0 B11R1.266 CC(=O)C1=CC=CC(C#N)=C1 BB01-7824 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.266 CNC1=CC(C(C)C)=CC=C1 BB01-3266 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.266 COC1=CC=CC(B(O)O)=C1 BB01-0922 [0,0,0,0,0,0|1,0,1]=2 3 B11R1.266 COC1=CC=CC(C(C)N)=C1 BB01-4887 [0,0,0,0,0,0|2,0,1]=3 4 B11R1.266 N#CC1=CC=CC(C(=O)Cl)=C1 BB20-1583 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.266 NCC1=CC([N+](=O)[O-])=CC=C1 BB55-8158 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.266 NNC1=CC=CC(C(=O)O)=C1 BB01-6377 [0,0,0,0,0,0|2,0,0]=2 7 B11R1.266 O=C(O)C1=CC(CBr)=CC=C1 BB01-6346 [0,0,0,0,0,0|2,0,0]=2 8 B11R1.266 O=CC1=CC(B(O)O)=CC=C1 BB01-0980 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.266 O=CC1=CC(C(=O)O)=CC=C1 BB57-2440 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.113 CC1=CC=CC(B(O)O)=C1 BB01-0930 [1,0,0,0,0,0|1,0,1]=3 11 B10R1.113 N=C(N)C1=CC=CC(F)=C1 BB01-8167 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 BB57-1536 [1,0,0,0,0,0|3,0,0]=4 13 B10R1.113 NC(=O)C1=CC(F)=CC=C1 BB17-0563 [1,0,0,0,0,0|2,0,0]=3 14 B10R1.113 NC(=O)C1=CN=CC(Br)=C1 BB17-0501 [1,0,0,0,0,0|3,0,0]=4 15 B10R1.113 NC(=O)C1=NC(Cl)=CC=C1 BB57-3761 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.113 NC1=CC(C(=O)O)=CN=C1 BB17-0500 [1,0,0,0,0,0|2,0,0]=3 17 B10R1.113 O=C(Cl)C1=CC=NC(Cl)=C1 BB58-1947 [1,0,0,0,0,0|3,0,0]=4 18 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 BB01-8309 [1,0,0,0,0,0|2,0,0]=3 19 B10R1.113 O=C(O)C1=CC(O)=NC=C1 BB01-7894 [1,0,0,0,0,0|1,0,0]=2 20 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 BB01-8307 [1,0,0,0,0,0|2,0,0]=3 21 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 BB57-3857 [1,0,0,0,0,0|2,0,0]=3 22 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 BB57-2098 [1,0,0,0,0,0|2,0,0]=3 23 B10R1.113 O=[N+]([O-])C1=CN=CC(O)=C1 BB32-0650 [1,0,0,0,0,0|2,0,1]=4 24 B10R1.113 OB(O)C1=CC(Cl)=CC=C1 BB01-0937 [1,0,0,0,0,0|2,0,1]=4 25 B10R1.113 OB(O)C1=CC(F)=CC=C1 BB01-0919 [1,0,0,0,0,0|2,0,1]=4 26 B10R1.172 CNC1=CC(OC)=CC=C1 BB01-3262 [1,0,0,0,0,0|2,0,0]=3 27 B10R1.172 COC1=CC=CC(C=O)=N1 BB01-8348 [1,0,0,0,0,0|1,0,0]=2 