0 B10R1.15 C#CC(O)C1=CC=CC=C1 AC-82932 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.15 C#CC(O)C1=CC=NC=C1 AC-80684 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.15 CC(CN)C1=CC=CC=C1 AC-76879 [0,0,0,0,0,0|0,0,0]=0 3 B10R1.15 CCC(=O)C1=CC=CC=C1 AC-15135 [0,0,0,0,0,0|2,0,1]=3 4 B10R1.15 CCC(=O)C1=CC=NC=C1 AC-23999 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.15 CCC(=O)C1=NC=CC=C1 AC-41298 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.15 CCC(N)C1=CC=CN=C1 AC-81475 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.15 CCC(N)C1=NC=CC=C1 AC-85412 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.15 CN(C=O)C1=NC=CC=C1 AC-83726 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.15 CNC(C)C1=CC=CC=C1 AC-75895 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.15 CNC(C)C1=CC=CC=C1 AC-92088 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.15 CNC(C)C1=CC=NC=C1 AC-57441 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.15 N#CC(N)C1=CC=CC=C1 AC-83867 [0,0,0,0,0,0|1,0,2]=3 13 B10R1.15 N#CC(N)C1=CC=CC=C1 AC-92943 [0,0,0,0,0,0|1,0,2]=3 14 B10R1.15 NC(CO)C1=CC=CN=C1 AC-81396 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.15 NCC(N)C1=CC=CC=C1 AC-38860 [0,0,0,0,0,0|1,0,0]=1 16 B10R1.15 NCC(O)C1=CC=CC=C1 AC-76221 [0,0,0,0,0,0|1,0,0]=1 17 B10R1.15 NNC(=O)C1=CC=CC=C1 AC-33227 [0,0,0,0,0,0|2,0,1]=3 18 B10R1.15 NNC(=O)C1=CN=CC=C1 AC-22241 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.15 NNC(=O)C1=NC=CC=C1 AC-47120 [0,0,0,0,0,0|3,0,1]=4 20 B10R1.15 N[C@H](CO)C1=CC=CC=C1 AC-11520 [0,0,0,0,0,0|2,0,0]=2 21 B10R1.15 N[C@H](CO)C1=CC=CC=C1 AC-11521 [0,0,0,0,0,0|2,0,0]=2 22 B10R1.15 N[C@H](CO)C1=CC=CC=C1 AC-38862 [0,0,0,0,0,0|2,0,0]=2 23 B10R1.15 N\C(=N/O)C1=CC=CC=C1 AC-16547 [0,0,0,0,0,0|3,0,1]=4 24 B10R1.15 N\C(=N/O)C1=CC=CC=C1 AC-85499 [0,0,0,0,0,0|3,0,1]=4 25 B10R1.15 O=C(CBr)C1=CC=CN=C1 AC-17732 [0,0,0,0,0,0|3,0,1]=4 26 B10R1.15 O=C(CBr)C1=CC=NC=C1 AC-17733 [0,0,0,0,0,0|3,0,1]=4 27 B10R1.15 O=C(CBr)C1=NC=CC=C1 AC-17731 [0,0,0,0,0,0|3,0,1]=4 28 B10R1.15 O=C(CCl)C1=CC=CC=C1 AC-25606 [0,0,0,0,0,0|2,0,1]=3 29 B10R1.15 O=C(CCl)C1=CC=CN=C1 AC-76332 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.15 O=C(CCl)C1=CC=CN=C1 AC-87675 [0,0,0,0,0,0|3,0,1]=4 31 B10R1.15 OC(CBr)C1=CC=CC=C1 AC-77224 [0,0,0,0,0,0|2,0,0]=2 32 B9R1.6 CC(=O)C1=CC=CC=C1 AC-74174 [1,0,0,0,0,0|1,0,1]=3 33 B9R1.6 CC(=O)C1=CC=NC=C1 AC-22437 [1,0,0,0,0,0|2,0,1]=4 34 B9R1.6 CC(=O)C1=NC=CC=C1 AC-22438 [1,0,0,0,0,0|2,0,1]=4 35 B9R1.6 CC(Br)C1=NC=CN=C1 AC-81558 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.6 CC(N)C1=CC=CC=C1 AC-32241 [1,0,0,0,0,0|0,0,0]=1 37 B9R1.6 CC(N)C1=CC=NN=C1 AC-69280 [1,0,0,0,0,0|2,0,0]=3 38 B9R1.6 CC(O)C1=CC=CN=C1 AC-41175 [1,0,0,0,0,0|2,0,0]=3 39 B9R1.6 CC(O)C1=NC=CC=C1 AC-41174 [1,0,0,0,0,0|2,0,0]=3 40 B9R1.6 CN(C)C1=CC=NC=C1 AC-11024 [1,0,0,0,0,0|2,0,0]=3 41 B9R1.6 CN(C)C1=NC=CN=C1 AC-96684 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.6 C[C@@H](N)C1=CC=CC=C1 AC-13616 [1,0,0,0,0,0|0,0,0]=1 43 B9R1.6 C[C@@H](N)C1=NC=CC=C1 AC-81041 [1,0,0,0,0,0|1,0,0]=2 44 B9R1.6 C[C@@H](O)C1=CC=CC=C1 AC-64050 [1,0,0,0,0,0|1,0,0]=2 45 B9R1.6 C[C@H](N)C1=CC=CC=C1 AC-13614 [1,0,0,0,0,0|0,0,0]=1 46 B9R1.6 N=C(N)C1=CC=CC=C1 AC-76838 [1,0,0,0,0,0|1,0,1]=3 47 B9R1.6 N=C(N)C1=CC=CC=C1 AC-93565 [1,0,0,0,0,0|1,0,1]=3 48 B9R1.6 N=C(N)C1=CC=CN=C1 AC-26641 [1,0,0,0,0,0|2,0,1]=4 49 B9R1.6 N=C(N)C1=CC=NC=C1 AC-26642 [1,0,0,0,0,0|2,0,1]=4 50 B9R1.6 N=C(N)C1=NC=CC=C1 AC-22465 [1,0,0,0,0,0|2,0,1]=4 51 B9R1.6 NC(=O)C1=CC=CC=C1 AC-77263 [1,0,0,0,0,0|1,0,1]=3 52 B9R1.6 NC(=O)C1=CC=NC=C1 AC-65230 [1,0,0,0,0,0|2,0,1]=4 53 B9R1.6 NC(=O)C1=NC=CC=C1 AC-71367 [1,0,0,0,0,0|2,0,1]=4 54 B9R1.6 NC(=S)C1=CC=CN=C1 AC-56566 [1,0,0,0,0,0|2,0,1]=4 55 B9R1.6 O=C(Br)C1=CC=CC=C1 AC-83660 [1,0,0,0,0,0|2,0,1]=4 56 B9R1.6 O=S([O-])C1=CC=CC=C1 AC-22838 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.6 OB(O)C1=CC=CC=C1 AC-76741 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.8 BrCCC1=CC=CC=C1 AC-10988 [1,0,0,0,0,0|1,0,0]=2 59 B9R1.8 BrCCC1=NC=CC=C1 AC-24894 [1,0,0,0,0,0|2,0,0]=3 60 B9R1.8 BrCCC1=NC=CC=C1 AC-33015 [1,0,0,0,0,0|2,0,0]=3 61 B9R1.8 Br\C=C\C1=CC=CC=C1 AC-15087 [1,0,0,0,0,0|1,0,2]=4 62 B9R1.8 CCCC1=CC=NC=C1 AC-12668 [1,0,0,0,0,0|2,0,0]=3 63 B9R1.8 CCNC1=NC=CC=C1 AC-28871 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.8 CCOC1=NC=CC=C1 AC-11163 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.8 CNCC1=CC=CN=C1 AC-31451 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.8 CNCC1=CC=NC=C1 AC-41285 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.8 CNCC1=CC=NC=C1 AC-92743 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.8 CNCC1=NC=CC=C1 AC-41284 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.8 CNNC1=CC=CC=C1 AC-86441 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.8 COCC1=NC=CC=C1 AC-30327 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.8 N#CCC1=CC=CN=C1 AC-24013 [1,0,0,0,0,0|1,0,2]=4 72 B9R1.8 N#CCC1=NC=CC=C1 AC-11591 [1,0,0,0,0,0|1,0,2]=4 73 B9R1.8 NCCC1=CC=CN=C1 AC-10206 [1,0,0,0,0,0|1,0,0]=2 74 B9R1.8 NCCC1=CC=CN=C1 AC-95294 [1,0,0,0,0,0|1,0,0]=2 75 B9R1.8 NCCC1=NC=CC=C1 AC-22649 [1,0,0,0,0,0|1,0,0]=2 76 B9R1.8 NCCC1=NC=CC=N1 AC-94495 [1,0,0,0,0,0|2,0,0]=3 77 B9R1.8 NNCC1=CC=CC=C1 AC-75839 [1,0,0,0,0,0|1,0,0]=2 78 B9R1.8 NNCC1=CC=CN=C1 AC-75992 [1,0,0,0,0,0|2,0,0]=3 79 B9R1.8 NNCC1=CC=NC=C1 AC-69402 [1,0,0,0,0,0|2,0,0]=3 80 B9R1.8 NNCC1=CC=NC=C1 AC-75993 [1,0,0,0,0,0|2,0,0]=3 