0 B11R1.21 C=C(C)C1=CC=C(C(=C1)O)C CNP0410462.0 [0,0,0,0,0,0|0,0,2]=2 1 B11R1.21 C=C(C)C1=CC=C(C(=O)C1)C CNP0377811.0 [0,0,0,0,0,0|0,0,4]=4 2 B11R1.21 C=C(C)C1=CC=C(C(C1)O)C CNP0162450.0 [0,0,0,0,0,0|0,0,4]=4 3 B11R1.21 C=C1C=C[C@@H](C[C@@H]1O)C(C)C CNP0159669.4 [0,0,0,0,0,0|0,0,4]=4 4 B11R1.21 C=C1C=C[C@@H](C[C@H]1O)C(C)C CNP0159669.2 [0,0,0,0,0,0|0,0,4]=4 5 B11R1.21 C=C1C=C[C@H](C[C@@H]1O)C(C)C CNP0159669.1 [0,0,0,0,0,0|0,0,4]=4 6 B11R1.21 C=C1C=C[C@H](C[C@H]1O)C(C)C CNP0159669.3 [0,0,0,0,0,0|0,0,4]=4 7 B11R1.21 CC(=O)C1=CC=C(C(=C1)C)C CNP0091143.0 [0,0,0,0,0,0|2,0,1]=3 8 B11R1.21 CC(=O)C1=CC=C(C(=C1)C)O CNP0484144.0 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.21 CC(=O)C1=CC=C(C(=C1)O)C CNP0155281.0 [0,0,0,0,0,0|1,0,1]=2 10 B11R1.21 CC(=O)C1=CC=C(C(=C1)O)O CNP0310121.0 [0,0,0,0,0,0|2,0,1]=3 11 B11R1.21 CC(=O)C1=CC=C(C(=O)O1)C CNP0144436.0 [0,0,0,0,0,0|2,0,2]=4 12 B11R1.21 CC(C)C1=CC(=O)[C@H](CC1)C CNP0214671.1 [0,0,0,0,0,0|0,0,4]=4 13 B11R1.21 CC(C)[C@@H]1C=C([C@@H](CC1)C)O CNP0560097.1 [0,0,0,0,0,0|0,0,4]=4 14 B11R1.21 CC(C)[C@H]1C=C[C@@H]([C@H](C1)O)C CNP0304405.1 [0,0,0,0,0,0|0,0,4]=4 15 B11R1.21 CC1=C(C=C(CC1)C(C)C)O CNP0605783.0 [0,0,0,0,0,0|0,0,2]=2 16 B11R1.21 CC1=C(OC(=CC1)C(C)C)C CNP0229126.0 [0,0,0,0,0,0|2,0,1]=3 17 B11R1.21 CC1=CC(=CC=C1O)C(C)C CNP0364356.0 [0,0,0,0,0,0|2,0,0]=2 18 B11R1.21 CC1=CC=C(C=C1C)C(=O)N CNP0387935.0 [0,0,0,0,0,0|3,0,1]=4 19 B11R1.21 CC1=CC=C(C=C1C)C(=O)O CNP0109169.0 [0,0,0,0,0,0|3,0,1]=4 20 B11R1.21 CC1=CC=C(C=C1C)C(C)C CNP0226831.0 [0,0,0,0,0,0|1,0,0]=1 21 B11R1.21 CC1=CC=C(C=C1C)C(C)O CNP0612219.0 [0,0,0,0,0,0|2,0,0]=2 22 B11R1.21 CC1=CC=C(C=C1O)C(=O)O CNP0262674.0 [0,0,0,0,0,0|2,0,1]=3 23 B11R1.21 CC1=CC=C(C=C1O)C(C)C CNP0210919.0 [0,0,0,0,0,0|0,0,0]=0 24 B11R1.21 CC1=CC=C(CC1O)C(C)C CNP0592854.0 [0,0,0,0,0,0|0,0,2]=2 25 B11R1.21 CC1=CC=C(N=C1C)C(C)C CNP0304301.0 [0,0,0,0,0,0|2,0,0]=2 26 B11R1.21 CC1=CCC(CC1O)C(C)C CNP0150657.0 [0,0,0,0,0,0|0,0,4]=4 27 B11R1.21 CC1=CC[C@@H](CC1=O)C(C)C CNP0402519.1 [0,0,0,0,0,0|0,0,4]=4 28 B11R1.21 CC1=CC[C@H](CC1=O)C(C)C CNP0402519.2 [0,0,0,0,0,0|0,0,4]=4 29 B11R1.21 NC(=O)C1=CC=C(C(=C1)O)O CNP0582162.0 [0,0,0,0,0,0|3,0,1]=4 30 B11R1.21 NC1=CC=C(C=C1O)C(=O)O CNP0018090.0 [0,0,0,0,0,0|3,0,1]=4 31 B11R1.21 O=C(O)C1=CC=C(C(=C1)O)O CNP0348948.0 [0,0,0,0,0,0|3,0,1]=4 32 B11R1.21 O=[N+]([O-])C1=CC=C(C(=C1)O)O CNP0593657.0 [0,0,0,0,0,0|4,0,0]=4 33 B10R1.13 C=C(C)C1=CC=C(C=C1)C CNP0302429.0 [1,0,0,0,0,0|0,0,2]=3 34 B10R1.13 C=C(C)C1=CC=C(N=C1)C CNP0550241.0 [1,0,0,0,0,0|1,0,2]=4 35 B10R1.13 CC(=O)C1=CC=C(C=C1)Br CNP0078494.0 [1,0,0,0,0,0|2,0,1]=4 36 B10R1.13 CC(=O)C1=CC=C(C=C1)C CNP0415909.0 [1,0,0,0,0,0|1,0,1]=3 37 B10R1.13 CC(=O)C1=CC=C(C=C1)I CNP0361256.0 [1,0,0,0,0,0|2,0,1]=4 38 B10R1.13 CC(=O)C1=CC=C(C=C1)N CNP0127987.0 [1,0,0,0,0,0|2,0,1]=4 39 B10R1.13 CC(=O)C1=CC=C(C=C1)O CNP0327993.0 [1,0,0,0,0,0|2,0,1]=4 40 B10R1.13 CC(=O)C1=CC=C(C=N1)C CNP0046782.0 [1,0,0,0,0,0|2,0,1]=4 41 B10R1.13 CC(=O)C1=CC=C(N=C1)C CNP0135801.0 [1,0,0,0,0,0|2,0,1]=4 42 B10R1.13 CC(C)C1=CC=C(C=C1)N CNP0455541.0 [1,0,0,0,0,0|1,0,0]=2 43 B10R1.13 CC(C)C1=CC=C(C=C1)O CNP0127505.0 [1,0,0,0,0,0|1,0,0]=2 44 B10R1.13 CC(C)C1=CC[C@@H](C=C1)C CNP0316117.2 [1,0,0,0,0,0|0,0,2]=3 45 B10R1.13 CC(C)C1=CC[C@H](C=C1)C CNP0316117.1 [1,0,0,0,0,0|0,0,2]=3 46 B10R1.13 CC(N)C1=CC=C(C=C1)O CNP0292009.0 [1,0,0,0,0,0|2,0,0]=3 47 B10R1.13 CC1=CC=C(C=C1)C(=O)Br CNP0248072.0 [1,0,0,0,0,0|2,0,1]=4 48 B10R1.13 CC1=CC=C(C=C1)C(=O)Cl CNP0150539.0 [1,0,0,0,0,0|2,0,1]=4 49 B10R1.13 CC1=CC=C(C=C1)C(=O)N CNP0158656.0 [1,0,0,0,0,0|2,0,1]=4 50 B10R1.13 CC1=CC=C(C=C1)C(=O)O CNP0232170.0 [1,0,0,0,0,0|2,0,1]=4 51 B10R1.13 CC1=CC=C(C=C1)C(C)C CNP0145577.0 [1,0,0,0,0,0|0,0,0]=1 52 B10R1.13 CC1=CC=C(C=C1)[C@@H](C)O CNP0154242.1 [1,0,0,0,0,0|1,0,0]=2 53 B10R1.13 CC1=CC=C(C=C1)[C@H](C)O CNP0154242.2 [1,0,0,0,0,0|1,0,0]=2 54 B10R1.13 CC1=CC=C(C=N1)[C@H](C)N CNP0243226.1 [1,0,0,0,0,0|2,0,0]=3 55 B10R1.13 CC1=CC=C(CC1)C(C)C CNP0178656.0 [1,0,0,0,0,0|0,0,2]=3 56 B10R1.13 CC1=CCC(=CC1)C(C)C CNP0255720.0 [1,0,0,0,0,0|0,0,2]=3 57 B10R1.13 CC1=CC[C@@H](C=C1)C(C)C CNP0162506.2 [1,0,0,0,0,0|0,0,2]=3 58 B10R1.13 CC1=CC[C@H](C=C1)C(C)C CNP0162506.1 [1,0,0,0,0,0|0,0,2]=3 59 B10R1.13 CC1=CN=C(C=N1)C(C)C CNP0266332.0 [1,0,0,0,0,0|2,0,0]=3 