0 B11R1.266 C#CC1=CC=CC(C(C)=O)=C1 BB31-2469 [0,0,0,0,0,0|2,0,1]=3 1 B11R1.266 CCC1=NC=CC(C(=O)O)=C1 BB12-2280 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.266 COC1=CC(C(C)N)=CC=C1 BB05-0763 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.266 N#CC1=CC=CC(C(N)=O)=C1 BB12-1669 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.266 NCC1=CC([N+](=O)[O-])=CC=C1 BB12-2269 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.266 NCC1=CC=CC(C(N)=O)=C1 BB58-1316 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.266 NNC1=NC=CC(C(N)=O)=C1 BB57-3960 [0,0,0,0,0,0|4,0,0]=4 7 B11R1.266 O=C(O)C1=CC(CBr)=CC=C1 BB05-1921 [0,0,0,0,0,0|2,0,0]=2 8 B11R1.266 O=C(O)C1=CC(CO)=CC=C1 BB57-2446 [0,0,0,0,0,0|2,0,0]=2 9 B11R1.266 O=CC1=CC(C(=O)Cl)=CC=C1 BB58-1955 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.113 CC(N)C1=CC=CC(O)=C1 BB57-2921 [1,0,0,0,0,0|2,0,1]=4 11 B10R1.113 CC1=CC=CC(C(C)N)=C1 BB55-1697 [1,0,0,0,0,0|2,0,1]=4 12 B10R1.113 CC1=NC=CC([N+](=O)[O-])=C1 BB54-4400 [1,0,0,0,0,0|2,0,1]=4 13 B10R1.113 N=C(N)C1=CC(Cl)=CC=C1 BB01-7872 [1,0,0,0,0,0|3,0,0]=4 14 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 BB20-4612 [1,0,0,0,0,0|3,0,0]=4 15 B10R1.113 NC1=CC(C(=O)O)=NC=C1 BB54-4685 [1,0,0,0,0,0|2,0,0]=3 16 B10R1.113 NC1=CC=CC(B(O)O)=C1 BB12-2221 [1,0,0,0,0,0|2,0,1]=4 17 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 BB17-0499 [1,0,0,0,0,0|2,0,0]=3 18 B10R1.113 O=C(O)C1=CC(O)=CN=C1 BB01-2808 [1,0,0,0,0,0|1,0,0]=2 19 B10R1.172 CCC1=NC=CC(C=O)=N1 BB58-0533 [1,0,0,0,0,0|3,0,0]=4 20 B10R1.172 COC1=CC(NN)=CC=C1 BB01-6124 [1,0,0,0,0,0|2,0,0]=3 21 B10R1.172 COC1=NC(CO)=CC=N1 BB32-1574 [1,0,0,0,0,0|2,0,1]=4 22 B10R1.172 NCC1=CC(CO)=CC=C1 BB57-3669 [1,0,0,0,0,0|2,0,1]=4 23 B12R1.11 COC1=CC(N)=CC([N+](=O)[O-])=C1 BB12-1977 [0,1,0,0,0,0|1,0,1]=3 24 B12R1.11 COC1=CC([N+](=O)[O-])=CC(N)=C1 BB05-1312 [0,1,0,0,0,0|1,0,1]=3 25 B12R1.56 CCC1=CC(C(=O)O)=CC=C1F BB58-4734 [0,1,0,0,0,0|1,0,0]=2 26 B12R1.56 CNC1=CC(C(=O)O)=CC=C1O BB57-6482 [0,1,0,0,0,0|1,0,0]=2 27 B12R1.56 COC1=C(I)C=CC([N+](=O)[O-])=C1 BB12-4663 [0,1,0,0,0,0|1,0,1]=3 28 B12R1.56 NCC1=C(O)C=CC(C(=O)O)=C1 BB57-4979 [0,1,0,0,0,0|2,0,0]=3 29 B12R1.56 NNC1=CC(C(=O)O)=CC=C1Cl BB56-0613 [0,1,0,0,0,0|2,0,0]=3 30 B12R1.279 CC(=O)C1=CC(N=C=O)=CC=C1 BB01-6564 [0,1,0,0,0,0|2,0,1]=4 31 B12R1.279 CCCC1=NC=CC(C(=O)O)=C1 BB57-6484 [0,1,0,0,0,0|2,0,0]=3 32 B12R1.279 CCOC1=CC(C(=O)Cl)=CC=C1 BB55-5558 [0,1,0,0,0,0|1,0,0]=2 33 B12R1.279 CCOC1=CC=CC(C(C)N)=C1 BB55-1644 [0,1,0,0,0,0|2,0,1]=4 34 B12R1.279 O=C(O)C1=CC(N=C=S)=CC=C1 BB12-1379 [0,1,0,0,0,0|1,0,1]=3 35 B12R1.435 CNC(=O)C1=CC=CC(C#N)=C1 BB12-3385 [0,1,0,0,0,0|3,0,0]=4 36 B12R1.435 CNC(=O)C1=CC=CC(C=O)=C1 BB17-2997 [0,1,0,0,0,0|3,0,0]=4 37 B12R1.435 CNC(=O)C1=CC=CC(CN)=C1 BB57-2441 [0,1,0,0,0,0|3,0,0]=4 38 B12R1.435 COC(=O)C1=CC=CC(CN)=C1 BB20-4654 [0,1,0,0,0,0|2,0,0]=3 39 B12R1.435 COC1=CC(C(=O)CN)=CC=C1 BB26-0152 [0,1,0,0,0,0|1,0,0]=2 40 B12R1.435 COC1=CC(C(=O)CN)=CC=C1 BB58-1431 [0,1,0,0,0,0|1,0,0]=2 41 B12R1.435 COC1=CC=CC(C(=O)CBr)=C1 BB01-6358 [0,1,0,0,0,0|1,0,0]=2 42 B12R1.435 N#CC1=CC(C(=O)NN)=CC=C1 BB12-2651 [0,1,0,0,0,0|3,0,0]=4 43 B12R1.436 COC1=CC=CC(C(C)(C)N)=C1 BB58-2829 [0,1,0,0,0,0|2,0,1]=4 44 B12R1.440 COC1=NC=CC(C(=O)O)=C1C BB32-0066 [0,1,0,0,0,0|1,0,0]=2 45 B12R1.453 COC1=CC(C(=O)O)=C(Cl)C=C1 BB05-4232 [0,1,0,0,0,0|0,0,0]=1 46 B12R1.453 COC1=CC(C(=O)O)=C(O)C=C1 BB12-4643 [0,1,0,0,0,0|0,0,0]=1 47 B12R1.453 COC1=CC([N+](=O)[O-])=C(Br)C=C1 BB55-8760 [0,1,0,0,0,0|1,0,1]=3 48 B12R1.453 COC1=CC([N+](=O)[O-])=C(Cl)C=C1 BB17-0386 [0,1,0,0,0,0|1,0,1]=3 49 B12R1.453 CSC1=NC(C(=O)O)=C(Br)C=N1 BB54-2756 [0,1,0,0,0,0|2,1,0]=4 50 B12R1.453 CSC1=NC=C(Cl)C(C(=O)O)=N1 BB54-1313 [0,1,0,0,0,0|2,1,0]=4 51 B12R1.453 NNC1=CC(C(=O)O)=C(Cl)C=C1 BB17-0985 [0,1,0,0,0,0|2,0,0]=3 52 B10R1.31 CCC1=CC(C(=O)Cl)=CS1 BB55-5695 [0,0,0,0,1,0|3,0,0]=4 53 B10R1.31 CCC1=CC(C(=O)O)=CS1 BB55-0637 [0,0,0,0,1,0|2,0,0]=3 54 B10R1.31 CCC1=CC(C(=O)O)=NN1 BB56-2146 [0,0,0,0,1,0|3,0,0]=4 55 B10R1.31 