81 B9R1.8 NNCC1=NC=CC=C1 AC-75991 [1,0,0,0,0,0|2,0,0]=3 82 B9R1.8 NOCC1=CC=CC=C1 AC-13722 [1,0,0,0,0,0|1,0,0]=2 83 B9R1.8 O=CCC1=NC=CC=C1 AC-86545 [1,0,0,0,0,0|2,0,1]=4 84 B9R1.8 O=COC1=CC=CC=C1 AC-86693 [1,0,0,0,0,0|2,0,1]=4 85 B9R1.8 OCCC1=CC=CN=C1 AC-17846 [1,0,0,0,0,0|2,0,0]=3 86 B9R1.8 OCCC1=CN=CN=C1 AC-80131 [1,0,0,0,0,0|3,0,0]=4 87 B9R1.8 OCCC1=NC=CC=C1 AC-57914 [1,0,0,0,0,0|2,0,0]=3 88 B9R1.8 OCCC1=NC=CC=N1 AC-92422 [1,0,0,0,0,0|3,0,0]=4 89 B9R1.8 ONCC1=CC=CC=C1 AC-45409 [1,0,0,0,0,0|2,0,0]=3 90 B9R1.8 [C-]#[N+]CC1=NC=CC=C1 AC-76114 [1,0,0,0,0,0|3,0,0]=4 91 B11R1.7 CC(C)(C#N)C1=CC=CC=C1 AC-38662 [0,1,0,0,0,0|0,0,2]=3 92 B11R1.7 COC(O)(O)C1=CC=CC=C1 AC-89931 [0,1,0,0,0,0|3,0,0]=4 93 B11R1.7 C[Si](C)(CCl)C1=CC=CC=C1 AC-83695 [0,1,0,0,0,0|1,1,0]=3 94 B11R1.7 O=S(=O)(CCl)C1=CC=CC=C1 AC-37561 [0,1,0,0,0,0|3,0,0]=4 95 B11R1.12 CCB(CC)C1=CC=CN=C1 AC-76504 [0,1,0,0,0,0|3,0,0]=4 96 B11R1.12 CCC(NN)C1=CC=CC=C1 AC-91484 [0,1,0,0,0,0|1,0,0]=2 97 B11R1.12 COC(CO)C1=CC=CC=C1 AC-82924 [0,1,0,0,0,0|1,0,0]=2 98 B11R1.12 COC(OC)C1=CC=CC=C1 AC-33207 [0,1,0,0,0,0|2,0,0]=3 99 B11R1.12 OCC(CO)C1=CC=CC=C1 AC-20194 [0,1,0,0,0,0|1,0,0]=2 100 B11R1.16 C#CCC(O)C1=CC=CN=C1 AC-90489 [0,1,0,0,0,0|3,0,0]=4 101 B11R1.16 CCCC(N)C1=NC=CC=C1 AC-34690 [0,1,0,0,0,0|3,0,0]=4 102 B11R1.16 N#CCC(=O)C1=CC=CC=C1 AC-16572 [0,1,0,0,0,0|1,0,2]=4 103 B11R1.16 N#CCC(O)C1=CC=CC=C1 AC-59838 [0,1,0,0,0,0|1,0,1]=3 104 B11R1.16 NC(CCO)C1=CC=CC=C1 AC-32476 [0,1,0,0,0,0|2,0,0]=3 105 B11R1.16 NCCC(O)C1=CC=CC=C1 AC-79691 [0,1,0,0,0,0|1,0,0]=2 106 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 AC-66687 [0,1,0,0,0,0|2,0,0]=3 107 B11R1.16 OCCC(O)C1=NC=CC=C1 AC-88985 [0,1,0,0,0,0|3,0,0]=4 108 B11R1.16 O[C@@H](CCCl)C1=CC=CC=C1 AC-14427 [0,1,0,0,0,0|2,0,0]=3 109 B11R1.22 C#CC(O)C1=CC=C(C)C=C1 AC-93282 [0,1,0,0,0,0|2,0,1]=4 110 B11R1.22 C#CC(O)C1=CC=C(Cl)C=C1 AC-85397 [0,1,0,0,0,0|2,0,1]=4 111 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 AC-25181 [0,1,0,0,0,0|2,0,1]=4 112 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 AC-32163 [0,1,0,0,0,0|1,0,1]=3 113 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 AC-19857 [0,1,0,0,0,0|2,0,1]=4 114 B11R1.22 CC1=CC=C(C(O)CN)C=C1 AC-32074 [0,1,0,0,0,0|1,0,0]=2 115 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 AC-14902 [0,1,0,0,0,0|2,0,1]=4 116 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 AC-15046 [0,1,0,0,0,0|2,0,1]=4 117 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 AC-12096 [0,1,0,0,0,0|2,0,1]=4 118 B11R1.22 CCC(N)C1=CC=C(F)C=C1 AC-91805 [0,1,0,0,0,0|2,0,0]=3 119 B11R1.22 C\C(=N\O)C1=CC=C(Br)C=C1 AC-95714 [0,1,0,0,0,0|2,0,1]=4 120 B11R1.22 NC(CO)C1=CC=C(Cl)C=C1 AC-86145 [0,1,0,0,0,0|2,0,0]=3 121 B11R1.22 NC(CO)C1=CC=C(F)C=C1 AC-43874 [0,1,0,0,0,0|2,0,0]=3 122 B11R1.22 NC1=CC=C(C(=O)CBr)C=C1 AC-93403 [0,1,0,0,0,0|2,0,1]=4 123 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 AC-10873 [0,1,0,0,0,0|1,0,1]=3 124 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 AC-24358 [0,1,0,0,0,0|1,0,1]=3 125 B11R1.22 NCC(=O)C1=CC=C(I)C=C1 AC-95392 [0,1,0,0,0,0|1,0,1]=3 126 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 AC-19296 [0,1,0,0,0,0|2,0,1]=4 127 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 AC-84462 [0,1,0,0,0,0|2,0,0]=3 128 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 AC-86438 [0,1,0,0,0,0|2,0,0]=3 129 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 AC-11319 [0,1,0,0,0,0|2,0,1]=4 130 B11R1.22 O=C(CCl)C1=CC=C(Br)C=C1 AC-25654 [0,1,0,0,0,0|2,0,1]=4 131 B11R1.22 O=C(CF)C1=CC=C(Cl)C=C1 AC-26502 [0,1,0,0,0,0|2,0,1]=4 132 B11R1.22 O=C(CO)C1=CC=C(Cl)C=C1 AC-72831 [0,1,0,0,0,0|2,0,1]=4 133 B11R1.22 O=C(CO)C1=CC=C(F)C=C1 AC-75710 [0,1,0,0,0,0|2,0,1]=4 134 B11R1.22 OC(CCl)C1=CC=C(Cl)C=C1 AC-88884 [0,1,0,0,0,0|2,0,0]=3 135 B11R1.23 CC(C=O)C1=CC=CC(Br)=C1 AC-94312 [0,1,0,0,0,0|1,0,1]=3 136 B11R1.23 CC1=CC(C(N)CO)=CC=C1 AC-88653 [0,1,0,0,0,0|2,0,0]=3 137 B11R1.23 CCC(=O)C1=CC=CC(Br)=C1 AC-33403 [0,1,0,0,0,0|2,0,1]=4 138 B11R1.23 CCC(N)C1=CC=CC(F)=C1 AC-83298 [0,1,0,0,0,0|2,0,0]=3 139 B11R1.23 CCC(O)C1=CC=CC(F)=C1 AC-83109 [0,1,0,0,0,0|2,0,0]=3 140 B11R1.23 CNC(C)C1=CC=CC(Cl)=C1 AC-95593 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.23 NC(CO)C1=CC=CC(Br)=C1 AC-92052 [0,1,0,0,0,0|2,0,0]=3 142 B11R1.23 NC(CO)C1=CC=CC(Cl)=C1 AC-84004 [0,1,0,0,0,0|2,0,0]=3 143 B11R1.23 NCC(=O)C1=CC=CC(Br)=C1 AC-83923 [0,1,0,0,0,0|1,0,1]=3 144 B11R1.23 NCC(=O)C1=CC=CC(Cl)=C1 AC-95155 [0,1,0,0,0,0|1,0,1]=3 145 B11R1.23 NNC(=O)C1=CC=CC(Br)=C1 AC-17735 [0,1,0,0,0,0|2,0,1]=4 146 B11R1.23 NNC(=O)C1=CC=CC(Cl)=C1 AC-19295 [0,1,0,0,0,0|2,0,1]=4 147 B11R1.23 NNC(=O)C1=CC=CC(F)=C1 AC-19441 [0,1,0,0,0,0|2,0,1]=4 148 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 AC-85747 [0,1,0,0,0,0|2,0,0]=3 149 B11R1.23 O=C(CBr)C1=CC=CC(Cl)=C1 AC-17487 [0,1,0,0,0,0|2,0,1]=4 150 B11R1.23 O=C(CBr)C1=CC=CC(F)=C1 AC-33849 [0,1,0,0,0,0|2,0,1]=4 151 B11R1.23 O=C(CBr)C1=CC=CC(O)=C1 AC-33611 [0,1,0,0,0,0|2,0,1]=4 152 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 AC-75835 [0,1,0,0,0,0|2,0,1]=4 153 B11R1.36 CC(C(=O)O)C1=CC=CN=C1 AC-76132 [0,1,0,0,0,0|2,0,1]=4 154 B11R1.36 CC(C)C(=O)C1=CC=CC=C1 AC-75245 [0,1,0,0,0,0|2,0,1]=4 155 B11R1.36 CC(C)C(Br)C1=CC=CC=C1 AC-88554 [0,1,0,0,0,0|2,0,0]=3 156 B11R1.36 CC(C)C(N)C1=NC=CC=C1 AC-92437 [0,1,0,0,0,0|3,0,0]=4 157 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 AC-11561 [0,1,0,0,0,0|1,0,1]=3 158 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 