0 B12R2.32 BrCC1=NC2=C(C=CC=C2)O1 B48072 [0,0,0,0,0,0|2,0,1]=3 1 B12R2.32 CCC1=CC2=C(C=CC=C2)N1 E52501 [0,0,0,0,0,0|2,0,1]=3 2 B12R2.32 CCC1=NC2=C(C=CC=C2)N1 E37955 [0,0,0,0,0,0|3,0,1]=4 3 B12R2.32 CCC1=NC2=C(C=CC=C2)O1 E51753 [0,0,0,0,0,0|2,0,1]=3 4 B12R2.32 CCC1=NC2=C(C=CC=N2)O1 E48800 [0,0,0,0,0,0|3,0,1]=4 5 B12R2.32 CNC1=NC2=C(C=CC=C2)N1 M49208 [0,0,0,0,0,0|4,0,0]=4 6 B12R2.32 CSC1=NC2=C(C=CC=C2)O1 M48556 [0,0,0,0,0,0|3,0,0]=3 7 B12R2.32 CSC1=NC2=C(C=CC=C2)S1 M69659 [0,0,0,0,0,0|3,1,0]=4 8 B12R2.32 CSC1=NC2=C(C=CC=N2)O1 M45265 [0,0,0,0,0,0|4,0,0]=4 9 B12R2.32 ClCC1=CN2C=CC=CC2=N1 C3371 [0,0,0,0,0,0|3,0,1]=4 10 B12R2.32 ClCC1=NC2=C(C=CC=C2)N1 C48331 [0,0,0,0,0,0|3,0,1]=4 11 B12R2.32 ClCC1=NC2=C(C=CC=C2)O1 C48088 [0,0,0,0,0,0|2,0,1]=3 12 B12R2.32 ClCC1=NC2=C(C=CC=C2)S1 C47967 [0,0,0,0,0,0|2,1,1]=4 13 B12R2.32 N#CC1=CC2=C(C=CC=C2)N1 K50792 [0,0,0,0,0,0|2,0,1]=3 14 B12R2.32 N#CC1=CC2=C(C=CC=C2)O1 B50747 [0,0,0,0,0,0|1,0,1]=2 15 B12R2.32 N#CC1=CC2=C(C=CC=C2)S1 B50760 [0,0,0,0,0,0|1,1,1]=3 16 B12R2.32 NCC1=CC2=C(C=CC=C2)N1 K22314 [0,0,0,0,0,0|2,0,1]=3 17 B12R2.32 NCC1=CC2=CC=CN=C2N1 P27892 [0,0,0,0,0,0|3,0,1]=4 18 B12R2.32 NCC1=CN2C=CC=CC2=N1 K49626 [0,0,0,0,0,0|3,0,1]=4 19 B12R2.32 NCC1=NC2=C(C=CC=C2)N1 B49625 [0,0,0,0,0,0|3,0,1]=4 20 B12R2.32 NCC1=NC2=C(C=CC=C2)N1 B49689 [0,0,0,0,0,0|3,0,1]=4 21 B12R2.32 NCC1=NC2=C(C=CC=C2)N1 B9950 [0,0,0,0,0,0|3,0,1]=4 22 B12R2.32 NNC1=NC2=C(C=CC=C2)N1 H46066 [0,0,0,0,0,0|4,0,0]=4 23 B12R2.32 O=CC1=CC2=C(C=CC=C2)N1 I38005 [0,0,0,0,0,0|1,0,0]=1 24 B12R2.32 O=CC1=CC2=C(C=CC=C2)O1 B50964 [0,0,0,0,0,0|0,0,0]=0 25 B12R2.32 O=CC1=CC2=C(C=CC=C2)S1 B37929 [0,0,0,0,0,0|0,1,0]=1 26 B12R2.32 O=CC1=CC2=C(C=CC=N2)O1 F10728 [0,0,0,0,0,0|1,0,0]=1 27 B12R2.32 O=CC1=CC2=C(C=CN=C2)N1 P24641 [0,0,0,0,0,0|2,0,0]=2 28 B12R2.32 O=CC1=CC2=C(N=CC=C2)N1 P1530 [0,0,0,0,0,0|2,0,0]=2 29 B12R2.32 O=CC1=CC2=CC=CN=C2S1 T47760 [0,0,0,0,0,0|1,1,0]=2 30 B12R2.32 O=CC1=NC2=C(C=CC=C2)N1 B23090 [0,0,0,0,0,0|2,0,0]=2 31 B12R2.32 O=CC1=NC2=C(C=CC=C2)S1 B9216 [0,0,0,0,0,0|1,1,0]=2 32 B12R2.32 O=CC1=NN2C=CC=CC2=N1 T44871 [0,0,0,0,0,0|3,0,0]=3 33 B12R2.32 OCC1=CC2=C(C=CC=C2)N1 M9932 [0,0,0,0,0,0|1,0,2]=3 34 B12R2.32 OCC1=CC2=C(C=CC=C2)S1 B51662 [0,0,0,0,0,0|0,1,2]=3 35 B12R2.32 OCC1=CN2C=CC=CC2=N1 I5665 [0,0,0,0,0,0|2,0,2]=4 36 B12R2.32 OCC1=NC2=C(C=CC=C2)N1 B28661 [0,0,0,0,0,0|2,0,2]=4 37 B12R2.32 OCC1=NC2=C(C=CC=C2)O1 B48459 [0,0,0,0,0,0|1,0,2]=3 38 B12R2.32 OCC1=NC2=C(C=CC=C2)S1 B69048 [0,0,0,0,0,0|1,1,2]=4 39 B12R2.32 OC[C@H]1CC2=C(C=CC=C2)O1 D49898 [0,0,0,0,0,0|0,0,4]=4 40 B11R2.10 BrC1=CC2=C(C=CC=C2)C1 B51041 [1,0,0,0,0,0|2,0,0]=3 41 B11R2.10 BrC1=CC2=C(C=CC=C2)O1 B47828 [1,0,0,0,0,0|1,0,0]=2 42 B11R2.10 BrC1=CC2=C(C=CC=C2)S1 B47534 [1,0,0,0,0,0|1,1,0]=3 43 B11R2.10 BrC1=CC2=C(C=NC=C2)N1 B69716 [1,0,0,0,0,0|3,0,0]=4 44 B11R2.10 BrC1=CC2=C(N=CC=C2)N1 B16458 [1,0,0,0,0,0|3,0,0]=4 45 B11R2.10 BrC1=CN2C=CC=CC2=N1 B16658 [1,0,0,0,0,0|3,0,0]=4 46 B11R2.10 BrC1=NC2=C(C=CC=C2)N1 B36657 [1,0,0,0,0,0|3,0,0]=4 47 B11R2.10 BrC1=NC2=C(C=CC=C2)S1 B44414 [1,0,0,0,0,0|2,1,0]=4 48 B11R2.10 CC1=CC2=C(C=CC=C2)C1 M38071 [1,0,0,0,0,0|1,0,1]=3 49 B11R2.10 CC1=CC2=C(C=CC=C2)N1 M13893 [1,0,0,0,0,0|1,0,1]=3 50 B11R2.10 CC1=CC2=C(C=CC=C2)S1 M51663 [1,0,0,0,0,0|0,1,1]=3 51 B11R2.10 CC1=CC2=C(C=CN=C2)N1 M14784 [1,0,0,0,0,0|2,0,1]=4 52 B11R2.10 CC1=CC2=C(C=NC=C2)N1 M12631 [1,0,0,0,0,0|2,0,1]=4 53 B11R2.10 CC1=CC2=CC=CN=C2N1 M0598 [1,0,0,0,0,0|2,0,1]=4 54 B11R2.10 CC1=CC2=NC=CC=C2N1 M25103 [1,0,0,0,0,0|2,0,1]=4 55 B11R2.10 CC1=NC2=C(C=CC=C2)O1 M63131 [1,0,0,0,0,0|1,0,1]=3 56 B11R2.10 CC1=NC2=C(C=CC=C2)S1 M39486 [1,0,0,0,0,0|1,1,1]=4 57 B11R2.10 CC1=NC2=C(C=CC=N2)O1 M38652 [1,0,0,0,0,0|2,0,1]=4 58 B11R2.10 CN1C=C2C=CC=CC2=N1 M14460 [1,0,0,0,0,0|2,0,1]=4 59 B11R2.10 ClC1=CC2=C(C=CC=C2)N1 C47956 [1,0,0,0,0,0|2,0,0]=3 60 B11R2.10 ClC1=NC2=C(C=CC=C2)N1 C39352 [1,0,0,0,0,0|3,0,0]=4 61 B11R2.10 ClC1=NC2=C(C=CC=C2)O1 C44527 [1,0,0,0,0,0|2,0,0]=3 62 B11R2.10 ClC1=NC2=C(C=CC=C2)S1 C39328 [1,0,0,0,0,0|2,1,0]=4 63 B11R2.10 ClC1=NC2=C(C=CC=N2)O1 C38306 [1,0,0,0,0,0|3,0,0]=4 64 B11R2.10 ClC1=NC2=C(C=CC=N2)O1 C41854 [1,0,0,0,0,0|3,0,0]=4 65 B11R2.10 IC1=CC2=C(C=CC=C2)N1 K47983 [1,0,0,0,0,0|2,0,0]=3 66 B11R2.10 IC1=CC2=C(C=CN=C2)N1 I37324 [1,0,0,0,0,0|3,0,0]=4 67 B11R2.10 IC1=CC2=C(N=CC=C2)N1 I8108 [1,0,0,0,0,0|3,0,0]=4 68 B11R2.10 IC1=NC2=C(C=CC=C2)S1 K44444 [1,0,0,0,0,0|2,1,0]=4 69 B11R2.10 NC1=CC2=C(C=CC=C2)S1 B39092 [1,0,0,0,0,0|1,1,0]=3 70 B11R2.10 NC1=NC2=C(C=CC=C2)N1 K64925 [1,0,0,0,0,0|3,0,0]=4 71 B11R2.10 NC1=NC2=C(C=CC=C2)O1 B45208 [1,0,0,0,0,0|2,0,0]=3 72 B11R2.10 NC1=NC2=C(C=CN=C2)O1 X42470 [1,0,0,0,0,0|3,0,0]=4 73 B11R2.10 NC1=NC2=C(C=NC=C2)O1 X42471 [1,0,0,0,0,0|3,0,0]=4 74 B11R2.10 O=C1C=C2C=CC=CN2N1 