251316 [1,1,0,0,0,0|2,0,0]=4 260 B12R1.46 O=C(O)C1=C(OC)C=NC(Br)=C1 AK119928 [1,1,0,0,0,0|1,0,0]=3 261 B12R1.46 O=C(O)C1=C(OC)N=CC(Cl)=C1 AK-81689 [1,1,0,0,0,0|1,0,0]=3 262 B12R1.46 O=C(O)C1=C(OC)N=CC(F)=C1 AK-36696 [1,1,0,0,0,0|1,0,0]=3 263 B12R1.46 O=C(O)C1=CC(Br)=CC=C1OC AK-24341 [1,1,0,0,0,0|0,0,0]=2 264 B12R1.46 O=C(O)C1=CC(Cl)=CC=C1OC AK-47654 [1,1,0,0,0,0|0,0,0]=2 265 B12R1.46 O=C(O)C1=CC(F)=CC=C1OC AK-34999 [1,1,0,0,0,0|0,0,0]=2 266 B12R1.46 O=[N+](C1=CC(F)=CC=C1OC)[O-] AK-53788 [1,1,0,0,0,0|1,0,1]=4 267 B12R1.46 O=[N+](C1=CC(I)=CC=C1OC)[O-] AK115135 [1,1,0,0,0,0|1,0,1]=4 268 B12R1.46 OB(C1=CC(Br)=CC=C1OC)O AK-36794 [1,1,0,0,0,0|1,0,1]=4 269 B12R1.46 OB(C1=CC(C)=CC=C1OC)O AK-33075 [1,1,0,0,0,0|1,0,1]=4 270 B12R1.46 OC(=O)C1=C(C=O)C=CC(Cl)=C1 AK-79888 [1,1,0,0,0,0|2,0,0]=4 271 B12R1.46 OC1=CC=C(OC)C([N+]([O-])=O)=C1 AK-33414 [1,1,0,0,0,0|1,0,1]=4 272 B12R1.57 C1=C(F)C=CC(=C1OC)C(O)=O AK-35011 [1,1,0,0,0,0|0,0,0]=2 273 B12R1.57 CC(C1=CC=C(Br)C=C1OC)=O AK104826 [1,1,0,0,0,0|0,0,0]=2 274 B12R1.57 COC1=C(C=CC(=C1)O)[N+](=O)[O-] AK-47446 [1,1,0,0,0,0|1,0,1]=4 275 B12R1.57 COC1=C(C=CC(Br)=C1)C(O)=O AK-28153 [1,1,0,0,0,0|0,0,0]=2 276 B12R1.57 COC1=C(C=CC(Br)=C1)[N+]([O-])=O AK-80201 [1,1,0,0,0,0|1,0,1]=4 277 B12R1.57 COC1=C(C=CC(Cl)=C1)B(O)O AK-36317 [1,1,0,0,0,0|1,0,1]=4 278 B12R1.57 COC1=C(C=CC(Cl)=N1)C(O)=O AK-67843 [1,1,0,0,0,0|1,0,0]=3 279 B12R1.57 COC1=C(C=CC(N)=C1)C(C)=O AK-86813 [1,1,0,0,0,0|0,0,0]=2 280 B12R1.57 COC1=C(C=CC(N)=C1)[N+]([O-])=O AK-79735 [1,1,0,0,0,0|1,0,1]=4 281 B12R1.57 COC1=CC(Cl)=CC=C1[N+]([O-])=O AK-26237 [1,1,0,0,0,0|1,0,1]=4 282 B12R1.57 ClC1=NC=C(C(=O)O)C(=C1)OC AK-47449 [1,1,0,0,0,0|1,0,0]=3 283 B12R1.57 FC1=CC(=C(C=C1)[N+](=O)[O-])OC AK-27021 [1,1,0,0,0,0|1,0,1]=4 284 B12R1.57 O=C(O)C1=C(OC)N=C(Br)C=C1 AK121840 [1,1,0,0,0,0|1,0,0]=3 285 B12R1.57 O=C(O)C1=C(OC)N=C(N)C=C1 AK550297 [1,1,0,0,0,0|1,0,0]=3 286 B12R1.57 O=C(O)C1=CC=C(Br)C=C1CO AK141775 [1,1,0,0,0,0|2,0,0]=4 287 B12R1.57 O=C(O)C1=CC=C(Br)C=C1NN AK601795 [1,1,0,0,0,0|2,0,0]=4 288 B12R1.57 O=C(O)C1=CC=C(Cl)C=C1OC AK-35706 [1,1,0,0,0,0|0,0,0]=2 289 B12R1.57 OB(C1=CC=C(F)C=C1OC)O AK-33789 [1,1,0,0,0,0|1,0,1]=4 290 B12R1.76 O=S(C1=CC=CC=C1OC)(Cl)=O AK-45769 [1,1,0,0,0,0|1,0,1]=4 291 B12R1.87 CC(C1=CC=CC(F)=C1OC)=O AK-68623 [1,1,0,0,0,0|0,0,0]=2 292 B12R1.87 COC1=C(C=CC=C1Br)C(C)=O AK100687 [1,1,0,0,0,0|0,0,0]=2 293 B12R1.87 COC1=C(C=CC=C1Cl)B(O)O AK-84172 [1,1,0,0,0,0|1,0,1]=4 294 B12R1.87 COC1=C(C=CC=C1F)C(O)=O AK-32772 [1,1,0,0,0,0|0,0,0]=2 295 B12R1.87 COC1=C([N+]([O-])=O)C=CC=C1Cl AK-36435 [1,1,0,0,0,0|1,0,1]=4 296 B12R1.87 ClC1=CC=CC(=C1OC)C(=O)O AK-34697 [1,1,0,0,0,0|0,0,0]=2 297 B12R1.87 O=C(O)C1=CC=CC(Br)=C1CC AK141322 [1,1,0,0,0,0|1,0,0]=3 298 B12R1.87 O=C(O)C1=CC=CC(Br)=C1OC AK-51515 [1,1,0,0,0,0|0,0,0]=2 299 B12R1.87 O=C(O)C1=CC=CC(F)=C1NC AK174305 [1,1,0,0,0,0|1,0,0]=3 300 B12R1.87 O=[N+](C1=C(OC)C(Br)=CC=C1)[O-] AK-83535 [1,1,0,0,0,0|1,0,1]=4 301 B12R1.261 C1=CC=CC(=C1C(C)=O)[N+](=O)[O-] AK-54010 [1,1,0,0,0,0|2,0,0]=4 302 B12R1.261 CN(C)C1=C(C=CC=C1)C(O)=O AK-77302 [1,1,0,0,0,0|1,0,0]=3 303 B12R1.261 O=C(O)C1=CC=CC=C1B(O)O AK-33370 [1,1,0,0,0,0|2,0,0]=4 304 B12R1.261 O=C(O)C1=CC=CC=C1[N+]([O-])=O AK-49895 [1,1,0,0,0,0|2,0,0]=4 305 B12R1.437 BrC1=C(C(=O)O)C(=CC=C1)OC AK-34652 [1,1,0,0,0,0|0,0,0]=2 306 B12R1.437 C1=C(C(=C(C=C1)Cl)C(O)=O)OC AK-24452 [1,1,0,0,0,0|0,0,0]=2 307 B12R1.437 CC(C1=C(C)C=CC=C1OC)=O AK145156 [1,1,0,0,0,0|0,0,0]=2 308 B12R1.437 CC(C1=C(OC)C=CC=C1Br)=O AK144491 [1,1,0,0,0,0|0,0,0]=2 309 B12R1.437 CC(C1=C(OC)C=CC=C1Cl)=O AK128371 [1,1,0,0,0,0|0,0,0]=2 310 B12R1.437 CC(C1=C(OC)C=CC=C1F)=O AK-44489 [1,1,0,0,0,0|0,0,0]=2 311 B12R1.437 CC(C1=C(OC)C=CC=C1O)=O AK-76818 [1,1,0,0,0,0|0,0,0]=2 312 B12R1.437 COC1=C(C(O)=O)C(Cl)=CN=C1 AK101793 [1,1,0,0,0,0|1,0,0]=3 313 B12R1.437 COC1=CC=CC(Br)=C1[N+]([O-])=O AK-35337 [1,1,0,0,0,0|1,0,1]=4 314 B12R1.437 COC1=CC=CC(Cl)=C1B(O)O AK-40420 [1,1,0,0,0,0|1,0,1]=4 315 B12R1.437 COC1=CC=CC(O)=C1C(O)=O AK-81588 [1,1,0,0,0,0|0,0,0]=2 316 B12R1.437 FC1=C(C(=O)O)C(=CC=C1)OC AK-33199 [1,1,0,0,0,0|0,0,0]=2 317 B12R1.437 FC1=CC=CC(=C1[N+](=O)[O-])OC AK-35967 [1,1,0,0,0,0|1,0,1]=4 318 B12R1.437 NC1=C(C(=O)O)C(=CC=C1)OC AK-32458 [1,1,0,0,0,0|0,0,0]=2 319 B12R1.437 NC1=CC=CC(OC)=C1[N+]([O-])=O AK-76066 [1,1,0,0,0,0|1,0,1]=4 320 B12R1.437 O=C(N)C1=C(OC)C=CC=C1Br AK145908 [1,1,0,0,0,0|1,0,0]=3 321 B12R1.437 O=C(O)C1=C(C)C=CC=C1OC AK-35864 [1,1,0,0,0,0|0,0,0]=2 322 B12R1.437 O=C(O)C1=C(Cl)N=CC=C1OC AK158984 [1,1,0,0,0,0|1,0,0]=3 323 B12R1.437 O=C(O)C1=C(OC)N=CC=C1Cl AK167713 [1,1,0,0,0,0|1,0,0]=3 324 B12R1.24 BrC1=C(C(=O)OC)C=CC=C1C AK-26780 [1,1,0,0,0,0|1,0,0]=3 325 B12R1.24 C1=C(C(=C(C=C1)C)N)C(OC)=O AK-32253 [1,1,0,0,0,0|1,0,0]=3 326 B12R1.24 C1=C(C(=C(Cl)C=C1)O)C(=O)OC AK-40718 [1,1,0,0,0,0|0,0,0]=2 327 B12R1.24 COC(=O)C1=C(C)C(Br)=CC=C1 AK-40045 [1,1,0,0,0,0|0,0,0]=2 328 B12R1.24 COC(=O)C1=CC=CC(Br)=C1F AK-54792 [1,1,0,0,0,0|1,0,0]=3 329 B12R1.24 COC(C1=C(C(=CC=C1)Cl)N)=O AK-72996 [1,1,0,0,0,0|1,0,0]=3 330 B12R1.24 COC(C1=C(C(=CC=C1)N)N)=O AK-46703 [1,1,0,0,0,0|1,0,0]=3 331 B12R1.24 COC(C1=C(C(=NC=C1)Cl)F)=O AK-35915 [1,1,0,0,0,0|2,0,0]=4 332 B12R1.24 NC1=C(C(=O)OC)C=CC=C1F AK-73081 [1,1,0,0,0,0|1,0,0]=3 333 B12R1.24 O=C(C1=CC=CC(N1C)=O)OC AK130484 [1,1,0,0,0,0|1,0,0]=3 334 B12R1.24 O=C(OC)C1=CC=CC(Br)=C1Cl AK145354 [1,1,0,0,0,0|1,0,0]=3 335 B12R1.24 O=C(OC)C1=CC=CC(Br)=C1N AK-50612 [1,1,0,0,0,0|1,0,0]=3 336 B12R1.24 O=C(OC)C1=CC=CC(Br)=C1O AK136127 [1,1,0,0,0,0|0,0,0]=2 337 B12R1.24 O=C(OC)C1=CC=CC(C)=C1C AK136365 [1,1,0,0,0,0|0,0,0]=2 338 B12R1.24 O=C(OC)C1=CC=CC(C)=C1F AK-86744 [1,1,0,0,0,0|1,0,0]=3 339 B12R1.24 O=C(OC)C1=CC=CC(Cl)=C1Cl AK115924 [1,1,0,0,0,0|1,0,0]=3 340 B12R1.24 O=C(OC)C1=CC=CC(F)=C1O AK116128 [1,1,0,0,0,0|0,0,0]=2 341 B12R1.24 O=C(OC)C1=CC=CC(I)=C1C