28 B10R1.172 COC1=CC=CC(CN)=C1 BB01-6176 [1,0,0,0,0,0|1,0,1]=3 29 B10R1.172 N#CC1=CC=CC(C=O)=C1 BB57-2100 [1,0,0,0,0,0|2,0,0]=3 30 B12R1.56 CC1=CC=C(C(=O)O)C=C1NN BB01-6310 [0,1,0,0,0,0|2,0,0]=3 31 B12R1.56 COC1=C(Cl)C=CC([N+](=O)[O-])=C1 BB17-0546 [0,1,0,0,0,0|1,0,1]=3 32 B12R1.258 CC(=O)C1=CC=CC(C(=O)O)=C1 BB57-0259 [0,1,0,0,0,0|1,0,0]=2 33 B12R1.258 CC(O)C1=CC=CC([N+](=O)[O-])=C1 BB57-4621 [0,1,0,0,0,0|2,0,1]=4 34 B12R1.258 CN(C)C1=CC(C(=O)O)=CC=C1 BB01-6167 [0,1,0,0,0,0|1,0,0]=2 35 B12R1.258 O=C(O)C1=CC=CC(B(O)O)=C1 BB01-0954 [0,1,0,0,0,0|2,0,0]=3 36 B12R1.258 O=C(O)C1=CC=CC(C(=O)O)=N1 BB01-7988 [0,1,0,0,0,0|3,0,0]=4 37 B12R1.258 O=C(O)C1=CN=CC(C(=O)O)=C1 BB17-0788 [0,1,0,0,0,0|3,0,0]=4 38 B12R1.279 CC(=O)C1=CC=CC(N=C=S)=C1 BB55-2419 [0,1,0,0,0,0|2,0,1]=4 39 B12R1.279 CCOC1=CC(C(=O)O)=CC=C1 BB55-0500 [0,1,0,0,0,0|0,0,0]=1 40 B12R1.279 CCOC1=CC(C(C)=O)=CC=C1 BB55-2292 [0,1,0,0,0,0|1,0,0]=2 41 B12R1.435 COC(=O)C1=CC(C#N)=CC=C1 BB58-0779 [0,1,0,0,0,0|2,0,0]=3 42 B12R1.435 COC(=O)C1=CC(CBr)=CC=C1 BB01-5010 [0,1,0,0,0,0|2,0,0]=3 43 B12R1.435 COC(=O)C1=NC=CC(CO)=C1 BB32-1399 [0,1,0,0,0,0|3,0,0]=4 44 B12R1.435 N#CC1=CC=CC(C(=O)CBr)=C1 BB01-5000 [0,1,0,0,0,0|3,0,0]=4 45 B12R1.436 COC1=CC=CC(S(=O)(=O)Cl)=C1 BB58-0004 [0,1,0,0,0,0|1,0,1]=3 46 B12R1.440 COC1=C(C)C(C(=O)O)=CC=C1 BB01-7913 [0,1,0,0,0,0|0,0,0]=1 47 B12R1.440 COC1=CC=CC(C(=O)O)=C1O BB17-0681 [0,1,0,0,0,0|0,0,0]=1 48 B12R1.453 CCC1=CC([N+](=O)[O-])=C(O)C=C1 BB57-6805 [0,1,0,0,0,0|2,0,1]=4 49 B12R1.453 COC1=CC([N+](=O)[O-])=C(I)C=C1 BB17-0425 [0,1,0,0,0,0|1,0,1]=3 50 B12R1.453 CSC1=CC(C(=O)Cl)=C(Cl)C=C1 BB01-8264 [0,1,0,0,0,0|1,1,0]=3 51 B12R1.453 CSC1=CC(C(=O)O)=C(Cl)C=C1 BB58-4602 [0,1,0,0,0,0|0,1,0]=2 52 B12R1.453 O=CC1=CC(C(=O)O)=C(O)C=C1 BB57-2282 [0,1,0,0,0,0|2,0,0]=3 53 B10R1.31 CCN1C=CC(C(=O)O)=N1 BB05-0010 [0,0,0,0,1,0|3,0,0]=4 54 B10R1.39 CCN1N=CC=C1C(=O)O BB01-4865 [0,0,0,0,1,0|3,0,0]=4 55 B10R1.39 CCN1N=CC=C1C(=O)O BB05-0011 [0,0,0,0,1,0|3,0,0]=4 56 B12R1.438 COC1=CC(CC(=O)Cl)=CC=C1 BB20-1577 [0,0,0,0,0,1|1,0,0]=2 57 B12R1.438 COC1=CC=CC(NC(N)=S)=C1 BB17-0999 [0,0,0,0,0,1|1,1,0]=3 58 B9R1.2 