0 B12R1.43 C=C(Cl)C(=O)OC1=CC=CC=C1 CNP0300036.0 [0,0,0,0,0,0|3,0,0]=3 1 B12R1.43 CC(=CC1=CC=CC=C1)C(=O)O CNP0011910.0 [0,0,0,0,0,0|1,0,1]=2 2 B12R1.43 CC(=CC1=CC=CC=C1)[N+](=O)[O-] CNP0485758.0 [0,0,0,0,0,0|2,0,2]=4 3 B12R1.43 CC(=O)C(=CC1=CC=CC=C1)C CNP0379625.0 [0,0,0,0,0,0|2,0,1]=3 4 B12R1.43 CC(=O)C(=O)CC1=CC=CC=C1 CNP0588983.0 [0,0,0,0,0,0|1,0,0]=1 5 B12R1.43 CC(=O)C(=O)NC1=CC=CC=C1 CNP0033092.0 [0,0,0,0,0,0|2,0,0]=2 6 B12R1.43 CC(=O)[C@H](O)CC1=CC=CC=C1 CNP0353502.1 [0,0,0,0,0,0|1,0,2]=3 7 B12R1.43 CC(C)C(=O)OC1=CC=CC=C1 CNP0524813.0 [0,0,0,0,0,0|3,0,1]=4 8 B12R1.43 CC(Cl)C(=O)NC1=CC=CC=C1 CNP0267765.0 [0,0,0,0,0,0|3,0,1]=4 9 B12R1.43 CN(C)C(=O)CC1=CC=CC=C1 CNP0250069.0 [0,0,0,0,0,0|3,0,0]=3 10 B12R1.43 CN(C)C(=O)NC1=CC=CC=C1 CNP0348092.0 [0,0,0,0,0,0|4,0,0]=4 11 B12R1.43 CN(O)C(=O)CC1=CC=CC=C1 CNP0104612.0 [0,0,0,0,0,0|2,0,0]=2 12 B12R1.43 C[C@@H](CC1=CC=CC=C1)C(=O)O CNP0456241.2 [0,0,0,0,0,0|1,0,1]=2 13 B12R1.43 C[C@@H](Cl)C(=O)NC1=CC=CC=C1 CNP0267765.1 [0,0,0,0,0,0|3,0,1]=4 14 B12R1.43 C[C@@H](O)[C@H](O)CC1=CC=CC=C1 CNP0193877.1 [0,0,0,0,0,0|1,0,3]=4 15 B12R1.43 C[C@@H](OC1=CC=CC=C1)C(=O)O CNP0058094.2 [0,0,0,0,0,0|2,0,1]=3 16 B12R1.43 C[C@H](CC1=CC=CC=C1)C(=O)O CNP0456241.1 [0,0,0,0,0,0|1,0,1]=2 17 B12R1.43 C[C@H](NC1=CC=CC=C1)C(=O)O CNP0587408.1 [0,0,0,0,0,0|2,0,1]=3 18 B12R1.43 C[C@H](O)[C@@H](N)CC1=CC=CC=C1 CNP0596460.1 [0,0,0,0,0,0|2,0,2]=4 19 B12R1.43 C[C@H](O)[C@@H](O)CC1=CC=CC=C1 CNP0193877.2 [0,0,0,0,0,0|1,0,3]=4 20 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)O CNP0058094.1 [0,0,0,0,0,0|2,0,1]=3 21 B12R1.43 NC(=CC1=CC=CC=C1)C(=O)O CNP0502610.0 [0,0,0,0,0,0|1,0,1]=2 22 B12R1.43 NC(=O)C(=O)CC1=CC=CC=C1 CNP0113488.0 [0,0,0,0,0,0|1,0,0]=1 23 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 CNP0349122.1 [0,0,0,0,0,0|2,0,1]=3 24 B12R1.43 NC(=O)[C@H](O)CC1=CC=CC=C1 CNP0541348.1 [0,0,0,0,0,0|1,0,2]=3 25 B12R1.43 N[C@@H](CC1=CC=CC=C1)B(O)O CNP0504436.1 [0,0,0,0,0,0|2,0,2]=4 26 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O CNP0193965.1 [0,0,0,0,0,0|1,0,1]=2 27 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(O)O CNP0571051.1 [0,0,0,0,0,0|1,0,3]=4 28 B12R1.43 N[C@@H](CC1=CC=CC=N1)C(=O)O CNP0184941.1 [0,0,0,0,0,0|2,0,1]=3 29 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O CNP0351562.2 [0,0,0,0,0,0|2,0,1]=3 30 B12R1.43 N[C@@H](CC1=CCC=CC1)C(=O)O CNP0307488.2 [0,0,0,0,0,0|1,0,3]=4 31 B12R1.43 N[C@@H](CC1C=CC=CC1)C(=O)O CNP0486521.1 [0,0,0,0,0,0|1,0,3]=4 32 B12R1.43 N[C@@H](OC1=CC=CC=C1)C(=O)O CNP0333196.1 [0,0,0,0,0,0|2,0,1]=3 33 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O CNP0193965.2 [0,0,0,0,0,0|1,0,1]=2 34 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O CNP0351562.1 [0,0,0,0,0,0|2,0,1]=3 35 B12R1.43 N[C@H](CC1=CCC=CC1)C(=O)O CNP0307488.1 [0,0,0,0,0,0|1,0,3]=4 36 B12R1.43 N[C@H](CC1C=CCC=C1)C(=O)O CNP0412664.1 [0,0,0,0,0,0|1,0,3]=4 37 B12R1.43 O=C(O)C(=CC1=CC=CC=C1)O CNP0271736.0 [0,0,0,0,0,0|0,0,2]=2 38 B12R1.43 O=C(O)C(=CC1=CC=CC=C1)S CNP0539031.0 [0,0,0,0,0,0|0,1,1]=2 39 B12R1.43 O=C(O)C(=CC1=CC=NC=C1)O CNP0276347.0 [0,0,0,0,0,0|1,0,2]=3 40 B12R1.43 O=C(O)C(=O)C=C1C=CNC=C1 CNP0483926.0 [0,0,0,0,0,0|1,0,1]=2 41 B12R1.43 O=C(O)C(=O)CC1=CC=CC=C1 CNP0177093.0 [0,0,0,0,0,0|0,0,0]=0 42 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 CNP0213490.2 [0,0,0,0,0,0|0,0,2]=2 43 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 CNP0213490.1 [0,0,0,0,0,0|0,0,2]=2 44 B11R1.40 CC(=CC1=CC=CC=C1)C=O CNP0107200.0 [1,0,0,0,0,0|1,0,1]=3 45 B11R1.40 CCC(=O)CC1=CC=CC=C1 CNP0003461.0 [1,0,0,0,0,0|1,0,1]=3 46 B11R1.40 CCC(=O)NC1=CC=CC=C1 CNP0215971.0 [1,0,0,0,0,0|2,0,1]=4 47 B11R1.40 CCC(=O)OC1=CC=CC=C1 CNP0392371.0 [1,0,0,0,0,0|2,0,1]=4 48 B11R1.40 CN(C=O)NC1=CC=CC=C1 CNP0115944.0 [1,0,0,0,0,0|3,0,0]=4 49 B11R1.40 CNC(=O)CC1=CC=CC=C1 CNP0400808.0 [1,0,0,0,0,0|2,0,0]=3 50 B11R1.40 COC(=O)CC1=CC=CC=C1 CNP0328249.0 [1,0,0,0,0,0|2,0,0]=3 51 B11R1.40 C[C@@H](C=O)CC1=CC=CC=C1 CNP0101541.1 [1,0,0,0,0,0|1,0,1]=3 52 B11R1.40 N#CC(=O)CC1=CC=CC=C1 CNP0017972.0 [1,0,0,0,0,0|1,0,1]=3 53 B11R1.40 NC(C=O)CC1=CC=CC=C1 CNP0540734.1 [1,0,0,0,0,0|1,0,1]=3 54 B11R1.40 NC(C=O)CC1=CC=CC=C1 CNP0545581.1 [1,0,0,0,0,0|1,0,1]=3 55 B11R1.40 NC(C=O)CC1=CC=CC=C1 CNP0559492.0 [1,0,0,0,0,0|1,0,1]=3 56 B11R1.40 NC(C=O)CC1=CC=CC=C1 CNP0578552.0 [1,0,0,0,0,0|1,0,1]=3 57 B11R1.40 NNC(=O)NC1=CC=CC=C1 CNP0536638.0 [1,0,0,0,0,0|3,0,0]=4 58 B11R1.40 NOC(=O)NC1=CC=CC=C1 CNP0579392.0 [1,0,0,0,0,0|3,0,0]=4 59 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 CNP0254447.2 [1,0,0,0,0,0|1,0,2]=4 60 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 CNP0254447.1 [1,0,0,0,0,0|1,0,2]=4 61 B11R1.40 O=C(CC1=CC=CC=C1)NO CNP0275698.0 [1,0,0,0,0,0|1,0,0]=2 62 B11R1.40 O=C(CO)NC1=CC=CC=C1 CNP0492856.0 [1,0,0,0,0,0|1,0,1]=3 63 B11R1.40 O=CC(=CC1=CC=CC=C1)Br CNP0581236.0 [1,0,0,0,0,0|1,0,1]=3 64 B11R1.40 OC[C@@H](O)CC1=CC=CC=C1 CNP0380924.2 [1,0,0,0,0,0|0,0,3]=4 65 B11R1.40 OC[C@H](O)CC1=CC=CC=C1 CNP0380924.1 [1,0,0,0,0,0|0,0,3]=4 66 B11R1.40 ON=C(S)CC1=CC=CC=C1 CNP0359280.0 [1,0,0,0,0,0|1,1,0]=3 67 B11R1.91 CC(=CCC1=CC=CC=C1)C CNP0096741.0 [1,0,0,0,0,0|2,0,0]=3 68 B11R1.91 CC(=O)C=CC1=CC=CC=C1 CNP0331521.0 [1,0,0,0,0,0|1,0,1]=3 69 B11R1.91 CC(=O)CCC1=CC=CC=C1 CNP0182353.0 [1,0,0,0,0,0|1,0,1]=3 70 B11R1.91 CC(=O)OCC1=CC=CC=C1 CNP0361944.0 [1,0,0,0,0,0|2,0,0]=3 71 B11R1.91 CC(=O)ONC1=CC=CC=C1 CNP0256903.0 [1,0,0,0,0,0|3,0,0]=4 72 B11R1.91 CC(O)C=CC1=CC=CC=C1 CNP0091112.0 [1,0,0,0,0,0|1,0,2]=4 73 B11R1.91 C[C@H](O)CCC1=CC=CC=C1 CNP0154609.1 [1,0,0,0,0,0|1,0,2]=4 74 B11R1.91 NC(=O)C=CC1=CC=CC=C1 CNP0277735.0 [1,0,0,0,0,0|1,0,1]=3 75 B11R1.91 NC(=O)CCC1=CC=CC=C1 CNP0190126.0 [1,0,0,0,0,0|1,0,1]=3 76 B11R1.91 NC(=O)COC1=CC=CC=C1 CNP0071085.0 [1,0,0,0,0,0|2,0,1]=4 77 B11R1.91 NC(=O)NCC1=CC=CC=C1 CNP0071045.0 [1,0,0,0,0,0|2,0,0]=3 78 B11R1.91 NC(=O)NNC1=CC=CC=C1 CNP0514672.0 [1,0,0,0,0,0|3,0,0]=4 79 B11R1.91 NC(=S)NCC1=CC=CC=C1 CNP0114859.0 [1,0,0,0,0,0|2,1,0]=4 80 B11R1.91 O=C(Cl)C=CC1=CC=CC=C1 CNP0314597.0 [1,0,0,0,0,0|1,0,1]=3 81 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 CNP0330120.0 [1,0,0,0,0,0|1,0,1]=3 82 B11R1.91 O=C(O)C#CC1=CC=CC=C1 CNP0082220.0 [1,0,0,0,0,0|0,0,2]=3 83 