0 B12R1.4 C=CC1=CC=C(OC(C)=O)C=C1 50340 [0,0,0,0,0,0|2,0,1]=3 1 B12R1.4 CC(=O)CC1=CC=C(C#N)C=C1 D84247 [0,0,0,0,0,0|2,0,0]=2 2 B12R1.4 CC(=O)NC1=CC=C(C#N)C=C1 35468 [0,0,0,0,0,0|3,0,0]=3 3 B12R1.4 CC(=O)NC1=CC=C(C=O)C=C1 CK2088 [0,0,0,0,0,0|3,0,0]=3 4 B12R1.4 CC(=O)NC1=CC=C(CO)C=C1 20522 [0,0,0,0,0,0|3,0,0]=3 5 B12R1.4 CC(=O)OC1=CC=C(C=O)C=C1 20466 [0,0,0,0,0,0|3,0,0]=3 6 B12R1.4 CC(=O)OC1=CC=C(CBr)C=C1 A51165 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.4 CC(=O)OC1=CC=C(CCl)C=C1 F10379 [0,0,0,0,0,0|3,0,0]=3 8 B12R1.4 CC(=O)OC1=CC=C(CO)C=C1 D80495 [0,0,0,0,0,0|3,0,0]=3 9 B12R1.4 CC(C)CC1=CC=C(C=O)C=C1 D84252 [0,0,0,0,0,0|3,0,1]=4 10 B12R1.4 CCC1=CC=C(CC(C)=O)C=C1 34183 [0,0,0,0,0,0|1,0,0]=1 11 B12R1.4 CCC1=CC=C(CC(C)C)C=C1 D81530 [0,0,0,0,0,0|2,0,1]=3 12 B12R1.4 CCC1=CC=C(OC(C)=O)C=C1 D88417 [0,0,0,0,0,0|2,0,0]=2 13 B12R1.4 CN(C)CC1=CC=C(CN)C=C1 AC9373 [0,0,0,0,0,0|4,0,0]=4 14 B12R1.4 CN(C)CC1=CC=C(CN)C=C1 C74240 [0,0,0,0,0,0|4,0,0]=4 15 B12R1.4 COC1=CC=C(CC(=O)Cl)C=C1 D78187 [0,0,0,0,0,0|1,0,0]=1 16 B12R1.4 COC1=CC=C(CC(=O)O)C=C1 D70488 [0,0,0,0,0,0|1,0,0]=1 17 B12R1.4 COC1=CC=C(CC(C)=O)C=C1 26091 [0,0,0,0,0,0|0,0,0]=0 18 B12R1.4 COC1=CC=C(CC(N)=O)C=C1 63938 [0,0,0,0,0,0|1,0,0]=1 19 B12R1.4 COC1=CC=C(NC(C)=O)C=C1 C10221 [0,0,0,0,0,0|1,0,0]=1 20 B12R1.4 COC1=CC=C(NC(N)=S)C=C1 64378 [0,0,0,0,0,0|2,1,0]=3 21 B12R1.4 COC1=CN=C(CC(=O)O)C=C1 88383 [0,0,0,0,0,0|2,0,0]=2 22 B12R1.4 COC1=NC=C(CC(=O)O)C=C1 32328 [0,0,0,0,0,0|2,0,0]=2 23 B12R1.4 CSC1=CC=C(CC(=O)O)C=C1 F11769 [0,0,0,0,0,0|1,1,0]=2 24 B12R1.4 N#CC1=CC=C(CC(=O)O)C=C1 59528 [0,0,0,0,0,0|3,0,0]=3 25 B12R1.4 NCC1=CC=C(CC(=O)O)C=C1 75935 [0,0,0,0,0,0|3,0,0]=3 26 B12R1.4 O=C(O)CC1=CC=C(CBr)C=C1 11292 [0,0,0,0,0,0|3,0,0]=3 27 B12R1.4 O=C(O)CC1=CC=C(CO)C=C1 H10579 [0,0,0,0,0,0|3,0,0]=3 28 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 CL9059 [1,0,0,0,0,0|1,0,0]=2 29 B11R1.20 CC(=O)CC1=CC=C(C)C=C1 N11980 [1,0,0,0,0,0|0,0,0]=1 30 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 S10960 [1,0,0,0,0,0|1,0,0]=2 31 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 CL9158 [1,0,0,0,0,0|1,0,0]=2 32 B11R1.20 CC(=O)NC1=CC=C(Br)C=C1 D71238 [1,0,0,0,0,0|2,0,0]=3 33 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 11780 [1,0,0,0,0,0|1,0,0]=2 34 B11R1.20 CC(=O)NC1=CC=C(Cl)C=C1 TD1001 [1,0,0,0,0,0|2,0,0]=3 35 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 20004 [1,0,0,0,0,0|2,0,0]=3 36 B11R1.20 CC(=O)NC1=CC=C(I)C=C1 F21272 [1,0,0,0,0,0|2,0,0]=3 37 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 AC8790 [1,0,0,0,0,0|1,0,0]=2 38 B11R1.20 CC(=O)NC1=NC=C(Br)C=C1 46002 [1,0,0,0,0,0|3,0,0]=4 39 B11R1.20 CC(=O)NC1=NC=C(N)C=C1 22249 [1,0,0,0,0,0|3,0,0]=4 40 B11R1.20 CC(=O)OC1=CC=C(Br)C=C1 I10246 [1,0,0,0,0,0|2,0,0]=3 41 B11R1.20 CC(=O)OC1=CC=C(C)C=C1 F19619 [1,0,0,0,0,0|1,0,0]=2 42 B11R1.20 CC(=O)OC1=CC=C(Cl)C=C1 A51155 [1,0,0,0,0,0|2,0,0]=3 43 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 34627 [1,0,0,0,0,0|2,0,0]=3 44 B11R1.20 CC(=O)OC1=CC=C(I)C=C1 H11537 [1,0,0,0,0,0|2,0,0]=3 45 B11R1.20 CC(=O)OC1=CC=C(N)C=C1 AC1885 [1,0,0,0,0,0|2,0,0]=3 46 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 W10553 [1,0,0,0,0,0|1,0,0]=2 47 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 34723 [1,0,0,0,0,0|2,0,1]=4 48 B11R1.20 CC(C)CC1=CC=C(I)C=C1 D94791 [1,0,0,0,0,0|2,0,1]=4 49 B11R1.20 CC(C)CC1=CC=C(N)C=C1 N12506 [1,0,0,0,0,0|2,0,1]=4 50 B11R1.20 CC(C)OC1=CC=C(O)C=C1 78799 [1,0,0,0,0,0|2,0,1]=4 51 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 73716 [1,0,0,0,0,0|1,0,0]=2 52 B11R1.20 CC1=CC=C(NC(=N)N)C=C1 28823 [1,0,0,0,0,0|3,0,0]=4 53 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 D92325 [1,0,0,0,0,0|2,0,0]=3 54 B11R1.20 CC1=CC=C(NC(N)=S)C=C1 78765 [1,0,0,0,0,0|2,1,0]=4 55 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 RB3375 [1,0,0,0,0,0|2,0,0]=3 56 B11R1.20 CC1=NC=C(CC(=O)O)C=C1 76381 [1,0,0,0,0,0|2,0,0]=3 57 B11R1.20 CN(C)CC1=CC=C(Br)C=C1 D97623 [1,0,0,0,0,0|3,0,0]=4 58 B11R1.20 CN(C)CC1=CC=C(N)C=C1 34677 [1,0,0,0,0,0|3,0,0]=4 59 B11R1.20 CN(C)CC1=CC=C(O)C=C1 C80067 [1,0,0,0,0,0|2,0,0]=3 60 B11R1.20 C[C@H](N)CC1=CC=C(F)C=C1 BL000373 [1,0,0,0,0,0|2,0,1]=4 61 B11R1.20 NC(=O)CC1=CC=C(Br)C=C1 D97484 [1,0,0,0,0,0|2,0,0]=3 62 B11R1.20 NC(=O)CC1=CC=C(Cl)C=C1 84998 [1,0,0,0,0,0|2,0,0]=3 63 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 S12297 [1,0,0,0,0,0|1,0,0]=2 64 B11R1.20 NC(=O)NC1=CC=C(Br)C=C1 F20475 [1,0,0,0,0,0|3,0,0]=4 65 B11R1.20 NC(=O)NC1=CC=C(Cl)C=C1 D84244 [1,0,0,0,0,0|3,0,0]=4 66 B11R1.20 NC(=O)NC1=CC=C(F)C=C1 D90690 [1,0,0,0,0,0|3,0,0]=4 67 B11R1.20 NC(=S)NC1=CC=C(O)C=C1 AB7339 [1,0,0,0,0,0|2,1,0]=4 68 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 AC7503 [1,0,0,0,0,0|2,0,0]=3 69 B11R1.20 O=C(Cl)CC1=CC=C(Br)C=C1 D81755 [1,0,0,0,0,0|2,0,0]=3 70 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 P16509 [1,0,0,0,0,0|2,0,0]=3 71 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 D70527 [1,0,0,0,0,0|2,0,0]=3 72 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 25500 [1,0,0,0,0,0|2,0,0]=3 73 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 33451 [1,0,0,0,0,0|2,0,0]=3 74 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 AC7824 [1,0,0,0,0,0|1,0,0]=2 75 B11R1.20 O=C(O)CC1=CN=C(Cl)C=C1 57816 [1,0,0,0,0,0|3,0,0]=4 76 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 36095 [1,0,0,0,0,0|3,0,0]=4 77 B11R1.83 C#CC1=CC=C(CCC)C=C1 26804 [1,0,0,0,0,0|1,0,2]=4 78 B11R1.83 C=CCC1=CC=C(OC)C=C1 43558 [1,0,0,0,0,0|0,0,1]=2 79 B11R1.83 CCC1=CC=C(CNC)C=C1 29723 [1,0,0,0,0,0|2,0,0]=3 80 B11R1.83 CCC1=CC=C(N=C=O)C=C1 D90562 [1,0,0,0,0,0|2,0,1]=4 81 B11R1.83 CCCC1=CC=C(C=O)C=C1 CK1040 [1,0,0,0,0,0|2,0,1]=4 82 B11R1.83 CCCC1=CC=C(OC)C=C1 D97196 [1,0,0,0,0,0|0,0,1]=2 83 B11R1.83 CCOC1=CC=C(CC)C=C1 D90515 [1,0,0,0,0,0|2,0,1]=4 84 B11R1.83 CNCC1=CC=C(OC)C=C1 34682 [1,0,0,0,0,0|1,0,0]=2 85 B11R1.83 CNCC1=CC=C(OC)C=C1 F14713 [1,0,0,0,0,0|1,0,0]=2 86 B11R1.83 COC1=CC=C(C=NO)C=C1 AR2369 [1,0,0,0,0,0|1,0,2]=4 87 B11R1.83 COC1=CC=C(CC#N)C=C1 63962 [1,0,0,0,0,0|1,0,1]=3 88 B11R1.83 COC1=CC=C(CCBr)C=C1 S10931 [1,0,0,0,0,0|1,0,1]=3 89 B11R1.83 COC1=CC=C(CCCl)C=C1 D89445 [1,0,0,0,0,0|1,0,1]=3 90 B11R1.83 COC1=CC=C(CCN)C=C1 63814 [1,0,0,0,0,0|1,0,1]=3 91 B11R1.83 COC1=CC=C(CCO)C=C1 67626 [1,0,0,0,0,0|0,0,2]=3 92 B11R1.83 COC1=CC=C(CNN)C=C1 25799 [1,0,0,0,0,0|2,0,0]=3 93 B11R1.83 COC1=CC=C(CNN)C=C1 P10418 [1,0,0,0,0,0|2,0,0]=3 94 B11R1.83 COC1=CC=C(CNO)C=C1 S11725 [1,0,0,0,0,0|1,0,1]=3 95 B11R1.83 COC1=CC=C(CON)C=C1 BL009653 [1,0,0,0,0,0|2,0,0]=3 96 B11R1.83 COC1=CC=C(CON)C=C1 W18358 [1,0,0,0,0,0|2,0,0]=3 97 B11R1.83 COC1=CC=C(N=C=S)C=C1 