0 B10R1.17 BrCCOC1=CC=CC=C1 AC-23943 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.17 BrC\C=C\C1=CC=CC=C1 AC-27040 [0,0,0,0,0,0|2,0,2]=4 2 B10R1.17 CCCCC1=CC=NC=C1 AC-79321 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.17 CCNCC1=CC=CC=C1 AC-23535 [0,0,0,0,0,0|2,0,1]=3 4 B10R1.17 CCNCC1=NC=CC=C1 AC-41270 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.17 CNCCC1=CC=CN=C1 AC-86271 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.17 ClCSCC1=CC=CC=C1 AC-94728 [0,0,0,0,0,0|1,1,1]=3 7 B10R1.17 ClC\C=C\C1=CC=CC=C1 AC-93428 [0,0,0,0,0,0|2,0,2]=4 8 B10R1.17 N#CC#CC1=CC=CC=C1 AC-79420 [0,0,0,0,0,0|2,0,2]=4 9 B10R1.17 N#CCNC1=CC=CC=C1 AC-64031 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.17 NCC#CC1=CC=CC=C1 AC-44516 [0,0,0,0,0,0|2,0,2]=4 11 B10R1.17 NCCCC1=CC=NC=C1 AC-58135 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.17 NCCCC1=NC=CC=C1 AC-81362 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.17 NCCNC1=CC=CC=C1 AC-23964 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.17 O=CC#CC1=CC=CC=C1 AC-61166 [0,0,0,0,0,0|1,0,1]=2 15 B10R1.17 OCCCC1=CC=CC=C1 AC-90879 [0,0,0,0,0,0|1,0,2]=3 16 B10R1.17 OCCCC1=CC=CN=C1 AC-63756 [0,0,0,0,0,0|2,0,2]=4 17 B10R1.17 OCCCC1=NC=CC=C1 AC-72227 [0,0,0,0,0,0|2,0,2]=4 18 B10R1.17 OC\C=C\C1=CC=CC=C1 AC-96518 [0,0,0,0,0,0|1,0,3]=4 19 B9R1.8 BrCCC1=CC=CC=C1 AC-10988 [1,0,0,0,0,0|1,0,1]=3 20 B9R1.8 BrCCC1=NC=CC=C1 AC-24894 [1,0,0,0,0,0|2,0,1]=4 21 B9R1.8 BrCCC1=NC=CC=C1 AC-33015 [1,0,0,0,0,0|2,0,1]=4 22 B9R1.8 Br\C=C\C1=CC=CC=C1 AC-15087 [1,0,0,0,0,0|1,0,1]=3 23 B9R1.8 CCCC1=CC=NC=C1 AC-12668 [1,0,0,0,0,0|2,0,1]=4 24 B9R1.8 CCOC1=NC=CC=C1 AC-11163 [1,0,0,0,0,0|2,0,1]=4 25 B9R1.8 CNCC1=CC=CN=C1 AC-31451 [1,0,0,0,0,0|2,0,1]=4 26 B9R1.8 CNCC1=CC=NC=C1 AC-41285 [1,0,0,0,0,0|2,0,1]=4 27 B9R1.8 CNCC1=CC=NC=C1 AC-92743 [1,0,0,0,0,0|2,0,1]=4 28 B9R1.8 CNCC1=NC=CC=C1 AC-41284 [1,0,0,0,0,0|2,0,1]=4 29 B9R1.8 CNNC1=CC=CC=C1 AC-86441 [1,0,0,0,0,0|2,0,1]=4 30 B9R1.8 COCC1=NC=CC=C1 AC-30327 [1,0,0,0,0,0|1,0,1]=3 31 B9R1.8 N#CCC1=CC=CN=C1 AC-24013 [1,0,0,0,0,0|2,0,1]=4 32 B9R1.8 N#CCC1=NC=CC=C1 AC-11591 [1,0,0,0,0,0|2,0,1]=4 33 B9R1.8 NCCC1=CC=CN=C1 AC-10206 [1,0,0,0,0,0|2,0,1]=4 34 B9R1.8 NCCC1=CC=CN=C1 AC-95294 [1,0,0,0,0,0|2,0,1]=4 35 B9R1.8 NCCC1=NC=CC=C1 AC-22649 [1,0,0,0,0,0|2,0,1]=4 36 B9R1.8 NNCC1=CC=CC=C1 AC-75839 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.8 NNCC1=CC=CN=C1 AC-75992 [1,0,0,0,0,0|3,0,0]=4 38 B9R1.8 NNCC1=CC=NC=C1 AC-69402 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.8 NNCC1=CC=NC=C1 AC-75993 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.8 NNCC1=NC=CC=C1 AC-75991 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.8 NOCC1=CC=CC=C1 AC-13722 [1,0,0,0,0,0|1,0,0]=2 42 B9R1.8 O=CCC1=NC=CC=C1 AC-86545 [1,0,0,0,0,0|1,0,0]=2 43 B9R1.8 O=COC1=CC=CC=C1 AC-86693 [1,0,0,0,0,0|0,0,0]=1 44 B9R1.8 OCCC1=CC=CN=C1 AC-17846 [1,0,0,0,0,0|1,0,2]=4 45 B9R1.8 OCCC1=NC=CC=C1 AC-57914 [1,0,0,0,0,0|1,0,2]=4 46 B9R1.8 ONCC1=CC=CC=C1 AC-45409 [1,0,0,0,0,0|1,0,1]=3 47 B9R1.8 [C-]#[N+]CC1=NC=CC=C1 AC-76114 [1,0,0,0,0,0|2,0,1]=4 48 B11R1.1 CC1=CC=C(\C=C\C=O)C=C1 AC-76926 [0,1,0,0,0,0|1,0,1]=3 49 B11R1.1 CCCCC1=CC=C(Br)C=C1 AC-33706 [0,1,0,0,0,0|2,0,1]=4 50 B11R1.1 CCCCC1=CC=C(I)C=C1 AC-77139 [0,1,0,0,0,0|2,0,1]=4 51 B11R1.1 CCNCC1=CC=C(Br)C=C1 AC-38745 [0,1,0,0,0,0|2,0,1]=4 52 B11R1.1 CCNCC1=CC=C(Cl)C=C1 AC-38746 [0,1,0,0,0,0|2,0,1]=4 53 B11R1.1 CCNCC1=CC=C(Cl)C=C1 AC-88177 [0,1,0,0,0,0|2,0,1]=4 54 B11R1.1 CNCCC1=CC=C(Br)C=C1 AC-95450 [0,1,0,0,0,0|3,0,0]=4 55 B11R1.1 CNCCC1=CC=C(C)C=C1 AC-92276 [0,1,0,0,0,0|3,0,0]=4 56 B11R1.1 CNCCC1=CC=C(Cl)C=C1 AC-38790 [0,1,0,0,0,0|3,0,0]=4 57 B11R1.1 CNCCC1=CC=C(F)C=C1 AC-93825 [0,1,0,0,0,0|3,0,0]=4 58 B11R1.1 CNCCC1=CC=C(O)C=C1 AC-86530 [0,1,0,0,0,0|3,0,0]=4 59 B11R1.1 ClCCCC1=CC=C(Cl)C=C1 AC-34962 [0,1,0,0,0,0|2,0,1]=4 60 B11R1.1 N#CCCC1=CC=C(Br)C=C1 AC-18561 [0,1,0,0,0,0|2,0,1]=4 61 B11R1.1 NCCCC1=CC=C(Cl)C=C1 AC-59478 [0,1,0,0,0,0|2,0,1]=4 62 B11R1.1 O=C\C=C\C1=CC=C(F)C=C1 AC-66142 [0,1,0,0,0,0|1,0,1]=3 63 B11R1.1 O=C\C=C\C1=CC=C(O)C=C1 AC-80157 [0,1,0,0,0,0|1,0,1]=3 64 B11R1.16 N#CCC(O)C1=CC=CC=C1 AC-59838 [0,1,0,0,0,0|2,0,1]=4 65 B11R1.16 NC(CCO)C1=CC=CC=C1 AC-32476 [0,1,0,0,0,0|1,0,2]=4 66 B11R1.16 NCCC(O)C1=CC=CC=C1 AC-79691 [0,1,0,0,0,0|2,0,1]=4 67 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 AC-66687 [0,1,0,0,0,0|1,0,2]=4 68 B11R1.16 O[C@@H](CCCl)C1=CC=CC=C1 AC-14427 [0,1,0,0,0,0|2,0,1]=4 69 B11R1.17 CCCCC1=CC=CC=C1Br AC-96717 [0,1,0,0,0,0|2,0,1]=4 70 B11R1.17 CCCCC1=CC=CC=C1N AC-88454 [0,1,0,0,0,0|2,0,1]=4 71 B11R1.17 CCNCC1=CC=CC=C1O AC-86121 [0,1,0,0,0,0|2,0,1]=4 72 B11R1.17 CNCCC1=CC=CC=C1O AC-90214 [0,1,0,0,0,0|3,0,0]=4 73 B11R1.17 N#CCCC1=CC=CC=C1Cl AC-93353 [0,1,0,0,0,0|2,0,1]=4 74 B11R1.17 O=C\C=C\C1=CC=CC=C1F AC-66141 [0,1,0,0,0,0|1,0,1]=3 75 B11R1.17 OCCCC1=CC=CC=C1Br AC-25432 [0,1,0,0,0,0|1,0,2]=4 76 B11R1.17 OCCCC1=CC=CC=C1O AC-85673 [0,1,0,0,0,0|1,0,2]=4 77 B11R1.24 CCNCC1=CC(O)=CC=C1 AC-92385 [0,1,0,0,0,0|2,0,1]=4 78 B11R1.24 CCNCC1=CC=CC(Br)=C1 AC-38744 [0,1,0,0,0,0|2,0,1]=4 79 B11R1.24 CCNCC1=CC=CC(Cl)=C1 AC-86783 [0,1,0,0,0,0|2,0,1]=4 80 B11R1.24 CNCCC1=CC=CC(Cl)=C1 AC-38789 [0,1,0,0,0,0|3,0,0]=4 81 B11R1.24 O=CCCC1=CC=CC(Cl)=C1 AC-85446 [0,1,0,0,0,0|1,0,0]=2 82 B11R1.24 O=CNNC1=NC(Cl)=CC=C1 AC-94397 [0,1,0,0,0,0|3,0,0]=4 83 B11R1.24 OCCCC1=CC(O)=CC=C1 AC-92950 [0,1,0,0,0,0|1,0,2]=4 84 B11R1.28 BrCCCOC1=CC=CC=C1 AC-34539 [0,1,0,0,0,0|2,0,1]=4 85 B11R1.28 BrCCOCC1=CC=CC=C1 AC-73705 [0,1,0,0,0,0|1,0,1]=3 86 B11R1.28 NCCNCC1=CC=CC=C1 AC-22878 [0,1,0,0,0,0|2,0,1]=4 87 B11R1.28 NCCOCC1=CC=CC=C1 AC-76963 [0,1,0,0,0,0|1,0,1]=3 88 B11R1.28 O=CCOCC1=CC=CC=C1 AC-81292 [0,1,0,0,0,0|0,0,0]=1 89 B11R1.40 COC(=N)CC1=CC=CC=C1 AC-95822 [0,1,0,0,0,0|3,0,0]=4 90 B11R1.40 NC(CO)CC1=CC=CC=C1 AC-76906 [0,1,0,0,0,0|1,0,2]=4 91 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 AC-11522 [0,1,0,0,0,0|1,0,2]=4 92 B11R1.40 O=C(CBr)CC1=CC=CC=C1 AC-75854 [0,1,0,0,0,0|2,0,1]=4 93 B11R1.40 O=C\C(Cl)=C\C1=CC=CC=C1 AC-93438 [0,1,0,0,0,0|1,0,1]=3 94 B11R1.91 CC(=O)OCC1=CC=NC=C1 AC-24117 [0,1,0,0,0,0|1,0,0]=2 95 B11R1.91 NC(=O)NCC1=CC=CC=C1 AC-85594 [0,1,0,0,0,0|1,0,0]=2 96 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 AC-37551 [0,1,0,0,0,0|1,0,1]=3 97 B11R1.91 O=C(O)C#CC1=CC=CC=C1 AC-12737 [0,1,0,0,0,0|1,0,1]=3 98 B11R1.91 O=C(O)C#CC1=NC=CC=C1 AC-93902 [0,1,0,0,0,0|2,0,1]=4 99 B11R1.91 O=C(O)CCC1=CC=CN=C1 AC-24033 [0,1,0,0,0,0|2,0,0]=3 100 B11R1.91 O=C(O)CCC1=CC=NC=C1 AC-44325 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.91 O=C(O)COC1=CC=CC=C1 AC-64140 [0,1,0,0,0,0|2,0,0]=3 102 B11R1.91 O=C(O)COC1=NC=CC=C1 AC-63733 [0,1,0,0,0,0|3,0,0]=4 103 B11R1.91 O=C(O)CSC1=CC=NC=C1 AC-61576 [0,1,0,0,0,0|3,0,0]=4 104 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 AC-75552 [0,1,0,0,0,0|2,0,1]=4 105 B11R1.91 O=C([O-])C#CC1=CC=CC=C1 AC-85071 [0,1,0,0,0,0|1,0,1]=3 106 B11R1.91 O=C([O-])\C=C\C1=CC=CC=C1 AC-15127 [0,1,0,0,0,0|1,0,1]=3 107 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 AC-80706 [0,1,0,0,0,0|2,0,0]=3 108 B11R1.91 OB(O)CCC1=CC=CC=C1 AC-20976 [0,1,0,0,0,0|2,0,1]=4 109 B11R2.1 BrC1=CNC2=C1C=CC=C2 AC-25069 [0,0,0,1,0,0|3,0,0]=4 110 B11R2.1 BrC1=COC2=CC=CC=C12 AC-43028 [0,0,0,1,0,0|3,0,0]=4 111 B11R2.1 BrC1=CSC2=CC=CC=C12 AC-16121 [0,0,0,1,0,0|3,0,0]=4 112 B11R2.1 BrC1=NNC2=C1C=CC=C2 AC-25060 [0,0,0,1,0,0|3,0,0]=4 113 B11R2.1 CC1=CNC2=C1C=CC=C2 AC-13153 [0,0,0,1,0,0|3,0,0]=4 114 B11R2.1 CC1=CSC2=CC=CC=C12 AC-61665 [0,0,0,1,0,0|3,0,0]=4 115 B11R2.1 CC1=NNC2=C1C=CC=C2 AC-31044 [0,0,0,1,0,0|3,0,0]=4 116 B11R2.1 ClC1=COC2=CC=CC=C12 AC-86483 [0,0,0,1,0,0|3,0,0]=4 117 B11R2.1 ClC1=NNC2=C1C=CC=C2 AC-61426 [0,0,0,1,0,0|3,0,0]=4 118 B11R2.1 ClC1=NOC2=C1C=CC=C2 AC-16985 [0,0,0,1,0,0|3,0,0]=4 119 B11R2.1 ClC1=NSC2=CC=CC=C21 AC-14541 [0,0,0,1,0,0|3,0,0]=4 120 B11R2.1 IC1=CNC2=C1C=CC=C2 AC-29929 [0,0,0,1,0,0|3,0,0]=4 121 B11R2.1 IC1=CSC2=CC=CC=C12 AC-80484 [0,0,0,1,0,0|3,0,0]=4 122 B11R2.1 NC1=CSC2=CC=CC=C12 AC-80787 [0,0,0,1,0,0|3,0,0]=4 123 B11R2.1 NC1=NNC2=C1C=CC=C2 AC-29846 [0,0,0,1,0,0|3,0,0]=4 124 B11R2.1 NC1=NOC2=C1C=CC=C2 AC-16026 [0,0,0,1,0,0|3,0,0]=4 125 B11R2.1 NC1CCC2=C1C=CC=C2 AC-20254 [0,0,0,1,0,0|2,0,1]=4 126 B11R2.1 NC1CCC2=C1C=CC=C2 AC-39373 [0,0,0,1,0,0|2,0,1]=4 127 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 