0 B13R1.337 CC(=O)C=CC=CC1=CC=CC=C1 CNP0296768.0 [0,0,0,0,0,0|1,0,1]=2 1 B13R1.337 CC(=O)C=CCCC1=CC=CC=C1 CNP0172070.0 [0,0,0,0,0,0|1,0,3]=4 2 B13R1.337 CC(=O)C=CNCC1=CC=CC=C1 CNP0417107.0 [0,0,0,0,0,0|2,0,2]=4 3 B13R1.337 CC(=O)OCC=CC1=CC=CC=C1 CNP0207222.0 [0,0,0,0,0,0|0,0,0]=0 4 B13R1.337 CC(=O)OCCCC1=CC=CC=C1 CNP0266306.0 [0,0,0,0,0,0|0,0,2]=2 5 B13R1.337 CC(C)CCN=CC1=CC=CC=C1 CNP0477012.0 [0,0,0,0,0,0|3,0,1]=4 6 B13R1.337 NC(=O)OCCCC1=CC=CC=C1 CNP0301747.0 [0,0,0,0,0,0|1,0,2]=3 7 B13R1.337 O=C(O)C=CC=CC1=CC=CC=C1 CNP0177753.0 [0,0,0,0,0,0|2,0,1]=3 8 B13R1.337 O=C(O)CC=CCC1=CC=CC=C1 CNP0286082.0 [0,0,0,0,0,0|2,0,2]=4 9 B13R1.337 O=C(O)CCC=CC1=CC=CC=C1 CNP0594952.0 [0,0,0,0,0,0|2,0,0]=2 10 B13R1.337 O=C(O)CCCCC1=CC=CC=C1 CNP0097941.0 [0,0,0,0,0,0|2,0,2]=4 11 B12R1.8 CC=CC=CCC1=CC=CC=C1 CNP0076593.0 [1,0,0,0,0,0|1,0,2]=4 12 B12R1.8 CNCCC=CC1=CC=CN=C1 CNP0127845.0 [1,0,0,0,0,0|3,0,0]=4 13 B12R1.8 O=CC=CC=CC1=CC=CC=C1 CNP0470167.0 [1,0,0,0,0,0|1,0,1]=3 14 B12R1.8 O=COCC=CC1=CC=CC=C1 CNP0186643.0 [1,0,0,0,0,0|0,0,0]=1 15 B12R1.8 O=COCCCC1=CC=CC=C1 CNP0314153.0 [1,0,0,0,0,0|0,0,2]=3 16 B14R1.159 CC(=O)OCC=CC1=CC=CC=C1O CNP0108630.0 [0,1,0,0,0,0|0,0,0]=1 17 B14R1.159 CC1=CC=CC=C1C=CCCC(=O)O CNP0322810.0 [0,1,0,0,0,0|2,0,0]=3 18 B14R1.420 CC(=CCOC(=O)C1=CC=CC=C1)C CNP0611701.0 [0,1,0,0,0,0|3,0,0]=4 19 B14R1.420 NC(=O)CCCC(=O)C1=CC=CC=C1 CNP0117112.0 [0,1,0,0,0,0|2,0,1]=4 20 B14R1.420 O=C(O)CCCC(=O)C1=CC=CC=C1 CNP0467044.0 [0,1,0,0,0,0|2,0,1]=4 21 B14R1.420 O=C(O)CCNC(=O)C1=CC=CC=C1 CNP0342116.0 [0,1,0,0,0,0|3,0,0]=4 22 B14R1.423 CC(=O)NC[C@@H](O)CC1=CC=CC=C1 CNP0429280.1 [0,1,0,0,0,0|1,0,2]=4 23 B14R1.423 O=C(O)CCC(=O)CC1=CC=CC=C1 CNP0167736.0 [0,1,0,0,0,0|2,0,1]=4 24 B14R1.423 O=C(O)CCC(=O)NC1=CC=CC=C1 CNP0542382.0 [0,1,0,0,0,0|3,0,0]=4 25 B14R1.677 CC(=O)CCC=CC1=CC=C(C=C1)O CNP0249738.0 [0,1,0,0,0,0|1,0,0]=2 26 B14R1.677 CC(=O)OCC=CC1=CC=C(C=C1)O CNP0136768.0 [0,1,0,0,0,0|0,0,0]=1 27 B14R1.677 CC(=O)OCCCC1=CC=C(C=C1)O CNP0197993.0 [0,1,0,0,0,0|0,0,2]=3 