0 B13R1.547 COC(=O)C1=C(B(O)O)C=CC=C1 CJ2411 [0,0,0,0,0,0|3,0,0]=3 1 B12R1.77 COC(=O)C1=C(CO)C=CC=C1 LX2827 [1,0,0,0,0,0|2,0,0]=3 2 B12R1.77 COC(=O)C1=CC=CC=C1C=O XJ2640 [1,0,0,0,0,0|2,0,0]=3 3 B12R1.77 COC(=O)C1=CC=CC=C1CBr JZ2022 [1,0,0,0,0,0|2,0,0]=3 4 B12R1.77 COC(=O)C1=NC=CC=C1C=O LL2134 [1,0,0,0,0,0|3,0,0]=4 5 B12R1.77 COC1=CC=CC=C1C(=O)CBr LT0285 [1,0,0,0,0,0|3,0,0]=4 6 B12R1.77 COC1=CC=CC=C1C(=O)NN XJ3327 [1,0,0,0,0,0|3,0,0]=4 7 B12R1.261 CC(C)C1=CC=CC=C1C(C)C JZ5679 [1,0,0,0,0,0|2,0,1]=4 8 B12R1.261 CC(C)C1=CC=CC=C1[N+](=O)[O-] XJ3155 [1,0,0,0,0,0|2,0,1]=4 9 B12R1.261 NC(=O)C1=CC=CC=C1C(=O)O LL0181 [1,0,0,0,0,0|3,0,0]=4 10 B12R1.261 O=C(O)C1=C(I(=O)=O)C=CC=C1 YH11720 [1,0,0,0,0,0|3,0,0]=4 11 B12R1.261 O=C(O)C1=CC=CC=C1B(O)O LL2271 [1,0,0,0,0,0|3,0,0]=4 12 B12R1.261 O=C([O-])C1=CC=CC=C1C(=O)O HL0475 [1,0,0,0,0,0|3,0,0]=4 13 B12R1.261 O=C([O-])C1=CC=CC=C1C(=O)O XJ6408 [1,0,0,0,0,0|3,0,0]=4 14 B14R1.623 CCOC(=O)C1=CC=CC=C1C(=O)O RT11586 [0,1,0,0,0,0|3,0,0]=4 15 B14R1.623 CCOC(=O)C1=CC=CC=C1[N+](=O)[O-] XJ1099 [0,1,0,0,0,0|2,0,1]=4 16 B14R1.707 COC(=O)C1=C([N+](=O)[O-])C=CC(Cl)=C1 LT5542 [0,1,0,0,0,0|2,0,1]=4 17 B14R1.746 COC(=O)C1=CC=CC=C1C(=O)OC RT12330 [0,1,0,0,0,0|2,0,0]=3 18 B14R1.1153 COC(=O)C1=C([N+](=O)[O-])C(C)=CC=C1 LQ2934 [0,1,0,0,0,0|2,0,1]=4 19 B14R1.1153 COC(=O)C1=CC=CC(F)=C1[N+](=O)[O-] YH28641 [0,1,0,0,0,0|2,0,1]=4 20 B14R2.29285 CC1(C)CCC(=O)C2=CC=CC=C21 CJ2866 [0,0,0,1,0,0|2,0,0]=3 21 B14R1.3302 COC(=O)CC1=CC=CC=C1[N+](=O)[O-] CJ3186 [0,0,0,0,0,1|2,0,1]=4 22 B11R1.53 C#CC1=C(C(=O)O)C=CC=C1 YH55244 [2,0,0,0,0,0|1,0,1]=4 23 B11R1.53 CC(C)C1=CC=CC=C1OO XJ0107 [2,0,0,0,0,0|2,0,0]=4 24 B11R1.53 CNC1=CC=CC=C1C(=O)O LQ0517 [2,0,0,0,0,0|0,0,0]=2 25 B11R1.53 CNC1=CC=CC=C1[N+](=O)[O-] HL0141 [2,0,0,0,0,0|1,0,1]=4 26 B11R1.53 CNC1=NC=CC=C1C(=O)O XJ5069 [2,0,0,0,0,0|1,0,0]=3 27 B11R1.53 COC1=C(C(=O)O)C=CC=C1 XJ0973 [2,0,0,0,0,0|1,0,0]=3 28 B11R1.53 COC1=C(C(=O)O)C=CN=C1 YH12258 [2,0,0,0,0,0|2,0,0]=4 29 B11R1.53 COC1=CC=CC=C1C(N)=O LT1774 [2,0,0,0,0,0|2,0,0]=4 30 B11R1.53 COC1=NC=CC=C1C(=O)O JZ0743 [2,0,0,0,0,0|2,0,0]=4 31 B11R1.53 NNC1=CC=CC=C1C(=O)O JZ0801 [2,0,0,0,0,0|1,0,0]=3 32 B11R1.53 O=C(O)C1=CC=CC=C1CBr HL4661 [2,0,0,0,0,0|2,0,0]=4 33 B11R1.53 O=C(O)C1=CC=CC=C1CBr YH15164 [2,0,0,0,0,0|2,0,0]=4 34 B11R1.53 O=C(O)C1=CC=CC=C1CCl HL4793 [2,0,0,0,0,0|2,0,0]=4 35 B11R1.222 CCC(=O)C1=CC=CC=C1F XJ0760 [2,0,0,0,0,0|2,0,0]=4 36 B11R1.222 CNC(=O)C1=CC=CC=C1N HL2654 [2,0,0,0,0,0|1,0,0]=3 37 B11R1.222 COC(=O)C1=C(Br)C=CC=N1 YH05902 [2,0,0,0,0,0|2,0,0]=4 