AK-94556 [1,1,0,0,0,0|0,0,0]=2 342 B12R1.24 O=C(OC)C1=CC=CC(N)=C1Br AK-32786 [1,1,0,0,0,0|1,0,0]=3 343 B12R1.24 O=C(OC)C1=CC=CC(N)=C1C AK-61635 [1,1,0,0,0,0|0,0,0]=2 344 B12R1.24 O=C(OC)C1=CC=CC(N)=C1Cl AK141780 [1,1,0,0,0,0|1,0,0]=3 345 B12R1.24 O=C(OC)C1=CC=CC(O)=C1N AK-59663 [1,1,0,0,0,0|1,0,0]=3 346 B12R1.24 O=C(OC)C1=CC=NC(Cl)=C1C AK-82326 [1,1,0,0,0,0|1,0,0]=3 347 B12R1.24 O=C(OC)C1=CC=NC(Cl)=C1Cl AK114429 [1,1,0,0,0,0|2,0,0]=4 348 B12R1.24 O=C(OC)C1=CC=NC(Cl)=C1N AK-28890 [1,1,0,0,0,0|2,0,0]=4 349 B12R1.24 O=C(OC)C1=CC=NC(F)=C1F AK-53681 [1,1,0,0,0,0|2,0,0]=4 350 B12R1.24 O=C(OC)C1=CN=CC(Br)=C1O AK137339 [1,1,0,0,0,0|1,0,0]=3 351 B12R1.24 O=C(OC)C1=NC=CC(Cl)=C1C AK-32423 [1,1,0,0,0,0|1,0,0]=3 352 B12R1.24 O=C(OC)C1=NC=CC(Cl)=C1F AK100169 [1,1,0,0,0,0|2,0,0]=4 353 B12R1.124 CC(Br)C(C1=CC=CC=C1Cl)=O AK208953 [1,1,0,0,0,0|2,0,0]=4 354 B12R1.308 C(C)OC(C1=CN=CC=C1Cl)=O AK-29976 [1,1,0,0,0,0|2,0,0]=4 355 B12R1.308 C1=CC=CC(=C1C(OCC)=O)F AK-46540 [1,1,0,0,0,0|1,0,0]=3 356 B12R1.308 C1=CC=NC(=C1C(OCC)=O)Cl AK-39200 [1,1,0,0,0,0|2,0,0]=4 357 B12R1.308 CCOC(=O)C1=C(C)N=CN=C1 AK-82588 [1,1,0,0,0,0|2,0,0]=4 358 B12R1.308 CCOC(=O)C1=CC=CN=C1Br AK-35509 [1,1,0,0,0,0|2,0,0]=4 359 B12R1.308 CCOC(=O)C1=CC=CN=C1C AK-25491 [1,1,0,0,0,0|1,0,0]=3 360 B12R1.308 NC1=C(C(=O)OCC)C=CC=N1 AK-23890 [1,1,0,0,0,0|2,0,0]=4 361 B12R1.308 NC1=C(C=CN=C1)C(=O)OCC AK-21982 [1,1,0,0,0,0|2,0,0]=4 362 B12R1.308 O=C(OCC)C1=CC=CC=C1Cl AK117233 [1,1,0,0,0,0|1,0,0]=3 363 B12R1.308 O=C(OCC)C1=CC=CC=C1I AK-94262 [1,1,0,0,0,0|1,0,0]=3 364 B12R1.308 O=C(OCC)C1=CC=CC=C1O AK114211 [1,1,0,0,0,0|0,0,0]=2 365 B12R1.308 O=C(OCC)C1=CC=NC=C1Cl AK167712 [1,1,0,0,0,0|2,0,0]=4 366 B12R1.308 O=C(OCC)C1=NC=CC=C1Br AK128513 [1,1,0,0,0,0|2,0,0]=4 367 B12R1.308 O=C(OCC)C1=NC=CC=C1N AK-76176 [1,1,0,0,0,0|2,0,0]=4 368 B12R1.308 O=C(OCC)C1=NC=CC=C1O AK126269 [1,1,0,0,0,0|1,0,0]=3 369 B12R1.354 BrC1=CC(=C(N=C1)F)C(=O)OC AK-26871 [1,1,0,0,0,0|2,0,0]=4 370 B12R1.354 C1=C(C(=CC=C1Br)C)C(=O)OC AK-72499 [1,1,0,0,0,0|0,0,0]=2 371 B12R1.354 C1=C(Cl)C=CC(=C1C(OC)=O)N AK-70910 [1,1,0,0,0,0|1,0,0]=3 372 B12R1.354 C1=C(O)C=CC(=C1C(OC)=O)O AK-46580 [1,1,0,0,0,0|0,0,0]=2 373 B12R1.354 COC(=O)C1=C(Br)C=CC(C)=C1 AK-64919 [1,1,0,0,0,0|1,0,0]=3 374 B12R1.354 COC(=O)C1=C(Br)C=CC(Cl)=C1 AK-46759 [1,1,0,0,0,0|1,0,0]=3 375 B12R1.354 COC(=O)C1=C(Br)C=CC(F)=C1 AK-53851 [1,1,0,0,0,0|1,0,0]=3 376 B12R1.354 COC(=O)C1=C(Cl)C=CC(O)=C1 AK-40211 [1,1,0,0,0,0|1,0,0]=3 377 B12R1.354 COC(=O)C1=C(Cl)N=CC(C)=C1 AK-67048 [1,1,0,0,0,0|2,0,0]=4 378 B12R1.354 COC(=O)C1=C(F)C=CC(F)=C1 AK-79666 [1,1,0,0,0,0|1,0,0]=3 379 B12R1.354 COC(=O)C1=C(I)C=CC(Br)=C1 AK-48957 [1,1,0,0,0,0|1,0,0]=3 380 B12R1.354 COC(=O)C1=C(I)C=CC(F)=C1 AK-43507 [1,1,0,0,0,0|1,0,0]=3 381 B12R1.354 COC(=O)C1=C(N)C=CC(C)=C1 AK-40247 [1,1,0,0,0,0|1,0,0]=3 382 B12R1.354 COC(=O)C1=C(N)C=CC(F)=C1 AK-79131 [1,1,0,0,0,0|1,0,0]=3 383 