B11R1.91 O=C(O)C=CC1=CC=CC=C1 CNP0390407.0 [1,0,0,0,0,0|0,0,1]=2 84 B11R1.91 O=C(O)C=CC1=CC=CN=C1 CNP0471683.0 [1,0,0,0,0,0|1,0,1]=3 85 B11R1.91 O=C(O)C=CC1C=CC=CC1 CNP0538582.0 [1,0,0,0,0,0|0,0,3]=4 86 B11R1.91 O=C(O)CCC1=CC=CC=C1 CNP0298094.0 [1,0,0,0,0,0|0,0,1]=2 87 B11R1.91 O=C(O)CNC1=CC=CC=C1 CNP0458877.0 [1,0,0,0,0,0|1,0,1]=3 88 B11R1.91 O=C(O)COC1=CC=CC=C1 CNP0231951.0 [1,0,0,0,0,0|1,0,1]=3 89 B11R1.91 O=C(O)NCC1=CC=CC=C1 CNP0176098.0 [1,0,0,0,0,0|1,0,0]=2 90 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 CNP0605764.0 [1,0,0,0,0,0|1,0,2]=4 91 B11R1.91 OB(O)CCC1=CC=CC=C1 CNP0528561.0 [1,0,0,0,0,0|1,0,2]=4 92 B13R1.133 CC(=CC1=CC=C(C=C1)I)C(=O)O CNP0438539.0 [0,1,0,0,0,0|1,0,1]=3 93 B13R1.133 CC(=O)C(=O)NC1=CC=C(C=C1)Br CNP0058879.0 [0,1,0,0,0,0|2,0,0]=3 94 B13R1.133 CC(=O)C(=O)NC1=CC=C(C=C1)C CNP0188373.0 [0,1,0,0,0,0|2,0,0]=3 95 B13R1.133 CC(=O)C(=O)NC1=CC=C(C=C1)Cl CNP0065177.0 [0,1,0,0,0,0|2,0,0]=3 96 B13R1.133 CC(=O)C(=O)NC1=CC=C(C=C1)I CNP0050257.0 [0,1,0,0,0,0|2,0,0]=3 97 B13R1.133 CC(=O)C(=S)NC1=CC=C(C=C1)Br CNP0032596.0 [0,1,0,0,0,0|2,1,0]=4 98 B13R1.133 CC(=O)C(=S)NC1=CC=C(C=C1)C CNP0407432.0 [0,1,0,0,0,0|2,1,0]=4 99 B13R1.133 CC(=O)C(=S)NC1=CC=C(C=C1)Cl CNP0046230.0 [0,1,0,0,0,0|2,1,0]=4 100 B13R1.133 CC(=O)C(=S)NC1=CC=C(C=C1)I CNP0058183.0 [0,1,0,0,0,0|2,1,0]=4 101 B13R1.133 CC(=O)C(O)CC1=CC=C(C=C1)O CNP0103595.0 [0,1,0,0,0,0|1,0,2]=4 102 B13R1.133 CC(=O)[C@@H](O)CC1=CC=C(C=C1)O CNP0103595.1 [0,1,0,0,0,0|1,0,2]=4 103 B13R1.133 CC(OC1=CC=C(C=C1)Cl)C(=O)O CNP0119097.0 [0,1,0,0,0,0|2,0,1]=4 104 B13R1.133 CC1=CC=C(C=C1)CC(=O)C(=O)O CNP0582979.0 [0,1,0,0,0,0|0,0,0]=1 105 B13R1.133 C[C@@H](OC1=CC=C(C=C1)O)C(=O)O CNP0437991.1 [0,1,0,0,0,0|2,0,1]=4 106 B13R1.133 N=C(CC1=CC=C(C=C1)O)C(=O)O CNP0435695.0 [0,1,0,0,0,0|1,0,0]=2 107 B13R1.133 NC(=O)[C@@H](N)CC1=CC=C(C=C1)O CNP0021095.1 [0,1,0,0,0,0|2,0,1]=4 108 B13R1.133 NC(CC1=CNC(=O)C=C1)C(=O)O CNP0485960.0 [0,1,0,0,0,0|2,0,1]=4 109 B13R1.133 NC1=CC=C(C=C1)C[C@@H](N)C(=O)O CNP0187252.1 [0,1,0,0,0,0|1,0,1]=3 110 B13R1.133 NC1=CC=C(C=C1)C[C@H](N)C(=O)O CNP0187252.2 [0,1,0,0,0,0|1,0,1]=3 111 B13R1.133 NN(CC1=CC=C(C=C1)O)C(=O)O CNP0565576.0 [0,1,0,0,0,0|2,0,0]=3 112 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Br)C(=O)O CNP0133258.1 [0,1,0,0,0,0|1,0,1]=3 113 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O CNP0293334.2 [0,1,0,0,0,0|1,0,1]=3 114 B13R1.133 N[C@@H](CC1=CC=C(C=C1)I)C(=O)O CNP0601134.1 [0,1,0,0,0,0|1,0,1]=3 115 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)O CNP0116237.1 [0,1,0,0,0,0|1,0,1]=3 116 B13R1.133 N[C@@H](CC1=CC=C(C=N1)O)C(=O)O CNP0228825.1 [0,1,0,0,0,0|2,0,1]=4 117 B13R1.133 N[C@@H](CC1=CC=C(N=C1)O)C(=O)O CNP0202206.1 [0,1,0,0,0,0|2,0,1]=4 118 B13R1.133 N[C@H](CC1=CC=C(C=C1)Br)C(=O)O CNP0133258.2 [0,1,0,0,0,0|1,0,1]=3 119 B13R1.133 N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O CNP0293334.1 [0,1,0,0,0,0|1,0,1]=3 120 B13R1.133 N[C@H](CC1=CC=C(C=C1)I)C(=O)O CNP0601134.2 [0,1,0,0,0,0|1,0,1]=3 121 B13R1.133 N[C@H](CC1=CC=C(C=C1)O)C(=O)O CNP0116237.2 [0,1,0,0,0,0|1,0,1]=3 122 B13R1.133 O=C(O)C(=CC1=CC=C(C=C1)O)O CNP0185306.0 [0,1,0,0,0,0|0,0,2]=3 123 B13R1.133 O=C(O)C(=O)CC1=CC=C(C=C1)O CNP0412003.0 [0,1,0,0,0,0|0,0,0]=1 124 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)O CNP0177541.1 [0,1,0,0,0,0|0,0,2]=3 125 B13R1.133 O=C(O)[C@@H](S)CC1=CC=C(C=C1)I CNP0587186.1 [0,1,0,0,0,0|0,1,1]=3 126 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)O CNP0177541.2 [0,1,0,0,0,0|0,0,2]=3 127 B13R1.135 CCC(=O)[C@H](O)CC1=CC=CC=C1 CNP0117427.1 [0,1,0,0,0,0|1,0,2]=4 128 B13R1.135 COC(=O)C(=CC1=CC=CC=C1)N CNP0597874.0 [0,1,0,0,0,0|1,0,1]=3 129 B13R1.135 COC(=O)C(=O)CC1=CC=CC=C1 CNP0210071.0 [0,1,0,0,0,0|0,0,0]=1 130 B13R1.135 COC(=O)[C@@H](C)NC1=CC=CC=C1 CNP0588654.2 [0,1,0,0,0,0|2,0,1]=4 131 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 CNP0261581.3 [0,1,0,0,0,0|1,0,1]=3 132 B13R1.135 COC(=O)[C@@H](N)OC1=CC=CC=C1 CNP0170775.1 [0,1,0,0,0,0|2,0,1]=4 133 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 CNP0387243.1 [0,1,0,0,0,0|0,0,2]=3 134 B13R1.135 COC(=O)[C@H](C)NC1=CC=CC=C1 CNP0588654.1 [0,1,0,0,0,0|2,0,1]=4 135 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 CNP0261581.2 [0,1,0,0,0,0|1,0,1]=3 136 B13R1.135 COC(=O)[C@H](O)CC1=CC=CC=C1 CNP0387243.2 [0,1,0,0,0,0|0,0,2]=3 137 B13R1.135 N[C@@H](CC1=CC=CC=C1)C(=O)CCl CNP0508331.1 [0,1,0,0,0,0|2,0,1]=4 138 B13R1.135 N[C@@H](CC1=CC=CC=C1)C(=O)NI CNP0171534.1 [0,1,0,0,0,0|2,0,1]=4 139 B13R1.148 CC1=CC=CC(=C1)C[C@H](N)C(=O)O CNP0530805.1 [0,1,0,0,0,0|1,0,1]=3 140 B13R1.148 C[C@@H](CC1=CC=CC(=C1)O)C(=O)O CNP0356280.1 [0,1,0,0,0,0|1,0,1]=3 141 B13R1.148 N[C@@H](CC1=CC=CC(=C1)O)C(=O)O CNP0201266.1 [0,1,0,0,0,0|1,0,1]=3 142 B13R1.148 O=C(O)C(=O)CC1=CC=CC(=C1)O CNP0150167.0 [0,1,0,0,0,0|0,0,0]=1 143 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@@H](N)C(=O)O CNP0350308.4 [0,1,0,0,0,0|1,0,1]=3 144 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@@H](O)C(=O)O CNP0463734.1 [0,1,0,0,0,0|0,0,2]=3 145 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@H](N)C(=O)O CNP0350308.2 [0,1,0,0,0,0|1,0,1]=3 146 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@H](O)C(=O)O CNP0463734.3 [0,1,0,0,0,0|0,0,2]=3 147 B13R1.152 C[C@H](C1=CC=CC=C1)[C@@H](N)C(=O)O CNP0350308.3 [0,1,0,0,0,0|1,0,1]=3 148 B13R1.152 C[C@H](C1=CC=CC=C1)[C@@H](O)C(=O)O CNP0463734.4 [0,1,0,0,0,0|0,0,2]=3 149 B13R1.152 C[C@H](C1=CC=CC=C1)[C@H](N)C(=O)O CNP0350308.1 [0,1,0,0,0,0|1,0,1]=3 150 B13R1.152 C[C@H](C1=CC=CC=C1)[C@H](O)C(=O)O CNP0463734.2 [0,1,0,0,0,0|0,0,2]=3 151 B13R1.152 N[C@@H](C(=O)O)[C@@H](O)C1=CC=CC=C1 CNP0361341.4 [0,1,0,0,0,0|1,0,1]=3 152 B13R1.152 N[C@@H](C(=O)O)[C@H](O)C1=CC=CC=C1 CNP0361341.2 [0,1,0,0,0,0|1,0,1]=3 153 B13R1.152 N[C@H](C(=O)O)C(O)C1=CC=CC=C1 CNP0361341.1 [0,1,0,0,0,0|1,0,1]=3 154 B13R1.152 N[C@H](C(=O)O)[C@@H](O)C1=CC=CC=C1 CNP0361341.3 [0,1,0,0,0,0|1,0,1]=3 155 B13R1.152 N[C@H](C(=O)O)[C@H](O)C1=CC=CC=C1 CNP0361341.5 [0,1,0,0,0,0|1,0,1]=3 156 B13R1.152 N[C@H](C1=CC=CC=C1)[C@@H](O)C(=O)O CNP0214237.1 [0,1,0,0,0,0|0,0,2]=3 157 B13R1.152 O=C(O)C(=C(Br)C1=CC=CC=C1)Br CNP0267224.0 [0,1,0,0,0,0|1,0,1]=3 158 B13R1.152 O=C(O)C(=O)C(O)C1=CC=CC=C1 