AC-68865 [0,0,0,1,0,0|2,0,1]=4 128 B11R2.1 O=C1CCC2=C1C=CC=C2 AC-14690 [0,0,0,1,0,0|1,0,0]=2 129 B11R2.1 O=C1CCC2=C1C=CN=C2 AC-69988 [0,0,0,1,0,0|2,0,0]=3 130 B11R2.1 O=C1CCC2=C1C=NC=C2 AC-28080 [0,0,0,1,0,0|2,0,0]=3 131 B11R2.1 O=C1CCC2=CC=CN=C12 AC-28078 [0,0,0,1,0,0|2,0,0]=3 132 B11R2.1 O=C1CCC2=NC=CC=C12 AC-28079 [0,0,0,1,0,0|2,0,0]=3 133 B11R2.1 O=C1COC2=C1C=CN=C2 AC-87743 [0,0,0,1,0,0|3,0,0]=4 134 B11R2.1 O=C1COC2=C1C=CN=C2 AC-92402 [0,0,0,1,0,0|3,0,0]=4 135 B11R2.1 O=C1COC2=CC=CC=C12 AC-24718 [0,0,0,1,0,0|2,0,0]=3 136 B11R2.1 O=C1COC2=NC=CC=C12 AC-80899 [0,0,0,1,0,0|3,0,0]=4 137 B11R2.1 O=C1NCC2=C1C=CC=C2 AC-28098 [0,0,0,1,0,0|1,0,0]=2 138 B11R2.1 O=C1NOC2=C1C=CN=C2 AC-95983 [0,0,0,1,0,0|3,0,0]=4 139 B11R2.1 O=C1NSC2=C1C=CC=C2 AC-13925 [0,0,0,1,0,0|2,0,0]=3 140 B11R2.1 O=C1OCC2=C1C=CC=C2 AC-76770 [0,0,0,1,0,0|0,0,0]=1 141 B11R2.1 OC1=CSC2=CC=CC=C12 AC-16180 [0,0,0,1,0,0|2,0,1]=4 142 B11R2.1 OC1=NNC2=C1C=CC=C2 AC-73906 [0,0,0,1,0,0|2,0,1]=4 143 B11R2.1 OC1OCC2=C1C=CC=C2 AC-95328 [0,0,0,1,0,0|0,0,2]=3 144 B11R2.1 O[C@@H]1CCC2=C1C=CC=C2 AC-83064 [0,0,0,1,0,0|1,0,2]=4 145 B11R2.20 C1=CC2=C(C=C1)COCC2 AC-76958 [0,0,0,1,0,0|1,0,1]=3 146 B11R2.20 C1=CC2=CC=NC=C2C=C1 AC-74175 [0,0,0,1,0,0|2,0,1]=4 147 B11R2.20 C1=CC2=CC=NN=C2C=C1 AC-80878 [0,0,0,1,0,0|3,0,0]=4 148 B11R2.20 C1=CC2=CC=NN=C2C=C1 AC-81439 [0,0,0,1,0,0|3,0,0]=4 149 B11R2.20 C1=CC2=CN=CN=C2C=C1 AC-24044 [0,0,0,1,0,0|2,0,1]=4 150 B11R2.20 C1=CC2=NC=CN=C2C=C1 AC-76783 [0,0,0,1,0,0|3,0,0]=4 151 B11R2.238 C1=CC=C(CC2=NC2)C=C1 AC-83751 [0,0,0,1,0,0|2,0,1]=4 152 B11R2.239 C1=CC=C(C2CNC2)C=C1 AC-39099 [0,0,0,1,0,0|3,0,0]=4 153 B9R1.12 CCOCC1=CC=CO1 AC-77358 [0,0,0,0,1,0|2,0,1]=4 154 B8R1.2 BrCC1=CC=CN=C1 AC-25258 [2,0,0,0,0,0|2,0,0]=4 155 B8R1.2 BrCC1=CC=CN=C1 AC-76498 [2,0,0,0,0,0|2,0,0]=4 156 B8R1.2 BrCC1=NC=CC=C1 AC-25266 [2,0,0,0,0,0|2,0,0]=4 157 B8R1.2 COC1=CC=CN=C1 AC-61633 [2,0,0,0,0,0|1,0,1]=4 158 B8R1.2 COC1=NC=CC=C1 AC-77035 [2,0,0,0,0,0|1,0,1]=4 159 B8R1.2 ClCC1=CC=CN=C1 AC-11627 [2,0,0,0,0,0|2,0,0]=4 160 B8R1.2 ClCC1=CC=NC=C1 AC-11628 [2,0,0,0,0,0|2,0,0]=4 161 B8R1.2 ClCC1=NC=CC=C1 AC-11626 [2,0,0,0,0,0|2,0,0]=4 162 B8R1.2 ICC1=CC=CC=C1 AC-80028 [2,0,0,0,0,0|1,0,0]=3 163 B8R1.2 NCC1=CC=CC=C1 AC-22861 [2,0,0,0,0,0|1,0,0]=3 164 B8R1.2 NCC1=CC=CN=C1 AC-13721 [2,0,0,0,0,0|2,0,0]=4 165 B8R1.2 NCC1=CC=CN=C1 AC-16657 [2,0,0,0,0,0|2,0,0]=4 166 B8R1.2 NCC1=CC=NC=C1 AC-22745 [2,0,0,0,0,0|2,0,0]=4 167 B8R1.2 NCC1=CC=NC=C1 AC-75575 [2,0,0,0,0,0|2,0,0]=4 168 B8R1.2 NCC1=NC=CC=C1 AC-22744 [2,0,0,0,0,0|2,0,0]=4 169 B8R1.2 NOC1=CC=CC=C1 AC-83716 [2,0,0,0,0,0|1,0,0]=3 170 B8R1.2 O=CC1=CC=CN=C1 AC-24016 [2,0,0,0,0,0|1,0,0]=3 171 B8R1.2 O=CC1=CC=NC=C1 AC-15288 [2,0,0,0,0,0|1,0,0]=3 172 B8R1.2 O=CC1=NC=CC=C1 AC-24015 [2,0,0,0,0,0|1,0,0]=3 173 B8R1.2 O=CC1=NC=CN=C1 AC-63783 [2,0,0,0,0,0|2,0,0]=4 174 B8R1.2 OCC1=CC=CN=C1 AC-13420 [2,0,0,0,0,0|1,0,0]=3 175 B8R1.2 OCC1=CC=NC=C1 AC-11666 [2,0,0,0,0,0|1,0,0]=3 176 B8R1.2 OCC1=CC=NN=C1 AC-40989 [2,0,0,0,0,0|2,0,0]=4 177 B8R1.2 OCC1=CN=CN=C1 AC-26624 [2,0,0,0,0,0|2,0,0]=4 178 B8R1.2 OCC1=NC=CC=C1 AC-11665 [2,0,0,0,0,0|1,0,0]=3 179 B8R1.2 OCC1=NC=CC=N1 AC-26633 [2,0,0,0,0,0|2,0,0]=4 180 B8R1.2 OCC1=NC=CN=C1 AC-45233 [2,0,0,0,0,0|2,0,0]=4 181 B8R1.2 OCC1=NN=CC=C1 AC-40990 [2,0,0,0,0,0|2,0,0]=4 182 B10R1.1 CC1=CC=C(CCBr)C=C1 AC-79725 [1,1,0,0,0,0|1,0,1]=4 183 B10R1.1 CC1=CC=C(CCN)C=C1 AC-66651 [1,1,0,0,0,0|1,0,1]=4 184 B10R1.1 CC1=CC=C(CCO)C=C1 AC-85373 [1,1,0,0,0,0|0,0,2]=4 185 B10R1.1 CC1=CC=C(CNN)C=C1 AC-80941 [1,1,0,0,0,0|2,0,0]=4 186 B10R1.1 CC1=CC=C(CNN)C=C1 AC-93370 [1,1,0,0,0,0|2,0,0]=4 187 B10R1.1 CCCC1=CC=C(Br)C=C1 AC-10989 [1,1,0,0,0,0|1,0,1]=4 188 B10R1.1 CCOC1=CC=C(I)C=C1 AC-14563 [1,1,0,0,0,0|1,0,1]=4 189 B10R1.1 CCOC1=CC=C(O)C=C1 AC-23515 [1,1,0,0,0,0|1,0,1]=4 190 B10R1.1 CNCC1=CC=C(Br)C=C1 AC-38785 [1,1,0,0,0,0|1,0,1]=4 191 B10R1.1 CNCC1=CC=C(C)C=C1 AC-72102 [1,1,0,0,0,0|1,0,1]=4 192 B10R1.1 CNCC1=CC=C(F)C=C1 AC-38800 [1,1,0,0,0,0|1,0,1]=4 193 B10R1.1 COCC1=CC=C(O)C=C1 AC-30313 [1,1,0,0,0,0|0,0,1]=3 194 B10R1.1 COCC1=CN=C(Cl)C=C1 AC-89029 [1,1,0,0,0,0|1,0,1]=4 195 B10R1.1 ClC1=CC=C(CCBr)C=C1 AC-77013 [1,1,0,0,0,0|1,0,1]=4 