0 B11R1.3 CNC1=CC=C(N(C)C)C=C1 BB32-2491 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.3 COC1=CC=C(C(=N)N)C=C1 BB58-0024 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.3 COC1=CC=C(C(C)N)C=C1 BB05-0764 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.3 COC1=NC=C(C(=O)O)C=C1 BB54-0843 [0,0,0,0,0,0|1,0,0]=1 4 B11R1.3 NC(=O)C1=CC=C(C=O)C=C1 BB12-1599 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.3 NC(=O)C1=CC=C(CCl)C=C1 BB53-1358 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 BB12-2672 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 BB56-2538 [0,0,0,0,0,0|2,0,0]=2 8 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 BB12-3514 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.3 OCC1=CC=C(B(O)O)C=C1 BB12-2258 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.3 C=CC1=CC=C(CC)C=C1 BB01-8156 [1,0,0,0,0,0|2,0,0]=3 11 B10R1.3 CCC1=CC=C(NN)C=C1 BB01-8045 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.3 CCC1=CC=C(NN)C=C1 BB56-0994 [1,0,0,0,0,0|3,0,0]=4 13 B10R1.3 COC1=CC=C(NN)C=C1 BB01-6100 [1,0,0,0,0,0|2,0,0]=3 14 B10R1.3 COC1=CC=C(NN)C=C1 BB56-2536 [1,0,0,0,0,0|2,0,0]=3 15 B10R1.3 COC1=NC=C(C=O)C=N1 BB54-4202 [1,0,0,0,0,0|2,0,0]=3 16 B10R1.3 NCC1=CC=C(CO)C=C1 BB12-1471 [1,0,0,0,0,0|2,0,1]=4 17 B10R1.3 [C-]#[N+]C1=CC=C(CC)C=C1 BB56-1198 [1,0,0,0,0,0|3,0,0]=4 18 B10R1.13 CC(=O)C1=CC=C(I)C=C1 BB17-2376 [1,0,0,0,0,0|2,0,0]=3 19 B10R1.13 CC(O)C1=CC=C(N)C=C1 BB12-2291 [1,0,0,0,0,0|2,0,1]=4 20 B10R1.13 CC1=CC=C(C(=N)N)C=C1 BB20-3270 [1,0,0,0,0,0|2,0,0]=3 21 B10R1.13 NC(=O)C1=CC=C(N)N=C1 BB57-6415 [1,0,0,0,0,0|3,0,0]=4 22 B10R1.13 NC1=CC=C(S(=O)O)C=C1 BB57-6605 [1,0,0,0,0,0|2,0,0]=3 23 B10R1.13 NC1=NC=C(C(=O)O)C=C1 BB01-7654 [1,0,0,0,0,0|2,0,0]=3 24 B10R1.13 O=C(O)C1=CC=C(Cl)N=N1 BB55-6488 [1,0,0,0,0,0|3,0,0]=4 25 B10R1.13 O=C(O)C1=CC=C(O)C=N1 BB56-1848 [1,0,0,0,0,0|1,0,0]=2 26 B10R1.13 O=C(O)C1=NC=C(F)C=N1 BB31-1339 [1,0,0,0,0,0|3,0,0]=4 27 B10R1.13 O=C1C=CC(C(=O)O)=CO1 BB26-0398 [1,0,0,0,0,0|1,0,1]=3 28 B10R1.13 O=C1C=CC(C(=O)O)=NN1 BB12-2030 [1,0,0,0,0,0|2,0,1]=4 29 B12R1.5 C#CC(=O)C1=CC=C(OC)C=C1 BB54-5201 [0,1,0,0,0,0|1,0,0]=2 30 B12R1.5 CCC(=O)C1=CC=C(C#N)C=C1 BB54-5210 [0,1,0,0,0,0|3,0,0]=4 