CNP0056799.0 [0,1,0,0,0,0|0,0,0]=1 159 B13R1.152 O=C(O)[C@@H](Br)[C@@H](Br)C1=CC=CC=C1 CNP0445487.3 [0,1,0,0,0,0|1,0,1]=3 160 B13R1.152 O=C(O)[C@@H](Br)[C@H](Br)C1=CC=CC=C1 CNP0445487.4 [0,1,0,0,0,0|1,0,1]=3 161 B13R1.152 O=C(O)[C@@H](O)[C@@H](O)C1=CC=CC=C1 CNP0234856.1 [0,1,0,0,0,0|0,0,2]=3 162 B13R1.152 O=C(O)[C@H](Br)[C@@H](Br)C1=CC=CC=C1 CNP0445487.1 [0,1,0,0,0,0|1,0,1]=3 163 B13R1.152 O=C(O)[C@H](Br)[C@H](Br)C1=CC=CC=C1 CNP0445487.2 [0,1,0,0,0,0|1,0,1]=3 164 B13R1.202 C[C@H](CC1=CC=CC=C1O)C(=O)O CNP0488255.1 [0,1,0,0,0,0|1,0,1]=3 165 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O CNP0300752.2 [0,1,0,0,0,0|1,0,1]=3 166 B13R1.202 N[C@H](CC1=CC=CC=C1O)C(=O)O CNP0300752.1 [0,1,0,0,0,0|1,0,1]=3 167 B13R1.202 O=C(O)C(=O)CC1=CC=CC=C1O CNP0164162.0 [0,1,0,0,0,0|0,0,0]=1 168 B13R1.202 O=C(O)[C@@H](O)CC1=CC=CC=C1O CNP0312598.1 [0,1,0,0,0,0|0,0,2]=3 169 B13R1.353 N[C@@H](CC1=CC=CC=C1)P(=O)(O)O CNP0096775.2 [0,1,0,0,0,0|2,0,1]=4 170 B13R1.353 N[C@H](CC1=CC=CC=C1)P(=O)(O)O CNP0096775.1 [0,1,0,0,0,0|2,0,1]=4 171 B13R1.418 CC(=O)C(=CN)CC1=CC=CC=C1 CNP0043268.0 [0,1,0,0,0,0|2,0,0]=3 172 B13R1.418 CC(=O)[C@@H](C=O)CC1=CC=CC=C1 CNP0392217.1 [0,1,0,0,0,0|1,0,1]=3 173 B13R1.418 CC(=O)[C@H](C=O)CC1=CC=CC=C1 CNP0392217.2 [0,1,0,0,0,0|1,0,1]=3 174 B13R1.418 CCC(=CC1=CC=CC=C1)C(=O)O CNP0325742.0 [0,1,0,0,0,0|1,0,1]=3 175 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O CNP0187424.1 [0,1,0,0,0,0|1,0,1]=3 176 B13R1.418 CN[C@H](CC1=CC=CC=C1)C(=O)O CNP0187424.2 [0,1,0,0,0,0|1,0,1]=3 177 B13R1.418 COC(=CC1=CC=CC=C1)C(=O)O CNP0540263.0 [0,1,0,0,0,0|0,0,2]=3 178 B13R1.418 CO[C@@H](CC1=CC=CC=C1)C(=O)O CNP0243391.2 [0,1,0,0,0,0|0,0,2]=3 179 B13R1.418 CO[C@H](CC1=CC=CC=C1)C(=O)O CNP0243391.1 [0,1,0,0,0,0|0,0,2]=3 180 B13R1.418 N#CC(=CC1=CC=CC=C1)C(=O)N CNP0128787.0 [0,1,0,0,0,0|2,0,1]=4 181 B13R1.418 NC(=O)C(=NO)CC1=CC=CC=C1 CNP0186138.0 [0,1,0,0,0,0|1,0,1]=3 182 B13R1.418 O=C(O)C(=NO)CC1=CC=CC=C1 CNP0272865.0 [0,1,0,0,0,0|0,0,1]=2 183 B13R1.418 O=C(O)[C@@H](CC1=CC=CC=C1)NO CNP0288777.1 [0,1,0,0,0,0|0,0,2]=3 184 B13R1.418 O=C(O)[C@@H](CS)CC1=CC=CC=C1 CNP0581897.1 [0,1,0,0,0,0|0,1,1]=3 185 B13R1.418 O=C(O)[C@H](CC1=CC=CC=C1)NO CNP0288777.2 [0,1,0,0,0,0|0,0,2]=3 186 B13R1.418 O=C(O)[C@H](CI)CC1=CC=CC=C1 CNP0546564.1 [0,1,0,0,0,0|1,0,1]=3 187 B13R1.1073 C[C@@](N)(CC1=CC=CC=C1)C(=O)O CNP0049229.2 [0,1,0,0,0,0|1,0,1]=3 188 B13R1.1073 C[C@](N)(CC1=CC=CC=C1)C(=O)O CNP0049229.1 [0,1,0,0,0,0|1,0,1]=3 189 B13R2.359 C[C@]1(C(=O)NC2=CC=CC=C12)O CNP0292518.1 [0,0,0,1,0,0|2,0,1]=4 190 B13R2.369 CC1=CC2=CC=CC=C2N=C1O CNP0132288.0 [0,0,0,1,0,0|2,0,1]=4 191 B13R2.369 CC1=CC2=CC=CC=C2OC1=O CNP0554094.0 [0,0,0,1,0,0|1,0,1]=3 192 B13R2.369 NC1=CC2=CC=CC=C2OC1=O CNP0022464.0 [0,0,0,1,0,0|1,0,1]=3 193 B13R2.369 O=C1N=C2C=CC=CC2=NC1=O CNP0466838.0 [0,0,0,1,0,0|2,0,0]=3 194 B13R2.369 O=C1NC2=CC=CC=C2NC1=O CNP0494204.0 [0,0,0,1,0,0|2,0,0]=3 195 B13R2.369 O=C1NC2=CC=CC=C2OC1=O CNP0289759.0 [0,0,0,1,0,0|1,0,0]=2 196 B13R2.369 O=C1NC2=CC=CC=C2O[C@H]1O CNP0291912.1 [0,0,0,1,0,0|1,0,2]=4 197 B13R2.369 O=C1OC2=CC=CC=C2C=C1Cl CNP0586906.0 [0,0,0,1,0,0|1,0,1]=3 198 B13R2.369 O=C1OC2=CC=CC=C2C=C1O CNP0227778.0 [0,0,0,1,0,0|0,0,2]=3 199 B13R2.369 OC1=CC2=CC=CC=C2C=C1O CNP0610143.0 [0,0,0,1,0,0|1,0,2]=4 200 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=CC=C2 CNP0306656.4 [0,0,0,1,0,0|1,0,1]=3 201 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 CNP0306656.1 [0,0,0,1,0,0|1,0,1]=3 202 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=CC=CC=C2 CNP0306656.3 [0,0,0,1,0,0|1,0,1]=3 203 B13R2.423 O=C(O)[C@H]1C[C@H]1C2=CC=CC=C2 CNP0306656.2 [0,0,0,1,0,0|1,0,1]=3 204 B13R2.435 CC(=O)C1=CC2=CC=CC=C2C1 CNP0049314.0 [0,0,0,1,0,0|2,0,0]=3 205 B13R2.435 CC(=O)C1=CC2=CC=CC=C2O1 CNP0524572.0 [0,0,0,1,0,0|1,0,2]=4 206 B13R2.435 O=C(O)C1=CC2=CC=CC=C2N1 CNP0273430.0 [0,0,0,1,0,0|1,0,1]=3 207 B13R2.435 O=C(O)C1=CC2=CC=CC=C2O1 CNP0251705.0 [0,0,0,1,0,0|0,0,2]=3 208 B13R2.435 O=C(O)C1=CC2=CC=CC=C2S1 CNP0443849.0 [0,0,0,1,0,0|0,1,1]=3 209 B13R2.435 O=C(O)C1=NC2=CC=CC=C2N1 CNP0500150.0 [0,0,0,1,0,0|2,0,0]=3 210 B13R2.435 O=C(O)[C@@H]1CC2=CC=CC=C2N1 CNP0087377.1 [0,0,0,1,0,0|1,0,1]=3 211 B13R2.5517 C[C@@]1(CC2=CC=CC=C12)C(=O)O CNP0476499.2 [0,0,0,1,0,0|1,0,1]=3 212 B13R2.5517 C[C@]1(CC2=CC=CC=C12)C(=O)O CNP0476499.1 [0,0,0,1,0,0|1,0,1]=3 213 B11R1.35 N[C@@H](CC1=CC=CS1)C(=O)O CNP0037775.1 [0,0,0,0,1,0|2,0,1]=4 214 B11R1.35 N[C@@H](CN1C=CC=C1)C(=O)O CNP0507224.1 [0,0,0,0,1,0|2,0,1]=4 215 B11R1.35 N[C@H](CC1=CC=CS1)C(=O)O CNP0037775.2 [0,0,0,0,1,0|2,0,1]=4 216 B11R1.35 N[C@H](CN1C=CC=C1)C(=O)O CNP0507224.2 [0,0,0,0,1,0|2,0,1]=4 217 B11R1.35 O=C(O)C(=O)CN1C=CN=C1 CNP0305763.0 [0,0,0,0,1,0|2,0,0]=3 218 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 CNP0302092.0 [0,0,0,0,1,0|1,0,0]=2 219 B11R1.36 CC(C)C(=O)C1=CC=CC=C1 CNP0127365.0 [0,0,0,0,1,0|2,0,1]=4 220 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 CNP0224074.1 [0,0,0,0,1,0|1,0,1]=3 221 B11R1.36 C[C@@H](N)C(=O)C1=CC=CC=C1 CNP0277529.2 [0,0,0,0,1,0|2,0,1]=4 222 B11R1.36 C[C@H](C(=O)O)C1=CC=CC=C1 CNP0224074.2 [0,0,0,0,1,0|1,0,1]=3 223 B11R1.36 C[C@H](N)C(=O)C1=CC=CC=C1 CNP0277529.1 [0,0,0,0,1,0|2,0,1]=4 224 B11R1.36 NC(=O)C(=O)C1=CC=CC=C1 CNP0359777.0 [0,0,0,0,1,0|1,0,0]=2 225 B11R1.36 NC(=O)[C@@H](N)C1=CC=CC=C1 CNP0218836.2 [0,0,0,0,1,0|2,0,1]=4 226 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 CNP0218836.1 [0,0,0,0,1,0|2,0,1]=4 227 B11R1.36 NC(=O)[C@H](O)C1=CC=CC=C1 CNP0213891.1 [0,0,0,0,1,0|1,0,2]=4 228 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 CNP0137107.2 [0,0,0,0,1,0|1,0,1]=3 229 B11R1.36 N[C@@H](C(=O)O)C1=CC=CN=C1 CNP0515087.2 [0,0,0,0,1,0|2,0,1]=4 230 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 CNP0137107.1 [0,0,0,0,1,0|1,0,1]=3 231 B11R1.36 N[C@H](C(=O)O)C1=CC=CN=C1 CNP0515087.1 [0,0,0,0,1,0|2,0,1]=4 232 B11R1.36 O=C(C1=CC=CC=C1)C(O)O CNP0177704.0 [0,0,0,0,1,0|0,0,2]=3 233 B11R1.36 O=C(Cl)C(=O)C1=CC=CC=C1 CNP0193068.0 [0,0,0,0,1,0|1,0,0]=2 234 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 CNP0256089.0 [0,0,0,0,1,0|0,0,0]=1 235 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 CNP0248394.1 [0,0,0,0,1,0|0,0,2]=3 236 