D78362 [1,0,0,0,0,0|1,1,1]=4 98 B11R1.83 COC1=CC=C(NC=O)C=C1 D91515 [1,0,0,0,0,0|1,0,0]=2 99 B11R1.83 COC1=NC=C(CCN)C=C1 FD7158 [1,0,0,0,0,0|2,0,1]=4 100 B11R1.83 COCC1=CC=C(OC)C=C1 S10552 [1,0,0,0,0,0|1,0,0]=2 101 B11R1.83 CSC1=CC=C(N=C=O)C=C1 C80083 [1,0,0,0,0,0|1,1,1]=4 102 B11R1.83 CSCC1=CC=C(C#N)C=C1 W18483 [1,0,0,0,0,0|3,0,0]=4 103 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 D70168 [1,0,0,0,0,0|0,0,1]=2 104 B13R1.5 CNC1=CC=C(CC(=O)OC)C=C1 D84447 [0,1,0,0,0,0|1,0,0]=2 105 B13R1.5 COC(=O)CC1=CC=C(C#N)C=C1 CL8811 [0,1,0,0,0,0|2,0,0]=3 106 B13R1.5 COC(=O)CC1=CC=C(C=O)C=C1 CL9157 [0,1,0,0,0,0|2,0,0]=3 107 B13R1.5 COC(=O)CC1=CC=C(CBr)C=C1 63136 [0,1,0,0,0,0|2,0,0]=3 108 B13R1.5 COC(=O)CC1=CC=C(OC)C=C1 63944 [0,1,0,0,0,0|0,0,0]=1 109 B13R1.5 COC1=CC=C(C[C@H](N)CO)C=C1 N10843 [0,1,0,0,0,0|1,0,1]=3 110 B13R1.5 COC1=CC=C(O[C@@H](C)CN)C=C1 AR3800 [0,1,0,0,0,0|2,0,1]=4 111 B13R1.35 COC1=C(Br)C=C(CC(=O)O)C=C1 29032 [0,1,0,0,0,0|1,0,0]=2 112 B13R1.35 COC1=C(C)C=C(CC(=O)O)C=C1 CL8793 [0,1,0,0,0,0|1,0,0]=2 113 B13R1.35 COC1=C(C)C=C(CC(C)=O)C=C1 N10857 [0,1,0,0,0,0|0,0,0]=1 114 B13R1.35 COC1=C(Cl)C=C(CC(=O)O)C=C1 T70235 [0,1,0,0,0,0|1,0,0]=2 115 B13R1.35 COC1=C(F)C=C(CC(=O)O)C=C1 CL8779 [0,1,0,0,0,0|1,0,0]=2 116 B13R1.35 COC1=C(N)C=C(NC(C)=O)C=C1 F20328 [0,1,0,0,0,0|1,0,0]=2 117 B13R1.35 COC1=C(O)C=C(CC(=O)O)C=C1 CX1259 [0,1,0,0,0,0|1,0,0]=2 118 B13R1.36 COC1=CC=C([C@@H](N)C(=O)O)C=C1 29634 [0,1,0,0,0,0|1,0,0]=2 119 B13R1.36 COC1=CC=C([C@@H](N)C(=O)O)C=C1 I10564 [0,1,0,0,0,0|1,0,0]=2 120 B13R1.36 COC1=CC=C([C@@H](O)C(=O)O)C=C1 FD1310 [0,1,0,0,0,0|1,0,0]=2 121 B13R1.36 COC1=CC=C([C@@H](O)C(=O)O)C=C1 FD1313 [0,1,0,0,0,0|1,0,0]=2 122 B13R1.36 COC1=CC=C([C@@H](O)C(=O)O)C=C1 FD1316 [0,1,0,0,0,0|1,0,0]=2 123 B13R1.36 C[C@@H](C(=O)O)C1=CC=C(CBr)C=C1 28563 [0,1,0,0,0,0|3,0,0]=4 124 B13R1.142 CC(=O)NC1=CC=C(CC#N)C=C1 A10173 [0,1,0,0,0,0|2,0,1]=4 125 B13R1.142 CC(=O)NC1=CC=C(CCO)C=C1 AB11504 [0,1,0,0,0,0|2,0,0]=3 126 B13R1.142 CCCC1=CC=C(CC(=O)O)C=C1 CK1038 [0,1,0,0,0,0|2,0,0]=3 127 B13R1.142 CCOC1=CC=C(CC(=O)O)C=C1 A50733 [0,1,0,0,0,0|1,0,0]=2 128 B13R1.142 CCOC1=CC=C(NC(C)=O)C=C1 D84419 [0,1,0,0,0,0|1,0,0]=2 129 B13R1.142 COCC1=CC=C(CC(=O)O)C=C1 75036 [0,1,0,0,0,0|1,0,0]=2 130 B13R1.585 CC(=O)C1=CC=C(CC(C)C)C=C1 34153 [0,1,0,0,0,0|2,0,1]=4 131 B13R1.585 CC(=O)CC1=CC=C([N+](=O)[O-])C=C1 34189 [0,1,0,0,0,0|2,0,0]=3 132 B13R1.585 CC(=O)NC1=CC=C(B(O)O)C=C1 33013 [0,1,0,0,0,0|3,0,0]=4 133 B13R1.585 CC(=O)NC1=CC=C(C(=O)O)C=C1 AC1876 [0,1,0,0,0,0|3,0,0]=4 134 B13R1.585 CC(=O)NC1=CC=C(C(=O)O)C=C1 D82952 [0,1,0,0,0,0|3,0,0]=4 135 B13R1.585 CC(=O)NC1=CC=C(C(C)=O)C=C1 A10281 [0,1,0,0,0,0|2,0,0]=3 136 B13R1.585 CC(=O)NC1=CC=C([N+](=O)[O-])C=C1 AB9858 [0,1,0,0,0,0|3,0,0]=4 137 B13R1.585 CC(=O)OC1=CC=C(C(=O)O)C=C1 W13458 [0,1,0,0,0,0|3,0,0]=4 138 B13R1.585 CC(=O)OC1=CC=C([N+](=O)[O-])C=C1 F31024 [0,1,0,0,0,0|3,0,0]=4 139 B13R1.585 CC(C)C1=CC=C(CC(=O)O)C=C1 F20937 [0,1,0,0,0,0|2,0,0]=3 140 B13R1.585 CN(C)C1=CC=C(CC(=O)O)C=C1 22844 [0,1,0,0,0,0|2,0,0]=3 141 B13R1.585 O=C(O)CC1=CC=C(C(=O)O)C=C1 CL8788 [0,1,0,0,0,0|3,0,0]=4 142 B13R1.585 O=C(O)CC1=CC=C([N+](=O)[O-])C=C1 S12333 [0,1,0,0,0,0|3,0,0]=4 143 B13R1.653 COC1=CC(Br)=C(CC(=O)O)C=C1 CL8755 [0,1,0,0,0,0|1,0,0]=2 144 B13R1.653 COC1=CC(C)=C(CC(=O)O)C=C1 D83026 [0,1,0,0,0,0|1,0,0]=2 145 B13R1.653 COC1=CC(C)=C(NC(C)=O)C=C1 30807 [0,1,0,0,0,0|1,0,0]=2 146 B13R1.653 COC1=CC(Cl)=C(CC(=O)O)C=C1 35735 [0,1,0,0,0,0|1,0,0]=2 147 B13R1.653 COC1=CC(F)=C(CC(=O)O)C=C1 CL8760 [0,1,0,0,0,0|1,0,0]=2 148 B13R1.653 COC1=CC(N)=C(NC(C)=O)C=C1 D81990 [0,1,0,0,0,0|1,0,0]=2 149 B13R2.2121 COC1=CC2=C(C=C1)CC(=O)N2 25477 [0,0,0,1,0,0|1,0,0]=2 150 B13R2.2121 COC1=CC2=C(C=C1)N=C(Br)S2 54544 [0,0,0,1,0,0|2,1,0]=4 151 B13R2.2121 COC1=CC2=C(C=C1)N=C(Cl)S2 74881 [0,0,0,1,0,0|2,1,0]=4 152 B13R2.2121 COC1=CC2=C(C=C1)N=C(N)S2 26097 [0,0,0,1,0,0|2,1,0]=4 153 B13R2.2121 COC1=CC2=C(C=C1)NC(=O)C2 68469 [0,0,0,1,0,0|1,0,0]=2 154 B13R2.2121 COC1=CC2=C(C=C1)NC(=O)N2 43908 [0,0,0,1,0,0|2,0,0]=3 155 B13R2.2121 COC1=CC2=C(C=C1)NC(=O)O2 42997 [0,0,0,1,0,0|2,0,0]=3 156 B13R2.2121 COC1=CC2=C(C=C1)NC(=S)S2 D78286 [0,0,0,1,0,0|2,1,0]=4 157 B13R2.2121 COC1=CC2=C(C=C1)NC(C)=C2 33931 [0,0,0,1,0,0|2,0,0]=3 158 B13R2.2121 COC1=CC2=C(C=C1)NC(N)=N2 71398 [0,0,0,1,0,0|3,0,0]=4 159 B13R2.2121 COC1=CC2=C(C=C1)NC(S)=N2 11807 [0,0,0,1,0,0|2,1,0]=4 160 B13R2.2121 COC1=CC2=C(C=C1)OC(C)=C2 D78664 [0,0,0,1,0,0|2,0,0]=3 161 B13R2.2121 COC1=CC2=C(C=C1)OC(S)=N2 F30136 [0,0,0,1,0,0|2,1,0]=4 162 B13R2.2121 COC1=CC2=C(C=C1)SC(C)=N2 F16671 [0,0,0,1,0,0|2,0,0]=3 163 B13R2.2121 COC1=CC2=C(C=C1)SC(N)=N2 FD7390 [0,0,0,1,0,0|3,0,0]=4 164 B13R2.2121 COC1=CC2=C(C=C1)SC(S)=N2 Y10254 [0,0,0,1,0,0|2,1,0]=4 165 B13R2.2121 N#CC1=CC2=C(C=C1)CC(=O)N2 BL003636 [0,0,0,1,0,0|3,0,0]=4 166 B13R2.2121 N#CC1=CC2=C(C=C1)NC(=O)C2 95291 [0,0,0,1,0,0|3,0,0]=4 167 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 AB1444 [0,0,0,0,1,0|2,0,1]=4 168 B11R1.3 C#CC1=CC=C(C(=O)[O-])C=C1 D95539 [0,0,0,0,1,0|2,0,1]=4 169 B11R1.3 C=CC1=CC=C(C(=O)O)C=C1 67700 [0,0,0,0,1,0|2,0,1]=4 170 B11R1.3 CC(=O)C1=CC=C(C#N)C=C1 34727 [0,0,0,0,1,0|2,0,0]=3 171 B11R1.3 CC(=O)C1=CC=C(C=O)C=C1 CL9707 [0,0,0,0,1,0|2,0,0]=3 172 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 CL8917 [0,0,0,0,1,0|2,0,0]=3 173 B11R1.3 CCC1=CC=C(C(=O)Cl)C=C1 28595 [0,0,0,0,1,0|2,0,0]=3 174 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 CK2173 [0,0,0,0,1,0|2,0,0]=3 175 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 78945 [0,0,0,0,1,0|1,0,0]=2 176 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 F16175 [0,0,0,0,1,0|2,0,0]=3 177 B11R1.3 CNC1=CC=C(C(C)=O)C=C1 N12151 [0,0,0,0,1,0|1,0,0]=2 178 B11R1.3 CNC1=CC=C([N+](=O)[O-])C=C1 12028 [0,0,0,0,1,0|3,0,0]=4 179 B11R1.3 COC1=CC=C(B(O)O)C=C1 59418 [0,0,0,0,1,0|2,0,1]=4 180 B11R1.3 COC1=CC=C(C(=N)N)C=C1 D87896 [0,0,0,0,1,0|2,0,0]=3 181 B11R1.3 COC1=CC=C(C(=N)N)C=C1 H10325 [0,0,0,0,1,0|2,0,0]=3 182 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 73294 [0,0,0,0,1,0|1,0,0]=2 183 B11R1.3 COC1=CC=C(C(=O)O)C=C1 AB2885 [0,0,0,0,1,0|1,0,0]=2 184 B11R1.3 COC1=CC=C(C(C)=O)C=C1 D71251 [0,0,0,0,1,0|0,0,0]=1 185 B11R1.3 COC1=CC=C(C(C)C)C=C1 76144 [0,0,0,0,1,0|1,0,1]=3 186 B11R1.3 COC1=CC=C(C(N)=O)C=C1 F11797 [0,0,0,0,1,0|1,0,0]=2 187 B11R1.3 COC1=CC=C(N(C)C)C=C1 34356 [0,0,0,0,1,0|2,0,0]=3 188 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 30768 [0,0,0,0,1,0|1,0,1]=3 189 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 31917 [0,0,0,0,1,0|1,0,1]=3 190 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 63817 [0,0,0,0,1,0|1,0,1]=3 191 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 