60 B10R1.13 CN(C)C1=CC=C(C=C1)N CNP0581368.0 [1,0,0,0,0,0|2,0,0]=3 61 B10R1.13 C[C@@H](O)C1=CC=C(C=C1)O CNP0112149.2 [1,0,0,0,0,0|2,0,0]=3 62 B10R1.13 C[C@H](O)C1=CC=C(C=C1)O CNP0112149.1 [1,0,0,0,0,0|2,0,0]=3 63 B10R1.113 C=C(C)C1=CC=CC(=C1)C CNP0131383.0 [1,0,0,0,0,0|1,0,2]=4 64 B10R1.113 CC(=O)C1=CC=CC(=C1)C CNP0320614.0 [1,0,0,0,0,0|2,0,1]=4 65 B10R1.113 CC(=O)C1=CC=CC(=C1)O CNP0108325.0 [1,0,0,0,0,0|1,0,1]=3 66 B10R1.113 CC(C)C1=CC(=O)OC=C1 CNP0193118.0 [1,0,0,0,0,0|1,0,1]=3 67 B10R1.113 CC(C)C1=CC=CC(=C1)O CNP0246144.0 [1,0,0,0,0,0|0,0,0]=1 68 B10R1.113 CC(O)C1=CC=CC(=C1)O CNP0171685.0 [1,0,0,0,0,0|1,0,0]=2 69 B10R1.113 CC1=CC(=CC=N1)C(C)C CNP0586055.0 [1,0,0,0,0,0|2,0,0]=3 70 B10R1.113 CC1=CC(=CC=N1)N(C)C CNP0436330.0 [1,0,0,0,0,0|3,0,0]=4 71 B10R1.113 CC1=CC=CC(=C1)C(C)C CNP0151774.0 [1,0,0,0,0,0|1,0,0]=2 72 B10R1.113 CC1=CC=CC(=C1)N(C)C CNP0030877.0 [1,0,0,0,0,0|2,0,0]=3 73 B10R1.113 CC1=CC=NC(=C1)C(C)C CNP0555146.0 [1,0,0,0,0,0|2,0,0]=3 74 B10R1.113 CC1=CN=CC(=N1)C(C)C CNP0492233.0 [1,0,0,0,0,0|3,0,0]=4 75 B10R1.113 CN(C)C1=CC=CC(=C1)Cl CNP0339431.0 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.113 C[C@H](O)C1=CC=CC(=C1)O CNP0171685.1 [1,0,0,0,0,0|1,0,0]=2 77 B10R1.113 NC(=O)C1=CC=CC(=C1)O CNP0113657.0 [1,0,0,0,0,0|2,0,1]=4 78 B10R1.113 O=C(O)C1=CC=CC(=C1)O CNP0217243.0 [1,0,0,0,0,0|2,0,1]=4 79 B10R1.176 C=CC1=CC=C(C(=C1)C)C CNP0083008.0 [1,0,0,0,0,0|1,0,2]=4 80 B10R1.176 C=CC1=CC=C(C(=C1)O)O CNP0218096.0 [1,0,0,0,0,0|1,0,2]=4 81 B10R1.176 CC1=CC=C(C=C1C)C#N CNP0181583.0 [1,0,0,0,0,0|2,0,1]=4 82 B10R1.176 CC1=CC=C(C=C1C)CO CNP0515257.0 [1,0,0,0,0,0|2,0,0]=3 83 B10R1.176 CCC1=CC=C(C(=C1)C)C CNP0111798.0 [1,0,0,0,0,0|1,0,0]=2 84 B10R1.176 CCC1=CC=C(C(=C1)C)O CNP0271974.0 [1,0,0,0,0,0|2,0,0]=3 85 B10R1.176 CCC1=CC=C(C(=C1)O)C CNP0152157.0 [1,0,0,0,0,0|0,0,0]=1 86 B10R1.176 CCC1=CC=C(C(=C1)O)O CNP0344368.0 [1,0,0,0,0,0|1,0,0]=2 87 B10R1.176 CCC1=CC=C(C(=N1)C)C CNP0105764.0 [1,0,0,0,0,0|2,0,0]=3 88 B10R1.176 CCC1=CN=C(C(=N1)C)C CNP0231860.0 [1,0,0,0,0,0|3,0,0]=4 89 B10R1.176 COC1=CC=C(C(=C1)C)Br CNP0334567.0 [1,0,0,0,0,0|3,0,0]=4 90 B10R1.176 COC1=CC=C(C(=C1)C)Cl CNP0187648.0 [1,0,0,0,0,0|3,0,0]=4 91 B10R1.176 COC1=CC=C(C(=C1)C)O CNP0175131.0 [1,0,0,0,0,0|3,0,0]=4 92 B10R1.176 COC1=CC=C(C(=C1)Cl)Cl CNP0369428.0 [1,0,0,0,0,0|3,0,0]=4 93 B10R1.176 COC1=CC=C(C(=C1)N)O CNP0323578.0 [1,0,0,0,0,0|3,0,0]=4 94 B10R1.176 COC1=CC=C(C(=C1)O)O CNP0241033.0 [1,0,0,0,0,0|2,0,0]=3 95 B10R1.176 N#CC1=CC=C(C(=C1)O)O CNP0155663.0 [1,0,0,0,0,0|2,0,1]=4 96 B10R1.176 NCC1=CC=C(C(=C1)O)O CNP0353669.0 [1,0,0,0,0,0|2,0,0]=3 97 B10R1.176 O=CC1=CC=C(C(=C1)O)O CNP0203672.0 [1,0,0,0,0,0|2,0,1]=4 98 B10R1.176 OCC1=CC=C(C(=C1)Br)O CNP0161139.0 [1,0,0,0,0,0|3,0,0]=4 99 B10R1.176 OCC1=CC=C(C(=C1)O)O CNP0262481.0 [1,0,0,0,0,0|2,0,0]=3 100 B12R1.23 CC(C)(C)C1=CC=C(C(=C1)O)O CNP0201724.0 [0,1,0,0,0,0|1,0,0]=2 101 B12R1.23 CC1=CC(=CC=C1O)C(C)(C)C CNP0379795.0 [0,1,0,0,0,0|2,0,0]=3 102 B12R1.23 CC1=CC(=CC=C1S)C(C)(C)C CNP0480587.0 [0,1,0,0,0,0|2,0,0]=3 103 B12R1.23 CC1=CC=C(C=C1O)C(C)(C)O CNP0181250.0 [0,1,0,0,0,0|0,0,0]=1 104 B12R1.48 CC(C)C1=CC=C(C(=C1)O)C=O CNP0136074.0 [0,1,0,0,0,0|0,0,1]=2 105 B12R1.48 COC1=CC=C(C=C1O)C(=O)C CNP0215048.0 [0,1,0,0,0,0|1,0,1]=3 106 B12R1.48 COC1=CC=C(C=C1O)C(=O)N CNP0428552.0 [0,1,0,0,0,0|2,0,1]=4 107 B12R1.48 COC1=CC=C(C=C1O)C(=O)O CNP0220341.0 [0,1,0,0,0,0|2,0,1]=4 108 B12R1.48 COC1=CC=C(C=C1O)[N+](=O)[O-] CNP0599616.0 [0,1,0,0,0,0|3,0,0]=4 109 B12R1.48 O=C(O)C1=CC=C(C(=C1)O)CO CNP0123838.0 [0,1,0,0,0,0|2,0,1]=4 110 B12R1.56 C=C(C)C1=CC=C(C(=C1)OC)C CNP0254908.0 [0,1,0,0,0,0|0,0,2]=3 111 B12R1.56 C=C(C)C1=CC=C(C(=C1)OC)O CNP0208361.0 [0,1,0,0,0,0|1,0,2]=4 112 B12R1.56 CC1=CC=C(C=C1CO)C(C)C CNP0524285.0 [0,1,0,0,0,0|0,0,0]=1 113 B12R1.56 CC1=CC=C(C=C1CO)[N+](=O)[O-] CNP0531354.0 [0,1,0,0,0,0|3,0,0]=4 114 B12R1.56 COC1=CC(=CC=C1C)C(=O)C CNP0017950.0 [0,1,0,0,0,0|1,0,1]=3 115 B12R1.56 COC1=CC(=CC=C1C)C(=O)O CNP0497367.0 [0,1,0,0,0,0|2,0,1]=4 116 B12R1.56 COC1=CC(=CC=C1C)C(C)C CNP0163527.0 [0,1,0,0,0,0|0,0,0]=1 117 B12R1.56 COC1=CC(=CC=C1O)C(=O)C CNP0219031.0 [0,1,0,0,0,0|2,0,1]=4 118 B12R1.56 COC1=CC(=CC=C1O)C(C)O CNP0582143.0 [0,1,0,0,0,0|2,0,0]=3 119 B12R1.232 CC(=O)C1=CC(=C(C=C1O)C)C CNP0579678.0 [0,1,0,0,0,0|2,0,1]=4 120 B12R1.232 CC(=O)C1=CC(=C(C=C1O)C)O CNP0136455.0 [0,1,0,0,0,0|1,0,1]=3 121 B12R1.232 CC(=O)C1=CC(=C(C=C1O)O)O CNP0243066.0 [0,1,0,0,0,0|2,0,1]=4 122 B12R1.232 CC1=CC(=C(C=C1C)C(C)C)C CNP0164128.0 [0,1,0,0,0,0|1,0,0]=2 123 B12R1.232 CC1=CC(=C(C=C1O)C(C)C)O CNP0224526.0 [0,1,0,0,0,0|0,0,0]=1 124 B12R1.232 CC1=CC(=O)C(=CC1=O)C(C)C CNP0158912.0 [0,1,0,0,0,0|0,0,1]=2 125 B12R1.232 CC1=CC(=O)[C@@H](C[C@@H]1O)C(C)C CNP0295182.4 [0,1,0,0,0,0|0,0,3]=4 126 B12R1.232 CC1=CC(=O)[C@@H](C[C@H]1O)C(C)C CNP0295182.3 [0,1,0,0,0,0|0,0,3]=4 127 B12R1.232 CC1=CC(=O)[C@H](C[C@@H]1O)C(C)C CNP0295182.1 [0,1,0,0,0,0|0,0,3]=4 128 B12R1.232 CC1=CC(=O)[C@H](C[C@H]1O)C(C)C CNP0295182.2 [0,1,0,0,0,0|0,0,3]=4 129 B12R1.367 CC1=CC=C(C=C1O)[C@@H](C)CO CNP0591150.1 [0,1,0,0,0,0|0,0,0]=1 130 B12R1.367 CC=C(C)C1=CC=C(C(=O)O1)C CNP0209736.0 [0,1,0,0,0,0|1,0,2]=4 131 B12R1.367 CCC(=O)C1=CC=C(C(=C1)O)O CNP0313770.0 [0,1,0,0,0,0|2,0,1]=4 132 B12R1.367 CC[C@@H](C)C1=CC=C(C(=O)O1)C CNP0431455.1 [0,1,0,0,0,0|1,0,1]=3 133 B12R1.367 CC[C@H](C)C1=CC(=C(C=N1)C)C CNP0297045.1 [0,1,0,0,0,0|2,0,0]=3 134 B12R1.367 COC(=O)C1=CC=C(C(=C1)O)N CNP0083419.0 [0,1,0,0,0,0|2,0,1]=4 135 B12R1.367 COC(=O)C1=CC=C(C(=C1)O)O CNP0279680.0 [0,1,0,0,0,0|2,0,1]=4 136 B12R1.367 N#CC(O)C1=CC=C(C(=C1)O)O CNP0085424.0 [0,1,0,0,0,0|2,0,1]=4 137 B12R1.367 NCC(=O)C1=CC=C(C(=C1)O)O CNP0133774.0 [0,1,0,0,0,0|2,0,1]=4 138 B12R1.367 NC[C@@H](O)C1=CC=C(C(=C1)O)O CNP0214798.3 [0,1,0,0,0,0|2,0,0]=3 139 B12R1.367 NC[C@H](O)C1=CC=C(C(=C1)O)O CNP0214798.2 [0,1,0,0,0,0|2,0,0]=3 140 B12R1.367 O=C(CO)C1=CC=C(C(=C1)O)O CNP0281749.0 [0,1,0,0,0,0|2,0,1]=4 141 B12R1.367 O=CC(O)C1=CC=C(C(=C1)O)O CNP0280132.0 [0,1,0,0,0,0|2,0,1]=4 142 B12R1.367 OC[C@H](O)C1=CC=C(C(=C1)O)O CNP0188951.1 [0,1,0,0,0,0|2,0,0]=3 143 B12R1.893 CC(=C1CCC(=C(C1=O)O)C)C CNP0304604.0 [0,1,0,0,0,0|0,0,3]=4 144 B12R1.893 CC(=O)C1=CC=C(C(=C1C)C)C CNP0584174.0 [0,1,0,0,0,0|2,0,1]=4 145 B12R1.893 CC(=O)C1=CC=C(C(=C1O)O)O CNP0213966.0 [0,1,0,0,0,0|2,0,1]=4 146 B12R1.893 CC1=C(C(=O)[C@@H](CC1)C(C)C)O CNP0204545.1 [0,1,0,0,0,0|0,0,3]=4 147 B12R1.893 CC1=C(C(=O)[C@H](CC1)C(C)C)O CNP0204545.2 [0,1,0,0,0,0|0,0,3]=4 148 B12R1.893 CC1=CC=C(C(=C1O)C)C(C)C CNP0526701.0 [0,1,0,0,0,0|0,0,0]=1 149 B12R1.893 CC1=CC=C(C(=C1O)N)C(=O)O CNP0239974.0 [0,1,0,0,0,0|2,0,1]=4 150 B12R1.893 CC1=CC=C(C(=C1O)O)C(C)C CNP0298407.0 [0,1,0,0,0,0|0,0,0]=1 151 B12R1.1005 CC(=O)C1=CC(=C(C(=C1)O)O)O CNP0139788.0 [0,1,0,0,0,0|2,0,1]=4 152 B12R1.1005 CC1=C(C=C(C=C1O)C(=O)O)O CNP0453501.0 [0,1,0,0,0,0|2,0,1]=4 153 B12R1.1005 CC1=C(C=C(C=C1O)C(C)C)O CNP0424233.0 [0,1,0,0,0,0|0,0,0]=1 154 B12R1.1005 CC1=C(C=C(OC1=O)C(C)C)O CNP0131967.0 [0,1,0,0,0,0|1,0,0]=2 155 B12R1.1005 CC1=NC(=NC(=C1C)O)N(C)C CNP0040114.0 [0,1,0,0,0,0|3,0,0]=4 156 B10R0.98 CC(=CCC=C(C)C(=O)O)C CNP0318467.0 [0,0,1,0,0,0|1,0,2]=4 157 B10R0.98 CC(=O)C=CC=C(C)C(=O)O CNP0156753.0 [0,0,1,0,0,0|2,0,1]=4 158 B10R1.58 CC1=C(OC(=N1)C(C)C)C CNP0140800.0 [0,0,0,0,1,0|3,0,0]=4 159 B10R1.58 CC1=C(SC(=N1)C(C)C)C CNP0271534.0 [0,0,0,0,1,0|3,0,0]=4 160 B10R1.194 CC(C)C1=C(C(=O)CC1)O CNP0240398.0 [0,0,0,0,1,0|1,0,2]=4 161 B10R1.194 CC(C)C1=CCC(C1=O)C CNP0116593.0 [0,0,0,0,1,0|0,0,3]=4 162 B12R1.19 CC(=O)CC1=CC=C(C(=C1)O)O CNP0097636.0 [0,0,0,0,0,1|2,0,1]=4 163 B12R1.19 CC(=O)NC1=CC=C(C(=C1)Cl)C CNP0024410.0 [0,0,0,0,0,1|2,0,1]=4 164 B12R1.19 CC(=O)OC1=CC=C(C(=C1)O)O CNP0238472.0 [0,0,0,0,0,1|2,0,1]=4 165 B12R1.19 C[C@H](N)CC1=CC=C(C(=C1)O)O CNP0397624.1 [0,0,0,0,0,1|2,0,0]=3 166 B12R1.892 CC(C)C1=CC=C(C(=O)C=C1)O CNP0218976.0 [0,0,0,0,0,1|1,0,0]=2 167 B12R1.1021 C=C(C)C1=CC=CC(=O)C(=C1)O CNP0310811.0 [0,0,0,0,0,1|1,0,2]=4 168 B12R1.1021 CC(=O)C1=CC=CC(=O)C(=C1)O CNP0339263.0 [0,0,0,0,0,1|2,0,1]=4 169 B12R1.1021 CC(C)C1=CC(=O)C(=CC=C1)O CNP0146660.0 [0,0,0,0,0,1|1,0,1]=3 170 B12R1.1021 CC(C)C1=CC=CC(=O)C(=C1)O CNP0584336.0 [0,0,0,0,0,1|1,0,0]=2 171 B9R0.1 C=CC(=CC=CC(=C)C)C CNP0243185.0 [1,0,1,0,0,0|0,0,2]=4 172 B9R0.1 C=CC(=CC=CC(C)C)C CNP0086413.0 [1,0,1,0,0,0|0,0,0]=2 173 B9R0.1 C=CC(=CCC=C(C)C)C CNP0295010.0 [1,0,1,0,0,0|0,0,2]=4 174 B9R0.1 C=CC(=CCCC(C)C)C CNP0227262.0 [1,0,1,0,0,0|0,0,2]=4 175 B9R0.1 C=C[C@@H](C)/C=C\C=C(C)C CNP0312376.1 [1,0,1,0,0,0|0,0,2]=4 176 B9R0.1 CC=C(C)C=CC=C(C)C CNP0248120.0 [1,0,1,0,0,0|0,0,2]=4 