31 B12R1.5 CCC1=CC=C(C(=O)NN)N=C1 BB17-2220 [0,1,0,0,0,0|3,0,0]=4 32 B12R1.5 CNC(=O)C1=CC=C(CCl)C=C1 BB12-3362 [0,1,0,0,0,0|3,0,0]=4 33 B12R1.5 CNC(=O)C1=CC=C(CN)C=C1 BB12-3364 [0,1,0,0,0,0|3,0,0]=4 34 B12R1.5 COC(=O)C1=CC=C(CBr)N=C1 BB58-0697 [0,1,0,0,0,0|3,0,0]=4 35 B12R1.5 COC(=O)C1=CC=C(CCl)C=C1 BB12-2994 [0,1,0,0,0,0|2,0,0]=3 36 B12R1.5 COC(=O)C1=CC=C(CN)N=C1 BB58-0692 [0,1,0,0,0,0|3,0,0]=4 37 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 BB26-0170 [0,1,0,0,0,0|1,0,0]=2 38 B12R1.5 CSC1=CC=C(C(N)CO)C=C1 BB56-2165 [0,1,0,0,0,0|1,1,1]=4 39 B12R1.5 N#CC1=CC=C(C(=O)NN)C=C1 BB12-2652 [0,1,0,0,0,0|3,0,0]=4 40 B12R1.6 CSC1=CC=C(S(=O)(=O)Cl)C=C1 BB56-2219 [0,1,0,0,0,0|1,1,1]=4 41 B12R1.48 CNC1=CC=C([N+](=O)[O-])C=C1N BB12-0977 [0,1,0,0,0,0|2,0,1]=4 42 B12R1.48 CNC1=CC=C([N+](=O)[O-])C=C1N BB53-1389 [0,1,0,0,0,0|2,0,1]=4 43 B12R1.48 COC1=C(Cl)C=C(C(=O)O)C=C1 BB54-4504 [0,1,0,0,0,0|0,0,0]=1 44 B12R1.48 COC1=C(F)C=C(C(C)=O)C=C1 BB53-1298 [0,1,0,0,0,0|1,0,0]=2 45 B12R1.48 COC1=C(F)C=C(C(C)N)C=C1 BB53-1497 [0,1,0,0,0,0|2,0,1]=4 46 B12R1.48 COC1=C(N)C=C(C(C)=O)C=C1 BB12-0014 [0,1,0,0,0,0|1,0,0]=2 47 B12R1.48 COC1=CNC(C(=O)O)=CC1=O BB26-0368 [0,1,0,0,0,0|1,0,0]=2 48 B12R1.48 COC1=COC(C(=O)O)=CC1=O BB26-0367 [0,1,0,0,0,0|1,0,0]=2 49 B12R1.113 CC(=O)C1=CC=C(N=C=O)C=C1 BB01-6587 [0,1,0,0,0,0|2,0,1]=4 50 B12R1.113 CC(=O)C1=CC=C(N=C=S)C=C1 BB53-1311 [0,1,0,0,0,0|2,0,1]=4 51 B12R1.113 CNCC1=CC=C(C(=O)O)C=C1 BB12-2998 [0,1,0,0,0,0|1,0,0]=2 52 B12R1.113 COCC1=CC=C(C(=O)O)C=C1 BB58-2784 [0,1,0,0,0,0|0,0,0]=1 53 B12R1.256 CC(C)C1=CC=C(C(=N)N)C=C1 BB01-8171 [0,1,0,0,0,0|3,0,0]=4 54 B12R1.256 CC(N)C1=CC=C(C(=O)O)C=C1 BB31-9136 [0,1,0,0,0,0|1,0,0]=2 55 B12R1.256 CC(O)C1=CC=C([N+](=O)[O-])C=C1 BB57-4690 [0,1,0,0,0,0|2,0,1]=4 56 B12R1.256 CN(C)C1=CC=C([N+](=O)[O-])C=C1 BB17-0745 [0,1,0,0,0,0|2,0,1]=4 57 B12R1.256 CN(C)C1=NC=C(C(=O)O)C=C1 BB12-3628 [0,1,0,0,0,0|2,0,0]=3 58 B12R1.452 COC1=CC(N)=C(C(C)=O)C=C1 BB32-1283 [0,1,0,0,0,0|1,0,0]=2 59 B12R1.452 COC1=NC(N)=C([N+](=O)[O-])C=C1 BB54-0842 [0,1,0,0,0,0|2,0,1]=4 60 B10R1.31 CCC1=CC(C(=O)Cl)=CS1 BB55-5695 [0,0,0,0,1,0|3,0,0]=4 61 B10R1.31 CCC1=CC(C(=O)O)=CS1 BB55-0637 [0,0,0,0,1,0|2,0,0]=3 