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 CNP0248394.2 [0,0,0,0,1,0|0,0,2]=3 237 B13R1.348 CC(=O)C=C(C)NC1=CC=CC=C1 CNP0070664.0 [0,0,0,0,0,1|3,0,0]=4 238 B13R1.348 CC(=O)CC(=CC1=CC=CC=C1)C CNP0258512.0 [0,0,0,0,0,1|2,0,1]=4 239 B13R1.348 CC(=O)CC(=NC1=CC=CC=C1)C CNP0377921.0 [0,0,0,0,0,1|3,0,0]=4 240 B13R1.348 CC(=O)C[C@H](O)CC1=CC=CC=C1 CNP0264298.1 [0,0,0,0,0,1|1,0,2]=4 241 B13R1.348 CC(=O)N[C@@H](C)CC1=CC=CC=C1 CNP0071012.2 [0,0,0,0,0,1|2,0,1]=4 242 B13R1.348 CC(=O)N[C@H](C)CC1=CC=CC=C1 CNP0071012.1 [0,0,0,0,0,1|2,0,1]=4 243 B13R1.348 CC(C)CC(=O)CC1=CC=CC=C1 CNP0319392.0 [0,0,0,0,0,1|2,0,1]=4 244 B13R1.348 CC(C)OC(=O)CC1=CC=CC=C1 CNP0282252.0 [0,0,0,0,0,1|2,0,1]=4 245 B13R1.348 NC(=O)NC(=O)CC1=CC=CC=C1 CNP0191800.0 [0,0,0,0,0,1|1,0,0]=2 246 B13R1.348 NC(=O)NC(=O)OC1=CC=CC=C1 CNP0150119.0 [0,0,0,0,0,1|2,0,0]=3 247 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 CNP0238803.0 [0,0,0,0,0,1|1,0,1]=3 248 B13R1.348 O=C(O)CC(=O)NC1=CC=CC=C1 CNP0071010.0 [0,0,0,0,0,1|1,0,0]=2 249 B13R1.351 CC(=O)C(=CNC1=CC=CC=C1)C CNP0106967.0 [0,0,0,0,0,1|2,0,1]=4 250 B13R1.351 CC(=O)[C@@H](N)CCC1=CC=CC=C1 CNP0565249.1 [0,0,0,0,0,1|2,0,1]=4 251 B13R1.351 CC(C)C(=O)OCC1=CC=CC=C1 CNP0039876.0 [0,0,0,0,0,1|2,0,1]=4 252 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O CNP0082825.1 [0,0,0,0,0,1|1,0,1]=3 253 B13R1.351 N[C@@H](CSC1=CC=CC=C1)C(=O)O CNP0294633.1 [0,0,0,0,0,1|1,0,1]=3 254 B13R1.351 N[C@H](CCC1=CC=CC=C1)C(=O)O CNP0082825.2 [0,0,0,0,0,1|1,0,1]=3 255 B13R1.351 O=C(O)C(=O)NCC1=CC=CC=N1 CNP0478013.0 [0,0,0,0,0,1|1,0,0]=2 256 B13R1.351 O=C(O)[C@@H](O)COC1=CC=CC=C1 CNP0287022.1 [0,0,0,0,0,1|0,0,2]=3 257 B10R0.4 C=CC=CC=CCCC(=O)C CNP0477041.0 [1,0,1,0,0,0|1,0,1]=4 258 B10R1.17 C=CCCC1=CC=CC=C1 CNP0486810.0 [2,0,0,0,0,0|1,0,1]=4 259 B10R1.17 CC=CCC1=CC=CC=C1 CNP0361275.0 [2,0,0,0,0,0|1,0,0]=3 260 B10R1.17 O=C=NCC1=CC=CC=C1 CNP0498912.0 [2,0,0,0,0,0|1,0,1]=4 261 B10R1.17 O=CC=CC1=CC=CC=C1 CNP0279382.0 [2,0,0,0,0,0|0,0,1]=3 262 B10R1.17 O=CCCC1=CC=CC=C1 CNP0353125.0 [2,0,0,0,0,0|0,0,1]=3 263 B10R1.17 O=CNCC1=CC=CC=C1 CNP0021384.0 [2,0,0,0,0,0|1,0,0]=3 264 B10R1.17 O=CNNC1=CC=CC=C1 CNP0045586.0 [2,0,0,0,0,0|2,0,0]=4 265 B10R1.17 O=COCC1=CC=CC=C1 CNP0294760.0 [2,0,0,0,0,0|1,0,0]=3 266 B10R1.17 OCC=CC1=CC=CC=C1 CNP0214953.0 [2,0,0,0,0,0|0,0,2]=4 267 B10R1.17 OCCCC1=CC=CC=C1 CNP0393684.0 [2,0,0,0,0,0|0,0,2]=4 268 B10R1.17 OCSCC1=CC=CC=C1 CNP0193580.0 [2,0,0,0,0,0|1,0,1]=4 269 B10R1.17 ON=CCC1=CC=CC=C1 CNP0114756.0 [2,0,0,0,0,0|1,0,0]=3 270 B10R1.17 S=CC=NC1=CC=CC=C1 CNP0296748.0 [2,0,0,0,0,0|1,1,0]=4 271 B10R1.17 S=CNCC1=CC=CC=C1 CNP0159195.0 [2,0,0,0,0,0|1,1,0]=4 272 B10R1.18 C=C(C)CC1=CC=CC=C1 CNP0299392.0 [2,0,0,0,0,0|1,0,0]=3 273 B10R1.18 CC(=O)CC1=CC=CC=C1 CNP0310853.0 [2,0,0,0,0,0|0,0,1]=3 274 B10R1.18 CC(=O)NC1=CC=CC=C1 CNP0299776.0 [2,0,0,0,0,0|1,0,1]=4 275 B10R1.18 CC(=O)OC1=CC=CC=C1 CNP0333279.0 [2,0,0,0,0,0|1,0,1]=4 276 B10R1.18 N=C(N)CC1=CC=CC=C1 CNP0452177.0 [2,0,0,0,0,0|2,0,0]=4 277 B10R1.18 NC(=O)CC1=CC=CC=C1 CNP0212090.0 [2,0,0,0,0,0|1,0,0]=3 278 B10R1.18 NC(=O)C[N+]1=CC=CC=C1 CNP0486406.0 [2,0,0,0,0,0|2,0,0]=4 279 B10R1.18 NC(=O)NC1=CC=CC=C1 CNP0279748.0 [2,0,0,0,0,0|2,0,0]=4 280 B10R1.18 O=C(Br)CC1=CC=CC=C1 CNP0152845.0 [2,0,0,0,0,0|1,0,0]=3 281 B10R1.18 O=C(Cl)CC1=CC=CC=C1 CNP0283126.0 [2,0,0,0,0,0|1,0,0]=3 282 B10R1.18 O=C(O)CC1=CC=CC=C1 CNP0311203.0 [2,0,0,0,0,0|0,0,0]=2 283 B10R1.18 O=C(O)CC1=CC=CN=C1 CNP0105682.0 [2,0,0,0,0,0|1,0,0]=3 284 B10R1.18 [2H][13C](=O)CC1=CC=CC=C1 CNP0527841.0 [2,0,0,0,0,0|1,0,0]=3 285 B12R0.166 C=CC=C(C=CN)CC(C)C(=O)O CNP0386482.0 [0,1,1,0,0,0|1,0,1]=4 286 B12R1.32 C=CCC(=O)NC1=CC=CC=C1 CNP0211229.0 [1,1,0,0,0,0|2,0,0]=4 287 B12R1.32 CC(CC1=CC=CC=C1)NC=O CNP0077379.0 [1,1,0,0,0,0|1,0,1]=4 288 B12R1.32 CCCC(=O)CC1=CC=CC=C1 CNP0538882.0 [1,1,0,0,0,0|1,0,1]=4 289 B12R1.32 CCNC(=O)CC1=CC=CC=C1 CNP0069475.0 [1,1,0,0,0,0|1,0,1]=4 290 B12R1.32 CCOC(=O)CC1=CC=CC=C1 CNP0112866.0 [1,1,0,0,0,0|1,0,1]=4 291 B12R1.32 CNNC(=O)CC1=CC=CC=C1 CNP0042437.0 [1,1,0,0,0,0|2,0,0]=4 292 B12R1.34 CC(C1=CC=CC=C1)C(N)C=O CNP0518505.1 [1,1,0,0,0,0|1,0,1]=4 293 B12R1.34 COC(=O)[C@@H](N)C1=CC=CC=C1 CNP0318507.2 [1,1,0,0,0,0|2,0,0]=4 294 B12R1.34 COC(=O)[C@@H](O)C1=CC=CC=C1 CNP0421747.1 [1,1,0,0,0,0|2,0,0]=4 295 B12R1.34 COC(=O)[C@H](N)C1=CC=CC=C1 CNP0318507.1 [1,1,0,0,0,0|2,0,0]=4 296 B12R1.34 COC(=O)[C@H](O)C1=CC=CC=C1 CNP0421747.2 [1,1,0,0,0,0|2,0,0]=4 297 B12R1.34 C[C@@H](C1=CC=CC=C1)N(C)C=O CNP0565966.1 [1,1,0,0,0,0|2,0,0]=4 298 B12R1.49 CC1=CC=C(C=C1)CC(C)C=O CNP0288270.0 [1,1,0,0,0,0|1,0,1]=4 299 B12R1.49 CCC(=O)CC1=CC=C(C=C1)O CNP0549133.0 [1,1,0,0,0,0|1,0,1]=4 300 B12R1.49 COC(=O)CC1=CC=C(C=C1)O CNP0332506.0 [1,1,0,0,0,0|2,0,0]=4 301 B12R1.49 N[C@H](C=O)CC1=CC=C(C=C1)O CNP0232449.1 [1,1,0,0,0,0|1,0,1]=4 302 B12R1.49 O=NC(=O)NC1=CC=C(C=C1)O CNP0501405.0 [1,1,0,0,0,0|2,0,0]=4 303 B12R1.49 ON=C(S)CC1=CC=C(C=C1)O CNP0205375.0 [1,1,0,0,0,0|1,1,0]=4 304 B12R1.118 COC(=CC1=CC=CC=C1)C=O CNP0496622.0 [1,1,0,0,0,0|0,0,2]=4 305 B12R1.371 CC1=CC=CC=C1CC(C)C=O CNP0002505.0 [1,1,0,0,0,0|1,0,1]=4 306 B12R1.371 COC(=O)CC1=CC=CC=C1O CNP0205970.0 [1,1,0,0,0,0|2,0,0]=4 307 B12R1.371 O=C(CO)NC1=CC=CC=C1O CNP0547732.0 [1,1,0,0,0,0|1,0,1]=4 308 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)O CNP0238281.0 [1,1,0,0,0,0|1,0,1]=4 309 B12R1.21 CC(=O)CCC1=CC=C(C=C1)C CNP0002929.0 [1,1,0,0,0,0|1,0,1]=4 310 B12R1.21 CC(=O)CCC1=CC=C(C=C1)O CNP0218694.0 [1,1,0,0,0,0|1,0,1]=4 311 B12R1.21 CC(=O)NCC1=CC=C(C=C1)O CNP0325229.0 [1,1,0,0,0,0|2,0,0]=4 312 B12R1.21 CC(=O)OCC1=CC=C(C=C1)C CNP0139398.0 [1,1,0,0,0,0|2,0,0]=4 313 B12R1.21 CC1=CC=C(C=C1)C=CC(=O)O CNP0158019.0 [1,1,0,0,0,0|0,0,1]=3 314 B12R1.21 CC1=CC=C(C=C1)CCC(=O)O CNP0556712.0 [1,1,0,0,0,0|0,0,1]=3 315 B12R1.21 NC(=O)C=CC1=CC=C(C=C1)Cl CNP0552238.0 [1,1,0,0,0,0|1,0,1]=4 316 B12R1.21 NC(=O)C=CC1=CC=C(C=C1)O CNP0070658.0 [1,1,0,0,0,0|1,0,1]=4 317 B12R1.21 NC(=O)CCC1=CC=C(C=C1)O CNP0590164.0 [1,1,0,0,0,0|1,0,1]=4 318 B12R1.21 NC(=O)OCC1=CC=C(C=C1)O CNP0435961.0 [1,1,0,0,0,0|2,0,0]=4 319 B12R1.21 NC1=CC=C(C=C1)CCC(=O)O CNP0585639.0 [1,1,0,0,0,0|0,0,1]=3 320 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)Br CNP0594784.0 [1,1,0,0,0,0|0,0,1]=3 321 