177 B9R0.1 CC=C(C)C=CCC(C)C CNP0113285.0 [1,0,1,0,0,0|0,0,2]=4 178 B9R1.1 C=CC1=CC=C(C=C1)C CNP0003402.0 [2,0,0,0,0,0|0,0,2]=4 179 B9R1.1 CC1=CC=C(C=C1)C#N CNP0319761.0 [2,0,0,0,0,0|1,0,1]=4 180 B9R1.1 CC1=CC=C(C=C1)C=O CNP0234694.0 [2,0,0,0,0,0|1,0,1]=4 181 B9R1.1 CC1=CC=C(C=C1)CO CNP0002396.0 [2,0,0,0,0,0|1,0,0]=3 182 B9R1.1 CC1=CC=C(C=C1)I=O CNP0508059.0 [2,0,0,0,0,0|2,0,0]=4 183 B9R1.1 CC1=CC=C(C=C1)N=O CNP0522636.0 [2,0,0,0,0,0|2,0,0]=4 184 B9R1.1 CCC1=CC=C(C=C1)Br CNP0211844.0 [2,0,0,0,0,0|1,0,0]=3 185 B9R1.1 CCC1=CC=C(C=C1)C CNP0119285.0 [2,0,0,0,0,0|0,0,0]=2 186 B9R1.1 CCC1=CC=C(C=C1)N CNP0166611.0 [2,0,0,0,0,0|1,0,0]=3 187 B9R1.1 CCC1=CC=C(C=C1)O CNP0299375.0 [2,0,0,0,0,0|1,0,0]=3 188 B9R1.1 CCC1=CC=C(C=N1)C CNP0185750.0 [2,0,0,0,0,0|1,0,0]=3 189 B9R1.1 CCC1=CC=C(N=C1)C CNP0341471.0 [2,0,0,0,0,0|1,0,0]=3 190 B9R1.1 CCC1=CN=C(C=N1)C CNP0183380.0 [2,0,0,0,0,0|2,0,0]=4 191 B9R1.1 CCN1C=CC(=N)C=C1 CNP0467750.0 [2,0,0,0,0,0|2,0,0]=4 192 B9R1.1 CCN1C=CC(=[N])C=C1 CNP0554973.0 [2,0,0,0,0,0|2,0,0]=4 193 B9R1.1 CNC1=CC=C(C=C1)O CNP0036253.0 [2,0,0,0,0,0|2,0,0]=4 194 B9R1.1 COC1=CC=C(C=C1)C CNP0160002.0 [2,0,0,0,0,0|1,0,0]=3 195 B9R1.1 COC1=CC=C(C=C1)N CNP0027059.0 [2,0,0,0,0,0|2,0,0]=4 196 B9R1.1 COC1=CC=C(C=C1)O CNP0236213.0 [2,0,0,0,0,0|2,0,0]=4 197 B9R1.1 NCC1=CC=C(C=C1)O CNP0106686.0 [2,0,0,0,0,0|2,0,0]=4 198 B9R1.1 OCC1=CC=C(C=C1)Br CNP0519580.0 [2,0,0,0,0,0|2,0,0]=4 199 B9R1.1 OCC1=CC=C(C=C1)O CNP0103281.0 [2,0,0,0,0,0|2,0,0]=4 200 B9R1.6 C=C(C)C1=CC=CC=C1 CNP0080169.0 [2,0,0,0,0,0|0,0,2]=4 201 B9R1.6 CC(=O)C1=CC=CC=C1 CNP0296349.0 [2,0,0,0,0,0|1,0,1]=4 202 B9R1.6 CC(C)C1=CC=CC=C1 CNP0123409.0 [2,0,0,0,0,0|0,0,0]=2 203 B9R1.6 CC(C)C1=CC=CN=C1 CNP0157310.0 [2,0,0,0,0,0|1,0,0]=3 204 B9R1.6 CC(C)C1=CCC=CC1 CNP0531274.0 [2,0,0,0,0,0|0,0,2]=4 205 B9R1.6 CC(C)C1=CN=CC=N1 CNP0293152.0 [2,0,0,0,0,0|2,0,0]=4 206 B9R1.6 CN(C)C1=CC=CC=C1 CNP0137867.0 [2,0,0,0,0,0|1,0,0]=3 207 B9R1.6 CN(C)C1=CC=NC=C1 CNP0362397.0 [2,0,0,0,0,0|2,0,0]=4 208 B9R1.6 C[C@@H](N)C1=CC=CC=C1 CNP0079805.1 [2,0,0,0,0,0|1,0,0]=3 209 B9R1.6 C[C@@H](O)C1=CC=CC=C1 CNP0207239.2 [2,0,0,0,0,0|1,0,0]=3 210 B9R1.6 C[C@H](N)C1=CC=CC=C1 CNP0079805.2 [2,0,0,0,0,0|1,0,0]=3 211 B9R1.6 C[C@H](O)C1=CC=CC=C1 CNP0207239.1 [2,0,0,0,0,0|1,0,0]=3 212 B9R1.6 C[S@@+]([O-])C1=CC=CC=C1 CNP0081847.1 [2,0,0,0,0,0|2,0,0]=4 213 B9R1.2 CC1=CC=CC(=C1)CBr CNP0097763.0 [2,0,0,0,0,0|2,0,0]=4 214 B9R1.2 CCC1=CC(=CC=N1)C CNP0220065.0 [2,0,0,0,0,0|2,0,0]=4 215 B9R1.2 CCC1=CC=CC(=C1)C CNP0313685.0 [2,0,0,0,0,0|1,0,0]=3 216 B9R1.2 CCC1=CC=CC(=C1)O CNP0135916.0 [2,0,0,0,0,0|0,0,0]=2 217 B9R1.2 CCC1=CC=CC(=N1)C CNP0315271.0 [2,0,0,0,0,0|2,0,0]=4 218 B9R1.2 CCC1=CC=C[N+](=C1)[O-] CNP0497622.0 [2,0,0,0,0,0|1,0,1]=4 219 B9R1.2 CCC1=CC=NC(=C1)C CNP0209249.0 [2,0,0,0,0,0|2,0,0]=4 220 B9R1.2 CCC1=CN=CC(=C1)C CNP0150046.0 [2,0,0,0,0,0|2,0,0]=4 221 B9R1.2 COC1=CC=CC(=C1)C CNP0354375.0 [2,0,0,0,0,0|2,0,0]=4 222 B9R1.2 COC1=CC=CC(=C1)Cl CNP0167565.0 [2,0,0,0,0,0|2,0,0]=4 223 B9R1.2 COC1=CC=CC(=C1)N CNP0079992.0 [2,0,0,0,0,0|2,0,0]=4 224 B9R1.2 COC1=CC=CC(=C1)O CNP0268248.0 [2,0,0,0,0,0|1,0,0]=3 225 B9R1.2 N#CC1=CC=CC(=C1)O CNP0104146.0 [2,0,0,0,0,0|1,0,1]=4 226 B9R1.2 NCC1=CC=CC(=C1)O CNP0366572.0 [2,0,0,0,0,0|1,0,0]=3 227 B9R1.2 O=CC1=CC=CC(=C1)O CNP0106037.0 [2,0,0,0,0,0|1,0,1]=4 228 B9R1.2 OCC1=CC=CC(=C1)I CNP0564021.0 [2,0,0,0,0,0|2,0,0]=4 229 B9R1.2 OCC1=CC=CC(=C1)O CNP0315716.0 [2,0,0,0,0,0|1,0,0]=3 230 B9R1.69 CC1=CC(=C(C=N1)C)C CNP0375292.0 [2,0,0,0,0,0|2,0,0]=4 231 B9R1.69 CC1=CC=C(C(=C1)Br)Br CNP0060402.0 [2,0,0,0,0,0|2,0,0]=4 232 B9R1.69 CC1=CC=C(C(=C1)Br)N CNP0031609.0 [2,0,0,0,0,0|2,0,0]=4 233 B9R1.69 CC1=CC=C(C(=C1)C)Br CNP0365794.0 [2,0,0,0,0,0|2,0,0]=4 234 B9R1.69 CC1=CC=C(C(=C1)C)C CNP0110255.0 [2,0,0,0,0,0|1,0,0]=3 235 B9R1.69 CC1=CC=C(C(=C1)C)Cl CNP0093284.0 [2,0,0,0,0,0|2,0,0]=4 236 B9R1.69 CC1=CC=C(C(=C1)C)N CNP0375981.0 [2,0,0,0,0,0|2,0,0]=4 237 B9R1.69 CC1=CC=C(C(=C1)C)O CNP0080029.0 [2,0,0,0,0,0|2,0,0]=4 238 B9R1.69 CC1=CC=C(C(=C1)Cl)C CNP0337392.0 [2,0,0,0,0,0|1,0,0]=3 239 B9R1.69 CC1=CC=C(C(=C1)Cl)Cl CNP0253916.0 [2,0,0,0,0,0|2,0,0]=4 240 B9R1.69 CC1=CC=C(C(=C1)Cl)N CNP0363714.0 [2,0,0,0,0,0|2,0,0]=4 241 B9R1.69 CC1=CC=C(C(=C1)Cl)O CNP0145784.0 [2,0,0,0,0,0|2,0,0]=4 242 B9R1.69 