CC1=CC=CC(C=O)=N1 BB17-1884 [2,0,0,0,0,0|1,0,0]=3 59 B9R1.2 CC1=CC=CC(CN)=C1 BB57-0207 [2,0,0,0,0,0|1,0,1]=4 60 B9R1.2 CC1=CC=CC(NN)=C1 BB01-7859 [2,0,0,0,0,0|2,0,0]=4 61 B9R1.2 CCC1=CC(O)=CC=C1 BB58-0142 [2,0,0,0,0,0|1,0,0]=3 62 B9R1.2 CNC1=CC(Br)=CC=C1 BB01-3264 [2,0,0,0,0,0|2,0,0]=4 63 B9R1.2 CNC1=CC(Cl)=CC=C1 BB01-5244 [2,0,0,0,0,0|2,0,0]=4 64 B9R1.2 COC1=CC(S)=CC=C1 BB01-6053 [2,0,0,0,0,0|0,1,0]=3 65 B9R1.2 CSC1=CC=CC(N)=C1 BB17-2811 [2,0,0,0,0,0|1,1,0]=4 66 B9R1.2 O=CC1=CC(Cl)=CC=C1 BB01-6045 [2,0,0,0,0,0|1,0,0]=3 67 B9R1.2 O=CC1=CC(F)=CC=C1 BB01-6048 [2,0,0,0,0,0|1,0,0]=3 68 B9R1.2 O=CC1=CC(I)=CC=C1 BB17-1813 [2,0,0,0,0,0|1,0,0]=3 69 B9R1.6 N=C(N)C1=CC=CC=C1 BB01-6195 [2,0,0,0,0,0|2,0,0]=4 70 B9R1.6 NC(=O)C1=CC=CC=C1 BB01-2129 [2,0,0,0,0,0|1,0,0]=3 71 B9R1.6 NC(=O)C1=CC=CC=N1 BB01-5863 [2,0,0,0,0,0|2,0,0]=4 72 B9R1.6 O=C(O)C1=CN=CN=C1 BB01-7914 [2,0,0,0,0,0|2,0,0]=4 73 B9R1.6 O=C(O)C1=NC=CN=C1 BB01-7797 [2,0,0,0,0,0|2,0,0]=4 74 B9R1.6 OB(O)C1=CC=CC=C1 BB01-1068 [2,0,0,0,0,0|1,0,1]=4 75 B11R1.21 CC(=O)C1=CC(F)=C(F)C=C1 BB01-6259 [1,1,0,0,0,0|2,0,0]=4 76 B11R1.21 CC(=O)C1=CC=C(O)C(Cl)=C1 BB01-2046 [1,1,0,0,0,0|2,0,0]=4 77 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=C1 BB17-2778 [1,1,0,0,0,0|1,0,0]=3 78 B11R1.21 CC1=C(Br)C=CC(C(=O)O)=C1 BB17-0869 [1,1,0,0,0,0|0,0,0]=2 79 B11R1.21 CC1=C(Br)C=CC([N+](=O)[O-])=C1 BB17-2858 [1,1,0,0,0,0|1,0,1]=4 80 B11R1.21 CC1=C(C)C=C(C(=O)Cl)C=C1 BB20-1582 [1,1,0,0,0,0|1,0,0]=3 81 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 BB01-8352 [1,1,0,0,0,0|1,0,0]=3 82 B11R1.21 CC1=C(I)C=CC([N+](=O)[O-])=C1 BB17-0451 [1,1,0,0,0,0|1,0,1]=4 83 B11R1.21 CC1=C(O)C=C(C(=O)O)C=C1 BB57-1377 [1,1,0,0,0,0|0,0,0]=2 84 B11R1.21 CC1=CC=C(C(=O)O)C=C1I BB01-6183 [1,1,0,0,0,0|1,0,0]=3 85 B11R1.21 CN1N=C(C(=O)O)C=CC1=O BB91-0077 [1,1,0,0,0,0|2,0,0]=4 86 B11R1.21 NC1=C(Cl)C=C(C(=O)O)C=C1 BB17-0579 [1,1,0,0,0,0|1,0,0]=3 87 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=C1 BB17-0677 [1,1,0,0,0,0|1,0,0]=3 88 B11R1.21 O=C(O)C1=CC(Cl)=C(Br)C=C1 BB17-0868 [1,1,0,0,0,0|1,0,0]=3 89 B11R1.21 O=C(O)C1=CN=C(Cl)C(Cl)=C1 BB01-8372 [1,1,0,0,0,0|2,0,0]=4 90 