CCC1=CC(C(=O)O)=NO1 BB55-6238 [0,0,0,0,1,0|3,0,0]=4 56 B10R1.31 CCC1=CC=C(C(=O)Cl)S1 BB55-5709 [0,0,0,0,1,0|3,0,0]=4 57 B10R1.31 CCC1=CC=C(C(=O)O)S1 BB05-0002 [0,0,0,0,1,0|2,0,0]=3 58 B10R1.31 CCC1=CC=C(C(=O)O)S1 BB55-0647 [0,0,0,0,1,0|2,0,0]=3 59 B10R1.31 CCC1=NC(C(=O)O)=CN1 BB90-0132 [0,0,0,0,1,0|3,0,0]=4 60 B10R1.31 CCC1=NC(C(=O)O)=CO1 BB12-3563 [0,0,0,0,1,0|3,0,0]=4 61 B10R1.31 CCC1=NC(C(=O)O)=CS1 BB12-3311 [0,0,0,0,1,0|3,0,0]=4 62 B10R1.31 CCC1=NOC(C(=O)O)=C1 BB05-3825 [0,0,0,0,1,0|3,0,0]=4 63 B10R1.31 CCC1=NOC(C(=O)O)=C1 BB55-3460 [0,0,0,0,1,0|3,0,0]=4 64 B10R1.31 CCN1C=C(C(=O)O)C=N1 BB55-0058 [0,0,0,0,1,0|3,0,0]=4 65 B10R1.31 CCN1C=CC(C(=O)O)=N1 BB01-4866 [0,0,0,0,1,0|3,0,0]=4 66 B10R1.31 COC1=NC=C(C(=O)[O-])S1 BB58-3686 [0,0,0,0,1,0|2,0,1]=4 67 B10R1.31 NCC1=CC=C(C(=O)O)O1 BB58-1060 [0,0,0,0,1,0|3,0,0]=4 68 B10R1.31 O=C(O)C1=CC=C(CO)O1 BB55-3457 [0,0,0,0,1,0|3,0,0]=4 69 B10R1.39 CCC1=C(C(=O)O)NC=N1 BB90-0012 [0,0,0,0,1,0|3,0,0]=4 70 B10R1.39 CCC1=NNC=C1C(=O)O BB57-2172 [0,0,0,0,1,0|3,0,0]=4 71 B12R1.438 CC(=O)NC1=CC(CN)=CC=C1 BB57-3163 [0,0,0,0,0,1|3,0,0]=4 72 B9R1.2 C=CC1=CC(O)=CC=C1 BB58-0330 [2,0,0,0,0,0|1,0,0]=3 73 B9R1.2 CC1=CC(NN)=CC=C1 BB56-2532 [2,0,0,0,0,0|2,0,0]=4 74 B9R1.2 CNC1=CC(C)=CC=C1 BB01-7304 [2,0,0,0,0,0|1,0,1]=4 75 B9R1.2 CNC1=CC(F)=CC=C1 BB01-7291 [2,0,0,0,0,0|2,0,0]=4 76 B9R1.2 N#CC1=CC(O)=CC=C1 BB20-4617 [2,0,0,0,0,0|1,0,1]=4 77 B9R1.2 OCC1=NC(O)=CC=C1 BB57-1045 [2,0,0,0,0,0|1,0,1]=4 78 B9R1.6 O=C(O)C1=CC=CN=N1 BB58-3622 [2,0,0,0,0,0|2,0,0]=4 79 B9R1.6 O=C(O)C1=CC=NC=N1 BB54-3716 [2,0,0,0,0,0|2,0,0]=4 80 B11R1.21 CC(=O)C1=CC(C)=C(C)C=C1 BB55-3428 [1,1,0,0,0,0|1,0,0]=3 81 B11R1.21 CC(=O)C1=CC(N)=C(O)C=C1 BB12-2899 [1,1,0,0,0,0|2,0,0]=4 82 B11R1.21 CC(=O)C1=CC=C(Br)C(O)=C1 BB01-7488 [1,1,0,0,0,0|1,0,0]=3 83 B11R1.21 CC1=C(Cl)C=CC([N+](=O)[O-])=C1 BB17-0545 [1,1,0,0,0,0|1,0,1]=4 84 B11R1.21 CC1=CC=C(C(N)=O)C=C1Br BB57-2924 [1,1,0,0,0,0|2,0,0]=4 85 B11R1.21 CN1C=CC(C(=O)O)=CC1=O BB54-4391 [1,1,0,0,0,0|1,0,1]=4 