0 B10R1.22 CC1=C(C(=O)NC(=O)N1)O CNP0368070.0 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.22 CC1=C(C=C(C=C1Cl)S)Cl CNP0108382.0 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.22 CC1=C(C=C(C=C1O)O)O CNP0270802.0 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.22 CC1=CC(=C(C(=C1)Br)I)Cl CNP0179139.0 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.22 CC1=CC(=C(C(=C1)Br)N)Cl CNP0063027.0 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.22 CC1=CC(=C(C(=C1)Br)N)N CNP0039347.0 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.22 CC1=CC(=C(C(=C1)Br)O)Br CNP0242146.0 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.22 CC1=CC(=C(C(=C1)C)C)C CNP0375454.0 [0,0,0,0,0,0|1,0,0]=1 8 B10R1.22 CC1=CC(=C(C(=C1)C)N)C CNP0072418.0 [0,0,0,0,0,0|1,0,0]=1 9 B10R1.22 CC1=CC(=C(C(=C1)C)O)C CNP0321032.0 [0,0,0,0,0,0|0,0,0]=0 10 B10R1.22 CC1=CC(=C(C(=C1)Cl)Br)Cl CNP0296853.0 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.22 CC1=CC(=C(C(=C1)Cl)N)N CNP0097451.0 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.22 CC1=CC(=C(C(=C1)N)C)C CNP0027884.0 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.22 CC1=CC(=C(C(=C1)O)C)C CNP0281157.0 [0,0,0,0,0,0|2,0,0]=2 14 B10R1.22 CC1=CC(=C(C(=C1)O)C)O CNP0156178.0 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.22 CC1=CC(=C(C(=C1)O)Cl)O CNP0171455.0 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.22 CC1=CC(=C(C(=C1)O)O)C CNP0386654.0 [0,0,0,0,0,0|1,0,0]=1 17 B10R1.22 CC1=CC(=C(C(=C1)O)O)O CNP0266425.0 [0,0,0,0,0,0|2,0,0]=2 18 B10R1.22 CC1=CC(=C(C(=N1)C)C)C CNP0182494.0 [0,0,0,0,0,0|2,0,0]=2 19 B10R1.22 CC1=CC(=C(C(=O)O1)C)O CNP0371588.0 [0,0,0,0,0,0|4,0,0]=4 20 B10R1.22 CC1=CC(=CC(=C1C)C)N CNP0214882.0 [0,0,0,0,0,0|2,0,0]=2 21 B10R1.22 CC1=CC(=CC(=C1C)C)O CNP0208232.0 [0,0,0,0,0,0|2,0,0]=2 22 B10R1.22 CC1=CC(=CC(=C1C)O)O CNP0138651.0 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.22 CC1=CC(=CC(=C1Cl)C)O CNP0229378.0 [0,0,0,0,0,0|2,0,0]=2 24 B10R1.22 CC1=CC(=CC(=C1Cl)O)O CNP0283107.0 [0,0,0,0,0,0|3,0,0]=3 25 B10R1.22 CC1=CC(=CC(=C1N)C)I CNP0086270.0 [0,0,0,0,0,0|2,0,0]=2 26 B10R1.22 CC1=CC(=CC(=C1O)C)O CNP0107250.0 [0,0,0,0,0,0|1,0,0]=1 27 B10R1.22 CC1=CC(=CC(=C1O)O)O CNP0249116.0 [0,0,0,0,0,0|2,0,0]=2 28 B10R1.22 CC1=CC(=CC(=[N+]1[O-])C)Cl CNP0584434.0 [0,0,0,0,0,0|2,0,1]=3 29 B10R1.22 CC1=CC(=NC(=C1N)Cl)Cl CNP0023634.0 [0,0,0,0,0,0|4,0,0]=4 30 B10R1.22 CC1=CC(=O)C=C(C1=O)C CNP0081563.0 [0,0,0,0,0,0|1,0,1]=2 31 B10R1.22 CC1=CC(=O)C=C(C1=O)O CNP0106705.0 [0,0,0,0,0,0|2,0,1]=3 32 B10R1.22 CC1=CC(=[N+](C(=C1)C)[O-])C CNP0516353.0 [0,0,0,0,0,0|1,0,1]=2 33 B10R1.22 CN1C=C(C=C(C1=O)Br)Br CNP0224301.0 [0,0,0,0,0,0|3,0,1]=4 34 B10R1.22 NC1=C(C=C(C=C1Br)Br)Br CNP0057961.0 [0,0,0,0,0,0|4,0,0]=4 35 B10R1.22 NC1=C(C=C(C=C1Cl)Cl)Cl CNP0036320.0 [0,0,0,0,0,0|4,0,0]=4 36 B10R1.22 NC1=CC(=C(C(=C1)O)O)N CNP0223457.0 [0,0,0,0,0,0|3,0,0]=3 37 B10R1.22 NC1=CC(=O)C=C(C1=O)O CNP0072657.0 [0,0,0,0,0,0|3,0,1]=4 38 B10R1.22 O=C1C=C(C(=O)C(=C1)Br)Br CNP0157909.0 [0,0,0,0,0,0|3,0,1]=4 39 B10R1.22 O=C1C=C(C(=O)C(=C1)O)O CNP0322998.0 [0,0,0,0,0,0|3,0,1]=4 40 B10R1.22 OC1=C(C=C(C=C1Br)Br)Br CNP0415243.0 [0,0,0,0,0,0|3,0,0]=3 41 B10R1.22 OC1=C(C=C(C=C1Br)Br)Cl CNP0017890.0 [0,0,0,0,0,0|3,0,0]=3 42 B10R1.22 OC1=C(C=C(C=C1Br)Cl)Br CNP0371629.0 [0,0,0,0,0,0|3,0,0]=3 43 B10R1.22 OC1=C(C=C(C=C1Br)Cl)Cl CNP0322036.0 [0,0,0,0,0,0|3,0,0]=3 44 B10R1.22 OC1=C(C=C(C=C1Cl)I)Cl CNP0173173.0 [0,0,0,0,0,0|3,0,0]=3 45 B10R1.22 OC1=CC(=C(C(=C1)Br)Br)O CNP0224842.0 [0,0,0,0,0,0|4,0,0]=4 46 B10R1.22 OC1=CC(=C(C(=C1)Br)O)Br CNP0113606.0 [0,0,0,0,0,0|3,0,0]=3 47 B10R1.22 OC1=CC(=C(C(=C1)Cl)O)Cl CNP0083796.0 [0,0,0,0,0,0|3,0,0]=3 48 B10R1.22 OC1=CC(=C(C(=C1)I)O)I CNP0313558.0 [0,0,0,0,0,0|3,0,0]=3 49 B10R1.22 OC1=CC(=C(C(=C1)O)Br)O CNP0173865.0 [0,0,0,0,0,0|4,0,0]=4 50 B10R1.22 OC1=CC(=C(C(=C1)O)Cl)O CNP0254438.0 [0,0,0,0,0,0|4,0,0]=4 51 B10R1.22 OC1=CC(=C(C(=C1)O)I)O CNP0053849.0 [0,0,0,0,0,0|4,0,0]=4 52 B10R1.22 OC1=CC(=C(C(=C1)O)O)O CNP0134222.0 [0,0,0,0,0,0|3,0,0]=3 53 B10R1.22 OC1=CC(=CC(=C1O)Br)Br CNP0081702.0 [0,0,0,0,0,0|3,0,0]=3 54 B10R1.22 OC1=CC(=CC(=C1O)Cl)Cl CNP0598413.0 [0,0,0,0,0,0|3,0,0]=3 55 B9R1.3 C=C1C=CC=C([C@@H]1N)C CNP0587426.1 [1,0,0,0,0,0|1,0,2]=4 56 B9R1.3 C=C1C=COC(=C1O)C CNP0335368.0 [1,0,0,0,0,0|1,0,1]=3 57 B9R1.3 CC1=C(C(=O)C=CN1)O CNP0416033.0 [1,0,0,0,0,0|2,0,0]=3 58 B9R1.3 CC1=C(C(=O)C=CO1)O CNP0287207.0 [1,0,0,0,0,0|2,0,0]=3 59 B9R1.3 CC1=C(C(=O)C=CO1)[O-] CNP0589150.0 [1,0,0,0,0,0|2,0,1]=4 60 B9R1.3 CC1=C(C=CC=C1Br)O CNP0597127.0 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.3 CC1=C(C=CC=C1Cl)N CNP0102945.0 [1,0,0,0,0,0|3,0,0]=4 62 B9R1.3 CC1=C(C=CC=C1N)N CNP0199822.0 [1,0,0,0,0,0|3,0,0]=4 63 B9R1.3 CC1=C(C=CC=C1O)O CNP0572969.0 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.3 CC1=CC=CC(=C1C)C CNP0219925.0 [1,0,0,0,0,0|1,0,0]=2 65 B9R1.3 CC1=CC=CC(=C1C)N CNP0330285.0 [1,0,0,0,0,0|2,0,0]=3 66 B9R1.3 CC1=CC=CC(=C1C)O CNP0282533.0 [1,0,0,0,0,0|2,0,0]=3 67 B9R1.3 CC1=CC=CC(=C1N)C CNP0261599.0 [1,0,0,0,0,0|1,0,0]=2 68 B9R1.3 CC1=CC=CC(=C1N)O CNP0350085.0 [1,0,0,0,0,0|2,0,0]=3 69 B9R1.3 CC1=CC=CC(=C1O)C CNP0332594.0 [1,0,0,0,0,0|0,0,0]=1 70 B9R1.3 CC1=CC=CC(=C1O)O CNP0143209.0 [1,0,0,0,0,0|1,0,0]=2 71 B9R1.3 CC1=CC=CC(=C1S)C CNP0032129.0 [1,0,0,0,0,0|0,1,0]=2 72 B9R1.3 CC1=CC=CC(=O)C1=O CNP0588286.0 [1,0,0,0,0,0|1,0,1]=3 73 B9R1.3 CC1=CC=NC(=C1C)C CNP0326800.0 [1,0,0,0,0,0|2,0,0]=3 74 B9R1.3 CC1=CN=CC(=C1C)C CNP0297347.0 [1,0,0,0,0,0|2,0,0]=3 75 B9R1.3 NC1=C(C=CC=C1Cl)Cl CNP0029750.0 [1,0,0,0,0,0|3,0,0]=4 76 B9R1.3 NC1=CC=CC(=C1Cl)Cl CNP0079961.0 [1,0,0,0,0,0|3,0,0]=4 77 B9R1.3 O=C1C=CC=C(C1=O)O CNP0358701.0 [1,0,0,0,0,0|2,0,1]=4 78 B9R1.3 OC1=C(C=CC=C1Br)Br CNP0310547.0 [1,0,0,0,0,0|2,0,0]=3 79 B9R1.3 OC1=C(C=CC=C1Cl)Cl CNP0231789.0 [1,0,0,0,0,0|2,0,0]=3 80 B9R1.3 OC1=CC=CC(=C1Br)Br CNP0592928.0 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.3 OC1=CC=CC(=C1Cl)Cl CNP0060336.0 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.3 OC1=CC=CC(=C1O)O CNP0308187.0 [1,0,0,0,0,0|2,0,0]=3 83 B9R1.34 CC1=CC(=CC(=C1)Br)C CNP0313661.0 [1,0,0,0,0,0|1,0,0]=2 84 B9R1.34 CC1=CC(=CC(=C1)Br)N CNP0191453.0 [1,0,0,0,0,0|2,0,0]=3 85 B9R1.34 CC1=CC(=CC(=C1)C)C CNP0226551.0 [1,0,0,0,0,0|0,0,0]=1 86 B9R1.34 CC1=CC(=CC(=C1)Cl)Cl CNP0135847.0 [1,0,0,0,0,0|2,0,0]=3 87 B9R1.34 CC1=CC(=CC(=C1)I)C CNP0302224.0 [1,0,0,0,0,0|1,0,0]=2 88 B9R1.34 CC1=CC(=CC(=C1)N)C CNP0206372.0 [1,0,0,0,0,0|1,0,0]=2 89 B9R1.34 CC1=CC(=CC(=C1)O)C CNP0206447.0 [1,0,0,0,0,0|1,0,0]=2 90 B9R1.34 CC1=CC(=CC(=C1)O)O CNP0300146.0 [1,0,0,0,0,0|2,0,0]=3 91 B9R1.34 CC1=CC(=CC(=C1)S)C CNP0440794.0 [1,0,0,0,0,0|1,0,0]=2 92 B9R1.34 CC1=CC(=CC(=O)O1)O CNP0150285.0 [1,0,0,0,0,0|3,0,0]=4 93 B9R1.34 CC1=CC(=NC(=C1)C)C CNP0261026.0 [1,0,0,0,0,0|1,0,0]=2 94 B9R1.34 CC1=CC(=NC(=C1)O)O CNP0028519.0 [1,0,0,0,0,0|3,0,0]=4 95 B9R1.34 CC1=CC(=NC(=N1)Cl)C CNP0067917.0 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.34 CC1=CC(=NC(=N1)N)C CNP0449380.0 [1,0,0,0,0,0|3,0,0]=4 97 B9R1.34 CC1=CC(=O)C=C(O1)O CNP0580633.0 [1,0,0,0,0,0|3,0,0]=4 98 B9R1.34 CC1=CC(=O)OC(=C1)C CNP0079979.0 [1,0,0,0,0,0|2,0,0]=3 99 B9R1.34 CC1=CC(=S)C=C(O1)C CNP0070174.0 [1,0,0,0,0,0|2,0,0]=3 100 B9R1.34 ClC1=CC(=CC(=C1)Cl)Cl CNP0491812.0 [1,0,0,0,0,0|3,0,0]=4 101 B9R1.34 NC1=CC(=CC(=C1)N)N CNP0518662.0 [1,0,0,0,0,0|3,0,0]=4 102 B9R1.34 OC1=CC(=CC(=C1)Cl)Cl CNP0017796.0 [1,0,0,0,0,0|3,0,0]=4 103 B9R1.34 OC1=CC(=CC(=C1)O)O CNP0299558.0 [1,0,0,0,0,0|3,0,0]=4 104 B9R1.69 CC1=CC(=C(C=N1)C)C CNP0375292.0 [1,0,0,0,0,0|2,0,0]=3 105 B9R1.69 CC1=CC(=CC=C1Br)Cl CNP0064949.0 [1,0,0,0,0,0|2,0,0]=3 106 B9R1.69 CC1=CC(=CC=C1Br)N CNP0054285.0 [1,0,0,0,0,0|2,0,0]=3 107 B9R1.69 CC1=CC(=CC=C1Br)O CNP0025703.0 [1,0,0,0,0,0|2,0,0]=3 108 B9R1.69 CC1=CC(=CC=C1Cl)Br CNP0266846.0 [1,0,0,0,0,0|2,0,0]=3 109 B9R1.69 CC1=CC(=CC=C1Cl)N CNP0024502.0 [1,0,0,0,0,0|2,0,0]=3 110 B9R1.69 CC1=CC(=CC=C1Cl)O CNP0329015.0 [1,0,0,0,0,0|2,0,0]=3 111 B9R1.69 CC1=CC(=CC=C1N)Br CNP0038450.0 [1,0,0,0,0,0|2,0,0]=3 112 B9R1.69 CC1=CC(=CC=C1N)Cl CNP0245359.0 [1,0,0,0,0,0|2,0,0]=3 113 B9R1.69 CC1=CC(=CC=C1O)O CNP0324010.0 [1,0,0,0,0,0|1,0,0]=2 114 B9R1.69 CC1=CC(=O)C(=CO1)O CNP0142931.0 [1,0,0,0,0,0|2,0,0]=3 115 B9R1.69 CC1=CC(=O)C=CC1=O CNP0221358.0 [1,0,0,0,0,0|1,0,1]=3 116 B9R1.69 CC1=CC(C=CC1O)O CNP0455439.0 [1,0,0,0,0,0|1,0,2]=4 117 B9R1.69 CC1=CC=C(C(=C1)Br)Br CNP0060402.0 [1,0,0,0,0,0|2,0,0]=3 118 B9R1.69 CC1=CC=C(C(=C1)Br)N CNP0031609.0 [1,0,0,0,0,0|2,0,0]=3 119 B9R1.69 CC1=CC=C(C(=C1)C)Br CNP0365794.0 [1,0,0,0,0,0|1,0,0]=2 120 B9R1.69 CC1=CC=C(C(=C1)C)C CNP0110255.0 [1,0,0,0,0,0|1,0,0]=2 121 B9R1.69 CC1=CC=C(C(=C1)C)Cl CNP0093284.0 [1,0,0,0,0,0|1,0,0]=2 122 B9R1.69 CC1=CC=C(C(=C1)C)N CNP0375981.0 [1,0,0,0,0,0|1,0,0]=2 123 B9R1.69 CC1=CC=C(C(=C1)C)O CNP0080029.0 [1,0,0,0,0,0|0,0,0]=1 124 B9R1.69 CC1=CC=C(C(=C1)Cl)C CNP0337392.0 [1,0,0,0,0,0|2,0,0]=3 125 B9R1.69 CC1=CC=C(C(=C1)Cl)Cl CNP0253916.0 [1,0,0,0,0,0|2,0,0]=3 126 B9R1.69 CC1=CC=C(C(=C1)Cl)N CNP0363714.0 [1,0,0,0,0,0|2,0,0]=3 127 B9R1.69 CC1=CC=C(C(=C1)Cl)O CNP0145784.0 [1,0,0,0,0,0|1,0,0]=2 128 B9R1.69 CC1=CC=C(C(=C1)N)Br CNP0057363.0 [1,0,0,0,0,0|2,0,0]=3 129 B9R1.69 CC1=CC=C(C(=C1)N)C CNP0307574.0 [1,0,0,0,0,0|2,0,0]=3 130 B9R1.69 CC1=CC=C(C(=C1)N)Cl CNP0495286.0 [1,0,0,0,0,0|2,0,0]=3 131 B9R1.69 CC1=CC=C(C(=C1)N)N CNP0080098.0 [1,0,0,0,0,0|2,0,0]=3 132 B9R1.69 CC1=CC=C(C(=C1)N)O CNP0421546.0 [1,0,0,0,0,0|1,0,0]=2 133 B9R1.69 CC1=CC=C(C(=C1)N)S CNP0463153.0 [1,0,0,0,0,0|1,1,0]=3 134 B9R1.69 CC1=CC=C(C(=C1)O)C CNP0172791.0 [1,0,0,0,0,0|2,0,0]=3 135 B9R1.69 CC1=CC=C(C(=C1)O)O CNP0114802.0 [1,0,0,0,0,0|1,0,0]=2 136 B9R1.69 CC1=CC=C(C(=N1)C)C CNP0390721.0 [1,0,0,0,0,0|2,0,0]=3 137 B9R1.69 CC1=CC=C(C(=N1)C)O CNP0056515.0 [1,0,0,0,0,0|1,0,0]=2 138 B9R1.69 CC1=CC=C(C(=N1)Cl)N CNP0043466.0 [1,0,0,0,0,0|3,0,0]=4 139 B9R1.69 CC1=CC=C(C=C1Br)Cl CNP0186814.0 [1,0,0,0,0,0|3,0,0]=4 140 B9R1.69 CC1=CC=C(C=C1C)Br CNP0125395.0 [1,0,0,0,0,0|2,0,0]=3 141 B9R1.69 CC1=CC=C(C=C1C)Cl CNP0482651.0 [1,0,0,0,0,0|2,0,0]=3 142 B9R1.69 CC1=CC=C(C=C1C)N CNP0171920.0 [1,0,0,0,0,0|2,0,0]=3 143 B9R1.69 CC1=CC=C(C=C1C)O CNP0160429.0 [1,0,0,0,0,0|2,0,0]=3 144 B9R1.69 CC1=CC=C(C=C1Cl)N CNP0028854.0 [1,0,0,0,0,0|3,0,0]=4 145 B9R1.69 CC1=CC=C(C=C1N)N CNP0023048.0 [1,0,0,0,0,0|3,0,0]=4 146 B9R1.69 CC1=CC=C(C=C1O)O CNP0256040.0 [1,0,0,0,0,0|3,0,0]=4 147 B9R1.69 CC1=CN=C(C(=C1)C)C CNP0331632.0 [1,0,0,0,0,0|2,0,0]=3 148 B9R1.69 CC1=CN=C(C(=C1)Cl)Br CNP0177235.0 [1,0,0,0,0,0|3,0,0]=4 149 B9R1.69 CC1=CN=C(C(=N1)C)C CNP0313440.0 [1,0,0,0,0,0|3,0,0]=4 150 B9R1.69 C[N+]1=CC(=CC=C1N)I CNP0606794.0 [1,0,0,0,0,0|3,0,0]=4 151 B9R1.69 ClC1=CC=C(C(=C1)Cl)Cl CNP0206286.0 [1,0,0,0,0,0|3,0,0]=4 152 