F11221 [0,0,0,0,1,0|1,0,1]=3 192 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 Y12471 [0,0,0,0,1,0|1,0,1]=3 193 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 D70953 [0,0,0,0,1,0|0,0,2]=3 194 B11R1.3 COC1=CC=C([N+](=O)[O-])C=C1 63190 [0,0,0,0,1,0|2,0,0]=3 195 B11R1.3 COC1=CN=C(C(=O)O)C=C1 24332 [0,0,0,0,1,0|2,0,0]=3 196 B11R1.3 COC1=CN=C(C(=O)O)C=N1 RB3245 [0,0,0,0,1,0|3,0,0]=4 197 B11R1.3 COC1=NC=C(C(=N)N)C=C1 27515 [0,0,0,0,1,0|3,0,0]=4 198 B11R1.3 COC1=NC=C(C(=O)O)C=C1 76377 [0,0,0,0,1,0|2,0,0]=3 199 B11R1.3 COC1=NC=C(C(=O)O)C=N1 69184 [0,0,0,0,1,0|3,0,0]=4 200 B11R1.3 COC1=NC=C(C(C)=O)C=C1 29324 [0,0,0,0,1,0|1,0,0]=2 201 B11R1.3 COC1=NC=C(C(N)=O)C=C1 D95562 [0,0,0,0,1,0|2,0,0]=3 202 B11R1.3 COC1=NC=C(C(N)=S)C=C1 78879 [0,0,0,0,1,0|2,1,0]=4 203 B11R1.3 COC1=NC=C([N+](=O)[O-])C=C1 98331 [0,0,0,0,1,0|3,0,0]=4 204 B11R1.3 CSC1=CC=C(C(=O)O)C=C1 FD7312 [0,0,0,0,1,0|1,1,0]=3 205 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 F14884 [0,0,0,0,1,0|0,1,0]=2 206 B11R1.3 CSC1=CC=C([N+](=O)[O-])C=C1 D84262 [0,0,0,0,1,0|2,1,0]=4 207 B11R1.3 CSC1=NC=C(C(=O)O)C=C1 54707 [0,0,0,0,1,0|2,1,0]=4 208 B11R1.3 N#CC1=CC=C(C(=O)Cl)C=C1 F16199 [0,0,0,0,1,0|3,0,0]=4 209 B11R1.3 N#CC1=CC=C(C(=O)O)C=C1 CK2166 [0,0,0,0,1,0|3,0,0]=4 210 B11R1.3 N#CC1=CC=C(C(N)=O)C=C1 A12402 [0,0,0,0,1,0|3,0,0]=4 211 B11R1.3 NC(=O)C1=CC=C(CBr)C=C1 25783 [0,0,0,0,1,0|3,0,0]=4 212 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 D70590 [0,0,0,0,1,0|3,0,0]=4 213 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 73711 [0,0,0,0,1,0|3,0,0]=4 214 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 73712 [0,0,0,0,1,0|3,0,0]=4 215 B11R1.3 O=C(Cl)C1=CC=C(CCl)C=C1 D78183 [0,0,0,0,1,0|3,0,0]=4 216 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 CK2205 [0,0,0,0,1,0|3,0,0]=4 217 B11R1.3 O=C(O)C1=CC=C(CCl)C=C1 CK2167 [0,0,0,0,1,0|3,0,0]=4 218 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 RB3326 [0,0,0,0,1,0|3,0,0]=4 219 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 D71017 [0,0,0,0,1,0|3,0,0]=4 220 B13R1.3 C=CC1=CC=C(COC(C)=O)C=C1 F17591 [0,0,0,0,0,1|1,0,1]=3 221 B13R1.3 CCC1=CC=C(CCC(=O)O)C=C1 F52865 [0,0,0,0,0,1|2,0,0]=3 222 B13R1.3 CCC1=CC=C(OCC(=O)O)C=C1 74020 [0,0,0,0,0,1|2,0,0]=3 223 B13R1.3 COC1=CC=C(CCC(=O)Cl)C=C1 20668 [0,0,0,0,0,1|1,0,0]=2 224 B13R1.3 COC1=CC=C(CCC(=O)O)C=C1 26099 [0,0,0,0,0,1|1,0,0]=2 225 B13R1.3 COC1=CC=C(CCC(C)=O)C=C1 D70489 [0,0,0,0,0,1|0,0,0]=1 226 B13R1.3 COC1=CC=C(CC[C@H](C)O)C=C1 D93078 [0,0,0,0,0,1|0,0,2]=3 227 B13R1.3 COC1=CC=C(CNC(N)=O)C=C1 S10890 [0,0,0,0,0,1|1,0,0]=2 228 B13R1.3 COC1=CC=C(COC(C)=O)C=C1 AC8426 [0,0,0,0,0,1|0,0,0]=1 229 B13R1.3 COC1=CC=C(OCC(=O)O)C=C1 A50583 [0,0,0,0,0,1|1,0,0]=2 230 B13R1.3 COC1=CC=C(\C=C\C(=O)O)C=C1 A10220 [0,0,0,0,0,1|1,0,1]=3 231 B13R1.3 COC1=CC=C(\C=C\[N+](=O)[O-])C=C1 F13726 [0,0,0,0,0,1|2,0,1]=4 232 B13R1.3 N#CC1=CC=C(CCC(=O)O)C=C1 57328 [0,0,0,0,0,1|3,0,0]=4 233 B13R1.3 N#CC1=CC=C(NCC(=O)O)C=C1 SC3501 [0,0,0,0,0,1|3,0,0]=4 234 B13R1.3 O=C(O)COC1=CC=C(CO)C=C1 33497 [0,0,0,0,0,1|3,0,0]=4 235 B13R1.3 O=CC1=CC=C(OCC(=O)O)C=C1 20462 [0,0,0,0,0,1|3,0,0]=4 236 B10R1.1 CC1=CC=C(CC#N)C=C1 67688 [2,0,0,0,0,0|1,0,1]=4 237 B10R1.1 CC1=CC=C(CC=O)C=C1 W16820 [2,0,0,0,0,0|0,0,0]=2 238 B10R1.1 CC1=CC=C(CCBr)C=C1 64231 [2,0,0,0,0,0|1,0,1]=4 239 B10R1.1 CC1=CC=C(CCN)C=C1 66611 [2,0,0,0,0,0|1,0,1]=4 240 B10R1.1 CC1=CC=C(CCN)C=C1 66612 [2,0,0,0,0,0|1,0,1]=4 241 B10R1.1 CC1=CC=C(CCO)C=C1 CK2469 [2,0,0,0,0,0|0,0,2]=4 242 B10R1.1 CC1=CC=C(N=C=O)C=C1 D92322 [2,0,0,0,0,0|1,0,1]=4 243 B10R1.1 CC1=CC=C(NC=O)C=C1 D85912 [2,0,0,0,0,0|1,0,0]=3 244 B10R1.1 CCCC1=CC=C(Br)C=C1 36843 [2,0,0,0,0,0|1,0,1]=4 245 B10R1.1 CCCC1=CC=C(Cl)C=C1 D89488 [2,0,0,0,0,0|1,0,1]=4 246 B10R1.1 CCCC1=CC=C(N)C=C1 F11809 [2,0,0,0,0,0|1,0,1]=4 247 B10R1.1 CCCC1=CC=C(O)C=C1 F16572 [2,0,0,0,0,0|0,0,1]=3 248 B10R1.1 CCOC1=CC=C(O)C=C1 23058 [2,0,0,0,0,0|1,0,1]=4 249 B10R1.1 CNCC1=CC=C(Br)C=C1 30718 [2,0,0,0,0,0|2,0,0]=4 250 B10R1.1 CNCC1=CC=C(Br)C=C1 34885 [2,0,0,0,0,0|2,0,0]=4 251 B10R1.1 CNCC1=CC=C(C)C=C1 31931 [2,0,0,0,0,0|1,0,0]=3 252 B10R1.1 CNCC1=CC=C(C)C=C1 35837 [2,0,0,0,0,0|1,0,0]=3 253 B10R1.1 CNCC1=CC=C(Cl)C=C1 23650 [2,0,0,0,0,0|2,0,0]=4 254 B10R1.1 CNCC1=CC=C(Cl)C=C1 32294 [2,0,0,0,0,0|2,0,0]=4 255 B10R1.1 CNCC1=CC=C(F)C=C1 48475 [2,0,0,0,0,0|2,0,0]=4 256 B10R1.1 CNCC1=CC=C(N)C=C1 28703 [2,0,0,0,0,0|2,0,0]=4 257 B10R1.1 CNCC1=CN=C(C)C=C1 AC2520 [2,0,0,0,0,0|2,0,0]=4 258 B10R1.1 COCC1=CC=C(Br)C=C1 N10190 [2,0,0,0,0,0|2,0,0]=4 259 B10R1.1 COCC1=CC=C(Cl)C=C1 N10137 [2,0,0,0,0,0|2,0,0]=4 260 B10R1.1 COCC1=CC=C(N)C=C1 29846 [2,0,0,0,0,0|2,0,0]=4 261 B10R1.1 N#CCC1=CC=C(O)C=C1 74178 [2,0,0,0,0,0|1,0,1]=4 262 B10R1.1 NCCC1=CC=C(O)C=C1 AC1814 [2,0,0,0,0,0|1,0,1]=4 263 B10R1.1 NCCC1=CC=C(O)C=C1 S12325 [2,0,0,0,0,0|1,0,1]=4 264 B10R1.1 O=CCC1=CC=C(Br)C=C1 68586 [2,0,0,0,0,0|1,0,0]=3 265 B10R1.1 O=CCC1=CC=C(F)C=C1 H10605 [2,0,0,0,0,0|1,0,0]=3 266 B10R1.1 O=CNC1=CC=C(Cl)C=C1 57440 [2,0,0,0,0,0|2,0,0]=4 267 B10R1.1 OC1=CC=C(CCBr)C=C1 C10633 [2,0,0,0,0,0|1,0,1]=4 268 B10R1.1 OCCC1=CC=C(O)C=C1 36252 [2,0,0,0,0,0|0,0,2]=4 269 B10R1.18 CC(=O)CC1=CC=NC=C1 32302 [2,0,0,0,0,0|1,0,0]=3 270 B10R1.18 CC(=O)CC1=CC=NC=C1 65526 [2,0,0,0,0,0|1,0,0]=3 271 B10R1.18 CC(=O)CC1=NC=CC=C1 65544 [2,0,0,0,0,0|1,0,0]=3 272 B10R1.18 CC(=O)C[N+]1=CC=CC=C1 D88335 [2,0,0,0,0,0|1,0,0]=3 273 B10R1.18 CC(=O)NC1=CC=NC=C1 D88476 [2,0,0,0,0,0|2,0,0]=4 274 B10R1.18 CC(=O)NC1=CN=CC=C1 D76087 [2,0,0,0,0,0|2,0,0]=4 275 B10R1.18 CC(=O)NC1=NC=CC=C1 H10380 [2,0,0,0,0,0|2,0,0]=4 276 B10R1.18 CC(=O)OC1=CC=CC=C1 D88203 [2,0,0,0,0,0|1,0,0]=3 277 B10R1.18 CC(=O)OC1=CN=CC=C1 D88394 [2,0,0,0,0,0|2,0,0]=4 278 B10R1.18 CC(=O)SC1=CC=CC=C1 H12050 [2,0,0,0,0,0|1,0,0]=3 279 B10R1.18 CC(=S)NC1=CC=CC=C1 81311 [2,0,0,0,0,0|1,1,0]=4 280 B10R1.18 CC(C)=CC1=CC=CC=C1 W16227 [2,0,0,0,0,0|1,0,1]=4 281 B10R1.18 C[C@H](O)CC1=CC=CC=C1 D71014 [2,0,0,0,0,0|0,0,2]=4 282 B10R1.18 C[Si](C)CC1=CC=CC=C1 D89172 [2,0,0,0,0,0|1,1,0]=4 283 B10R1.18 NC(=O)CC1=CC=CC=C1 20020 [2,0,0,0,0,0|1,0,0]=3 284 B10R1.18 NC(=O)CC1=CN=CC=C1 F30204 [2,0,0,0,0,0|2,0,0]=4 285 B10R1.18 NC(=O)C[N+]1=CC=CC=C1 D87783 [2,0,0,0,0,0|2,0,0]=4 286 B10R1.18 NC(=O)NC1=CC=CC=C1 C11241 [2,0,0,0,0,0|2,0,0]=4 287 B10R1.18 NC(=O)OC1=CC=CC=C1 81483 [2,0,0,0,0,0|2,0,0]=4 288 B10R1.18 O=C(Cl)CC1=CC=CC=C1 S11991 [2,0,0,0,0,0|1,0,0]=3 289 B10R1.18 O=C(O)CC1=CC=CC=C1 A12791 [2,0,0,0,0,0|1,0,0]=3 290 B10R1.18 O=C(O)CC1=CC=NC=C1 65460 [2,0,0,0,0,0|2,0,0]=4 291 B10R1.18 O=C(O)CC1=CC=NC=C1 65461 [2,0,0,0,0,0|2,0,0]=4 292 B10R1.18 O=C(O)CC1=CN=CC=C1 23119 [2,0,0,0,0,0|2,0,0]=4 293 B10R1.18 O=C(O)CC1=CN=CC=C1 28500 [2,0,0,0,0,0|2,0,0]=4 