86 B11R1.21 NC1=C(Br)C=CC(C(=O)O)=C1 BB58-0453 [1,1,0,0,0,0|1,0,0]=3 87 B11R1.21 NC1=C(O)C=C([N+](=O)[O-])C=C1 BB12-1569 [1,1,0,0,0,0|1,0,1]=4 88 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 BB12-4696 [1,1,0,0,0,0|1,0,0]=3 89 B11R1.21 O=[N+]([O-])C1=CC(O)=C(Cl)C=C1 BB54-0005 [1,1,0,0,0,0|1,0,1]=4 90 B11R1.23 CC1=CC(C(=O)NN)=CC=C1 BB12-2533 [1,1,0,0,0,0|1,0,0]=3 91 B11R1.23 COC(=O)C1=CC(Br)=CN=C1 BB01-2813 [1,1,0,0,0,0|2,0,0]=4 92 B11R1.23 COC(=O)C1=NC=CC(O)=C1 BB32-2632 [1,1,0,0,0,0|1,0,0]=3 93 B11R1.23 C\C(=N\O)C1=CC(Br)=CC=C1 BB57-4225 [1,1,0,0,0,0|2,0,0]=4 94 B11R1.23 NCC(=O)C1=CC(O)=CC=C1 BB32-0779 [1,1,0,0,0,0|1,0,0]=3 95 B11R1.23 NNC(=O)C1=CC=CC(F)=C1 BB12-2681 [1,1,0,0,0,0|2,0,0]=4 96 B11R1.74 CC1=CC(=O)C=C(C(=O)O)N1 BB57-2517 [1,1,0,0,0,0|1,0,0]=3 97 B11R1.74 CC1=CC(=O)C=C(C(=O)O)O1 BB57-2516 [1,1,0,0,0,0|1,0,0]=3 98 B11R1.74 CC1=NC(O)=NC(C(=O)O)=C1 BB01-7742 [1,1,0,0,0,0|2,0,0]=4 99 B11R1.74 N=C(N)C1=CC(O)=CC(O)=C1 BB55-7340 [1,1,0,0,0,0|2,0,0]=4 100 B11R1.74 NC1=CC(O)=CC([N+](=O)[O-])=C1 BB05-1028 [1,1,0,0,0,0|1,0,1]=4 101 B11R1.74 O=C(O)C1=CC(O)=NC(O)=C1 BB10-1202 [1,1,0,0,0,0|1,0,0]=3 102 B11R1.159 CC1=C(C(N)=O)C=CC=C1N BB54-3470 [1,1,0,0,0,0|2,0,0]=4 103 B11R1.159 CN1C=CC=C(C(=O)O)C1=O BB12-3383 [1,1,0,0,0,0|1,0,0]=3 104 B11R1.159 NC1=C(O)C(C(=O)O)=CC=C1 BB54-0431 [1,1,0,0,0,0|1,0,0]=3 105 B11R1.159 NC1=CC=CC(C(=O)O)=C1N BB54-3084 [1,1,0,0,0,0|1,0,0]=3 106 B11R1.159 O=C(O)C1=C(O)C(Br)=CC=C1 BB12-4608 [1,1,0,0,0,0|1,0,0]=3 107 B11R1.159 O=C(O)C1=C(O)C(Cl)=CC=C1 BB12-4662 [1,1,0,0,0,0|1,0,0]=3 108 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 BB53-1900 [1,1,0,0,0,0|2,0,0]=4 109 B11R1.167 CC(=O)C1=CC(F)=CC=C1O BB01-7439 [1,1,0,0,0,0|2,0,0]=4 110 B11R1.167 CC1=CC([N+](=O)[O-])=C(O)C=C1 BB01-7555 [1,1,0,0,0,0|1,0,1]=4 111 B11R1.167 CC1=NNC(=O)C(C(=O)O)=C1 BB17-0297 [1,1,0,0,0,0|2,0,0]=4 112 B11R1.167 NC(=O)C1=C(Br)C=CC(I)=C1 BB17-0460 [1,1,0,0,0,0|2,0,0]=4 113 B11R1.167 NC(=O)C1=C(Cl)C=CC(Br)=C1 BB17-0366 [1,1,0,0,0,0|2,0,0]=4 114 B11R1.167 NC(=O)C1=CC(I)=CC=C1Cl BB54-4404 [1,1,0,0,0,0|2,0,0]=4 115 B11R1.167 O=C(O)C1=C(F)C=CC(Br)=N1 BB31-8301 [1,1,0,0,0,0|2,0,0]=4 116 B11R1.189 CCNC1=CC=CC(OC)=C1 BB32-1922 [1,1,0,0,0,0|1,0,1]=4 117 B11R1.189 COC1=CC(CNN)=CC=C1 BB55-6524 [1,1,0,0,0,0|1,0,1]=4 118 B11R1.189 COC1=CC=CC(CCN)=C1 BB12-0768 [1,1,0,0,0,0|1,0,1]=4 119 B11R1.280 CC1=C(C#N)C=C(C=O)C=C1 BB12-1259 [1,1,0,0,0,0|2,0,0]=4 120 B11R1.280 COC1=C(C)C=CC(CO)=C1 BB32-2628 [1,1,0,0,0,0|0,0,1]=3 121 B11R1.280 COC1=C(O)C=CC(C#N)=C1 BB05-0505 [1,1,0,0,0,0|1,0,1]=4 122 B11R1.280 COC1=C(O)C=CC(CO)=C1 BB17-0749 [1,1,0,0,0,0|0,0,1]=3 123 B11R1.280 COC1=CC(C=O)=C(F)C=C1 BB01-6273 [1,1,0,0,0,0|0,0,0]=2 124 B11R1.280 N#CC1=C(F)C=CC(C=O)=C1 BB12-3557 [1,1,0,0,0,0|2,0,0]=4 125 B11R1.280 O=CC1=C(O)C=CC(CCl)=C1 BB57-7172 [1,1,0,0,0,0|2,0,0]=4 126 B11R1.280 O=CC1=CC(CO)=CC=C1O BB55-7415 [1,1,0,0,0,0|2,0,0]=4 127 B11R1.44 CCC1=CC(C(=O)OC)=CS1 BB05-3541 [0,1,0,0,1,0|2,0,0]=4 128 B11R1.48 CCC1=C(Br)C=C(C(=O)O)S1 BB05-1236 [0,1,0,0,1,0|2,0,0]=4 129 B11R1.48 CCC1=C(Br)C=C(C(=O)O)S1 BB55-0645 [0,1,0,0,1,0|2,0,0]=4 130 B11R1.124 CCCC1=CC(C(=O)O)=CS1 BB55-0638 [0,1,0,0,1,0|2,0,0]=4 131 B11R1.124 CCCC1=CC=C(C(=O)O)S1 BB05-2200 [0,1,0,0,1,0|2,0,0]=4 132 B11R1.124 CNCC1=CC=C(C(=O)O)S1 BB58-3645 [0,1,0,0,1,0|2,0,0]=4 133 B11R1.124 COCC1=CC=C(C(=O)O)O1 BB53-1836 [0,1,0,0,1,0|1,0,0]=3 134 B11R1.124 COCC1=CC=C(C(=O)O)S1 BB57-7175 [0,1,0,0,1,0|1,0,0]=3 135 B11R1.124 COCN1C=CC(C(=O)O)=N1 BB05-1948 [0,1,0,0,1,0|2,0,0]=4 136 B11R1.175 CC(C)C1=CC(C(=O)O)=CS1 BB55-0639 [0,1,0,0,1,0|2,0,0]=4 137 B11R1.64 CCC1=C(C)SC=C1C(=O)O BB05-1142 [0,1,0,0,1,0|2,0,0]=4 138 B11R1.64 CCC1=C(C)SC=C1C(=O)O BB55-0636 [0,1,0,0,1,0|2,0,0]=4 139 B13R1.81 CCC1=CC(NC(=O)CCl)=CC=C1 BB01-5330 [0,1,0,0,0,1|2,0,0]=4 140 B13R1.81 COC1=CC=CC(NC(=O)CN)=C1 BB53-1841 [0,1,0,0,0,1|1,0,0]=3 141 B13R1.642 COC1=CC(C(N)C(=O)O)=CC=C1 BB56-0185 [0,1,0,0,0,1|0,0,0]=2 142 B13R1.642 COC1=CC=CC(C(O)C(=O)O)=C1 BB31-5338 [0,1,0,0,0,1|0,0,0]=2 