B9R1.69 N=C1C=CC(=O)C(=C1)O CNP0274436.0 [1,0,0,0,0,0|2,0,1]=4 153 B9R1.69 NC1=CC(=CC=C1Cl)Cl CNP0040093.0 [1,0,0,0,0,0|3,0,0]=4 154 B9R1.69 NC1=CC(=CC=C1O)O CNP0176630.0 [1,0,0,0,0,0|2,0,0]=3 155 B9R1.69 NC1=CC(=CC=C1S)Cl CNP0458275.0 [1,0,0,0,0,0|2,1,0]=4 156 B9R1.69 NC1=CC=C(C(=C1)N)N CNP0131312.0 [1,0,0,0,0,0|3,0,0]=4 157 B9R1.69 NC1=CC=C(C(=C1)N)O CNP0003471.0 [1,0,0,0,0,0|2,0,0]=3 158 B9R1.69 NC1=CC=C(C=C1Br)Br CNP0063783.0 [1,0,0,0,0,0|3,0,0]=4 159 B9R1.69 NC1=CC=C(C=C1Cl)Cl CNP0048955.0 [1,0,0,0,0,0|3,0,0]=4 160 B9R1.69 O=C1C=CC(=O)C(=C1)O CNP0230039.0 [1,0,0,0,0,0|2,0,1]=4 161 B9R1.69 OC1=CC(=CC=C1Cl)Cl CNP0236901.0 [1,0,0,0,0,0|3,0,0]=4 162 B9R1.69 OC1=CC=C(C(=C1)Br)O CNP0161760.0 [1,0,0,0,0,0|2,0,0]=3 163 B9R1.69 OC1=CC=C(C(=C1)Cl)Cl CNP0386646.0 [1,0,0,0,0,0|3,0,0]=4 164 B9R1.69 OC1=CC=C(C(=C1)Cl)O CNP0331365.0 [1,0,0,0,0,0|2,0,0]=3 165 B9R1.69 OC1=CC=C(C(=C1)O)O CNP0187325.0 [1,0,0,0,0,0|2,0,0]=3 166 B9R1.69 OC1=CC=C(C=C1Br)Br CNP0216116.0 [1,0,0,0,0,0|2,0,0]=3 167 B9R1.69 OC1=CC=C(C=C1Cl)Cl CNP0401033.0 [1,0,0,0,0,0|2,0,0]=3 168 B11R1.8 COC1=C(C(=O)OC(=C1)C)C CNP0157461.0 [0,1,0,0,0,0|3,0,0]=4 169 B11R1.8 COC1=CC(=CC(=C1C)O)C CNP0174177.0 [0,1,0,0,0,0|2,0,0]=3 170 B11R1.8 COC1=CC(=CC(=C1C)O)O CNP0262935.0 [0,1,0,0,0,0|3,0,0]=4 171 B11R1.8 COC1=CC(=CC(=C1O)Br)Br CNP0067769.0 [0,1,0,0,0,0|2,0,0]=3 172 B11R1.8 COC1=CC(=CC(=C1O)C)O CNP0140056.0 [0,1,0,0,0,0|1,0,0]=2 173 B11R1.8 COC1=CC(=CC(=C1O)O)C CNP0147274.0 [0,1,0,0,0,0|1,0,0]=2 174 B11R1.8 COC1=CC(=CC(=C1O)O)O CNP0350475.0 [0,1,0,0,0,0|2,0,0]=3 175 B11R1.8 COC1=CC(=O)C=C(C1=O)C CNP0357550.0 [0,1,0,0,0,0|1,0,1]=3 176 B11R1.8 N#CC1=CC(=CC(=C1O)Br)Br CNP0275601.0 [0,1,0,0,0,0|2,0,1]=4 177 B11R1.8 O=C1C=C(C(=O)C(=C1)CO)Cl CNP0274303.0 [0,1,0,0,0,0|2,0,1]=4 178 B11R1.8 O=CC1=CC(=CC(=C1O)Br)Br CNP0248962.0 [0,1,0,0,0,0|2,0,1]=4 179 B11R1.8 OCC1=CC(=CC(=C1O)Br)O CNP0073176.0 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.8 OCC1=CC(=CC(=C1O)Cl)O CNP0321775.0 [0,1,0,0,0,0|2,0,0]=3 181 B11R1.8 OCC1=CC(=CC(=C1O)O)O CNP0551970.0 [0,1,0,0,0,0|2,0,0]=3 182 B11R1.14 C=CC1=CC(=C(C(=C1)Br)O)O CNP0580129.0 [0,1,0,0,0,0|2,0,1]=4 183 B11R1.14 CC1=CC(=CC(=C1O)C)C=O CNP0331607.0 [0,1,0,0,0,0|0,0,1]=2 184 B11R1.14 COC1=CC(=C(C(=C1)Br)O)Br CNP0419946.0 [0,1,0,0,0,0|2,0,0]=3 185 B11R1.14 COC1=CC(=C(C(=C1)C)Br)C CNP0205664.0 [0,1,0,0,0,0|1,0,0]=2 186 B11R1.14 COC1=CC(=C(C(=C1)C)O)C CNP0227213.0 [0,1,0,0,0,0|0,0,0]=1 187 B11R1.14 COC1=CC(=C(C(=C1)Cl)O)Cl CNP0210331.0 [0,1,0,0,0,0|2,0,0]=3 188 B11R1.14 COC1=CC(=C(C(=C1)O)C)O CNP0312414.0 [0,1,0,0,0,0|3,0,0]=4 189 B11R1.14 COC1=CC(=[N+](C(=C1)C)[O-])C CNP0605512.0 [0,1,0,0,0,0|1,0,1]=3 190 B11R1.14 N#CC1=CC(=C(C(=C1)O)O)O CNP0123806.0 [0,1,0,0,0,0|2,0,1]=4 191 B11R1.14 O=CC1=CC(=C(C(=C1)Br)O)Br CNP0188044.0 [0,1,0,0,0,0|2,0,1]=4 192 B11R1.14 O=CC1=CC(=C(C(=C1)Br)O)O CNP0146798.0 [0,1,0,0,0,0|2,0,1]=4 193 B11R1.14 O=CC1=CC(=C(C(=C1)O)O)O CNP0306277.0 [0,1,0,0,0,0|2,0,1]=4 194 B11R1.14 OCC1=CC(=C(C(=C1)Br)O)Br CNP0322070.0 [0,1,0,0,0,0|2,0,0]=3 195 B11R1.14 OCC1=CC(=C(C(=C1)Br)O)O CNP0347203.0 [0,1,0,0,0,0|2,0,0]=3 196 B11R1.14 OCC1=CC(=C(C(=C1)Cl)O)O CNP0147248.0 [0,1,0,0,0,0|2,0,0]=3 197 B11R1.14 OCC1=CC(=C(C(=C1)O)O)O CNP0196506.0 [0,1,0,0,0,0|2,0,0]=3 198 B11R1.32 CC1=C(C(=CC(=C1Cl)O)O)Cl CNP0430106.0 [0,1,0,0,0,0|3,0,0]=4 199 B11R1.32 CC1=C(C(=O)C=C(C1=O)O)O CNP0221051.0 [0,1,0,0,0,0|2,0,0]=3 200 B11R1.32 CC1=CC(=C(C(=C1C)Br)C)C CNP0228587.0 [0,1,0,0,0,0|2,0,0]=3 201 B11R1.32 CC1=CC(=C(C(=C1C)C)Br)C CNP0094730.0 [0,1,0,0,0,0|1,0,0]=2 202 B11R1.32 CC1=CC(=C(C(=C1C)C)C)Br CNP0068892.0 [0,1,0,0,0,0|2,0,0]=3 203 B11R1.32 CC1=CC(=C(C(=C1C)C)O)C CNP0205719.0 [0,1,0,0,0,0|0,0,0]=1 204 B11R1.32 CC1=CC(=C(C(=C1C)C)O)O CNP0288515.0 [0,1,0,0,0,0|1,0,0]=2 205 B11R1.32 CC1=CC(=C(C(=C1C)I)C)C CNP0069313.0 [0,1,0,0,0,0|2,0,0]=3 206 B11R1.32 CC1=CC(=C(C(=C1C)O)C)C CNP0212055.0 [0,1,0,0,0,0|2,0,0]=3 207 B11R1.32 CC1=CC(=C(C(=C1C)O)C)O CNP0324335.0 [0,1,0,0,0,0|3,0,0]=4 208 B11R1.32 CC1=CC(=C(C(=C1I)C)I)C CNP0030832.0 [0,1,0,0,0,0|1,0,0]=2 209 B11R1.32 CC1=CC(=C(C(=C1N)C)N)C CNP0600092.0 [0,1,0,0,0,0|1,0,0]=2 210 B11R1.32 CC1=CC(=C(C(=C1O)C)C)O CNP0086369.0 [0,1,0,0,0,0|1,0,0]=2 211 B11R1.32 CC1=CC(=C(C(=C1O)O)O)O CNP0166636.0 [0,1,0,0,0,0|2,0,0]=3 212 B11R1.32 CC1=CC(=O)C(=C(C1=O)C)C CNP0313155.0 [0,1,0,0,0,0|1,0,1]=3 213 B11R1.32 CC1=CC(=O)C(=C(C1=O)O)C CNP0231654.0 [0,1,0,0,0,0|2,0,1]=4 214 B11R1.32 CC1=CC(=O)C(=C(C1=O)O)O CNP0207805.0 [0,1,0,0,0,0|2,0,0]=3 215 B11R1.32 CC1=CN(C(=O)N(C1=O)C)C CNP0233790.0 [0,1,0,0,0,0|2,0,1]=4 216 B11R1.32 OC1=CC(=C(C(=C1Br)Br)O)Br CNP0046080.0 [0,1,0,0,0,0|3,0,0]=4 217 B11R1.32 OC1=CC(=C(C(=C1Cl)Cl)O)Cl CNP0083797.0 [0,1,0,0,0,0|3,0,0]=4 218 B11R1.32 OC1=CC(=C(C(=C1O)O)Br)O CNP0437743.0 [0,1,0,0,0,0|3,0,0]=4 219 B11R1.464 CC1=CC(=C(C(=C1)C)C=O)C CNP0234902.0 [0,1,0,0,0,0|0,0,1]=2 220 B11R1.464 CC1=CC(=C(C(=C1)C)N=O)C CNP0216799.0 [0,1,0,0,0,0|0,0,1]=2 221 B11R1.464 CC1=CC(=C(C(=C1)Cl)C=O)Cl CNP0026222.0 [0,1,0,0,0,0|2,0,1]=4 222 B11R1.464 CC1=CC(=C(C(=C1)O)C=O)O CNP0218508.0 [0,1,0,0,0,0|2,0,1]=4 223 B11R1.464 CC1=CC(=CC(=C1C=O)O)O CNP0115622.0 [0,1,0,0,0,0|2,0,1]=4 224 B11R1.464 CCC1=C(C=C(C=C1C)C)C CNP0246344.0 [0,1,0,0,0,0|1,0,0]=2 225 B11R1.464 CCC1=C(C=C(C=C1C)O)C CNP0365832.0 [0,1,0,0,0,0|2,0,0]=3 226 B11R1.464 CCC1=C(C=C(C=C1Cl)C)C CNP0233565.0 [0,1,0,0,0,0|2,0,0]=3 227 B11R1.464 COC1=C(C=C(C=C1Br)Br)Br CNP0126610.0 [0,1,0,0,0,0|3,0,0]=4 228 B11R1.464 COC1=C(C=C(C=C1Br)Br)O CNP0097750.0 [0,1,0,0,0,0|3,0,0]=4 229 B11R1.464 COC1=C(C=C(C=C1Br)O)Br CNP0178459.0 [0,1,0,0,0,0|3,0,0]=4 230 B11R1.464 COC1=C(C=C(C=C1C)C)C CNP0565570.0 [0,1,0,0,0,0|0,0,0]=1 231 B11R1.464 COC1=C(C=C(C=C1Cl)Cl)Cl CNP0178727.0 [0,1,0,0,0,0|3,0,0]=4 232 B11R1.464 COC1=C(C=C(C=C1O)O)O CNP0224483.0 [0,1,0,0,0,0|3,0,0]=4 233 B11R1.464 COC1=C(C=C(NC1=O)C)O CNP0316494.0 [0,1,0,0,0,0|3,0,0]=4 234 B11R1.1361 CC1=CC(C=C(C1=O)O)(C)C CNP0312318.0 [0,1,0,0,0,0|1,0,2]=4 235 B11R1.1361 CC1=CC(N=C(C1=O)C)(C)C CNP0412347.0 [0,1,0,0,0,0|1,0,2]=4 236 B9R0.34 CC=CC(=CC(=CC)C)C CNP0404267.0 [0,0,1,0,0,0|1,0,0]=2 237 B9R0.34 CCC=C(C)C=C(C)CO CNP0110428.0 [0,0,1,0,0,0|0,0,2]=3 238 B11R2.610 CC1=CC(=C2CCC2=C1)C CNP0050950.0 [0,0,0,1,0,0|1,0,0]=2 239 B9R1.37 C=C1CC(=C(C1=O)C)C CNP0259066.0 [0,0,0,0,1,0|0,0,3]=4 240 B9R1.37 C=C1OC(=C(C1=O)O)C CNP0458882.0 [0,0,0,0,1,0|2,0,1]=4 241 B9R1.37 CC1=C(C(=C(N1)C)C)C CNP0159162.0 [0,0,0,0,1,0|2,0,0]=3 242 B9R1.37 CC1=C(C(=O)C[C@H]1C)O CNP0318056.1 [0,0,0,0,1,0|1,0,2]=4 243 B9R1.37 CC1=C(C(=O)O[C@@H]1C)O CNP0413738.1 [0,0,0,0,1,0|2,0,1]=4 244 B9R1.37 CC1=C(C(=O)O[C@H]1C)O CNP0413738.2 [0,0,0,0,1,0|2,0,1]=4 245 B9R1.37 CC1=C(C(=O)[C@@H](C1)C)C CNP0135578.1 [0,0,0,0,1,0|0,0,3]=4 246 B9R1.37 CC1=C(C(=O)[C@@H](C1)C)O CNP0306768.1 [0,0,0,0,1,0|1,0,2]=4 247 B9R1.37 CC1=C(C(=O)[C@@H](O1)C)O CNP0310181.1 [0,0,0,0,1,0|2,0,1]=4 248 B9R1.37 CC1=C(C(=O)[C@H](O1)C)O CNP0310181.2 [0,0,0,0,1,0|2,0,1]=4 249 B9R1.37 CC1=C(C(C(=O)O1)O)C CNP0600080.0 [0,0,0,0,1,0|2,0,1]=4 250 B9R1.37 CC1=CC(=O)N(C1=O)C CNP0017910.0 [0,0,0,0,1,0|2,0,1]=4 251 B11R1.494 CC1=CC(=C(C(=O)C=C1)O)O CNP0455660.0 [0,0,0,0,0,1|2,0,0]=3 252 B11R1.494 CC1=CC=C(C(=O)C(=C1)Cl)Cl CNP0364082.0 [0,0,0,0,0,1|2,0,1]=4 253 B8R0.6 CC(=CC=CC=O)CO CNP0246608.0 [1,0,1,0,0,0|1,0,1]=4 254 B8R0.19 CC=C(C)C=C(C)C=O CNP0259001.0 [1,0,1,0,0,0|0,0,1]=3 255 B8R0.19 CC=C(C)C=C(C)CO CNP0307713.0 [1,0,1,0,0,0|0,0,1]=3 256 B8R1.4 CC1=CC(=CC=N1)O CNP0308761.0 [2,0,0,0,0,0|2,0,0]=4 257 B8R1.4 CC1=CC(=O)C=CN1 CNP0513735.0 [2,0,0,0,0,0|2,0,0]=4 258 B8R1.4 CC1=CC(=O)C=CO1 CNP0179458.0 [2,0,0,0,0,0|2,0,0]=4 259 B8R1.4 CC1=CC=CC(=C1)Br CNP0039148.0 [2,0,0,0,0,0|1,0,0]=3 260 B8R1.4 CC1=CC=CC(=C1)C CNP0152592.0 [2,0,0,0,0,0|0,0,0]=2 261 B8R1.4 CC1=CC=CC(=C1)Cl CNP0583031.0 [2,0,0,0,0,0|1,0,0]=3 262 B8R1.4 CC1=CC=CC(=C1)N CNP0300821.0 [2,0,0,0,0,0|1,0,0]=3 263 B8R1.4 CC1=CC=CC(=C1)O CNP0355586.0 [2,0,0,0,0,0|1,0,0]=3 264 B8R1.4 CC1=CC=CC(=N1)Br CNP0033684.0 [2,0,0,0,0,0|2,0,0]=4 265 B8R1.4 CC1=CC=CC(=N1)C CNP0246832.0 [2,0,0,0,0,0|1,0,0]=3 266 B8R1.4 CC1=CC=CC(=N1)N CNP0039742.0 [2,0,0,0,0,0|2,0,0]=4 267 B8R1.4 CC1=CC=C[N+](=C1)[O-] CNP0579325.0 [2,0,0,0,0,0|2,0,0]=4 268 B8R1.4 CC1=CC=NC(=C1)C CNP0143367.0 [2,0,0,0,0,0|1,0,0]=3 269 B8R1.4 CC1=CC=NC(=C1)N CNP0425527.0 [2,0,0,0,0,0|2,0,0]=4 270 B8R1.4 CC1=CC=[NH+]C(=C1)N CNP0513297.0 [2,0,0,0,0,0|2,0,0]=4 271 B8R1.4 CC1=CCCC(=C1)C CNP0118398.0 [2,0,0,0,0,0|0,0,2]=4 272 B8R1.4 CC1=CN=CC(=C1)C CNP0366505.0 [2,0,0,0,0,0|1,0,0]=3 273 B8R1.4 CC1=CN=CC(=C1)O CNP0135310.0 [2,0,0,0,0,0|2,0,0]=4 274 B8R1.4 CC1=CN=CC(=N1)C CNP0296461.0 [2,0,0,0,0,0|2,0,0]=4 275 B8R1.4 ClC1=CC=CC(=C1)Cl CNP0080171.0 [2,0,0,0,0,0|2,0,0]=4 276 B8R1.4 NC1=CC=CC(=C1)Cl CNP0066965.0 [2,0,0,0,0,0|2,0,0]=4 277 B8R1.4 NC1=CC=CC(=C1)N CNP0033147.0 [2,0,0,0,0,0|2,0,0]=4 278 B8R1.4 NC1=CC=CC(=C1)O CNP0172517.0 [2,0,0,0,0,0|2,0,0]=4 279 B8R1.4 OC1=CC=CC(=C1)Cl CNP0109649.0 [2,0,0,0,0,0|2,0,0]=4 280 B8R1.4 OC1=CC=CC(=C1)O CNP0414137.0 [2,0,0,0,0,0|2,0,0]=4 281 B8R1.4 [O-]C1=CC=CC(=C1)[O-] CNP0552554.0 [2,0,0,0,0,0|2,0,0]=4 282 B8R1.5 C=C1[CH]C=CC=C1C CNP0546829.0 [2,0,0,0,0,0|1,0,1]=4 283 B8R1.5 CC1=CC=CC=C1Br CNP0035566.0 [2,0,0,0,0,0|1,0,0]=3 284 B8R1.5 CC1=CC=CC=C1C CNP0365784.0 [2,0,0,0,0,0|1,0,0]=3 285 B8R1.5 CC1=CC=CC=C1Cl CNP0335361.0 [2,0,0,0,0,0|1,0,0]=3 286 B8R1.5 CC1=CC=CC=C1N CNP0178803.0 [2,0,0,0,0,0|1,0,0]=3 287 B8R1.5 CC1=CC=CC=C1O CNP0242840.0 [2,0,0,0,0,0|0,0,0]=2 288 B8R1.5 CC1=CC=CC=C1S CNP0309831.0 [2,0,0,0,0,0|0,1,0]=3 289 B8R1.5 CC1=CC=CC=[N+]1C CNP0553099.0 [2,0,0,0,0,0|2,0,0]=4 290 B8R1.5 CC1=CC=CC=[N+]1[O-] CNP0511667.0 [2,0,0,0,0,0|1,0,1]=4 291 B8R1.5 CC1=CC=CN=C1C CNP0151242.0 [2,0,0,0,0,0|2,0,0]=4 292 B8R1.5 CC1=CC=CN=C1N CNP0505128.0 [2,0,0,0,0,0|2,0,0]=4 293 B8R1.5 CC1=CC=C[NH+]=C1N CNP0549558.0 [2,0,0,0,0,0|2,0,0]=4 294 B8R1.5 CC1=CC=NC=C1C CNP0275303.0 [2,0,0,0,0,0|2,0,0]=4 295 B8R1.5 CC1=CC=NC=C1N CNP0236716.0 [2,0,0,0,0,0|2,0,0]=4 296 B8R1.5 CC1=NC=CC=C1O CNP0418507.0 [2,0,0,0,0,0|1,0,0]=3 297 B8R1.5 ClC1=CC=CC=C1Cl CNP0284887.0 [2,0,0,0,0,0|2,0,0]=4 298 B8R1.5 NC1=CC=CC=C1Br CNP0295031.0 [2,0,0,0,0,0|2,0,0]=4 299 B8R1.5 NC1=CC=CC=C1N CNP0232275.0 [2,0,0,0,0,0|2,0,0]=4 300 B8R1.5 NC1=CC=CC=C1O CNP0115137.0 [2,0,0,0,0,0|1,0,0]=3 301 B8R1.5 NC1=CC=CC=C1S CNP0083879.0 [2,0,0,0,0,0|1,1,0]=4 302 B8R1.5 O=C1C=CC=CC1=O CNP0309111.0 [2,0,0,0,0,0|1,0,1]=4 303 B8R1.5 O=C1C=CCC=C1O CNP0560107.0 [2,0,0,0,0,0|1,0,1]=4 304 B8R1.5 O=C1C=CNC=C1O CNP0258387.0 [2,0,0,0,0,0|2,0,0]=4 305 B8R1.5 O=C1C=COC=C1O CNP0116604.0 [2,0,0,0,0,0|2,0,0]=4 306 B8R1.5 O=C1NC=CC=C1O CNP0598897.0 [2,0,0,0,0,0|2,0,0]=4 307 B8R1.5 O=C1OC=CC=C1O CNP0103332.0 [2,0,0,0,0,0|2,0,0]=4 308 B8R1.5 OC1=CC=CC=C1Br