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)Cl CNP0031776.0 [1,1,0,0,0,0|0,0,1]=3 322 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)O CNP0255341.0 [1,1,0,0,0,0|0,0,1]=3 323 B12R1.21 O=C(O)CCC1=CC=C(C=C1)O CNP0290882.0 [1,1,0,0,0,0|0,0,1]=3 324 B12R1.21 O=C(O)CNC1=CC=C(C=C1)O CNP0287419.0 [1,1,0,0,0,0|1,0,1]=4 325 B12R1.21 O=C(O)COC1=CC=C(C=C1)Br CNP0468193.0 [1,1,0,0,0,0|1,0,1]=4 326 B12R1.21 O=C(O)COC1=CC=C(C=C1)Cl CNP0467480.0 [1,1,0,0,0,0|1,0,1]=4 327 B12R1.21 O=C(O)COC1=CC=C(C=C1)O CNP0053966.0 [1,1,0,0,0,0|1,0,1]=4 328 B12R1.27 CC(=NO)C=CC1=CC=CC=C1 CNP0073914.0 [1,1,0,0,0,0|1,0,1]=4 329 B12R1.27 CCC(=O)CCC1=CC=CC=C1 CNP0536432.0 [1,1,0,0,0,0|1,0,1]=4 330 B12R1.27 CCC(=O)OCC1=CC=CC=C1 CNP0120803.0 [1,1,0,0,0,0|2,0,0]=4 331 B12R1.27 CNC(=O)C=CC1=CC=CC=C1 CNP0112097.0 [1,1,0,0,0,0|1,0,1]=4 332 B12R1.27 COC(=O)C=CC1=CC=CC=C1 CNP0290830.0 [1,1,0,0,0,0|0,0,1]=3 333 B12R1.27 COC(=O)C=CC1=CC=CN=C1 CNP0057404.0 [1,1,0,0,0,0|1,0,1]=4 334 B12R1.27 COC(=O)CCC1=CC=CC=C1 CNP0253198.0 [1,1,0,0,0,0|0,0,1]=3 335 B12R1.27 COC(=S)NCC1=CC=CC=C1 CNP0103481.0 [1,1,0,0,0,0|1,1,0]=4 336 B12R1.27 NCC(=O)OCC1=CC=CC=C1 CNP0003113.0 [1,1,0,0,0,0|2,0,0]=4 337 B12R1.27 NNC(=O)OCC1=CC=CC=C1 CNP0146630.0 [1,1,0,0,0,0|2,0,0]=4 338 B12R1.27 O=C(C=CC1=CC=CC=C1)OO CNP0086495.0 [1,1,0,0,0,0|0,0,1]=3 339 B12R1.27 O=C(NCl)OCC1=CC=CC=C1 CNP0069758.0 [1,1,0,0,0,0|2,0,0]=4 340 B12R1.107 CC(=O)O[C@@H](C)C1=CC=CC=C1 CNP0214274.1 [1,1,0,0,0,0|2,0,0]=4 341 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 CNP0028406.0 [1,1,0,0,0,0|0,0,1]=3 342 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 CNP0360184.1 [1,1,0,0,0,0|0,0,1]=3 343 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CN=C1 CNP0149806.1 [1,1,0,0,0,0|1,0,1]=4 344 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 CNP0360184.2 [1,1,0,0,0,0|0,0,1]=3 345 B12R1.107 N[C@H](CC(=O)O)C1=CC=CN=C1 CNP0149806.2 [1,1,0,0,0,0|1,0,1]=4 346 B12R1.107 O=C(O)C[C@@H](O)C1=CC=CC=C1 CNP0238020.1 [1,1,0,0,0,0|0,0,1]=3 347 B12R1.107 O=C(O)C[C@H](O)C1=CC=CC=C1 CNP0238020.2 [1,1,0,0,0,0|0,0,1]=3 348 B12R1.125 CC(=O)C=CC1=CC=CC=C1O CNP0537172.0 [1,1,0,0,0,0|1,0,1]=4 349 B12R1.125 CC(=O)CCC1=CC=CC=C1O CNP0273155.0 [1,1,0,0,0,0|1,0,1]=4 350 B12R1.125 CC(=O)OCC1=CC=CC=C1C CNP0024152.0 [1,1,0,0,0,0|2,0,0]=4 351 B12R1.125 CC1=CC=CC=C1C=CC(=O)N CNP0278078.0 [1,1,0,0,0,0|1,0,1]=4 352 B12R1.125 CC1=CC=CC=C1C=CC(=O)O CNP0254758.0 [1,1,0,0,0,0|0,0,1]=3 353 B12R1.125 CC1=CC=NC=C1C=CC(=O)O CNP0467544.0 [1,1,0,0,0,0|1,0,1]=4 354 B12R1.125 NC(=O)CCC1=CC=CC=C1O CNP0509635.0 [1,1,0,0,0,0|1,0,1]=4 355 B12R1.125 NC1=CC=CC=C1C=CC(=O)O CNP0453465.0 [1,1,0,0,0,0|0,0,1]=3 356 B12R1.125 O=C(O)C=CC1=CC=CC=C1Cl CNP0576243.0 [1,1,0,0,0,0|0,0,1]=3 357 B12R1.125 O=C(O)C=CC1=CC=CC=C1O CNP0207361.0 [1,1,0,0,0,0|0,0,1]=3 358 B12R1.125 O=C(O)CCC1=CC=CC=C1O CNP0103376.0 [1,1,0,0,0,0|0,0,1]=3 359 B12R1.125 O=C(O)COC1=CC=CC=C1Cl CNP0460590.0 [1,1,0,0,0,0|1,0,1]=4 360 B12R1.226 CC(=O)OCC1=CC=CC(=C1)C CNP0002410.0 [1,1,0,0,0,0|2,0,0]=4 361 B12R1.226 O=C(O)C=CC1=CC=CC(=C1)Br CNP0574767.0 [1,1,0,0,0,0|0,0,1]=3 362 B12R1.226 O=C(O)C=CC1=CC=CC(=C1)Cl CNP0394142.0 [1,1,0,0,0,0|0,0,1]=3 363 B12R1.226 O=C(O)C=CC1=CC=CC(=C1)O CNP0335428.0 [1,1,0,0,0,0|0,0,1]=3 364 B12R1.226 O=C(O)CCC1=CC=CC(=C1)O CNP0166101.0 [1,1,0,0,0,0|0,0,1]=3 365 B12R1.226 O=C(O)CNC1=CC=CC(=C1)O CNP0322304.0 [1,1,0,0,0,0|1,0,1]=4 366 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)N CNP0571554.0 [0,1,0,0,1,0|1,0,1]=4 367 B12R1.20 CC1=CC=C(C=C1)[C@@H](C)C(=O)O CNP0452903.1 [0,1,0,0,1,0|1,0,1]=4 368 B12R1.20 CC1=CC=C(C=C1)[C@H](C)C(=O)O CNP0452903.2 [0,1,0,0,1,0|1,0,1]=4 369 B12R1.20 CN(O)C(=O)C1=CC=C(C=C1)Br CNP0048624.0 [0,1,0,0,1,0|2,0,0]=4 370 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(C=C1)O CNP0251220.1 [0,1,0,0,1,0|1,0,1]=4 371 B12R1.20 C[C@H](C(=O)O)C1=CC=C(C=C1)O CNP0251220.2 [0,1,0,0,1,0|1,0,1]=4 372 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)O CNP0106681.1 [0,1,0,0,1,0|1,0,1]=4 373 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)O CNP0106681.2 [0,1,0,0,1,0|1,0,1]=4 374 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)O CNP0148868.0 [0,1,0,0,1,0|0,0,0]=2 375 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(C=C1)O CNP0103860.2 [0,1,0,0,1,0|0,0,2]=4 376 B12R1.20 O=C(O)[C@H](O)C1=CC=C(C=C1)O CNP0103860.1 [0,1,0,0,1,0|0,0,2]=4 377 B12R1.124 CC1=CC=CC=C1[C@@H](O)C(=O)O CNP0017568.1 [0,1,0,0,1,0|0,0,2]=4 378 B12R1.124 NC1=CC=CC=C1C(=O)C(=O)O CNP0082491.0 [0,1,0,0,1,0|0,0,0]=2 379 B12R1.124 N[C@@H](C(=O)O)C1=CC=CC=C1Br CNP0577696.2 [0,1,0,0,1,0|1,0,1]=4 380 B12R1.124 N[C@H](C(=O)O)C1=CC=CC=C1Br CNP0577696.1 [0,1,0,0,1,0|1,0,1]=4 381 B12R1.225 CC(C(=O)O)C1=CC=CC(=C1)N CNP0584804.0 [0,1,0,0,1,0|1,0,1]=4 382 B12R1.225 CC(C(=O)O)C1=CC=CC(=C1)O CNP0140626.0 [0,1,0,0,1,0|1,0,1]=4 383 B12R1.225 CC1=CC=CC(=C1)[C@@H](N)C(=O)O CNP0581273.1 [0,1,0,0,1,0|1,0,1]=4 384 B12R1.225 CC1=CC=CC(=C1)[C@H](N)C(=O)O CNP0581273.2 [0,1,0,0,1,0|1,0,1]=4 385 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(=C1)Cl CNP0491115.1 [0,1,0,0,1,0|1,0,1]=4 386 B12R1.225 N[C@H](C(=O)O)C1=CC=CC(=C1)Cl CNP0491115.2 [0,1,0,0,1,0|1,0,1]=4 387 B12R1.225 N[C@H](C(=O)O)C1=CC=CC(=C1)O CNP0183373.1 [0,1,0,0,1,0|1,0,1]=4 388 B12R1.225 O=C(O)[C@@H](O)C1=CC=CC(=C1)O CNP0133718.2 [0,1,0,0,1,0|0,0,2]=4 389 B12R1.225 O=C(O)[C@H](O)C1=CC=CC(=C1)O CNP0133718.1 [0,1,0,0,1,0|0,0,2]=4 390 B12R1.253 CC(C)(C(=O)O)C1=CC=CC=C1 CNP0476981.0 [0,1,0,0,1,0|1,0,1]=4 391 B12R1.253 C[C@@](O)(C(=O)O)C1=CC=CC=C1 CNP0021992.1 [0,1,0,0,1,0|0,0,2]=4 392 B12R1.253 C[C@](N)(C(=O)O)C1=CC=CC=C1 CNP0272279.1 [0,1,0,0,1,0|1,0,1]=4 393 B12R1.478 CC(=O)C(=CN)C1=CC=CC=C1 CNP0043428.0 [0,1,0,0,1,0|2,0,0]=4 394 B12R1.478 CC=C(C(=O)O)C1=CC=CC=C1 CNP0468782.0 [0,1,0,0,1,0|1,0,0]=3 395 B12R1.478 CC[C@@H](C(=O)O)C1=CC=CC=C1 CNP0002389.1 [0,1,0,0,1,0|1,0,1]=4 396 B12R1.478 CC[C@H](C(=O)O)C1=CC=CC=C1 CNP0002389.2 [0,1,0,0,1,0|1,0,1]=4 397 B12R1.478 CN[C@@H](C(=O)O)C1=CC=CC=C1 CNP0318350.2 [0,1,0,0,1,0|1,0,1]=4 398 B12R1.478 CN[C@H](C(=O)O)C1=CC=CC=C1 CNP0318350.1 [0,1,0,0,1,0|1,0,1]=4 399 B12R1.478 CO[C@@H](C(=O)O)C1=CC=CC=C1 CNP0291222.2 [0,1,0,0,1,0|0,0,2]=4 400 B12R1.478 