B11R1.23 CNC(=O)C1=CC(Br)=CC=C1 BB55-4688 [1,1,0,0,0,0|2,0,0]=4 91 B11R1.23 COC(=O)C1=CC(Cl)=CC=C1 BB01-6335 [1,1,0,0,0,0|1,0,0]=3 92 B11R1.23 COC(=O)C1=CC(Cl)=NC=C1 BB57-1534 [1,1,0,0,0,0|2,0,0]=4 93 B11R1.23 COC(=O)C1=CC(F)=CC=C1 BB01-6089 [1,1,0,0,0,0|1,0,0]=3 94 B11R1.23 COC(=O)C1=CC=CC(N)=C1 BB17-0320 [1,1,0,0,0,0|1,0,0]=3 95 B11R1.23 N=C(NO)C1=CC=CC(Cl)=C1 BB58-3250 [1,1,0,0,0,0|2,0,0]=4 96 B11R1.23 NCC(O)C1=CC=CC(O)=C1 BB57-0249 [1,1,0,0,0,0|1,0,1]=4 97 B11R1.23 NNC(=O)C1=CC(Cl)=CC=C1 BB01-4965 [1,1,0,0,0,0|2,0,0]=4 98 B11R1.23 NNC(=O)C1=CC=CC(Br)=C1 BB01-7995 [1,1,0,0,0,0|2,0,0]=4 99 B11R1.23 NNC(=O)C1=CC=CC(I)=C1 BB17-1115 [1,1,0,0,0,0|2,0,0]=4 100 B11R1.23 NNC(=O)C1=CC=CC(O)=C1 BB55-0720 [1,1,0,0,0,0|1,0,0]=3 101 B11R1.23 N\C(=N\O)C1=CC(F)=CC=C1 BB01-2701 [1,1,0,0,0,0|2,0,0]=4 102 B11R1.74 CC(=O)C1=CC(F)=CC(F)=C1 BB01-7836 [1,1,0,0,0,0|2,0,0]=4 103 B11R1.74 NC1=CC(N)=CC(C(=O)O)=C1 BB01-2903 [1,1,0,0,0,0|1,0,0]=3 104 B11R1.74 O=C(Cl)C1=CC(F)=CC(F)=C1 BB01-8263 [1,1,0,0,0,0|2,0,0]=4 105 B11R1.74 O=C(O)C1=CC(Cl)=NC(Cl)=C1 BB01-7790 [1,1,0,0,0,0|2,0,0]=4 106 B11R1.155 CC1=CC(S(=O)(=O)Cl)=CC=C1 BB01-4832 [1,1,0,0,0,0|1,0,1]=4 107 B11R1.159 CC1=C(C(=O)O)C=CC=C1Br BB17-2779 [1,1,0,0,0,0|1,0,0]=3 108 B11R1.159 CC1=C(C(=O)O)C=CC=C1I BB17-2772 [1,1,0,0,0,0|1,0,0]=3 109 B11R1.159 CC1=C(C(=O)O)C=CC=C1N BB01-6043 [1,1,0,0,0,0|1,0,0]=3 110 B11R1.159 CC1=C(N)C([N+](=O)[O-])=CC=C1 BB17-0961 [1,1,0,0,0,0|1,0,1]=4 111 B11R1.159 CC1=C(O)C([N+](=O)[O-])=CC=C1 BB17-0454 [1,1,0,0,0,0|1,0,1]=4 112 B11R1.159 CC1=CC=CC(C(=O)O)=C1O BB17-0688 [1,1,0,0,0,0|0,0,0]=2 113 B11R1.159 NC1=C(C(=O)O)C=CC=C1Cl BB57-6134 [1,1,0,0,0,0|1,0,0]=3 114 B11R1.159 NC1=C(C(=O)O)C=CC=C1O BB57-6066 [1,1,0,0,0,0|0,0,0]=2 115 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 BB01-2226 [1,1,0,0,0,0|1,0,0]=3 116 B11R1.167 CC(=O)C1=CC(O)=CC=C1O BB01-2831 [1,1,0,0,0,0|1,0,0]=3 117 B11R1.167 CC1=CC(C(=O)O)=C(N)C=C1 BB57-0255 [1,1,0,0,0,0|0,0,0]=2 118 B11R1.167 CC1=CC(C(=O)O)=C(O)C=C1 BB17-0943 [1,1,0,0,0,0|0,0,0]=2 119 B11R1.167 CC1=CC=C(C)C(C(=O)Cl)=C1 BB20-1589 [1,1,0,0,0,0|1,0,0]=3 120 B11R1.167 NC(=O)C1=C(N)C=CC(Cl)=C1 