B12R1.354 COC(=O)C1=C(O)C=CC(Br)=C1 AK-59850 [1,1,0,0,0,0|0,0,0]=2 384 B12R1.354 COC(=O)C1=C(O)C=CC(N)=C1 AK-82780 [1,1,0,0,0,0|0,0,0]=2 385 B12R1.354 COC(=O)C1=CC(Br)=CNC1=O AK-44252 [1,1,0,0,0,0|1,0,1]=4 386 B12R1.354 FC1=CC(=C(C=C1)C)C(=O)OC AK-49054 [1,1,0,0,0,0|0,0,0]=2 387 B12R1.354 NC1=C(C(=O)OC)C=C(C=C1)O AK-28110 [1,1,0,0,0,0|1,0,0]=3 388 B12R1.354 NC1=C(C(=O)OC)C=C(C=N1)C AK-28006 [1,1,0,0,0,0|2,0,0]=4 389 B12R1.354 NC1=CC(=C(C=C1)C)C(=O)OC AK-25532 [1,1,0,0,0,0|0,0,0]=2 390 B12R1.354 NC1=NC=C(C=C1C(=O)OC)Br AK-24044 [1,1,0,0,0,0|2,0,0]=4 391 B12R1.354 O=C(C1=CC(Br)=NC=C1F)OC AK186022 [1,1,0,0,0,0|2,0,0]=4 392 B12R1.354 O=C(C1=CC(I)=CNC1=O)OC AK-82570 [1,1,0,0,0,0|1,0,1]=4 393 B12R1.354 O=C(C1=CC(N)=NC=C1Br)OC AK-30491 [1,1,0,0,0,0|2,0,0]=4 394 B12R1.354 O=C(C1=NC(Cl)=CN=C1C)OC AK158180 [1,1,0,0,0,0|2,0,0]=4 395 B12R1.354 O=C(NO)C1=CC(Cl)=CC=C1O AK-80149 [1,1,0,0,0,0|2,0,0]=4 396 B12R1.354 O=C(OC)C1=C(Br)C=NC(O)=C1 AK-29594 [1,1,0,0,0,0|2,0,0]=4 397 B12R1.354 O=C(OC)C1=C(Br)N=CC(C)=C1 AK100323 [1,1,0,0,0,0|2,0,0]=4 398 B12R1.354 O=C(OC)C1=C(C)N=CC(Cl)=C1 AK-39713 [1,1,0,0,0,0|1,0,0]=3 399 B12R1.354 O=C(OC)C1=C(Cl)C=NC(Cl)=C1 AK126033 [1,1,0,0,0,0|2,0,0]=4 400 B12R1.354 O=C(OC)C1=C(Cl)N=CC(Br)=C1 AK-23916 [1,1,0,0,0,0|2,0,0]=4 401 B12R1.354 O=C(OC)C1=C(Cl)N=CC(Cl)=C1 AK-36081 [1,1,0,0,0,0|2,0,0]=4 402 B12R1.354 O=C(OC)C1=C(F)N=CC(F)=C1 AK187952 [1,1,0,0,0,0|2,0,0]=4 403 B12R1.354 O=C(OC)C1=C(N)N=CC(Cl)=C1 AK-76210 [1,1,0,0,0,0|2,0,0]=4 404 B12R1.354 O=C(OC)C1=C(N)N=CC(I)=C1 AK136170 [1,1,0,0,0,0|2,0,0]=4 405 B12R1.354 O=C(OC)C1=CC(Br)=CC=C1Br AK113243 [1,1,0,0,0,0|1,0,0]=3 406 B12R1.354 O=C(OC)C1=CC(Br)=CC=C1F AK104796 [1,1,0,0,0,0|1,0,0]=3 407 B12R1.354 O=C(OC)C1=CC(Br)=CC=C1N AK-42294 [1,1,0,0,0,0|1,0,0]=3 408 B12R1.354 O=C(OC)C1=CC(Cl)=CC=C1Cl AK135726 [1,1,0,0,0,0|1,0,0]=3 409 B12R1.354 O=C(OC)C1=CC(Cl)=CC=C1I AK194044 [1,1,0,0,0,0|1,0,0]=3 410 B12R1.354 O=C(OC)C1=CC(Cl)=CC=C1O AK-80153 [1,1,0,0,0,0|0,0,0]=2 411 B12R1.354 O=C(OC)C1=CC(F)=CC=C1O AK-81427 [1,1,0,0,0,0|0,0,0]=2 412 B12R1.354 O=C(OC)C1=CC(I)=CC=C1C AK130391 [1,1,0,0,0,0|0,0,0]=2 413 B12R1.354 O=C(OC)C1=CC(I)=CC=C1Cl AK113568 [1,1,0,0,0,0|1,0,0]=3 414 B12R1.354 O=C(OC)C1=CC(N)=CC=C1Br AK126705 [1,1,0,0,0,0|1,0,0]=3 415 B12R1.354 O=C(OC)C1=CC(N)=CC=C1Cl AK-61315 [1,1,0,0,0,0|1,0,0]=3 416 B12R1.354 O=C(OC)C1=CC(O)=CC=C1F AK-64940 [1,1,0,0,0,0|1,0,0]=3 417 B12R1.354 O=C(OC)C1=NC(C)=CC=C1O AK123477 [1,1,0,0,0,0|1,0,0]=3 418 B12R1.354 O=C(OC)C1=NC(Cl)=CC=C1C AK-32402 [1,1,0,0,0,0|1,0,0]=3 419 B12R1.354 O=C(OC)C1=NC(Cl)=CC=C1N AK-47130 [1,1,0,0,0,0|2,0,0]=4 420 B12R1.1703 BrC1=C(C(=O)OC)C=CC(=C1)C AK-46754 [1,1,0,0,0,0|1,0,0]=3 421 B12R1.1703 BrC1=CC(=C(C(=O)OC)C=C1)C AK-28097 [1,1,0,0,0,0|0,0,0]=2 422 B12R1.1703 C1=C(C(=CC(=C1)F)Cl)C(OC)=O AK-47401 [1,1,0,0,0,0|1,0,0]=3 423 B12R1.1703 C1=C(C(=CC(=C1)O)O)C(OC)=O AK-50554 [1,1,0,0,0,0|0,0,0]=2 