AC-32405 [0,1,0,0,0,0|1,0,1]=3 159 B11R1.36 NC(=O)[C@@H](N)C1=CC=CC=C1 AC-83167 [0,1,0,0,0,0|1,0,1]=3 160 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 AC-24682 [0,1,0,0,0,0|2,0,1]=4 161 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 AC-77311 [0,1,0,0,0,0|2,0,1]=4 162 B11R1.36 N[C@H](C(=O)Cl)C1=CC=CC=C1 AC-64035 [0,1,0,0,0,0|2,0,1]=4 163 B11R1.36 O=C(O)C(Br)C1=CC=CC=C1 AC-14893 [0,1,0,0,0,0|2,0,1]=4 164 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 AC-81118 [0,1,0,0,0,0|2,0,1]=4 165 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 AC-76874 [0,1,0,0,0,0|2,0,1]=4 166 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 AC-11550 [0,1,0,0,0,0|2,0,1]=4 167 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 AC-11551 [0,1,0,0,0,0|2,0,1]=4 168 B11R1.222 CCC(C)C1=CC=CC=C1Br AC-90206 [0,1,0,0,0,0|1,0,0]=2 169 B11R1.222 CCC(N)C1=CC=CC=C1C AC-88096 [0,1,0,0,0,0|2,0,0]=3 170 B11R1.222 CC[C@@H](N)C1=CC=CC=C1C AC-80318 [0,1,0,0,0,0|2,0,0]=3 171 B11R1.222 N#CC(O)C1=CC=CC=C1Cl AC-95349 [0,1,0,0,0,0|1,0,2]=4 172 B11R1.222 N#CC(O)C1=CC=CC=C1F AC-86154 [0,1,0,0,0,0|1,0,2]=4 173 B11R1.222 NC(CO)C1=CC=CC=C1Cl AC-87972 [0,1,0,0,0,0|2,0,0]=3 174 B11R1.222 NCC(=O)C1=CC=CC=C1F AC-24511 [0,1,0,0,0,0|1,0,1]=3 175 B11R1.222 NCC(=O)C1=CC=CC=C1F AC-80100 [0,1,0,0,0,0|1,0,1]=3 176 B11R1.222 NCC(O)C1=CC=CC=C1I AC-79822 [0,1,0,0,0,0|1,0,0]=2 177 B11R1.222 NNC(=O)C1=CC=CC=C1Cl AC-19294 [0,1,0,0,0,0|2,0,1]=4 178 B11R1.222 N[C@@H](CO)C1=CC=CC=C1F AC-83262 [0,1,0,0,0,0|2,0,0]=3 179 B11R1.222 O=C(CBr)C1=CC=CC=C1Br AC-85357 [0,1,0,0,0,0|2,0,1]=4 180 B11R1.222 O=C(CBr)C1=CC=CC=C1F AC-24900 [0,1,0,0,0,0|2,0,1]=4 181 B11R2.1 BrC1=CNC2=C1C=CC=C2 AC-25069 [0,0,0,1,0,0|1,0,2]=4 182 B11R2.1 BrC1=NNC2=C1C=CC=C2 AC-25060 [0,0,0,1,0,0|2,0,1]=4 183 B11R2.1 CC1=CNC2=C1C=CC=C2 AC-13153 [0,0,0,1,0,0|0,0,2]=3 184 B11R2.1 CC1=CNC2=CC=CN=C12 AC-83983 [0,0,0,1,0,0|1,0,2]=4 185 B11R2.1 CC1=CSC2=CC=CC=C12 AC-61665 [0,0,0,1,0,0|1,0,2]=4 186 B11R2.1 CC1=NNC2=C1C=CC=C2 AC-31044 [0,0,0,1,0,0|1,0,1]=3 187 B11R2.1 CC1=NNC2=C1C=CN=C2 AC-80963 [0,0,0,1,0,0|2,0,1]=4 188 B11R2.1 CC1=NNC2=NC=CC=C12 AC-69538 [0,0,0,1,0,0|2,0,1]=4 189 B11R2.1 CN1C=CC2=C1C=CC=C2 AC-13481 [0,0,0,1,0,0|2,0,1]=4 190 B11R2.1 CN1C=NC2=CC=CC=C21 AC-14085 [0,0,0,1,0,0|1,0,2]=4 191 B11R2.1 CN1N=CC2=C1C=CC=C2 AC-43239 [0,0,0,1,0,0|3,0,0]=4 192 B11R2.1 ClC1=NNC2=C1C=CC=C2 AC-61426 [0,0,0,1,0,0|2,0,1]=4 193 B11R2.1 IC1=CNC2=C1C=CC=C2 AC-29929 [0,0,0,1,0,0|1,0,2]=4 194 B11R2.1 NC1=NNC2=C1C=CC=C2 AC-29846 [0,0,0,1,0,0|2,0,1]=4 195 B11R2.1 NC1CCC2=C1C=CC=C2 AC-20254 [0,0,0,1,0,0|2,0,0]=3 196 B11R2.1 NC1CCC2=C1C=CC=C2 AC-39373 [0,0,0,1,0,0|2,0,0]=3 197 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 AC-68865 [0,0,0,1,0,0|2,0,0]=3 198 B11R2.1 O=C1CCC2=C1C=CC=C2 AC-14690 [0,0,0,1,0,0|2,0,1]=4 199 B11R2.1 O=C1COC2=CC=CC=C12 AC-24718 [0,0,0,1,0,0|2,0,1]=4 200 B11R2.1 OC1=NNC2=C1C=CC=C2 AC-73906 [0,0,0,1,0,0|2,0,1]=4 201 B11R2.1 OC1OCC2=C1C=CC=C2 AC-95328 [0,0,0,1,0,0|3,0,0]=4 202 B11R2.1 O[C@@H]1CCC2=C1C=CC=C2 AC-83064 [0,0,0,1,0,0|2,0,0]=3 203 B11R2.239 C1=CC=C(C2CNC2)C=C1 AC-39099 [0,0,0,1,0,0|0,0,0]=1 204 B11R1.40 CC(C#N)NC1=CC=CC=C1 AC-88942 [0,0,0,0,0,1|0,0,2]=3 205 B11R1.40 NC(CO)CC1=CC=CC=C1 AC-76906 [0,0,0,0,0,1|2,0,0]=3 206 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 AC-11522 [0,0,0,0,0,1|2,0,0]=3 207 B11R1.40 O=C(CBr)CC1=CC=CC=C1 AC-75854 [0,0,0,0,0,1|2,0,1]=4 208 B11R1.40 O=C(CCl)NC1=CC=CC=C1 AC-16971 [0,0,0,0,0,1|2,0,1]=4 209 B8R1.2 BrCC1=CC=CN=C1 AC-25258 [2,0,0,0,0,0|2,0,0]=4 210 B8R1.2 BrCC1=CC=CN=C1 AC-76498 [2,0,0,0,0,0|2,0,0]=4 211 B8R1.2 BrCC1=NC=CC=C1 AC-25266 [2,0,0,0,0,0|2,0,0]=4 212 B8R1.2 CCC1=CC=NC=N1 AC-87953 [2,0,0,0,0,0|2,0,0]=4 213 B8R1.2 CCC1=NC=CN=C1 AC-13441 [2,0,0,0,0,0|2,0,0]=4 214 B8R1.2 CNC1=CC=NC=C1 AC-10223 [2,0,0,0,0,0|2,0,0]=4 215 B8R1.2 COC1=CC=CN=C1 AC-61633 [2,0,0,0,0,0|2,0,0]=4 216 B8R1.2 COC1=NC=CC=C1 AC-77035 [2,0,0,0,0,0|2,0,0]=4 217 B8R1.2 ClCC1=CC=CN=C1 AC-11627 [2,0,0,0,0,0|2,0,0]=4 218 B8R1.2 ClCC1=CC=NC=C1 AC-11628 [2,0,0,0,0,0|2,0,0]=4 219 B8R1.2 ClCC1=NC=CC=C1 AC-11626 [2,0,0,0,0,0|2,0,0]=4 220 B8R1.2 ICC1=CC=CC=C1 AC-80028 [2,0,0,0,0,0|1,0,0]=3 221 B8R1.2 NCC1=CC=CC=C1 AC-22861 [2,0,0,0,0,0|0,0,0]=2 222 B8R1.2 NCC1=CC=CN=C1 AC-13721 [2,0,0,0,0,0|1,0,0]=3 223 B8R1.2 NCC1=CC=CN=C1 AC-16657 [2,0,0,0,0,0|1,0,0]=3 224 B8R1.2 NCC1=CC=NC=C1 AC-22745 [2,0,0,0,0,0|1,0,0]=3 225 B8R1.2 NCC1=CC=NC=C1 AC-75575 [2,0,0,0,0,0|1,0,0]=3 226 B8R1.2 NCC1=CC=NC=N1 AC-22746 [2,0,0,0,0,0|2,0,0]=4 227 B8R1.2 NCC1=CC=NC=N1 AC-68960 [2,0,0,0,0,0|2,0,0]=4 228 B8R1.2 NCC1=CC=NN=C1 AC-69278 [2,0,0,0,0,0|2,0,0]=4 229 B8R1.2 NCC1=CC=NN=C1 AC-81095 [2,0,0,0,0,0|2,0,0]=4 230 B8R1.2 NCC1=CN=CN=C1 AC-88522 [2,0,0,0,0,0|2,0,0]=4 231 B8R1.2 NCC1=NC=CC=C1 AC-22744 [2,0,0,0,0,0|1,0,0]=3 232 B8R1.2 NCC1=NC=CC=N1 AC-24647 [2,0,0,0,0,0|2,0,0]=4 233 B8R1.2 NCC1=NC=CC=N1 AC-34916 [2,0,0,0,0,0|2,0,0]=4 234 B8R1.2 NCC1=NC=CC=N1 AC-95654 [2,0,0,0,0,0|2,0,0]=4 235 B8R1.2 NCC1=NC=CN=C1 AC-24641 [2,0,0,0,0,0|2,0,0]=4 236 B8R1.2 NCC1=NC=CN=C1 AC-40799 [2,0,0,0,0,0|2,0,0]=4 237 B8R1.2 NCC1=NN=CC=C1 AC-69279 [2,0,0,0,0,0|2,0,0]=4 238 B8R1.2 NCC1=NN=CC=C1 AC-69336 [2,0,0,0,0,0|2,0,0]=4 239 B8R1.2 NNC1=CC=NC=C1 AC-34830 [2,0,0,0,0,0|2,0,0]=4 240 B8R1.2 NNC1=CC=NC=C1 AC-56235 [2,0,0,0,0,0|2,0,0]=4 241 B8R1.2 NNC1=NC=CC=C1 AC-44634 [2,0,0,0,0,0|2,0,0]=4 242 B8R1.2 NNC1=NC=CC=C1 AC-77176 [2,0,0,0,0,0|2,0,0]=4 243 B8R1.2 NNC1=NC=CC=C1 AC-77364 [2,0,0,0,0,0|2,0,0]=4 