CNP0083000.0 [2,0,0,0,0,0|1,0,0]=3 309 B8R1.5 OC1=CC=CC=C1Cl CNP0071171.0 [2,0,0,0,0,0|1,0,0]=3 310 B8R1.5 OC1=CC=CC=C1O CNP0143972.0 [2,0,0,0,0,0|1,0,0]=3 311 B8R1.5 OC1=CC=CN=C1I CNP0061816.0 [2,0,0,0,0,0|2,0,0]=4 312 B8R1.5 OC1=CC=CN=C1O CNP0082051.0 [2,0,0,0,0,0|2,0,0]=4 313 B8R1.5 OC1=CC=NC=C1O CNP0510670.0 [2,0,0,0,0,0|2,0,0]=4 314 B8R1.5 ON1C=CC=CC1=S CNP0586487.0 [2,0,0,0,0,0|2,0,0]=4 315 B8R1.5 O[14C]1=[14CH][14CH]=[14CH][14CH]=[14C]1O CNP0513395.0 [2,0,0,0,0,0|1,0,0]=3 316 B8R1.5 [CH2]C1=CC=CC=C1C CNP0593977.0 [2,0,0,0,0,0|1,0,0]=3 317 B8R1.3 BrC1=CC=C(C=C1)Br CNP0468033.0 [2,0,0,0,0,0|2,0,0]=4 318 B8R1.3 C=C1C=CC(=O)C=C1 CNP0610154.0 [2,0,0,0,0,0|0,0,2]=4 319 B8R1.3 CC1=CC=C(C=C1)Br CNP0372052.0 [2,0,0,0,0,0|1,0,0]=3 320 B8R1.3 CC1=CC=C(C=C1)C CNP0227482.0 [2,0,0,0,0,0|1,0,0]=3 321 B8R1.3 CC1=CC=C(C=C1)Cl CNP0177290.0 [2,0,0,0,0,0|1,0,0]=3 322 B8R1.3 CC1=CC=C(C=C1)N CNP0232157.0 [2,0,0,0,0,0|1,0,0]=3 323 B8R1.3 CC1=CC=C(C=C1)O CNP0267550.0 [2,0,0,0,0,0|0,0,0]=2 324 B8R1.3 CC1=CC=C(C=C1)S CNP0315228.0 [2,0,0,0,0,0|0,1,0]=3 325 B8R1.3 CC1=CC=C(C=N1)N CNP0257052.0 [2,0,0,0,0,0|2,0,0]=4 326 B8R1.3 CC1=CC=C(C=N1)O CNP0164492.0 [2,0,0,0,0,0|1,0,0]=3 327 B8R1.3 CC1=CC=C(N=C1)C CNP0244329.0 [2,0,0,0,0,0|2,0,0]=4 328 B8R1.3 CC1=CC=C(N=C1)N CNP0531563.0 [2,0,0,0,0,0|2,0,0]=4 329 B8R1.3 CC1=CC=C(N=C1)O CNP0541416.0 [2,0,0,0,0,0|1,0,0]=3 330 B8R1.3 CC1=CC=C([NH+]=C1)N CNP0549835.0 [2,0,0,0,0,0|2,0,0]=4 331 B8R1.3 CC1=CNC(=O)C=C1 CNP0085670.0 [2,0,0,0,0,0|1,0,1]=4 332 B8R1.3 CN1C=CC(=N)C=C1 CNP0407521.0 [2,0,0,0,0,0|2,0,0]=4 333 B8R1.3 ClC1=CC=C(C=C1)Cl CNP0341270.0 [2,0,0,0,0,0|2,0,0]=4 334 B8R1.3 NC1=CC=C(C=C1)Br CNP0044742.0 [2,0,0,0,0,0|2,0,0]=4 335 B8R1.3 NC1=CC=C(C=C1)I CNP0290133.0 [2,0,0,0,0,0|2,0,0]=4 336 B8R1.3 NC1=CC=C(C=C1)N CNP0208924.0 [2,0,0,0,0,0|2,0,0]=4 337 B8R1.3 NC1=CC=C(C=C1)O CNP0149529.0 [2,0,0,0,0,0|1,0,0]=3 338 B8R1.3 O=C1C=CC(=CN1)O CNP0491283.0 [2,0,0,0,0,0|2,0,0]=4 339 B8R1.3 O=C1C=CC(=O)C=C1 CNP0164682.0 [2,0,0,0,0,0|1,0,1]=4 340 B8R1.3 OC1=CC=C(C=C1)Br CNP0085593.0 [2,0,0,0,0,0|1,0,0]=3 341 B8R1.3 OC1=CC=C(C=C1)Cl CNP0334769.0 [2,0,0,0,0,0|1,0,0]=3 342 B8R1.3 OC1=CC=C(C=C1)I CNP0471533.0 [2,0,0,0,0,0|1,0,0]=3 343 B8R1.3 OC1=CC=C(C=C1)O CNP0246516.0 [2,0,0,0,0,0|1,0,0]=3 344 B8R1.3 OC1=CC=C(C=C1)S CNP0531619.0 [2,0,0,0,0,0|1,0,0]=3 345 B8R1.3 OC1=CC=C(N=C1)O CNP0381187.0 [2,0,0,0,0,0|2,0,0]=4 346 B10R0.44 C=CC(=CC(=O)C=C(C)C)C CNP0174615.0 [0,1,1,0,0,0|2,0,0]=4 347 B10R1.2 C#[N+]C1=CC=CC(=C1O)N CNP0440267.0 [1,1,0,0,0,0|1,0,1]=4 348 B10R1.2 CC1=CC=CC(=C1C)C#N CNP0139053.0 [1,1,0,0,0,0|1,0,1]=4 349 B10R1.2 CC1=CC=CC(=C1C)C=O CNP0501818.0 [1,1,0,0,0,0|1,0,1]=4 350 B10R1.2 CCC1=C(C(=O)C=CO1)O CNP0197022.0 [1,1,0,0,0,0|2,0,0]=4 351 B10R1.2 CCC1=CC=CC(=C1C)C CNP0183405.0 [1,1,0,0,0,0|1,0,0]=3 352 B10R1.2 CCC1=CC=CC(=C1O)C CNP0284386.0 [1,1,0,0,0,0|0,0,0]=2 353 B10R1.2 CCC1=CC=CC(=C1O)O CNP0002512.0 [1,1,0,0,0,0|1,0,0]=3 354 B10R1.2 COC1=CC=CC(=C1C)C CNP0198695.0 [1,1,0,0,0,0|1,0,0]=3 355 B10R1.2 COC1=CC=CC(=C1N)C CNP0448107.0 [1,1,0,0,0,0|1,0,0]=3 356 B10R1.2 COC1=CC=CC(=C1O)I CNP0386670.0 [1,1,0,0,0,0|1,0,0]=3 357 B10R1.2 COC1=CC=CC(=C1O)O CNP0330888.0 [1,1,0,0,0,0|1,0,0]=3 358 B10R1.2 COC1=CC=CC(=O)C1=O CNP0358042.0 [1,1,0,0,0,0|1,0,1]=4 359 B10R1.2 O=C1C=COC(=C1O)CO CNP0298786.0 [1,1,0,0,0,0|2,0,0]=4 360 B10R1.2 O=CC1=CC=CC(=C1O)O CNP0104242.0 [1,1,0,0,0,0|1,0,1]=4 361 B10R1.2 OCC1=CC=CC(=C1O)O CNP0210787.0 [1,1,0,0,0,0|1,0,0]=3 362 B10R1.2 [2H]C1=CC=CC(=C1O)OC CNP0538068.0 [1,1,0,0,0,0|1,0,0]=3 363 B10R1.119 CC1=C(C(=O)C(=CO1)C)O CNP0126465.0 [1,1,0,0,0,0|2,0,0]=4 364 B10R1.119 CC1=C(C(=O)C(=CO1)O)O CNP0249032.0 [1,1,0,0,0,0|2,0,0]=4 365 B10R1.119 CC1=C(C(=O)C=CC1=O)C CNP0252044.0 [1,1,0,0,0,0|2,0,0]=4 366 B10R1.119 CC1=C(C(=O)C=CC1=O)O CNP0304817.0 [1,1,0,0,0,0|1,0,0]=3 367 B10R1.119 CC1=C(C(=O)C=CN1C)O CNP0409474.0 [1,1,0,0,0,0|2,0,0]=4 368 B10R1.119 CC1=C(C=CC(=C1C)O)N CNP0562106.0 [1,1,0,0,0,0|2,0,0]=4 369 B10R1.119 CC1=C(C=CC(=C1C)O)O CNP0119775.0 [1,1,0,0,0,0|2,0,0]=4 370 B10R1.119 CC1=C(C=CC(=C1O)O)O CNP0354287.0 [1,1,0,0,0,0|1,0,0]=3 371 B10R1.119 CC1=CC=C(C(=C1C)C)C CNP0376974.0 [1,1,0,0,0,0|1,0,0]=3 372 B10R1.119 CC1=CC=C(C(=C1C)O)C CNP0224100.0 [1,1,0,0,0,0|0,0,0]=2 373 B10R1.119 CC1=CC=C(C(=C1C)O)O CNP0352924.0 [1,1,0,0,0,0|1,0,0]=3 374 B10R1.119 CC1=CC=C(C(=C1Cl)C)S CNP0345116.0 [1,1,0,0,0,0|1,0,0]=3 375 B10R1.119 CC1=CC=C(C(=C1O)C)O CNP0142427.0 [1,1,0,0,0,0|0,0,0]=2 376 B10R1.119 CC1=CC=C(C(=C1O)O)C CNP0183636.0 [1,1,0,0,0,0|1,0,0]=3 377 B10R1.119 CC1=CN=C(C(=C1C)C)C CNP0265742.0 [1,1,0,0,0,0|2,0,0]=4 378 B10R1.119 O=C1C=CC(=O)C(=C1O)O CNP0263917.0 [1,1,0,0,0,0|2,0,0]=4 379 B10R1.119 OC1=C(C=CC(=C1O)Cl)Cl CNP0043594.0 [1,1,0,0,0,0|2,0,0]=4 380 B10R1.119 OC1=CC=C(C(=C1Br)O)Br CNP0192123.0 [1,1,0,0,0,0|2,0,0]=4 381 B10R1.119 OC1=CC=C(C(=C1O)O)O CNP0189021.0 [1,1,0,0,0,0|2,0,0]=4 382 B10R1.245 CC1=CC=CC(=C1C#N)C CNP0139271.0 [1,1,0,0,0,0|1,0,0]=3 383 B10R1.245 CC1=CC=CC(=C1C=O)C CNP0561651.0 [1,1,0,0,0,0|0,0,1]=3 384 B10R1.245 CC1=CC=CC(=C1C=O)O CNP0298218.0 [1,1,0,0,0,0|1,0,1]=4 385 B10R1.245 CC1=CC=CC(=C1CO)O CNP0321165.0 [1,1,0,0,0,0|1,0,0]=3 386 B10R1.245 CCC1=C(C=CC=C1C)C CNP0182931.0 [1,1,0,0,0,0|1,0,0]=3 387 B10R1.245 CNC1=C(C=CC=C1C)C CNP0282095.0 [1,1,0,0,0,0|1,0,0]=3 388 B10R1.245 COC1=C(C=CC=C1Br)Br CNP0017925.0 [1,1,0,0,0,0|2,0,0]=4 