196 B10R1.1 FC1=CC=C(CCBr)C=C1 AC-73072 [1,1,0,0,0,0|1,0,1]=4 197 B10R1.1 FC1=CC=C(CCCl)C=C1 AC-17337 [1,1,0,0,0,0|1,0,1]=4 198 B10R1.1 N#CCC1=CC=C(Cl)C=C1 AC-35335 [1,1,0,0,0,0|1,0,1]=4 199 B10R1.1 N#CCC1=CC=C(I)C=C1 AC-23798 [1,1,0,0,0,0|1,0,1]=4 200 B10R1.1 N#CCC1=CC=C(N)C=C1 AC-22770 [1,1,0,0,0,0|1,0,1]=4 201 B10R1.1 N#CCC1=CC=C(O)C=C1 AC-14346 [1,1,0,0,0,0|1,0,1]=4 202 B10R1.1 NC1=CC=C(CCO)C=C1 AC-10397 [1,1,0,0,0,0|0,0,2]=4 203 B10R1.1 NCCC1=CC=C(Br)C=C1 AC-17006 [1,1,0,0,0,0|1,0,1]=4 204 B10R1.1 NCCC1=CC=C(Br)C=C1 AC-25390 [1,1,0,0,0,0|1,0,1]=4 205 B10R1.1 NCCC1=CC=C(Cl)C=C1 AC-26439 [1,1,0,0,0,0|1,0,1]=4 206 B10R1.1 NCCC1=CC=C(F)C=C1 AC-38429 [1,1,0,0,0,0|1,0,1]=4 207 B10R1.1 NCCC1=CC=C(O)C=C1 AC-10670 [1,1,0,0,0,0|1,0,1]=4 208 B10R1.1 NCCC1=CC=C(O)C=C1 AC-10671 [1,1,0,0,0,0|1,0,1]=4 209 B10R1.1 NNCC1=CC=C(F)C=C1 AC-80042 [1,1,0,0,0,0|2,0,0]=4 210 B10R1.1 NOCC1=CC=C(Cl)C=C1 AC-72834 [1,1,0,0,0,0|1,0,0]=3 211 B10R1.1 O=CCC1=CC=C(Br)C=C1 AC-25397 [1,1,0,0,0,0|0,0,0]=2 212 B10R1.1 O=CCC1=CC=C(O)C=C1 AC-82884 [1,1,0,0,0,0|0,0,0]=2 213 B10R1.1 OCCC1=CC=C(Br)C=C1 AC-38196 [1,1,0,0,0,0|0,0,2]=4 214 B10R1.1 OCCC1=CC=C(Cl)C=C1 AC-26438 [1,1,0,0,0,0|0,0,2]=4 215 B10R1.1 OCCC1=CC=C(I)C=C1 AC-80036 [1,1,0,0,0,0|0,0,2]=4 216 B10R1.4 CC1=CC=CC=C1CC#N AC-75241 [1,1,0,0,0,0|1,0,1]=4 217 B10R1.4 CCOC1=CC=CC=C1Br AC-25393 [1,1,0,0,0,0|1,0,1]=4 218 B10R1.4 CCOC1=CC=CC=C1O AC-23517 [1,1,0,0,0,0|1,0,1]=4 219 B10R1.4 COCC1=CC=CC=C1Br AC-75841 [1,1,0,0,0,0|0,0,1]=3 220 B10R1.4 ClC1=CC=CC=C1CCBr AC-38231 [1,1,0,0,0,0|1,0,1]=4 221 B10R1.4 N#CCC1=CC=CC=C1Br AC-33883 [1,1,0,0,0,0|1,0,1]=4 222 B10R1.4 N#CCC1=CC=CC=C1I AC-23796 [1,1,0,0,0,0|1,0,1]=4 223 B10R1.4 NC1=CC=CC=C1CCO AC-32173 [1,1,0,0,0,0|0,0,2]=4 224 B10R1.4 NCCC1=CC=CC=C1Br AC-25392 [1,1,0,0,0,0|1,0,1]=4 225 B10R1.4 NCCC1=CC=CC=C1Cl AC-17496 [1,1,0,0,0,0|1,0,1]=4 226 B10R1.4 NCCC1=CC=CC=C1F AC-38427 [1,1,0,0,0,0|1,0,1]=4 227 B10R1.4 NCCC1=CC=CC=C1N AC-88322 [1,1,0,0,0,0|1,0,1]=4 228 B10R1.4 NCCC1=CC=CC=C1O AC-32404 [1,1,0,0,0,0|1,0,1]=4 229 B10R1.4 NOCC1=CC=CC=C1Cl AC-73620 [1,1,0,0,0,0|1,0,0]=3 230 B10R1.4 O=CCC1=CC=CC=C1O AC-90670 [1,1,0,0,0,0|0,0,0]=2 231 B10R1.4 OCCC1=CC=CC=C1Br AC-33636 [1,1,0,0,0,0|0,0,2]=4 232 B10R1.4 OCCC1=CC=CC=C1I AC-86393 [1,1,0,0,0,0|0,0,2]=4 233 B10R1.10 CC1=CC(CC#N)=CC=C1 AC-61319 [1,1,0,0,0,0|1,0,1]=4 234 B10R1.10 CC1=CC(CCN)=CC=C1 AC-66716 [1,1,0,0,0,0|1,0,1]=4 235 B10R1.10 CC1=CC(CCN)=CC=C1 AC-96075 [1,1,0,0,0,0|1,0,1]=4 236 B10R1.10 CNCC1=CC=CC(Br)=C1 AC-38786 [1,1,0,0,0,0|1,0,1]=4 237 B10R1.10 COCC1=CC(Cl)=NC=C1 AC-88834 [1,1,0,0,0,0|1,0,1]=4 238 B10R1.10 COCC1=CN=CC(Br)=C1 AC-33183 [1,1,0,0,0,0|1,0,1]=4 239 B10R1.10 FC1=CC(CCBr)=CC=C1 AC-19695 [1,1,0,0,0,0|1,0,1]=4 240 B10R1.10 N#CCC1=CC=CC(N)=C1 AC-80758 [1,1,0,0,0,0|1,0,1]=4 241 B10R1.10 NC1=CC(CCO)=CC=C1 AC-76030 [1,1,0,0,0,0|0,0,2]=4 242 B10R1.10 NCCC1=CC(N)=CC=C1 AC-32588 [1,1,0,0,0,0|1,0,1]=4 243 B10R1.10 NCCC1=CC(N)=CC=C1 AC-91002 [1,1,0,0,0,0|1,0,1]=4 244 B10R1.10 NCCC1=CC=CC(Br)=C1 AC-25391 [1,1,0,0,0,0|1,0,1]=4 245 B10R1.10 NCCC1=CC=CC(Br)=C1 AC-90655 [1,1,0,0,0,0|1,0,1]=4 246 B10R1.10 NCCC1=CC=CC(Cl)=C1 AC-26501 [1,1,0,0,0,0|1,0,1]=4 247 B10R1.10 NCCC1=CC=CC(F)=C1 AC-38428 [1,1,0,0,0,0|1,0,1]=4 248 B10R1.10 NCCC1=CC=CC(O)=C1 AC-14733 [1,1,0,0,0,0|1,0,1]=4 249 B10R1.10 NNCC1=CC=CC(Cl)=C1 AC-90652 [1,1,0,0,0,0|2,0,0]=4 250 B10R1.10 NNCC1=CC=CC(F)=C1 AC-58275 [1,1,0,0,0,0|2,0,0]=4 251 B10R1.10 NOCC1=CC=CC(Cl)=C1 AC-92923 [1,1,0,0,0,0|1,0,0]=3 252 B10R1.10 NOCC1=CC=CC(F)=C1 AC-38834 [1,1,0,0,0,0|1,0,0]=3 253 B10R1.10 O=CCC1=CC=CC(O)=C1 AC-82788 [1,1,0,0,0,0|0,0,0]=2 254 B10R1.10 OCCC1=CC=CC(Br)=C1 AC-33732 [1,1,0,0,0,0|0,0,2]=4 255 B10R1.10 OCCC1=CC=CC(Cl)=C1 AC-38230 [1,1,0,0,0,0|0,0,2]=4 256 B10R1.10 OCCC1=CC=CC(F)=C1 AC-66130 [1,1,0,0,0,0|0,0,2]=4 257 B10R1.15 C#CC(O)C1=CC=CC=C1 AC-82932 [1,1,0,0,0,0|1,0,1]=4 258 B10R1.15 CC(CN)C1=CC=CC=C1 AC-76879 [1,1,0,0,0,0|1,0,1]=4 259 B10R1.15 CN(C=O)C1=NC=CC=C1 AC-83726 [1,1,0,0,0,0|2,0,0]=4 260 B10R1.15 CNC(C)C1=CC=CC=C1 AC-75895 [1,1,0,0,0,0|1,0,1]=4 261 B10R1.15 CNC(C)C1=CC=CC=C1 AC-92088 [1,1,0,0,0,0|1,0,1]=4 262 B10R1.15 N#CC(N)C1=CC=CC=C1 