424 B12R1.1703 C1=CC(=CC(=C1C(OC)=O)O)N AK-45502 [1,1,0,0,0,0|0,0,0]=2 425 B12R1.1703 COC(=O)C1=C(Br)C=C(F)C=C1 AK-46746 [1,1,0,0,0,0|1,0,0]=3 426 B12R1.1703 COC(=O)C1=C(C)C=C(I)C=C1 AK-77363 [1,1,0,0,0,0|0,0,0]=2 427 B12R1.1703 COC(=O)C1=C(F)C=C(Br)C=C1 AK-46835 [1,1,0,0,0,0|1,0,0]=3 428 B12R1.1703 COC(=O)C1=C(N)C=C(I)C=C1 AK-37605 [1,1,0,0,0,0|1,0,0]=3 429 B12R1.1703 COC(=O)C1=C(O)C=C(C)C=C1 AK-82342 [1,1,0,0,0,0|0,0,0]=2 430 B12R1.1703 COC(=O)C1=CC=C(C)C=C1N AK-61296 [1,1,0,0,0,0|1,0,0]=3 431 B12R1.1703 COC(=O)C1=CC=C(O)C=C1Cl AK-32726 [1,1,0,0,0,0|1,0,0]=3 432 B12R1.1703 COC(=O)C1=NC=C(C=C1C)Br AK-25600 [1,1,0,0,0,0|1,0,0]=3 433 B12R1.1703 COC(C1=C(C=C(C=C1)N)F)=O AK-75833 [1,1,0,0,0,0|1,0,0]=3 434 B12R1.1703 ClC1=CC(=NC=C1C(=O)OC)Cl AK-23913 [1,1,0,0,0,0|2,0,0]=4 435 B12R1.1703 FC1=C(C(=O)OC)C=CC(=C1)O AK-41478 [1,1,0,0,0,0|1,0,0]=3 436 B12R1.1703 FC1=CC(=C(C(=O)OC)C=C1)O AK-49085 [1,1,0,0,0,0|0,0,0]=2 437 B12R1.1703 NC1=CC(=C(C(=O)OC)C=C1)C AK-46101 [1,1,0,0,0,0|0,0,0]=2 438 B12R1.1703 NC1=CC(=C(C(=O)OC)C=C1)Cl AK-40022 [1,1,0,0,0,0|1,0,0]=3 439 B12R1.1703 O=C(C1=NN=C(O)C=C1O)OC AK-51407 [1,1,0,0,0,0|2,0,0]=4 440 B12R1.1703 O=C(NC)C1=CC=C(Br)C=C1F AK-98185 [1,1,0,0,0,0|2,0,0]=4 441 B12R1.1703 O=C(NC)C1=CC=C(N)C=C1F AK135551 [1,1,0,0,0,0|2,0,0]=4 442 B12R1.1703 O=C(OC)C1=C(C)N=C(F)C=C1 AK198785 [1,1,0,0,0,0|1,0,0]=3 443 B12R1.1703 O=C(OC)C1=C(Cl)N=C(C)C=C1 AK-28460 [1,1,0,0,0,0|2,0,0]=4 444 B12R1.1703 O=C(OC)C1=C(Cl)N=C(Cl)C=C1 AK-82618 [1,1,0,0,0,0|2,0,0]=4 445 B12R1.1703 O=C(OC)C1=CC=C(Br)C=C1Cl AK107560 [1,1,0,0,0,0|1,0,0]=3 446 B12R1.1703 O=C(OC)C1=CC=C(Br)C=C1N AK-53857 [1,1,0,0,0,0|1,0,0]=3 447 B12R1.1703 O=C(OC)C1=CC=C(Br)C=C1O AK-88441 [1,1,0,0,0,0|0,0,0]=2 448 B12R1.1703 O=C(OC)C1=CC=C(C)C=C1C AK140642 [1,1,0,0,0,0|0,0,0]=2 449 B12R1.1703 O=C(OC)C1=CC=C(Cl)C=C1Br AK-64354 [1,1,0,0,0,0|1,0,0]=3 450 B12R1.1703 O=C(OC)C1=CC=C(Cl)C=C1I AK201245 [1,1,0,0,0,0|1,0,0]=3 451 B12R1.1703 O=C(OC)C1=CC=C(Cl)C=C1N AK-72924 [1,1,0,0,0,0|1,0,0]=3 452 B12R1.1703 O=C(OC)C1=CC=C(Cl)C=C1O AK-46989 [1,1,0,0,0,0|0,0,0]=2 453 B12R1.1703 O=C(OC)C1=CC=C(F)C=C1C AK-63369 [1,1,0,0,0,0|0,0,0]=2 454 B12R1.1703 O=C(OC)C1=CC=C(F)C=C1F AK-39185 [1,1,0,0,0,0|1,0,0]=3 455 B12R1.1703 O=C(OC)C1=CC=C(I)C=C1F AK174064 [1,1,0,0,0,0|1,0,0]=3 456 B12R1.1703 O=C(OC)C1=CC=C(I)C=C1O AK144550 [1,1,0,0,0,0|0,0,0]=2 457 B12R1.1703 O=C(OC)C1=CN=C(Br)C=C1Cl AK157951 [1,1,0,0,0,0|2,0,0]=4 458 B12R1.1703 O=C(OC)C1=CN=C(C)C=C1N AK321488 [1,1,0,0,0,0|2,0,0]=4 459 B12R1.1703 O=C(OC)C1=CN=C(N)C=C1Cl AK543110 [1,1,0,0,0,0|2,0,0]=4 460 B12R1.1703 O=C(OC)C1=CN=C(O)C=C1O AK-65278 [1,1,0,0,0,0|1,0,0]=3 461 B12R1.1703 O=C(OC)C1=NC=C(Br)C=C1Cl AK128538 [1,1,0,0,0,0|2,0,0]=4 462 B12R1.1703 O=C(OC)C1=NC=C(F)C=C1C AK146488 [1,1,0,0,0,0|1,0,0]=3 463 B12R1.3441 BrC1=C(C(=O)OC)C(=CC=C1)C AK-29651 [1,1,0,0,0,0|0,0,0]=2 464 B12R1.3441 COC(=O)C1=C(Br)C=CC=C1F