294 B10R1.18 O=C(O)CC1=NC=CC=C1 31161 [2,0,0,0,0,0|2,0,0]=4 295 B10R1.18 O=C(O)C[N+]1=CC=CC=C1 D85775 [2,0,0,0,0,0|2,0,0]=4 296 B10R1.3 C#CC1=CC=C(C=O)C=C1 51709 [2,0,0,0,0,0|1,0,1]=4 297 B10R1.3 C#CC1=CC=C(CC)C=C1 23050 [2,0,0,0,0,0|1,0,1]=4 298 B10R1.3 C#CC1=CC=C(OC)C=C1 99314 [2,0,0,0,0,0|0,0,2]=4 299 B10R1.3 C=CC1=CC=C(C=O)C=C1 F17742 [2,0,0,0,0,0|1,0,1]=4 300 B10R1.3 C=CC1=CC=C(OC)C=C1 D71253 [2,0,0,0,0,0|0,0,1]=3 301 B10R1.3 CCC1=CC=C(C#N)C=C1 I11479 [2,0,0,0,0,0|2,0,0]=4 302 B10R1.3 CCC1=CC=C(CBr)C=C1 W17947 [2,0,0,0,0,0|2,0,0]=4 303 B10R1.3 CCC1=CC=C(CCl)C=C1 76102 [2,0,0,0,0,0|2,0,0]=4 304 B10R1.3 CCC1=CC=C(CO)C=C1 D71245 [2,0,0,0,0,0|1,0,1]=4 305 B10R1.3 CCC1=CC=C(NN)C=C1 36403 [2,0,0,0,0,0|2,0,0]=4 306 B10R1.3 CCC1=CC=C(OC)C=C1 F14894 [2,0,0,0,0,0|0,0,0]=2 307 B10R1.3 CNC1=CC=C(OC)C=C1 70827 [2,0,0,0,0,0|1,0,0]=3 308 B10R1.3 CNC1=CC=C(OC)C=C1 D82640 [2,0,0,0,0,0|1,0,0]=3 309 B10R1.3 COC1=CC=C(C#N)C=C1 O11255 [2,0,0,0,0,0|1,0,1]=4 310 B10R1.3 COC1=CC=C(C=O)C=C1 AC7808 [2,0,0,0,0,0|0,0,0]=2 311 B10R1.3 COC1=CC=C(CBr)C=C1 20625 [2,0,0,0,0,0|1,0,0]=3 312 B10R1.3 COC1=CC=C(CN)C=C1 D77999 [2,0,0,0,0,0|1,0,0]=3 313 B10R1.3 COC1=CC=C(CO)C=C1 D77792 [2,0,0,0,0,0|0,0,1]=3 314 B10R1.3 COC1=CC=C(CS)C=C1 N11954 [2,0,0,0,0,0|0,1,0]=3 315 B10R1.3 COC1=CC=C(NN)C=C1 73714 [2,0,0,0,0,0|2,0,0]=4 316 B10R1.3 COC1=CC=C(OC)C=C1 D70298 [2,0,0,0,0,0|1,0,0]=3 317 B10R1.3 COC1=CC=C(SC)C=C1 D91543 [2,0,0,0,0,0|1,0,0]=3 318 B10R1.3 COC1=CC=C([N+]#N)C=C1 TD8040 [2,0,0,0,0,0|2,0,0]=4 319 B10R1.3 COC1=CN=C(C=O)C=C1 61667 [2,0,0,0,0,0|1,0,0]=3 320 B10R1.3 COC1=CN=C(CCl)C=C1 F11620 [2,0,0,0,0,0|2,0,0]=4 321 B10R1.3 COC1=CN=C(CO)C=C1 25486 [2,0,0,0,0,0|1,0,1]=4 322 B10R1.3 COC1=CN=C(OC)C=C1 I11454 [2,0,0,0,0,0|2,0,0]=4 323 B10R1.3 COC1=NC=C(C=O)C=C1 64881 [2,0,0,0,0,0|1,0,0]=3 324 B10R1.3 COC1=NC=C(C=O)C=N1 25288 [2,0,0,0,0,0|2,0,0]=4 325 B10R1.3 COC1=NC=C(CBr)C=C1 AB10400 [2,0,0,0,0,0|2,0,0]=4 326 B10R1.3 COC1=NC=C(CN)C=C1 30987 [2,0,0,0,0,0|2,0,0]=4 327 B10R1.3 COC1=NC=C(CN)C=C1 37569 [2,0,0,0,0,0|2,0,0]=4 328 B10R1.3 COC1=NC=C(CO)C=C1 27629 [2,0,0,0,0,0|1,0,1]=4 329 B10R1.3 CSC1=CC=C(C=O)C=C1 S11974 [2,0,0,0,0,0|0,1,0]=3 330 B10R1.3 CSC1=CC=C(CCl)C=C1 H10874 [2,0,0,0,0,0|1,1,0]=4 331 B10R1.3 CSC1=CC=C(CN)C=C1 35662 [2,0,0,0,0,0|1,1,0]=4 332 B10R1.3 CSC1=CC=C(CO)C=C1 D91589 [2,0,0,0,0,0|0,1,1]=4 333 B10R1.3 N#CC1=CC=C(C=O)C=C1 22314 [2,0,0,0,0,0|2,0,0]=4 334 B10R1.3 O=CC1=CC=C(C=O)C=C1 D70415 [2,0,0,0,0,0|2,0,0]=4 335 B10R1.3 O=CC1=CC=C(CBr)C=C1 CL9239 [2,0,0,0,0,0|2,0,0]=4 336 B10R1.3 O=CC1=CC=C(CO)C=C1 72242 [2,0,0,0,0,0|2,0,0]=4 337 B12R1.19 CC(=O)NC1=CC(Br)=C(C)C=C1 D84576 [1,1,0,0,0,0|1,0,0]=3 338 B12R1.19 CC(=O)NC1=CC(Br)=C(F)C=C1 32187 [1,1,0,0,0,0|2,0,0]=4 339 B12R1.19 CC(=O)NC1=CC(C)=C(Br)C=C1 D88986 [1,1,0,0,0,0|2,0,0]=4 340 B12R1.19 CC(=O)NC1=CC(C)=C(C)C=C1 50530 [1,1,0,0,0,0|1,0,0]=3 341 B12R1.19 CC(=O)NC1=CC(Cl)=C(Br)C=C1 AT10248 [1,1,0,0,0,0|2,0,0]=4 342 B12R1.19 CC(=O)NC1=CC(Cl)=C(C)C=C1 AB6861 [1,1,0,0,0,0|1,0,0]=3 343 B12R1.19 CC(=O)NC1=CC(Cl)=C(Cl)C=C1 AB6994 [1,1,0,0,0,0|2,0,0]=4 344 B12R1.19 CC(=O)NC1=CC(Cl)=C(F)C=C1 F21244 [1,1,0,0,0,0|2,0,0]=4 345 B12R1.19 CC(=O)NC1=CC(Cl)=C(O)C=C1 25132 [1,1,0,0,0,0|1,0,0]=3 346 B12R1.19 CC(=O)NC1=CC(N)=C(Cl)C=C1 D88451 [1,1,0,0,0,0|2,0,0]=4 347 B12R1.19 CC(=O)NC1=CC(O)=C(O)C=C1 S10202 [1,1,0,0,0,0|1,0,0]=3 348 B12R1.19 CC(=O)OC1=CC(N)=C(F)C=C1 34416 [1,1,0,0,0,0|2,0,0]=4 349 B12R1.19 CC1=C(Br)C=CC(CC(=O)O)=C1 CL8787 [1,1,0,0,0,0|2,0,0]=4 350 B12R1.19 CC1=C(C)C=C(CC(=O)O)C=C1 67768 [1,1,0,0,0,0|1,0,0]=3 351 B12R1.19 CC1=C(F)C=C(CC(=O)O)C=C1 CL9109 [1,1,0,0,0,0|1,0,0]=3 352 B12R1.19 CC1=C(F)C=CC(CC(=O)O)=C1 CL9442 [1,1,0,0,0,0|2,0,0]=4 353 B12R1.19 CC1=C(N)C=CC(CC(=O)O)=C1 Y10010 [1,1,0,0,0,0|2,0,0]=4 354 B12R1.19 CC1=C(O)C=CC(CC(=O)O)=C1 CL9284 [1,1,0,0,0,0|1,0,0]=3 355 B12R1.19 O=C(O)CC1=CC(Br)=C(Cl)C=C1 SC5040 [1,1,0,0,0,0|2,0,0]=4 356 B12R1.19 O=C(O)CC1=CC(Br)=C(F)C=C1 67770 [1,1,0,0,0,0|2,0,0]=4 357 B12R1.19 O=C(O)CC1=CC(Br)=C(O)C=C1 CK2069 [1,1,0,0,0,0|1,0,0]=3 358 B12R1.19 O=C(O)CC1=CC(Cl)=C(Cl)C=C1 75669 [1,1,0,0,0,0|2,0,0]=4 359 B12R1.19 O=C(O)CC1=CC(Cl)=C(F)C=C1 67623 [1,1,0,0,0,0|2,0,0]=4 360 B12R1.19 O=C(O)CC1=CC(Cl)=C(O)C=C1 C13676 [1,1,0,0,0,0|1,0,0]=3 361 B12R1.19 O=C(O)CC1=CC(F)=C(Br)C=C1 22748 [1,1,0,0,0,0|2,0,0]=4 362 B12R1.19 O=C(O)CC1=CC(F)=C(Cl)C=C1 35504 [1,1,0,0,0,0|2,0,0]=4 363 B12R1.19 O=C(O)CC1=CC(F)=C(F)C=C1 22054 [1,1,0,0,0,0|2,0,0]=4 364 B12R1.19 O=C(O)CC1=CC(F)=C(I)C=C1 CL8777 [1,1,0,0,0,0|2,0,0]=4 365 B12R1.19 O=C(O)CC1=CC(F)=C(O)C=C1 CL8962 [1,1,0,0,0,0|1,0,0]=3 366 B12R1.19 O=C(O)CC1=CC(O)=C(O)C=C1 33468 [1,1,0,0,0,0|1,0,0]=3 367 B12R1.20 CC(=O)N(C)C1=CC=C(N)C=C1 AB3043 [1,1,0,0,0,0|2,0,0]=4 368 B12R1.20 CC(=O)N(C)C1=CC=C(O)C=C1 Y11633 [1,1,0,0,0,0|1,0,0]=3 369 B12R1.20 CC1=CC=C([C@@H](C)C(=O)O)C=C1 F19228 [1,1,0,0,0,0|1,0,0]=3 370 B12R1.20 CC1=CC=C([C@@H](N)C(=O)O)C=C1 69416 [1,1,0,0,0,0|1,0,0]=3 371 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(Cl)C=C1 11021 [1,1,0,0,0,0|2,0,0]=4 372 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(F)C=C1 24605 [1,1,0,0,0,0|2,0,0]=4 373 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(O)C=C1 F17592 [1,1,0,0,0,0|1,0,0]=3 374 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Br)C=C1 23737 [1,1,0,0,0,0|2,0,0]=4 375 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Br)C=C1 N10975 [1,1,0,0,0,0|2,0,0]=4 376 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Cl)C=C1 28178 [1,1,0,0,0,0|2,0,0]=4 377 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Cl)C=C1 28179 [1,1,0,0,0,0|2,0,0]=4 378 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Cl)C=C1 28180 [1,1,0,0,0,0|2,0,0]=4 379 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Cl)C=C1 57525 [1,1,0,0,0,0|2,0,0]=4 380 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(F)C=C1 57523 [1,1,0,0,0,0|2,0,0]=4 381 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(F)C=C1 58552 [1,1,0,0,0,0|2,0,0]=4 382 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(F)C=C1 58553 [1,1,0,0,0,0|2,0,0]=4 383 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(F)C=C1 58554 [1,1,0,0,0,0|2,0,0]=4 384 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(O)C=C1 62399 [1,1,0,0,0,0|1,0,0]=3 385 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(O)C=C1 D71081 [1,1,0,0,0,0|1,0,0]=3 386 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(O)C=C1 F11089 [1,1,0,0,0,0|1,0,0]=3 387 B12R1.20 O=C(O)[C@H](Br)C1=CC=C(Cl)C=C1 75437 [1,1,0,0,0,0|2,0,0]=4 388 B12R1.20 O=C(O)[C@H](O)C1=CC=C(Br)C=C1 C10958 [1,1,0,0,0,0|2,0,0]=4 389 B12R1.20 O=C(O)[C@H](O)C1=CC=C(Cl)C=C1 75254 [1,1,0,0,0,0|2,0,0]=4 390 B12R1.20 O=C(O)[C@H](O)C1=CC=C(Cl)C=C1 A11529 [1,1,0,0,0,0|2,0,0]=4 391 B12R1.20 O=C(O)[C@H](O)C1=CC=C(F)C=C1 H10731 [1,1,0,0,0,0|2,0,0]=4 392 B12R1.20 O=C(O)[C@H](O)C1=CC=C(O)C=C1 28708 [1,1,0,0,0,0|1,0,0]=3 393 B12R1.20 O=C(O)[C@H](O)C1=CC=C(O)C=C1 D95528 [1,1,0,0,0,0|1,0,0]=3 394 B12R1.49 CCC(=O)NC1=CC=C(O)C=C1 A51184 [1,1,0,0,0,0|1,0,0]=3 395 B12R1.49 CNC(=O)CC1=CC=C(Br)C=C1 85543 [1,1,0,0,0,0|1,0,0]=3 396 B12R1.49 CNC(=O)CC1=CC=C(Cl)C=C1 W12083 [1,1,0,0,0,0|1,0,0]=3 397 B12R1.49 CNC(=O)CC1=CC=C(O)C=C1 W17425 [1,1,0,0,0,0|0,0,0]=2 398 B12R1.49 COC(=O)CC1=CC=C(Br)C=C1 AB3932 [1,1,0,0,0,0|1,0,0]=3 399 B12R1.49 COC(=O)CC1=CC=C(C)C=C1 76662 [1,1,0,0,0,0|0,0,0]=2 400 B12R1.49 COC(=O)CC1=CC=C(Cl)C=C1 76653 [1,1,0,0,0,0|1,0,0]=3 401 B12R1.49 COC(=O)CC1=CC=C(F)C=C1 AB7526 [1,1,0,0,0,0|1,0,0]=3 402 B12R1.49 COC(=O)CC1=CC=C(I)C=C1 AC6509 [1,1,0,0,0,0|1,0,0]=3 403 B12R1.49 COC(=O)CC1=CC=C(N)C=C1 50001 [1,1,0,0,0,0|1,0,0]=3 404 B12R1.49 COC(=O)CC1=CC=C(N)C=C1 AB7450 [1,1,0,0,0,0|1,0,0]=3 405 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 35758 [1,1,0,0,0,0|0,0,0]=2 406 B12R1.49 COC(=O)CC1=CN=C(Cl)C=C1 F16371 [1,1,0,0,0,0|2,0,0]=4 407 B12R1.49 COC(=O)NC1=CC=C(N)C=C1 AB10046 [1,1,0,0,0,0|2,0,0]=4 408 B12R1.49 NCC(=O)NC1=CC=C(N)C=C1 D81587 [1,1,0,0,0,0|2,0,0]=4 409 B12R1.49 NNC(=O)CC1=CC=C(Cl)C=C1 W10668 [1,1,0,0,0,0|2,0,0]=4 410 B12R1.49 NNC(=O)CC1=CC=C(F)C=C1 24102 [1,1,0,0,0,0|2,0,0]=4 411 B12R1.49 NNC(=O)CC1=CC=C(F)C=C1 W10662 [1,1,0,0,0,0|2,0,0]=4 412 B12R1.49 N[C@H](CO)CC1=CC=C(O)C=C1 C10910 [1,1,0,0,0,0|1,0,1]=4 413 B12R1.49 N[C@H](CO)CC1=CC=C(O)C=C1 D97455 [1,1,0,0,0,0|1,0,1]=4 414 B12R1.49 O=C(CCl)NC1=CC=C(Br)C=C1 W11889 [1,1,0,0,0,0|2,0,0]=4 415 B12R1.49 O=C(CCl)NC1=CC=C(Cl)C=C1 F30176 [1,1,0,0,0,0|2,0,0]=4 416 B12R1.49 O=C(CCl)NC1=CC=C(F)C=C1 D83579 [1,1,0,0,0,0|2,0,0]=4 417 B12R1.106 CC1=CC=C(CS(=O)(=O)Cl)C=C1 AR2933 [1,1,0,0,0,0|2,0,0]=4 418 B12R1.106 CC1=CC=C(OS(C)(=O)=O)C=C1 D84401 [1,1,0,0,0,0|2,0,0]=4 419 B12R1.233 CC(=O)CC1=C(Cl)C=C(Cl)C=C1 D90132 [1,1,0,0,0,0|1,0,0]=3 420 B12R1.233 CC(=O)NC1=C(Br)C=C(C)C=C1 54572 [1,1,0,0,0,0|1,0,0]=3 421 B12R1.233 CC(=O)NC1=C(Br)C=C(F)C=C1 D88957 [1,1,0,0,0,0|2,0,0]=4 422 B12R1.233 CC(=O)NC1=C(C)C=C(Br)C=C1 A51056 [1,1,0,0,0,0|2,0,0]=4 423 B12R1.233 CC(=O)NC1=C(C)C=C(C)C=C1 W11349 [1,1,0,0,0,0|1,0,0]=3 424 B12R1.233 CC(=O)NC1=C(C)C=C(Cl)C=C1 W10837 [1,1,0,0,0,0|2,0,0]=4 425 B12R1.233 CC(=O)NC1=C(C)C=C(F)C=C1 F21460 [1,1,0,0,0,0|2,0,0]=4 426 B12R1.233 CC(=O)NC1=C(C)C=C(N)C=C1 78470 [1,1,0,0,0,0|2,0,0]=4 427 B12R1.233 CC(=O)NC1=C(Cl)C=C(Br)C=C1 S10886 [1,1,0,0,0,0|2,0,0]=4 428 B12R1.233 CC(=O)NC1=C(Cl)C=C(Cl)C=C1 D84493 [1,1,0,0,0,0|2,0,0]=4 429 B12R1.233 CC(=O)NC1=C(Cl)C=C(F)C=C1 36575 [1,1,0,0,0,0|2,0,0]=4 430 B12R1.233 CC(=O)NC1=C(F)C=C(Br)C=C1 C10923 [1,1,0,0,0,0|2,0,0]=4 431 B12R1.233 CC(=O)NC1=C(F)C=C(C)C=C1 D83825 [1,1,0,0,0,0|1,0,0]=3 432 B12R1.233 CC(=O)NC1=C(F)C=C(Cl)C=C1 36892 [1,1,0,0,0,0|2,0,0]=4 433 B12R1.233 CC(=O)NC1=C(F)C=C(F)C=C1 36609 [1,1,0,0,0,0|2,0,0]=4 434 B12R1.233 CC(=O)NC1=C(N)C=C(Br)C=C1 F21313 [1,1,0,0,0,0|2,0,0]=4 435 B12R1.233 CC1=C(CC(=O)O)C=CC(Br)=C1 CL9343 [1,1,0,0,0,0|2,0,0]=4 436 B12R1.233 CC1=C(CC(=O)O)C=CC(F)=C1 CK2067 [1,1,0,0,0,0|2,0,0]=4 437 B12R1.233 CC1=CC(C)=C(CC(=O)O)C=C1 67678 [1,1,0,0,0,0|1,0,0]=3 438 B12R1.233 CC1=CC(F)=C(CC(=O)O)C=C1 CL9433 [1,1,0,0,0,0|1,0,0]=3 439 B12R1.233 NC(=O)CC1=C(Cl)C=C(Cl)C=C1 D84567 [1,1,0,0,0,0|2,0,0]=4 440 B12R1.233 NC1=C(CC(=O)O)C=CC(Cl)=C1 A10628 [1,1,0,0,0,0|2,0,0]=4 441 B12R1.233 O=C(O)CC1=C(Br)C=C(Br)C=C1 22757 [1,1,0,0,0,0|2,0,0]=4 442 B12R1.233 O=C(O)CC1=C(Br)C=C(Cl)C=C1 CL8754 [1,1,0,0,0,0|2,0,0]=4 443 B12R1.233 O=C(O)CC1=C(Br)C=C(F)C=C1 67762 [1,1,0,0,0,0|2,0,0]=4 444 B12R1.233 O=C(O)CC1=C(Cl)C=C(Br)C=C1 CL8783 [1,1,0,0,0,0|2,0,0]=4 445 B12R1.233 O=C(O)CC1=C(Cl)C=C(Cl)C=C1 F11217 [1,1,0,0,0,0|2,0,0]=4 446 B12R1.233 O=C(O)CC1=C(Cl)C=C(F)C=C1 CL8960 [1,1,0,0,0,0|2,0,0]=4 447 B12R1.233 O=C(O)CC1=C(F)C=C(Br)C=C1 CL8784 [1,1,0,0,0,0|2,0,0]=4 448 B12R1.233 O=C(O)CC1=C(F)C=C(Cl)C=C1 CK1034 [1,1,0,0,0,0|2,0,0]=4 449 B12R1.233 O=C(O)CC1=C(F)C=C(F)C=C1 67758 [1,1,0,0,0,0|2,0,0]=4 450 B12R1.233 O=C(O)CC1=C(O)C=C(F)C=C1 95684 [1,1,0,0,0,0|2,0,0]=4 451 B12R1.5 CCC(=O)C1=CC=C(OC)C=C1 D91525 [1,1,0,0,0,0|0,0,2]=4 452 B12R1.5 COC(=O)C1=CC=C(OC)C=C1 AC7521 [1,1,0,0,0,0|1,0,1]=4 453 B12R1.5 COC1=CC=C([C@@H](N)CO)C=C1 F16935 [1,1,0,0,0,0|0,0,2]=4 454 B12R1.5 COC1=CC=C([C@@H](N)CO)C=C1 I11111 [1,1,0,0,0,0|0,0,2]=4 455 B12R1.5 COC1=CC=C([C@@H](O)CN)C=C1 AR2876 [1,1,0,0,0,0|1,0,1]=4 456 B12R1.5 COC1=CC=C([C@H](N)C#N)C=C1 D84404 [1,1,0,0,0,0|1,0,1]=4 457 B12R1.71 C#CCOC1=CC=C(OC)C=C1 C77964 [1,1,0,0,0,0|0,0,2]=4 458 B12R1.71 CCNCC1=CC=C(OC)C=C1 30822 [1,1,0,0,0,0|0,0,1]=3 459 B12R1.71 CCNCC1=CC=C(OC)C=C1 AC2482 [1,1,0,0,0,0|0,0,1]=3 460 B12R1.71 CNCCC1=CC=C(OC)C=C1 29820 [1,1,0,0,0,0|0,0,1]=3 461 B12R1.71 COC1=CC=C(CCCN)C=C1 64244 [1,1,0,0,0,0|0,0,1]=3 462 B12R1.71 COC1=CC=C(CCCN)C=C1 64245 [1,1,0,0,0,0|0,0,1]=3 463 B12R1.71 COC1=CC=C(CCCO)C=C1 F52593 [1,1,0,0,0,0|0,0,1]=3 464 B12R1.71 COC1=CC=C(CN=C=S)C=C1 AC1241 [1,1,0,0,0,0|0,1,1]=4 465 B12R1.71 COC1=CC=C(CNC=O)C=C1 AB9534 [1,1,0,0,0,0|0,0,0]=2 466 B12R1.71 COC1=CC=C(OCC#N)C=C1 29474 [1,1,0,0,0,0|1,0,1]=4 467 B12R1.71 COC1=CC=C(OCCN)C=C1 29700 [1,1,0,0,0,0|1,0,1]=4 468 B12R1.71 COC1=CC=C(\C=C\C=O)C=C1 D82618 [1,1,0,0,0,0|0,0,1]=3 469 B12R1.113 CCCC1=CC=C(C(C)=O)C=C1 FD10624 [1,1,0,0,0,0|1,0,1]=4 470 B12R1.113 CNCC1=CC=C(N(C)C)C=C1 31646 [1,1,0,0,0,0|2,0,0]=4 471 B12R1.114 COC1=CC(C)=C(CC#N)C=C1 CL8765 [1,1,0,0,0,0|1,0,1]=4 472 B12R1.116 CCCC1=CC=C(CCC)C=C1 T70953 [1,1,0,0,0,0|1,0,1]=4 473 B12R1.116 CCOC1=CC=C(CC#N)C=C1 35755 [1,1,0,0,0,0|1,0,1]=4 474 B12R1.288 COC1=C(Br)C=C(CC#N)C=C1 D73298 [1,1,0,0,0,0|1,0,1]=4 475 B12R1.288 COC1=C(C)C=C(CC#N)C=C1 CL9295 [1,1,0,0,0,0|1,0,1]=4 476 B12R1.288 COC1=C(F)C=C(CC#N)C=C1 67624 [1,1,0,0,0,0|1,0,1]=4 477 B12R1.288 COC1=C(F)C=C(CCO)C=C1 AC1396 [1,1,0,0,0,0|0,0,2]=4 478 B12R1.288 COC1=C(O)C=C(CCN)C=C1 51443 [1,1,0,0,0,0|1,0,1]=4 479 B12R1.6 CNC1=CC=C(S(C)(=O)=O)C=C1 23819 [0,1,0,0,1,0|2,0,0]=4 480 B12R1.6 COC1=CC=C(C(C)(C)C)C=C1 N10383 [0,1,0,0,1,0|1,0,1]=4 481 B12R1.6 COC1=CC=C(S(=O)(=O)Cl)C=C1 F11798 [0,1,0,0,1,0|2,0,0]=4 482 B12R1.6 COC1=CC=C(S(=O)(=O)O)C=C1 W17239 [0,1,0,0,1,0|2,0,0]=4 483 B12R1.6 COC1=CC=C(S(N)(=O)=O)C=C1 C13911 [0,1,0,0,1,0|2,0,0]=4 484 B12R1.48 CC(=O)C1=CC(Br)=C(CO)C=C1 P18096 [0,1,0,0,1,0|2,0,0]=4 485 B12R1.48 CC(=O)C1=CC(F)=C(C#N)C=C1 74006 [0,1,0,0,1,0|2,0,0]=4 486 B12R1.48 CCC1=C(N)C=C(C(=O)O)C=C1 25457 [0,1,0,0,1,0|2,0,0]=4 487 B12R1.48 CNC1=C(N)C=C(C(=O)O)C=C1 C76085 [0,1,0,0,1,0|2,0,0]=4 488 B12R1.48 COC1=C(Br)C=C(C(=O)O)C=C1 57064 [0,1,0,0,1,0|1,0,0]=3 489 B12R1.48 COC1=C(Br)C=C(C(C)=O)C=C1 CL9267 [0,1,0,0,1,0|0,0,0]=2 490 B12R1.48 COC1=C(Br)C=C([N+](=O)[O-])C=C1 75454 [0,1,0,0,1,0|2,0,0]=4 491 B12R1.48 COC1=C(C)C=C(C(=O)O)C=C1 28885 [0,1,0,0,1,0|1,0,0]=3 492 B12R1.48 COC1=C(C)C=C(C(C)=O)C=C1 76150 [0,1,0,0,1,0|0,0,0]=2 493 B12R1.48 COC1=C(C)C=C([N+](=O)[O-])C=C1 CL8595 [0,1,0,0,1,0|2,0,0]=4 494 B12R1.48 COC1=C(Cl)C=C(C(=O)O)C=C1 I11253 [0,1,0,0,1,0|1,0,0]=3 495 B12R1.48 COC1=C(Cl)C=C(C(=O)O)C=N1 CL0216 [0,1,0,0,1,0|2,0,0]=4 496 B12R1.48 COC1=C(Cl)C=C(C(C)=O)C=C1 CL9107 [0,1,0,0,1,0|0,0,0]=2 497 B12R1.48 COC1=C(Cl)C=C([N+](=O)[O-])C=C1 75501 [0,1,0,0,1,0|2,0,0]=4 498 B12R1.48 COC1=C(F)C=C(C(=O)Cl)C=C1 35141 [0,1,0,0,1,0|1,0,0]=3 499 B12R1.48 COC1=C(F)C=C(C(=O)O)C=C1 24120 [0,1,0,0,1,0|1,0,0]=3 500 B12R1.48 COC1=C(F)C=C(C(=O)O)C=N1 26414 [0,1,0,0,1,0|2,0,0]=4 501 B12R1.48 COC1=C(F)C=C(C(C)=O)C=C1 CL8657 [0,1,0,0,1,0|0,0,0]=2 502 B12R1.48 COC1=C(F)C=C([C@H](C)N)C=C1 D80943 [0,1,0,0,1,0|1,0,1]=4 503 B12R1.48 COC1=C(F)C=C([N+](=O)[O-])C=C1 75543 [0,1,0,0,1,0|2,0,0]=4 504 B12R1.48 COC1=C(I)C=C(C(=O)O)C=C1 67822 [0,1,0,0,1,0|1,0,0]=3 505 B12R1.48 COC1=C(I)C=C([N+](=O)[O-])C=C1 67706 [0,1,0,0,1,0|2,0,0]=4 506 B12R1.48 COC1=C(N)C=C(C(=O)O)C=C1 75741 [0,1,0,0,1,0|1,0,0]=3 507 B12R1.48 COC1=C(N)C=C(C(N)=O)C=C1 D78393 [0,1,0,0,1,0|1,0,0]=3 508 B12R1.48 COC1=C(N)C=C([N+](=O)[O-])C=C1 D72503 [0,1,0,0,1,0|2,0,0]=4 509 B12R1.48 COC1=C(N)C=C([N+](=O)[O-])C=C1 O10818 [0,1,0,0,1,0|2,0,0]=4 510 B12R1.48 COC1=C(O)C=C(C(=O)O)C=C1 79397 [0,1,0,0,1,0|1,0,0]=3 511 B12R1.48 COC1=C(O)C=C(C(C)=O)C=C1 35532 [0,1,0,0,1,0|0,0,0]=2 512 B12R1.48 COC1=C(O)C=C([N+](=O)[O-])C=C1 A11767 [0,1,0,0,1,0|2,0,0]=4 513 B12R1.48 COC1=C([O-])C=C([N+](=O)[O-])C=C1 H10821 [0,1,0,0,1,0|2,0,0]=4 514 B12R1.48 COC1=CC=C(C(=O)O)N=C1Br 73491 [0,1,0,0,1,0|2,0,0]=4 515 B12R1.256 C=C(C)C1=CC=C(C(=C)C)C=C1 D89965 [0,1,0,0,1,0|2,0,0]=4 516 B12R1.256 CC(=O)C1=CC=C(B(O)O)C=C1 33014 [0,1,0,0,1,0|2,0,0]=4 517 B12R1.256 CC(=O)C1=CC=C(C(=O)O)C=C1 23087 [0,1,0,0,1,0|2,0,0]=4 518 B12R1.256 CC(=O)C1=CC=C(C(C)=O)C=C1 D80181 [0,1,0,0,1,0|1,0,0]=3 519 B12R1.256 CC(=O)C1=CC=C(C(C)C)C=C1 H11892 [0,1,0,0,1,0|1,0,0]=3 520 B12R1.256 CC(=O)C1=CC=C(N(C)C)C=C1 11984 [0,1,0,0,1,0|1,0,0]=3 521 B12R1.256 CC(=O)C1=CC=C([N+](=O)[O-])C=C1 AC1233 [0,1,0,0,1,0|2,0,0]=4 522 B12R1.256 CC(C)C1=CC=C(C(=O)O)C=C1 CK2213 [0,1,0,0,1,0|2,0,0]=4 523 B12R1.256 CN(C)C1=CC=C(C(=O)Cl)C=C1 60434 [0,1,0,0,1,0|2,0,0]=4 524 B12R1.256 CN(C)C1=CC=C(C(=O)Cl)C=C1 F16172 [0,1,0,0,1,0|2,0,0]=4 525 B12R1.256 CN(C)C1=CC=C(C(=O)O)C=C1 76097 [0,1,0,0,1,0|2,0,0]=4 526 B12R1.256 CN(C)C1=CC=C(C(N)=O)C=C1 25227 [0,1,0,0,1,0|2,0,0]=4 527 B12R1.256 C[C@H](N)C1=CC=C(C(=O)O)C=C1 20156 [0,1,0,0,1,0|2,0,0]=4 528 B12R1.256 C[C@H](N)C1=CC=C(C(=O)O)C=C1 F52737 [0,1,0,0,1,0|2,0,0]=4 529 B12R1.452 COC1=CC(Br)=C(C(=O)O)C=C1 23526 [0,1,0,0,1,0|1,0,0]=3 530 B12R1.452 COC1=CC(Br)=C([N+](=O)[O-])C=C1 CL9100 [0,1,0,0,1,0|2,0,0]=4 531 B12R1.452 COC1=CC(C)=C(C(=O)O)C=C1 CL8052 [0,1,0,0,1,0|1,0,0]=3 532 B12R1.452 COC1=CC(C)=C(C(C)=O)C=C1 D76545 [0,1,0,0,1,0|0,0,0]=2 533 B12R1.452 COC1=CC(C)=C([N+](=O)[O-])C=C1 34537 [0,1,0,0,1,0|2,0,0]=4 534 B12R1.452 COC1=CC(Cl)=C(C(=O)O)C=C1 CL8037 [0,1,0,0,1,0|1,0,0]=3 535 B12R1.452 COC1=CC(F)=C(C(=O)Cl)C=C1 CK2242 [0,1,0,0,1,0|1,0,0]=3 536 B12R1.452 COC1=CC(F)=C(C(=O)O)C=C1 24118 [0,1,0,0,1,0|1,0,0]=3 537 B12R1.452 COC1=CC(F)=C(C(C)=O)C=C1 CL8642 [0,1,0,0,1,0|0,0,0]=2 538 B12R1.452 COC1=CC(F)=C([N+](=O)[O-])C=C1 22547 [0,1,0,0,1,0|2,0,0]=4 539 B12R1.452 COC1=CC(I)=C(C(=O)O)C=C1 25942 [0,1,0,0,1,0|1,0,0]=3 540 B12R1.452 COC1=CC(I)=C([N+](=O)[O-])C=C1 34536 [0,1,0,0,1,0|2,0,0]=4 541 B12R1.452 COC1=CC(N)=C(C(=O)O)C=C1 63803 [0,1,0,0,1,0|1,0,0]=3 542 B12R1.452 COC1=CC(N)=C(C(C)C)C=C1 D82924 [0,1,0,0,1,0|1,0,1]=4 543 B12R1.452 COC1=CC(N)=C([N+](=O)[O-])C=C1 39338 [0,1,0,0,1,0|2,0,0]=4 544 B12R1.452 COC1=CC(O)=C(C(=O)O)C=C1 27008 [0,1,0,0,1,0|1,0,0]=3 545 B12R1.452 COC1=CC(O)=C(C(C)=O)C=C1 38112 [0,1,0,0,1,0|0,0,0]=2 546 B12R1.452 COC1=CC(O)=C(C(N)=O)C=C1 FD10482 [0,1,0,0,1,0|1,0,0]=3 547 B12R1.452 COC1=CC(O)=C([N+](=O)[O-])C=C1 82255 [0,1,0,0,1,0|2,0,0]=4 548 B14R1.2 CCC1=CC=C([C@@H](N)CC(=O)O)C=C1 N12368 [0,1,0,0,0,1|2,0,0]=4 549 B14R1.2 COC1=CC=C([C@@H](N)CC(=O)O)C=C1 63894 [0,1,0,0,0,1|1,0,0]=3 550 B14R1.2 COC1=CC=C([C@@H](N)CC(=O)O)C=C1 63895 [0,1,0,0,0,1|1,0,0]=3 551 B14R1.2 COC1=CC=C([C@@H](N)CC(=O)O)C=C1 63896 [0,1,0,0,0,1|1,0,0]=3 552 B14R1.3 COC1=CC=C(C[C@H](N)C(=O)O)C=C1 23103 [0,1,0,0,0,1|1,0,0]=3 553 B14R1.3 COC1=CC=C(C[C@H](N)C(=O)O)C=C1 64206 [0,1,0,0,0,1|1,0,0]=3 554 B14R1.3 COC1=CC=C(C[C@H](N)C(=O)O)C=C1 I10726 [0,1,0,0,0,1|1,0,0]=3 555 B14R1.3 COC1=CC=C(O[C@@H](C)C(=O)O)C=C1 AR3818 [0,1,0,0,0,1|1,0,0]=3 556 B14R1.5 COC(=O)CCC1=CC=C(OC)C=C1 F52669 [0,1,0,0,0,1|0,0,0]=2 557 B14R1.5 COC(=O)COC1=CC=C(C#N)C=C1 31003 [0,1,0,0,0,1|2,0,0]=4 558 B14R1.5 COC(=O)COC1=CC=C(C=O)C=C1 84731 [0,1,0,0,0,1|2,0,0]=4 559 B14R1.5 COC(=O)\C=C\C1=CC=C(OC)C=C1 W11634 [0,1,0,0,0,1|0,0,1]=3 560 B14R1.103 COC1=CC(F)=C(CCC(=O)O)C=C1 72403 [0,1,0,0,0,1|1,0,0]=3 561 B14R1.142 CCOC1=CC=C(CCC(=O)O)C=C1 F52927 [0,1,0,0,0,1|1,0,0]=3 562 B14R1.419 CC(=O)C1=CC=C(CCC(=O)O)C=C1 D80232 [0,1,0,0,0,1|2,0,0]=4 563 B14R1.419 CC(=O)C1=CC=C(OCC(=O)O)C=C1 D88510 [0,1,0,0,0,1|2,0,0]=4 564 B14R1.419 CC(=O)NCC1=CC=C(B(O)O)C=C1 D81779 [0,1,0,0,0,1|2,0,0]=4 565 B14R1.419 CC(=O)OCC1=CC=C([N+](=O)[O-])C=C1 28068 [0,1,0,0,0,1|2,0,0]=4 566 B14R1.419 CC(C)C1=CC=C(OCC(=O)O)C=C1 D81713 [0,1,0,0,0,1|2,0,0]=4 567 B14R1.3653 COC1=C(Br)C=C(CCC(=O)O)C=C1 F52907 [0,1,0,0,0,1|1,0,0]=3 568 B14R1.3653 COC1=C(Br)C=C(\C=C\C(=O)O)C=C1 71333 [0,1,0,0,0,1|1,0,1]=4 569 B14R1.3653 COC1=C(Cl)C=C(CCC(=O)O)C=C1 F52903 [0,1,0,0,0,1|1,0,0]=3 570 B14R1.3653 COC1=C(O)C=C(\C=C\C(=O)O)C=C1 28603 [0,1,0,0,0,1|1,0,1]=4 571 B14R1.3653 COC1=C(O)C=C(\C=C\C(=O)O)C=C1 D78092 [0,1,0,0,0,1|1,0,1]=4 572 B14R1.24 CCOC1=CC=C(CC(=O)OC)C=C1 AC7901 [0,2,0,0,0,0|0,0,0]=2 573 B14R1.24 COC(=O)CC1=CC=C(NC=O)C=C1 D84563 [0,2,0,0,0,0|1,0,1]=4 574 B14R1.954 CCN[C@@H](C)CC1=CC=C(OC)C=C1 D90500 [0,2,0,0,0,0|1,0,1]=4 575 B14R1.954 CCOC(=O)CC1=CC=C(C#N)C=C1 AB3735 [0,2,0,0,0,0|2,0,0]=4 576 B14R1.954 CCOC(=O)CC1=CC=C(CN)C=C1 76008 [0,2,0,0,0,0|2,0,0]=4 577 B14R1.954 CCOC(=O)CC1=CC=C(OC)C=C1 A50726 [0,2,0,0,0,0|0,0,0]=2 578 B14R1.954 COC1=CC=C(NC(=O)\C=N\O)C=C1 N12447 [0,2,0,0,0,0|1,0,1]=4 579 B14R1.2879 COC(=O)CC1=CC=C(B(O)O)C=C1 W16865 [0,2,0,0,0,0|2,0,0]=4 580 B14R1.2879 COC(=O)CC1=CC=C([N+](=O)[O-])C=C1 AB7569 [0,2,0,0,0,0|2,0,0]=4 581 B14R1.3651 COC1=C(OC)C=C(CC(=O)O)C=C1 22516 [0,2,0,0,0,0|1,0,0]=3 