244 B8R1.2 NOC1=CC=CC=C1 AC-83716 [2,0,0,0,0,0|1,0,0]=3 245 B8R1.2 OCC1=CC=CN=C1 AC-13420 [2,0,0,0,0,0|2,0,0]=4 246 B8R1.2 OCC1=CC=NC=C1 AC-11666 [2,0,0,0,0,0|2,0,0]=4 247 B8R1.2 OCC1=NC=CC=C1 AC-11665 [2,0,0,0,0,0|2,0,0]=4 248 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 AC-76806 [1,1,0,0,0,0|1,0,1]=4 249 B10R1.13 CC(=O)C1=CC=C(C)C=C1 AC-30553 [1,1,0,0,0,0|1,0,1]=4 250 B10R1.13 CC(=O)C1=CC=C(O)C=C1 AC-75373 [1,1,0,0,0,0|1,0,1]=4 251 B10R1.13 CC(C)C1=CC=C(I)C=C1 AC-87889 [1,1,0,0,0,0|0,0,0]=2 252 B10R1.13 CC(C)C1=CC=C(N)C=C1 AC-23808 [1,1,0,0,0,0|0,0,0]=2 253 B10R1.13 CC(C)C1=CC=C(N)C=N1 AC-79877 [1,1,0,0,0,0|1,0,0]=3 254 B10R1.13 CC(C)C1=CN=C(Cl)N=C1 AC-57578 [1,1,0,0,0,0|2,0,0]=4 255 B10R1.13 CC(C)C1=CN=C(F)C=C1 AC-88124 [1,1,0,0,0,0|1,0,0]=3 256 B10R1.13 CC(C)C1=CN=C(I)C=C1 AC-94128 [1,1,0,0,0,0|1,0,0]=3 257 B10R1.13 CC(C)C1=CN=C(N)N=C1 AC-30067 [1,1,0,0,0,0|2,0,0]=4 258 B10R1.13 CC(C)C1=NC=C(Br)C=C1 AC-81674 [1,1,0,0,0,0|1,0,0]=3 259 B10R1.13 CC(C)C1=NN=C(N)C=C1 AC-81235 [1,1,0,0,0,0|2,0,0]=4 260 B10R1.13 CC(Cl)C1=NC=C(Br)C=C1 AC-92479 [1,1,0,0,0,0|2,0,0]=4 261 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 AC-48114 [1,1,0,0,0,0|0,0,0]=2 262 B10R1.13 CC(N)C1=CC=C(F)C=C1 AC-38446 [1,1,0,0,0,0|0,0,0]=2 263 B10R1.13 CC(N)C1=NC=C(Cl)C=C1 AC-85205 [1,1,0,0,0,0|1,0,0]=3 264 B10R1.13 CC(N)C1=NC=C(F)C=C1 AC-69689 [1,1,0,0,0,0|1,0,0]=3 265 B10R1.13 CC(N)C1=NC=C(F)C=C1 AC-91482 [1,1,0,0,0,0|1,0,0]=3 266 B10R1.13 CC(O)C1=CC=C(F)N=C1 AC-96637 [1,1,0,0,0,0|2,0,0]=4 267 B10R1.13 CC(O)C1=CC=C(N)C=C1 AC-14321 [1,1,0,0,0,0|1,0,0]=3 268 B10R1.13 CC1=CC=C(C(=N)N)C=C1 AC-64850 [1,1,0,0,0,0|1,0,1]=4 269 B10R1.13 CC1=CC=C(C(=N)N)C=C1 AC-81217 [1,1,0,0,0,0|1,0,1]=4 270 B10R1.13 CC1=CC=C(C(N)=O)C=C1 AC-30674 [1,1,0,0,0,0|1,0,1]=4 271 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 AC-64830 [1,1,0,0,0,0|2,0,0]=4 272 B10R1.13 CN(C)C1=CC=C(Br)C=C1 AC-76796 [1,1,0,0,0,0|1,0,0]=3 273 B10R1.13 CN(C)C1=CC=C(I)C=C1 AC-77470 [1,1,0,0,0,0|1,0,0]=3 274 B10R1.13 CN(C)C1=CC=C(O)C=C1 AC-80522 [1,1,0,0,0,0|1,0,0]=3 275 B10R1.13 CN(C)C1=NC=C(Br)C=C1 AC-34484 [1,1,0,0,0,0|2,0,0]=4 276 B10R1.13 CN(C)C1=NC=C(I)C=C1 AC-77134 [1,1,0,0,0,0|2,0,0]=4 277 B10R1.13 CN(C)C1=NC=C(N)C=C1 AC-69415 [1,1,0,0,0,0|2,0,0]=4 278 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 AC-38884 [1,1,0,0,0,0|0,0,0]=2 279 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 AC-11552 [1,1,0,0,0,0|0,0,0]=2 280 B10R1.13 C[C@H](N)C1=CC=C(Cl)C=C1 AC-26497 [1,1,0,0,0,0|0,0,0]=2 281 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 AC-81190 [1,1,0,0,0,0|0,0,0]=2 282 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 AC-79436 [1,1,0,0,0,0|1,0,0]=3 283 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 AC-25626 [1,1,0,0,0,0|1,0,1]=4 284 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 AC-25631 [1,1,0,0,0,0|1,0,1]=4 285 B10R1.13 N=C(N)C1=CC=C(F)C=C1 AC-43000 [1,1,0,0,0,0|1,0,1]=4 286 B10R1.13 N=C(N)C1=CC=C(F)C=C1 AC-77210 [1,1,0,0,0,0|1,0,1]=4 287 B10R1.13 N=C(N)C1=CC=C(N)C=C1 AC-10700 [1,1,0,0,0,0|1,0,1]=4 288 B10R1.13 NC(=O)C1=CC=C(I)C=C1 AC-61396 [1,1,0,0,0,0|1,0,1]=4 289 B10R1.13 NC(=O)C1=CC=C(N)C=C1 AC-22483 [1,1,0,0,0,0|1,0,1]=4 290 B10R1.13 NC(=O)C1=CC=C(O)C=C1 AC-65640 [1,1,0,0,0,0|1,0,1]=4 291 B10R1.13 NC(=S)C1=CC=C(O)C=C1 AC-17906 [1,1,0,0,0,0|1,0,1]=4 292 B10R1.13 NC1=CC=C(C(F)F)C=C1 AC-93915 [1,1,0,0,0,0|2,0,0]=4 293 B10R1.28 CC(C)(C)C1=CC=NC=C1 AC-77128 [1,1,0,0,0,0|1,0,0]=3 294 B10R1.28 CC(C)(N)C1=CC=CC=C1 AC-42905 [1,1,0,0,0,0|0,0,0]=2 295 B10R1.28 CC(C)(N)C1=CC=NC=C1 AC-71714 [1,1,0,0,0,0|1,0,0]=3 296 B10R1.28 CC(C)(N)C1=NC=CC=C1 AC-83987 [1,1,0,0,0,0|1,0,0]=3 297 B10R1.28 CC(C)(O)C1=CC=CC=C1 AC-76466 [1,1,0,0,0,0|0,0,0]=2 298 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 AC-81317 [1,1,0,0,0,0|1,0,0]=3 299 B10R1.28 C[Si](C)(C)C1=CC=CN=C1 AC-95797 [1,1,0,0,0,0|1,1,0]=4 300 B10R1.28 C[Si](C)(C)C1=NC=CC=C1 AC-62431 [1,1,0,0,0,0|1,1,0]=4 301 B10R1.28 C[Si](C)(Cl)C1=CC=CC=C1 AC-74054 [1,1,0,0,0,0|0,1,0]=3 302 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 AC-22839 [1,1,0,0,0,0|2,0,0]=4 303 B10R1.61 CC(=O)C1=CC=CC=C1Br AC-14551 [1,1,0,0,0,0|1,0,1]=4 304 B10R1.61 CC(=O)C1=CC=CC=C1O AC-45312 [1,1,0,0,0,0|1,0,1]=4 305 B10R1.61 CC(Br)C1=CC=CC=C1F AC-75606 [1,1,0,0,0,0|1,0,0]=3 306 B10R1.61 CC(C)C1=C(Br)C=CN=C1 AC-87353 [1,1,0,0,0,0|1,0,0]=3 307 B10R1.61 CC(C)C1=CC=CN=C1Br AC-83214 [1,1,0,0,0,0|1,0,0]=3 308 B10R1.61 CC(C)C1=NC=CC=C1Br AC-83215 [1,1,0,0,0,0|1,0,0]=3 309 B10R1.61 CC(C)C1=NC=CC=C1O AC-42351 [1,1,0,0,0,0|1,0,0]=3 310 B10R1.61 CC(N)C1=CC=CC=C1O AC-91103 [1,1,0,0,0,0|0,0,0]=2 311 B10R1.61 CC(O)C1=CC=CC=C1Cl AC-26494 [1,1,0,0,0,0|1,0,0]=3 312 B10R1.61 CC(O)C1=CC=CN=C1Br AC-75652 [1,1,0,0,0,0|2,0,0]=4 313 B10R1.61 CC1=CC=CC=C1C(=N)N AC-38595 [1,1,0,0,0,0|1,0,1]=4 314 B10R1.61 CC1=CC=CC=C1C(C)N AC-38657 [1,1,0,0,0,0|0,0,0]=2 315 B10R1.61 CC1=CC=CC=C1C(C)N AC-38658 [1,1,0,0,0,0|0,0,0]=2 316 B10R1.61 CN(C)C1=CC=CC=C1N AC-56529 [1,1,0,0,0,0|1,0,0]=3 317 B10R1.61 C[C@@H](O)C1=CC=CC=C1Cl AC-26492 [1,1,0,0,0,0|1,0,0]=3 318 B10R1.61 C[C@H](N)C1=CC=CC=C1Br AC-80926 [1,1,0,0,0,0|0,0,0]=2 319 B10R1.61 C[C@H](N)C1=CC=CC=C1Cl AC-81310 [1,1,0,0,0,0|0,0,0]=2 320 B10R1.61 C[C@H](N)C1=CC=CC=C1F AC-66123 [1,1,0,0,0,0|0,0,0]=2 321 B10R1.61 C[C@H](O)C1=CC=CC=C1F AC-75584 [1,1,0,0,0,0|1,0,0]=3 322 B10R1.61 N=C(N)C1=CC=CC=C1Br AC-92650 [1,1,0,0,0,0|1,0,1]=4 323 B10R1.61 N=C(N)C1=CC=CC=C1Cl AC-38209 [1,1,0,0,0,0|1,0,1]=4 324 B10R1.61 