AK-98628 [1,1,0,0,0,0|1,0,0]=3 465 B12R1.3441 COC(=O)C1=C(Cl)C=CC=C1F AK-79668 [1,1,0,0,0,0|1,0,0]=3 466 B12R1.3441 COC(=O)C1=C(O)C=CC=C1C AK-72747 [1,1,0,0,0,0|0,0,0]=2 467 B12R1.3441 ClC1=C(C(=O)OC)C(=CC=N1)Cl AK-46583 [1,1,0,0,0,0|2,0,0]=4 468 B12R1.3441 O=C(OC)C1=C(Br)C=CC=C1N AK-58414 [1,1,0,0,0,0|1,0,0]=3 469 B12R1.3441 O=C(OC)C1=C(C)C=CC=C1N AK-33845 [1,1,0,0,0,0|0,0,0]=2 470 B12R1.3441 O=C(OC)C1=C(Cl)C=CC=C1Br AK-61908 [1,1,0,0,0,0|1,0,0]=3 471 B12R1.3441 O=C(OC)C1=C(Cl)C=CC=C1N AK157079 [1,1,0,0,0,0|1,0,0]=3 472 B12R1.3441 O=C(OC)C1=C(Cl)N=CC=C1I AK-28929 [1,1,0,0,0,0|2,0,0]=4 473 B12R1.3441 O=C(OC)C1=C(F)C=CC=C1F AK-58617 [1,1,0,0,0,0|1,0,0]=3 474 B12R1.3441 O=C(OC)C1=C(F)C=NC=C1Br AK134751 [1,1,0,0,0,0|2,0,0]=4 475 B12R1.3441 O=C(OC)C1=C(F)N=CC=C1I AK-36697 [1,1,0,0,0,0|2,0,0]=4 476 B12R1.3441 O=C(OC)C1=C(O)C=CC=C1F AK-80495 [1,1,0,0,0,0|0,0,0]=2 477 B12R1.3441 O=C(OC)C1=C(O)C=CC=C1O AK-64730 [1,1,0,0,0,0|0,0,0]=2 478 B12R1.316 O=C(C1=CNN=C1OC)OCC AK164956 [0,1,0,0,1,0|2,0,0]=4 479 B14R1.95 O=C(OC)C(Br)C1=CC=CC=C1OC AK128117 [0,1,0,0,0,1|0,0,0]=2 480 B14R1.3302 COC(=O)CC1=C(C=CC=C1)C(O)=O AK-38489 [0,1,0,0,0,1|2,0,0]=4 481 B14R1.3302 O=C(OC)CC1=CC=CC=C1[N+]([O-])=O AK-77166 [0,1,0,0,0,1|2,0,0]=4 482 B14R1.1153 C1=C(C(=C(C=C1)C)[N+]([O-])=O)C(OC)=O AK-73064 [0,2,0,0,0,0|2,0,0]=4 483 B14R1.1153 COC(=O)C1=C(C(O)=CC=C1)[N+]([O-])=O AK-77566 [0,2,0,0,0,0|2,0,0]=4 484 B14R1.1153 O=C(O)C1=C(C(OC)=O)C=CC=C1Br AK554616 [0,2,0,0,0,0|2,0,0]=4 485 B14R1.2171 COC(=O)C1=C(OC)C(OC)=CC=C1 AK-40893 [0,2,0,0,0,0|0,0,0]=2 486 B14R1.2171 O=C(OC)C1=CC=CC(C=O)=C1OC AK146189 [0,2,0,0,0,0|0,0,0]=2 487 B14R1.12435 O=C(OC)C1=CC=C(N)C(N)=C1OC AK141357 [0,2,0,0,0,0|0,0,0]=2 488 B14R1.12530 O=C(C1=NC(Cl)=NC(Cl)=C1OC)OC AK103254 [0,2,0,0,0,0|2,0,0]=4 489 B14R1.263 CCCC(C1=C(OCC)C=CN=C1)=O AK431784 [0,2,0,0,0,0|2,0,0]=4 490 B14R1.744 O=C(O)CC1=CC=CC=C1C(OC)=O AK554545 [0,2,0,0,0,0|1,0,1]=4 491 B14R1.746 O=C(C1=NC=CC=C1C(OC)=O)OC AK-43317 [0,2,0,0,0,0|1,0,0]=3 492 B14R1.789 O=C(OC)C1=CC=CC=C1NCC#N AK445558 [0,2,0,0,0,0|1,0,0]=3 493 B14R1.789 OCC#CC1=C(C(=O)OC)C=CC=C1 AK-57152 [0,2,0,0,0,0|1,0,0]=3 494 B14R1.623 O=C(C1=CC=CC=C1B(O)O)OCC AK-45558 [0,2,0,0,0,0|2,0,0]=4 495 B14R1.623 O=C(OCC)C1=CC=CC=C1C(C)=O AK124155 [0,2,0,0,0,0|1,0,0]=3 496 B14R1.7276 O=C(OCC)C1=C(C)C=CC=C1OC AK-80357 [0,2,0,0,0,0|0,0,0]=2 497 B14R1.707 C1=C(C(=CC=C1Cl)[N+](=O)[O-])C(OC)=O AK-47288 [0,2,0,0,0,0|2,0,0]=4 498 B14R1.707 O=C(OC)C1=CC(F)=CC=C1[N+]([O-])=O AK-39891 [0,2,0,0,0,0|2,0,0]=4 499 B14R1.707 O=C(OC)C1=CC(N)=CC=C1[N+]([O-])=O AK-77401 [0,2,0,0,0,0|2,0,0]=4 500 B14R1.745 O=C(OC)C1=CC=CC=C1S(=O)(Cl)=O AK-49631 [0,2,0,0,0,0|1,1,0]=4 501 B14R1.1126 O=C(OC)C1=CC=C(Br)C=C1[N+]([O-])=O AK-64845 [0,2,0,0,0,0|2,0,0]=4 502 B14R1.1164 COC(=O)C1=C(C)C=CC=C1[N+]([O-])=O AK-35874 [0,2,0,0,0,0|2,0,0]=4 503 B14R1.1164 O=C(OC)C1=C([N+]([O-])=O)C=CC=C1Br