BB01-8295 [1,1,0,0,0,0|2,0,0]=4 121 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=C1 BB17-0401 [1,1,0,0,0,0|1,0,0]=3 122 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=C1 BB17-0400 [1,1,0,0,0,0|1,0,0]=3 123 B11R1.167 NC1=C(C(=O)O)C=C(F)C=C1 BB57-0226 [1,1,0,0,0,0|1,0,0]=3 124 B11R1.167 NC1=C(C(=O)O)C=C(I)C=C1 BB17-0402 [1,1,0,0,0,0|1,0,0]=3 125 B11R1.167 O=C(Cl)C1=CC(F)=CC=C1Cl BB20-1590 [1,1,0,0,0,0|2,0,0]=4 126 B11R1.167 O=C(O)C1=C(Br)C=CC(I)=C1 BB17-0458 [1,1,0,0,0,0|1,0,0]=3 127 B11R1.167 O=C(O)C1=C(F)C=CC(Cl)=C1 BB01-7856 [1,1,0,0,0,0|1,0,0]=3 128 B11R1.167 O=C(O)C1=C(F)C=CC(F)=C1 BB01-8304 [1,1,0,0,0,0|1,0,0]=3 129 B11R1.167 O=C(O)C1=C(I)C=CC(I)=C1 BB17-0459 [1,1,0,0,0,0|1,0,0]=3 130 B11R1.167 O=C(O)C1=CC(I)=CN=C1O BB20-0613 [1,1,0,0,0,0|2,0,0]=4 131 B11R1.167 O=[N+]([O-])C1=CC(O)=CC=C1O BB57-6077 [1,1,0,0,0,0|1,0,1]=4 132 B11R1.189 CCC1=CC(N=C=O)=CC=C1 BB01-6580 [1,1,0,0,0,0|1,0,1]=4 133 B11R1.189 CCOC1=CC(C=O)=CC=C1 BB55-0788 [1,1,0,0,0,0|0,0,0]=2 134 B11R1.189 CCOC1=CC=CC(CN)=C1 BB57-0157 [1,1,0,0,0,0|1,0,1]=4 135 B11R1.189 CNCC1=CC=CC(OC)=C1 BB55-7030 [1,1,0,0,0,0|1,0,1]=4 136 B11R1.189 COC1=CC(N=C=O)=CC=C1 BB01-7818 [1,1,0,0,0,0|0,0,1]=3 137 B11R1.189 COC1=CC(N=C=S)=CC=C1 BB17-0181 [1,1,0,0,0,0|0,1,1]=4 138 B11R1.189 COC1=CC(N=S=O)=CC=C1 BB58-0241 [1,1,0,0,0,0|1,0,0]=3 139 B11R1.189 CSC1=CC(N=C=O)=CC=C1 BB01-6532 [1,1,0,0,0,0|0,1,1]=4 140 B11R1.280 COC1=C(Cl)C=CC(C=O)=C1 BB17-2319 [1,1,0,0,0,0|0,0,0]=2 141 B11R1.280 COC1=C(F)C=CC(C=O)=C1 BB01-4798 [1,1,0,0,0,0|0,0,0]=2 142 B11R1.280 COC1=CC(C=O)=C(O)C=C1 BB17-2245 [1,1,0,0,0,0|0,0,0]=2 143 B11R1.280 COC1=CC(CN)=CC=C1O BB57-0245 [1,1,0,0,0,0|1,0,1]=4 144 B13R1.81 COC1=CC(CC(=O)NN)=CC=C1 BB01-5056 [0,1,0,0,0,1|1,0,0]=3 145 B13R1.81 COC1=CC=CC(NC(=O)CBr)=C1 BB55-5011 [0,1,0,0,0,1|1,0,0]=3 146 B13R1.81 COC1=CC=CC(NC(=O)CCl)=C1 BB01-5103 [0,1,0,0,0,1|1,0,0]=3 147 B13R1.81 CSC1=CC=CC(NC(=O)CCl)=C1 BB01-5312 [0,1,0,0,0,1|1,1,0]=4 148 B13R1.97 COC1=CC=C(N)C(NC(C)=O)=C1 BB58-4321 [0,1,0,0,0,1|1,0,0]=3 149 B13R1.587 CC(=O)NC1=CC=CC(C(C)=O)=C1 BB57-4705 [0,1,0,0,0,1|2,0,0]=4 150 B13R1.126 