582 B14R1.3651 COC1=C(OC)C=C(CC(C)=O)C=C1 28452 [0,2,0,0,0,0|0,0,0]=2 583 B14R1.3651 COC1=C(OC)C=C(C[C@H](C)O)C=C1 D75342 [0,2,0,0,0,0|0,0,2]=4 584 B14R1.5801 CC(=O)NC1=CC(C)=C(C(C)=O)C=C1 50386 [0,2,0,0,0,0|2,0,0]=4 585 B14R1.8 COC1=CC=C([C@H](CN)N(C)C)C=C1 AR3473 [0,2,0,0,0,0|2,0,0]=4 586 B14R1.717 COC(=O)C1=CC=C(CC(=O)O)C=C1 26251 [0,2,0,0,0,0|1,0,0]=3 587 B14R1.717 COC(=O)C1=CC=C(OC(C)=O)C=C1 D88397 [0,2,0,0,0,0|1,0,0]=3 588 B14R1.805 CC(=O)NC1=CC=C(CC(=O)O)C=C1 AB6003 [0,2,0,0,0,0|2,0,0]=4 589 B14R1.805 CC(=O)NC1=CC=C(NC(C)=O)C=C1 D84616 [0,2,0,0,0,0|2,0,0]=4 590 B14R1.805 CC(=O)NC1=CC=C(OC(C)=O)C=C1 F17539 [0,2,0,0,0,0|1,0,0]=3 591 B14R1.805 CC(=O)NC1=CC=C(OC(F)F)C=C1 H10909 [0,2,0,0,0,0|1,0,0]=3 592 B14R1.805 CC(=O)OC1=CC=C(OC(C)=O)C=C1 D83403 [0,2,0,0,0,0|1,0,0]=3 593 B14R1.805 CC(C)CC1=CC=C(CC(=O)O)C=C1 CL8792 [0,2,0,0,0,0|2,0,0]=4 594 B14R1.805 CN(C)CC1=CC=C(CC(=O)O)C=C1 D80414 [0,2,0,0,0,0|2,0,0]=4 595 B14R1.805 O=C(O)CC1=CC=C(OC(F)F)C=C1 CL9301 [0,2,0,0,0,0|1,0,0]=3 596 B14R1.806 CC(=O)CC1=CC=C(C(F)(F)F)C=C1 CL9159 [0,2,0,0,0,0|2,0,0]=4 597 B14R1.806 CC(=O)NC1=CC=C(C(C)(C)C)C=C1 C10097 [0,2,0,0,0,0|2,0,0]=4 598 B14R1.806 CC(C)(C)C1=CC=C(CC(=O)O)C=C1 56809 [0,2,0,0,0,0|2,0,0]=4 599 B14R1.806 CS(=O)(=O)C1=CC=C(CC(=O)O)C=C1 64115 [0,2,0,0,0,0|1,1,0]=4 600 B14R1.101 COC1=CC(C#N)=C(CC(=O)O)C=C1 CK2079 [0,2,0,0,0,0|1,0,0]=3 601 B14R1.101 COC1=CC(OC)=C(CC(=O)O)C=C1 25035 [0,2,0,0,0,0|1,0,0]=3 602 B14R1.560 COC1=CC(Cl)=C(NC(C)=O)C(Cl)=C1 D81989 [0,2,0,0,0,0|1,0,0]=3 603 B14R1.560 COC1=CC(F)=C(CC(=O)O)C(F)=C1 CL8751 [0,2,0,0,0,0|1,0,0]=3 604 B12R1.453 COC1=CC(C(C)=O)=C(Br)C=C1 F20521 [0,0,1,1,0,0|1,0,1]=4 605 B12R1.453 COC1=CC(C(C)=O)=C(F)C=C1 85237 [0,0,1,1,0,0|1,0,1]=4 606 B12R1.453 COC1=CC(C(C)=O)=C(O)C=C1 F30218 [0,0,1,1,0,0|1,0,1]=4 607 B12R2.606 CC1=CC2=C(C=C(O)C=C2)N1 62420 [1,0,0,1,0,0|1,0,1]=4 608 B12R2.606 CC1=CC2=C(C=C1)C=C(C)N2 36286 [1,0,0,1,0,0|1,0,1]=4 609 B12R2.606 CC1=CC2=C(C=C1)CC(=O)N2 35613 [1,0,0,1,0,0|1,0,0]=3 610 B12R2.606 CC1=CC2=C(C=C1)NC(=O)C2 83183 [1,0,0,1,0,0|1,0,0]=3 611 B12R2.606 CC1=CC2=C(C=C1)NC(=O)N2 F14739 [1,0,0,1,0,0|2,0,0]=4 612 B12R2.606 CC1=CC2=C(C=C1)NC(C)=C2 60590 [1,0,0,1,0,0|2,0,0]=4 613 B12R2.606 CC1=CC2=C(C=C1)NC(C)=N2 C15122 [1,0,0,1,0,0|2,0,0]=4 614 B12R2.606 CC1=CC2=C(C=C1)OC(C)=N2 F14942 [1,0,0,1,0,0|2,0,0]=4 615 B12R2.606 CC1=CC2=C(C=C1)SC(C)=N2 D73290 [1,0,0,1,0,0|2,0,0]=4 616 B12R2.606 CC1=CC2=C(C=CC(O)=C2)N1 33558 [1,0,0,1,0,0|2,0,0]=4 617 B12R2.606 CC1=NC2=C(C=C(O)C=C2)O1 W17196 [1,0,0,1,0,0|1,0,1]=4 618 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 25815 [1,0,0,1,0,0|2,0,0]=4 619 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 37209 [1,0,0,1,0,0|2,0,0]=4 620 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 87806 [1,0,0,1,0,0|2,0,0]=4 621 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)N1 68032 [1,0,0,1,0,0|2,0,0]=4 622 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)C1 53585 [1,0,0,1,0,0|1,0,0]=3 623 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)N1 23032 [1,0,0,1,0,0|2,0,0]=4 624 B12R2.606 O=C1CC2=C(C=C(F)C=C2)N1 33629 [1,0,0,1,0,0|2,0,0]=4 625 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 21706 [1,0,0,1,0,0|2,0,0]=4 626 B12R2.606 O=C1CC2=C(C=CC(Cl)=C2)N1 58042 [1,0,0,1,0,0|2,0,0]=4 627 B12R2.606 O=C1CC2=C(C=CC(F)=C2)N1 61060 [1,0,0,1,0,0|2,0,0]=4 628 B12R2.606 O=C1CC2=C(C=CC(I)=C2)N1 12836 [1,0,0,1,0,0|2,0,0]=4 629 B12R2.606 O=C1CC2=C(C=CC(O)=C2)N1 50045 [1,0,0,1,0,0|1,0,0]=3 630 B12R2.606 O=C1CC2=C(C=CC(O)=C2)O1 TD8103 [1,0,0,1,0,0|1,0,0]=3 631 B12R2.44 COC1=CC2=C(C=C1)CCN2 F11865 [1,0,0,1,0,0|1,0,1]=4 632 B12R2.44 COC1=CC2=C(C=C1)CNC2 64066 [1,0,0,1,0,0|1,0,0]=3 633 B12R2.44 COC1=CC2=C(C=C1)N=CS2 24867 [1,0,0,1,0,0|1,1,0]=4 634 B12R2.44 COC1=CC2=C(C=C1)NC=C2 29335 [1,0,0,1,0,0|1,0,1]=4 635 B12R2.44 COC1=CC2=C(C=C1)NC=N2 F17318 [1,0,0,1,0,0|2,0,0]=4 636 B12R2.44 COC1=CC2=C(C=C1)NCC2 23816 [1,0,0,1,0,0|1,0,1]=4 637 B12R2.44 COC1=CC2=C(C=C1)NCC2 29213 [1,0,0,1,0,0|1,0,1]=4 638 B12R2.44 COC1=CC2=C(C=C1)SC=N2 O11467 [1,0,0,1,0,0|2,0,0]=4 639 B12R2.44 COC1=CC2=C(C=CN2)C=C1 29336 [1,0,0,1,0,0|1,0,1]=4 640 B12R2.44 COC1=CC2=C(C=CO2)C=C1 F10222 [1,0,0,1,0,0|0,0,2]=4 641 B12R2.44 COC1=CC2=C(C=CS2)C=C1 82369 [1,0,0,1,0,0|0,1,1]=4 642 B14R2.134 COC1=CC2=C(C=C1)CCC(=O)C2 27006 [0,0,0,1,0,1|0,0,0]=2 643 B14R2.134 COC1=CC2=C(C=C1)CCC(=O)N2 25936 [0,0,0,1,0,1|1,0,0]=3 644 B14R2.134 COC1=CC2=C(C=CC(=O)O2)C=C1 84574 [0,0,0,1,0,1|1,0,1]=4 645 B14R2.134 COC1=CC2=CC(C)=NC=C2C=C1 76373 [0,0,0,1,0,1|1,0,1]=4 646 B14R2.2332 COC1=CC2=C(C=C1)CC(=O)CC2 36691 [0,1,0,1,0,0|0,0,0]=2 647 B14R2.2332 COC1=CC2=C(C=C1)NC(=O)CC2 61018 [0,1,0,1,0,0|1,0,0]=3 648 B14R2.2332 COC1=CC2=C(C=C1)NC(=O)CS2 64792 [0,1,0,1,0,0|1,0,0]=3 649 B14R2.2332 COC1=CC2=CC=C(C)N=C2C=C1 F17645 [0,1,0,1,0,0|2,0,0]=4 650 B14R2.3274 COC1=CC2=C(C=C1)NC(=O)C2=O CL3515 [0,1,0,1,0,0|1,0,1]=4 651 B14R2.3304 COC1=CC2=C(C=C1)NC(C=O)=C2 P16431 [0,1,0,1,0,0|1,0,1]=4 652 B14R2.3304 COC1=CC2=C(C=C1)NC(CO)=C2 64236 [0,1,0,1,0,0|2,0,0]=4 653 B14R2.3304 COC1=CC2=C(C=C1)NC(CO)=N2 70968 [0,1,0,1,0,0|2,0,0]=4 654 B14R2.1008 CC(=O)OC1=CC2=C(C=C1)OCO2 D83607 [0,1,0,1,0,0|1,0,0]=3 655 B14R2.1008 NC(=O)CC1=CC2=C(C=C1)OCO2 D86622 [0,1,0,1,0,0|1,0,0]=3 656 B14R2.1008 O=C(Cl)OC1=CC2=C(C=C1)OCO2 D80374 [0,1,0,1,0,0|2,0,0]=4 657 B14R2.1008 O=C(O)CC1=CC2=C(C=C1)OC=C2 N12392 [0,1,0,1,0,0|1,0,1]=4 658 B14R2.1008 O=C(O)CC1=CC2=C(C=C1)OCC2 F10315 [0,1,0,1,0,0|1,0,0]=3 659 B14R2.1008 O=C(O)CC1=CC2=C(C=C1)OCO2 53670 [0,1,0,1,0,0|1,0,0]=3 660 B14R2.1815 COC1=CC2=C(C=C1)C(=O)C(=O)N2 24575 [0,1,0,1,0,0|1,0,1]=4 661 B14R2.601 O=C1CC2=C(C=C([N+](=O)[O-])C=C2)C1 64652 [0,1,0,1,0,0|2,0,0]=4 662 B10R1.13 C=C(C)C1=CC=C(C)C=C1 F17145 [1,0,0,0,1,0|1,0,0]=3 663 B10R1.13 C=C(C)C1=CC=C(Cl)C=C1 D89216 [1,0,0,0,1,0|2,0,0]=4 664 B10R1.13 C=C(C)C1=CC=C(F)C=C1 CK2305 [1,0,0,0,1,0|2,0,0]=4 665 B10R1.13 C=C(C)C1=CC=C(O)C=C1 A11171 [1,0,0,0,1,0|1,0,0]=3 666 B10R1.13 CC(=O)C1=CC=C(C)C=C1 D70502 [1,0,0,0,1,0|0,0,0]=2 667 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 N10056 [1,0,0,0,1,0|1,0,0]=3 668 B10R1.13 CC(=O)C1=CC=C(F)C=C1 D70558 [1,0,0,0,1,0|1,0,0]=3 669 B10R1.13 CC(=O)C1=CC=C(I)C=C1 34152 [1,0,0,0,1,0|1,0,0]=3 670 B10R1.13 CC(=O)C1=CC=C(N)C=C1 D88235 [1,0,0,0,1,0|1,0,0]=3 671 B10R1.13 CC(=O)C1=CC=C(N)C=C1 F11286 [1,0,0,0,1,0|1,0,0]=3 672 B10R1.13 CC(=O)C1=CC=C(O)C=C1 44466 [1,0,0,0,1,0|0,0,0]=2 673 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 34646 [1,0,0,0,1,0|2,0,0]=4 674 B10R1.13 CC(=O)C1=CN=C(C)C=C1 24573 [1,0,0,0,1,0|1,0,0]=3 675 B10R1.13 CC(=O)C1=CN=C(Cl)C=C1 57255 [1,0,0,0,1,0|2,0,0]=4 676 B10R1.13 