P45223 [1,0,0,0,0,0|2,0,0]=3 75 B11R2.10 O=C1CC2=C(C=CC=C2)C1 K24552 [1,0,0,0,0,0|1,0,1]=3 76 B11R2.10 O=C1CC2=C(C=CC=N2)N1 D0382 [1,0,0,0,0,0|2,0,1]=4 77 B11R2.10 O=C1CC2=C(C=CN=C2)N1 D0077 [1,0,0,0,0,0|2,0,1]=4 78 B11R2.10 O=C1CC2=C(C=NC=C2)N1 D0383 [1,0,0,0,0,0|2,0,1]=4 79 B11R2.10 O=C1CC2=C(N=CC=C2)N1 D0034 [1,0,0,0,0,0|2,0,1]=4 80 B11R2.10 O=C1CC2=C(N=CC=C2)N1 D15765 [1,0,0,0,0,0|2,0,1]=4 81 B11R2.10 O=C1CN2C=CC=CC2=N1 K46529 [1,0,0,0,0,0|2,0,1]=4 82 B11R2.10 O=C1NC2=C(C=CC=C2)N1 H67954 [1,0,0,0,0,0|2,0,0]=3 83 B11R2.10 O=C1NC2=C(C=CC=N2)O1 X39239 [1,0,0,0,0,0|2,0,0]=3 84 B11R2.10 O=C1NC2=C(C=CC=N2)S1 T42138 [1,0,0,0,0,0|2,1,0]=4 85 B11R2.10 O=C1NC2=C(C=NC=C2)N1 I38762 [1,0,0,0,0,0|3,0,0]=4 86 B11R2.10 O=C1NC2=C(N=CC=C2)N1 K42475 [1,0,0,0,0,0|3,0,0]=4 87 B11R2.10 O=C1OC2=C(C=CC=C2)O1 B44621 [1,0,0,0,0,0|1,0,0]=2 88 B11R2.10 OC1=CN2C=CC=CC2=N1 K45215 [1,0,0,0,0,0|2,0,1]=4 89 B11R2.10 S=C1NC2=C(C=CC=C2)N1 B69662 [1,0,0,0,0,0|2,1,0]=4 90 B11R2.10 S=C1NC2=C(C=CC=C2)S1 B69039 [1,0,0,0,0,0|1,2,0]=4 91 B11R2.10 S=C1NC2=C(C=CC=N2)O1 X42139 [1,0,0,0,0,0|2,1,0]=4 92 B11R2.10 SC1=NC2=C(C=CC=N2)O1 X42137 [1,0,0,0,0,0|2,1,0]=4 93 B13R2.26 NCCC1=CC2=C(C=CC=C2)N1 K52682 [0,1,0,0,0,0|2,0,1]=4 94 B13R2.43 CC1=CC2=C(C=C1)C=C(C#N)N2 M53634 [0,1,0,0,0,0|2,0,1]=4 95 B13R2.43 CC1=CN2C=C(C=O)N=C2C=C1 M51366 [0,1,0,0,0,0|2,0,0]=3 96 B13R2.43 CCC1=CC2=C(C=C(N)C=C2)O1 E52543 [0,1,0,0,0,0|1,0,1]=3 97 B13R2.43 CCC1=CC2=C(C=CC(Br)=C2)O1 B54043 [0,1,0,0,0,0|1,0,1]=3 98 B13R2.43 CCC1=NC2=C(C=CC(Br)=C2)O1 B51507 [0,1,0,0,0,0|2,0,1]=4 99 B13R2.43 N#CC1=CC2=C(C=C(Br)C=C2)S1 B50648 [0,1,0,0,0,0|1,1,1]=4 100 B13R2.43 N#CC1=CC2=C(C=CC(Br)=C2)N1 B50666 [0,1,0,0,0,0|2,0,1]=4 101 B13R2.43 NCC1=CC2=C(C=CC(Cl)=C2)N1 C51680 [0,1,0,0,0,0|2,0,1]=4 102 B13R2.43 NNC1=NC2=C(C=C(Cl)C=C2)O1 C45306 [0,1,0,0,0,0|3,0,0]=4 103 B13R2.43 O=CC1=CC2=C(C=C(Br)C=C2)N1 B5218 [0,1,0,0,0,0|1,0,0]=2 104 B13R2.43 O=CC1=CC2=C(C=C(Cl)C=C2)N1 C50939 [0,1,0,0,0,0|1,0,0]=2 105 B13R2.43 O=CC1=CC2=C(C=CC(Br)=C2)N1 B64748 [0,1,0,0,0,0|1,0,0]=2 106 B13R2.43 O=CC1=CC2=C(C=CC(Br)=C2)S1 B63212 [0,1,0,0,0,0|0,1,0]=2 107 B13R2.43 O=CC1=CC2=C(C=CC(Cl)=C2)N1 C50938 [0,1,0,0,0,0|1,0,0]=2 108 B13R2.43 O=CC1=CN2C=C(Br)C=CC2=N1 B14166 [0,1,0,0,0,0|2,0,0]=3 109 B13R2.43 O=CC1=CN2C=CC(Br)=CC2=N1 B7939 [0,1,0,0,0,0|2,0,0]=3 110 B13R2.43 O=CC1=NC2=C(C=C(F)C=C2)N1 F47620 [0,1,0,0,0,0|2,0,0]=3 111 B13R2.43 OCC1=CC2=C(C=C(Br)C=C2)N1 B51508 [0,1,0,0,0,0|1,0,2]=4 112 B13R2.43 OCC1=CC2=C(C=C(Cl)C=C2)N1 C51523 [0,1,0,0,0,0|1,0,2]=4 113 B13R2.45 CC1=C(C#N)NC2=C1C=CC=C2 M53633 [0,1,0,0,0,0|2,0,1]=4 114 B13R2.45 CC1=C(C=O)NC2=C1C=CC=C2 M61458 [0,1,0,0,0,0|1,0,0]=2 115 B13R2.45 CC1=C(C=O)OC2=C1C=CC=C2 M53796 [0,1,0,0,0,0|0,0,0]=1 116 B13R2.45 CN1C(C=O)=CC2=C1C=CC=C2 M53907 [0,1,0,0,0,0|1,0,0]=2 117 B13R2.45 CN1C(C=O)=CC2=C1N=CC=C2 M19102 [0,1,0,0,0,0|2,0,0]=3 118 B13R2.45 CN1C(C=O)=NC2=C1C=CC=C2 M28682 [0,1,0,0,0,0|2,0,0]=3 119 B13R2.54 N#CC1=CC2=C(C=CC=C2O)S1 H65375 [0,1,0,0,0,0|1,1,1]=4 120 B13R2.54 N#CC1=CC2=C(Cl)C=CC=C2S1 C50651 [0,1,0,0,0,0|1,1,1]=4 121 B13R2.54 N#CC1=CC2=CC=CC(Cl)=C2N1 C50670 [0,1,0,0,0,0|2,0,1]=4 122 B13R2.54 N#CC1=CC2=NC=CC(Cl)=C2O1 C12676 [0,1,0,0,0,0|2,0,1]=4 123 B13R2.54 O=CC1=CC2=C(Br)C=CC=C2N1 B32055 [0,1,0,0,0,0|1,0,0]=2 124 B13R2.54 O=CC1=CC2=C(Br)C=CC=C2S1 B63343 [0,1,0,0,0,0|0,1,0]=2 125 B13R2.54 O=CC1=CC2=C(S1)C(Cl)=NC=N2 C13921 [0,1,0,0,0,0|2,1,0]=4 126 B13R2.54 O=CC1=CC2=NC=CC(Cl)=C2S1 C12672 [0,1,0,0,0,0|1,1,0]=3 127 B13R2.54 O=CC1=CN2C(Br)=CC=CC2=N1 B7536 [0,1,0,0,0,0|2,0,0]=3 128 B13R2.54 O=CC1=CN2C(Cl)=CC=CC2=N1 C63625 [0,1,0,0,0,0|2,0,0]=3 129 B13R2.54 O=CC1=CN2C=CC=C(Br)C2=N1 B14167 [0,1,0,0,0,0|2,0,0]=3 130 B13R2.435 CC(=O)C1=CC2=C(C=CC=C2)N1 K53902 [0,1,0,0,0,0|1,0,0]=2 131 B13R2.435 CC(=O)C1=CC2=C(C=CC=C2)O1 B61955 [0,1,0,0,0,0|0,0,0]=1 132 B13R2.435 CC(=O)C1=CC2=C(C=CC=C2)S1 A64883 [0,1,0,0,0,0|0,1,0]=2 133 B13R2.435 CC(=O)C1=NC2=C(C=CC=C2)N1 B51360 [0,1,0,0,0,0|2,0,0]=3 134 B13R2.435 CC(=O)C1=NC2=C(C=CC=C2)O1 B51183 [0,1,0,0,0,0|1,0,0]=2 135 B13R2.435 NC(=O)C1=CC2=CC=CNC2=N1 P29771 [0,1,0,0,0,0|2,0,0]=3 136 B13R2.435 NC(=O)C1=NC2=C(C=CC=C2)N1 B48396 [0,1,0,0,0,0|2,0,0]=3 137 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)O1 B38556 [0,1,0,0,0,0|0,0,0]=1 138 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)S1 B36620 [0,1,0,0,0,0|0,1,0]=2 139 B13R2.435 O=C(O)C1=CC2=C(C=CC=N2)N1 A12533 [0,1,0,0,0,0|2,0,0]=3 140 B13R2.435 O=C(O)C1=CC2=C(C=CC=N2)S1 T0447 [0,1,0,0,0,0|1,1,0]=3 141 B13R2.435 O=C(O)C1=CC2=C(C=CN=C2)N1 P9023 [0,1,0,0,0,0|2,0,0]=3 142 B13R2.435 O=C(O)C1=CC2=C(C=NC=C2)O1 F8714 [0,1,0,0,0,0|1,0,0]=2 143 B13R2.435 O=C(O)C1=CC2=C(C=NC=N2)N1 P14654 [0,1,0,0,0,0|3,0,0]=4 144 B13R2.435 