NC(=O)C1=CC=CC=C1I AC-87241 [1,1,0,0,0,0|1,0,1]=4 325 B10R1.61 NC1=CC=CC=C1C(F)F AC-84602 [1,1,0,0,0,0|2,0,0]=4 326 B10R1.61 NC1=CC=CC=C1C(F)F AC-87979 [1,1,0,0,0,0|2,0,0]=4 327 B10R1.113 CC(=O)C1=CC=CC(Cl)=C1 AC-14011 [1,1,0,0,0,0|1,0,1]=4 328 B10R1.113 CC(=O)C1=CC=CC(I)=C1 AC-83642 [1,1,0,0,0,0|1,0,1]=4 329 B10R1.113 CC(=O)C1=CC=CC(N)=C1 AC-22473 [1,1,0,0,0,0|1,0,1]=4 330 B10R1.113 CC(=O)C1=CC=CC(O)=C1 AC-75372 [1,1,0,0,0,0|1,0,1]=4 331 B10R1.113 CC(C)C1=CC(Br)=NC=C1 AC-91072 [1,1,0,0,0,0|1,0,0]=3 332 B10R1.113 CC(C)C1=CC(Cl)=NC=C1 AC-91073 [1,1,0,0,0,0|1,0,0]=3 333 B10R1.113 CC(C)C1=CC(I)=CC=C1 AC-89393 [1,1,0,0,0,0|0,0,0]=2 334 B10R1.113 CC(C)C1=CC(N)=CC=C1 AC-88442 [1,1,0,0,0,0|0,0,0]=2 335 B10R1.113 CC(C)C1=CC=CC(Br)=N1 AC-41048 [1,1,0,0,0,0|1,0,0]=3 336 B10R1.113 CC(C)C1=CC=CC(Cl)=N1 AC-37567 [1,1,0,0,0,0|1,0,0]=3 337 B10R1.113 CC(C)C1=CC=CC(N)=N1 AC-41004 [1,1,0,0,0,0|1,0,0]=3 338 B10R1.113 CC(C)C1=NC(N)=NC=C1 AC-56580 [1,1,0,0,0,0|2,0,0]=4 339 B10R1.113 CC(C)C1=NC=CC(Br)=C1 AC-88038 [1,1,0,0,0,0|1,0,0]=3 340 B10R1.113 CC(C)C1=NC=CC(Cl)=C1 AC-80394 [1,1,0,0,0,0|1,0,0]=3 341 B10R1.113 CC(C)C1=NC=NC(Cl)=C1 AC-34980 [1,1,0,0,0,0|2,0,0]=4 342 B10R1.113 CC(N)C1=CC=CC(F)=C1 AC-93554 [1,1,0,0,0,0|0,0,0]=2 343 B10R1.113 CC(N)C1=NC(Br)=CC=C1 AC-83274 [1,1,0,0,0,0|1,0,0]=3 344 B10R1.113 CC1=CC(C(C)N)=CC=C1 AC-48161 [1,1,0,0,0,0|0,0,0]=2 345 B10R1.113 CC1=CC(C(C)N)=CC=C1 AC-75976 [1,1,0,0,0,0|0,0,0]=2 346 B10R1.113 CC1=CC([C@@H](C)N)=CC=C1 AC-79587 [1,1,0,0,0,0|0,0,0]=2 347 B10R1.113 CN(C)C1=CC=CC(Br)=C1 AC-34552 [1,1,0,0,0,0|1,0,0]=3 348 B10R1.113 CN(C)C1=CC=CC(F)=C1 AC-86782 [1,1,0,0,0,0|1,0,0]=3 349 B10R1.113 CN(C)C1=CC=CC(N)=C1 AC-80600 [1,1,0,0,0,0|1,0,0]=3 350 B10R1.113 CN(C)C1=NC=CC(Cl)=C1 AC-68861 [1,1,0,0,0,0|2,0,0]=4 351 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 AC-66127 [1,1,0,0,0,0|0,0,0]=2 352 B10R1.113 N=C(N)C1=CC=CC(Cl)=C1 AC-25627 [1,1,0,0,0,0|1,0,1]=4 353 B10R1.113 N=C(N)C1=CC=CC(F)=C1 AC-76737 [1,1,0,0,0,0|1,0,1]=4 354 B10R1.113 N=C(N)C1=CC=CC(O)=C1 AC-68448 [1,1,0,0,0,0|1,0,1]=4 355 B10R1.113 NC(=O)C1=CC=CC(I)=C1 AC-88429 [1,1,0,0,0,0|1,0,1]=4 356 B10R1.1 CC1=CC=C(CCBr)C=C1 AC-79725 [1,1,0,0,0,0|1,0,0]=3 357 B10R1.1 CC1=CC=C(CCN)C=C1 AC-66651 [1,1,0,0,0,0|0,0,0]=2 358 B10R1.1 CC1=CC=C(CCO)C=C1 AC-85373 [1,1,0,0,0,0|1,0,0]=3 359 B10R1.1 CC1=CC=C(CCO)C=N1 AC-31645 [1,1,0,0,0,0|2,0,0]=4 360 B10R1.1 CC1=CC=C(CNN)C=C1 AC-80941 [1,1,0,0,0,0|1,0,0]=3 361 B10R1.1 CC1=CC=C(CNN)C=C1 AC-93370 [1,1,0,0,0,0|1,0,0]=3 362 B10R1.1 CCCC1=CC=C(Br)C=C1 AC-10989 [1,1,0,0,0,0|1,0,0]=3 363 B10R1.1 CCNC1=CC=C(Br)C=C1 AC-92040 [1,1,0,0,0,0|2,0,0]=4 364 B10R1.1 CCNC1=CC=C(F)C=C1 AC-55530 [1,1,0,0,0,0|2,0,0]=4 365 B10R1.1 CCNC1=CC=C(F)C=C1 AC-55530 [1,1,0,0,0,0|2,0,0]=4 366 B10R1.1 CCOC1=CC=C(I)C=C1 AC-14563 [1,1,0,0,0,0|2,0,0]=4 367 B10R1.1 CCOC1=CC=C(O)C=C1 AC-23515 [1,1,0,0,0,0|2,0,0]=4 368 B10R1.1 CNCC1=CC=C(Br)C=C1 AC-38785 [1,1,0,0,0,0|2,0,0]=4 369 B10R1.1 CNCC1=CC=C(C)C=C1 AC-72102 [1,1,0,0,0,0|2,0,0]=4 370 B10R1.1 CNCC1=CC=C(F)C=C1 AC-38800 [1,1,0,0,0,0|2,0,0]=4 371 B10R1.1 COCC1=CC=C(O)C=C1 AC-30313 [1,1,0,0,0,0|2,0,0]=4 372 B10R1.1 ClC1=CC=C(CCBr)C=C1 AC-77013 [1,1,0,0,0,0|1,0,0]=3 373 B10R1.1 FC1=CC=C(CCBr)C=C1 AC-73072 [1,1,0,0,0,0|1,0,0]=3 374 B10R1.1 FC1=CC=C(CCCl)C=C1 AC-17337 [1,1,0,0,0,0|1,0,0]=3 375 B10R1.1 N#CCC1=CC=C(Cl)C=C1 AC-35335 [1,1,0,0,0,0|0,0,2]=4 376 B10R1.1 N#CCC1=CC=C(I)C=C1 AC-23798 [1,1,0,0,0,0|0,0,2]=4 377 B10R1.1 N#CCC1=CC=C(N)C=C1 AC-22770 [1,1,0,0,0,0|0,0,2]=4 378 B10R1.1 N#CCC1=CC=C(O)C=C1 AC-14346 [1,1,0,0,0,0|0,0,2]=4 379 B10R1.1 NC1=CC=C(CCO)C=C1 AC-10397 [1,1,0,0,0,0|1,0,0]=3 380 B10R1.1 NCCC1=CC=C(Br)C=C1 AC-17006 [1,1,0,0,0,0|0,0,0]=2 381 B10R1.1 NCCC1=CC=C(Br)C=C1 AC-25390 [1,1,0,0,0,0|0,0,0]=2 382 B10R1.1 NCCC1=CC=C(Cl)C=C1 AC-26439 [1,1,0,0,0,0|0,0,0]=2 383 B10R1.1 NCCC1=CC=C(F)C=C1 AC-38429 [1,1,0,0,0,0|0,0,0]=2 384 B10R1.1 NCCC1=CC=C(O)C=C1 AC-10670 [1,1,0,0,0,0|0,0,0]=2 385 B10R1.1 NCCC1=CC=C(O)C=C1 AC-10671 [1,1,0,0,0,0|0,0,0]=2 386 B10R1.1 NCCC1=NC=C(Br)C=C1 AC-69603 [1,1,0,0,0,0|1,0,0]=3 387 B10R1.1 NCCC1=NC=C(Cl)C=C1 AC-94399 [1,1,0,0,0,0|1,0,0]=3 388 B10R1.1 NNCC1=CC=C(F)C=C1 AC-80042 [1,1,0,0,0,0|1,0,0]=3 389 B10R1.1 NOCC1=CC=C(Cl)C=C1 AC-72834 [1,1,0,0,0,0|1,0,0]=3 390 B10R1.1 O=CCC1=CC=C(Br)C=C1 AC-25397 [1,1,0,0,0,0|1,0,1]=4 391 B10R1.1 O=CCC1=CC=C(O)C=C1 AC-82884 [1,1,0,0,0,0|1,0,1]=4 392 B10R1.1 OCCC1=CC=C(Br)C=C1 AC-38196 [1,1,0,0,0,0|1,0,0]=3 393 B10R1.1 OCCC1=CC=C(Cl)C=C1 AC-26438 [1,1,0,0,0,0|1,0,0]=3 394 B10R1.1 OCCC1=CC=C(I)C=C1 AC-80036 [1,1,0,0,0,0|1,0,0]=3 395 B10R1.1 OCCC1=NC=C(Br)C=C1 AC-69602 [1,1,0,0,0,0|2,0,0]=4 396 B10R1.4 CC1=CC=CC=C1CC#N AC-75241 [1,1,0,0,0,0|0,0,2]=4 397 B10R1.4 CCNC1=CC=CC=C1C AC-91623 [1,1,0,0,0,0|2,0,0]=4 398 B10R1.4 CCOC1=CC=CC=C1Br AC-25393 [1,1,0,0,0,0|2,0,0]=4 399 B10R1.4 CCOC1=CC=CC=C1O AC-23517 [1,1,0,0,0,0|2,0,0]=4 400 B10R1.4 COCC1=CC=CC=C1Br AC-75841 [1,1,0,0,0,0|2,0,0]=4 401 B10R1.4 ClC1=CC=CC=C1CCBr AC-38231 [1,1,0,0,0,0|1,0,0]=3 402 B10R1.4 N#CCC1=CC=CC=C1Br AC-33883 [1,1,0,0,0,0|0,0,2]=4 403 B10R1.4 N#CCC1=CC=CC=C1I AC-23796 [1,1,0,0,0,0|0,0,2]=4 404 B10R1.4 NC1=CC=CC=C1CCO AC-32173 [1,1,0,0,0,0|1,0,0]=3 405 B10R1.4 NCCC1=CC=CC=C1Br AC-25392 [1,1,0,0,0,0|0,0,0]=2 406 B10R1.4 NCCC1=CC=CC=C1Cl AC-17496 [1,1,0,0,0,0|0,0,0]=2 407 B10R1.4 NCCC1=CC=CC=C1F AC-38427 [1,1,0,0,0,0|0,0,0]=2 408 B10R1.4 NCCC1=CC=CC=C1N AC-88322 [1,1,0,0,0,0|0,0,0]=2 409 B10R1.4 NCCC1=CC=CC=C1O AC-32404 [1,1,0,0,0,0|0,0,0]=2 