CO[C@H](C(=O)O)C1=CC=CC=C1 CNP0291222.1 [0,1,0,0,1,0|0,0,2]=4 401 B12R1.478 O=C(O)[C@@H](CO)C1=CC=CC=C1 CNP0185259.1 [0,1,0,0,1,0|0,0,2]=4 402 B12R1.478 O=C(O)[C@H](CO)C1=CC=CC=C1 CNP0185259.2 [0,1,0,0,1,0|0,0,2]=4 403 B12R1.564 C=C(C1=CC=CC=C1)P(=O)(O)O CNP0446923.0 [0,1,0,0,1,0|2,0,0]=4 404 B14R1.337 NC(=O)NC(=O)NC1=CC=CC=C1Cl CNP0064716.0 [0,1,0,0,0,1|2,0,0]=4 405 B14R1.337 NC(=O)NC(=O)NC1=CC=CC=C1I CNP0473852.0 [0,1,0,0,0,1|2,0,0]=4 406 B14R1.425 N[C@H](CC1=CC=CC=C1)[C@H](O)C(=O)O CNP0400824.1 [0,1,0,0,0,1|1,0,1]=4 407 B14R1.698 CC(=O)CC(=O)NC1=CC=C(C=C1)Cl CNP0208625.0 [0,1,0,0,0,1|2,0,0]=4 408 B14R1.698 NC(=O)NC(=O)NC1=CC=C(C=C1)Br CNP0042495.0 [0,1,0,0,0,1|2,0,0]=4 409 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)O CNP0415764.0 [0,1,0,0,0,1|1,0,1]=4 410 B14R1.698 O=C(O)CC(=O)OC1=CC=C(C=C1)O CNP0084206.0 [0,1,0,0,0,1|1,0,0]=3 411 B14R1.743 CNC(=O)CC(=O)CC1=CC=CN=C1 CNP0325410.0 [0,1,0,0,0,1|2,0,0]=4 412 B14R1.743 COC(=O)C=C(C)NC1=CC=CC=C1 CNP0099886.0 [0,1,0,0,0,1|2,0,0]=4 413 B14R1.161 NC(=O)C(=O)NCC1=CC=CC=C1O CNP0063010.0 [0,1,0,0,0,1|1,0,0]=3 414 B14R1.161 NC1=CC=CC=C1CC[C@@H](N)C(=O)O CNP0183073.1 [0,1,0,0,0,1|1,0,1]=4 415 B14R1.161 O=C(O)C(=O)C=CC1=CC=CC=C1O CNP0605638.0 [0,1,0,0,0,1|0,0,1]=3 416 B14R1.415 CN(C[C@@H](N)C(=O)O)C1=CC=CC=C1 CNP0517587.2 [0,1,0,0,0,1|1,0,1]=4 417 B14R1.415 CN(C[C@H](N)C(=O)O)C1=CC=CC=C1 CNP0517587.1 [0,1,0,0,0,1|1,0,1]=4 418 B14R1.415 NC(CC(=O)C1=CC=CC=C1)C(=O)O CNP0292373.0 [0,1,0,0,0,1|1,0,1]=4 419 B14R1.679 O=C(O)C(O)COC1=CC=C(C=C1)Cl CNP0076718.0 [0,1,0,0,0,1|0,0,2]=4 420 B14R1.679 O=C(O)[C@@H](O)CCC1=CC=C(C=C1)O CNP0157305.2 [0,1,0,0,0,1|0,0,2]=4 421 B14R1.679 O=C(O)[C@H](O)CCC1=CC=C(C=C1)O CNP0157305.1 [0,1,0,0,0,1|0,0,2]=4 422 B14R1.756 CC=C(C)C(=O)OCC1=CC=CC=C1 CNP0244771.0 [0,1,0,0,0,1|2,0,0]=4 423 B14R1.756 COC(=O)[C@@H](C)CCC1=CC=CC=C1 CNP0179092.2 [0,1,0,0,0,1|1,0,1]=4 424 B14R1.756 COC(=O)[C@@H](C)NCC1=CC=CC=C1 CNP0313908.1 [0,1,0,0,0,1|1,0,1]=4 425 B14R1.756 COC(=O)[C@H](C)CCC1=CC=CC=C1 CNP0179092.1 [0,1,0,0,0,1|1,0,1]=4 426 B14R1.756 COC(=O)[C@H](C)NCC1=CC=CC=C1 CNP0313908.2 [0,1,0,0,0,1|1,0,1]=4 427 B14R1.756 O=C(OCC1=CC=CC=C1)C(=CBr)Br CNP0069557.0 [0,1,0,0,0,1|2,0,0]=4 428 B14R1.5956 CC1=CC=CC(=N1)CNC(=O)C(=O)N CNP0224057.0 [0,1,0,0,0,1|2,0,0]=4 429 B14R1.3 COC1=CC=C(C=C1)C=C(C)C(=O)O CNP0224859.0 [0,2,0,0,0,0|1,0,1]=4 430 B14R1.3 COC1=CC=C(C=C1)C=C(S)C(=O)O CNP0586939.0 [0,2,0,0,0,0|0,1,1]=4 431 B14R1.3 COC1=CC=C(C=C1)CC(=O)C(=O)O CNP0018016.0 [0,2,0,0,0,0|0,0,0]=2 432 B14R1.3 COC1=CC=C(C=C1)CC(=S)C(=O)O CNP0443715.0 [0,2,0,0,0,0|0,1,0]=3 433 B14R1.3 COC1=CC=C(C=C1)C[C@@H](N)C(=O)O CNP0402588.2 [0,2,0,0,0,0|1,0,1]=4 434 B14R1.3 COC1=CC=C(C=C1)C[C@@H](O)C(=O)O CNP0320715.1 [0,2,0,0,0,0|0,0,2]=4 435 B14R1.3 COC1=CC=C(C=C1)C[C@H](N)C(=O)O CNP0402588.1 [0,2,0,0,0,0|1,0,1]=4 436 B14R1.3 COC1=CC=C(C=C1)NC(=O)C(=O)C CNP0062043.0 [0,2,0,0,0,0|2,0,0]=4 437 B14R1.3 NCC1=CC=C(C=C1)NC(=O)C(=O)O CNP0597020.0 [0,2,0,0,0,0|1,0,0]=3 438 B14R1.3 N[C@@H](CC1=CC=C(C=C1)CO)C(=O)O CNP0304718.1 [0,2,0,0,0,0|1,0,1]=4 439 B14R1.132 C[C@H](C1=CC=C(C=C1)O)[C@H](O)C(=O)O CNP0597363.1 [0,2,0,0,0,0|0,0,2]=4 440 B14R1.132 O=C(O)[C@@H](O)[C@@H](O)C1=CC=C(C=C1)O CNP0602438.4 [0,2,0,0,0,0|0,0,2]=4 441 B14R1.132 O=C(O)[C@@H](O)[C@H](O)C1=CC=C(C=C1)O CNP0602438.2 [0,2,0,0,0,0|0,0,2]=4 442 B14R1.132 O=C(O)[C@H](O)[C@@H](O)C1=CC=C(C=C1)O CNP0602438.1 [0,2,0,0,0,0|0,0,2]=4 443 B14R1.132 O=C(O)[C@H](O)[C@H](O)C1=CC=C(C=C1)O CNP0602438.3 [0,2,0,0,0,0|0,0,2]=4 444 B14R1.134 COC(=O)C(=CC1=CC=C(C=C1)O)O CNP0199127.0 [0,2,0,0,0,0|0,0,2]=4 445 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)Cl CNP0355431.0 [0,2,0,0,0,0|1,0,1]=4 446 B14R1.134 COC(=O)C(O)CC1=CC=C(C=C1)O CNP0118416.0 [0,2,0,0,0,0|0,0,2]=4 447 B14R1.134 COC(=O)[C@@H](C)CC1=CC=C(C=C1)C CNP0033915.2 [0,2,0,0,0,0|1,0,1]=4 448 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)O CNP0122998.1 [0,2,0,0,0,0|1,0,1]=4 449 B14R1.134 COC(=O)[C@H](C)CC1=CC=C(C=C1)C CNP0033915.1 [0,2,0,0,0,0|1,0,1]=4 450 B14R1.134 COC(=O)[C@H](O)CC1=CC=C(C=C1)O CNP0118416.1 [0,2,0,0,0,0|0,0,2]=4 451 B14R1.134 N[C@H](CC1=CC=C(C=C1)I)C(=O)NO CNP0602089.1 [0,2,0,0,0,0|1,0,1]=4 452 B14R1.536 CNC(CC1=CC=C(C=C1)I)C(=O)O CNP0421391.0 [0,2,0,0,0,0|1,0,1]=4 453 B14R1.536 CN[C@@H](CC1=CC=C(C=C1)O)C(=O)O CNP0259108.2 [0,2,0,0,0,0|1,0,1]=4 454 B14R1.536 CN[C@H](CC1=CC=C(C=C1)O)C(=O)O CNP0259108.1 [0,2,0,0,0,0|1,0,1]=4 455 B14R1.536 CO[C@@H](CC1=CC=C(C=C1)O)C(=O)O CNP0255437.1 [0,2,0,0,0,0|0,0,2]=4 456 B14R1.536 N#CC(=CC1=CC=C(C=C1)O)C(=O)O CNP0194422.0 [0,2,0,0,0,0|1,0,1]=4 457 B14R1.536 O=C(O)C(=NO)CC1=CC=C(C=C1)O CNP0341137.0 [0,2,0,0,0,0|0,0,1]=3 458 B14R1.536 O=C(O)[C@H](CC1=CC=C(C=C1)O)NO CNP0247200.1 [0,2,0,0,0,0|0,0,2]=4 459 B14R1.686 CC(=CC1=CC=C(C(=C1)O)O)C(=O)O CNP0080811.0 [0,2,0,0,0,0|1,0,1]=4 460 B14R1.686 C[C@@H](CC1=CC=C(C(=C1)O)O)C(=O)O CNP0236065.1 [0,2,0,0,0,0|1,0,1]=4 461 B14R1.686 N=C(CC1=CC=C(C(=C1)O)O)C(=O)O CNP0486723.0 [0,2,0,0,0,0|1,0,0]=3 462 B14R1.686 NC1=CC(=CC=C1O)C[C@H](N)C(=O)O CNP0194206.2 [0,2,0,0,0,0|1,0,1]=4 463 B14R1.686 N[C@@H](CC1=CC(=O)C(=O)C=C1)C(=O)O CNP0118108.1 [0,2,0,0,0,0|1,0,1]=4 464 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)Br)O)C(=O)O CNP0139461.1 [0,2,0,0,0,0|1,0,1]=4 465 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)Cl)O)C(=O)O CNP0342895.1 [0,2,0,0,0,0|1,0,1]=4 466 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)I)O)C(=O)O CNP0354293.1 [0,2,0,0,0,0|1,0,1]=4 467 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)O)O)C(=O)O CNP0290328.1 [0,2,0,0,0,0|1,0,1]=4 468 B14R1.686 N[C@H](CC1=CC=C(C(=C1)I)O)C(=O)O CNP0354293.2 [0,2,0,0,0,0|1,0,1]=4 469 B14R1.686 N[C@H](CC1=CC=C(C(=C1)O)O)C(=O)O CNP0290328.2 [0,2,0,0,0,0|1,0,1]=4 470 B14R1.686 O=C(O)C(=CC1=CC=C(C(=C1)O)O)O CNP0487192.0 [0,2,0,0,0,0|0,0,2]=4 471 B14R1.686 O=C(O)C(=O)CC1=CC=C(C(=C1)I)O CNP0275421.0 [0,2,0,0,0,0|0,0,0]=2 472 B14R1.686 O=C(O)C(=O)CC1=CC=C(C(=C1)O)O CNP0017898.0 [0,2,0,0,0,0|0,0,0]=2 473 B14R1.686 O=C(O)C(=S)CC1=CC=C(C(=C1)Cl)Cl CNP0194088.0 [0,2,0,0,0,0|0,1,0]=3 474 B14R1.686 O=C(O)[C@@H](O)CC1=CC=C(C(=C1)O)O CNP0265014.2 [0,2,0,0,0,0|0,0,2]=4 475 B14R1.686 O=C(O)[C@H](O)CC1=CC=C(C(=C1)O)O