O=C(O)C1=CC2=C(N=CC=C2)N1 P0055 [0,1,0,0,0,0|2,0,0]=3 145 B13R2.435 O=C(O)C1=CC2=C(N=CC=N2)N1 P44883 [0,1,0,0,0,0|3,0,0]=4 146 B13R2.435 O=C(O)C1=CC2=C(N=CN=C2)N1 P7615 [0,1,0,0,0,0|3,0,0]=4 147 B13R2.435 O=C(O)C1=CC2=CC=CN=C2S1 T12732 [0,1,0,0,0,0|1,1,0]=3 148 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 K3713 [0,1,0,0,0,0|2,0,0]=3 149 B13R2.435 O=C(O)C1=CN2C=CC=NC2=N1 K60831 [0,1,0,0,0,0|3,0,0]=4 150 B13R2.435 O=C(O)C1=CN2C=CN=CC2=N1 K44878 [0,1,0,0,0,0|3,0,0]=4 151 B13R2.435 O=C(O)C1=CN2N=CC=CC2=C1 P47888 [0,1,0,0,0,0|3,0,0]=4 152 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)N1 B22825 [0,1,0,0,0,0|2,0,0]=3 153 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)S1 B13965 [0,1,0,0,0,0|1,1,0]=3 154 B13R2.435 O=C(O)C1=NC2=C(C=CN=C2)N1 K44881 [0,1,0,0,0,0|3,0,0]=4 155 B13R2.435 O=C(O)C1=NC2=C(N=CC=C2)N1 K44882 [0,1,0,0,0,0|3,0,0]=4 156 B13R2.435 O=C(O)C1=NN2C=CC=CC2=C1 P47887 [0,1,0,0,0,0|2,0,0]=3 157 B13R2.435 O=C(O)C1=NN2N=CC=CC2=C1 P15084 [0,1,0,0,0,0|3,0,0]=4 158 B13R2.435 O=C(O)C1CC2=C(C=CC=C2)C1 D22647 [0,1,0,0,0,0|1,0,2]=4 159 B13R2.435 O=C(O)[C@@H]1CC2=C(C=CC=C2)N1 K9534 [0,1,0,0,0,0|1,0,2]=4 160 B13R2.435 O=C(O)[C@@H]1CC2=C(C=CC=C2)O1 D9444 [0,1,0,0,0,0|0,0,2]=3 161 B13R2.435 O=C([O-])C1=NC2=C(C=CC=C2)O1 B37604 [0,1,0,0,0,0|1,0,0]=2 162 B13R2.435 OB(O)C1=CC2=C(C=CC=C2)O1 B1440 [0,1,0,0,0,0|1,0,1]=3 163 B11R1.17 O=C\C=C\C1=C(Cl)C=CC=C1 C51320 [0,0,1,0,0,0|1,0,0]=2 164 B11R1.40 C=CC(=O)NC1=CC=CC=C1 P38034 [0,0,1,0,0,0|2,0,1]=4 165 B11R1.40 C=CC(=O)OC1=CC=CC=C1 P32241 [0,0,1,0,0,0|2,0,0]=3 166 B11R1.40 COC(=O)OC1=CC=CC=C1 M37596 [0,0,1,0,0,0|3,0,0]=4 167 B11R1.40 O=C(CBr)OC1=CC=CC=C1 P48564 [0,0,1,0,0,0|2,0,1]=4 168 B11R2.15 O=CC1=CC2=C(C=CS2)S1 T44688 [0,0,0,0,1,0|1,1,0]=3 169 B13R2.57 BrCC1=CC2=CC=CC=C2C=C1 B55307 [0,0,0,0,0,1|2,0,1]=4 170 B13R2.57 BrCC1=NC2=CC=CC=C2C=C1 B53698 [0,0,0,0,0,1|2,0,1]=4 171 B13R2.57 C#CC1=CC2=CC=CC=C2C=C1 E67694 [0,0,0,0,0,1|2,0,1]=4 172 B13R2.57 C#CC1=CC2=CC=CC=C2N=C1 E63866 [0,0,0,0,0,1|2,0,1]=4 173 B13R2.57 C=CC1=NC2=CC=CC=C2C=C1 V55310 [0,0,0,0,0,1|2,0,0]=3 174 B13R2.57 CNC1=NC2=CC=CC=C2C=C1 M52278 [0,0,0,0,0,1|3,0,0]=4 175 B13R2.57 COC1=CC2=CC=CC=C2N=C1 M53890 [0,0,0,0,0,1|3,0,0]=4 176 B13R2.57 COC1=NC2=CC=CC=C2C=C1 M53889 [0,0,0,0,0,1|3,0,0]=4 177 B13R2.57 ClCC1=CC2=CC=CC=C2C=C1 C55309 [0,0,0,0,0,1|2,0,1]=4 178 B13R2.57 ClCC1=CC2=CC=CC=C2C=N1 C38262 [0,0,0,0,0,1|2,0,1]=4 179 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 C53733 [0,0,0,0,0,1|2,0,1]=4 180 B13R2.57 ClCC1=NC2=CC=CC=C2C=N1 C36784 [0,0,0,0,0,1|2,0,1]=4 181 B13R2.57 N#CC1=CC2=CC=CC=C2C=N1 Q53424 [0,0,0,0,0,1|2,0,1]=4 182 B13R2.57 N#CC1=CC2=CC=CC=C2N=C1 C3747 [0,0,0,0,0,1|2,0,1]=4 183 B13R2.57 N#CC1=NC2=CC=CC=C2C=C1 Q3937 [0,0,0,0,0,1|2,0,1]=4 184 B13R2.57 NCC1=CC2=CC=CC=C2C=C1 N54371 [0,0,0,0,0,1|2,0,1]=4 185 B13R2.57 NCC1=CC2=CC=CC=C2C=C1 N55437 [0,0,0,0,0,1|2,0,1]=4 186 B13R2.57 NCC1=CC2=CC=CC=C2C=N1 I32057 [0,0,0,0,0,1|2,0,1]=4 187 B13R2.57 NCC1=CC2=CC=CC=C2C=N1 Q54084 [0,0,0,0,0,1|2,0,1]=4 188 B13R2.57 NCC1=CC2=CC=CC=C2N=C1 Q61339 [0,0,0,0,0,1|2,0,1]=4 189 B13R2.57 NNC1=CC2=CC=CC=C2C=C1 N39648 [0,0,0,0,0,1|3,0,0]=4 190 B13R2.57 NNC1=NC2=CC=CC=C2C=C1 H51702 [0,0,0,0,0,1|3,0,0]=4 191 B13R2.57 O=CC1=CC2=CC=CC=C2C=C1 N64900 [0,0,0,0,0,1|1,0,0]=2 192 B13R2.57 O=CC1=CC2=CC=CC=C2C=N1 I3896 [0,0,0,0,0,1|1,0,0]=2 193 B13R2.57 O=CC1=CC2=CC=CN=C2C=C1 Q1105 [0,0,0,0,0,1|2,0,0]=3 194 B13R2.57 O=CC1=CC2=NC=CN=C2C=C1 Q3628 [0,0,0,0,0,1|3,0,0]=4 195 B13R2.57 O=CC1=NC2=CC=CC=C2N=C1 F1406 [0,0,0,0,0,1|1,0,0]=2 196 B13R2.57 O=C[C@@H]1COC2=C(C=CC=C2)O1 D36985 [0,0,0,0,0,1|0,0,2]=3 197 B13R2.57 OCC1=CC2=CC=CC=C2C=C1 N67432 [0,0,0,0,0,1|1,0,2]=4 198 B13R2.57 OCC1=CC2=CC=CC=C2C=N1 I38800 [0,0,0,0,0,1|1,0,2]=4 199 B13R2.57 OCC1=CC2=CC=CC=C2N=C1 Q53901 [0,0,0,0,0,1|1,0,2]=4 200 B10R1.17 C=CCOC1=CC=CC=C1 A68573 [1,0,1,0,0,0|1,0,1]=4 201 B10R1.17 O=CC#CC1=CC=CC=C1 P68152 [1,0,1,0,0,0|0,0,2]=4 202 B10R1.18 CC(=O)NC1=CC=CC=C1 A60649 [1,0,1,0,0,0|1,0,1]=4 203 B10R1.18 CC(C)=CC1=CC=CC=C1 M52675 [1,0,1,0,0,0|1,0,1]=4 204 B10R1.18 NC(=O)CC1=CC=CC=C1 P69172 [1,0,1,0,0,0|1,0,1]=4 205 B10R1.18 NC(=O)OC1=CC=CC=C1 P45812 [1,0,1,0,0,0|1,0,0]=3 206 B10R1.18 O=C(O)CC1=CC=NC=C1 P46551 [1,0,1,0,0,0|1,0,1]=4 207 B10R1.18 O=C(O)CC1=CN=CC=C1 P39426 [1,0,1,0,0,0|1,0,1]=4 208 B10R1.18 O=C(O)CC1=NC=CC=C1 P18563 [1,0,1,0,0,0|1,0,1]=4 209 B10R1.18 O=C(O)CC1=NC=CC=C1 P38331 [1,0,1,0,0,0|1,0,1]=4 210 B10R1.18 S=C(Cl)OC1=CC=CC=C1 P37341 [1,0,1,0,0,0|1,1,0]=4 211 B10R1.16 CC1=CC=C(C=CC=O)O1 M49076 [1,0,1,0,0,0|1,0,1]=4 212 B10R2.7 C1=CC2=C(C=C1)NC=N2 B69282 [2,0,0,0,0,0|2,0,0]=4 213 B10R2.7 C1=CC2=C(C=C1)NN=C2 I14459 [2,0,0,0,0,0|2,0,0]=4 214 B10R2.7 C1=CC2=C(C=C1)OC=N2 B39360 [2,0,0,0,0,0|1,0,0]=3 215 B10R2.7 C1=CC2=C(C=C1)OCC2 D65079 [2,0,0,0,0,0|0,0,2]=4 216 B10R2.7 C1=CC2=C(C=C1)OCO2 B69389 [2,0,0,0,0,0|1,0,1]=4 217 B10R2.7 C1=CC2=C(C=C1)SC=N2 B68567 [2,0,0,0,0,0|1,1,0]=4 218 B10R2.7 C1=CC2=C(C=CN2)C=N1 A3184 [2,0,0,0,0,0|2,0,0]=4 219 B10R2.7 C1=CC2=C(C=CO2)N=C1 F10431 [2,0,0,0,0,0|1,0,0]=3 220 B10R2.7 C1=CC2=C(C=CS2)N=C1 T14110 [2,0,0,0,0,0|1,1,0]=4 221 B10R2.7 C1=CC2=C(C=N1)N=CO2 X42084 [2,0,0,0,0,0|2,0,0]=4 222 B10R2.7 C1=CC2=C(C=N1)NC=C2 A2957 [2,0,0,0,0,0|2,0,0]=4 223 B10R2.7 C1=CC2=C(C=N1)OC=C2 F3036 [2,0,0,0,0,0|1,0,0]=3 224 B10R2.7 C1=CC2=C(C=N1)SC=C2 T3035 [2,0,0,0,0,0|1,1,0]=4 225 B10R2.7 C1=CC2=C(N=C1)N=CO2 X42083 [2,0,0,0,0,0|2,0,0]=4 226 B10R2.7 C1=CC2=CC=NN2C=C1 P64401 [2,0,0,0,0,0|2,0,0]=4 227 B10R2.7 C1=CC2=NC=CN2C=C1 I5954 [2,0,0,0,0,0|2,0,0]=4 228 B10R2.7 C1=CN=C2C=CNC2=C1 A2958 [2,0,0,0,0,0|2,0,0]=4 229 B10R2.7 C1=CN=C2NC=CC2=C1 A4765 [2,0,0,0,0,0|2,0,0]=4 230 B10R2.7 C1=CN=C2OC=NC2=C1 X42085 [2,0,0,0,0,0|2,0,0]=4 231 B10R2.7 C1=CN=C2SC=CC2=C1 T67796 [2,0,0,0,0,0|1,1,0]=4 232 B12R1.121 C=CCOC1=C(C=O)C=CC=C1 A52429 [0,1,1,0,0,0|1,0,1]=4 233 B12R1.121 COC1=C(CCC=O)C=CC=C1 M52790 [0,1,1,0,0,0|0,0,2]=4 234 B12R1.125 CC(=O)NCC1=C(O)C=CC=C1 H50049 [0,1,1,0,0,0|1,0,1]=4 235 B12R1.125 CC1=C(C=CC(=O)O)C=CC=C1 M52420 [0,1,1,0,0,0|1,0,0]=3 236 B12R1.125 CC1=C(OCC(=O)O)C=CC=C1 M62392 [0,1,1,0,0,0|0,0,2]=4 237 B12R1.125 O=C(O)COC1=C(F)C=CC=C1 F48669 [0,1,1,0,0,0|1,0,1]=4 238 B12R1.125 O=C(O)\C=C\C1=C(Br)C=CC=C1 B62216 [0,1,1,0,0,0|1,0,0]=3 239 B12R1.125 O=C(O)\C=C\C1=C(Cl)C=CC=C1 C6638 [0,1,1,0,0,0|1,0,0]=3 240 B12R1.125 O=C(O)\C=C\C1=C(F)C=CC=C1 F68685 [0,1,1,0,0,0|1,0,0]=3 241 B12R1.125 O=C(O)\C=C\C1=C(O)C=CC=C1 H68558 [0,1,1,0,0,0|0,0,0]=2 242 B12R1.125 O=[N+]([O-])C=CC1=C(Cl)C=CC=C1 C47994 [0,1,1,0,0,0|2,0,0]=4 243 B12R1.125 O=[N+]([O-])\C=C\C1=C(Cl)C=CC=C1 C47995 [0,1,1,0,0,0|2,0,0]=4 244 B12R1.125 O=[N+]([O-])\C=C\C1=C(F)C=CC=C1 F61821 [0,1,1,0,0,0|2,0,0]=4 245 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O B39587 [0,1,1,0,0,0|1,0,0]=3 246 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)Cl P51914 [0,1,1,0,0,0|0,0,2]=4 247 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)O P69450 [0,1,1,0,0,0|0,0,2]=4 248 B12R1.43 C\C(=C/C1=NC=CC=C1)C(=O)O M62826 [0,1,1,0,0,0|2,0,0]=4 249 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 H49929 [0,1,1,0,0,0|0,0,2]=4 250 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 H49928 [0,1,1,0,0,0|0,0,2]=4 251 B12R1.43 O=C([O-])N(O)CC1=CC=CC=C1 B49301 [0,1,1,0,0,0|1,0,1]=4 252 B12R2.18 BrC1=C(Br)C2=C(C=CC=C2)S1 D47321 [1,1,0,0,0,0|1,1,0]=4 253 B12R2.18 CC1=C(Br)C2=C(C=CC=C2)O1 B62060 [1,1,0,0,0,0|0,0,1]=3 254 B12R2.18 CC1=C(Br)C2=C(C=CC=C2)S1 B37673 [1,1,0,0,0,0|0,1,1]=4 255 B12R2.18 CC1=C(C)C2=C(C=CC=C2)N1 D68340 [1,1,0,0,0,0|1,0,1]=4 256 B12R2.18 CC1=CC2=C(C=CC=C2)N1C D26007 [1,1,0,0,0,0|1,0,1]=4 257 B12R2.18 CN1C(=O)NC2=C1C=CC=C2 M48815 [1,1,0,0,0,0|2,0,0]=4 258 B12R2.18 CN1C(N)=CC2=C1C=CC=C2 M38994 [1,1,0,0,0,0|2,0,0]=4 259 B12R2.18 O=C1NC2=C(C=CC=N2)C1=O P9936 [1,1,0,0,0,0|2,0,0]=4 260 B12R2.202 CC1=CC2=C(Br)C=CC=C2N1 B24528 [1,1,0,0,0,0|1,0,1]=4 261 B12R2.202 CC1=CC2=C(O)C=CC=C2N1 M23244 [1,1,0,0,0,0|1,0,1]=4 262 B12R2.202 CC1=CC2=CC=CC(Br)=C2C1 B10696 [1,1,0,0,0,0|1,0,1]=4 263 B12R2.202 CC1=CC2=NC=CC(Cl)=C2O1 C12674 [1,1,0,0,0,0|1,0,1]=4 264 B12R2.202 CC1=CC=CC2=C1CC(=O)N2 M51751 [1,1,0,0,0,0|1,0,1]=4 265 B12R2.202 CC1=NC2=C(F)C=CC=C2O1 F48104 [1,1,0,0,0,0|1,0,1]=4 266 B12R2.202 ClC1=CC=CC2=C1SC(Br)=C2 B63280 [1,1,0,0,0,0|1,1,0]=4 267 B12R2.202 ClC1=CC=NC2=C1OC(I)=C2 C12675 [1,1,0,0,0,0|2,0,0]=4 268 B12R2.202 NC1=CC2=C(Br)C=CC=C2S1 A12712 [1,1,0,0,0,0|1,1,0]=4 269 B12R2.202 NC1=CC2=CC=CC(Br)=C2S1 A10456 [1,1,0,0,0,0|1,1,0]=4 270 B12R2.202 NC1=CC=CC2=C1NC(=O)C2 A48794 [1,1,0,0,0,0|1,0,1]=4 271 B12R2.202 NC1=CC=CC2=C1OC(=O)N2 A45229 [1,1,0,0,0,0|1,0,0]=3 272 B12R2.202 NC1=NC2=C(Br)C=CC=C2O1 B44825 [1,1,0,0,0,0|2,0,0]=4 273 B12R2.202 NC1=NC2=C(C=CC=C2O)O1 H45228 [1,1,0,0,0,0|2,0,0]=4 274 B12R2.202 NC1=NC2=CC=CC(Br)=C2O1 B44827 [1,1,0,0,0,0|2,0,0]=4 275 B12R2.202 O=C1CC2=C(Br)C=CC=C2N1 B2074 [1,1,0,0,0,0|1,0,1]=4 276 B12R2.202 O=C1CC2=C(C=CC=C2O)N1 H48455 [1,1,0,0,0,0|1,0,1]=4 277 B12R2.202 O=C1CC2=C(Cl)C=CC=C2N1 C22284 [1,1,0,0,0,0|1,0,1]=4 278 B12R2.202 O=C1CC2=C(F)C=CC=C2N1 F48095 [1,1,0,0,0,0|1,0,1]=4 279 B12R2.202 O=C1CC2=CC=CC(Br)=C2C1 B10978 [1,1,0,0,0,0|1,0,1]=4 280 B12R2.202 O=C1CC2=CC=CC(Br)=C2N1 B12492 [1,1,0,0,0,0|1,0,1]=4 281 B12R2.202 O=C1CC2=CC=CC(F)=C2N1 F48096 [1,1,0,0,0,0|1,0,1]=4 282 B12R2.202 O=C1NC2=C(C=CC=C2F)S1 F44555 [1,1,0,0,0,0|1,1,0]=4 283 B12R2.202 O=C1NC2=C(Cl)C=CC=C2S1 C44540 [1,1,0,0,0,0|1,1,0]=4 284 B12R2.202 O=C1NC2=CC=CC(Br)=C2O1 B44448 [1,1,0,0,0,0|1,0,0]=3 285 B12R2.202 O=C1NC2=CC=CC(Br)=C2S1 B44525 [1,1,0,0,0,0|1,1,0]=4 286 B12R2.202 O=C1NC2=CC=CC(Cl)=C2S1 C44541 [1,1,0,0,0,0|1,1,0]=4 287 B12R2.202 O=C1NC2=CC=CC(F)=C2N1 F38220 [1,1,0,0,0,0|2,0,0]=4 288 B12R2.202 S=C1NC2=CC=CC(Cl)=C2O1 C62263 [1,1,0,0,0,0|1,1,0]=4 289 B12R2.606 CC1=CC2=C(C=C(Br)C=C2)N1 B24529 [1,1,0,0,0,0|1,0,1]=4 290 B12R2.606 CC1=CC2=C(C=C(Cl)C=C2)N1 C24527 [1,1,0,0,0,0|1,0,1]=4 291 B12R2.606 CC1=CC2=C(C=C(F)C=C2)N1 F23531 [1,1,0,0,0,0|1,0,1]=4 292 B12R2.606 CC1=CC2=C(C=C(I)C=C2)N1 I18181 [1,1,0,0,0,0|1,0,1]=4 293 B12R2.606 CC1=CC2=C(C=C(N)C=C2)N1 M13891 [1,1,0,0,0,0|1,0,1]=4 294 B12R2.606 CC1=CC2=C(C=C(O)C=C2)N1 M24189 [1,1,0,0,0,0|1,0,1]=4 295 B12R2.606 CC1=CC2=C(C=C(O)C=C2)O1 M63165 [1,1,0,0,0,0|0,0,1]=3 296 B12R2.606 CC1=CC2=C(C=C1)C=C(C)N2 D52503 [1,1,0,0,0,0|1,0,1]=4 297 B12R2.606 CC1=CC2=C(C=C1)CC(=O)N2 M24288 [1,1,0,0,0,0|1,0,1]=4 298 B12R2.606 CC1=CC2=C(C=C1)NC(=O)C2 M51752 [1,1,0,0,0,0|1,0,1]=4 299 B12R2.606 CC1=CC2=C(C=C1)NC(=O)N2 M48816 [1,1,0,0,0,0|2,0,0]=4 300 B12R2.606 CC1=CC2=C(C=C1)NC(C)=C2 D17352 [1,1,0,0,0,0|1,0,1]=4 301 B12R2.606 CC1=CC2=C(C=C1)OC(=S)N2 M48557 [1,1,0,0,0,0|1,1,0]=4 302 B12R2.606 CC1=CC2=C(C=C1)OC(C)=N2 D51756 [1,1,0,0,0,0|1,0,1]=4 303 B12R2.606 CC1=CC2=C(C=C1)OC(N)=N2 M48797 [1,1,0,0,0,0|2,0,0]=4 304 B12R2.606 CC1=CC2=C(C=CC(Br)=C2)N1 B16417 [1,1,0,0,0,0|1,0,1]=4 305 B12R2.606 CC1=CC2=C(C=CC(Cl)=C2)N1 C16418 [1,1,0,0,0,0|1,0,1]=4 306 B12R2.606 CC1=CC2=C(C=CC(F)=C2)N1 F12894 [1,1,0,0,0,0|1,0,1]=4 307 B12R2.606 CC1=CC2=C(C=CC(O)=C2)N1 M18691 [1,1,0,0,0,0|1,0,1]=4 308 B12R2.606 CC1=NC2=C(C=C(Br)C=C2)O1 B48073 [1,1,0,0,0,0|1,0,1]=4 309 B12R2.606 CC1=NC2=C(C=C(Cl)C=C2)O1 C48089 [1,1,0,0,0,0|1,0,1]=4 310 B12R2.606 CC1=NC2=C(C=C(N)C=C2)O1 M48804 [1,1,0,0,0,0|1,0,1]=4 311 B12R2.606 CC1=NC2=C(C=CC(Br)=C2)O1 B38129 [1,1,0,0,0,0|1,0,1]=4 312 B12R2.606 CC1=NC2=C(C=CC(F)=C2)O1 F48105 [1,1,0,0,0,0|1,0,1]=4 313 B12R2.606 CC1=NC2=C(C=CC(N)=C2)O1 M61203 [1,1,0,0,0,0|1,0,1]=4 314 B12R2.606 CC1=NC2=C(C=CC(O)=C2)O1 M38254 [1,1,0,0,0,0|1,0,1]=4 315 B12R2.606 ClC1=CC2=C(C=C1)N=C(Cl)O2 D44181 [1,1,0,0,0,0|2,0,0]=4 316 B12R2.606 ClC1=CC2=C(C=C1)NC(I)=C2 C47699 [1,1,0,0,0,0|2,0,0]=4 317 B12R2.606 ClC1=CC2=C(C=C1)OC(Cl)=N2 D13938 [1,1,0,0,0,0|2,0,0]=4 318 B12R2.606 ClC1=NC2=C(C=CC(Br)=C2)O1 B37658 [1,1,0,0,0,0|2,0,0]=4 319 B12R2.606 FC1=CC2=C(C=C1)OC(S)=N2 F44554 [1,1,0,0,0,0|1,1,0]=4 320 B12R2.606 NC1=CC2=C(C=C(Br)C=C2)S1 B10455 [1,1,0,0,0,0|1,1,0]=4 321 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 A12202 [1,1,0,0,0,0|1,0,1]=4 322 B12R2.606 NC1=CC2=C(C=C1)N=C(O)O2 A62037 [1,1,0,0,0,0|1,0,1]=4 323 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 A0306 [1,1,0,0,0,0|1,0,1]=4 324 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 A49612 [1,1,0,0,0,0|1,0,1]=4 325 B12R2.606 NC1=CC2=C(C=C1)NC(=O)N2 A69233 [1,1,0,0,0,0|2,0,0]=4 326 B12R2.606 NC1=CC2=C(C=C1)NC(=O)S2 A45264 [1,1,0,0,0,0|1,1,0]=4 327 B12R2.606 NC1=CC2=C(C=C1)OC(=O)C2 A48458 [1,1,0,0,0,0|0,0,1]=3 328 B12R2.606 NC1=CC2=C(C=CC(Br)=C2)S1 A10454 [1,1,0,0,0,0|1,1,0]=4 329 B12R2.606 NC1=NC2=C(C=C(Br)C=C2)O1 A44824 [1,1,0,0,0,0|2,0,0]=4 330 B12R2.606 NC1=NC2=C(C=C(Cl)C=C2)O1 A44834 [1,1,0,0,0,0|2,0,0]=4 331 B12R2.606 NC1=NC2=C(C=CC(Br)=C2)O1 B44826 [1,1,0,0,0,0|2,0,0]=4 332 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)C1 B51311 [1,1,0,0,0,0|1,0,1]=4 333 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)N1 B9533 [1,1,0,0,0,0|1,0,1]=4 334 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)C1 C51319 [1,1,0,0,0,0|1,0,1]=4 335 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)N1 C24287 [1,1,0,0,0,0|1,0,1]=4 336 B12R2.606 O=C1CC2=C(C=C(F)C=C2)N1 F24289 [1,1,0,0,0,0|1,0,1]=4 337 B12R2.606 O=C1CC2=C(C=C(I)C=C2)N1 K61888 [1,1,0,0,0,0|1,0,1]=4 338 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 B0214 [1,1,0,0,0,0|1,0,1]=4 339 B12R2.606 O=C1CC2=C(C=CC(F)=C2)N1 F28486 [1,1,0,0,0,0|1,0,1]=4 340 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)N1 B36673 [1,1,0,0,0,0|2,0,0]=4 341 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)O1 B69565 [1,1,0,0,0,0|1,0,0]=3 342 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)S1 B44524 [1,1,0,0,0,0|1,1,0]=4 343 B12R2.606 O=C1NC2=C(C=C(Cl)C=C2)N1 C69352 [1,1,0,0,0,0|2,0,0]=4 344 B12R2.606 O=C1NC2=C(C=C(Cl)C=C2)S1 C38265 [1,1,0,0,0,0|1,1,0]=4 345 B12R2.606 O=C1NC2=C(C=C(F)C=C2)N1 F44847 [1,1,0,0,0,0|2,0,0]=4 346 B12R2.606 O=C1NC2=C(C=C(F)C=C2)S1 F44553 [1,1,0,0,0,0|1,1,0]=4 347 B12R2.606 O=C1NC2=C(C=CC(Br)=C2)O1 B44447 [1,1,0,0,0,0|1,0,0]=3 348 B12R2.606 O=C1NC2=C(C=CC(F)=C2)O1 F44453 [1,1,0,0,0,0|1,0,0]=3 349 B12R2.606 O=C1NC2=NC=C(Br)C=C2O1 B41837 [1,1,0,0,0,0|2,0,0]=4 350 B12R2.606 