389 B10R1.245 COC1=C(C=CC=C1C)C CNP0308029.0 [1,1,0,0,0,0|0,0,0]=2 390 B10R1.245 COC1=C(C=CC=C1Cl)Cl CNP0143389.0 [1,1,0,0,0,0|2,0,0]=4 391 B10R1.245 COC1=C(C=CC=C1O)O CNP0193285.0 [1,1,0,0,0,0|2,0,0]=4 392 B10R1.245 COC1=C(NC=CC1=O)C CNP0226695.0 [1,1,0,0,0,0|2,0,0]=4 393 B10R1.245 COC1=C(OC=CC1=O)C CNP0167853.0 [1,1,0,0,0,0|2,0,0]=4 394 B10R1.301 CC1=CC=CC(C1=O)(C)C CNP0077154.0 [1,1,0,0,0,0|0,0,2]=4 395 B10R1.8 C#CC1=CC(=CC(=C1)C)C CNP0069485.0 [1,1,0,0,0,0|0,0,1]=3 396 B10R1.8 C=CC1=CC(=CC(=C1)C)C CNP0039391.0 [1,1,0,0,0,0|0,0,1]=3 397 B10R1.8 CC1=CC(=CC(=C1)C#N)C CNP0079258.0 [1,1,0,0,0,0|0,0,1]=3 398 B10R1.8 CC1=CC(=CC(=C1)C=O)C CNP0196447.0 [1,1,0,0,0,0|0,0,1]=3 399 B10R1.8 CC1=CC(=CC(=C1)C=O)O CNP0067641.0 [1,1,0,0,0,0|1,0,1]=4 400 B10R1.8 CC1=CC(=CC(=C1)CO)C CNP0300262.0 [1,1,0,0,0,0|0,0,0]=2 401 B10R1.8 CC1=CC(=CC(=C1)NN)C CNP0042212.0 [1,1,0,0,0,0|1,0,0]=3 402 B10R1.8 CC1=CC(=O)C=C(O1)CO CNP0356793.0 [1,1,0,0,0,0|2,0,0]=4 403 B10R1.8 CC1=CC(=O)OC(=C1)CBr CNP0047993.0 [1,1,0,0,0,0|2,0,0]=4 404 B10R1.8 CCC1=CC(=CC(=C1)C)C CNP0504620.0 [1,1,0,0,0,0|0,0,0]=2 405 B10R1.8 CCC1=CC(=CC(=C1)O)C CNP0307978.0 [1,1,0,0,0,0|1,0,0]=3 406 B10R1.8 CCC1=CC(=CC(=N1)C)C CNP0160210.0 [1,1,0,0,0,0|1,0,0]=3 407 B10R1.8 CCC1=CC(=NC(=C1)C)C CNP0234681.0 [1,1,0,0,0,0|1,0,0]=3 408 B10R1.8 COC1=CC(=CC(=C1)C)C CNP0153704.0 [1,1,0,0,0,0|0,0,0]=2 409 B10R1.8 COC1=CC(=CC(=C1)Cl)Cl CNP0017966.0 [1,1,0,0,0,0|2,0,0]=4 410 B10R1.8 COC1=CC(=CC(=C1)O)C CNP0325489.0 [1,1,0,0,0,0|1,0,0]=3 411 B10R1.8 COC1=CC(=CC(=C1)O)O CNP0081787.0 [1,1,0,0,0,0|2,0,0]=4 412 B10R1.8 COC1=CC(=O)OC(=C1)C CNP0494967.0 [1,1,0,0,0,0|2,0,0]=4 413 B10R1.8 OCC1=CC(=CC(=C1)O)O CNP0197323.0 [1,1,0,0,0,0|2,0,0]=4 414 B10R1.329 CC1=CC(CC(=C1)C)(C)C CNP0076041.0 [1,1,0,0,0,0|0,0,2]=4 415 B10R1.25 C=CC1=CC=C(C=C1C)C CNP0479270.0 [1,1,0,0,0,0|1,0,0]=3 416 B10R1.25 CC1=CC(=C(C=N1)C#N)C CNP0069171.0 [1,1,0,0,0,0|2,0,0]=4 417 B10R1.25 CC1=CC(=CC=C1N=O)N CNP0033954.0 [1,1,0,0,0,0|1,0,1]=4 418 B10R1.25 CC1=CC(=O)C=CC1=NO CNP0220999.0 [1,1,0,0,0,0|1,0,0]=3 419 B10R1.25 CC1=CC=C(C(=C1)C)C#N CNP0033930.0 [1,1,0,0,0,0|1,0,0]=3 420 B10R1.25 CC1=CC=C(C(=C1)C)C=O CNP0194374.0 [1,1,0,0,0,0|0,0,1]=3 421 B10R1.25 CC1=CC=C(C(=C1)C)CCl CNP0377096.0 [1,1,0,0,0,0|1,0,0]=3 422 B10R1.25 CC1=CC=C(C(=C1)C)CO CNP0490250.0 [1,1,0,0,0,0|0,0,0]=2 423 B10R1.25 CC1=CC=C(C(=C1)Cl)C#N CNP0353020.0 [1,1,0,0,0,0|2,0,0]=4 424 B10R1.25 CC1=CC=C(C(=C1)O)C=O CNP0384037.0 [1,1,0,0,0,0|1,0,1]=4 425 B10R1.25 CCC1=CC=C(C=C1C)C CNP0219596.0 [1,1,0,0,0,0|1,0,0]=3 426 B10R1.25 CCC1=CC=C(C=C1O)C CNP0289222.0 [1,1,0,0,0,0|2,0,0]=4 427 B10R1.25 COC1=CC=C(C=C1Br)Br CNP0018124.0 [1,1,0,0,0,0|2,0,0]=4 428 B10R1.25 COC1=CC=C(C=C1C)C CNP0076750.0 [1,1,0,0,0,0|0,0,0]=2 429 B10R1.25 COC1=CC=C(C=C1C)O CNP0142095.0 [1,1,0,0,0,0|1,0,0]=3 430 B10R1.25 COC1=CC=C(C=C1I)I CNP0051717.0 [1,1,0,0,0,0|2,0,0]=4 431 B10R1.25 COC1=CC=C(C=C1N)C CNP0028982.0 [1,1,0,0,0,0|1,0,0]=3 432 B10R1.25 COC1=CC=C(C=C1N)O CNP0285627.0 [1,1,0,0,0,0|2,0,0]=4 433 B10R1.25 COC1=CC=C(C=C1O)C CNP0345030.0 [1,1,0,0,0,0|1,0,0]=3 434 B10R1.25 COC1=CC=C(C=C1O)O CNP0160849.0 [1,1,0,0,0,0|2,0,0]=4 435 B10R1.25 COC1=CC=[N+](C=C1C)[O-] CNP0606691.0 [1,1,0,0,0,0|2,0,0]=4 436 B10R1.25 COC1=NC=C(N=C1C)C CNP0234083.0 [1,1,0,0,0,0|2,0,0]=4 437 B10R1.25 OCC1=CC=C(C=C1Cl)Cl CNP0569884.0 [1,1,0,0,0,0|2,0,0]=4 438 B10R1.30 C=CC1=CC(=CC=C1C)C CNP0027363.0 [1,1,0,0,0,0|1,0,1]=4 439 B10R1.30 CC1=CC=C(C(=C1)C#N)C CNP0233289.0 [1,1,0,0,0,0|1,0,1]=4 440 B10R1.30 CC1=CC=C(C(=C1)C#N)Cl CNP0033668.0 [1,1,0,0,0,0|1,0,1]=4 441 B10R1.30 CC1=CC=C(C(=C1)C=O)C CNP0076382.0 [1,1,0,0,0,0|1,0,1]=4 442 B10R1.30 CC1=CC=C(C(=C1)CO)C CNP0281493.0 [1,1,0,0,0,0|1,0,0]=3 443 B10R1.30 CCC1=CC(=CC=C1C)C CNP0220953.0 [1,1,0,0,0,0|1,0,0]=3 444 B10R1.30 CCC1=CC(=CC=C1C)O CNP0305920.0 [1,1,0,0,0,0|2,0,0]=4 445 B10R1.30 CCC1=CC(=CC=C1O)C CNP0329742.0 [1,1,0,0,0,0|0,0,0]=2 446 B10R1.30 CCC1=CC(=CC=C1O)O CNP0246876.0 [1,1,0,0,0,0|1,0,0]=3 447 B10R1.30 CCC1=CC(=O)C=CC1=O CNP0391524.0 [1,1,0,0,0,0|1,0,1]=4 448 B10R1.30 CCC1=NC(=CC=C1O)C CNP0422716.0 [1,1,0,0,0,0|1,0,0]=3 449 B10R1.30 COC1=CC(=CC=C1C)C CNP0250959.0 [1,1,0,0,0,0|1,0,0]=3 450 B10R1.30 COC1=CC(=CC=C1N)O CNP0304667.0 [1,1,0,0,0,0|2,0,0]=4 451 B10R1.30 COC1=CC(=CC=C1O)C CNP0264266.0 [1,1,0,0,0,0|0,0,0]=2 452 B10R1.30 COC1=CC(=CC=C1O)O CNP0204166.0 [1,1,0,0,0,0|1,0,0]=3 453 B10R1.30 COC1=CC(=N)C=CC1=O CNP0141181.0 [1,1,0,0,0,0|1,0,1]=4 454 B10R1.30 COC1=CC(=O)C=CC1=O CNP0221542.0 [1,1,0,0,0,0|1,0,1]=4 455 B10R1.30 N#CC1=CC(=CC=C1O)O CNP0284631.0 [1,1,0,0,0,0|1,0,1]=4 456 B10R1.30 O=C1C=C(C(=CO1)O)CO CNP0349514.0 [1,1,0,0,0,0|2,0,0]=4 457 B10R1.30 O=C1C=CC(=O)C(=C1)CO CNP0212904.0 [1,1,0,0,0,0|1,0,1]=4 458 B10R1.30 O=CC1=CC(=CC=C1O)O CNP0326066.0 [1,1,0,0,0,0|1,0,1]=4 459 B10R1.30 OCC1=CC(=CC=C1Cl)O CNP0112835.0 [1,1,0,0,0,0|2,0,0]=4 460 B10R1.30 OCC1=CC(=CC=C1O)O CNP0290995.0 [1,1,0,0,0,0|1,0,0]=3 461 B10R1.118 CC1=C(C=C(C(=C1)C)C)C CNP0218764.0 [1,1,0,0,0,0|1,0,0]=3 462 B10R1.118 CC1=CC(=C(C=C1Br)C)Br CNP0024349.0 [1,1,0,0,0,0|2,0,0]=4 463 B10R1.118 CC1=CC(=C(C=C1C)N)N CNP0106845.0 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.118 CC1=CC(=C(C=C1C)O)C CNP0242109.0 [1,1,0,0,0,0|0,0,0]=2 465 B10R1.118 CC1=CC(=C(C=C1Cl)C)Cl CNP0062326.0 [1,1,0,0,0,0|2,0,0]=4 466 B10R1.118 CC1=CC(=C(C=C1O)C)O CNP0533659.0 [1,1,0,0,0,0|1,0,0]=3 467 B10R1.118 CC1=CC(=C(N=C1C)C)C CNP0272756.0 [1,1,0,0,0,0|2,0,0]=4 468 B10R1.118 CC1=CC(=O)C(=CC1=O)C CNP0221747.0 [1,1,0,0,0,0|1,0,1]=4 469 B10R1.118 CC1=CC(=O)C(=CC1=O)O CNP0288982.0 [1,1,0,0,0,0|1,0,0]=3 470 B10R1.118 CC1=CN(C(=O)N=C1O)C CNP0516273.0 [1,1,0,0,0,0|2,0,0]=4 471 B10R1.118 O=C1C=C(C(=O)C=C1O)O CNP0327645.0 [1,1,0,0,0,0|2,0,0]=4 472 B10R1.118 OC1=C(C=C(C(=C1)O)O)O CNP0611719.0 [1,1,0,0,0,0|2,0,0]=4 473 B10R1.118 OC1=CC(=C(C=C1Cl)O)Cl CNP0067457.0 [1,1,0,0,0,0|2,0,0]=4 474 B10R1.118 OC1=CC(=C(C=C1O)Br)Br CNP0556999.0 [1,1,0,0,0,0|2,0,0]=4 475 B10R1.176 C=CC1=CC=C(C(=C1)C)C CNP0083008.0 [1,1,0,0,0,0|1,0,1]=4 476 B10R1.176 C=CC1=CC=C(C(=C1)O)O CNP0218096.0 [1,1,0,0,0,0|1,0,1]=4 477 B10R1.176 CC1=CC(=CC=C1N)N=O CNP0042604.0 [1,1,0,0,0,0|2,0,0]=4 478 B10R1.176 CC1=CC(=CC=C1O)C=O CNP0018890.0 [1,1,0,0,0,0|0,0,1]=3 479 B10R1.176 CC1=CC(=NO)C=CC1=O CNP0254335.0 [1,1,0,0,0,0|1,0,1]=4 480 B10R1.176 CC1=CC=C(C=C1C)C#N CNP0181583.0 [1,1,0,0,0,0|1,0,1]=4 481 B10R1.176 CC1=CC=C(C=C1C)CO CNP0515257.0 [1,1,0,0,0,0|1,0,0]=3 482 B10R1.176 CCC1=CC=C(C(=C1)C)C CNP0111798.0 [1,1,0,0,0,0|1,0,0]=3 483 B10R1.176 CCC1=CC=C(C(=C1)C)O CNP0271974.0 [1,1,0,0,0,0|0,0,0]=2 484 B10R1.176 CCC1=CC=C(C(=C1)O)C CNP0152157.0 [1,1,0,0,0,0|2,0,0]=4 485 B10R1.176 CCC1=CC=C(C(=C1)O)O CNP0344368.0 [1,1,0,0,0,0|1,0,0]=3 486 B10R1.176 CCC1=CC=C(C(=N1)C)C CNP0105764.0 [1,1,0,0,0,0|2,0,0]=4 487 B10R1.176 COC1=CC=C(C(=C1)C)Br CNP0334567.0 [1,1,0,0,0,0|1,0,0]=3 488 B10R1.176 COC1=CC=C(C(=C1)C)Cl CNP0187648.0 [1,1,0,0,0,0|1,0,0]=3 489 B10R1.176 COC1=CC=C(C(=C1)C)O CNP0175131.0 [1,1,0,0,0,0|0,0,0]=2 490 B10R1.176 COC1=CC=C(C(=C1)Cl)Cl CNP0369428.0 [1,1,0,0,0,0|2,0,0]=4 491 B10R1.176 COC1=CC=C(C(=C1)N)O CNP0323578.0 [1,1,0,0,0,0|1,0,0]=3 492 B10R1.176 COC1=CC=C(C(=C1)O)O CNP0241033.0 [1,1,0,0,0,0|1,0,0]=3 493 B10R1.176 N#CC1=CC=C(C(=C1)O)O CNP0155663.0 [1,1,0,0,0,0|1,0,1]=4 494 B10R1.176 NC1=CC(=CC=C1O)C=O CNP0343365.0 [1,1,0,0,0,0|1,0,1]=4 495 B10R1.176 NCC1=CC=C(C(=C1)O)O CNP0353669.0 [1,1,0,0,0,0|1,0,0]=3 496 B10R1.176 O=C1C=C(OC=C1O)CO CNP0328434.0 [1,1,0,0,0,0|2,0,0]=4 497 B10R1.176 O=CC1=CC=C(C(=C1)Br)O CNP0212461.0 [1,1,0,0,0,0|1,0,1]=4 498 B10R1.176 O=CC1=CC=C(C(=C1)O)O CNP0203672.0 [1,1,0,0,0,0|1,0,1]=4 499 B10R1.176 OCC1=CC=C(C(=C1)Br)O CNP0161139.0 [1,1,0,0,0,0|1,0,0]=3 500 B10R1.176 OCC1=CC=C(C(=C1)O)O CNP0262481.0 [1,1,0,0,0,0|1,0,0]=3 501 B10R1.34 CC=C1OC(=C(C1=O)O)C CNP0081746.0 [0,1,0,0,1,0|2,0,0]=4 502 B10R1.191 C=C1C(=C(C(=C1C)C)C)C CNP0566839.0 [0,1,0,0,1,0|1,0,0]=3 503 B10R1.191 CC1=C(C(C(=C1C)C)C)C CNP0153262.0 [0,1,0,0,1,0|1,0,1]=4 504 B10R1.256 CCC1=C(NC(=C1C)C)C CNP0244315.0 [0,1,0,0,1,0|2,0,0]=4 505 B12R1.14 CC1=CC(=C(C(=C1C)C)C)C=O CNP0609155.0 [0,2,0,0,0,0|1,0,1]=4 506 B12R1.14 CC1=CC(=C(C(=C1C)C)C)CCl CNP0291313.0 [0,2,0,0,0,0|1,0,0]=3 507 B12R1.14 CC1=CC(=NO)C(=C(C1=O)C)C CNP0292044.0 [0,2,0,0,0,0|1,0,1]=4 508 B12R1.14 CNC1=CC(=O)C(=C(C1=O)C)O CNP0080303.0 [0,2,0,0,0,0|1,0,0]=3 509 B12R1.14 COC1=CC(=C(C(=C1C)C)O)C CNP0572680.0 [0,2,0,0,0,0|0,0,0]=2 510 B12R1.14 COC1=CC(=C(C(=C1Cl)C)Cl)O CNP0130539.0 [0,2,0,0,0,0|2,0,0]=4 511 B12R1.14 COC1=CC(=C(C(=C1Cl)O)Cl)C CNP0513062.0 [0,2,0,0,0,0|2,0,0]=4 512 B12R1.14 COC1=CC(=C(C(=C1O)Cl)Cl)Cl CNP0263801.0 [0,2,0,0,0,0|2,0,0]=4 513 B12R1.14 COC1=CC(=C(C(=C1O)O)C)O CNP0250808.0 [0,2,0,0,0,0|2,0,0]=4 514 B12R1.14 COC1=CC(=O)C(=C(C1=O)C)Cl CNP0348389.0 [0,2,0,0,0,0|1,0,1]=4 515 B12R1.14 COC1=CC(=O)C(=C(C1=O)C)O CNP0164479.0 [0,2,0,0,0,0|1,0,0]=3 516 B12R1.14 NCC1=CC(=C(C(=C1Br)Br)O)O CNP0247332.0 [0,2,0,0,0,0|2,0,0]=4 517 B12R1.14 O=C1C=C(C(=O)C(=C1O)Cl)CO CNP0537917.0 [0,2,0,0,0,0|2,0,0]=4 518 B12R1.14 OCC1=CC(=C(C(=C1Br)Br)O)Br CNP0264391.0 [0,2,0,0,0,0|2,0,0]=4 519 B12R1.14 OCC1=CC(=C(C(=C1Br)Br)O)O CNP0225292.0 [0,2,0,0,0,0|2,0,0]=4 520 B12R1.14 OCC1=CC(=C(C(=C1Br)O)O)Br CNP0078281.0 [0,2,0,0,0,0|2,0,0]=4 521 B12R1.40 CCOC1=CC(=O)C=C(C1=O)C CNP0216915.0 [0,2,0,0,0,0|1,0,1]=4 522 B12R1.40 COCC1=CC(=CC(=C1O)Cl)O CNP0216728.0 [0,2,0,0,0,0|2,0,0]=4 523 B12R1.234 COC1=CC(=CC(=C1C=O)C)O CNP0131937.0 [0,2,0,0,0,0|1,0,1]=4 524 B12R1.235 CC1=CC(=C(C(=C1)CCl)O)C=O CNP0066874.0 [0,2,0,0,0,0|0,0,1]=3 525 B12R1.235 CC1=CC(=C(C(=C1)CO)O)C=O CNP0030692.0 [0,2,0,0,0,0|0,0,1]=3 526 B12R1.235 CCC1=CC(=O)C=C(C1=O)OC CNP0105786.0 [0,2,0,0,0,0|1,0,1]=4 527 B12R1.235 CCC1=NC(=CC(=C1O)CBr)C CNP0116065.0 [0,2,0,0,0,0|1,0,0]=3 528 B12R1.235 COC1=CC(=CC(=C1C)OC)C CNP0424423.0 [0,2,0,0,0,0|1,0,0]=3 529 B12R1.235 COC1=CC(=CC(=C1Cl)OC)C CNP0310875.0 [0,2,0,0,0,0|1,0,0]=3 530 B12R1.235 COC1=CC(=CC(=C1O)C=O)Br CNP0519100.0 [0,2,0,0,0,0|1,0,1]=4 531 B12R1.235 COC1=CC(=CC(=C1O)OC)C CNP0111116.0 [0,2,0,0,0,0|0,0,0]=2 532 B12R1.235 COC1=CC(=CC(=C1O)OC)O CNP0396396.0 [0,2,0,0,0,0|1,0,0]=3 533 B12R1.235 COC1=CC(=O)C=C(C1=O)CO CNP0360843.0 [0,2,0,0,0,0|1,0,1]=4 534 B12R1.235 COC1=CC(=O)C=C(C1=O)OC CNP0209741.0 [0,2,0,0,0,0|1,0,1]=4 535 B12R1.300 CCC1=CC(=C(C(=C1)OC)O)C CNP0518382.0 [0,2,0,0,0,0|0,0,0]=2 536 B12R1.300 COC1=CC(=C(C(=C1)OC)C)O CNP0284366.0 [0,2,0,0,0,0|2,0,0]=4 537 B12R1.300 COC1=CC(=CC(=C1O)Br)C=O CNP0317155.0 [0,2,0,0,0,0|1,0,1]=4 538 B12R1.300 COC1=CC(=CC(=C1O)I)C=O CNP0268105.0 [0,2,0,0,0,0|1,0,1]=4 539 B12R1.300 COC1=CC(=CC(=C1O)O)C=O CNP0377931.0 [0,2,0,0,0,0|1,0,1]=4 540 B12R1.300 O=CC1=CC(=CC(=C1O)O)CO CNP0095333.0 [0,2,0,0,0,0|1,0,1]=4 