62 B10R1.31 CCC1=CC(C(=O)O)=NN1 BB56-2146 [0,0,0,0,1,0|3,0,0]=4 63 B10R1.31 CCC1=CC(C(=O)O)=NO1 BB55-6238 [0,0,0,0,1,0|3,0,0]=4 64 B10R1.31 CCC1=CC=C(C(=O)Cl)S1 BB55-5709 [0,0,0,0,1,0|3,0,0]=4 65 B10R1.31 CCC1=CC=C(C(=O)O)S1 BB05-0002 [0,0,0,0,1,0|2,0,0]=3 66 B10R1.31 CCC1=CC=C(C(=O)O)S1 BB55-0647 [0,0,0,0,1,0|2,0,0]=3 67 B10R1.31 CCC1=NC(C(=O)O)=CN1 BB90-0132 [0,0,0,0,1,0|3,0,0]=4 68 B10R1.31 CCC1=NC(C(=O)O)=CO1 BB12-3563 [0,0,0,0,1,0|3,0,0]=4 69 B10R1.31 CCC1=NC(C(=O)O)=CS1 BB12-3311 [0,0,0,0,1,0|3,0,0]=4 70 B10R1.31 CCC1=NOC(C(=O)O)=C1 BB05-3825 [0,0,0,0,1,0|3,0,0]=4 71 B10R1.31 CCC1=NOC(C(=O)O)=C1 BB55-3460 [0,0,0,0,1,0|3,0,0]=4 72 B10R1.31 CCN1C=C(C(=O)O)C=N1 BB55-0058 [0,0,0,0,1,0|3,0,0]=4 73 B10R1.31 CCN1C=CC(C(=O)O)=N1 BB01-4866 [0,0,0,0,1,0|3,0,0]=4 74 B10R1.31 COC1=NC=C(C(=O)[O-])S1 BB58-3686 [0,0,0,0,1,0|2,0,1]=4 75 B10R1.31 NCC1=CC=C(C(=O)O)O1 BB58-1060 [0,0,0,0,1,0|3,0,0]=4 76 B10R1.31 O=C(O)C1=CC=C(CO)O1 BB55-3457 [0,0,0,0,1,0|3,0,0]=4 77 B12R1.4 CCC1=CC=C(CC(=O)O)C=C1 BB55-6334 [0,0,0,0,0,1|1,0,0]=2 78 B12R1.4 COC1=CC=C(NC(=N)N)C=C1 BB57-2956 [0,0,0,0,0,1|2,0,0]=3 79 B9R1.1 CC1=CC=C(CO)C=N1 BB58-3092 [2,0,0,0,0,0|1,0,1]=4 80 B9R1.1 CC1=CN=C(C=O)C=C1 BB12-2174 [2,0,0,0,0,0|1,0,0]=3 81 B9R1.1 CC1=CN=C(C=O)C=N1 BB58-1329 [2,0,0,0,0,0|2,0,0]=4 82 B9R1.1 NCC1=CC=C(O)C=C1 BB12-1603 [2,0,0,0,0,0|1,0,1]=4 83 B9R1.1 OCC1=CC=C(O)N=C1 BB57-1801 [2,0,0,0,0,0|1,0,1]=4 84 B9R1.6 O=C(O)C1=CC=CN=N1 BB58-3622 [2,0,0,0,0,0|2,0,0]=4 85 B9R1.6 O=C(O)C1=CC=NC=N1 BB54-3716 [2,0,0,0,0,0|2,0,0]=4 86 B11R1.83 COC1=CC=C(CNN)C=C1 BB55-6542 [1,1,0,0,0,0|1,0,1]=4 87 B11R1.83 COC1=CC=C(\C=N/O)C=C1 BB01-7427 [1,1,0,0,0,0|0,0,0]=2 88 B11R1.83 [C-]#[N+]C1=CC=C(OCC)C=C1 BB56-1768 [1,1,0,0,0,0|2,0,0]=4 89 B11R1.83 [C-]#[N+]CC1=CC=C(OC)C=C1 BB56-2858 [1,1,0,0,0,0|1,0,1]=4 90 B11R1.279 COC1=C(Cl)C=C(NN)C=C1 BB56-0919 [1,1,0,0,0,0|2,0,0]=4 91 B11R1.279 COC1=C(I)C=C(C=O)C=C1 BB17-1449 [1,1,0,0,0,0|0,0,0]=2 92 B11R1.279 COC1=C(O)C=C(CN)C=C1 BB54-0027 [1,1,0,0,0,0|1,0,1]=4 93 B11R1.279 COC1=CC(C)=C(CN)C=C1 BB55-8670 [1,1,0,0,0,0|1,0,1]=4 94 B11R1.279 COC1=CC=C(C#N)C=C1O BB54-1520 [1,1,0,0,0,0|1,0,1]=4 95 B11R1.279 COC1=CNC(CO)=CC1=O BB26-0375 [1,1,0,0,0,0|1,0,1]=4 