CC1=CC=C(C(=C1)N)Br CNP0057363.0 [2,0,0,0,0,0|2,0,0]=4 243 B9R1.69 CC1=CC=C(C(=C1)N)C CNP0307574.0 [2,0,0,0,0,0|1,0,0]=3 244 B9R1.69 CC1=CC=C(C(=C1)N)Cl CNP0495286.0 [2,0,0,0,0,0|2,0,0]=4 245 B9R1.69 CC1=CC=C(C(=C1)N)N CNP0080098.0 [2,0,0,0,0,0|2,0,0]=4 246 B9R1.69 CC1=CC=C(C(=C1)N)O CNP0421546.0 [2,0,0,0,0,0|2,0,0]=4 247 B9R1.69 CC1=CC=C(C(=C1)N)S CNP0463153.0 [2,0,0,0,0,0|2,0,0]=4 248 B9R1.69 CC1=CC=C(C(=C1)O)C CNP0172791.0 [2,0,0,0,0,0|0,0,0]=2 249 B9R1.69 CC1=CC=C(C(=C1)O)O CNP0114802.0 [2,0,0,0,0,0|1,0,0]=3 250 B9R1.69 CC1=CC=C(C(=N1)C)C CNP0390721.0 [2,0,0,0,0,0|2,0,0]=4 251 B9R1.69 CC1=CC=C(C=C1Br)Cl CNP0186814.0 [2,0,0,0,0,0|2,0,0]=4 252 B9R1.69 CC1=CC=C(C=C1C)Br CNP0125395.0 [2,0,0,0,0,0|2,0,0]=4 253 B9R1.69 CC1=CC=C(C=C1C)Cl CNP0482651.0 [2,0,0,0,0,0|2,0,0]=4 254 B9R1.69 CC1=CC=C(C=C1C)N CNP0171920.0 [2,0,0,0,0,0|2,0,0]=4 255 B9R1.69 CC1=CC=C(C=C1C)O CNP0160429.0 [2,0,0,0,0,0|2,0,0]=4 256 B9R1.69 CC1=CC=C(C=C1Cl)N CNP0028854.0 [2,0,0,0,0,0|2,0,0]=4 257 B9R1.69 CC1=CC=C(C=C1N)N CNP0023048.0 [2,0,0,0,0,0|2,0,0]=4 258 B9R1.69 CC1=CC=C(C=C1O)O CNP0256040.0 [2,0,0,0,0,0|1,0,0]=3 259 B9R1.69 CC1=CN=C(C(=C1)C)C CNP0331632.0 [2,0,0,0,0,0|2,0,0]=4 260 B9R1.69 CC1=CNC(=O)C=C1O CNP0017901.0 [2,0,0,0,0,0|2,0,0]=4 261 B9R1.69 N=C1C=CC(=O)C(=C1)O CNP0274436.0 [2,0,0,0,0,0|2,0,0]=4 262 B9R1.69 O=C1C=CC(=O)C(=C1)O CNP0230039.0 [2,0,0,0,0,0|2,0,0]=4 263 B9R1.69 OC1=CC(=CC=C1Cl)Cl CNP0236901.0 [2,0,0,0,0,0|2,0,0]=4 264 B9R1.69 OC1=CC=C(C(=C1)O)O CNP0187325.0 [2,0,0,0,0,0|2,0,0]=4 265 B11R0.92 CC=C(C)C=C(C)C(=O)C(C)C CNP0339213.0 [0,1,1,0,0,0|2,0,0]=4 266 B11R0.150 C=C(CC=C(C)C(=O)O)C(C)C CNP0035097.0 [0,1,1,0,0,0|0,0,1]=3 267 B11R0.109 CCC(O)C=CC=C(C)C(=O)O CNP0182418.0 [0,1,1,0,0,0|2,0,0]=4 268 B11R0.318 CC(=CC=CC(C)(C)O)C(=O)O CNP0137935.0 [0,1,1,0,0,0|1,0,0]=3 269 B11R1.3 BrCC1=CC=C(C=C1)C(Br)Br CNP0339732.0 [1,1,0,0,0,0|2,0,0]=4 270 B11R1.3 CC(C)C1=CC=C(C=C1)C=O CNP0195353.0 [1,1,0,0,0,0|0,0,1]=3 271 B11R1.3 CC(C)C1=CC=C(C=C1)CO CNP0157328.0 [1,1,0,0,0,0|0,0,0]=2 272 B11R1.3 CC(C)C1=CC=C(CC1)CO CNP0003449.0 [1,1,0,0,0,0|0,0,2]=4 273 B11R1.3 CC(C)C1=CCC(=CC1)CO CNP0359351.0 [1,1,0,0,0,0|0,0,2]=4 274 B11R1.3 CC(C)C1C=CC(=CC1)CO CNP0077140.0 [1,1,0,0,0,0|0,0,2]=4 275 B11R1.3 CCC1=CC=C(C=C1)C(=O)C CNP0409725.0 [1,1,0,0,0,0|1,0,1]=4 276 B11R1.3 CCC1=CC=C(C=C1)C(C)O CNP0483491.0 [1,1,0,0,0,0|1,0,0]=3 277 B11R1.3 CN(C)C1=CC=C(C=C1)C=O CNP0077269.0 [1,1,0,0,0,0|1,0,1]=4 278 B11R1.3 CNC1=CC=C(C=C1)N(C)C CNP0587499.0 [1,1,0,0,0,0|1,0,0]=3 279 B11R1.3 COC1=CC=C(C=C1)C(=O)C CNP0278778.0 [1,1,0,0,0,0|1,0,1]=4 280 B11R1.3 COC1=CC=C(C=C1)C(C)C CNP0579655.0 [1,1,0,0,0,0|0,0,0]=2 281 B11R1.3 COC1=CC=C(C=C1)[C@@H](C)O CNP0137067.1 [1,1,0,0,0,0|1,0,0]=3 282 B11R1.3 COC1=CC=C(C=C1)[C@H](C)O CNP0137067.2 [1,1,0,0,0,0|1,0,0]=3 283 B11R1.3 COC1=CN=C(C=N1)C(C)C CNP0044893.0 [1,1,0,0,0,0|2,0,0]=4 284 B11R1.3 C[C@H](O)C1=CC=C(C=C1)CN CNP0285277.1 [1,1,0,0,0,0|1,0,0]=3 285 B11R1.19 CC(C)(C)C1=CC=C(C=C1)Br CNP0508949.0 [1,1,0,0,0,0|1,0,0]=3 286 B11R1.19 CC1=CC=C(C=C1)C(C)(C)O CNP0300826.0 [1,1,0,0,0,0|0,0,0]=2 287 B11R1.19 CC1=CC[C@@H](C=C1)C(C)(C)O CNP0359689.2 [1,1,0,0,0,0|0,0,2]=4 288 B11R1.19 CC1=CC[C@H](C=C1)C(C)(C)O CNP0359689.1 [1,1,0,0,0,0|0,0,2]=4 289 B11R1.22 CC1=CC=C(C=C1)C(C)C=O CNP0371792.0 [1,1,0,0,0,0|0,0,1]=3 290 B11R1.22 CC1=CC=C(C=C1)[C@H](C)CO CNP0229536.1 [1,1,0,0,0,0|0,0,0]=2 291 B11R1.22 CCC(C)C1=CC=C(C=C1)C CNP0084852.0 [1,1,0,0,0,0|0,0,0]=2 292 B11R1.22 CCC(O)C1=CC=C(C=C1)O CNP0386254.0 [1,1,0,0,0,0|2,0,0]=4 293 B11R1.22 CC[C@@H](C)C1=CC=C(C=C1)O CNP0374132.1 [1,1,0,0,0,0|1,0,0]=3 294 B11R1.22 CNC(=O)C1=CC=C(C=C1)C CNP0126468.0 [1,1,0,0,0,0|1,0,1]=4 295 B11R1.22 COC(=O)C1=CC=C(C=C1)C CNP0137727.0 [1,1,0,0,0,0|1,0,1]=4 296 B11R1.22 CO[C@H](C)C1=CC=C(C=C1)O CNP0294754.1 [1,1,0,0,0,0|1,0,0]=3 297 B11R1.22 NC[C@@H](O)C1=CC=C(C=C1)O CNP0139359.1 [1,1,0,0,0,0|2,0,0]=4 298 B11R1.22 NC[C@H](O)C1=CC=C(C=C1)O CNP0139359.2 [1,1,0,0,0,0|2,0,0]=4 299 B11R1.22 OC[C@@H](O)C1=CC=C(C=C1)O CNP0398619.1 [1,1,0,0,0,0|2,0,0]=4 300 B11R1.22 OC[C@H](O)C1=CC=C(C=C1)O CNP0398619.2 [1,1,0,0,0,0|2,0,0]=4 301 B11R1.166 CC(=O)C1=CC=C(C=C1C)C CNP0090387.0 [1,1,0,0,0,0|1,0,1]=4 302 B11R1.166 CC(=O)C1=CC=C(C=C1O)C CNP0265619.0 [1,1,0,0,0,0|1,0,1]=4 303 B11R1.166 CC1=CC(=CC=C1C(C)C)O