38 B11R1.222 COC(=O)C1=C(C)C=CC=C1 LT7460 [2,0,0,0,0,0|0,0,0]=2 39 B11R1.222 COC(=O)C1=C(I)C=CC=C1 LT1761 [2,0,0,0,0,0|1,0,0]=3 40 B11R1.222 COC(=O)C1=C(I)C=NC=C1 YH42716 [2,0,0,0,0,0|2,0,0]=4 41 B11R1.222 COC(=O)C1=C(N)C=NC=C1 HL4261 [2,0,0,0,0,0|1,0,0]=3 42 B11R1.222 COC(=O)C1=C(N)N=CC=N1 LT5963 [2,0,0,0,0,0|2,0,0]=4 43 B11R1.222 COC(=O)C1=C(O)C=CN=C1 YH13199 [2,0,0,0,0,0|2,0,0]=4 44 B11R1.222 COC(=O)C1=CC=CC=C1O JZ3307 [2,0,0,0,0,0|1,0,0]=3 45 B11R1.222 COC(=O)C1=CC=CN=C1C XJ6093 [2,0,0,0,0,0|1,0,0]=3 46 B11R1.222 COC(=O)C1=CC=CN=C1F XJ0762 [2,0,0,0,0,0|2,0,0]=4 47 B11R1.222 COC(=O)C1=CC=CN=C1N LQ3812 [2,0,0,0,0,0|1,0,0]=3 48 B11R1.222 COC(=O)C1=CN=CN=C1C HL3598 [2,0,0,0,0,0|2,0,0]=4 49 B11R1.222 COC(=O)C1=NC=CC=C1C YH09125 [2,0,0,0,0,0|1,0,0]=3 50 B11R1.222 COC(=O)C1=NC=CC=C1O XJ5981 [2,0,0,0,0,0|2,0,0]=4 51 B11R1.222 [2H]OC(=O)C1=CC=CC=C1Cl RT12698 [2,0,0,0,0,0|2,0,0]=4 52 B13R1.382 CCOC1=CC=CC=C1C(=O)OC XJ2557 [1,1,0,0,0,0|1,0,0]=3 53 B13R1.382 COC(=O)C1=C(CC#N)C=CC=C1 LT1719 [1,1,0,0,0,0|1,0,1]=4 54 B13R1.382 COC(=O)C1=CC=CC=C1N=C=O XJ1940 [1,1,0,0,0,0|0,0,2]=4 55 B13R1.464 CCOC(=O)C1=CC=CC=C1CCl YH36514 [1,1,0,0,0,0|2,0,0]=4 56 B13R1.2065 COC(=O)C1=CC=C(Br)C=C1C#N CJ3306 [1,1,0,0,0,0|2,0,0]=4 57 B13R1.2065 COC(=O)C1=CC=C(N)C=C1OC YH51352 [1,1,0,0,0,0|1,0,0]=3 58 B13R1.2065 COC(=O)C1=CC=C(O)C=C1OC YH65166 [1,1,0,0,0,0|1,0,0]=3 59 B13R1.2209 COC(=O)C1=C(SC)C=CC(Br)=C1 YH96243 [1,1,0,0,0,0|1,0,0]=3 60 B13R1.2209 COC(=O)C1=CC(Cl)=CC=C1OC LT5190 [1,1,0,0,0,0|1,0,0]=3 61 B13R1.349 CC(C)(C)C1=CC=CC=C1C(=O)O YH23928 [1,1,0,0,0,0|1,0,0]=3 62 B15R1.810 CCOC(=O)C1=CC=CC=C1OC(C)=O LQ0980 [0,1,0,0,0,1|2,0,0]=4 63 B15R1.925 COC(=O)C1=C(NC(C)=O)C=CC(Br)=C1 HL3491 [0,1,0,0,0,1|2,0,0]=4 64 B15R1.925 COC(=O)C1=C(NC(C)=O)C=CC(Cl)=C1 JZ5447 [0,1,0,0,0,1|2,0,0]=4 65 B15R1.38521 COC(=O)C1=C(C(=O)OC)C=C(F)C=C1 LL1877 [0,2,0,0,0,0|2,0,0]=4 66 B15R1.38521 COC(=O)C1=CC=C(O)C=C1C(=O)OC XJ4716 [0,2,0,0,0,0|2,0,0]=4 67 B15R1.38509 COC(=O)C1=CC=CC(N)=C1C(=O)OC YH56557 [0,2,0,0,0,0|2,0,0]=4 68 B13R2.32 CC1CCC2=C(C=CC=C2)C1=O XJ1811 [1,0,0,1,0,0|2,0,0]=4 69 B13R2.5252 O=C1CCCCC2=CC=CC=C12 JZ4201 [1,0,0,1,0,0|2,0,0]=4 70 B13R2.5252 O=C1CCCNC2=C1C=CC=C2 HL0698 [1,0,0,1,0,0|1,0,0]=3 71 B15R2.19309 COC(=O)C1=C2C=N(C)NC2=CC=C1 YH23629 [0,0,0,1,0,1|1,0,1]=4 72 B15R2.19309 COC(=O)C1=C2NC(=O)CC2=CC=C1 YH58121 [0,0,0,1,0,1|2,0,0]=4 73 B15R2.23388 COC(=O)C1CC(=O)C2=C1C=CC=C2 CJ2863 [0,0,0,1,0,1|2,0,0]=4 74 B15R2.7494 CC1(C)CCC(=O)C2=C1C=CC(Br)=C2 CJ2807 [0,1,0,1,0,0|2,0,0]=4