AC-83867 [1,1,0,0,0,0|1,0,1]=4 263 B10R1.15 N#CC(N)C1=CC=CC=C1 AC-92943 [1,1,0,0,0,0|1,0,1]=4 264 B10R1.15 NCC(N)C1=CC=CC=C1 AC-38860 [1,1,0,0,0,0|1,0,1]=4 265 B10R1.15 NCC(O)C1=CC=CC=C1 AC-76221 [1,1,0,0,0,0|1,0,1]=4 266 B10R1.15 N[C@H](CO)C1=CC=CC=C1 AC-11520 [1,1,0,0,0,0|0,0,2]=4 267 B10R1.15 N[C@H](CO)C1=CC=CC=C1 AC-11521 [1,1,0,0,0,0|0,0,2]=4 268 B10R1.15 N[C@H](CO)C1=CC=CC=C1 AC-38862 [1,1,0,0,0,0|0,0,2]=4 269 B10R1.15 OC(CBr)C1=CC=CC=C1 AC-77224 [1,1,0,0,0,0|1,0,1]=4 270 B10R1.18 BrC(Br)=CC1=CC=CC=C1 AC-71796 [1,1,0,0,0,0|1,0,1]=4 271 B10R1.18 CC(=O)CC1=CC=CN=C1 AC-86273 [1,1,0,0,0,0|1,0,0]=3 272 B10R1.18 CC(=O)CC1=CC=NC=C1 AC-20022 [1,1,0,0,0,0|1,0,0]=3 273 B10R1.18 CC(=O)CC1=NC=CC=C1 AC-56618 [1,1,0,0,0,0|1,0,0]=3 274 B10R1.18 CC(=O)OC1=CC=CN=C1 AC-58110 [1,1,0,0,0,0|1,0,0]=3 275 B10R1.18 CC(Br)CC1=CC=CC=C1 AC-91740 [1,1,0,0,0,0|1,0,1]=4 276 B10R1.18 CC(C)=CC1=CC=CC=C1 AC-94041 [1,1,0,0,0,0|1,0,1]=4 277 B10R1.18 FC(F)OC1=CC=CC=C1 AC-83043 [1,1,0,0,0,0|1,0,1]=4 278 B10R1.18 NC(=O)CC1=CC=CC=C1 AC-64120 [1,1,0,0,0,0|0,0,0]=2 279 B10R1.18 NC(=O)CC1=CC=CN=C1 AC-82928 [1,1,0,0,0,0|1,0,0]=3 280 B10R1.18 NC(=O)CC1=NC=CC=N1 AC-79368 [1,1,0,0,0,0|2,0,0]=4 281 B10R1.18 NC(=O)NC1=CC=CC=C1 AC-76979 [1,1,0,0,0,0|1,0,0]=3 282 B10R1.18 O=C(Cl)OC1=CC=CC=C1 AC-64085 [1,1,0,0,0,0|0,0,0]=2 283 B10R1.18 O=C(O)CC1=CC=CN=C1 AC-11679 [1,1,0,0,0,0|1,0,0]=3 284 B10R1.18 O=C(O)CC1=CC=CN=C1 AC-12682 [1,1,0,0,0,0|1,0,0]=3 285 B10R1.18 O=C(O)CC1=CC=NC=C1 AC-11642 [1,1,0,0,0,0|1,0,0]=3 286 B10R1.18 O=C(O)CC1=CC=NC=C1 AC-81529 [1,1,0,0,0,0|1,0,0]=3 287 B10R1.18 O=C(O)CC1=CC=NC=N1 AC-86762 [1,1,0,0,0,0|2,0,0]=4 288 B10R1.18 O=C(O)CC1=NC=CC=C1 AC-11641 [1,1,0,0,0,0|1,0,0]=3 289 B10R1.18 O=C(O)CC1=NC=CC=C1 AC-45374 [1,1,0,0,0,0|1,0,0]=3 290 B10R1.66 O=C(O)CCC1=CC=CN1 AC-43159 [0,1,0,0,1,0|2,0,0]=4 291 B10R1.66 O=C(O)CCC1=CNC=C1 AC-93342 [0,1,0,0,1,0|2,0,0]=4 292 B12R1.16 C=CCC(N)C1=CC=C(F)C=C1 AC-95729 [0,2,0,0,0,0|2,0,0]=4 293 B12R1.21 CC(=O)CCC1=CC=C(Cl)C=C1 AC-89210 [0,2,0,0,0,0|1,0,0]=3 294 B12R1.21 CC(=O)CCC1=CC=C(N)C=C1 AC-87381 [0,2,0,0,0,0|1,0,0]=3 295 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 AC-62175 [0,2,0,0,0,0|1,0,0]=3 296 B12R1.21 N=C(N)SCC1=CC=C(Cl)C=C1 AC-58382 [0,2,0,0,0,0|1,1,0]=4 297 B12R1.21 NC1=CC=C(CCC(=O)O)C=N1 AC-79315 [0,2,0,0,0,0|2,0,0]=4 298 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 AC-18562 [0,2,0,0,0,0|1,0,0]=3 299 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 AC-14340 [0,2,0,0,0,0|1,0,0]=3 300 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 AC-11965 [0,2,0,0,0,0|1,0,0]=3 301 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 AC-29981 [0,2,0,0,0,0|1,0,0]=3 302 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 AC-14246 [0,2,0,0,0,0|1,0,0]=3 303 B12R1.21 O=C(O)CNC1=CC=C(Cl)C=C1 AC-16794 [0,2,0,0,0,0|2,0,0]=4 304 B12R1.21 O=C(O)CNC1=CC=C(Cl)C=C1 AC-26506 [0,2,0,0,0,0|2,0,0]=4 305 B12R1.21 O=C(O)CNC1=CC=C(Cl)C=C1 AC-26507 [0,2,0,0,0,0|2,0,0]=4 306 B12R1.21 O=C(O)CNC1=CC=C(F)C=C1 AC-11805 [0,2,0,0,0,0|2,0,0]=4 307 B12R1.21 O=C(O)CNC1=CC=C(O)C=C1 AC-65427 [0,2,0,0,0,0|2,0,0]=4 308 B12R1.21 O=C(O)CNC1=CC=C(O)C=C1 AC-65428 [0,2,0,0,0,0|2,0,0]=4 309 B12R1.21 O=C(O)COC1=CC=C(Cl)C=C1 AC-26444 [0,2,0,0,0,0|2,0,0]=4 310 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 AC-14338 [0,2,0,0,0,0|1,0,1]=4 311 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 AC-76803 [0,2,0,0,0,0|1,0,1]=4 312 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 AC-13909 [0,2,0,0,0,0|1,0,1]=4 313 B12R1.49 C=CC(=O)CC1=CC=C(F)C=C1 AC-96279 [0,2,0,0,0,0|2,0,0]=4 314 B12R1.71 N#CC1=CC=C(CCC=O)C=C1 AC-83327 [0,2,0,0,0,0|1,0,0]=3 315 B12R1.30 CN(\C=C\C=O)C1=CC=CC=C1 AC-64015 [0,2,0,0,0,0|1,0,1]=4 316 B12R1.39 CC(C)(CC=O)C1=CC=CC=C1 AC-82230 [0,2,0,0,0,0|1,0,0]=3 317 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 AC-22851 [0,2,0,0,0,0|1,0,1]=4 318 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 AC-54968 [0,2,0,0,0,0|2,0,0]=4 319 B12R1.107 NC(CC(=O)O)C1=CC=CN=C1 AC-32477 [0,2,0,0,0,0|2,0,0]=4 320 B12R1.107 NC(CC(=O)O)C1=CC=NC=C1 AC-82940 [0,2,0,0,0,0|2,0,0]=4 321 B12R1.121 COC1=CC=CC=C1CCC=O AC-89760 [0,2,0,0,0,0|1,0,0]=3 322 B12R1.125 CC(=O)CCC1=CC=CC=C1N AC-88817 [0,2,0,0,0,0|1,0,0]=3 323 B12R1.125 CC1=CC=CC=C1CCC(=O)O AC-20107 [0,2,0,0,0,0|1,0,0]=3 324 B12R1.125 O=C(O)C#CC1=CC=CC=C1F AC-87408 [0,2,0,0,0,0|1,0,1]=4 325 B12R1.125 O=C(O)CCC1=CC=CC=C1I AC-91029 [0,2,0,0,0,0|1,0,0]=3 326 B12R1.125 O=C(O)CCN1C=CC=CC1=O AC-57410 [0,2,0,0,0,0|2,0,0]=4 327 B12R1.125 O=C(O)CNC1=CC=CC=C1F AC-76022 [0,2,0,0,0,0|2,0,0]=4 328 B12R1.125 O=C(O)COC1=CC=CC=C1F AC-38430 [0,2,0,0,0,0|2,0,0]=4 329 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Br AC-89273 [0,2,0,0,0,0|1,0,1]=4 330 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Cl AC-19585 [0,2,0,0,0,0|1,0,1]=4 331 B12R1.226 CC(=O)CCC1=CC=CC(Br)=C1 AC-42792 [0,2,0,0,0,0|1,0,0]=3 332 B12R1.226 CC1=CC(CCC(=O)O)=CC=C1 AC-20108 [0,2,0,0,0,0|1,0,0]=3 333 B12R1.226 CC1=CC(\C=C\C(=O)O)=CC=C1 AC-38605 [0,2,0,0,0,0|1,0,1]=4 334 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 AC-18563 [0,2,0,0,0,0|1,0,0]=3 335 B12R1.226 O=C(O)CCC1=CC=CC(Cl)=C1 AC-26679 [0,2,0,0,0,0|1,0,0]=3 336 B12R1.226 O=C(O)CCC1=CC=CC(F)=C1 AC-11964 [0,2,0,0,0,0|1,0,0]=3 337 B12R1.226 O=C(O)\C=C\C1=CC=CC(Br)=C1 AC-34555 [0,2,0,0,0,0|1,0,1]=4 338 B12R1.226 O=C(O)\C=C\C1=CC=CC(Cl)=C1 AC-14279 [0,2,0,0,0,0|1,0,1]=4 339 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 AC-11968 [0,2,0,0,0,0|1,0,1]=4 340 B12R1.226 O=C(O)\C=C\C1=CC=CC(I)=C1 AC-89406 [0,2,0,0,0,0|1,0,1]=4 341 B12R1.226 O=C(O)\C=C\C1=CC=CC(O)=C1 AC-13911 [0,2,0,0,0,0|1,0,1]=4 342 B12R1.8 NCCCOCC1=CC=CC=C1 AC-58975 [0,2,0,0,0,0|1,0,1]=4 343 B12R1.8 O=CCCCOC1=CC=CC=C1 AC-90359 [0,2,0,0,0,0|1,0,0]=3 344 B12R1.8 O=COC\C=C\C1=CC=CC=C1 AC-83683 [0,2,0,0,0,0|0,0,0]=2 345 B12R1.8 OCCCOCC1=CC=CC=C1 AC-24730 [0,2,0,0,0,0|0,0,2]=4 346 B12R1.27 CCC(=O)OCC1=CC=CC=C1 AC-86751 [0,2,0,0,0,0|0,0,0]=2 347 B12R1.27 COC(=O)\C=C\C1=CC=CC=C1 AC-89581 [0,2,0,0,0,0|1,0,1]=4 348 B12R1.27 NCC(=O)NCC1=CC=CC=C1 AC-88856 [0,2,0,0,0,0|1,0,0]=3 349 B12R1.27 NNC(=O)OCC1=CC=CC=C1 AC-15263 [0,2,0,0,0,0|0,0,0]=2 350 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 AC-24724 [0,2,0,0,0,0|0,0,0]=2 351 B12R1.27 O=C(CCl)NCC1=CC=CC=C1 AC-48268 [0,2,0,0,0,0|1,0,0]=3 352 B12R1.27 O=C(CCl)OCC1=CC=CC=C1 AC-33118 [0,2,0,0,0,0|0,0,0]=2 353 B12R1.27 O=C(NO)OCC1=CC=CC=C1 AC-22907 [0,2,0,0,0,0|0,0,0]=2 354 B12R1.252 CC(=O)COCC1=CC=CC=C1 AC-33619 [0,2,0,0,0,0|0,0,0]=2 355 B12R1.252 CC(=O)NCCC1=NC=CC=C1 AC-90299 [0,2,0,0,0,0|2,0,0]=4 356 B12R1.252 O=C(O)CCCC1=CC=CC=C1 AC-38854 [0,2,0,0,0,0|1,0,0]=3 357 B12R1.252 O=C(O)CCNC1=CC=CC=C1 AC-42393 [0,2,0,0,0,0|1,0,0]=3 358 B12R1.252 O=C(O)CNCC1=CC=CC=C1 AC-17267 [0,2,0,0,0,0|1,0,0]=3 359 B12R1.252 O=C(O)CNCC1=NC=CC=C1 AC-94260 [0,2,0,0,0,0|2,0,0]=4 360 B12R1.252 O=C(O)COCC1=CC=CC=C1 AC-51588 [0,2,0,0,0,0|0,0,0]=2 361 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O AC-14523 [0,2,0,0,0,0|1,0,0]=3 362 B12R1.43 C[C@@H](OC1=CC=CC=C1)C(=O)O AC-64126 [0,2,0,0,0,0|2,0,0]=4 363 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O AC-23950 [0,2,0,0,0,0|1,0,0]=3 364 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O AC-89007 [0,2,0,0,0,0|1,0,0]=3 365 B12R1.43 NC(CC1=CC=CN=C1)C(=O)O AC-90689 [0,2,0,0,0,0|2,0,0]=4 366 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O AC-94314 [0,2,0,0,0,0|2,0,0]=4 367 B12R1.43 NC(CC1=NC=CC=C1)C(=O)O AC-94234 [0,2,0,0,0,0|2,0,0]=4 368 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O AC-77394 [0,2,0,0,0,0|2,0,0]=4 369 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O AC-75590 [0,2,0,0,0,0|2,0,0]=4 370 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O AC-10595 [0,2,0,0,0,0|1,0,0]=3 371 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 AC-93737 [0,2,0,0,0,0|1,0,0]=3 372 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 AC-67256 [0,2,0,0,0,0|1,0,0]=3 373 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 AC-12701 [0,2,0,0,0,0|1,0,0]=3 374 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 AC-12702 [0,2,0,0,0,0|1,0,0]=3 375 B10R2.6 C1=CC=C([C@H]2CO2)C=C1 AC-13229 [1,0,0,1,0,0|0,0,1]=3 376 B10R2.7 C1=CC2=C(C=C1)CNC2 AC-65239 [1,0,0,1,0,0|1,0,1]=4 377 B10R2.7 C1=CC2=C(C=C1)NC=C2 AC-44702 [1,0,0,1,0,0|1,0,1]=4 378 B10R2.7 C1=CC2=C(C=C1)NCC2 AC-73401 [1,0,0,1,0,0|1,0,1]=4 379 B10R2.7 C1=CC2=C(C=C1)NN=C2 AC-39456 [1,0,0,1,0,0|2,0,0]=4 380 B10R2.7 C1=CC2=NON=C2C=C1 AC-33092 [1,0,0,1,0,0|2,0,0]=4 381 B10R2.7 C1=CC=C2OCOC2=C1 AC-15297 [1,0,0,1,0,0|0,0,2]=4 382 B10R2.7 C1=CC=C2SC=CC2=C1 AC-16119 [1,0,0,1,0,0|0,1,1]=4 383 B10R2.7 C1=CC=C2SCOC2=C1 AC-96464 [1,0,0,1,0,0|0,1,1]=4 384 B10R2.7 C1=CN=C2C=COC2=C1 AC-69565 [1,0,0,1,0,0|2,0,0]=4 385 B10R2.7 C1=CN=C2N=COC2=C1 AC-81923 [1,0,0,1,0,0|2,0,0]=4 386 B10R2.32 O=C1CCC2=C1SC=C2 AC-28083 [0,0,0,1,1,0|2,0,0]=4 387 B12R2.24 BrC1=CC2=C(C=C1)CCOC2 AC-80191 [0,1,0,1,0,0|1,0,1]=4 388 B12R2.24 O=C1C=C2C=CC=CC2=NN1 AC-27043 [0,1,0,1,0,0|2,0,0]=4 389 B12R2.24 O=C1C=CC2=C(C=CC=C2)O1 AC-89608 [0,1,0,1,0,0|1,0,1]=4 390 B12R2.24 O=C1C=NC2=C(C=CC=C2)N1 AC-91101 [0,1,0,1,0,0|2,0,0]=4 391 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 AC-10639 [0,1,0,1,0,0|0,0,0]=2 392 B12R2.24 O=C1CCC2=C(C=CC=C2)C1 AC-21974 [0,1,0,1,0,0|1,0,0]=3 393 B12R2.24 O=C1CCC2=C(C=CC=C2)N1 AC-45915 [0,1,0,1,0,0|1,0,0]=3 394 B12R2.24 O=C1CCC2=C(C=CC=C2)O1 AC-28072 [0,1,0,1,0,0|1,0,0]=3 395 B12R2.24 O=C1CCC2=C(N=CC=C2)N1 AC-28118 [0,1,0,1,0,0|2,0,0]=4 396 B12R2.24 O=C1CCN2C=CC=CC2=N1 AC-83000 [0,1,0,1,0,0|2,0,0]=4 397 B12R2.24 O=C1COC2=CC=CC=C2N1 AC-22850 [0,1,0,1,0,0|2,0,0]=4 398 B12R2.24 O=C1CSC2=CC=CC=C2N1 AC-16563 [0,1,0,1,0,0|2,0,0]=4 399 B12R2.132 CC1=C2C=C(Cl)C=CC2=NO1 AC-85714 [0,1,0,1,0,0|2,0,0]=4 400 B12R2.132 CC1=CC=C2ONC(=O)C2=C1 AC-94482 [0,1,0,1,0,0|2,0,0]=4 401 B12R2.132 NC1=CC2=C(C=C1)CCC2=O AC-24567 [0,1,0,1,0,0|1,0,0]=3 402 B12R2.132 NC1=CC=C2ONC(=O)C2=C1 AC-91930 [0,1,0,1,0,0|2,0,0]=4 403 B12R2.132 O=C1CCC2=C1C=C(Cl)C=C2 AC-25910 [0,1,0,1,0,0|1,0,0]=3 404 B12R2.132 O=C1CCC2=C1C=C(I)C=C2 AC-29922 [0,1,0,1,0,0|1,0,0]=3 405 B12R2.132 O=C1CCC2=C1C=C(O)C=C2 AC-61806 [0,1,0,1,0,0|1,0,0]=3 406 B12R2.132 O=C1COC2=CC=C(Br)C=C12 AC-24764 [0,1,0,1,0,0|2,0,0]=4 407 B12R2.132 O=C1COC2=CC=C(Br)C=C12 AC-39231 [0,1,0,1,0,0|2,0,0]=4 408 B12R2.132 O=C1NCC2=C1C=C(Br)C=C2 AC-25110 [0,1,0,1,0,0|1,0,0]=3 409 B12R2.132 O=C1NCC2=C1C=C(I)C=C2 AC-84130 [0,1,0,1,0,0|1,0,0]=3 410 B12R2.132 O=C1NCC2=NC=C(Br)C=C12 AC-79606 [0,1,0,1,0,0|2,0,0]=4 411 B12R2.132 O=C1NCC2=NC=C(F)C=C12 AC-93499 [0,1,0,1,0,0|2,0,0]=4 412 B12R2.132 O=C1NNC2=C1C=C(F)C=C2 AC-67013 [0,1,0,1,0,0|2,0,0]=4 413 B12R2.132 O=C1NOC2=CC=C(Br)C=C12 AC-79367 [0,1,0,1,0,0|2,0,0]=4 414 B12R2.132 O=C1NOC2=CC=C(F)C=C12 AC-79612 [0,1,0,1,0,0|2,0,0]=4 415 B12R2.132 O=C1OCC2=C1C=C(Br)C=C2 AC-25107 [0,1,0,1,0,0|0,0,0]=2 416 B12R2.132 O=C1OCC2=C1C=C(I)C=C2 AC-39260 [0,1,0,1,0,0|0,0,0]=2 417 B12R2.132 O=C1ONC2=CC=C(F)C=C12 AC-94189 [0,1,0,1,0,0|1,0,0]=3 418 B12R2.132 O=C1ONC2=CC=C(I)C=C12 AC-91145 [0,1,0,1,0,0|1,0,0]=3 419 B12R2.2 C1=CC=C(C2=CC=CO2)C=C1 AC-83003 [0,1,0,1,0,0|1,0,1]=4 420 B12R2.2 C1=CC=C(C2=CN=CO2)C=C1 AC-77075 [0,1,0,1,0,0|1,0,1]=4 421 B12R2.2 C1=CC=C(C2=COC=N2)C=C1 AC-87013 [0,1,0,1,0,0|1,0,1]=4 422 B12R2.2 C1=CC=C(C2=NC=CO2)C=C1 AC-79292 [0,1,0,1,0,0|1,0,1]=4 423 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 AC-86625 [0,1,0,1,0,0|1,0,0]=3 424 B12R2.1081 BrC1=CC=CC2=C1COCC2 AC-83365 [0,1,0,1,0,0|1,0,1]=4 425 B12R2.1081 CC1=NCCC2=C1C=CC=C2 AC-79916 [0,1,0,1,0,0|2,0,0]=4 426 B12R2.1081 NC1COCC2=C1C=CC=C2 AC-28095 [0,1,0,1,0,0|1,0,1]=4 427 B12R2.1081 O=C1C=COC2=C1C=CC=C2 AC-16777 [0,1,0,1,0,0|1,0,1]=4 428 B12R2.1081 O=C1C=NNC2=C1C=CC=C2 AC-77424 [0,1,0,1,0,0|2,0,0]=4 429 B12R2.1081 O=C1CCCC2=C1C=CC=C2 AC-31405 [0,1,0,1,0,0|1,0,0]=3 430 B12R2.1081 O=C1CCCC2=C1C=CC=N2 AC-63020 [0,1,0,1,0,0|2,0,0]=4 431 B12R2.1081 O=C1CCCC2=C1C=CN=C2 AC-80182 [0,1,0,1,0,0|2,0,0]=4 432 B12R2.1081 O=C1CCCC2=C1C=NC=C2 AC-28103 [0,1,0,1,0,0|2,0,0]=4 433 B12R2.1081 O=C1CCCC2=C1C=NC=C2 AC-82840 [0,1,0,1,0,0|2,0,0]=4 434 B12R2.1081 O=C1CCCC2=C1N=CC=C2 AC-28150 [0,1,0,1,0,0|2,0,0]=4 435 B12R2.1081 O=C1CCOC2=C1C=CC=C2 AC-11244 [0,1,0,1,0,0|1,0,0]=3 436 B12R2.1081 O=C1CNCC2=C1C=CC=C2 AC-84554 [0,1,0,1,0,0|1,0,0]=3 437 B12R2.1081 O=C1NC=NC2=C1C=CC=C2 AC-94504 [0,1,0,1,0,0|1,0,1]=4 438 B12R2.1081 O=C1NCCC2=C1C=CC=C2 AC-28099 [0,1,0,1,0,0|1,0,0]=3 439 B12R2.1081 O=C1NCCC2=C1C=CC=N2 