CC(=O)C1=CN=C(F)C=C1 26492 [1,0,0,0,1,0|2,0,0]=4 677 B10R1.13 CC(=O)C1=CN=C(N)C=C1 AB8078 [1,0,0,0,1,0|2,0,0]=4 678 B10R1.13 CC(=O)C1=CN=C(O)C=C1 36014 [1,0,0,0,1,0|1,0,0]=3 679 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 56961 [1,0,0,0,1,0|2,0,0]=4 680 B10R1.13 CC(=O)C1=NC=C(C)C=C1 AB1019 [1,0,0,0,1,0|1,0,0]=3 681 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 80291 [1,0,0,0,1,0|2,0,0]=4 682 B10R1.13 CC(=O)C1=NC=C(F)C=C1 D82396 [1,0,0,0,1,0|2,0,0]=4 683 B10R1.13 CC1=CC=C(C(=N)N)C=C1 F11800 [1,0,0,0,1,0|2,0,0]=4 684 B10R1.13 CC1=CC=C(C(=O)O)C=C1 D70680 [1,0,0,0,1,0|1,0,0]=3 685 B10R1.13 CC1=CC=C(C(C)C)C=C1 78207 [1,0,0,0,1,0|1,0,1]=4 686 B10R1.13 CC1=CC=C(C(N)=O)C=C1 35410 [1,0,0,0,1,0|1,0,0]=3 687 B10R1.13 CC1=CC=C(C(N)=S)C=C1 H10917 [1,0,0,0,1,0|1,1,0]=4 688 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 30869 [1,0,0,0,1,0|1,0,1]=4 689 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 60067 [1,0,0,0,1,0|1,0,1]=4 690 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 F16888 [1,0,0,0,1,0|1,0,1]=4 691 B10R1.13 CC1=CC=C([C@H](C)O)C=C1 AC1243 [1,0,0,0,1,0|0,0,2]=4 692 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 97007 [1,0,0,0,1,0|2,0,0]=4 693 B10R1.13 CC1=CC=C([S@](=O)[O-])C=C1 AC8095 [1,0,0,0,1,0|2,0,0]=4 694 B10R1.13 CC1=CC=C([S@](=O)[O-])C=C1 D80624 [1,0,0,0,1,0|2,0,0]=4 695 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 95016 [1,0,0,0,1,0|1,0,0]=3 696 B10R1.13 CC1=CN=C(C(=O)O)C=C1 23515 [1,0,0,0,1,0|2,0,0]=4 697 B10R1.13 CC1=CN=C(C(=O)O)C=C1 C13862 [1,0,0,0,1,0|2,0,0]=4 698 B10R1.13 CC1=NC=C(C(=O)O)C=C1 78731 [1,0,0,0,1,0|2,0,0]=4 699 B10R1.13 CC1=NC=C(C(N)=O)C=C1 AB2935 [1,0,0,0,1,0|2,0,0]=4 700 B10R1.13 CN(C)C1=CC=C(O)C=C1 24476 [1,0,0,0,1,0|2,0,0]=4 701 B10R1.13 CN(C)C1=CC=C(O)C=C1 36466 [1,0,0,0,1,0|2,0,0]=4 702 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 74901 [1,0,0,0,1,0|1,0,1]=4 703 B10R1.13 C[S@](=O)C1=CC=C(Br)C=C1 A12944 [1,0,0,0,1,0|2,0,0]=4 704 B10R1.13 C[S@](=O)C1=CC=C(F)C=C1 W16289 [1,0,0,0,1,0|2,0,0]=4 705 B10R1.13 N=C(N)C1=CC=C(O)C=C1 28469 [1,0,0,0,1,0|2,0,0]=4 706 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 F10314 [1,0,0,0,1,0|2,0,0]=4 707 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 78552 [1,0,0,0,1,0|2,0,0]=4 708 B10R1.13 NC(=O)C1=CC=C(F)C=C1 W18647 [1,0,0,0,1,0|2,0,0]=4 709 B10R1.13 NC(=O)C1=CC=C(I)C=C1 D94716 [1,0,0,0,1,0|2,0,0]=4 710 B10R1.13 NC(=O)C1=CC=C(N)C=C1 26019 [1,0,0,0,1,0|2,0,0]=4 711 B10R1.13 NC(=O)C1=CC=C(O)C=C1 D90813 [1,0,0,0,1,0|1,0,0]=3 712 B10R1.13 NC(=O)C1=NC=C(O)C=C1 P11310 [1,0,0,0,1,0|2,0,0]=4 713 B10R1.13 NC(=S)C1=CC=C(O)C=C1 33351 [1,0,0,0,1,0|1,1,0]=4 714 B10R1.13 NC1=CC=C(C(=O)O)C=C1 20052 [1,0,0,0,1,0|2,0,0]=4 715 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 O12079 [1,0,0,0,1,0|2,0,0]=4 716 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 CK1093 [1,0,0,0,1,0|2,0,0]=4 717 B10R1.13 O=C(Cl)C1=CC=C(I)C=C1 35169 [1,0,0,0,1,0|2,0,0]=4 718 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 AB10302 [1,0,0,0,1,0|2,0,0]=4 719 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 D77513 [1,0,0,0,1,0|2,0,0]=4 720 B10R1.13 O=C(O)C1=CC=C(F)C=C1 D70922 [1,0,0,0,1,0|2,0,0]=4 721 B10R1.13 O=C(O)C1=CC=C(I)C=C1 D70923 [1,0,0,0,1,0|2,0,0]=4 722 B10R1.13 O=C(O)C1=CC=C(O)C=C1 D86505 [1,0,0,0,1,0|1,0,0]=3 723 B10R1.13 O=C(O)C1=CC=C(S)C=C1 22131 [1,0,0,0,1,0|1,1,0]=4 724 B10R1.13 O=C(O)C1=CN=C(O)C=C1 CX1100 [1,0,0,0,1,0|2,0,0]=4 725 B10R1.13 O=C(O)C1=NC=C(O)C=C1 32448 [1,0,0,0,1,0|2,0,0]=4 726 B10R1.13 O=C(O)C1=NC=C(O)C=C1 CX1286 [1,0,0,0,1,0|2,0,0]=4 727 B10R1.13 O=C(O)C1=NC=C(O)C=C1 W10240 [1,0,0,0,1,0|2,0,0]=4 728 B10R1.13 O=C([O-])C1=CC=C(F)C=C1 D83108 [1,0,0,0,1,0|2,0,0]=4 729 B10R1.13 O=C([O-])C1=CC=C(O)C=C1 D71249 [1,0,0,0,1,0|1,0,0]=3 730 B12R1.21 CC(=O)CCC1=CC=C(C)C=C1 32309 [1,0,0,0,0,1|0,0,0]=2 731 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 D70581 [1,0,0,0,0,1|0,0,0]=2 732 B12R1.21 CC(=O)CSC1=CC=C(F)C=C1 73930 [1,0,0,0,0,1|1,0,0]=3 733 B12R1.21 CC(=O)NCC1=CC=C(Br)C=C1 C78568 [1,0,0,0,0,1|1,0,0]=3 734 B12R1.21 CC(=O)NNC1=CC=C(Br)C=C1 D83902 [1,0,0,0,0,1|2,0,0]=4 735 B12R1.21 CC(=O)OCC1=CC=C(C)C=C1 D97438 [1,0,0,0,0,1|0,0,0]=2 736 B12R1.21 CC(=O)OCC1=CC=C(Cl)C=C1 C10410 [1,0,0,0,0,1|1,0,0]=3 737 B12R1.21 CC(=O)\C=C\C1=CC=C(O)C=C1 C11421 [1,0,0,0,0,1|0,0,1]=3 738 B12R1.21 CC1=CC=C(CCC(=O)O)C=C1 76168 [1,0,0,0,0,1|1,0,0]=3 739 B12R1.21 CC1=CC=C(OCC(=O)O)C=C1 A50584 [1,0,0,0,0,1|1,0,0]=3 740 B12R1.21 CC1=CC=C(SCC(=O)O)C=C1 71044 [1,0,0,0,0,1|1,0,0]=3 741 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 AC7520 [1,0,0,0,0,1|1,0,1]=4 742 B12R1.21 CN(C)CCC1=CC=C(O)C=C1 40371 [1,0,0,0,0,1|2,0,0]=4 743 B12R1.21 CN(C)CCC1=CC=C(O)C=C1 A10202 [1,0,0,0,0,1|2,0,0]=4 744 B12R1.21 C[C@H](O)CCC1=CC=C(O)C=C1 T72839 [1,0,0,0,0,1|0,0,2]=4 745 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 35369 [1,0,0,0,0,1|2,0,0]=4 746 B12R1.21 NC1=CC=C(OCC(=O)O)C=C1 68781 [1,0,0,0,0,1|2,0,0]=4 747 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 AB3203 [1,0,0,0,0,1|2,0,0]=4 748 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 33552 [1,0,0,0,0,1|2,0,0]=4 749 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 AB7295 [1,0,0,0,0,1|2,0,0]=4 750 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 35011 [1,0,0,0,0,1|2,0,0]=4 751 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 AT13193 [1,0,0,0,0,1|1,0,0]=3 752 B12R1.21 O=C(O)CNC1=CC=C(F)C=C1 CS1182 [1,0,0,0,0,1|2,0,0]=4 753 B12R1.21 O=C(O)COC1=CC=C(Br)C=C1 A50579 [1,0,0,0,0,1|2,0,0]=4 754 B12R1.21 O=C(O)COC1=CC=C(Cl)C=C1 A50588 [1,0,0,0,0,1|2,0,0]=4 755 B12R1.21 O=C(O)COC1=CC=C(F)C=C1 A50587 [1,0,0,0,0,1|2,0,0]=4 756 B12R1.21 O=C(O)COC1=CC=C(I)C=C1 78056 [1,0,0,0,0,1|2,0,0]=4 757 B12R1.21 O=C(O)COC1=CC=C(O)C=C1 AT23403 [1,0,0,0,0,1|1,0,0]=3 758 B12R1.21 O=C(O)CSC1=CC=C(Cl)C=C1 W11890 [1,0,0,0,0,1|2,0,0]=4 759 B12R1.21 O=C(O)CSC1=CC=C(F)C=C1 75256 [1,0,0,0,0,1|2,0,0]=4 760 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 AC7957 [1,0,0,0,0,1|1,0,1]=4 761 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 CK2547 [1,0,0,0,0,1|1,0,1]=4 762 B12R1.438 COC1=CC=CC(CC(=O)Cl)=C1 D97427 [0,0,0,0,1,1|1,0,0]=3 763 B12R1.438 COC1=CC=CC(CC(=O)O)=C1 CK2074 [0,0,0,0,1,1|1,0,0]=3 764 B12R1.438 COC1=CC=CC(CC(C)=O)=C1 34187 [0,0,0,0,1,1|0,0,0]=2 765 B12R1.438 COC1=CC=CC(NC(C)=O)=C1 64241 [0,0,0,0,1,1|1,0,0]=3 766 B14R1.4 CCC1=CC=C(CCCC(=O)O)C=C1 N12226 [0,0,0,0,0,2|2,0,0]=4 767 B14R1.4 COC1=CC=C(CCCC(=O)O)C=C1 28341 [0,0,0,0,0,2|1,0,0]=3 768 B14R1.4 COC1=CC=C(COCC(=O)O)C=C1 F21242 [0,0,0,0,0,2|1,0,0]=3 769 B14R1.4 COC1=CC=C(OCCC(=O)O)C=C1 84087 [0,0,0,0,0,2|1,0,0]=3