CNP0343687.0 [1,1,0,0,0,0|1,0,0]=3 304 B11R1.166 CC1=CC=C(C(=C1)C)C(C)C CNP0278893.0 [1,1,0,0,0,0|0,0,0]=2 305 B11R1.166 CC1=CC=C(C(=C1)O)C(C)C CNP0135128.0 [1,1,0,0,0,0|0,0,0]=2 306 B11R1.727 CC(=C1C=CC(C=C1)(C)O)C CNP0111511.0 [1,1,0,0,0,0|0,0,2]=4 307 B11R1.23 COC(=O)C1=CC=CC(=C1)O CNP0301417.0 [1,1,0,0,0,0|1,0,1]=4 308 B11R1.23 N#C[C@@H](O)C1=CC=CC(=C1)O CNP0135364.1 [1,1,0,0,0,0|1,0,1]=4 309 B11R1.74 CC(=O)C1=CC(=CC(=C1)O)O CNP0352952.0 [1,1,0,0,0,0|1,0,1]=4 310 B11R1.74 CC1=CC(=CC(=C1)C(C)C)C CNP0172814.0 [1,1,0,0,0,0|1,0,0]=3 311 B11R1.74 CC1=CC(=NC(=N1)C(C)C)O CNP0161448.0 [1,1,0,0,0,0|2,0,0]=4 312 B11R1.155 CC(C)(C)C1=CC=CC(=C1)O CNP0077275.0 [1,1,0,0,0,0|0,0,0]=2 313 B11R1.155 CC1=CC=CC(=C1)C(C)(C)C CNP0123429.0 [1,1,0,0,0,0|1,0,0]=3 314 B11R1.155 CC1=CC=CC(=C1)C(C)(C)O CNP0612226.0 [1,1,0,0,0,0|1,0,0]=3 315 B11R1.155 CC1=CC=CC(=C1)[N+](C)(C)C CNP0546596.0 [1,1,0,0,0,0|2,0,0]=4 316 B11R1.159 C=C(C)C1=CC=CC(=C1C)O CNP0547009.0 [1,1,0,0,0,0|0,0,2]=4 317 B11R1.159 CC(=O)C1=CC=CC(=C1O)O CNP0306897.0 [1,1,0,0,0,0|1,0,1]=4 318 B11R1.159 CC(C)C1=CC=CC(=C1O)O CNP0066936.0 [1,1,0,0,0,0|0,0,0]=2 319 B11R1.159 CC1=C(C=CC=C1C(C)C)O CNP0487698.0 [1,1,0,0,0,0|0,0,0]=2 320 B11R1.159 CC1=CC=CC(=C1N)C(C)C CNP0611703.0 [1,1,0,0,0,0|1,0,0]=3 321 B11R1.167 CC(=O)C1=CC(=CC=C1N)O CNP0207419.0 [1,1,0,0,0,0|1,0,1]=4 322 B11R1.167 CC(=O)C1=CC(=CC=C1O)O CNP0226762.0 [1,1,0,0,0,0|1,0,1]=4 323 B11R1.167 CC1=CC=C(C(=C1)C(C)C)C CNP0319974.0 [1,1,0,0,0,0|1,0,0]=3 324 B11R1.167 CC1=CC=C(C(=C1)C(C)C)O CNP0297378.0 [1,1,0,0,0,0|1,0,0]=3 325 B11R1.167 OC1=CC=C(C(=C1)C(O)Cl)O CNP0519910.0 [1,1,0,0,0,0|2,0,0]=4 326 B11R1.266 CC(C)C1=CC=CC(=C1)C=O CNP0572774.0 [1,1,0,0,0,0|0,0,1]=3 327 B11R1.266 COC1=CC=CC(=C1)C(=O)C CNP0402576.0 [1,1,0,0,0,0|1,0,1]=4 328 B11R1.266 COC1=CC=CC(=C1)N(C)C CNP0594647.0 [1,1,0,0,0,0|1,0,0]=3 329 B11R1.266 COC1=CN=CC(=N1)C(C)C CNP0002553.0 [1,1,0,0,0,0|2,0,0]=4 330 B11R1.667 CC(C)C1(C=C(C=CC1)O)C CNP0559894.0 [1,1,0,0,0,0|0,0,2]=4 331 B11R1.14 CCC1=CC(=C(C(=O)O1)C)O CNP0148440.0 [1,1,0,0,0,0|1,0,0]=3 332 B11R1.14 COC1=CC(=C(C(=C1)O)C)O CNP0312414.0 [1,1,0,0,0,0|1,0,0]=3 333 B11R1.14 OCC1=CC(=C(C(=C1)Br)O)O CNP0347203.0 [1,1,0,0,0,0|2,0,0]=4 334 B11R1.14 OCC1=CC(=C(C(=C1)Cl)O)O CNP0147248.0 [1,1,0,0,0,0|2,0,0]=4 335 B11R1.14 OCC1=CC(=C(C(=C1)O)O)O CNP0196506.0 [1,1,0,0,0,0|2,0,0]=4 336 B11R1.192 C=CCC1=CC=C(C(=C1)O)O CNP0278721.0 [1,1,0,0,0,0|1,0,1]=4 337 B11R1.192 CC=CC1=CC=C(C(=C1)C)C CNP0488892.0 [1,1,0,0,0,0|1,0,1]=4 338 B11R1.192 CC=CC1=CC=C(C(=C1)O)O CNP0370461.0 [1,1,0,0,0,0|1,0,1]=4 339 B11R1.192 CCCC1=CC=C(C(=C1)C)C CNP0295102.0 [1,1,0,0,0,0|1,0,0]=3 340 B11R1.192 COCC1=CC=C(C(=C1)Br)O CNP0105261.0 [1,1,0,0,0,0|2,0,0]=4 341 B11R1.192 COCC1=CC=C(C(=C1)O)O CNP0408139.0 [1,1,0,0,0,0|1,0,0]=3 342 B11R1.192 NCCC1=CC(=O)C(=O)C=C1 CNP0384373.0 [1,1,0,0,0,0|1,0,1]=4 343 B11R1.192 NCCC1=CC=C(C(=C1)Br)O CNP0107317.0 [1,1,0,0,0,0|2,0,0]=4 344 B11R1.192 NCCC1=CC=C(C(=C1)Cl)O CNP0576198.0 [1,1,0,0,0,0|2,0,0]=4 345 B11R1.192 NCCC1=CC=C(C(=C1)I)O CNP0147812.0 [1,1,0,0,0,0|2,0,0]=4 346 B11R1.192 NCCC1=CC=C(C(=C1)O)O CNP0254743.0 [1,1,0,0,0,0|1,0,0]=3 347 B11R1.192 O=CCC1=CC=C(C(=C1)O)O CNP0123574.0 [1,1,0,0,0,0|1,0,1]=4 348 B11R1.192 OCCC1=CC=C(C(=C1)Cl)O CNP0294538.0 [1,1,0,0,0,0|2,0,0]=4 349 B11R1.192 OCCC1=CC=C(C(=C1)O)O CNP0275287.0 [1,1,0,0,0,0|1,0,0]=3 350 B11R1.277 CC1=CC(=C(C=C1C)CO)C CNP0612014.0 [1,1,0,0,0,0|2,0,0]=4 351 B11R1.277 CCC1=CC(=C(C=C1C)C)C CNP0561211.0 [1,1,0,0,0,0|1,0,0]=3 352 B11R1.277 CCC1=CC(=C(C=C1O)C)C CNP0088843.0 [1,1,0,0,0,0|1,0,0]=3 353 B11R1.277 CCC1=CC(=O)C(=CC1=O)C CNP0227006.0 [1,1,0,0,0,0|0,0,1]=3 354 B11R1.277 COC1=CC(=C(C=C1C)C)C CNP0537102.0 [1,1,0,0,0,0|2,0,0]=4 355 B11R1.277 COC1=CC(=C(C=C1O)C)O CNP0167756.0 [1,1,0,0,0,0|1,0,0]=3 356 B11R1.277 COC1=CC(=O)C(=CC1=O)C CNP0269462.0 [1,1,0,0,0,0|1,0,1]=4 357 B11R1.277 OCC1=CC(=C(C=C1O)Cl)O CNP0329388.0 [1,1,0,0,0,0|2,0,0]=4 358 B11R1.278 CC1=NC=C(C(=C1O)C)CO CNP0346238.0 [1,1,0,0,0,0|2,0,0]=4 359 B11R1.278 CCC1=CC=C(C(=C1O)C)C CNP0328437.0 [1,1,0,0,0,0|1,0,0]=3 360 B11R1.278 COC1=CC=C(C(=O)C1=O)C CNP0534932.0 [1,1,0,0,0,0|1,0,1]=4 361 B11R1.279 C=CC1=CC=C(C(=C1)O)OC CNP0342720.0 [1,1,0,0,0,0|0,0,2]=4 362 B11R1.279 CCC1=CC=C(C(=C1)C)CC CNP0174684.0 [1,1,0,0,0,0|1,0,0]=3 363 B11R1.279 CCC1=CC=C(C(=C1)O)OC CNP0241141.0 [1,1,0,0,0,0|0,0,0]=2 364 B11R1.279 COC1=CC=C(C(=C1)Br)OC CNP0224499.0 [1,1,0,0,0,0|2,0,0]=4 365 B11R1.279 COC1=CC=C(C(=C1)C)OC CNP0235109.0 [1,1,0,0,0,0|2,0,0]=4 366 B11R1.279 COC1=CC=C(C(=C1)Cl)OC CNP0294313.0 [1,1,0,0,0,0|2,0,0]=4 367 B11R1.279 COC1=CC=C(C(=C1)N)OC CNP0151673.0 [1,1,0,0,0,0|2,0,0]=4 368 B11R1.279 COC1=CC=C(C(=C1)O)C=O CNP0298651.0 [1,1,0,0,0,0|1,0,1]=4 369 B11R1.279 COC1=CC=C(C(=C1)O)OC CNP0373176.0 [1,1,0,0,0,0|1,0,0]=3 370 B11R1.279 COC1=CC=C(C=C1Br)CO CNP0163543.0 [1,1,0,0,0,0|2,0,0]=4 371 B11R1.279 COC1=CC=C(C=C1Cl)CO CNP0187706.0 [1,1,0,0,0,0|2,0,0]=4 372 B11R1.279 COC1=CC=C(C=C1O)C=O CNP0420166.0 [1,1,0,0,0,0|1,0,1]=4 373 B11R1.279 COC1=CC=C(C=C1O)CN CNP0009082.0 [1,1,0,0,0,0|1,0,0]=3 374 B11R1.279 COC1=CC=C(C=C1O)CO CNP0153100.0 [1,1,0,0,0,0|1,0,0]=3 375 B11R1.279 NCC1=CC=C(C(=C1)O)CO CNP0119562.0 [1,1,0,0,0,0|1,0,0]=3 376 B11R1.280 CCC1=CC=C(C(=C1)CC)C CNP0134602.0 [1,1,0,0,0,0|1,0,0]=3 377 B11R1.280 CCC1=CC=C(C(=C1)OC)C CNP0257657.0 [1,1,0,0,0,0|0,0,0]=2 378 B11R1.280 CCC1=CC=C(C(=C1)OC)O CNP0401902.0 [1,1,0,0,0,0|1,0,0]=3 379 B11R1.280 COC1=CC(=CC=C1O)CN CNP0052909.0 [1,1,0,0,0,0|2,0,0]=4 380 B11R1.280 COC1=CC(=CC=C1O)CO CNP0268270.0 [1,1,0,0,0,0|2,0,0]=4 381 B11R1.280 COC1=CC=C(C(=C1)OC)Br CNP0018842.0 [1,1,0,0,0,0|2,0,0]=4 382 B11R1.280 COC1=CC=C(C(=C1)OC)O CNP0124974.0 [1,1,0,0,0,0|2,0,0]=4 383 B11R1.280 O=C1C=CC(=CC1=NO)CO CNP0510804.0 [1,1,0,0,0,0|2,0,0]=4 384 B11R1.316 CC1=CSC(=C1C)C(C)(C)C CNP0345135.0 [0,1,0,0,1,0|2,0,0]=4 385 B13R1.52 COC1=CC(=CC=C1O)CC(C)N CNP0310601.0 [0,1,0,0,0,1|2,0,0]=4 386 B13R1.52 COC1=CC(=CC=C1O)C[C@H](C)O CNP0207715.1 [0,1,0,0,0,1|2,0,0]=4 387 B13R1.52 COC1=NC(=CN=C1C)CC(C)C CNP0353194.0 [0,1,0,0,0,1|2,0,0]=4 388 B13R1.510 CC(C)C(=O)C1=CC=C(C(=C1)O)O CNP0168823.0 [0,1,0,0,0,1|1,0,0]=3 389 B13R1.510 C[C@H](N)[C@H](O)C1=CC=C(C(=C1)O)O CNP0335418.1 [0,1,0,0,0,1|2,0,0]=4 390 B13R1.3763 CC(=O)CC1=CC(=C(C(=C1)O)C)O CNP0464022.0 [0,1,0,0,0,1|1,0,1]=4 391 B13R1.3763 CC1=C(C=C(C=C1O)C[C@H](C)O)O CNP0073512.1 [0,1,0,0,0,1|1,0,0]=3 392 B13R1.3763 CC1=C(C=C(OC1=O)CC(C)C)O CNP0137255.0 [0,1,0,0,0,1|1,0,0]=3 393 B13R1.3763 CC1=C(C=C(OC1=O)C[C@H](C)O)O CNP0126980.1 [0,1,0,0,0,1|2,0,0]=4 394 B13R1.3800 CC(C)C1=CC(=C(C(=O)C=C1)O)O CNP0506692.0 [0,1,0,0,0,1|1,0,0]=3 395 B13R1.3800 CC(C)C1=CC=C(C(=O)C(=C1)Cl)Cl CNP0049491.0 [0,1,0,0,0,1|1,0,1]=4 396 B13R1.3800 CC(C)C1=CC=C(C(=O)C(=C1)O)O CNP0271620.0 [0,1,0,0,0,1|1,0,0]=3 397 B13R1.2176 COC1=CC=CC(=CC1=O)C(C)C CNP0320865.0 [0,1,0,0,0,1|0,0,1]=3 398 B13R1.3783 CC(C)C1=C(C(=O)C(=CC=C1)O)O CNP0501020.0 [0,1,0,0,0,1|1,0,1]=4 399 B13R1.3783 CC(C)C1=CC=CC(=O)C(=C1O)O CNP0186226.0 [0,1,0,0,0,1|1,0,0]=3 400 B13R1.38 CC(C)(O)C1=CC=C(C(=C1)O)CO CNP0520449.0 [0,2,0,0,0,0|0,0,0]=2 401 B13R1.50 COC1=CC(=CC=C1C)C(C)(C)O CNP0405242.0 [0,2,0,0,0,0|0,0,0]=2 402 B13R1.272 CC1=CC=C(C=C1O)C(C)(O)CO CNP0127978.0 [0,2,0,0,0,0|0,0,0]=2 403 B13R1.272 CC[C@@](C)(O)C1=CC=C(C(=O)O1)C CNP0445652.1 [0,2,0,0,0,0|1,0,1]=4 404 B13R1.272 COC(C)(C)C1=CC=C(C(=C1)O)C CNP0153685.0 [0,2,0,0,0,0|0,0,0]=2 405 B13R1.877 CC1=CC(=C(C=C1C(C)(C)C)O)O CNP0518433.0 [0,2,0,0,0,0|1,0,0]=3 406 B13R1.884 CC1=CC=C(C(=C1O)O)C(C)(C)O CNP0261183.0 [0,2,0,0,0,0|0,0,0]=2 407 B13R1.7922 CC(C)(C)C1=CC(=C(C(=C1)O)O)O CNP0489042.0 [0,2,0,0,0,0|1,0,0]=3 408 B13R1.120 CC(C)C1=CC=C(C(=C1)O)C(C)C CNP0389590.0 [0,2,0,0,0,0|0,0,0]=2 409 B13R1.652 COC1=CC(=C(C=C1O)C(=O)C)O CNP0205734.0 [0,2,0,0,0,0|1,0,1]=4 410 B13R1.3088 CCC1=CC=C(OC1=O)[C@H](C)CC CNP0432663.1 [0,2,0,0,0,0|1,0,1]=4 411 B13R1.3088 CC[C@@H](C)C1=CC=C(C(=O)O1)CO CNP0436103.1 [0,2,0,0,0,0|1,0,1]=4 412 B13R1.3088 COC(=O)C1=CC=C(C(=C1)O)OC CNP0155987.0 [0,2,0,0,0,0|1,0,1]=4 413 B13R1.3088 COC1=CC=C(C=C1O)[C@@H](O)CO CNP0150126.1 [0,2,0,0,0,0|1,0,0]=3 414 B13R1.3091 C=C(C)C1=CC=C(C(=C1)OC)OC CNP0310060.0 [0,2,0,0,0,0|0,0,2]=4 415 B13R1.3091 COC1=CC(=CC=C1C=O)C(C)C CNP0328050.0 [0,2,0,0,0,0|0,0,1]=3 416 B13R1.3091 COC1=CC=C(C=C1OC)C(=O)C CNP0212163.0 [0,2,0,0,0,0|1,0,1]=4 417 B13R1.3091 COC1=CC=C(C=C1OC)C(C)O CNP0521065.0 [0,2,0,0,0,0|1,0,0]=3 418 B13R1.3096 COC1=CC=C(C(=C1O)O)C(=O)C CNP0408569.0 [0,2,0,0,0,0|1,0,1]=4 419 B13R1.3380 CCC1=C(C=C(OC1=O)C(C)C)O CNP0285712.0 [0,2,0,0,0,0|1,0,0]=3 420 B13R1.3380 COC1=C(C=C(C=C1O)C(=O)C)C CNP0342545.0 [0,2,0,0,0,0|1,0,1]=4 421 B13R1.49 CCC(C)C1=CN=C(C(=N1)OC)C CNP0397456.0 [0,2,0,0,0,0|2,0,0]=4 422 B13R1.49 CC[C@@H](O)C1=CC=C(C(=C1)OC)O CNP0362761.2 [0,2,0,0,0,0|2,0,0]=4 423 B13R1.49 CC[C@H](O)C1=CC=C(C(=C1)OC)O CNP0362761.1 [0,2,0,0,0,0|2,0,0]=4 424 B13R1.49 COC1=CC(=CC=C1O)[C@@H](O)CN CNP0113388.2 [0,2,0,0,0,0|2,0,0]=4 425 B13R1.49 COC1=CC(=CC=C1O)[C@@H](O)CO CNP0116546.1 [0,2,0,0,0,0|2,0,0]=4 426 B13R1.49 COC1=CC(=CC=C1O)[C@H](O)CN CNP0113388.1 [0,2,0,0,0,0|2,0,0]=4 427 B13R1.49 COC1=CC(=CC=C1O)[C@H](O)CO CNP0116546.2 [0,2,0,0,0,0|2,0,0]=4 428 B13R1.298 COC1=C(C(=O)OC(=C1)C(C)O)C CNP0217104.0 [0,2,0,0,0,0|2,0,0]=4 429 B13R1.298 COC1=C(C(=O)OC(=C1)[C@H](C)O)C CNP0217104.1 [0,2,0,0,0,0|2,0,0]=4 430 B13R1.354 CC=CC1=CC(=CC=C1C)C(C)C CNP0336555.0 [0,2,0,0,0,0|1,0,0]=3 431 B13R1.354 CCOC1=CC(=CC=C1C)C(C)C CNP0242147.0 [0,2,0,0,0,0|0,0,0]=2 432 B13R1.651 COC1=CC(=C(C=C1C)O)C(C)C CNP0117764.0 [0,2,0,0,0,0|0,0,0]=2 433 B13R1.2398 COC1=CC(=C(C=C1C(C)C)O)C CNP0411678.0 [0,2,0,0,0,0|0,0,0]=2 434 B13R1.2811 CC1=C(C(=O)C(=CC1=O)C(C)C)O CNP0340343.0 [0,2,0,0,0,0|0,0,0]=2 435 B13R1.2811 CC1=C(C=C(C(=C1O)O)C(C)C)O CNP0299699.0 [0,2,0,0,0,0|0,0,0]=2 436 B13R1.2811 CC1=C(OC(=O)C(=C1O)C)C(C)C CNP0125708.0 [0,2,0,0,0,0|1,0,0]=3 437 B13R1.2812 CC1=CC(=O)C(=C(C1=O)O)C(C)C CNP0370759.0 [0,2,0,0,0,0|0,0,1]=3 438 B13R1.331 COC(OC)C1=CC=C(C(=C1)O)O CNP0129986.0 [0,2,0,0,0,0|1,0,0]=3 439 B13R1.331 CO[C@H](CO)C1=CC=C(C(=C1)O)O CNP0242961.1 [0,2,0,0,0,0|1,0,0]=3 440 B13R1.466 CNC[C@@H](O)C1=CC=C(C(=C1)O)O CNP0255612.2 [0,2,0,0,0,0|2,0,0]=4 441 B13R1.466 CNC[C@H](O)C1=CC=C(C(=C1)O)O CNP0255612.1 [0,2,0,0,0,0|2,0,0]=4 442 B13R1.1808 COC(=O)C1=CC=C(C(=C1N)O)C CNP0250480.0 [0,2,0,0,0,0|1,0,1]=4 443 B13R1.2678 CC=C(C)C1=CC(=C(C(=C1)O)C)O CNP0417299.0 [0,2,0,0,0,0|0,0,1]=3 444 B13R1.2678 CC=C(C)C1=CC(=C(C(=O)O1)C)O CNP0129131.0 [0,2,0,0,0,0|1,0,1]=4 445 B13R1.2678 CC[C@@H](C)C1=CC(=C(C(=O)O1)C)O CNP0146257.1 [0,2,0,0,0,0|1,0,0]=3 446 B13R1.2678 CC[C@H](C)C1=CC(=C(C(=O)O1)C)O CNP0146257.2 [0,2,0,0,0,0|1,0,0]=3 447 B11R1.370 CC1=C(C(C(=C1)C=O)(C)C)C CNP0496427.0 [0,0,1,1,0,0|2,0,0]=4 448 B11R1.90 C=C(C)C=CC1=C(C=CO1)C CNP0277350.0 [0,0,1,1,0,0|0,0,2]=4 449 B11R1.90 CC(=CCC1=C(C=CO1)C)C CNP0224893.0 [0,0,1,1,0,0|0,0,2]=4 450 B11R1.565 CC(C)C1=CC=CC(=O)C=C1 CNP0424734.0 [0,0,1,1,0,0|2,0,0]=4 451 B11R1.53 CC(C)C1=CC=CC=C1C=O CNP0492852.0 [0,0,1,1,0,0|0,0,2]=4 452 B11R1.561 CC1=CC=CC(CC1=O)(C)C CNP0265210.0 [0,0,1,1,0,0|0,0,2]=4 453 B11R2.34 BrC1=CC=C(C=C1)C2CC2 CNP0510546.0 [1,0,0,1,0,0|1,0,0]=3 454 B11R2.363 CC1=CC=C2C(=O)CC2=C1 CNP0317782.0 [1,0,0,1,0,0|1,0,1]=4 455 B11R2.190 COC1=CC=C2CCC2=C1 CNP0063591.0 [1,0,0,1,0,0|2,0,0]=4 456 B13R2.430 CC(=O)C1=CC=C2OCOC2=C1 CNP0109786.0 [0,1,0,1,0,0|1,0,1]=4 457 B13R2.1590 COC1=CC2=C(C=C1C)[C@@H](C2)Cl CNP0414182.1 [0,1,0,1,0,0|2,0,0]=4 458 B13R2.1590 COC1=CC2=C(C=C1C)[C@H](C2)Cl CNP0414182.2 [0,1,0,1,0,0|2,0,0]=4 459 B9R1.35 CC1=CC=C(O1)C(C)C CNP0259912.0 [1,0,0,0,1,0|1,0,0]=3 460 B9R1.35 CC1=CSC(=N1)C(C)C CNP0165450.0 [1,0,0,0,1,0|2,0,0]=4 461 B9R1.35 CC1=NC(=CS1)C(C)C CNP0015302.0 [1,0,0,0,1,0|2,0,0]=4 462 B9R1.132 CCC1=C(C(=CS1)C)C CNP0171065.0 [1,0,0,0,1,0|2,0,0]=4 463 B9R1.132 CCC1=CSC(=C1C)C CNP0103141.0 [1,0,0,0,1,0|2,0,0]=4 464 B11R0.6 CC(=CC=CC(=CC(=O)O)C)C CNP0286255.0 [0,0,1,0,0,1|1,0,1]=4 465 B11R1.20 CC(=O)OC1=CC=C(C=C1)C CNP0227103.0 [1,0,0,0,0,1|1,0,1]=4 466 B11R1.20 CC(C)CC1=CC=C(C=C1)O CNP0163738.0 [1,0,0,0,0,1|1,0,0]=3 467 B11R1.20 CC(N)CC1=CC=C(C=C1)I CNP0499686.0 [1,0,0,0,0,1|2,0,0]=4 468 B11R1.20 CC1=CC=C(C=C1)CC(C)C CNP0003406.0 [1,0,0,0,0,1|0,0,0]=2 469 B11R1.20 CC1=CC=C(C=C1)CC(C)N CNP0079876.0 [1,0,0,0,0,1|1,0,0]=3 470 B11R1.20 C[C@H](N)CC1=CC=C(C=C1)O CNP0196254.1 [1,0,0,0,0,1|2,0,0]=4 471 B11R1.157 CC(=O)NC1=CC=CC(=C1)O CNP0605398.0 [1,0,0,0,0,1|1,0,1]=4 472 B11R1.157 CC(=O)OC1=CC=CC(=C1)O CNP0341697.0 [1,0,0,0,0,1|1,0,1]=4 473 B11R1.157 CC(O)CC1=CN=CC(=C1)O CNP0432265.0 [1,0,0,0,0,1|2,0,0]=4 474 B13R1.511 CN(C)CCC1=CC=C(C(=C1)O)O CNP0358976.0 [0,0,0,0,0,2|2,0,0]=4 475 B13R1.511 C[C@@H](O)CCC1=CC=C(C(=C1)O)O CNP0157154.1 [0,0,0,0,0,2|2,0,0]=4 476 B13R1.511 C[C@H](O)CCC1=CC=C(C(=C1)O)O CNP0157154.2 [0,0,0,0,0,2|2,0,0]=4