O=C(O)C1=CC(Br)=CC([N+](=O)[O-])=C1 BB55-8753 [0,2,0,0,0,0|2,0,0]=4 151 B13R1.298 COC1=C(N)C(Br)=CC([N+](=O)[O-])=C1 BB17-2785 [0,2,0,0,0,0|1,0,1]=4 152 B13R1.437 COC1=CC(Br)=C(N)C([N+](=O)[O-])=C1 BB17-0779 [0,2,0,0,0,0|1,0,1]=4 153 B13R1.13 CC1=CC=C([N+](=O)[O-])C=C1C(=O)O BB55-8154 [0,2,0,0,0,0|2,0,0]=4 154 B13R1.13 O=C(O)C1=CC(C(=O)O)=C(Cl)C=C1 BB57-0280 [0,2,0,0,0,0|2,0,0]=4 155 B13R1.13 O=C(O)C1=CC([N+](=O)[O-])=C(Br)C=C1 BB17-0578 [0,2,0,0,0,0|2,0,0]=4 156 B13R1.13 O=C(O)C1=CC([N+](=O)[O-])=C(Cl)C=C1 BB17-1981 [0,2,0,0,0,0|2,0,0]=4 157 B13R1.49 CCC(O)C1=CC=C(O)C(OC)=C1 BB57-6748 [0,2,0,0,0,0|1,0,1]=4 158 B13R1.49 COC(=O)C1=CC(C#N)=C(O)C=C1 BB31-2970 [0,2,0,0,0,0|2,0,0]=4 159 B13R1.49 COC(=O)C1=CC(OC)=[N+](C)C=C1 BB58-1814 [0,2,0,0,0,0|1,0,0]=3 160 B13R1.49 COC1=C(O)C=CC(C(O)C#N)=C1 BB57-4888 [0,2,0,0,0,0|1,0,1]=4 161 B13R1.49 COC1=CC(C(=O)NN)=CC=C1O BB55-0724 [0,2,0,0,0,0|1,0,0]=3 162 B13R1.3091 COC1=C(OC)C=C(B(O)O)C=C1 BB01-0931 [0,2,0,0,0,0|1,0,1]=4 163 B13R1.345 NS(=O)(=O)C1=CC=CC(C(=O)O)=C1 BB57-4505 [0,2,0,0,0,0|1,1,0]=4 164 B13R1.345 O=C(O)C1=CC(C(F)(F)F)=CC=C1 BB57-4174 [0,2,0,0,0,0|2,0,0]=4 165 B13R1.543 CN(C)C1=CC=CC(C(=O)NN)=C1 BB01-5076 [0,2,0,0,0,0|2,0,0]=4 166 B13R1.543 COC(=O)C1=CC([N+](=O)[O-])=CC=C1 BB20-1314 [0,2,0,0,0,0|1,0,1]=4 167 B13R1.543 COC(=O)C1=CC=CC(C(=O)O)=C1 BB57-0257 [0,2,0,0,0,0|0,0,0]=2 168 B13R1.543 COC(=O)C1=CN=CC(C(=O)[O-])=C1 BB32-1445 [0,2,0,0,0,0|1,0,1]=4 169 B13R1.3801 CC1=C(C(=O)O)C=CC=C1[N+](=O)[O-] BB01-6168 [0,2,0,0,0,0|2,0,0]=4 170 B13R1.374 CCOC1=CC(C(=O)NN)=CC=C1 BB55-0693 [0,2,0,0,0,0|1,0,0]=3 171 B13R1.374 COC(=O)C1=CC(N=C=O)=CC=C1 BB01-6533 [0,2,0,0,0,0|1,0,1]=4 172 B13R1.387 CCOC1=CC([N+](=O)[O-])=C(N)C=C1 BB57-6592 [0,2,0,0,0,0|1,0,1]=4 173 B13R1.568 C=CCOC1=CC(C(C)=O)=CC=C1 BB55-2308 [0,2,0,0,0,0|1,0,0]=3 174 B13R1.568 CCCOC1=CC(C(C)=O)=CC=C1 BB55-2293 [0,2,0,0,0,0|1,0,0]=3 175 B13R1.82 COC(=O)C1=CC=CC(OC)=C1O BB58-5018 [0,2,0,0,0,0|0,0,0]=2 176 B13R1.82 COC1=C(O)C(C(=O)NN)=CC=C1 BB58-5017 [0,2,0,0,0,0|1,0,0]=3 177 B13R1.2431 COC(=O)C1=C(O)C=CC(OC)=C1 BB58-3155 [0,2,0,0,0,0|0,0,0]=2 178 B13R1.2431 COC1=CC=C(O)C(C(=O)NN)=C1 