143 B13R1.126 NC1=CC(C(=O)O)=CC([N+](=O)[O-])=C1 BB54-0274 [0,2,0,0,0,0|2,0,0]=4 144 B13R1.298 COC1=C(I)C(Cl)=CC([N+](=O)[O-])=C1 BB17-2798 [0,2,0,0,0,0|1,0,1]=4 145 B13R1.298 COC1=C(N)C(Cl)=CC([N+](=O)[O-])=C1 BB17-2784 [0,2,0,0,0,0|1,0,1]=4 146 B13R1.298 COC1=C(O)C(N)=CC(C(=O)O)=C1 BB54-5524 [0,2,0,0,0,0|0,0,0]=2 147 B13R1.299 COC1=CC(Br)=CC(C(=O)O)=C1O BB17-1057 [0,2,0,0,0,0|0,0,0]=2 148 B13R1.299 COC1=CC(Cl)=CC(C(=O)O)=C1O BB17-0680 [0,2,0,0,0,0|0,0,0]=2 149 B13R1.313 COC1=CC(NN)=CC([N+](=O)[O-])=C1 BB54-5718 [0,2,0,0,0,0|1,0,1]=4 150 B13R1.437 COC1=CC(C(=O)O)=C(O)C(Cl)=C1 BB12-4642 [0,2,0,0,0,0|0,0,0]=2 151 B13R1.437 COC1=CC(C(C)=O)=C(O)C(Cl)=C1 BB54-5011 [0,2,0,0,0,0|1,0,0]=3 152 B13R1.437 COC1=CC([N+](=O)[O-])=C(N)C(Cl)=C1 BB17-2755 [0,2,0,0,0,0|1,0,1]=4 153 B13R1.13 CC(=O)C1=CC(C(C)C)=CC=C1C BB17-2377 [0,2,0,0,0,0|2,0,0]=4 154 B13R1.13 CC(C)C1=CC(C(=O)O)=C(O)C=C1 BB17-0621 [0,2,0,0,0,0|1,0,0]=3 155 B13R1.13 CC1=CC=C([N+](=O)[O-])C=C1C(=O)O BB12-2263 [0,2,0,0,0,0|2,0,0]=4 156 B13R1.13 NC1=CC=C(C(=O)O)C=C1[N+](=O)[O-] BB54-0082 [0,2,0,0,0,0|2,0,0]=4 157 B13R1.13 O=C(O)C1=CC([N+](=O)[O-])=C(O)C=C1 BB01-7670 [0,2,0,0,0,0|2,0,0]=4 158 B13R1.49 COC(=O)C1=CC(CN)=C(O)C=C1 BB57-5719 [0,2,0,0,0,0|2,0,0]=4 159 B13R1.354 CCCC1=C(O)C=CC(C(=O)O)=C1 BB57-5840 [0,2,0,0,0,0|1,0,0]=3 160 B13R1.3091 [C-]#[N+]C1=C(OC)C=C([N+](=O)[O-])C=C1 BB56-1774 [0,2,0,0,0,0|1,0,1]=4 161 B13R1.345 CC(C)(C)C1=CC(C(=O)O)=NC=C1 BB31-5864 [0,2,0,0,0,0|2,0,0]=4 162 B13R1.543 COC(=O)C1=CC=CC(B(O)O)=C1 BB01-0953 [0,2,0,0,0,0|1,0,1]=4 163 B13R1.543 COC(=O)C1=CC=CC(C(=O)O)=N1 BB01-2457 [0,2,0,0,0,0|1,0,0]=3 164 B13R1.543 N\C(=N/O)C1=CC(C(=O)O)=CC=C1 BB01-3939 [0,2,0,0,0,0|2,0,0]=4 165 B13R1.3801 NC1=C(C(=O)O)C=CC=C1[N+](=O)[O-] BB54-0837 [0,2,0,0,0,0|2,0,0]=4 166 B13R1.3801 O=C(O)C1=C(O)C([N+](=O)[O-])=CC=C1 BB54-1832 [0,2,0,0,0,0|2,0,0]=4 167 B13R1.374 COC(=O)C1=CC(CC#N)=CC=C1 BB54-4796 [0,2,0,0,0,0|1,0,1]=4 168 B13R1.387 CCOC1=CC(C(=O)O)=C(O)C=C1 BB17-1068 [0,2,0,0,0,0|0,0,0]=2 169 B13R1.568 CCCOC1=CC(C(=O)Cl)=CC=C1 BB55-5559 [0,2,0,0,0,0|1,0,0]=3 170 B13R1.568 CCCOC1=CC(C(=O)O)=CC=C1 BB54-0443 [0,2,0,0,0,0|0,0,0]=2 171 B13R1.568 CCCOC1=CC=CC(C(N)=O)=C1 BB17-0468 [0,2,0,0,0,0|1,0,0]=3 172 B13R1.568 NCCOC1=CC(C(=O)O)=CC=C1 BB54-2934 [0,2,0,0,0,0|0,0,0]=2 173 B13R1.460 COC1=CC(C(=O)CC#N)=CC=C1 BB54-4374 [0,2,0,0,0,0|1,0,0]=3 174 B13R1.2431 CCC(=O)C1=CC(OC)=CC=C1O BB54-4718 [0,2,0,0,0,0|1,0,0]=3 175 B13R1.2431 COC(=O)C1=CC(NN)=CC=C1Cl BB57-6535 [0,2,0,0,0,0|2,0,0]=4 176 B13R1.2430 COC1=C(C(=O)O)C=C(C=O)C=C1 BB57-7054 [0,2,0,0,0,0|2,0,0]=4 177 B13R1.2430 COC1=CC=C(CCl)C=C1C(=O)O BB57-5790 [0,2,0,0,0,0|2,0,0]=4 178 B13R1.2430 COC1=CC=C(OC)C([N+](=O)[O-])=C1 BB17-0329 [0,2,0,0,0,0|1,0,1]=4 179 B11R1.37 COC1=C(C=O)C=C(O)C=C1 BB57-5890 [0,0,1,1,0,0|2,0,0]=4 180 B11R1.90 CN1N=CC=C1\C=C\C(=O)O BB05-3478 [0,0,1,1,0,0|2,0,0]=4 181 B11R1.89 CN1C=CC=C1C(=O)C(=O)O BB54-4908 [0,0,1,1,0,0|2,0,0]=4 182 B13R2.581 CCC1=C2NC(=O)CC2=CC=C1 BB17-0212 [0,0,0,1,0,1|2,0,0]=4 183 B13R2.2038 COC1=CC(CC2CO2)=CC=C1 BB54-3478 [0,0,0,1,0,1|1,0,1]=4 184 B13R2.2121 CCC1=CC=C2NC(=O)CC2=C1 BB17-0213 [0,0,0,1,0,1|2,0,0]=4 185 B13R2.2121 COC1=CC=C2NC(C)=NC2=C1 BB57-3663 [0,0,0,1,0,1|2,0,0]=4 186 B13R2.2121 COC1=CC=C2NC(S)=NC2=C1 BB12-1347 [0,0,0,1,0,1|1,1,0]=4 187 B13R2.2121 COC1=CC=C2SC(S)=NC2=C1 BB55-7897 [0,0,0,1,0,1|0,2,0]=4 188 B13R2.430 O=C(O)C1=CC2=C(C=C1)CCC2 BB57-5496 [0,1,0,1,0,0|1,0,0]=3 189 B13R2.430 O=C(O)C1=CC2=NON=C2C=C1 BB54-5302 [0,1,0,1,0,0|1,0,0]=3 190 B13R2.430 O=C(O)C1=CC=C2C=NNC2=C1 BB01-2605 [0,1,0,1,0,0|1,0,1]=4 191 B13R2.430 O=C(O)C1=CC=C2N=CNC2=C1 BB12-2808 [0,1,0,1,0,0|1,0,1]=4 192 B13R2.5569 O=C(O)C1=CC=CC2=C1N=CN2 BB54-3247 [0,1,0,1,0,0|1,0,1]=4 193 B13R2.669 NNC1=CC2=C(C=C1)COC2=O BB54-4317 [0,1,0,1,0,0|2,0,0]=4 194 B9R1.35 CC1=CC(C(=O)Cl)=CS1 BB55-5691 [1,0,0,0,1,0|2,0,0]=4 195 B9R1.35 CC1=CC(C(=O)O)=CS1 BB55-0634 [1,0,0,0,1,0|1,0,0]=3 196 B9R1.35 CC1=CC=C(C(=O)Cl)S1 BB55-5571 [1,0,0,0,1,0|2,0,0]=4 197 