410 B10R1.4 NOCC1=CC=CC=C1Cl AC-73620 [1,1,0,0,0,0|1,0,0]=3 411 B10R1.4 O=CCC1=CC=CC=C1O AC-90670 [1,1,0,0,0,0|1,0,1]=4 412 B10R1.4 OCCC1=CC=CC=C1Br AC-33636 [1,1,0,0,0,0|1,0,0]=3 413 B10R1.4 OCCC1=CC=CC=C1I AC-86393 [1,1,0,0,0,0|1,0,0]=3 414 B10R1.10 CC1=CC(CC#N)=CC=C1 AC-61319 [1,1,0,0,0,0|0,0,2]=4 415 B10R1.10 CC1=CC(CCN)=CC=C1 AC-66716 [1,1,0,0,0,0|0,0,0]=2 416 B10R1.10 CC1=CC(CCN)=CC=C1 AC-96075 [1,1,0,0,0,0|0,0,0]=2 417 B10R1.10 CC1=NC=CC(CCN)=C1 AC-76023 [1,1,0,0,0,0|1,0,0]=3 418 B10R1.10 CNCC1=CC=CC(Br)=C1 AC-38786 [1,1,0,0,0,0|2,0,0]=4 419 B10R1.10 FC1=CC(CCBr)=CC=C1 AC-19695 [1,1,0,0,0,0|1,0,0]=3 420 B10R1.10 N#CCC1=CC=CC(N)=C1 AC-80758 [1,1,0,0,0,0|0,0,2]=4 421 B10R1.10 NC1=CC(CCO)=CC=C1 AC-76030 [1,1,0,0,0,0|1,0,0]=3 422 B10R1.10 NCCC1=CC(N)=CC=C1 AC-32588 [1,1,0,0,0,0|0,0,0]=2 423 B10R1.10 NCCC1=CC(N)=CC=C1 AC-91002 [1,1,0,0,0,0|0,0,0]=2 424 B10R1.10 NCCC1=CC=CC(Br)=C1 AC-25391 [1,1,0,0,0,0|0,0,0]=2 425 B10R1.10 NCCC1=CC=CC(Br)=C1 AC-90655 [1,1,0,0,0,0|0,0,0]=2 426 B10R1.10 NCCC1=CC=CC(Cl)=C1 AC-26501 [1,1,0,0,0,0|0,0,0]=2 427 B10R1.10 NCCC1=CC=CC(F)=C1 AC-38428 [1,1,0,0,0,0|0,0,0]=2 428 B10R1.10 NCCC1=CC=CC(O)=C1 AC-14733 [1,1,0,0,0,0|0,0,0]=2 429 B10R1.10 NCCC1=NC(Br)=CC=C1 AC-87232 [1,1,0,0,0,0|1,0,0]=3 430 B10R1.10 NNCC1=CC=CC(Cl)=C1 AC-90652 [1,1,0,0,0,0|1,0,0]=3 431 B10R1.10 NNCC1=CC=CC(F)=C1 AC-58275 [1,1,0,0,0,0|1,0,0]=3 432 B10R1.10 NOCC1=CC=CC(Cl)=C1 AC-92923 [1,1,0,0,0,0|1,0,0]=3 433 B10R1.10 NOCC1=CC=CC(F)=C1 AC-38834 [1,1,0,0,0,0|1,0,0]=3 434 B10R1.10 O=CCC1=CC=CC(O)=C1 AC-82788 [1,1,0,0,0,0|1,0,1]=4 435 B10R1.10 OCCC1=CC(Cl)=NC=C1 AC-96102 [1,1,0,0,0,0|2,0,0]=4 436 B10R1.10 OCCC1=CC=CC(Br)=C1 AC-33732 [1,1,0,0,0,0|1,0,0]=3 437 B10R1.10 OCCC1=CC=CC(Cl)=C1 AC-38230 [1,1,0,0,0,0|1,0,0]=3 438 B10R1.10 OCCC1=CC=CC(F)=C1 AC-66130 [1,1,0,0,0,0|1,0,0]=3 439 B10R1.17 BrCCOC1=CC=CC=C1 AC-23943 [1,1,0,0,0,0|1,0,0]=3 440 B10R1.17 BrC\C=C\C1=CC=CC=C1 AC-27040 [1,1,0,0,0,0|1,0,1]=4 441 B10R1.17 CCCCC1=CC=NC=C1 AC-79321 [1,1,0,0,0,0|2,0,0]=4 442 B10R1.17 CCNCC1=CC=CC=C1 AC-23535 [1,1,0,0,0,0|1,0,0]=3 443 B10R1.17 CCNCC1=NC=CC=C1 AC-41270 [1,1,0,0,0,0|2,0,0]=4 444 B10R1.17 CNCCC1=CC=CN=C1 AC-86271 [1,1,0,0,0,0|1,0,0]=3 445 B10R1.17 ClCSCC1=CC=CC=C1 AC-94728 [1,1,0,0,0,0|1,0,0]=3 446 B10R1.17 ClC\C=C\C1=CC=CC=C1 AC-93428 [1,1,0,0,0,0|1,0,1]=4 447 B10R1.17 N#CCNC1=CC=CC=C1 AC-64031 [1,1,0,0,0,0|0,0,2]=4 448 B10R1.17 NCC#CC1=CC=CC=C1 AC-44516 [1,1,0,0,0,0|0,0,1]=3 449 B10R1.17 NCCCC1=CC=NC=C1 AC-58135 [1,1,0,0,0,0|1,0,0]=3 450 B10R1.17 NCCCC1=NC=CC=C1 AC-81362 [1,1,0,0,0,0|1,0,0]=3 451 B10R1.17 NCCNC1=CC=CC=C1 AC-23964 [1,1,0,0,0,0|0,0,0]=2 452 B10R1.17 NCCNC1=NC=CC=C1 AC-77117 [1,1,0,0,0,0|1,0,0]=3 453 B10R1.17 NCCNC1=NC=CN=C1 AC-79865 [1,1,0,0,0,0|2,0,0]=4 454 B10R1.17 NCCOC1=CC=CN=C1 AC-71925 [1,1,0,0,0,0|1,0,0]=3 455 B10R1.17 NCCOC1=NC=CC=C1 AC-81602 [1,1,0,0,0,0|1,0,0]=3 456 B10R1.17 OCCCC1=CC=CC=C1 AC-90879 [1,1,0,0,0,0|1,0,0]=3 457 B10R1.17 OCCCC1=CC=CN=C1 AC-63756 [1,1,0,0,0,0|2,0,0]=4 458 B10R1.17 OCCCC1=NC=CC=C1 AC-72227 [1,1,0,0,0,0|2,0,0]=4 459 B10R1.17 OC\C=C\C1=CC=CC=C1 AC-96518 [1,1,0,0,0,0|1,0,1]=4 460 B10R1.18 CC(Br)CC1=CC=CC=C1 AC-91740 [1,1,0,0,0,0|1,0,0]=3 461 B10R1.18 CC(C)NC1=CC=CC=C1 AC-13673 [1,1,0,0,0,0|2,0,0]=4 462 B10R1.18 FC(F)OC1=CC=CC=C1 AC-83043 [1,1,0,0,0,0|2,0,0]=4 463 B10R1.18 NC(=O)CC1=CC=CC=C1 AC-64120 [1,1,0,0,0,0|0,0,1]=3 464 B10R1.18 NC(=O)CC1=CC=CN=C1 AC-82928 [1,1,0,0,0,0|1,0,1]=4 465 B10R1.18 NC(=O)NC1=CC=CC=C1 AC-76979 [1,1,0,0,0,0|1,0,1]=4 466 B12R1.32 CN(CCN)CC1=CC=CC=C1 AC-57957 [0,1,0,0,0,1|1,0,0]=3 467 B12R1.32 CN(CCO)CC1=CC=CC=C1 AC-80118 [0,1,0,0,0,1|2,0,0]=4 468 B12R1.34 N[C@@H](CO)[C@@H](O)C1=CC=CC=C1 AC-20237 [0,1,0,0,0,1|2,0,0]=4 469 B12R1.43 C[C@@H](OC1=CC=CC=C1)C(=O)O AC-64126 [0,1,0,0,0,1|1,0,1]=4 470 B12R1.50 CCC(C)SC1=NC=CC(Cl)=C1 AC-95911 [0,1,0,0,0,1|2,0,0]=4 471 B12R1.50 NC(CO)CC1=CC=CC(F)=C1 AC-94723 [0,1,0,0,0,1|2,0,0]=4 472 B12R1.118 NCC(CO)CC1=CC=CC=C1 AC-86314 [0,1,0,0,0,1|0,0,0]=2 473 B12R1.371 NC(CO)CC1=CC=CC=C1F AC-87377 [0,1,0,0,0,1|2,0,0]=4 474 B12R1.9 CC(C)(C=O)C1=CC=C(Cl)C=C1 AC-82603 [0,2,0,0,0,0|1,0,1]=4 475 B12R1.9 CC(C)(CN)C1=NC=C(Br)C=C1 AC-85867 [0,2,0,0,0,0|1,0,0]=3 476 B12R1.9 CC(C)(CO)C1=CC=C(N)C=C1 AC-94841 [0,2,0,0,0,0|1,0,0]=3 477 B12R1.10 CC(C)(C#N)C1=CC=CC(Br)=C1 AC-81345 [0,2,0,0,0,0|0,0,2]=4 478 B12R1.10 CC(C)(CO)C1=CC=CC(Br)=C1 AC-83582 [0,2,0,0,0,0|1,0,0]=3 479 B12R1.10 CC[N+](C)(C)C1=CC=CC(O)=C1 AC-86347 [0,2,0,0,0,0|2,0,0]=4 480 B12R1.39 CC(C)(CC=O)C1=CC=CC=C1 AC-82230 [0,2,0,0,0,0|1,0,0]=3 481 B12R1.475 CC(CO)(CO)C1=CC=CC=C1 AC-88777 [0,2,0,0,0,0|1,0,0]=3 482 B12R1.12 CCN(CC)C1=CC=C(N)C=C1 AC-12916 [0,2,0,0,0,0|2,0,0]=4 483 B12R1.12 CCN(CC)C1=CC=C(N)C=C1 AC-60309 [0,2,0,0,0,0|2,0,0]=4 484 B12R1.13 CCN(CC)C1=CC=CC(N)=C1 AC-90913 [0,2,0,0,0,0|2,0,0]=4 485 B12R1.478 CC(=O)C(C#N)C1=CC=CC=C1 AC-64117 [0,2,0,0,0,0|0,0,2]=4 486 B12R1.478 CC(C)C(C#N)C1=CC=CC=C1 AC-23814 [0,2,0,0,0,0|0,0,2]=4 487 B12R1.478 CC(C)C(C=O)C1=CC=CC=C1 AC-96206 [0,2,0,0,0,0|1,0,1]=4 488 B12R1.478 CCC(C(=O)Cl)C1=CC=CC=C1 AC-64089 [0,2,0,0,0,0|1,0,1]=4 489 B12R1.478 CC[C@H](C(=O)O)C1=CC=CC=C1 AC-80175 [0,2,0,0,0,0|1,0,1]=4 490 B12R1.478 COC(C(=O)O)C1=CC=CC=C1 AC-58787 [0,2,0,0,0,0|1,0,1]=4 491 B12R1.478 N#CC(C(N)=O)C1=CC=CC=C1 AC-84502 [0,2,0,0,0,0|0,0,2]=4 492 B12R1.478 O=C(O)C(CO)C1=CC=CC=C1 AC-13172 [0,2,0,0,0,0|1,0,1]=4 493 B12R1.478 O=C(O)C(CO)C1=CC=CC=C1 AC-83044 [0,2,0,0,0,0|1,0,1]=4 494 B12R1.16 C=CCC(N)C1=CC=C(F)C=C1 AC-95729 [0,2,0,0,0,0|2,0,0]=4 495 B12R1.16 CC1=CC=C([C@@H](N)CCO)C=C1 AC-83113 [0,2,0,0,0,0|2,0,0]=4 496 B12R1.16 CNCC(O)C1=CC=C(O)C=C1 AC-15819 [0,2,0,0,0,0|1,0,0]=3 497 B12R1.16 CNCC(O)C1=CC=C(O)C=C1 AC-63329 [0,2,0,0,0,0|1,0,0]=3 498 B12R1.16 NC1=CC=C(C(N)CCO)C=C1 AC-66804 [0,2,0,0,0,0|2,0,0]=4 499 B12R1.17 NC(CCO)C1=CC=CC(Cl)=C1 AC-32120 [0,2,0,0,0,0|2,0,0]=4 500 B12R1.17 NC(CCO)C1=CC=CC(F)=C1 AC-66792 [0,2,0,0,0,0|2,0,0]=4 501 B12R1.17 N[C@H](CCO)C1=CC=CC(F)=C1 AC-83040 [0,2,0,0,0,0|2,0,0]=4 502 B12R1.30 CNCC[C@@H](O)C1=CC=CC=C1 AC-75382 [0,2,0,0,0,0|1,0,0]=3 503 B12R1.107 CC(C)NC(C)C1=CC=CC=C1 AC-95303 [0,2,0,0,0,0|1,0,0]=3 504 B12R1.107 CN(C)CC(N)C1=CC=CC=C1 AC-88518 [0,2,0,0,0,0|1,0,0]=3 505 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 AC-54968 [0,2,0,0,0,0|2,0,0]=4 506 B12R1.5 COC1=CC=C(C(N)CO)C=C1 AC-88641 [0,2,0,0,0,0|2,0,0]=4 507 B12R1.20 CC(C(=O)O)C1=CC=C(F)C=C1 AC-29657 [0,2,0,0,0,0|1,0,1]=4 508 B12R1.367 NC(CO)C1=CC=C(F)C(F)=C1 AC-93099 [0,2,0,0,0,0|2,0,0]=4 509 B12R1.367 NCC(=O)C1=CC=C(Br)C(F)=C1 AC-84487 [0,2,0,0,0,0|1,0,1]=4 510 B12R1.367 NCC(=O)C1=CC=C(Cl)C(Cl)=C1 AC-84154 [0,2,0,0,0,0|1,0,1]=4 511 B12R1.367 OC(CCl)C1=CC=C(Cl)C(Cl)=C1 AC-91096 [0,2,0,0,0,0|2,0,0]=4 512 B12R1.1703 NCC(=O)C1=CC=C(Cl)C=C1Cl AC-10875 [0,2,0,0,0,0|1,0,1]=4 513 B12R1.225 CC(=O)C(C)C1=CC=CC(Cl)=C1 AC-82602 [0,2,0,0,0,0|1,0,1]=4 514 B12R1.225 CC(=O)C(C)C1=CC=CC(I)=C1 AC-86391 [0,2,0,0,0,0|1,0,1]=4 515 B12R1.225 CC1=CC(C(C)C(=O)O)=CC=C1 AC-96133 [0,2,0,0,0,0|1,0,1]=4 516 B12R1.358 NCC(=O)C1=CC(F)=CC(F)=C1 AC-91490 [0,2,0,0,0,0|1,0,1]=4 517 B12R1.358 N[C@@H](CO)C1=CC(F)=CC(F)=C1 AC-81538 [0,2,0,0,0,0|2,0,0]=4 518 B12R1.435 CCC(N)C1=CC=CC(OC)=C1 AC-88655 [0,2,0,0,0,0|2,0,0]=4 519 B12R1.435 CC[C@@H](N)C1=CC(C#N)=CC=C1 AC-84171 [0,2,0,0,0,0|2,0,0]=4 520 B12R1.435 COC1=CC([C@@H](N)CO)=CC=C1 AC-83311 [0,2,0,0,0,0|2,0,0]=4 521 B12R1.124 CC(C)[C@@H](N)C1=CC=CC=C1Cl AC-83526 [0,2,0,0,0,0|2,0,0]=4 522 B12R1.564 CC(C)(C)C(N)C1=CC=CC=C1 AC-19142 [0,2,0,0,0,0|2,0,0]=4 523 B12R1.564 CC(C)(O)[C@@H](N)C1=CC=CC=C1 AC-85730 [0,2,0,0,0,0|2,0,0]=4 524 B12R1.564 CC(C)(O)[C@H](N)C1=CC=CC=C1 AC-85731 [0,2,0,0,0,0|2,0,0]=4 525 B12R1.564 N[C@@H](C1=CC=CC=C1)C(F)(F)F AC-83581 [0,2,0,0,0,0|2,0,0]=4 526 B12R1.564 N[C@H](C1=CC=CC=C1)C(F)(F)F AC-82417 [0,2,0,0,0,0|2,0,0]=4 527 B12R1.3441 CC[C@@H](N)C1=C(F)C=CC=C1F AC-38890 [0,2,0,0,0,0|2,0,0]=4 528 B10R2.6 C1=CC=C([C@H]2CO2)C=C1 AC-13229 [1,0,0,1,0,0|1,0,0]=3 529 B10R2.7 C1=CC2=C(C=C1)CNC2 AC-65239 [1,0,0,1,0,0|2,0,0]=4 530 B10R2.7 C1=CC2=C(C=C1)NC=C2 AC-44702 [1,0,0,1,0,0|0,0,2]=4 531 B10R2.7 C1=CC2=C(C=C1)NCC2 AC-73401 [1,0,0,1,0,0|0,0,0]=2 532 B10R2.7 C1=CC2=C(C=C1)NN=C2 AC-39456 [1,0,0,1,0,0|1,0,1]=4 533 B10R2.7 C1=CC2=C(C=N1)CCC2 AC-83878 [1,0,0,1,0,0|2,0,0]=4 534 B10R2.7 C1=CC2=C(N=C1)NCC2 AC-28052 [1,0,0,1,0,0|1,0,0]=3 535 B10R2.7 C1=CC=C2NN=NC2=C1 AC-92653 [1,0,0,1,0,0|2,0,0]=4 536 B10R2.7 C1=CC=C2OCOC2=C1 AC-15297 [1,0,0,1,0,0|2,0,0]=4 537 B10R2.7 C1=CC=C2SCOC2=C1 AC-96464 [1,0,0,1,0,0|2,0,0]=4 538 B10R2.7 C1=CN=C2CCCC2=C1 AC-15126 [1,0,0,1,0,0|2,0,0]=4 539 B10R2.7 C1=CN=C2CCNC2=C1 AC-76165 [1,0,0,1,0,0|1,0,0]=3 540 B12R2.18 CC1CC2=C(C=CC=C2)C1=O AC-39381 [0,0,0,1,0,1|1,0,1]=4 541 B12R2.18 CC1CC2=C(C=CC=C2)N1N AC-11735 [0,0,0,1,0,1|1,0,0]=3 542 B12R2.18 CC1CC2=C(C=CC=C2)N1N AC-32637 [0,0,0,1,0,1|1,0,0]=3 543 B12R2.18 NC1C2=C(C=CC=C2)CC1O AC-39374 [0,0,0,1,0,1|1,0,0]=3 544 B12R2.18 N[C@@H]1C2=C(C=CC=C2)C[C@@H]1O AC-13235 [0,0,0,1,0,1|1,0,0]=3 545 B12R2.18 N[C@@H]1C2=C(C=CC=C2)C[C@H]1O AC-81411 [0,0,0,1,0,1|1,0,0]=3 546 B12R2.18 N[C@H]1C2=C(C=CC=C2)C[C@H]1O AC-12978 [0,0,0,1,0,1|1,0,0]=3 547 B12R2.24 CC1CC2=C(C=CC=C2)CN1 AC-41390 [0,0,0,1,0,1|2,0,0]=4 548 B12R2.24 CC1CCC2=C(C=CC=C2)N1 AC-92540 [0,0,0,1,0,1|1,0,0]=3 549 B12R2.24 CC1CCC2=C(C=CC=N2)C1 AC-88413 [0,0,0,1,0,1|2,0,0]=4 550 B12R2.24 CC1CNC2=C(C=CC=C2)C1 AC-92541 [0,0,0,1,0,1|0,0,0]=2 551 B12R2.24 CN1CCC2=C(C=CC=C2)C1 AC-95591 [0,0,0,1,0,1|2,0,0]=4 552 B12R2.24 NC1CCC2=C(C=CC=C2)C1 AC-80418 [0,0,0,1,0,1|2,0,0]=4 553 B12R2.24 NC1CNC2=C(C=CC=C2)C1 AC-91183 [0,0,0,1,0,1|1,0,0]=3 554 B12R2.24 NC1COC2=C(C=CC=C2)C1 AC-93251 [0,0,0,1,0,1|2,0,0]=4 555 B12R2.24 OC1COC2=C(C=CC=C2)C1 AC-85844 [0,0,0,1,0,1|2,0,0]=4 556 B12R2.27 C#CC1CC1C2=CC=CC=C2 AC-93837 [0,0,0,1,0,1|1,0,1]=4 557 B12R2.32 NCC1=CC2=C(C=CC=C2)N1 AC-29880 [0,0,0,1,0,1|0,0,2]=4 558 B12R2.32 NCC1=CC2=CC=CC=C2O1 AC-58746 [0,0,0,1,0,1|0,0,2]=4 559 B12R2.32 NCC1=CC2=CC=CC=C2S1 AC-85674 [0,0,0,1,0,1|0,0,2]=4 560 B12R2.32 NCC1=NC2=CC=CC=C2N1 AC-22719 [0,0,0,1,0,1|1,0,1]=4 561 B12R2.32 NCC1=NC2=CC=CC=C2N1 AC-39291 [0,0,0,1,0,1|1,0,1]=4 562 B12R2.32 NCC1=NC2=CC=CC=C2O1 AC-75546 [0,0,0,1,0,1|1,0,1]=4 563 B12R2.32 OCC1CC2=C(C=CC=C2)C1 AC-88530 [0,0,0,1,0,1|1,0,0]=3 564 B12R2.48 C#CC1(C2=CC=CC=C2)CC1 AC-92602 [0,1,0,1,0,0|1,0,1]=4 565 B12R2.48 N#CC1(C2=CC=CC=C2)CC1 AC-31406 [0,1,0,1,0,0|0,0,2]=4 566 B12R2.48 NCC1(C2=CC=CC=C2)CC1 AC-58792 [0,1,0,1,0,0|0,0,0]=2 567 B12R2.48 O=CC1(C2=CC=CC=C2)CC1 AC-80799 [0,1,0,1,0,0|1,0,1]=4 568 B12R2.48 OCC1(C2=CC=CC=C2)CC1 AC-44806 [0,1,0,1,0,0|1,0,0]=3 569 B12R2.116 NC1(C2=CC=CC=C2)CCC1 AC-64081 [0,1,0,1,0,0|1,0,0]=3 570 B12R2.116 NC1(C2=CC=CC=C2)COC1 AC-87746 [0,1,0,1,0,0|1,0,0]=3 571 B12R2.116 OC1(C2=CC=CC=C2)COC1 AC-87695 [0,1,0,1,0,0|1,0,0]=3 572 B12R2.2403 CC1(C)CNC2=C1C=CC=C2 AC-70343 [0,1,0,1,0,0|0,0,0]=2 573 B12R2.1 BrCC1=CNC2=C1C=CC=C2 AC-82133 [0,1,0,1,0,0|0,0,2]=4 574 B12R2.1 BrCC1CCC2=C1C=CC=C2 AC-94008 [0,1,0,1,0,0|1,0,0]=3 575 B12R2.1 N#CC1CCC2=C1C=CC=C2 