28 B14R1.677 C[C@H](O)CC/C=C/C1=CC=C(C=C1)O CNP0161748.1 [0,1,0,0,0,0|1,0,2]=4 29 B14R1.677 NC(=O)C=CC=CC1=CC=C(C=C1)N CNP0401788.0 [0,1,0,0,0,0|2,0,1]=4 30 B14R1.677 NC1=CC=C(C=C1)C=CC=CC(=O)O CNP0419257.0 [0,1,0,0,0,0|2,0,1]=4 31 B14R1.677 O=C(O)C=CC=CC1=CC=C(C=C1)O CNP0175962.0 [0,1,0,0,0,0|2,0,1]=4 32 B14R1.716 CC(=NO)C=CC=CC1=CC=CC=C1 CNP0315084.0 [0,1,0,0,0,0|1,0,2]=4 33 B14R1.716 CCC(=O)CCCCC1=CC=CC=C1 CNP0547588.0 [0,1,0,0,0,0|1,0,2]=4 34 B14R1.716 CCC(=O)OCC=CC1=CC=CC=C1 CNP0002421.0 [0,1,0,0,0,0|0,0,0]=1 35 B14R1.716 CCC(=O)OCCCC1=CC=CC=C1 CNP0147172.0 [0,1,0,0,0,0|0,0,2]=3 36 B14R1.716 COC(=O)C=CC=CC1=CC=CC=C1 CNP0143962.0 [0,1,0,0,0,0|1,0,1]=3 37 B14R1.818 CC(=CC(=O)O)C=CC1=CC=CC=C1 CNP0513009.0 [0,1,0,0,0,0|2,0,1]=4 38 B14R1.818 CC(=O)CC(C)OCC1=CC=CC=C1 CNP0184746.0 [0,1,0,0,0,0|2,0,1]=4 39 B14R1.818 CC(=O)O[C@H](C)CCC1=CC=CC=C1 CNP0146654.1 [0,1,0,0,0,0|0,0,2]=3 40 B14R1.818 CC(C)OC(=O)C=CC1=CC=CC=C1 CNP0180499.0 [0,1,0,0,0,0|1,0,2]=4 41 B14R1.818 O=C(O)C[C@@H](O)/C=C/C1=CC=CC=C1 CNP0104971.1 [0,1,0,0,0,0|2,0,0]=3 42 B14R1.6449 CC(=CC=CC1=CC=CC=C1)C(=O)O CNP0472457.0 [0,1,0,0,0,0|2,0,1]=4 43 B14R1.6449 CC(=O)[C@@H](N)COCC1=CC=CC=C1 CNP0507142.1 [0,1,0,0,0,0|2,0,1]=4 44 B14R2.2 CC(=O)CC1=CNC2=CC=CC=C12 CNP0611662.0 [0,0,0,1,0,0|2,0,1]=4 45 B14R2.2 CC(=O)OC1=CNC2=CC=CC=C12 CNP0174179.0 [0,0,0,1,0,0|1,0,1]=3 46 B14R2.2 CC(=O)SC1=CNC2=CC=CC=C12 CNP0259512.0 [0,0,0,1,0,0|1,1,1]=4 47 B14R2.19 O=C1C=C(CO1)CC2=CC=CC=C2 CNP0220173.0 [0,0,0,1,0,0|0,0,2]=3 48 B14R2.19 O=C1N[C@H](CO1)CC2=CC=CC=C2 CNP0490847.1 [0,0,0,1,0,0|1,0,2]=4 49 B14R2.21 CC1=CC=CC(=C1)C2=CC=CC=C2 CNP0204278.0 [0,0,0,1,0,0|2,0,1]=4 50 B14R2.21 O=C1C=C(SCC1)C2=CC=CC=C2 CNP0044156.0 [0,0,0,1,0,0|2,0,1]=4 51 B14R2.21 O=C1C=CC=C(O1)C2=CC=CC=C2 CNP0142954.0 [0,0,0,1,0,0|2,0,1]=4 52 B14R2.21 O=C1CCC=C(O1)C2=CC=CC=C2 CNP0057103.0 [0,0,0,1,0,0|2,0,0]=3 53 B14R2.21 O=C1CCN[C@H](C1)C2=CC=CC=C2 CNP0102925.1 [0,0,0,1,0,0|2,0,1]=4 54 B14R2.21 O=C1CCO[C@H](C1)C2=CC=CC=C2 CNP0112018.1 [0,0,0,1,0,0|2,0,1]=4 55 B14R2.31359 O=C(O)C1=CC=CC2=CC=CC=C12 CNP0250928.0 [0,0,0,1,0,0|2,0,1]=4 56 B12R1.252 CC(=CCCC1=CC=CC=C1)C CNP0046365.0 [0,0,0,0,1,0|2,0,1]=4 57 B12R1.252 CC(=O)C=NNC1=CC=CC=C1 CNP0071032.0 [0,0,0,0,1,0|2,0,1]=4 58 B12R1.252 CC(=O)NCCC1=CC=CC=C1 CNP0298057.0 [0,0,0,0,1,0|1,0,1]=3 59 B12R1.252 CC(=O)OCCC1=CC=CC=C1 CNP0195113.0 [0,0,0,0,1,0|0,0,1]=2 60 B12R1.252 CC(C)CN=CC1=CC=CC=C1 CNP0478741.0 [0,0,0,0,1,0|2,0,1]=4 61 B12R1.252 NC(=O)CC=CC1=CC=CC=C1 CNP0073923.0 [0,0,0,0,1,0|1,0,0]=2 62 B12R1.252 NC(=O)NCCC1=CC=CC=C1 CNP0509449.0 [0,0,0,0,1,0|2,0,1]=4 63 B12R1.252 NC(=O)NN=CC1=CC=CC=C1 CNP0048901.0 [0,0,0,0,1,0|3,0,0]=4 64 B12R1.252 O=C(O)CC=CC1=CC=CC=C1 CNP0242436.0 [0,0,0,0,1,0|1,0,0]=2 65 B12R1.252 O=C(O)CC=CC1=CC=CN=C1 CNP0110379.0 [0,0,0,0,1,0|2,0,0]=3 66 B12R1.252 O=C(O)CCCC1=CC=CC=C1 CNP0152618.0 [0,0,0,0,1,0|1,0,2]=4 67 B12R1.252 O=C(O)CCOC1=CC=CC=C1 CNP0002351.0 [0,0,0,0,1,0|2,0,1]=4 68 B12R1.252 O=C(O)CSCC1=CC=CC=C1 CNP0438400.0 [0,0,0,0,1,0|2,0,1]=4 69 B11R1.28 CC=CC=CC1=CC=CC=N1 CNP0080784.0 [2,0,0,0,0,0|1,0,1]=4 70 B11R1.28 CC=CCCC1=CC=CC=C1 CNP0591592.0 [2,0,0,0,0,0|1,0,1]=4 71 B11R1.28 CCCC=CC1=CC=CC=C1 CNP0133408.0 [2,0,0,0,0,0|0,0,1]=3 72 B11R1.28 CCOCCC1=CC=CC=C1 CNP0162532.0 [2,0,0,0,0,0|0,0,2]=4 73 B11R1.28 CNCC=CC1=CC=CC=C1 CNP0268805.0 [2,0,0,0,0,0|1,0,0]=3 74 B11R1.28 COCCOC1=CC=CC=C1 CNP0511350.0 [2,0,0,0,0,0|1,0,1]=4 75 B11R1.28 O=CC=CCC1=CC=CC=C1 CNP0157371.0 [2,0,0,0,0,0|0,0,2]=4 76 B11R1.28 O=COCCC1=CC=CC=C1 CNP0271229.0 [2,0,0,0,0,0|0,0,1]=3 77 B13R0.54 CC=CC=CC#CC=CCOC(=O)C CNP0102755.0 [0,1,1,0,0,0|0,0,2]=4 78 B13R1.24 CC=CC=CC(=O)C1=CC=CC=C1 CNP0212500.0 [1,1,0,0,0,0|1,0,1]=4 79 B13R1.42 C=COC(=O)C=CC1=CC=CC=C1 CNP0604637.0 [1,1,0,0,0,0|0,0,2]=4 80 B13R1.42 CCOC(=O)C=CC1=CC=CC=C1 CNP0238965.0 [1,1,0,0,0,0|0,0,2]=4 81 B13R1.718 COC(=O)CC=CC1=CC=CC=C1 CNP0207145.0 [1,1,0,0,0,0|2,0,0]=4 82 B13R1.45 C=C(COC(=O)C)C1=CC=CC=C1 CNP0111069.0 [0,1,0,0,1,0|0,0,0]=2 83 B13R1.45 CC(=O)NCC(=O)C1=CC=CC=C1 