B9R1.35 CC1=CNC(C(=O)O)=N1 BB12-3671 [1,0,0,0,1,0|2,0,0]=4 198 B9R1.35 CC1=NC(C(=O)O)=CS1 BB01-2835 [1,0,0,0,1,0|2,0,0]=4 199 B9R1.35 CC1=NC=C(C(=O)O)N1 BB90-0104 [1,0,0,0,1,0|2,0,0]=4 200 B9R1.35 CC1=NC=C(C(=O)O)S1 BB57-5871 [1,0,0,0,1,0|2,0,0]=4 201 B9R1.35 CC1=NOC(C(=O)O)=C1 BB05-2690 [1,0,0,0,1,0|2,0,0]=4 202 B9R1.35 CC1=NOC(C(=O)O)=C1 BB54-1988 [1,0,0,0,1,0|2,0,0]=4 203 B9R1.35 CN1C=C(C(=O)O)C=N1 BB54-3240 [1,0,0,0,1,0|2,0,0]=4 204 B9R1.35 CN1C=CC(C(=O)O)=N1 BB54-1623 [1,0,0,0,1,0|2,0,0]=4 205 B9R1.35 CN1C=NC(C(=O)O)=C1 BB54-2031 [1,0,0,0,1,0|2,0,0]=4 206 B9R1.35 O=C(O)C1=CC(Br)=CS1 BB05-1234 [1,0,0,0,1,0|2,0,0]=4 207 B9R1.35 O=C(O)C1=CC(Br)=CS1 BB55-0644 [1,0,0,0,1,0|2,0,0]=4 208 B9R1.41 CC1=C(C(=O)O)C=CN1 BB57-2151 [1,0,0,0,1,0|1,0,0]=3 209 B9R1.41 CC1=C(C(=O)O)N=CN1 BB12-2055 [1,0,0,0,1,0|2,0,0]=4 210 B9R1.41 CC1=C(C(=O)O)N=CO1 BB57-4109 [1,0,0,0,1,0|2,0,0]=4 211 B9R1.41 CC1=C(C(=O)O)N=CS1 BB26-0189 [1,0,0,0,1,0|2,0,0]=4 212 B9R1.41 CC1=C(C(=O)O)N=CS1 BB58-0096 [1,0,0,0,1,0|2,0,0]=4 213 B9R1.41 CC1=C(C(=O)O)NC=N1 BB12-3121 [1,0,0,0,1,0|2,0,0]=4 214 B9R1.41 CC1=C(C(=O)O)SC=N1 BB12-3519 [1,0,0,0,1,0|2,0,0]=4 215 B9R1.41 CC1=NOC=C1C(=O)O BB54-4442 [1,0,0,0,1,0|2,0,0]=4 216 B9R1.41 NC1=C(C(=O)O)SC=C1 BB53-1404 [1,0,0,0,1,0|2,0,0]=4 217 B9R1.21 COC1=NC=C(C=O)S1 BB55-8397 [1,0,0,0,1,0|2,0,0]=4 218 B11R1.157 CC(=O)NC1=CC(Br)=CC=C1 BB57-1173 [1,0,0,0,0,1|2,0,0]=4 219 B11R1.157 CC(=O)OC1=CC(F)=CC=C1 BB12-2255 [1,0,0,0,0,1|2,0,0]=4 220 B11R1.157 CC1=CC(NC(=N)N)=CC=C1 BB57-2953 [1,0,0,0,0,1|2,0,0]=4 221 B11R1.3 COC1=CC=C(C(=N)N)C=C1 BB58-0024 [0,0,0,0,1,1|2,0,0]=4 222 B11R1.3 COC1=NC=C(C(=O)O)C=C1 BB54-0843 [0,0,0,0,1,1|0,0,0]=2 223 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 BB56-2538 [0,0,0,0,1,1|2,0,0]=4 224 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 BB12-3514 [0,0,0,0,1,1|2,0,0]=4 225 B13R1.643 COC1=CC(CNC(N)=O)=CC=C1 BB01-7617 [0,0,0,0,0,2|1,0,0]=3 226 B13R1.643 COC1=CC(OCC(=O)Cl)=CC=C1 BB55-5749 [0,0,0,0,0,2|1,0,0]=3