96 B11R1.279 COC1=COC(CO)=CC1=O BB26-0372 [1,1,0,0,0,0|1,0,1]=4 97 B11R1.279 COC1=COC(CO)=CC1=O BB58-0116 [1,1,0,0,0,0|1,0,1]=4 98 B11R1.279 [C-]#[N+]C1=CC(Cl)=C(OC)C=C1 BB56-1215 [1,1,0,0,0,0|2,0,0]=4 99 B11R1.21 CC(=O)C1=CC(C)=C(C)C=C1 BB55-3428 [1,1,0,0,0,0|1,0,0]=3 100 B11R1.21 CC(=O)C1=CC(N)=C(O)C=C1 BB12-2899 [1,1,0,0,0,0|1,0,0]=3 101 B11R1.21 CC(=O)C1=CC=C(Br)C(O)=C1 BB01-7488 [1,1,0,0,0,0|2,0,0]=4 102 B11R1.21 CC1=C(Br)C=C([N+](=O)[O-])C=C1 BB17-0720 [1,1,0,0,0,0|1,0,1]=4 103 B11R1.21 CC1=CC=C(C(N)=O)C=C1Br BB57-2924 [1,1,0,0,0,0|1,0,0]=3 104 B11R1.21 CN1C=CC(C(=O)O)=CC1=O BB54-4391 [1,1,0,0,0,0|1,0,0]=3 105 B11R1.21 NC1=C(Br)C=CC(C(=O)O)=C1 BB58-0453 [1,1,0,0,0,0|1,0,0]=3 106 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 BB12-4696 [1,1,0,0,0,0|1,0,0]=3 107 B11R1.21 O=[N+]([O-])C1=CC(I)=C(O)C=C1 BB57-5844 [1,1,0,0,0,0|1,0,1]=4 108 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 BB53-4156 [1,1,0,0,0,0|1,0,0]=3 109 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 BB12-2577 [1,1,0,0,0,0|1,0,0]=3 110 B11R1.22 CC1=CC=C(C(N)CO)C=C1 BB56-2094 [1,1,0,0,0,0|1,0,1]=4 111 B11R1.22 CC1=CC=C([C@H](N)CO)C=C1 BB32-1985 [1,1,0,0,0,0|1,0,1]=4 112 B11R1.22 CC1=CC=C(\C(N)=N\O)C=C1 BB12-3477 [1,1,0,0,0,0|1,0,0]=3 113 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 BB17-2353 [1,1,0,0,0,0|2,0,0]=4 114 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 BB12-1843 [1,1,0,0,0,0|2,0,0]=4 115 B11R1.22 COC(=O)C1=CC=C(Cl)N=C1 BB57-0237 [1,1,0,0,0,0|2,0,0]=4 116 B11R1.22 COC(=O)C1=CC=C(O)C=N1 BB56-2624 [1,1,0,0,0,0|1,0,0]=3 117 B11R1.22 COC(=O)C1=NC=C(N)C=C1 BB31-1465 [1,1,0,0,0,0|2,0,0]=4 118 B11R1.22 COC(=O)C1=NC=C(O)N=C1 BB54-2899 [1,1,0,0,0,0|2,0,0]=4 119 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 BB26-0169 [1,1,0,0,0,0|2,0,0]=4 120 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 BB01-7056 [1,1,0,0,0,0|2,0,0]=4 121 B11R1.22 NCC(O)C1=CC=C(O)C=C1 BB57-6723 [1,1,0,0,0,0|1,0,1]=4 122 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 BB12-2695 [1,1,0,0,0,0|2,0,0]=4 123 B11R1.22 NNC(=O)C1=CC=C(I)C=C1 BB17-2382 [1,1,0,0,0,0|2,0,0]=4 124 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 BB01-6328 [1,1,0,0,0,0|2,0,0]=4 125 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 BB53-4155 [1,1,0,0,0,0|2,0,0]=4 126 B11R1.22 O=C(CBr)C1=CC=C(I)C=C1 BB20-3112 [1,1,0,0,0,0|2,0,0]=4 127 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 BB01-6260 [1,1,0,0,0,0|2,0,0]=4 128 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 BB57-6308 [1,1,0,0,0,0|0,0,1]=3 129 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 BB12-2243 [1,1,0,0,0,0|1,0,0]=3 130 B11R1.166 CC1=CC(C)=C(C(=O)O)C=N1 BB57-1814 [1,1,0,0,0,0|1,0,0]=3 131 B11R1.166 NC1=C(C(=O)O)C=NC(O)=N1 BB12-4164 [1,1,0,0,0,0|2,0,0]=4 132 B11R1.166 NC1=CC(Br)=C(C(=O)O)C=C1 BB17-0728 [1,1,0,0,0,0|1,0,0]=3 133 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 BB20-4599 [1,1,0,0,0,0|1,0,0]=3 134 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 BB12-2552 [1,1,0,0,0,0|1,0,0]=3 135 B11R1.166 O=C(O)C1=C(O)C=C(O)N=C1 BB12-2178 [1,1,0,0,0,0|1,0,0]=3 136 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Cl BB12-2212 [1,1,0,0,0,0|2,0,0]=4 137 B11R1.166 O=[N+]([O-])C1=C(O)C=C(O)C=C1 BB55-7325 [1,1,0,0,0,0|1,0,1]=4 138 B11R1.44 CCC1=CC(C(=O)OC)=CS1 BB05-3541 [0,1,0,0,1,0|2,0,0]=4 139 B11R1.48 CCC1=C(Br)C=C(C(=O)O)S1 BB05-1236 [0,1,0,0,1,0|2,0,0]=4 140 B11R1.48 CCC1=C(Br)C=C(C(=O)O)S1 BB55-0645 [0,1,0,0,1,0|2,0,0]=4 141 B11R1.124 CCCC1=CC(C(=O)O)=CS1 BB55-0638 [0,1,0,0,1,0|2,0,0]=4 142 B11R1.124 CCCC1=CC=C(C(=O)O)S1 BB05-2200 [0,1,0,0,1,0|2,0,0]=4 143 B11R1.124 CNCC1=CC=C(C(=O)O)S1 BB58-3645 [0,1,0,0,1,0|2,0,0]=4 144 B11R1.124 COCC1=CC=C(C(=O)O)O1 BB53-1836 [0,1,0,0,1,0|1,0,0]=3 145 B11R1.124 COCC1=CC=C(C(=O)O)S1 BB57-7175 [0,1,0,0,1,0|1,0,0]=3 146 B11R1.124 COCN1C=CC(C(=O)O)=N1 BB05-1948 [0,1,0,0,1,0|2,0,0]=4 147 B11R1.175 CC(C)C1=CC(C(=O)O)=CS1 BB55-0639 [0,1,0,0,1,0|2,0,0]=4 148 B13R1.5 CCC1=CC=C(NC(=O)CBr)C=C1 BB17-0234 [0,1,0,0,0,1|2,0,0]=4 149 B13R1.5 COC1=CC=C(CC(N)CO)C=C1 BB31-3467 [0,1,0,0,0,1|1,0,1]=4 150 B13R1.5 COC1=CC=C(C\C(N)=N\O)C=C1 BB01-3934 [0,1,0,0,0,1|1,0,0]=3 151 B13R1.35 COC1=CC=C(CC(=O)O)C=C1C BB56-0509 [0,1,0,0,0,1|0,0,0]=2 152 B13R1.35 COC1=CC=C(NC(C)=O)C=C1N BB55-4804 [0,1,0,0,0,1|1,0,0]=3 153 B13R1.36 CCC1=CC=C(C(N)C(=O)O)C=C1 BB56-0235 [0,1,0,0,0,1|1,0,0]=3 