CNP0265014.3 [0,2,0,0,0,0|0,0,2]=4 476 B14R1.686 O=C(O)[C@H](O)CC1=CC=C(C(=C1)O)[O-] CNP0265014.1 [0,2,0,0,0,0|0,0,2]=4 477 B14R1.6049 NC1=CC(=CC=C1C[C@@H](N)C(=O)O)O CNP0602905.1 [0,2,0,0,0,0|1,0,1]=4 478 B14R1.6049 NC1=CC(=CC=C1C[C@H](N)C(=O)O)O CNP0602905.2 [0,2,0,0,0,0|1,0,1]=4 479 B14R1.7626 C[C@](N)(CC1=CC=C(C=C1)O)C(=O)O CNP0340484.1 [0,2,0,0,0,0|1,0,1]=4 480 B14R1.60 CCOC(=O)C(=O)CC1=CC=CC=C1 CNP0350709.0 [0,2,0,0,0,0|0,0,0]=2 481 B14R1.60 CCOC(=O)C(=O)NC1=CC=CC=C1 CNP0299874.0 [0,2,0,0,0,0|1,0,0]=3 482 B14R1.60 CCOC(=O)[C@@H](N)CC1=CC=CC=C1 CNP0259364.1 [0,2,0,0,0,0|1,0,1]=4 483 B14R1.60 CCOC(=O)[C@@H](O)CC1=CC=CC=C1 CNP0127852.1 [0,2,0,0,0,0|0,0,2]=4 484 B14R1.85 COC(=O)[C@@H](N)[C@@H](C)C1=CC=CC=C1 CNP0524984.3 [0,2,0,0,0,0|1,0,1]=4 485 B14R1.85 COC(=O)[C@@H](N)[C@H](C)C1=CC=CC=C1 CNP0524984.1 [0,2,0,0,0,0|1,0,1]=4 486 B14R1.85 COC(=O)[C@@H](O)[C@H](Cl)C1=CC=CC=C1 CNP0036227.1 [0,2,0,0,0,0|0,0,2]=4 487 B14R1.85 COC(=O)[C@H](N)[C@@H](C)C1=CC=CC=C1 CNP0524984.4 [0,2,0,0,0,0|1,0,1]=4 488 B14R1.85 COC(=O)[C@H](N)[C@H](C)C1=CC=CC=C1 CNP0524984.2 [0,2,0,0,0,0|1,0,1]=4 489 B14R1.1031 CN[C@@H](CC1=CC=CC=C1)C(=O)OC CNP0040111.2 [0,2,0,0,0,0|1,0,1]=4 490 B14R1.1031 CN[C@H](CC1=CC=CC=C1)C(=O)OC CNP0040111.1 [0,2,0,0,0,0|1,0,1]=4 491 B14R1.1031 COC(=O)[C@H](CC1=CC=CC=C1)NO CNP0292156.1 [0,2,0,0,0,0|0,0,2]=4 492 B14R1.1107 COC(=O)C(C)(C)CC1=CC=CC=C1 CNP0023760.0 [0,2,0,0,0,0|1,0,1]=4 493 B14R1.75 N#CC1=CC=CC(=C1)C[C@H](N)C(=O)O CNP0199493.1 [0,2,0,0,0,0|1,0,1]=4 494 B14R1.75 NCC1=CC=CC(=C1)C[C@H](N)C(=O)O CNP0225493.1 [0,2,0,0,0,0|1,0,1]=4 495 B14R1.75 N[C@@H](CC1=CC=CC(=C1)CO)C(=O)O CNP0157139.2 [0,2,0,0,0,0|1,0,1]=4 496 B14R1.75 N[C@H](CC1=CC=CC(=C1)CO)C(=O)O CNP0157139.1 [0,2,0,0,0,0|1,0,1]=4 497 B14R1.150 CC(=C(C)C1=CC=CC(=C1)C)C(=O)O CNP0451332.0 [0,2,0,0,0,0|1,0,1]=4 498 B14R1.153 N[C@@H](CC1=CC=CC(=C1O)O)C(=O)O CNP0355050.1 [0,2,0,0,0,0|1,0,1]=4 499 B14R1.542 N#CC(=CC1=CC=CC(=C1)O)C(=O)O CNP0121003.0 [0,2,0,0,0,0|1,0,1]=4 500 B14R1.4404 CC(N)(CC1=CC=CC(=C1)O)C(=O)O CNP0050866.0 [0,2,0,0,0,0|1,0,1]=4 501 B14R1.4474 N[C@@H](CC1=CC(=CC=C1O)O)C(=O)O CNP0146679.1 [0,2,0,0,0,0|1,0,1]=4 502 B14R1.980 O=CN[C@@H](CC1=CC=CC=C1)C(=O)O CNP0207541.2 [0,2,0,0,0,0|0,0,1]=3 503 B14R1.980 O=CN[C@H](CC1=CC=CC=C1)C(=O)O CNP0207541.1 [0,2,0,0,0,0|0,0,1]=3 504 B14R1.4513 CC(=O)C(CC1=CC=CC=C1)C(=O)C CNP0179026.0 [0,2,0,0,0,0|1,0,1]=4 505 B14R1.4513 CC(N)C(CC1=CC=CC=C1)C(=O)O CNP0599225.0 [0,2,0,0,0,0|1,0,1]=4 506 B14R1.4513 CN(C)[C@@H](CC1=CC=CC=C1)C(=O)O CNP0141586.1 [0,2,0,0,0,0|1,0,1]=4 507 B14R1.4513 CN(C)[C@H](CC1=CC=CC=C1)C(=O)O CNP0141586.2 [0,2,0,0,0,0|1,0,1]=4 508 B14R1.4513 NC(=O)C(CC1=CC=CC=C1)[N+](=O)[O-] CNP0518449.0 [0,2,0,0,0,0|1,0,1]=4 509 B14R1.4513 O=C(O)C(CC1=CC=CC=C1)N(O)O CNP0030247.0 [0,2,0,0,0,0|0,0,2]=4 510 B12R2.18 C=C1C(=O)NC2=CC=CC=C12 CNP0030308.0 [1,0,0,1,0,0|2,0,0]=4 511 B12R2.18 CC1=C(C2=CC=CC=C2C1)C CNP0191084.0 [1,0,0,1,0,0|2,0,0]=4 512 B12R2.18 CN1C(=O)CC2=CC=CC=C12 CNP0182982.0 [1,0,0,1,0,0|2,0,0]=4 513 B12R2.18 C[C@@H]1CC2=CC=CC=C2C1=O CNP0054143.2 [1,0,0,1,0,0|1,0,1]=4 514 B12R2.18 C[C@H]1CC2=CC=CC=C2C1=O CNP0054143.1 [1,0,0,1,0,0|1,0,1]=4 515 B12R2.18 O=C1C(=NC2=CC=CC=C12)O CNP0512501.0 [1,0,0,1,0,0|1,0,1]=4 516 B12R2.18 O=C1NC2=CC=CC=C2C1=O CNP0320767.0 [1,0,0,1,0,0|1,0,0]=3 517 B12R2.18 O=C1NC2=CC=CC=C2[C@@H]1O CNP0273186.1 [1,0,0,1,0,0|1,0,1]=4 518 B12R2.18 OC1=C(C2=CC=CC=C2N1)O CNP0017813.0 [1,0,0,1,0,0|1,0,1]=4 519 B12R2.24 O=C1C=CC2=CC=CC=C2C1 CNP0599990.0 [1,0,0,1,0,0|1,0,0]=3 520 B12R2.24 O=C1C=CC2=CC=CC=C2N1 CNP0583881.0 [1,0,0,1,0,0|2,0,0]=4 521 B12R2.24 O=C1C=CC2=CC=CC=C2O1 CNP0225025.0 [1,0,0,1,0,0|2,0,0]=4 522 B12R2.24 O=C1CC2=CC=CC=C2CO1 CNP0331991.0 [1,0,0,1,0,0|2,0,0]=4 523 B12R2.24 O=C1CCC2=CC=CC=C2C1 CNP0253800.0 [1,0,0,1,0,0|1,0,1]=4 524 B12R2.24 O=C1COC2=CC=CC=C2N1 CNP0343320.0 [1,0,0,1,0,0|1,0,1]=4 525 B12R2.24 O=C1COC2=CC=CC=C2O1 CNP0002476.0 [1,0,0,1,0,0|1,0,1]=4 526 B12R2.32 O=CC1=CC2=CC=CC=C2O1 CNP0003119.0 [1,0,0,1,0,0|0,0,2]=4 527 B12R2.32 ON=C1CC2=CC=CC=C2C1 CNP0396553.0 [1,0,0,1,0,0|2,0,0]=4 528 B12R2.3190 O=C(O)[C@@H]1CC2=CC=CC=C12 CNP0459478.1 [1,0,0,1,0,0|0,0,1]=3 529 B12R2.3190 O=C(O)[C@H]1CC2=CC=CC=C12 CNP0459478.2 [1,0,0,1,0,0|0,0,1]=3 530 B14R2.19 O=C1C=C(CO1)CC2=CC=CC=C2 CNP0220173.0 [0,0,0,1,0,1|1,0,0]=3 531 B14R2.19 O=C1N[C@H](CO1)CC2=CC=CC=C2 CNP0490847.1 [0,0,0,1,0,1|1,0,1]=4 532 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1C2=CC=CC=C2 CNP0138800.2 [0,0,0,1,0,1|1,0,1]=4 533 B14R2.598 C[C@@H]1NC(=O)O[C@H]1C2=CC=CC=C2 CNP0138800.4 [0,0,0,1,0,1|1,0,1]=4 534 B14R2.598 C[C@H]1NC(=O)O[C@@H]1C2=CC=CC=C2 CNP0138800.3 [0,0,0,1,0,1|1,0,1]=4 535 B14R2.598 C[C@H]1NC(=O)O[C@H]1C2=CC=CC=C2 CNP0138800.1 [0,0,0,1,0,1|1,0,1]=4 536 B14R2.598 NC1=NC(=O)C(O1)C2=CC=CC=C2 CNP0459002.0 [0,0,0,1,0,1|1,0,0]=3 537 B14R2.598 O=C1CC(=NN1C2=CC=CC=C2)O CNP0451388.0 [0,0,0,1,0,1|2,0,0]=4 538 B14R2.642 CC(=O)N1C(=O)OC2=CC=CC=C12 CNP0071114.0 [0,0,0,1,0,1|2,0,0]=4 539 B14R2.768 O=C(O)CC1=CC2=CC=CC=C2N1 CNP0583144.0 [0,0,0,1,0,1|1,0,1]=4 540 B14R2.260 O=C1N=C(SC1=O)C2=CC=CC=C2 CNP0474727.0 [0,0,0,1,0,1|0,1,1]=4 541 B14R2.260 O=C1OC(CC1O)C2=CC=CC=C2 CNP0557942.0 [0,0,0,1,0,1|0,0,2]=4 542 B14R2.741 O=C1N=NC2=CC=CC=C2C=C1O CNP0545745.0 [0,0,0,1,0,1|2,0,0]=4 543 B14R2.781 O=C(O)C1=CC2=CC=CC=C2OC1 CNP0256854.0 [0,0,0,1,0,1|1,0,0]=3 544 B14R2.781 O=C(O)C1=CC=C2C=CC=CC2=C1 CNP0083467.0 [0,0,0,1,0,1|1,0,1]=4 545 B14R2.781 O=C(O)C1=CC=C2C=CC=CC2=N1 CNP0097420.0 [0,0,0,1,0,1|1,0,1]=4 546 B14R2.781 O=C(O)C1=CN=C2C=CC=CC2=C1 CNP0507176.0 [0,0,0,1,0,1|1,0,1]=4 547 B14R2.781 O=C(O)C1=CN=C2C=CC=CC2=N1 CNP0212397.0 [0,0,0,1,0,1|1,0,1]=4 548 B14R2.781 O=C(O)[C@@H]1CC2=CC=CC=C2CN1 CNP0360235.2 [0,0,0,1,0,1|1,0,1]=4 549 B14R2.781 O=C(O)[C@@H]1COC2=CC=CC=C2C1 CNP0198581.2 [0,0,0,1,0,1|1,0,1]=4 550 B14R2.781 O=C(O)[C@H]1CC2=CC=CC=C2CN1 CNP0360235.1 [0,0,0,1,0,1|1,0,1]=4 551 B14R2.781 O=C(O)[C@H]1COC2=CC=CC=C2C1 CNP0198581.1 [0,0,0,1,0,1|1,0,1]=4 552 B14R2.9535 N[C@@]1(CCC2=CC=CC=C12)C(=O)O CNP0479506.2 [0,0,0,1,0,1|1,0,1]=4 553 B14R2.9535 N[C@]1(CCC2=CC=CC=C12)C(=O)O CNP0479506.1 [0,0,0,1,0,1|1,0,1]=4 554 B14R2.4529 O=C(O)C1=CC2=CC(=CC=C2N1)Cl CNP0340466.0 [0,1,0,1,0,0|1,0,1]=4 555 B14R2.4529 O=C(O)C1=CC2=CC(=CC=C2N1)O CNP0609129.0 [0,1,0,1,0,0|1,0,1]=4 556 B14R2.4529 O=C(O)C1=CC2=CC(=CC=C2O1)Br CNP0463700.0 [0,1,0,1,0,0|0,0,2]=4 557 B14R2.4529 O=C(O)C1=CC2=CC=C(C=C2N1)O CNP0575573.0 [0,1,0,1,0,0|1,0,1]=4 558 B14R2.8239 CC1=CC2=CC=C(C=C2OC1=O)O CNP0245727.0 [0,1,0,1,0,0|1,0,1]=4 559 B14R2.8239 CC1=CC2=NC(=O)C(=O)N=C2C=C1 CNP0094434.0 [0,1,0,1,0,0|2,0,0]=4 560 B14R2.8239 CC1=CC=C2NC(=O)C(=O)NC2=C1 CNP0498919.0 [0,1,0,1,0,0|2,0,0]=4 561 B14R2.8239 CN1CC2=CC(=CC=C2OC1=O)Br CNP0056386.0 [0,1,0,1,0,0|2,0,0]=4 562 B14R2.8239 O=C1OC2=CC(=CC=C2C=C1O)O CNP0410081.0 [0,1,0,1,0,0|0,0,2]=4 563 B14R2.1128 COC1=CC2=CC=CC=C2OC1=O CNP0191557.0 [0,1,0,1,0,0|0,0,2]=4 564 B14R2.1128 N#CC1=CC2=CC=CC=C2OC1=O CNP0385602.0 [0,1,0,1,0,0|1,0,1]=4 565 B14R2.1128 O=CC1=CC2=CC=CC=C2NC1=O CNP0373883.0 [0,1,0,1,0,0|1,0,1]=4 566 B14R2.4514 CN1C(=O)OC[C@@H]1C2=CC=CC=C2 CNP0331634.1 [0,1,0,1,0,0|2,0,0]=4 567 B14R2.8188 CC1=C(C2=CC=CC=C2OC1=O)O CNP0333808.0 [0,1,0,1,0,0|1,0,1]=4 568 B14R2.8188 O=C1NC2=CC=CC=C2C(=C1O)O CNP0343165.0 [0,1,0,1,0,0|1,0,1]=4 569 B14R2.8188 O=C1OC2=CC=CC=C2C(=C1Br)O CNP0451403.0 [0,1,0,1,0,0|1,0,1]=4 570 B14R2.450 CC1=C(NC2=CC=CC=C12)C(=O)O CNP0353602.0 [0,1,0,1,0,0|1,0,1]=4 571 B14R2.450 CC1=C(OC2=CC=CC=C12)C(=O)O CNP0476209.0 [0,1,0,1,0,0|0,0,2]=4 572 B14R2.450 CN1C(=CC2=CC=CC=C12)C(=O)O CNP0075697.0 [0,1,0,1,0,0|1,0,1]=4 573 B14R2.789 NC1(CC2=CC=CC=C2C1)C(=O)O CNP0556631.0 [0,1,0,1,0,0|1,0,1]=4 574 B14R3.697 O=C1OC2=CC=CC=C2[C@@H]3[C@H]1C3 CNP0028024.1 [0,0,0,2,0,0|1,0,1]=4 575 B10R1.15 C#CC(=O)C1=CC=CC=C1 CNP0026110.0 [1,0,0,0,1,0|1,0,1]=4 576 B10R1.15 C=C(C=O)C1=CC=CC=C1 CNP0395069.0 [1,0,0,0,1,0|1,0,0]=3 577 B10R1.15 C=CC(=C)C1=CC=CC=C1 CNP0518579.0 [1,0,0,0,1,0|2,0,0]=4 578 B10R1.15 C=CC(=O)C1=CC=CC=C1 CNP0085771.0 [1,0,0,0,1,0|1,0,0]=3 579 B10R1.15 CC(=NO)C1=CC=CC=C1 CNP0218225.0 [1,0,0,0,1,0|2,0,0]=4 580 B10R1.15 CC(C=O)C1=CC=CC=C1 CNP0070168.0 [1,0,0,0,1,0|1,0,1]=4 581 B10R1.15 CC=C(C)C1=CC=CC=C1 CNP0250835.0 [1,0,0,0,1,0|2,0,0]=4 582 B10R1.15 CCC(=O)C1=CC=CC=C1 CNP0320895.0 [1,0,0,0,1,0|1,0,1]=4 583 B10R1.15 CN(C=O)C1=CC=CC=C1 CNP0026033.0 [1,0,0,0,1,0|2,0,0]=4 584 B10R1.15 CNC(=O)C1=CC=CC=C1 CNP0491778.0 [1,0,0,0,1,0|2,0,0]=4 585 B10R1.15 COC(=O)C1=CC=CC=C1 CNP0233777.0 [1,0,0,0,1,0|2,0,0]=4 586 B10R1.15 CSC(=O)C1=CC=CC=C1 CNP0351124.0 [1,0,0,0,1,0|2,0,0]=4 587 B10R1.15 N#CC(=O)C1=CC=CC=C1 CNP0308967.0 [1,0,0,0,1,0|1,0,1]=4 588 B10R1.15 NC(=NO)C1=CC=CC=C1 CNP0049137.0 [1,0,0,0,1,0|2,0,0]=4 589 B10R1.15 NCC(=O)C1=CC=CC=C1 CNP0357301.0 [1,0,0,0,1,0|1,0,1]=4 590 B10R1.15 NNC(=O)C1=CC=CC=C1 CNP0576891.0 [1,0,0,0,1,0|2,0,0]=4 591 B10R1.15 O=C(CBr)C1=CC=CC=C1 CNP0204252.0 [1,0,0,0,1,0|1,0,1]=4 592 B10R1.15 O=C(CO)C1=CC=CC=C1 CNP0334071.0 [1,0,0,0,1,0|0,0,1]=3 593 B10R1.15 O=C(NO)C1=CC=CC=C1 CNP0395264.0 [1,0,0,0,1,0|1,0,0]=3 594 B10R1.15 O=C(NO)C1=CC=CN=C1 CNP0109606.0 [1,0,0,0,1,0|2,0,0]=4 595 B10R1.15 O=CC(=O)C1=CC=CC=C1 CNP0256547.0 [1,0,0,0,1,0|0,0,0]=2 596 B10R1.15 O=C[C@H](O)C1=CC=CC=C1 CNP0556372.1 [1,0,0,0,1,0|0,0,2]=4 597 B10R1.15 OC=C(O)C1=CC=CC=C1 CNP0119701.0 [1,0,0,0,1,0|0,0,1]=3 598 B10R1.66 O=C(O)C=CC1=CC=CO1 CNP0477259.0 [1,0,0,0,1,0|1,0,1]=4 599 B10R1.66 O=C(O)C=CC1=CNC=C1 CNP0242786.0 [1,0,0,0,1,0|1,0,1]=4 600 B10R1.23 CC(=O)C(=O)C1=CC=CO1 CNP0137174.0 [0,0,0,0,2,0|2,0,0]=4 601 B10R1.23 CC(=O)C(=O)C1=CC=CS1 CNP0002573.0 [0,0,0,0,2,0|2,0,0]=4 602 B10R1.23 CC(=O)C(=O)C1=COC=C1 CNP0289332.0 [0,0,0,0,2,0|2,0,0]=4 603 B10R1.23 O=C(O)C(=O)C1=CNC=N1 CNP0372712.0 [0,0,0,0,2,0|2,0,0]=4 604 B12R1.252 CC(=CCCC1=CC=CC=C1)C CNP0046365.0 [1,0,0,0,0,1|2,0,0]=4 605 B12R1.252 CC(=O)C=NNC1=CC=CC=C1 CNP0071032.0 [1,0,0,0,0,1|2,0,0]=4 606 B12R1.252 CC(=O)NCCC1=CC=CC=C1 CNP0298057.0 [1,0,0,0,0,1|1,0,1]=4 607 B12R1.252 CC(=O)OCCC1=CC=CC=C1 CNP0195113.0 [1,0,0,0,0,1|1,0,1]=4 608 B12R1.252 NC(=O)CC=CC1=CC=CC=C1 CNP0073923.0 [1,0,0,0,0,1|1,0,1]=4 609 B12R1.252 NC(=O)NCCC1=CC=CC=C1 CNP0509449.0 [1,0,0,0,0,1|1,0,1]=4 610 B12R1.252 O=C(O)CC=CC1=CC=CC=C1 CNP0242436.0 [1,0,0,0,0,1|0,0,1]=3 611 B12R1.252 O=C(O)CC=CC1=CC=CN=C1 CNP0110379.0 [1,0,0,0,0,1|1,0,1]=4 612 B12R1.252 O=C(O)CCCC1=CC=CC=C1 CNP0152618.0 [1,0,0,0,0,1|0,0,1]=3 613 B12R1.252 O=C(O)CCCC1=CC=CN=C1 CNP0002375.0 [1,0,0,0,0,1|1,0,1]=4 614 B12R1.252 O=C(O)CCOC1=CC=CC=C1 CNP0002351.0 [1,0,0,0,0,1|0,0,1]=3 615 B12R1.252 O=C(O)CSCC1=CC=CC=C1 CNP0438400.0 [1,0,0,0,0,1|0,0,1]=3 616 B14R1.423 CC(=NNC(=O)N)CC1=CC=CC=C1 CNP0111079.0 [0,0,0,0,0,2|2,0,0]=4 617 B14R1.423 C[C@@H](CCC(=O)O)CC1=CC=CC=C1 CNP0459573.2 [0,0,0,0,0,2|1,0,1]=4 618 B14R1.423 C[C@H](CCC(=O)O)CC1=CC=CC=C1 CNP0459573.1 [0,0,0,0,0,2|1,0,1]=4 619 B14R1.423 NC(=O)NNC(=O)CC1=CC=CC=C1 CNP0091768.0 [0,0,0,0,0,2|1,0,0]=3 620 B14R1.423 O=C(O)C=CC(=O)NC1=CC=CC=N1 CNP0446821.0 [0,0,0,0,0,2|2,0,0]=4 621 B14R1.423 O=C(O)CCC(=O)CC1=CC=CC=C1 CNP0167736.0 [0,0,0,0,0,2|0,0,0]=2 622 B14R1.423 O=C(O)CCC(=O)NC1=CC=CC=C1 CNP0542382.0 [0,0,0,0,0,2|1,0,0]=3 623 B14R1.423 O=C(O)CNC(=O)CC1=CC=CC=C1 CNP0183978.0 [0,0,0,0,0,2|0,0,0]=2 624 B14R1.818 CC(=CC(=O)O)C=CC1=CC=CC=C1 CNP0513009.0 [0,0,0,0,0,2|1,0,1]=4 625 B14R1.818 CC(=CC(=O)OCC1=CC=CC=C1)C CNP0329881.0 [0,0,0,0,0,2|2,0,0]=4 626 B14R1.818 CC(=O)CC(=O)OCC1=CC=CC=C1 CNP0232463.0 [0,0,0,0,0,2|1,0,0]=3 627 B14R1.818 CC(CCC1=CC=CC=C1)CC(=O)O CNP0526108.0 [0,0,0,0,0,2|1,0,1]=4 628 B14R1.818 NC(=O)NC(=O)OCC1=CC=CC=C1 CNP0227608.0 [0,0,0,0,0,2|1,0,0]=3 629 B14R1.818 O=C(O)C[C@H](O)CCC1=CC=CC=C1 CNP0246395.1 [0,0,0,0,0,2|0,0,2]=4 630 B14R1.6449 CC(=CC=CC1=CC=CC=C1)C(=O)O CNP0472457.0 [0,0,0,0,0,2|1,0,1]=4 631 B14R1.6449 CC(O)C(=O)OCCC1=CC=CC=C1 CNP0489052.0 [0,0,0,0,0,2|1,0,1]=4 632 B14R1.6449 C[C@H](NOCC1=CC=CC=C1)C(=O)O CNP0138190.1 [0,0,0,0,0,2|1,0,1]=4 633 B14R1.6449 NC(=O)C(=O)NCCC1=CC=CC=N1 CNP0032318.0 [0,0,0,0,0,2|2,0,0]=4 634 B14R1.6449 N[C@@H](COCC1=CC=CC=C1)C(=O)O CNP0404901.2 [0,0,0,0,0,2|1,0,1]=4 635 B14R1.6449 N[C@@H](CSCC1=CC=CC=C1)C(=O)O CNP0391051.1 [0,0,0,0,0,2|1,0,1]=4 636 B14R1.6449 N[C@H](COCC1=CC=CC=C1)C(=O)O CNP0404901.1 [0,0,0,0,0,2|1,0,1]=4 637 B14R1.6449 N[C@H](CSCC1=CC=CC=C1)C(=O)O CNP0391051.2 [0,0,0,0,0,2|1,0,1]=4 638 B14R1.6449 O=C(O)C(=O)CCCC1=CC=CC=C1 CNP0593415.0 [0,0,0,0,0,2|0,0,0]=2