AK141782 [0,2,0,0,0,0|2,0,0]=4 504 B14R1.1164 O=C(OC)C1=C([N+]([O-])=O)C=CC=C1O AK-76215 [0,2,0,0,0,0|2,0,0]=4 505 B14R1.346 O=C(OC)C1=C(OC)C=C(Br)C=C1F AK138920 [0,2,0,0,0,0|0,0,0]=2 506 B14R1.2287 COC(=O)C1=C(OC)C=C(N)C(I)=C1 AK-58789 [0,2,0,0,0,0|0,0,0]=2 507 B14R1.2287 O=C(OC)C1=CC(Br)=C(C)C=C1OC AK133856 [0,2,0,0,0,0|0,0,0]=2 508 B14R1.2334 C1=C(C(=CC=C1OC)C(OC)=O)CBr AK-25456 [0,2,0,0,0,0|2,0,0]=4 509 B14R1.2334 COC1=NC=C(C(=N1)OC)C(=O)OC AK-26767 [0,2,0,0,0,0|2,0,0]=4 510 B14R1.2334 O=C(OC)C1=C(OC)N=C(OC)C=C1 AK128337 [0,2,0,0,0,0|1,0,0]=3 511 B14R1.2334 O=C(OC)C1=CC=C(C#N)C=C1OC AK204971 [0,2,0,0,0,0|0,0,0]=2 512 B14R1.2334 O=C(OC)C1=CC=C(CBr)C=C1OC AK-38343 [0,2,0,0,0,0|0,0,0]=2 513 B14R1.2315 COC(=O)C1=C(OC)C=CC(C=O)=C1 AK-78739 [0,2,0,0,0,0|0,0,0]=2 514 B14R1.2315 O=C(OC)C1=CC(OC)=CC=C1CBr AK100623 [0,2,0,0,0,0|2,0,0]=4 515 B12R1.367 C1=C(C=CC(=C1C)Br)C(OC)=O AK-32180 [0,0,1,1,0,0|2,0,0]=4 516 B12R1.367 COC(=O)C1=CC(C)=C(I)C=C1 AK-26110 [0,0,1,1,0,0|2,0,0]=4 517 B12R1.367 FC1=C(C=C(C(=O)OC)C=C1)C AK-46648 [0,0,1,1,0,0|2,0,0]=4 518 B12R1.367 O=C(OC)C1=CC=C(Cl)C(C)=C1 AK117510 [0,0,1,1,0,0|2,0,0]=4 519 B12R1.367 O=C(OC)C1=CC=C(N)C(C)=C1 AK-41505 [0,0,1,1,0,0|2,0,0]=4 520 B12R1.367 O=C(OC)C1=CC=C(O)C(C)=C1 AK-78928 [0,0,1,1,0,0|2,0,0]=4 521 B12R1.27 O=C(OC)\C=C\C1=CC=CC=C1 AK-93451 [0,0,1,1,0,0|1,0,1]=4 522 B12R1.1879 O=CC1=C(OC)C=CC=C1OC AK-79290 [0,0,1,1,0,0|2,0,0]=4 523 B12R1.58 C1=C(OC)C=C(C=C1C=O)OC AK-47442 [0,0,1,1,0,0|2,0,0]=4 524 B12R2.18 C1=C([N](C2=CC=CC=C12)C)C AK-47660 [1,0,0,1,0,0|2,0,0]=4 525 B12R2.41 C1COC2=C(CN1)C=CC=C2 AK-90077 [1,0,0,1,0,0|1,0,1]=4 526 B12R2.315 C1=C[NH]C2=C1C(=CC=C2)OC AK-29290 [1,0,0,1,0,0|2,0,0]=4 527 B12R2.315 COC1=CC=CC2=C1C=NN2 AK-32142 [1,0,0,1,0,0|2,0,0]=4 528 B12R2.315 COC1=CC=CC2=C1CNC2 AK134878 [1,0,0,1,0,0|1,0,1]=4 529 B12R2.2028 BrC1CC(=O)C2=C1C=CC=C2 AK-32505 [1,0,0,1,0,0|2,0,0]=4 530 B12R2.2028 O=C1CC(C2=C1C=CC=C2)=O AK307475 [1,0,0,1,0,0|2,0,0]=4 531 B12R2.2028 O=C1NN(C)C2=C1C=CC=C2 AK155423 [1,0,0,1,0,0|2,0,0]=4 532 B12R2.2028 O=C1OC(O)C2=C1C=CC=C2 AK607884 [1,0,0,1,0,0|2,0,0]=4 533 B12R2.203 CC1=CC=CC2=C1C(=O)CC2 AK-41002 [1,0,0,1,0,0|1,0,0]=3 534 B12R2.203 FC1=C2C(CCC2=CC=C1)=O AK-30094 [1,0,0,1,0,0|2,0,0]=4 535 B12R2.203 O=C1CCC2=C1C(Br)=CC=C2 AK-28759 [1,0,0,1,0,0|2,0,0]=4 536 B12R2.203 O=C1CCC2=C1C(Cl)=CC=C2 AK-29207 [1,0,0,1,0,0|2,0,0]=4 537 B12R2.203 O=C1CCC2=C1C(N)=CC=C2 AK-30069 [1,0,0,1,0,0|2,0,0]=4 538 B12R2.203 O=C1CCC2=C1C(O)=CC=C2 AK-36137 [1,0,0,1,0,0|1,0,0]=3 539 B14R2.95 COC(=O)C1=N[NH]C2=CC=CC=C12 AK-25967 [0,0,0,1,0,1|2,0,0]=4 540 B14R2.95 O=C(C1=CNC2=C1C=CC=C2)OC AK-47146 [0,0,0,1,0,1|1,0,1]=4 541 B14R2.11645 O=C1NC2=C(C=CC=C2OC)C1=O AK-79361 [0,0,0,1,0,1|2,0,0]=4 542 B14R2.6175 O=C1C(C)(C)CCC2=C1C=CC=C2 AK375145 [0,1,0,1,0,0|2,0,0]=4 543 B14R2.98 COC1=CC=CC=C1C2=CC=CO2 AK198830 [0,1,0,1,0,0|1,0,1]=4 544 B14R2.685 