154 B13R1.36 COC1=CC=C(C(N)C(=O)O)C=C1 BB56-0264 [0,1,0,0,0,1|0,0,0]=2 155 B13R1.36 CSC1=CC=C(C(N)C(=O)O)C=C1 BB56-0269 [0,1,0,0,0,1|0,1,0]=3 156 B13R1.142 CCOC1=CC=C(CC(=O)Cl)C=C1 BB01-8261 [0,1,0,0,0,1|1,0,0]=3 157 B13R1.142 CCOC1=CC=C(CC(=O)O)C=C1 BB56-0010 [0,1,0,0,0,1|0,0,0]=2 158 B13R1.142 CCOC1=CC=C(NC(N)=S)C=C1 BB01-7610 [0,1,0,0,0,1|1,1,0]=4 159 B13R1.142 CNCC1=CC=C(NC(C)=O)C=C1 BB32-3596 [0,1,0,0,0,1|2,0,0]=4 160 B13R1.585 CC(=O)NC1=CC=C(C(C)=O)C=C1 BB12-1266 [0,1,0,0,0,1|2,0,0]=4 161 B13R1.585 O=C(O)CC1=CC=C([N+](=O)[O-])C=C1 BB12-4738 [0,1,0,0,0,1|2,0,0]=4 162 B13R1.653 COC1=CC(Br)=C(CC(=O)O)C=C1 BB56-1063 [0,1,0,0,0,1|0,0,0]=2 163 B13R1.653 COC1=CC(Cl)=C(CC(=O)O)C=C1 BB57-0258 [0,1,0,0,0,1|0,0,0]=2 164 B13R1.39 COC1=CC=C(\C(C#N)=C/[O-])C=C1 BB10-0859 [0,2,0,0,0,0|1,0,1]=4 165 B13R1.95 CCC(=O)C1=C(O)C=C(OC)C=C1 BB54-4799 [0,2,0,0,0,0|1,0,0]=3 166 B13R1.139 CCOC1=CC=C(C(N)CO)C=C1 BB56-2098 [0,2,0,0,0,0|1,0,1]=4 167 B13R1.139 CNCC1=CC=C(C(=O)NC)C=C1 BB12-2997 [0,2,0,0,0,0|2,0,0]=4 168 B13R1.139 COC(=O)C1=CC=C(N=C=O)C=C1 BB01-6523 [0,2,0,0,0,0|1,0,1]=4 169 B13R1.139 COC(=O)C1=CC=C(N=C=S)C=C1 BB53-1306 [0,2,0,0,0,0|1,0,1]=4 170 B13R1.187 COC1=CC=C(S(=O)(=O)NN)C=C1 BB55-2174 [0,2,0,0,0,0|1,0,1]=4 171 B13R1.452 CCOC(=O)C1=CC=C(CCl)C=C1 BB12-2992 [0,2,0,0,0,0|2,0,0]=4 172 B13R1.537 CCC(=O)C1=CC=C(N(C)C)C=C1 BB20-0388 [0,2,0,0,0,0|2,0,0]=4 173 B13R1.537 CN(C)C1=CC=C(\C(N)=N\O)C=C1 BB01-3936 [0,2,0,0,0,0|2,0,0]=4 174 B13R1.537 COC(=O)C1=CC=C(C(=O)O)C=C1 BB01-7001 [0,2,0,0,0,0|0,0,0]=2 175 B13R1.537 COC(C)C1=CC=C(B(O)O)C=C1 BB55-7849 [0,2,0,0,0,0|1,0,1]=4 176 B13R1.537 NNC(=O)C1=CC=C(C(=O)O)C=C1 BB05-4307 [0,2,0,0,0,0|2,0,0]=4 177 B13R1.537 N\C(=N/O)C1=CC=C(C(=O)O)C=C1 BB12-3479 [0,2,0,0,0,0|2,0,0]=4 178 B13R1.3088 COC1=C(Cl)C=C(C(N)CO)C=C1 BB56-2222 [0,2,0,0,0,0|1,0,1]=4 179 B13R1.3088 COC1=C(F)C=C(C(=O)CBr)C=C1 BB58-2052 [0,2,0,0,0,0|1,0,0]=3 180 B13R1.3088 COC1=C(F)C=C(C(=O)NN)C=C1 BB53-4196 [0,2,0,0,0,0|1,0,0]=3 181 B13R1.38 COC1=CC=C(S(=O)(=O)Cl)C=C1F BB56-2212 [0,2,0,0,0,0|1,0,1]=4 182 B13R1.120 CN(C)C1=C(N)C=C(C(=O)O)C=C1 BB12-4764 [0,2,0,0,0,0|1,0,0]=3 183 B13R1.120 NC1=CC([N+](=O)[O-])=CC=C1C(=O)O BB54-0343 [0,2,0,0,0,0|2,0,0]=4 184 B13R1.144 CCOC1=C(Br)C=C(C(=O)O)C=C1 BB17-0477 [0,2,0,0,0,0|0,0,0]=2 185 B13R1.144 CCOC1=C(Cl)C=C(C(N)=O)C=C1 BB17-0480 [0,2,0,0,0,0|1,0,0]=3 186 B13R1.144 CCOC1=C(F)C=C(C(C)=O)C=C1 BB53-1297 [0,2,0,0,0,0|1,0,0]=3 187 B13R1.652 COC1=CC(O)=C(C(C)=O)C=C1Cl BB54-4755 [0,2,0,0,0,0|1,0,0]=3 188 B13R1.652 COC1=CN(C)C(C(=O)O)=CC1=O BB26-0366 [0,2,0,0,0,0|1,0,0]=3 189 B13R1.3091 COC1=C(C#N)C=C([N+](=O)[O-])C=C1 BB12-0213 [0,2,0,0,0,0|1,0,1]=4 190 B13R1.3380 COC1=C(Br)C=C(C(=O)O)C=C1N BB17-0385 [0,2,0,0,0,0|0,0,0]=2 191 B13R1.3380 COC1=C(Br)C=C([N+](=O)[O-])C=C1Br BB54-1785 [0,2,0,0,0,0|1,0,1]=4 192 B13R1.3380 COC1=C(C)C=C(C(C)=O)C=C1C BB55-3430 [0,2,0,0,0,0|1,0,0]=3 193 B13R1.3380 COC1=C(Cl)C=C(C(=O)O)C=C1Cl BB17-0481 [0,2,0,0,0,0|0,0,0]=2 194 B13R1.3380 COC1=C(Cl)C=C(C(=O)O)C=C1N BB54-4841 [0,2,0,0,0,0|0,0,0]=2 195 B13R1.3380 COC1=C(Cl)C=C(C(N)=O)C=C1Cl BB17-0482 [0,2,0,0,0,0|1,0,0]=3 196 B13R1.74 C#CCOC1=CC=C(C(C)=O)C=C1 BB31-7983 [0,2,0,0,0,0|1,0,0]=3 197 B13R1.74 CCCOC1=CC=C(C(=O)Cl)C=C1 BB55-5560 [0,2,0,0,0,0|1,0,0]=3 198 B13R1.74 CCCOC1=CC=C(C(N)=O)C=C1 BB17-0472 [0,2,0,0,0,0|1,0,0]=3 199 B13R1.74 N#CCOC1=CC=C([N+](=O)[O-])C=C1 BB12-1852 [0,2,0,0,0,0|1,0,1]=4 200 B13R1.74 NCCOC1=CC=C(C(=O)O)C=C1 BB55-4855 [0,2,0,0,0,0|0,0,0]=2 201 B11R1.159 CN1C=CC=C(C(=O)O)C1=O BB12-3383 [0,0,1,1,0,0|2,0,0]=4 202 B13R2.2121 CCC1=CC=C2NC(=O)CC2=C1 BB17-0213 [0,0,0,1,0,1|2,0,0]=4 203 B13R2.2121 COC1=CC=C2NC(C)=NC2=C1 BB57-3663 [0,0,0,1,0,1|2,0,0]=4 204 B13R2.2121 COC1=CC=C2NC(S)=NC2=C1 BB12-1347 [0,0,0,1,0,1|1,1,0]=4 205 B13R2.2121 COC1=CC=C2SC(S)=NC2=C1 BB55-7897 [0,0,0,1,0,1|1,1,0]=4 206 B13R2.2130 COC1=CC=C2C(=O)COC2=C1 BB12-2913 [0,1,0,1,0,0|0,0,0]=2 207 B13R2.2130 N#CC1=CC=C2C(=O)OCC2=C1 BB01-7903 [0,1,0,1,0,0|2,0,0]=4 208 B13R2.430 O=C(O)C1=CC2=C(C=C1)CCC2 BB57-5496 [0,1,0,1,0,0|1,0,0]=3 209 B13R2.430 O=C(O)C1=CC2=NON=C2C=C1 BB54-5302 [0,1,0,1,0,0|1,0,0]=3 210 B13R2.430 O=C(O)C1=CC=C2C=NNC2=C1 BB01-2605 [0,1,0,1,0,0|2,0,0]=4 211 B13R2.430 O=C(O)C1=CC=C2N=CNC2=C1 BB12-2808 [0,1,0,1,0,0|1,0,1]=4 212 B9R1.21 COC1=NC=C(C=O)S1 BB55-8397 [1,0,0,0,1,0|2,0,0]=4 213 B9R1.35 CC1=CC(C(=O)Cl)=CS1 BB55-5691 [1,0,0,0,1,0|2,0,0]=4 214 B9R1.35 