BB58-4999 [0,2,0,0,0,0|1,0,0]=3 179 B13R1.2430 COC1=CC(C(C)=O)=C(OC)C=C1 BB01-6077 [0,2,0,0,0,0|1,0,0]=3 180 B11R1.90 CC1=C(\C=C\C(=O)O)SC=C1 BB01-4109 [0,0,1,1,0,0|2,0,0]=4 181 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 BB01-3764 [0,0,1,1,0,0|2,0,0]=4 182 B13R2.2121 COC1=CC2=C(C=C1)N=C(N)S2 BB01-5948 [0,0,0,1,0,1|2,0,0]=4 183 B13R2.2121 COC1=CC2=C(C=C1)NC(C)=C2 BB01-6538 [0,0,0,1,0,1|2,0,0]=4 184 B13R2.430 O=C(O)C1=CC2=C(C=C1)N=CS2 BB55-8507 [0,1,0,1,0,0|0,1,1]=4 185 B13R2.430 O=C(O)C1=CC2=C(C=C1)NC=N2 BB01-0986 [0,1,0,1,0,0|1,0,1]=4 186 B13R2.430 O=C(O)C1=CC2=C(C=C1)NN=N2 BB20-0034 [0,1,0,1,0,0|2,0,0]=4 187 B13R2.430 O=C(O)C1=CC2=C(C=C1)OCO2 BB17-2187 [0,1,0,1,0,0|0,0,0]=2 188 B13R2.430 O=C(O)C1=CC2=NSN=C2C=C1 BB58-2158 [0,1,0,1,0,0|1,1,0]=4 189 B13R2.430 O=C(O)C1=CC=C2C=CNC2=C1 BB01-0941 [0,1,0,1,0,0|1,0,1]=4 190 B13R2.430 O=C(O)C1=CC=C2NC=CC2=C1 BB01-0995 [0,1,0,1,0,0|1,0,1]=4 191 B13R2.5569 O=C(O)C1=C2C=CNC2=CC=C1 BB01-0994 [0,1,0,1,0,0|1,0,1]=4 192 B13R2.5569 O=C(O)C1=C2OCCC2=CC=C1 BB55-6213 [0,1,0,1,0,0|1,0,0]=3 193 B13R2.573 COC1=C2CCC(=O)C2=CC=C1 BB58-4372 [0,1,0,1,0,0|1,0,0]=3 194 B9R1.35 CC(=O)C1=CC=C(C)O1 BB55-2250 [1,0,0,0,1,0|2,0,0]=4 195 B9R1.35 CC(=O)C1=CC=C(C)S1 BB17-2349 [1,0,0,0,1,0|2,0,0]=4 196 B9R1.35 CC1=CC(C(=O)O)=NN1 BB01-2577 [1,0,0,0,1,0|2,0,0]=4 197 B9R1.35 CC1=CC(C(=O)O)=NO1 BB01-4962 [1,0,0,0,1,0|2,0,0]=4 198 B9R1.35 CC1=CC(C(=O)O)=NO1 BB05-1141 [1,0,0,0,1,0|2,0,0]=4 199 B9R1.35 CC1=CC=C(C(=O)Cl)O1 BB58-1944 [1,0,0,0,1,0|2,0,0]=4 200 B9R1.35 CC1=CC=C(C(=O)Cl)S1 BB20-1586 [1,0,0,0,1,0|2,0,0]=4 201 B9R1.35 CC1=CC=C(C(=O)O)O1 BB58-0337 [1,0,0,0,1,0|1,0,0]=3 202 B9R1.35 CC1=CC=C(C(=O)O)S1 BB55-0510 [1,0,0,0,1,0|1,0,0]=3 203 B9R1.35 CC1=NNC(C(=O)O)=C1 BB01-2833 [1,0,0,0,1,0|2,0,0]=4 204 B9R1.35 CN1C=C(C(=O)O)C=N1 BB05-0076 [1,0,0,0,1,0|2,0,0]=4 205 B9R1.35 CN1C=CC(C(=O)O)=N1 BB05-0012 [1,0,0,0,1,0|2,0,0]=4 206 B9R1.35 O=C(O)C1=CC=C(Br)S1 BB55-0508 [1,0,0,0,1,0|2,0,0]=4 207 B9R1.35 O=C(O)C1=CC=C(Cl)S1 BB55-0509 [1,0,0,0,1,0|2,0,0]=4 208 B9R1.41 CC1=C(C(=O)O)C=CO1 BB57-4813 [1,0,0,0,1,0|1,0,0]=3 209 B9R1.41 CC1=C(C(=O)O)C=NO1 BB55-3624 [1,0,0,0,1,0|2,0,0]=4 210 B9R1.41 CC1=C(C(=O)O)OC=N1 BB01-8336 [1,0,0,0,1,0|2,0,0]=4 211 B9R1.41 CC1=C(C(=O)O)SC=C1 BB01-0916 [1,0,0,0,1,0|1,0,0]=3 212 B9R1.41 CC1=NNC=C1C(=O)O BB01-5991 [1,0,0,0,1,0|2,0,0]=4 213 B9R1.41 CN1C=CC=C1C(=O)O BB01-1072 [1,0,0,0,1,0|1,0,0]=3 214 B9R1.41 CN1C=CN=C1C(=O)O BB57-7197 [1,0,0,0,1,0|2,0,0]=4 215 B9R1.41 CN1C=NC=C1C(=O)O BB55-8119 [1,0,0,0,1,0|2,0,0]=4 216 B9R1.41 CN1N=CC=C1C(=O)O BB01-4745 [1,0,0,0,1,0|2,0,0]=4 217 B9R1.41 CN1N=CC=C1C(=O)O BB05-0013 [1,0,0,0,1,0|2,0,0]=4 218 B9R1.21 CCC1=CC=C(C=O)O1 BB01-6282 [1,0,0,0,1,0|2,0,0]=4 219 B9R1.21 CCC1=CC=C(C=O)S1 BB05-0497 [1,0,0,0,1,0|2,0,0]=4 220 B11R1.157 CC(=O)CC1=NC=CC(C)=C1 BB55-6190 [1,0,0,0,0,1|2,0,0]=4 221 B11R1.157 CC(=O)NC1=CC(C)=CC=C1 BB20-0245 [1,0,0,0,0,1|1,0,0]=3 222 B11R1.157 CC(=O)NC1=CC(Cl)=CC=C1 BB20-0244 [1,0,0,0,0,1|2,0,0]=4 223 B11R1.157 CC(=O)NC1=CC=CC(C)=N1 BB58-5319 [1,0,0,0,0,1|2,0,0]=4 224 B11R1.157 CC(=O)NC1=CC=CC(N)=C1 BB57-6667 [1,0,0,0,0,1|2,0,0]=4 225 B11R1.157 CC1=CC(NC(=N)N)=CC=C1 BB01-2594 [1,0,0,0,0,1|2,0,0]=4 226 B11R1.157 CC1=CC=CC(NC(N)=S)=C1 BB20-1175 [1,0,0,0,0,1|1,1,0]=4 227 B11R1.157 NC(=S)NC1=CC(O)=CC=C1 BB17-0996 [1,0,0,0,0,1|1,1,0]=4 228 B11R1.157 O=C(Cl)CC1=CC(F)=CC=C1 BB20-1584 [1,0,0,0,0,1|2,0,0]=4 229 B11R1.157 O=C(Cl)CC1=CC=CC(O)=C1 BB58-5014 [1,0,0,0,0,1|1,0,0]=3 230 B11R1.157 O=C(O)CC1=CC(F)=CC=C1 BB01-6066 [1,0,0,0,0,1|1,0,0]=3 231 B11R1.3 CCC1=CC=C(C(=O)Cl)C=C1 BB20-1428 [0,0,0,0,1,1|2,0,0]=4 232 B11R1.3 COC1=CC=C(B(O)O)C=C1 BB01-0920 [0,0,0,0,1,1|1,0,1]=4 233 B11R1.3 COC1=CC=C(C(N)=O)C=C1 BB01-2755 [0,0,0,0,1,1|1,0,0]=3 234 B11R1.3 COC1=CC=C(C(N)=S)C=C1 BB17-0865 [0,0,0,0,1,1|1,1,0]=4 235 B11R1.3 COC1=CC=C([N+](=O)[O-])C=C1 BB17-2165 [0,0,0,0,1,1|1,0,1]=4 236 B11R1.3 CSC1=NC=C(C(=O)O)C=N1 BB20-6179 [0,0,0,0,1,1|1,1,0]=4 237 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 BB57-2084 [0,0,0,0,1,1|2,0,0]=4 238 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 BB58-2147 [0,0,0,0,1,1|2,0,0]=4 239 B13R1.643 COC1=CC(OCC(=O)O)=CC=C1 BB55-3497 [0,0,0,0,0,2|0,0,0]=2 240 B13R1.643 COC1=CC=CC(CCC(=O)O)=C1 BB01-7961 [0,0,0,0,0,2|0,0,0]=2