O=C1CCCCC2=C(N)C=CC=C21 AK116878 [0,1,0,1,0,0|2,0,0]=4 545 B14R2.10782 C1=CC=C2C(=C1C(OC)=O)[NH]C=C2 AK-54054 [0,1,0,1,0,0|1,0,1]=4 546 B14R2.10782 C1=C[NH]C2=C1C(=CC=C2)C(OC)=O AK-30347 [0,1,0,1,0,0|1,0,1]=4 547 B14R2.10782 COC(=O)C1=CC=CC2=C1N=CO2 AK100258 [0,1,0,1,0,0|1,0,1]=4 548 B14R2.10782 COC(=O)C1=CC=CC2=C1OC=N2 AK100260 [0,1,0,1,0,0|0,0,1]=3 549 B14R2.10782 COC(=O)C1=CC=CC2=C1SC=N2 AK-31618 [0,1,0,1,0,0|0,1,1]=4 550 B14R2.10782 O=C(C1=C2C(NC=N2)=CC=C1)OC AK-79020 [0,1,0,1,0,0|1,0,1]=4 551 B14R2.10782 O=C(C1=C2OCOC2=CC=C1)OC AK-78847 [0,1,0,1,0,0|0,0,0]=2 552 B14R2.10782 O=C(C1=CC=CC2=C1CNC2)OC AK-77906 [0,1,0,1,0,0|1,0,0]=3 553 B14R2.10782 O=C(C1=CC=CC2=C1NN=C2)OC AK-36301 [0,1,0,1,0,0|1,0,1]=4 554 B14R2.10782 O=C(C1=CC=CC2=CNN=C12)OC AK-76343 [0,1,0,1,0,0|1,0,1]=4 555 B14R2.11635 COC1=C2C(CCCC2=CC=C1)=O AK-39264 [0,1,0,1,0,0|1,0,0]=3 556 B14R2.11635 O=C1CCOC2=C1C(OC)=CC=C2 AK119567 [0,1,0,1,0,0|1,0,0]=3 557 B14R2.11691 CN1N=C(Cl)C2=C1C=CC=C2OC AK144985 [0,1,0,1,0,0|2,0,0]=4 558 B14R2.11691 O=C1OC(C2=C1C=CC=C2OC)=O AK199097 [0,1,0,1,0,0|0,0,1]=3 559 B14R2.8719 O=C1C2=CC=C(Br)C=C2OCCC1 AK103132 [0,1,0,1,0,0|1,0,0]=3 560 B14R2.8719 O=C1CCCCC2=CC(N)=CC=C21 AK103172 [0,1,0,1,0,0|2,0,0]=4 561 B14R2.29369 O=C1N(C)CCC2=C1C=CC(Br)=C2 AK545500 [0,1,0,1,0,0|2,0,0]=4 562 B14R2.5637 BrC1=CC2=C(OCCCC2=O)C=C1 AK-81692 [0,1,0,1,0,0|1,0,0]=3 563 B14R2.5637 BrC1=CC=C2CCCCC(=O)C2=C1 AK-84594 [0,1,0,1,0,0|2,0,0]=4 564 B14R2.5637 ClC1=CC2=C(NCCCC2=O)C=C1 AK-29885 [0,1,0,1,0,0|2,0,0]=4 565 B10R1.39 CCN1C=CC=C1C(C)=O AK-87978 [1,0,0,0,1,0|2,0,0]=4 566 B10R1.39 O=C(C1=CSC=C1OC)O AK-36174 [1,0,0,0,1,0|1,0,0]=3 567 B10R1.149 C1=CSC(=C1C(OC)=O)N AK-26003 [1,0,0,0,1,0|2,0,0]=4 568 B10R1.149 CC1=C(C=CS1)C(=O)OC AK-40494 [1,0,0,0,1,0|1,0,0]=3 569 B10R1.149 CC1=C(SC=N1)C(=O)OC AK-27820 [1,0,0,0,1,0|2,0,0]=4 570 B10R1.149 CC1=N[NH]C=C1C(=O)OC AK-31098 [1,0,0,0,1,0|2,0,0]=4 571 B10R1.149 COC(=O)C1=C(Br)SC=C1 AK-68215 [1,0,0,0,1,0|2,0,0]=4 572 B10R1.149 COC(=O)C1=C(C)C=CO1 AK-89345 [1,0,0,0,1,0|1,0,0]=3 573 B10R1.149 COC(=O)C1=C(Cl)C=CN1 AK109924 [1,0,0,0,1,0|2,0,0]=4 574 B10R1.149 COC(=O)C1=CSC=C1Br AK102742 [1,0,0,0,1,0|2,0,0]=4 575 B10R1.149 NC1=C(OC=C1)C(=O)OC AK-28297 [1,0,0,0,1,0|2,0,0]=4 576 B10R1.149 O=C(C1=C(Br)C=CS1)OC AK-24670 [1,0,0,0,1,0|2,0,0]=4 577 B10R1.149 O=C(C1=C(C)C=CS1)OC AK-29549 [1,0,0,0,1,0|1,0,0]=3 578 B10R1.149 O=C(C1=C(F)C=CS1)OC AK-40928 [1,0,0,0,1,0|2,0,0]=4 579 B10R1.149 O=C(C1=C(N)C=CS1)OC AK-26736 [1,0,0,0,1,0|2,0,0]=4 580 B10R1.149 O=C(C1=C(O)C=CN1)OC AK123374 [1,0,0,0,1,0|1,0,0]=3 581 B10R1.149 O=C(C1=C(O)C=CS1)OC AK-41067 [1,0,0,0,1,0|1,0,0]=3 582 B10R1.149 O=C(C1=CC=NN1C)OC AK119024 [1,0,0,0,1,0|2,0,0]=4 583 B10R1.149 O=C(C1=CNC=C1C)OC AK126219 [1,0,0,0,1,0|1,0,0]=3 584 B10R1.149 O=C(C1=NC=CN1C)OC AK139738 [1,0,0,0,1,0|2,0,0]=4 585 B14R1.863 C(=O)C1=C(OCC(=O)OC)C=CC=C1 AK-21928 [0,0,0,0,0,2|2,0,0]=4