AC-83855 [0,1,0,1,0,0|2,0,0]=4 440 B12R2.1081 O=C1NCCC2=C1N=CC=C2 AC-94411 [0,1,0,1,0,0|2,0,0]=4 441 B12R2.2028 CN1NC(=O)C2=C1C=CC=C2 AC-83562 [0,1,0,1,0,0|2,0,0]=4 442 B12R2.2028 NC1NC(=O)C2=C1C=CC=C2 AC-92774 [0,1,0,1,0,0|1,0,0]=3 443 B12R2.2028 O=C1CC(Br)C2=C1C=CC=C2 AC-71476 [0,1,0,1,0,0|1,0,0]=3 444 B12R2.2028 O=C1OC(=O)C2=NC=CC=C12 AC-11609 [0,1,0,1,0,0|1,0,1]=4 445 B12R2.32 O=CC1=CC2=C(C=CC=C2)N1 AC-29856 [0,1,0,1,0,0|1,0,1]=4 446 B12R2.32 O=CC1=NC2=CC=CC=C2N1 AC-16560 [0,1,0,1,0,0|2,0,0]=4 447 B12R2.32 O=CC1=NC2=CC=CC=C2O1 AC-92843 [0,1,0,1,0,0|2,0,0]=4 448 B12R2.196 NC1=CC=CC2=C1CNC2=O AC-24584 [0,1,0,1,0,0|1,0,0]=3 449 B12R2.196 NC1=CC=CC2=C1COC2=O AC-24689 [0,1,0,1,0,0|0,0,0]=2 450 B12R2.196 O=C1CCC2=C1C=CC=C2Cl AC-25911 [0,1,0,1,0,0|1,0,0]=3 451 B12R2.196 O=C1CCC2=C1C=CC=C2F AC-89381 [0,1,0,1,0,0|1,0,0]=3 452 B12R2.196 O=C1CCC2=C1C=CC=C2O AC-45322 [0,1,0,1,0,0|1,0,0]=3 453 B12R2.196 O=C1COC2=C(Br)C=CC=C12 AC-87908 [0,1,0,1,0,0|2,0,0]=4 454 B12R2.196 O=C1NCC2=C1C=CC=C2I AC-83287 [0,1,0,1,0,0|1,0,0]=3 455 B12R2.196 O=C1NCC2=C1C=CC=C2O AC-79560 [0,1,0,1,0,0|1,0,0]=3 456 B12R2.196 O=C1NNC2=C1C=CC=C2Br AC-93359 [0,1,0,1,0,0|2,0,0]=4 457 B12R2.196 O=C1OCC2=C1C=CC=C2Cl AC-35137 [0,1,0,1,0,0|0,0,0]=2 458 B12R2.196 O=C1ONC2=C(Cl)C=CC=C12 AC-88556 [0,1,0,1,0,0|1,0,0]=3 459 B12R2.196 O=C1ONC2=C(F)C=CC=C12 AC-93647 [0,1,0,1,0,0|1,0,0]=3 460 B12R2.203 NC1=CC=CC2=C1C(=O)CC2 AC-85465 [0,1,0,1,0,0|1,0,0]=3 461 B12R2.203 NC1=CC=CC2=C1C(=O)NC2 AC-70357 [0,1,0,1,0,0|1,0,0]=3 462 B12R2.203 O=C1CCC2=C1C(Br)=CC=C2 AC-25050 [0,1,0,1,0,0|1,0,0]=3 463 B12R2.203 O=C1CCC2=C1C(Cl)=CC=C2 AC-25909 [0,1,0,1,0,0|1,0,0]=3 464 B12R2.203 O=C1CCC2=C1C(F)=CC=C2 AC-45389 [0,1,0,1,0,0|1,0,0]=3 465 B12R2.203 O=C1CCC2=C1C(O)=CC=C2 AC-61378 [0,1,0,1,0,0|1,0,0]=3 466 B12R2.203 O=C1NCC2=C1C(Br)=CC=C2 AC-42126 [0,1,0,1,0,0|1,0,0]=3 467 B12R2.203 O=C1NCC2=C1C(F)=CC=C2 AC-93959 [0,1,0,1,0,0|1,0,0]=3 468 B12R2.203 O=C1NOC2=CC=CC(F)=C12 AC-79802 [0,1,0,1,0,0|2,0,0]=4 469 B12R2.203 O=C1OCC2=C1C(Br)=CC=C2 AC-88647 [0,1,0,1,0,0|0,0,0]=2 470 B12R2.203 O=C1ONC2=CC=CC(Br)=C12 AC-88398 [0,1,0,1,0,0|1,0,0]=3 471 B12R2.203 O=C1ONC2=CC=CC(Cl)=C12 AC-93646 [0,1,0,1,0,0|1,0,0]=3 472 B12R2.203 O=C1ONC2=CC=CC(F)=C12 AC-93614 [0,1,0,1,0,0|1,0,0]=3 473 B12R2.612 CC1=CC2=C(C=C1)C(=O)CC2 AC-89088 [0,1,0,1,0,0|1,0,0]=3 474 B12R2.612 CC1=CC2=C(C=C1)C(=O)NC2 AC-95688 [0,1,0,1,0,0|1,0,0]=3 475 B12R2.612 NC1=CC2=C(C=C1)C(=O)CC2 AC-15972 [0,1,0,1,0,0|1,0,0]=3 476 B12R2.612 NC1=CC2=C(C=C1)C(=O)NC2 AC-42773 [0,1,0,1,0,0|1,0,0]=3 477 B12R2.612 O=C1C=CC2=C1C=CC(Br)=C2 AC-93951 [0,1,0,1,0,0|1,0,1]=4 478 B12R2.612 O=C1CCC2=C1C=CC(Cl)=C2 AC-10645 [0,1,0,1,0,0|1,0,0]=3 479 B12R2.612 O=C1CCC2=C1C=CC(F)=C2 AC-11803 [0,1,0,1,0,0|1,0,0]=3 480 B12R2.612 O=C1CCC2=C1C=CC(I)=C2 AC-39380 [0,1,0,1,0,0|1,0,0]=3 481 B12R2.612 O=C1COC2=CC(Br)=CC=C12 AC-33483 [0,1,0,1,0,0|2,0,0]=4 482 B12R2.612 O=C1COC2=CC(O)=CC=C12 AC-65607 [0,1,0,1,0,0|2,0,0]=4 483 B12R2.612 O=C1NCC2=C1C=CC(F)=C2 AC-80169 [0,1,0,1,0,0|1,0,0]=3 484 B12R2.612 O=C1NCC2=C1C=CC(I)=C2 AC-86498 [0,1,0,1,0,0|1,0,0]=3 485 B12R2.612 O=C1NNC2=C1C=CC(F)=C2 AC-80141 [0,1,0,1,0,0|2,0,0]=4 486 B12R2.612 O=C1NSC2=CC(F)=CC=C12 AC-83819 [0,1,0,1,0,0|2,0,0]=4 487 B12R2.612 O=C1OCC2=C1C=CC(Br)=C2 AC-14023 [0,1,0,1,0,0|0,0,0]=2 488 B12R2.612 O=C1OCC2=C1C=CC(Cl)=C2 AC-87549 [0,1,0,1,0,0|0,0,0]=2 489 B12R2.612 O=C1OCC2=C1C=CC(F)=C2 AC-39245 [0,1,0,1,0,0|0,0,0]=2 490 B12R2.612 O=C1ONC2=CC(Br)=CC=C12 AC-94190 [0,1,0,1,0,0|1,0,0]=3 491 B12R2.1 O=CC1=CNC2=C1C=CC=C2 AC-10901 [0,1,0,1,0,0|1,0,1]=4 492 B12R2.1 O=CC1=COC2=CC=CC=C12 AC-39228 [0,1,0,1,0,0|1,0,1]=4 493 B12R2.1 O=CC1=NNC2=C1C=CC=C2 AC-39460 [0,1,0,1,0,0|2,0,0]=4 494 B12R2.1 O=CC1=NNC2=C1C=CC=C2 AC-65334 [0,1,0,1,0,0|2,0,0]=4 495 B12R2.18 CC1CC2=C(C=CC=C2)C1=O AC-39381 [0,1,0,1,0,0|1,0,0]=3 496 B12R2.18 O=C1C2=C(C=CC=C2)CC1Br AC-25052 [0,1,0,1,0,0|1,0,0]=3 497 B12R2.18 O=C1CC2=C(C=CC=C2)C1=O AC-65337 [0,1,0,1,0,0|1,0,0]=3 498 B12R2.18 O=C1NC2=C(C=CC=C2)C1=O AC-65284 [0,1,0,1,0,0|2,0,0]=4 499 B12R2.2403 O=S1(=O)NCC2=C1C=CC=C2 AC-75796 [0,1,0,1,0,0|2,0,0]=4 500 B8R1.8 O=CCC1=CC=CS1 AC-79856 [1,0,0,0,1,0|1,0,0]=3