O=C1NC2=NC=C(Cl)C=C2O1 C41838 [1,1,0,0,0,0|2,0,0]=4 351 B12R2.606 S=C1NC2=C(C=C(Cl)C=C2)O1 C63973 [1,1,0,0,0,0|1,1,0]=4 352 B12R2.606 S=C1NC2=C(C=CC(Br)=C2)O1 B44526 [1,1,0,0,0,0|1,1,0]=4 353 B12R2.606 S=C1NC2=C(C=CC(Cl)=C2)O1 C44542 [1,1,0,0,0,0|1,1,0]=4 354 B12R2.252 O=C(O)C1=CC2=C(C=CS2)S1 T44620 [0,1,0,0,1,0|1,1,0]=4 355 B14R2.92 NC1=C(C=O)C=CC2=CC=CN=C21 A53643 [0,1,0,0,0,1|2,0,0]=4 356 B14R2.92 O=CC1=C(Br)C2=CC=CC=C2C=C1 B55211 [0,1,0,0,0,1|1,0,0]=3 357 B14R2.92 O=CC1=C(Cl)C2=CC=CC=C2N=C1 C63922 [0,1,0,0,0,1|1,0,0]=3 358 B14R2.92 O=CC1=C(O)C2=CC=CC=C2C=C1 H62030 [0,1,0,0,0,1|1,0,0]=3 359 B14R2.92 O=CC1=COC2=C(C=CC=C2)C1=O X53493 [0,1,0,0,0,1|0,0,0]=2 360 B14R2.134 O=CC1=CN=C2C=CC(Br)=CC2=C1 B53475 [0,1,0,0,0,1|1,0,0]=3 361 B14R2.134 O=CC1=CN=C2C=CC(Cl)=CC2=C1 C53479 [0,1,0,0,0,1|1,0,0]=3 362 B14R2.142 O=CC1=CC=C2C=CC=C(F)C2=N1 F62617 [0,1,0,0,0,1|1,0,0]=3 363 B14R2.142 O=CC1=NC2=C(O)C=CC=C2C=C1 H53569 [0,1,0,0,0,1|1,0,0]=3 364 B14R2.781 CC(=O)C1=CC2=CC=CC=C2C=C1 N64544 [0,1,0,0,0,1|1,0,0]=3 365 B14R2.781 CC(=O)C1=NC2=CC=CC=C2N=C1 Q63133 [0,1,0,0,0,1|1,0,0]=3 366 B14R2.781 N=C(N)C1=NC2=CC=CC=C2C=C1 Q36993 [0,1,0,0,0,1|2,0,0]=4 367 B14R2.781 NC(=O)C1=CC2=CC=CC=C2C=C1 N69496 [0,1,0,0,0,1|1,0,0]=3 368 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=N1 I3901 [0,1,0,0,0,1|1,0,0]=3 369 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=N1 Q9606 [0,1,0,0,0,1|1,0,0]=3 370 B14R2.781 O=C(O)C1=CC2=CC=CC=C2N=C1 Q53568 [0,1,0,0,0,1|1,0,0]=3 371 B14R2.781 O=C(O)C1=CC2=CC=CN=C2C=C1 Q4615 [0,1,0,0,0,1|2,0,0]=4 372 B14R2.781 O=C(O)C1=CC2=CC=CN=C2N=C1 N50816 [0,1,0,0,0,1|2,0,0]=4 373 B14R2.781 O=C(O)C1=CC2=CC=NC=C2C=C1 Q9590 [0,1,0,0,0,1|2,0,0]=4 374 B14R2.781 O=C(O)C1=CC2=CC=NC=C2C=N1 N7542 [0,1,0,0,0,1|2,0,0]=4 375 B14R2.781 O=C(O)C1=CC2=CC=NC=C2N=C1 N64834 [0,1,0,0,0,1|2,0,0]=4 376 B14R2.781 O=C(O)C1=CC2=NC=CC=C2C=C1 Q16429 [0,1,0,0,0,1|2,0,0]=4 377 B14R2.781 O=C(O)C1=NC2=CC=CC=C2N=C1 Q67454 [0,1,0,0,0,1|1,0,0]=3 378 B14R2.781 O=C(O)C1=NC2=CC=CN=C2C=C1 N12774 [0,1,0,0,0,1|2,0,0]=4 379 B14R2.781 O=C(O)C1=NC2=CC=NC=C2C=C1 N22131 [0,1,0,0,0,1|2,0,0]=4 380 B14R2.781 O=C(O)C1=NC2=NC=CC=C2C=C1 N50815 [0,1,0,0,0,1|2,0,0]=4 381 B14R2.781 O=C(O)[C@@H]1CCC2=C(C=CC=C2)O1 C37839 [0,1,0,0,0,1|0,0,2]=4 382 B14R2.781 O=C(O)[C@@H]1COC2=C(C=CC=C2)O1 D9562 [0,1,0,0,0,1|0,0,2]=4 383 B14R2.1128 O=CC1=CC2=CC=CC=C2N=C1Cl C53477 [0,1,0,0,0,1|1,0,0]=3 384 B14R2.2332 C=CC1=CC=C2C=C(O)C=CC2=C1 V55606 [0,1,0,0,0,1|2,0,0]=4 385 B14R2.2332 O=CC1=CC2=CC=C(O)C=C2C=C1 H25376 [0,1,0,0,0,1|1,0,0]=3 386 B14R2.2332 O=CC1=CC=C2C=C(Br)C=CC2=N1 B53474 [0,1,0,0,0,1|1,0,0]=3 387 B14R2.2332 O=CC1=CC=C2C=C(F)C=CC2=N1 F62729 [0,1,0,0,0,1|1,0,0]=3 388 B14R2.2332 O=CC1=CC=C2N=C(Cl)C=CC2=C1 C53478 [0,1,0,0,0,1|2,0,0]=4 389 B14R2.768 O=C(O)CC1=CC2=C(C=CC=C2)N1 I38816 [0,2,0,0,0,0|1,0,0]=3 390 B14R2.768 O=C(O)CC1=CC2=C(C=CC=C2)S1 B53803 [0,2,0,0,0,0|0,1,0]=3 391 B14R2.768 O=C(O)CC1=NC2=C(C=CC=C2)N1 B37433 [0,2,0,0,0,0|2,0,0]=4 392 B14R2.972 COC(=O)C1=CC2=C(C=CC=C2)N1 M17396 [0,2,0,0,0,0|1,0,0]=3 393 B14R2.972 COC(=O)C1=CC2=C(C=CC=C2)S1 M53804 [0,2,0,0,0,0|0,1,0]=3 394 B14R2.972 COC(=O)C1=CC2=C(C=CC=N2)N1 M12534 [0,2,0,0,0,0|2,0,0]=4 395 B14R2.972 COC(=O)C1=CC2=C(C=CC=N2)S1 M13607 [0,2,0,0,0,0|1,1,0]=4 396 B14R2.972 COC(=O)C1=CC2=C(N=CC=C2)N1 M3314 [0,2,0,0,0,0|2,0,0]=4 397 B14R2.972 COC(=O)C1=NC2=C(C=CC=C2)N1 M51395 [0,2,0,0,0,0|2,0,0]=4 398 B14R2.972 COC(=O)C1=NC2=C(C=CC=C2)O1 M51214 [0,2,0,0,0,0|1,0,0]=3 399 B14R2.972 COC(=O)C1=NN2C=CC=CC2=C1 P3313 [0,2,0,0,0,0|2,0,0]=4 400 B14R2.1095 CC1=CC2=NC(C=O)=C(Br)N2C=C1 B63879 [0,2,0,0,0,0|2,0,0]=4 401 B14R2.3304 N#CC1=CC2=C(C=C1)C=C(C=O)N2 F53430 [0,2,0,0,0,0|1,0,0]=3 402 B14R2.4529 CC(=O)C1=NC2=C(C=C(Br)C=C2)N1 B51125 [0,2,0,0,0,0|2,0,0]=4 403 B14R2.4529 CC1=CC2=C(C=C1)C=C(C(=O)O)N2 M21987 [0,2,0,0,0,0|1,0,0]=3 404 B14R2.4529 CC1=CC2=C(C=C1)C=C(C(=O)O)S2 M20000 [0,2,0,0,0,0|0,1,0]=3 405 B14R2.4529 CC1=CC2=C(C=C1)NC(C(=O)O)=C2 M53943 [0,2,0,0,0,0|1,0,0]=3 406 B14R2.4529 CC1=CN2C=C(C(=O)O)N=C2C=C1 M51401 [0,2,0,0,0,0|2,0,0]=4 407 B14R2.4529 CC1=NC2=C(C=C1)C=C(C(=O)O)N2 M13886 [0,2,0,0,0,0|2,0,0]=4 408 B14R2.4529 NC(=O)C1=CC2=C(C=CC(Cl)=C2)N1 C38242 [0,2,0,0,0,0|1,0,0]=3 409 B14R2.4529 NC1=CC2=C(C=C1)OC(C(=O)O)=C2 A66229 [0,2,0,0,0,0|0,0,0]=2 410 B14R2.4529 NC1=CC2=C(C=C1)SC(C(=O)O)=C2 A51196 [0,2,0,0,0,0|0,1,0]=3 411 B14R2.4529 NC1=CC2=C(N=C1)NC(C(=O)O)=C2 A13885 [0,2,0,0,0,0|2,0,0]=4 412 B14R2.4529 O=C(O)C1=CC2=C(C=C(Br)C=C2)N1 B13084 [0,2,0,0,0,0|1,0,0]=3 413 B14R2.4529 O=C(O)C1=CC2=C(C=C(Br)C=C2)O1 B60538 [0,2,0,0,0,0|0,0,0]=2 414 B14R2.4529 O=C(O)C1=CC2=C(C=C(Br)C=C2)S1 B12709 [0,2,0,0,0,0|0,1,0]=3 415 B14R2.4529 O=C(O)C1=CC2=C(C=C(Cl)C=C2)S1 C50770 [0,2,0,0,0,0|0,1,0]=3 