CC1=CC(C(=O)O)=CS1 BB55-0634 [1,0,0,0,1,0|1,0,0]=3 215 B9R1.35 CC1=CC=C(C(=O)Cl)S1 BB55-5571 [1,0,0,0,1,0|2,0,0]=4 216 B9R1.35 CC1=CNC(C(=O)O)=N1 BB12-3671 [1,0,0,0,1,0|2,0,0]=4 217 B9R1.35 CC1=NC(C(=O)O)=CS1 BB01-2835 [1,0,0,0,1,0|2,0,0]=4 218 B9R1.35 CC1=NC=C(C(=O)O)N1 BB90-0104 [1,0,0,0,1,0|2,0,0]=4 219 B9R1.35 CC1=NC=C(C(=O)O)S1 BB57-5871 [1,0,0,0,1,0|2,0,0]=4 220 B9R1.35 CC1=NOC(C(=O)O)=C1 BB05-2690 [1,0,0,0,1,0|2,0,0]=4 221 B9R1.35 CC1=NOC(C(=O)O)=C1 BB54-1988 [1,0,0,0,1,0|2,0,0]=4 222 B9R1.35 CN1C=C(C(=O)O)C=N1 BB54-3240 [1,0,0,0,1,0|2,0,0]=4 223 B9R1.35 CN1C=CC(C(=O)O)=N1 BB54-1623 [1,0,0,0,1,0|2,0,0]=4 224 B9R1.35 CN1C=NC(C(=O)O)=C1 BB54-2031 [1,0,0,0,1,0|2,0,0]=4 225 B9R1.35 O=C(O)C1=CC(Br)=CS1 BB05-1234 [1,0,0,0,1,0|2,0,0]=4 226 B9R1.35 O=C(O)C1=CC(Br)=CS1 BB55-0644 [1,0,0,0,1,0|2,0,0]=4 227 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 BB12-3713 [1,0,0,0,0,1|1,0,0]=3 228 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 BB12-3000 [1,0,0,0,0,1|2,0,0]=4 229 B11R1.20 CC(=O)OC1=CC=C(N)C=C1 BB31-9516 [1,0,0,0,0,1|2,0,0]=4 230 B11R1.20 CC1=CC=C(CC(N)=S)C=C1 BB20-4553 [1,0,0,0,0,1|1,1,0]=4 231 B11R1.20 CC1=CC=C(NC(=N)N)C=C1 BB57-2955 [1,0,0,0,0,1|2,0,0]=4 232 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 BB12-4748 [1,0,0,0,0,1|1,0,0]=3 233 B11R1.20 O=C(O)CC1=CC=C(Cl)N=C1 BB54-4732 [1,0,0,0,0,1|2,0,0]=4 234 B11R1.20 O=C1C=CN(CC(=O)O)C=C1 BB55-5163 [1,0,0,0,0,1|1,0,1]=4 235 B11R1.266 CCC1=NC=CC(C(=O)O)=C1 BB12-2280 [0,0,0,0,1,1|1,0,0]=3 236 B11R1.266 O=C(O)C1=CC(CBr)=CC=C1 BB05-1921 [0,0,0,0,1,1|2,0,0]=4 237 B11R1.266 O=C(O)C1=CC(CO)=CC=C1 BB57-2446 [0,0,0,0,1,1|2,0,0]=4 238 B13R1.3 CCC1=CC=C(OCC(=O)Cl)C=C1 BB55-5190 [0,0,0,0,0,2|2,0,0]=4 239 B13R1.3 CCC1=CC=C(OCC(N)=O)C=C1 BB17-0399 [0,0,0,0,0,2|2,0,0]=4 240 B13R1.3 COC1=CC=C(CCC(C)=O)C=C1 BB54-1640 [0,0,0,0,0,2|1,0,0]=3 241 B13R1.3 COC1=CC=C(CNC(N)=O)C=C1 BB01-7607 [0,0,0,0,0,2|1,0,0]=3 242 B13R1.3 COC1=CC=C(NCC(=O)O)C=C1 BB58-0807 [0,0,0,0,0,2|0,0,0]=2 243 B13R1.3 COC1=CC=C(OCC(=O)Cl)C=C1 BB55-5195 [0,0,0,0,0,2|1,0,0]=3 244 B13R1.3 CSC1=CC=C(OCC(=O)O)C=C1 BB55-4256 [0,0,0,0,0,2|0,1,0]=3 245 B13R1.3 O=CC1=CC=C(OCC(=O)O)C=C1 BB56-1280 [0,0,0,0,0,2|2,0,0]=4