AC-80113 [0,1,0,1,0,0|0,0,2]=4 576 B12R2.1 NCC1=CNC2=C1C=CC=C2 AC-85126 [0,1,0,1,0,0|0,0,2]=4 577 B12R2.1 NCC1=CSC2=CC=CC=C12 AC-87902 [0,1,0,1,0,0|0,0,2]=4 578 B12R2.1 NCC1=NNC2=C1C=CC=C2 AC-81017 [0,1,0,1,0,0|1,0,1]=4 579 B12R2.1 NCC1=NOC2=CC=CC=C21 AC-83337 [0,1,0,1,0,0|1,0,1]=4 580 B12R2.1 NCC1CCC2=C1C=CC=C2 AC-86444 [0,1,0,1,0,0|0,0,0]=2 581 B12R2.1 OCC1=CNC2=C1C=CC=C2 AC-10921 [0,1,0,1,0,0|0,0,2]=4 582 B12R2.1 OCC1CCC2=C1C=CC=C2 AC-87580 [0,1,0,1,0,0|1,0,0]=3 583 B12R2.2 C1=CC(C2CCCN2)=CC=N1 AC-63678 [0,1,0,1,0,0|2,0,0]=4 584 B12R2.2 C1=CC=C(C2=CCCC2)C=C1 AC-75353 [0,1,0,1,0,0|1,0,1]=4 585 B12R2.2 C1=CC=C(C2CCCN2)C=C1 AC-62045 [0,1,0,1,0,0|1,0,0]=3 586 B12R2.2 C1=CC=C(C2CCNC2)C=C1 AC-57402 [0,1,0,1,0,0|0,0,0]=2 587 B12R2.2 C1=CC=C(C2CCNC2)C=C1 AC-91187 [0,1,0,1,0,0|0,0,0]=2 588 B12R2.2 C1=CC=C(C2SCCS2)C=C1 AC-84669 [0,1,0,1,0,0|2,0,0]=4 589 B12R2.2 C1=CC=C(N2CCCC2)C=C1 AC-23979 [0,1,0,1,0,0|2,0,0]=4 590 B12R2.2 C1=CC=C([C@@H]2CCNC2)C=C1 AC-83118 [0,1,0,1,0,0|0,0,0]=2 591 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 AC-71372 [0,1,0,1,0,0|0,0,0]=2 592 B12R2.2 C1=CN=C(C2CCCN2)C=C1 AC-93141 [0,1,0,1,0,0|2,0,0]=4 593 B12R2.2 C1=CN=C(C2CCNC2)C=C1 AC-84744 [0,1,0,1,0,0|1,0,0]=3 594 B12R2.2 C1=CN=CC(C2CCCN2)=C1 AC-63679 [0,1,0,1,0,0|2,0,0]=4 595 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 AC-86625 [0,1,0,1,0,0|1,0,0]=3 596 B12R2.1081 CC1=NCCC2=C1C=CC=C2 AC-79916 [0,1,0,1,0,0|1,0,1]=4 597 B12R2.1081 CC1CCCC2=C1C=CC=N2 AC-91063 [0,1,0,1,0,0|2,0,0]=4 598 B12R2.1081 CC1CNCC2=C1C=CC=C2 AC-41446 [0,1,0,1,0,0|0,0,0]=2 599 B12R2.1081 CC1CNCC2=C1C=CC=C2 AC-79561 [0,1,0,1,0,0|0,0,0]=2 600 B12R2.1081 CN1CCNC2=C1C=CC=C2 AC-79456 [0,1,0,1,0,0|1,0,0]=3 601 B12R2.1081 CN1CCNC2=C1C=CC=C2 AC-91080 [0,1,0,1,0,0|1,0,0]=3 602 B12R2.1081 NC1CCCC2=C1C=CC=C2 AC-88620 [0,1,0,1,0,0|2,0,0]=4 603 B12R2.1081 NC1COCC2=C1C=CC=C2 AC-28095 [0,1,0,1,0,0|2,0,0]=4 604 B12R2.1081 NC1CSCC2=C1C=CC=C2 AC-39187 [0,1,0,1,0,0|2,0,0]=4 605 B12R2.1081 N[C@@H]1CCOC2=C1C=CC=C2 AC-42702 [0,1,0,1,0,0|2,0,0]=4 606 B12R2.1081 O=C1CNCC2=C1C=CC=C2 AC-84554 [0,1,0,1,0,0|1,0,1]=4 607 B12R2.1081 OC1CCCC2=C1C=CC=C2 AC-21976 [0,1,0,1,0,0|2,0,0]=4 608 B12R2.2028 CN1N=C(N)C2=C1C=CC=C2 AC-39408 [0,1,0,1,0,0|1,0,1]=4 609 B12R2.2028 NC1NC(=O)C2=C1C=CC=C2 AC-92774 [0,1,0,1,0,0|1,0,1]=4 610 B12R2.2028 O=C1CC(Br)C2=C1C=CC=C2 AC-71476 [0,1,0,1,0,0|2,0,0]=4 611 B12R2.79 NC1CC1C2=CC=C(Br)C=C2 AC-76055 [0,1,0,1,0,0|0,0,0]=2 612 B12R2.612 CC1=CC2=C(C=C1)C(N)CC2 AC-93292 [0,1,0,1,0,0|2,0,0]=4 613 B12R2.612 CC1=NNC2=C1C=CC(I)=C2 AC-70465 [0,1,0,1,0,0|1,0,1]=4 614 B12R2.612 CC1=NNC2=C1C=CC(O)=C2 AC-42340 [0,1,0,1,0,0|1,0,1]=4 615 B12R2.612 CC1NCC2=C1C=CC(Br)=C2 AC-34036 [0,1,0,1,0,0|2,0,0]=4 616 B12R2.612 CN1CCC2=C1C=CC(N)=C2 AC-83284 [0,1,0,1,0,0|2,0,0]=4 617 B12R2.612 ClC1CCC2=C1C=CC(Br)=C2 AC-80381 [0,1,0,1,0,0|2,0,0]=4 618 B12R2.612 NC1CCC2=C1C=CC(Br)=C2 AC-44496 [0,1,0,1,0,0|2,0,0]=4 619 B12R2.612 NC1CCC2=C1C=CC(Cl)=C2 AC-89068 [0,1,0,1,0,0|2,0,0]=4 620 B12R2.612 OC1CCC2=C1C=CC(F)=C2 AC-81770 [0,1,0,1,0,0|2,0,0]=4 621 B12R2.612 OC1COC2=CC(Br)=CC=C21 AC-87612 [0,1,0,1,0,0|2,0,0]=4 622 B12R2.132 CC1=CNC2=C1C=C(F)C=C2 AC-10152 [0,1,0,1,0,0|0,0,2]=4 623 B12R2.132 CC1=NNC2=C1C=C(N)C=C2 AC-31057 [0,1,0,1,0,0|1,0,1]=4 624 B12R2.132 NC1CCC2=C1C=C(Br)C=C2 AC-43284 [0,1,0,1,0,0|2,0,0]=4 625 B12R2.132 OC1COC2=CC=C(Br)C=C21 AC-94033 [0,1,0,1,0,0|2,0,0]=4 626 B12R2.196 CC1=CC=CC2=C1CCC2O AC-42297 [0,1,0,1,0,0|2,0,0]=4 627 B12R2.196 NC1CCC2=C1C=CC=C2O AC-42779 [0,1,0,1,0,0|2,0,0]=4 628 B12R2.196 N[C@@H]1CCC2=C1C=CC=C2Br AC-80126 [0,1,0,1,0,0|2,0,0]=4 629 B12R2.196 N[C@H]1CCC2=C1C=CC=C2Br AC-81044 [0,1,0,1,0,0|2,0,0]=4 630 B12R2.196 O[C@H]1CCC2=C1C=CC=C2Br AC-83580 [0,1,0,1,0,0|2,0,0]=4 631 B12R2.92 ClC1(Cl)CC1C2=CC=CC=C2 AC-31399 [0,1,0,1,0,0|1,0,0]=3 632 B12R2.88 NC1(C2=CC=CC=C2Cl)CC1 AC-88156 [0,1,0,1,0,0|2,0,0]=4 633 B12R2.203 CC1=NNC2=C1C(Br)=CC=C2 AC-43211 [0,1,0,1,0,0|1,0,1]=4 634 B12R2.203 CC1=NNC2=C1C(I)=CC=C2 AC-95773 [0,1,0,1,0,0|1,0,1]=4 635 B8R1.7 CC(C)C1=CC=CO1 AC-65204 [1,0,0,0,1,0|1,0,0]=3 636 B8R1.7 CC(C)C1=CN=CS1 AC-92021 [1,0,0,0,1,0|2,0,0]=4 637 B8R1.7 CC(C)N1C=CN=C1 AC-30040 [1,0,0,0,1,0|2,0,0]=4 638 B8R1.7 CC(N)C1=CC=CS1 AC-41497 [1,0,0,0,1,0|1,0,0]=3 639 B8R1.7 CC(N)C1=CSC=C1 AC-58087 [1,0,0,0,1,0|1,0,0]=3 640 B8R1.7 CC(N)C1=CSC=N1 AC-86636 [1,0,0,0,1,0|2,0,0]=4 641 B8R1.7 CC(N)C1=NC=CS1 AC-46197 [1,0,0,0,1,0|2,0,0]=4 642 B8R1.7 CC(N)C1=NNC=C1 AC-75613 [1,0,0,0,1,0|2,0,0]=4 643 B8R1.7 CC(O)C1=CC=CS1 AC-42316 [1,0,0,0,1,0|2,0,0]=4 644 B8R1.7 CC(O)C1=CSC=C1 AC-75785 [1,0,0,0,1,0|2,0,0]=4 645 B8R1.8 NCCC1=CC=CO1 AC-44898 [1,0,0,0,1,0|1,0,0]=3 646 B8R1.8 NCCC1=CN=CN1 AC-73903 [1,0,0,0,1,0|2,0,0]=4 647 B8R1.8 NCCC1=CN=CS1 AC-90203 [1,0,0,0,1,0|2,0,0]=4 648 B8R1.8 NCCC1=CNN=C1 AC-55340 [1,0,0,0,1,0|2,0,0]=4 649 B8R1.8 NCCC1=CNN=C1 AC-89937 [1,0,0,0,1,0|2,0,0]=4 650 B8R1.8 NCCC1=CSC=C1 AC-32087 [1,0,0,0,1,0|1,0,0]=3 651 B8R1.8 NCCC1=CSC=C1 AC-46248 [1,0,0,0,1,0|1,0,0]=3 652 B8R1.8 NCCN1C=CC=N1 AC-53196 [1,0,0,0,1,0|2,0,0]=4 653 B8R1.8 OCCC1=CC=CS1 AC-13547 [1,0,0,0,1,0|2,0,0]=4 654 B8R1.8 OCCC1=CSC=C1 AC-62922 [1,0,0,0,1,0|2,0,0]=4 655 B12R1.27 CC(CCl)CNC1=CC=CC=C1 AC-93249 [0,0,0,0,0,2|1,0,0]=3 656 B12R1.27 C[C@@H](CO)NCC1=CC=CC=C1 AC-75587 [0,0,0,0,0,2|1,0,0]=3 657 B12R1.27 NCC(=O)NCC1=CC=CC=C1 AC-88856 [0,0,0,0,0,2|1,0,1]=4 658 B12R1.27 OC(CCl)COC1=CC=CC=C1 AC-90095 [0,0,0,0,0,2|2,0,0]=4 659 B12R1.27 OCC(O)COC1=CC=CC=C1 AC-23947 [0,0,0,0,0,2|2,0,0]=4