541 B12R1.705 CC1=CC(=C(C(=C1C)CCl)C)C CNP0220314.0 [0,2,0,0,0,0|1,0,0]=3 542 B12R1.705 CC1=CC(=C(C(=C1C)N=O)C)C CNP0060003.0 [0,2,0,0,0,0|2,0,0]=4 543 B12R1.705 CCC1=C(C(=O)C=C(C1=O)O)O CNP0131476.0 [0,2,0,0,0,0|2,0,0]=4 544 B12R1.705 COC1=C(C(=CC(=C1Br)C)O)O CNP0356282.0 [0,2,0,0,0,0|1,0,0]=3 545 B12R1.705 COC1=C(C(=CC(=C1C)C)C)C CNP0611967.0 [0,2,0,0,0,0|1,0,0]=3 546 B12R1.705 COC1=C(C(=CC(=C1Cl)C)O)O CNP0368464.0 [0,2,0,0,0,0|1,0,0]=3 547 B12R1.705 COC1=C(C(=CC(=C1Cl)O)C)O CNP0113771.0 [0,2,0,0,0,0|1,0,0]=3 548 B12R1.705 COC1=C(C(=O)C=C(C1=O)C)C CNP0209703.0 [0,2,0,0,0,0|1,0,1]=4 549 B12R1.705 COC1=C(C(=O)C=C(C1=O)C)O CNP0171369.0 [0,2,0,0,0,0|1,0,0]=3 550 B12R1.44 C=CCC1=CC(=C(C(=C1)O)O)O CNP0018885.0 [0,2,0,0,0,0|2,0,0]=4 551 B12R1.44 COCC1=CC(=C(C(=C1)Br)O)Br CNP0124550.0 [0,2,0,0,0,0|2,0,0]=4 552 B12R1.44 COCC1=CC(=C(C(=C1)Br)O)O CNP0220987.0 [0,2,0,0,0,0|2,0,0]=4 553 B12R1.44 COCC1=CC(=C(C(=C1)O)O)O CNP0298714.0 [0,2,0,0,0,0|2,0,0]=4 554 B12R1.44 N#CCC1=CC(=C(C(=C1)Br)O)Br CNP0368424.0 [0,2,0,0,0,0|2,0,0]=4 555 B12R1.44 NCCC1=CC(=C(C(=C1)Br)O)Br CNP0207759.0 [0,2,0,0,0,0|2,0,0]=4 556 B12R1.44 NCCC1=CC(=C(C(=C1)O)O)O CNP0084304.0 [0,2,0,0,0,0|2,0,0]=4 557 B12R1.44 OCCC1=CC(=C(C(=C1)Cl)O)Cl CNP0109811.0 [0,2,0,0,0,0|2,0,0]=4 558 B12R1.44 [2H]C1=CC(=CC(=C1O)[2H])CCO CNP0589370.0 [0,2,0,0,0,0|2,0,0]=4 559 B12R1.301 CC1=C(C(=O)C=C(O1)CO)CO CNP0379470.0 [0,2,0,0,0,0|2,0,0]=4 560 B12R1.301 CC1=CC(=CC(=C1C=O)O)CO CNP0539021.0 [0,2,0,0,0,0|1,0,1]=4 561 B12R1.301 CCC1=C(C=C(N=C1C)OC)C CNP0611558.0 [0,2,0,0,0,0|2,0,0]=4 562 B12R1.301 COC1=C(C=C(C=C1Br)CO)O CNP0134246.0 [0,2,0,0,0,0|2,0,0]=4 563 B12R1.301 COC1=C(C=C(C=C1Cl)CO)Cl CNP0365104.0 [0,2,0,0,0,0|2,0,0]=4 564 B12R1.301 COC1=C(C=C(C=C1O)CO)O CNP0164196.0 [0,2,0,0,0,0|2,0,0]=4 565 B12R1.301 COC1=CC(=C(C(=C1)Br)OC)Br CNP0222506.0 [0,2,0,0,0,0|2,0,0]=4 566 B12R1.301 COC1=CC(=C(C(=C1)O)C=O)C CNP0205790.0 [0,2,0,0,0,0|1,0,1]=4 567 B12R1.301 COC1=CC(=C(C(=C1)O)OC)O CNP0238336.0 [0,2,0,0,0,0|2,0,0]=4 568 B12R1.1005 CC(=O)C1=CC(=C(C(=C1)C)O)C CNP0169307.0 [0,2,0,0,0,0|0,0,0]=2 569 B12R1.1005 CC(=O)C1=CC(=C(C(=C1)O)O)O CNP0139788.0 [0,2,0,0,0,0|2,0,0]=4 570 B12R1.1005 CC1=CC(=CC(=C1O)C)C(=O)O CNP0192461.0 [0,2,0,0,0,0|0,0,1]=3 571 B12R1.98 CC1=CC(=C(C(=C1C)C)CCl)C CNP0059344.0 [0,2,0,0,0,0|1,0,0]=3 572 B12R1.98 COC1=C(C(=O)C(=CC1=O)C)O CNP0304377.0 [0,2,0,0,0,0|2,0,0]=4 573 B12R1.98 COC1=C(C=C(C(=C1O)O)C)O CNP0170903.0 [0,2,0,0,0,0|2,0,0]=4 574 B12R1.3795 CC1=C(C(=C(C(=C1Br)Br)O)O)Br CNP0318789.0 [0,2,0,0,0,0|2,0,0]=4 575 B12R1.3795 CC1=C(C(=C(C(=C1C)Br)Br)C)C CNP0470698.0 [0,2,0,0,0,0|2,0,0]=4 576 B12R1.3795 CC1=C(C(=C(C(=C1C)Br)C)Br)C CNP0458090.0 [0,2,0,0,0,0|1,0,0]=3 577 B12R1.3795 CC1=C(C(=C(C(=C1C)C)Br)C)C CNP0474642.0 [0,2,0,0,0,0|1,0,0]=3 578 B12R1.3795 CC1=C(C(=C(C(=C1C)C)C)C)C CNP0334926.0 [0,2,0,0,0,0|1,0,0]=3 579 B12R1.3795 CC1=C(C(=C(C(=C1I)C)C)I)C CNP0476567.0 [0,2,0,0,0,0|2,0,0]=4 580 B12R1.3795 CC1=C(C(=C(C(=C1I)C)I)C)I CNP0470016.0 [0,2,0,0,0,0|1,0,0]=3 581 B12R1.3795 CC1=C(C(=C(C(=O)C1=O)C)O)C CNP0551267.0 [0,2,0,0,0,0|1,0,0]=3 582 B12R1.3795 CC1=C(C(=O)C(=C(C1=O)C)C)C CNP0472017.0 [0,2,0,0,0,0|1,0,1]=4 583 B12R1.3795 CC1=C(C(=O)C(=C(C1=O)O)Cl)O CNP0269421.0 [0,2,0,0,0,0|2,0,0]=4 584 B12R1.3795 CC1=C(C(=O)C(=C(C1=O)O)O)C CNP0318306.0 [0,2,0,0,0,0|2,0,0]=4 585 B12R1.1000 CC1=CC(=C(C(=C1)C)C(=O)Cl)C CNP0037744.0 [0,2,0,0,0,0|0,0,1]=3 586 B12R1.1000 CC1=CC(=C(C(=C1)C)C(=O)O)C CNP0444261.0 [0,2,0,0,0,0|0,0,0]=2 587 B12R1.1000 CC1=CC(=C(C(=C1)C)C(C)O)C CNP0230604.0 [0,2,0,0,0,0|0,0,0]=2 588 B12R1.1000 CC1=CC(=C(C(=C1)O)C(=O)O)O CNP0244321.0 [0,2,0,0,0,0|2,0,0]=4 589 B12R1.1000 CC1=CC(=C(C(=N1)C)C(=O)O)C CNP0551550.0 [0,2,0,0,0,0|1,0,0]=3 590 B12R1.1000 CC1=CC(=C(C(=N1)N)C(=O)O)C CNP0236536.0 [0,2,0,0,0,0|2,0,0]=4 591 B12R1.1000 CC1=CC(=CC(=C1C(=O)O)O)O CNP0194999.0 [0,2,0,0,0,0|2,0,0]=4 592 B12R1.1000 CC1=CC(=O)OC(=C1C(=O)O)C CNP0133346.0 [0,2,0,0,0,0|2,0,0]=4 593 B10R1.59 CC(=O)C1=C(N=C(O1)C)C CNP0224102.0 [0,0,1,1,0,0|2,0,0]=4 594 B10R1.61 C=C(C)C1=CC=CC=C1C CNP0192226.0 [0,0,1,1,0,0|1,0,1]=4 595 B10R1.61 CC1=C(OCC=C1)C(C)C CNP0344214.0 [0,0,1,1,0,0|0,0,2]=4 596 B12R2.246 CC1=CC(=C2CCCC2=C1)C CNP0332105.0 [0,1,0,1,0,0|1,0,0]=3 597 B12R2.246 CC1=CC(=C2CCCC2=C1)O CNP0201391.0 [0,1,0,1,0,0|2,0,0]=4 598 B12R2.246 CC1=CC(=C2NN=CC2=C1)C CNP0176125.0 [0,1,0,1,0,0|1,0,1]=4 599 B12R2.246 CC1=CC(=C2OC=CC2=C1)C CNP0283975.0 [0,1,0,1,0,0|0,0,1]=3 600 B12R2.782 CC1=CC(=C2CCC2=C1C)C CNP0055253.0 [0,1,0,1,0,0|1,0,0]=3 601 B12R2.1134 CC1=CC2=C(CC2)C(=C1C)C CNP0057619.0 [0,1,0,1,0,0|1,0,0]=3 602 B12R2.3028 CC1=CC(=C2C(=C1)C[C@@H]2Cl)C CNP0059933.2 [0,1,0,1,0,0|1,0,0]=3 603 B12R2.3028 CC1=CC(=C2C(=C1)C[C@H]2Cl)C CNP0059933.1 [0,1,0,1,0,0|1,0,0]=3 604 B12R2.3028 CC1=CC(=C2C(=O)CC2=C1)C CNP0342183.0 [0,1,0,1,0,0|0,0,1]=3 605 B8R1.50 CC1=CCC(=C1C)C CNP0578082.0 [1,0,0,0,1,0|1,0,1]=4 606 B8R1.50 O=C1C=CC(=C1O)O CNP0105932.0 [1,0,0,0,1,0|2,0,0]=4 607 B8R1.18 CC1=CC(=C(N1)C)C CNP0194129.0 [1,0,0,0,1,0|1,0,0]=3 608 B8R1.18 CC1=CC(=C(O1)C)C CNP0302629.0 [1,0,0,0,1,0|1,0,0]=3 609 B8R1.18 CC1=CC(=C(O1)C)S CNP0277106.0 [1,0,0,0,1,0|2,0,0]=4 610 B8R1.18 CC1=NC(=C(O1)C)C CNP0297316.0 [1,0,0,0,1,0|2,0,0]=4 611 B8R1.18 CC1=NC(=C(S1)C)C CNP0077136.0 [1,0,0,0,1,0|2,0,0]=4 612 B10R1.332 CC1=C(C=CC(=O)C=C1)Cl CNP0070609.0 [1,0,0,0,0,1|2,0,0]=4