416 B14R2.4529 O=C(O)C1=CC2=C(C=C(F)C=C2)N1 F4742 [0,2,0,0,0,0|1,0,0]=3 417 B14R2.4529 O=C(O)C1=CC2=C(C=C(F)C=C2)O1 F63917 [0,2,0,0,0,0|0,0,0]=2 418 B14R2.4529 O=C(O)C1=CC2=C(C=C(O)C=C2)N1 H51210 [0,2,0,0,0,0|1,0,0]=3 419 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)N1 B4773 [0,2,0,0,0,0|1,0,0]=3 420 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)O1 B50778 [0,2,0,0,0,0|0,0,0]=2 421 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)S1 B12681 [0,2,0,0,0,0|0,1,0]=3 422 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=N2)N1 B14108 [0,2,0,0,0,0|2,0,0]=4 423 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=C2)N1 C9530 [0,2,0,0,0,0|1,0,0]=3 424 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=C2)O1 C50780 [0,2,0,0,0,0|0,0,0]=2 425 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=N2)N1 C12532 [0,2,0,0,0,0|2,0,0]=4 426 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=N2)N1 C4191 [0,2,0,0,0,0|2,0,0]=4 427 B14R2.4529 O=C(O)C1=CC2=C(C=CC(O)=C2)N1 H51209 [0,2,0,0,0,0|1,0,0]=3 428 B14R2.4529 O=C(O)C1=CC2=C(C=CC(O)=C2)O1 H51002 [0,2,0,0,0,0|0,0,0]=2 429 B14R2.4529 O=C(O)C1=CC2=C(N=C(Cl)C=C2)N1 C4190 [0,2,0,0,0,0|2,0,0]=4 430 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CN=C2N1 B1666 [0,2,0,0,0,0|2,0,0]=4 431 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CN=C2N1 B17676 [0,2,0,0,0,0|2,0,0]=4 432 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CN=C2S1 B17936 [0,2,0,0,0,0|1,1,0]=4 433 B14R2.4529 O=C(O)C1=CC2=CC(Br)=NC=C2N1 B47577 [0,2,0,0,0,0|2,0,0]=4 434 B14R2.4529 O=C(O)C1=CC2=CC(Cl)=NC=C2N1 C4188 [0,2,0,0,0,0|2,0,0]=4 435 B14R2.4529 O=C(O)C1=CC2=CC(F)=CN=C2N1 F12411 [0,2,0,0,0,0|2,0,0]=4 436 B14R2.4529 O=C(O)C1=CC2=NC=C(Br)C=C2N1 B7995 [0,2,0,0,0,0|2,0,0]=4 437 B14R2.4529 O=C(O)C1=CC2=NC=C(Cl)C=C2N1 C7929 [0,2,0,0,0,0|2,0,0]=4 438 B14R2.4529 O=C(O)C1=CN2C=C(Br)C=CC2=C1 B61317 [0,2,0,0,0,0|2,0,0]=4 439 B14R2.4529 O=C(O)C1=CN2C=C(Br)C=CC2=N1 B7464 [0,2,0,0,0,0|2,0,0]=4 440 B14R2.4529 O=C(O)C1=CN2C=C(Cl)C=CC2=N1 C47583 [0,2,0,0,0,0|2,0,0]=4 441 B14R2.4529 O=C(O)C1=CN2C=C(F)C=CC2=N1 F47596 [0,2,0,0,0,0|2,0,0]=4 442 B14R2.4529 O=C(O)C1=CN2C=C(O)C=CC2=N1 H63800 [0,2,0,0,0,0|2,0,0]=4 443 B14R2.4529 O=C(O)C1=CN2C=CC(Br)=CC2=N1 B11318 [0,2,0,0,0,0|2,0,0]=4 444 B14R2.4529 O=C(O)C1=CN2C=CC(F)=CC2=N1 F47597 [0,2,0,0,0,0|2,0,0]=4 445 B14R2.4529 O=C(O)C1=NC2=C(C=C(Br)C=C2)S1 B13968 [0,2,0,0,0,0|1,1,0]=4 446 B14R2.4529 O=C(O)C1=NC2=C(C=CC(Br)=C2)N1 B5840 [0,2,0,0,0,0|2,0,0]=4 447 B14R2.4529 O=C(O)C1=NC2=C(C=CC(Br)=C2)S1 B13966 [0,2,0,0,0,0|1,1,0]=4 448 B14R2.4529 O=C(O)C1=NC2=C(C=CC(Cl)=C2)S1 C60432 [0,2,0,0,0,0|1,1,0]=4 449 B14R2.4529 O=C(O)C1=NN2C=C(Br)C=CC2=C1 B1718 [0,2,0,0,0,0|2,0,0]=4 450 B14R2.4529 O=C(O)C1=NN2C=C(Cl)C=CC2=C1 C5621 [0,2,0,0,0,0|2,0,0]=4 451 B14R2.4529 O=C(O)C1=NN2C=CC(Br)=CC2=C1 B11335 [0,2,0,0,0,0|2,0,0]=4 452 B14R2.4529 OB(O)C1=CC2=C(C=CC(Br)=C2)O1 B48210 [0,2,0,0,0,0|1,0,1]=4 453 B14R2.4529 OB(O)C1=CC2=C(C=CC(Cl)=C2)O1 C48211 [0,2,0,0,0,0|1,0,1]=4 454 B14R2.4529 OB(O)C1=CC2=C(C=CC(F)=C2)O1 F39049 [0,2,0,0,0,0|1,0,1]=4 455 B14R2.450 CC1=C(B(O)O)OC2=C1C=CC=C2 M32251 [0,2,0,0,0,0|1,0,1]=4 456 B14R2.450 CC1=C(C(=O)O)NC2=C1C=CC=C2 M16318 [0,2,0,0,0,0|1,0,0]=3 457 B14R2.450 CC1=C(C(=O)O)OC2=C1C=CC=C2 M22616 [0,2,0,0,0,0|0,0,0]=2 458 B14R2.450 CN1C(C(=O)O)=CC2=C1C=CC=C2 M20601 [0,2,0,0,0,0|1,0,0]=3 459 B14R2.450 NC(=O)C1=C(N)C2=C(C=CC=C2)O1 A51383 [0,2,0,0,0,0|0,0,0]=2 460 B14R2.450 NC1=C(C(=O)O)SC2=NC=CC=C21 A47894 [0,2,0,0,0,0|1,1,0]=4 461 B14R2.450 O=C(O)C1=C(Br)C2=C(C=CC=C2)N1 B50864 [0,2,0,0,0,0|1,0,0]=3 462 B14R2.450 O=C(O)C1=C(Cl)C2=C(C=CC=C2)O1 C50779 [0,2,0,0,0,0|0,0,0]=2 463 B14R2.450 O=C(O)C1=C(Cl)C2=C(N=CC=C2)S1 C39052 [0,2,0,0,0,0|1,1,0]=4 464 B14R2.1199 CC1=CC=CC2=NC(C=O)=C(Br)N12 B63878 [0,2,0,0,0,0|2,0,0]=4 465 B14R2.2151 CC1=CC=CN2C1=NC(C=O)=C2Br B63070 [0,2,0,0,0,0|2,0,0]=4 466 B14R2.7969 CC1=CC=CC2=C1C=C(C(=O)O)N2 M21986 [0,2,0,0,0,0|1,0,0]=3 467 B14R2.7969 CC1=CC=CC2=C1C=C(C(=O)O)S2 M21818 [0,2,0,0,0,0|0,1,0]=3 468 B14R2.7969 CC1=CC=CC2=C1NC(C(=O)O)=C2 M21988 [0,2,0,0,0,0|1,0,0]=3 469 B14R2.7969 CC1=CC=CC2=NC(C(=O)O)=CN12 M26199 [0,2,0,0,0,0|2,0,0]=4 470 B14R2.7969 O=C(O)C1=CC2=C(Br)C=CC=C2N1 B37796 [0,2,0,0,0,0|1,0,0]=3 471 B14R2.7969 O=C(O)C1=CC2=C(Br)C=CC=C2S1 B12683 [0,2,0,0,0,0|0,1,0]=3 472 B14R2.7969 O=C(O)C1=CC2=C(Br)C=NC=C2N1 B47576 [0,2,0,0,0,0|2,0,0]=4 473 B14R2.7969 O=C(O)C1=CC2=C(C=NC=C2F)S1 F47408 [0,2,0,0,0,0|1,1,0]=4 474 B14R2.7969 O=C(O)C1=CC2=C(Cl)C=CC=C2S1 C22565 [0,2,0,0,0,0|0,1,0]=3 475 B14R2.7969 O=C(O)C1=CC2=C(Cl)C=CN=C2N1 C1667 [0,2,0,0,0,0|2,0,0]=4 476 B14R2.7969 O=C(O)C1=CC2=C(F)C=CC=C2N1 F23500 [0,2,0,0,0,0|1,0,0]=3 477 B14R2.7969 O=C(O)C1=CC2=C(N1)C(Cl)=NC=C2 C25890 [0,2,0,0,0,0|2,0,0]=4 478 B14R2.7969 O=C(O)C1=CC2=C(N1)C(O)=CC=C2 H51211 [0,2,0,0,0,0|1,0,0]=3 479 B14R2.7969 O=C(O)C1=CC2=C(S1)C(Br)=NC=C2 B47389 [0,2,0,0,0,0|1,1,0]=4 480 B14R2.7969 O=C(O)C1=CC2=CC=CC(Br)=C2N1 B50868 [0,2,0,0,0,0|1,0,0]=3 481 B14R2.7969 O=C(O)C1=CC2=CC=CC(Br)=C2O1 B9974 [0,2,0,0,0,0|0,0,0]=2 482 B14R2.7969 O=C(O)C1=CC2=CC=CC(Br)=C2S1 B12710 [0,2,0,0,0,0|0,1,0]=3 483 B14R2.7969 O=C(O)C1=CC2=CC=CC(Cl)=C2N1 C50879 [0,2,0,0,0,0|1,0,0]=3 484 B14R2.7969 O=C(O)C1=CC2=CC=CC(Cl)=C2S1 C26344 [0,2,0,0,0,0|0,1,0]=3 485 B14R2.7969 O=C(O)C1=CC2=CC=CC(F)=C2N1 F50889 [0,2,0,0,0,0|1,0,0]=3 486 B14R2.7969 O=C(O)C1=CC2=NC=CC(Cl)=C2S1 C12289 [0,2,0,0,0,0|1,1,0]=4 487 B14R2.7969 O=C(O)C1=CN2C(Br)=CC=CC2=N1 B7537 [0,2,0,0,0,0|2,0,0]=4 488 B14R2.7969 O=C(O)C1=CN2C=CC=C(Br)C2=N1 B14171 [0,2,0,0,0,0|2,0,0]=4 489 B14R2.7969 O=C(O)C1=NC2=C(Br)C=CC=C2S1 B13967 [0,2,0,0,0,0|1,1,0]=4 490 B14R2.7969 O=C(O)C1=NC2=C(C=CC=C2F)S1 F61527 [0,2,0,0,0,0|1,1,0]=4 491 B14R2.7969 O=C(O)C1=NC2=CC=CC(Br)=C2S1 B13969 [0,2,0,0,0,0|1,1,0]=4 492 B14R2.7969 O=C(O)C1=NN2C(Br)=CC=CC2=C1 B14200 [0,2,0,0,0,0|2,0,0]=4 493 B14R2.7969 O=C(O)C1=NN2C=CC=C(Br)C2=C1 B14202 [0,2,0,0,0,0|2,0,0]=4 494 B14R2.7969 O=C(O)C1=NN2C=CC=C(Cl)C2=C1 C60465 [0,2,0,0,0,0|2,0,0]=4 495 B12R2.24 BrC1=CC2=CC=CC=C2C=C1 B39635 [0,0,1,1,0,0|2,0,0]=4 496 B12R2.24 BrC1=NC2=CC=CC=C2C=C1 B1013 [0,0,1,1,0,0|2,0,0]=4 497 B12R2.24 CC1=CC2=CC=CC=C2N=C1 M68883 [0,0,1,1,0,0|2,0,0]=4 498 B12R2.24 ClC1=CC2=CC=CC=C2N=C1 C50850 [0,0,1,1,0,0|2,0,0]=4 499 B12R2.24 FC1=CC2=CC=CC=C2C=C1 F53501 [0,0,1,1,0,0|2,0,0]=4 500 B12R2.24 IC1=CC2=CC=CC=C2C=C1 I38722 [0,0,1,1,0,0|2,0,0]=4 501 B12R2.24 NC1=CC2=CC=CC=C2C=C1 N65553 [0,0,1,1,0,0|2,0,0]=4 502 B12R2.24 NC1=NC2=CC=CC=C2C=C1 Q9616 [0,0,1,1,0,0|2,0,0]=4 503 B12R2.24 O=C1C=CC2=C(C=CC=N2)N1 N37672 [0,0,1,1,0,0|2,0,0]=4 504 B12R2.24 O=C1C=CC2=CC=CNC2=N1 N0688 [0,0,1,1,0,0|2,0,0]=4 505 B12R2.24 O=C1COC2=C(C=CC=C2)N1 B48457 [0,0,1,1,0,0|1,0,1]=4 506 B12R2.24 O=C1COC2=C(C=CC=C2)O1 B62111 [0,0,1,1,0,0|1,0,1]=4 507 B12R2.24 OC1=CC2=CC=CC=C2N=C1 H32203 [0,0,1,1,0,0|1,0,1]=4 508 B12R2.24 [Mg+]C1=CC2=CC=CC=C2C=C1 N31715 [0,0,1,1,0,0|2,0,0]=4 509 B12R2.196 CC1=CC=CC2=C1ONC2=O M60993 [0,0,1,1,0,0|1,0,1]=4 510 B12R2.196 CN1C=CC2=C(O)C=CC=C21 M60832 [0,0,1,1,0,0|2,0,0]=4 511 B12R2.196 O=C1CCC2=C1C=CC=C2O H38442 [0,0,1,1,0,0|0,0,2]=4 512 B12R2.196 O=C1COC2=C(Br)C=CC=C12 B47766 [0,0,1,1,0,0|1,0,1]=4 513 B12R2.196 O=C1NCC2=C1C=CC=C2O H48467 [0,0,1,1,0,0|1,0,1]=4 514 B12R2.1081 BrC1=CC=CC2=NC=CC=C12 B1008 [0,0,1,1,0,0|2,0,0]=4 515 B12R2.1081 BrC1=CC=CC2=NC=CC=C12 B50848 [0,0,1,1,0,0|2,0,0]=4 516 B12R2.1081 CC1=C2C=CC=NC2=CC=C1 M53836 [0,0,1,1,0,0|2,0,0]=4 517 B12R2.1081 ClC1=CC=CC2=NC=CC=C12 C24659 [0,0,1,1,0,0|2,0,0]=4 518 B12R2.1081 FC1=CC=CC2=CC=CC=C12 F60518 [0,0,1,1,0,0|2,0,0]=4 519 B12R2.1081 IC1=CC=CC2=CC=CC=C12 K53502 [0,0,1,1,0,0|2,0,0]=4 520 B12R2.1081 OC1=CC=CC2=CC=NC=C12 Q3877 [0,0,1,1,0,0|2,0,0]=4 521 B12R2.1081 OC1=CC=CC2=CN=CC=C12 H51161 [0,0,1,1,0,0|2,0,0]=4 522 B12R2.1081 OC1=CC=CC2=NC=CC=C12 H4784 [0,0,1,1,0,0|1,0,0]=3 523 B12R2.1081 OC1=CC=CC2=NC=CN=C12 Q47865 [0,0,1,1,0,0|2,0,0]=4 524 B12R2.1081 OC1=CN=CC2=CC=CC=C12 H6069 [0,0,1,1,0,0|2,0,0]=4 525 B12R2.1081 OC1=NC=CC2=CC=CC=C21 H38444 [0,0,1,1,0,0|2,0,0]=4 526 B12R2.1081 [Mg+]C1=CC=CC2=CC=CC=C12 N31714 [0,0,1,1,0,0|2,0,0]=4 527 B12R2.1 O=CC1=C2C=CC=CN2C=C1 K61492 [0,0,1,1,0,0|2,0,0]=4 528 B12R2.1 O=CC1=C2C=CC=CN2C=N1 K47871 [0,0,1,1,0,0|2,0,0]=4 529 B12R2.1 O=CC1=CN=C2C=CC=CN12 I3368 [0,0,1,1,0,0|2,0,0]=4 530 B12R2.1 O=CC1=COC2=C1C=CC=C2 B23789 [0,0,1,1,0,0|2,0,0]=4 531 B12R2.1 O=CC1=CSC2=C1C=CC=C2 B67477 [0,0,1,1,0,0|2,0,0]=4 532 B12R2.1 O=CC1=NC=C2C=CC=CN21 K61874 [0,0,1,1,0,0|2,0,0]=4 533 B12R2.1 O=CC1=NNC2=C1C=CC=C2 K9332 [0,0,1,1,0,0|2,0,0]=4 534 B12R2.44 O=CC1=CC2=C(C=C1)NC=C2 F2137 [0,0,1,1,0,0|2,0,0]=4 535 B12R2.44 O=CC1=CC2=C(C=C1)OC=C2 B37163 [0,0,1,1,0,0|2,0,0]=4 536 B12R2.44 O=CC1=CC2=C(C=CN2)C=C1 F2138 [0,0,1,1,0,0|2,0,0]=4 537 B12R2.44 O=CC1=CC2=C(C=CS2)C=C1 B51038 [0,0,1,1,0,0|2,0,0]=4 538 B12R2.44 O=CC1=NC=C2NC=CC2=C1 P37025 [0,0,1,1,0,0|2,0,0]=4 539 B12R2.44 O=CC1=NC=C2OC=CC2=C1 F39054 [0,0,1,1,0,0|2,0,0]=4 540 B12R2.315 O=CC1=C2C=CNC2=CC=C1 F2311 [0,0,1,1,0,0|2,0,0]=4 541 B12R2.315 O=CC1=C2NC=CC2=CC=C1 K2139 [0,0,1,1,0,0|2,0,0]=4 542 B12R2.315 O=CC1=CC=CC2=C1C=CS2 B37155 [0,0,1,1,0,0|2,0,0]=4 543 B10R1.15 C=C(CC)C1=CC=CC=C1 B52673 [0,0,1,0,1,0|1,0,1]=4 544 B10R1.15 O=CC(=O)C1=CC=CC=C1 P48113 [0,0,1,0,1,0|0,0,1]=3 545 B10R2.320 O=C1CC2=C1C=CC=C2 B36727 [1,0,0,0,1,0|0,0,1]=3 546 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 B52417 [0,0,1,0,0,1|2,0,0]=4 547 B12R2.1041 NC1=CC2=CC=CC=CC2=C1 A53835 [1,0,0,0,0,1|2,0,0]=4