CNP0232667.0 [0,1,0,0,1,0|1,0,0]=3 84 B13R1.45 CC(=O)NCC(O)C1=CC=CC=C1 CNP0575044.0 [0,1,0,0,1,0|1,0,1]=4 85 B13R1.45 CC(=O)OC=C(C)C1=CC=CC=C1 CNP0052211.0 [0,1,0,0,1,0|0,0,0]=2 86 B13R1.45 O=C(O)C=CC(=O)C1=CC=CC=C1 CNP0009522.0 [0,1,0,0,1,0|1,0,1]=4 87 B13R1.45 O=C(O)CCC(=O)C1=CC=CC=C1 CNP0453495.0 [0,1,0,0,1,0|1,0,1]=4 88 B13R1.45 O=C(O)CNC(=O)C1=CC=CC=C1 CNP0201196.0 [0,1,0,0,1,0|2,0,0]=4 89 B13R1.149 CC(=O)OCCC1=CC=CC(=C1)O CNP0581912.0 [0,1,0,0,1,0|0,0,1]=3 90 B13R1.158 CC(=O)NCCC1=CC=CC=C1O CNP0308942.0 [0,1,0,0,1,0|1,0,1]=4 91 B13R1.158 CC1=CC=CC=C1C=CCC(=O)N CNP0577535.0 [0,1,0,0,1,0|1,0,0]=3 92 B13R1.158 O=C(O)CC=CC1=CC=CC=C1O CNP0121004.0 [0,1,0,0,1,0|1,0,0]=3 93 B13R1.348 CC(=O)C=C(C)NC1=CC=CC=C1 CNP0070664.0 [0,1,0,0,1,0|1,0,1]=4 94 B13R1.348 CC(=O)CC(=CC1=CC=CC=C1)C CNP0258512.0 [0,1,0,0,1,0|0,0,0]=2 95 B13R1.348 CC(=O)CC(=NC1=CC=CC=C1)C CNP0377921.0 [0,1,0,0,1,0|1,0,0]=3 96 B13R1.348 CC(=O)C[C@H](O)CC1=CC=CC=C1 CNP0264298.1 [0,1,0,0,1,0|0,0,2]=4 97 B13R1.348 CC(=O)N[C@@H](C)CC1=CC=CC=C1 CNP0071012.2 [0,1,0,0,1,0|1,0,1]=4 98 B13R1.348 CC(=O)N[C@H](C)CC1=CC=CC=C1 CNP0071012.1 [0,1,0,0,1,0|1,0,1]=4 99 B13R1.348 O=C(O)CC(=O)NC1=CC=CC=C1 CNP0071010.0 [0,1,0,0,1,0|2,0,0]=4 100 B13R1.351 CC(=O)C(=CNC1=CC=CC=C1)C CNP0106967.0 [0,1,0,0,1,0|1,0,1]=4 101 B13R1.351 CC(=O)[C@@H](N)CCC1=CC=CC=C1 CNP0565249.1 [0,1,0,0,1,0|0,0,2]=4 102 B13R1.351 C[C@@H](N)[C@@H](O)/C=C/C1=CC=CC=C1 CNP0287290.1 [0,1,0,0,1,0|1,0,1]=4 103 B13R1.351 C[C@H](N)[C@@H](O)/C=C/C1=CC=CC=C1 CNP0287290.3 [0,1,0,0,1,0|1,0,1]=4 104 B13R1.351 C[C@H](N)[C@H](O)/C=C/C1=CC=CC=C1 CNP0287290.2 [0,1,0,0,1,0|1,0,1]=4 105 B13R1.513 CC(=O)C=CNC1=CC=C(C=C1)Br CNP0465673.0 [0,1,0,0,1,0|1,0,1]=4 106 B13R1.513 CC(=O)CC=CC1=CC=C(C=C1)O CNP0480900.0 [0,1,0,0,1,0|0,0,0]=2 107 B13R1.513 CC(=O)CCOC1=CC=C(C=C1)O CNP0081116.0 [0,1,0,0,1,0|1,0,1]=4 108 B13R1.513 CC(=O)NCCC1=CC=C(C=C1)O CNP0309556.0 [0,1,0,0,1,0|1,0,1]=4 109 B13R1.513 CC(=O)OCCC1=CC=C(C=C1)O CNP0363419.0 [0,1,0,0,1,0|0,0,1]=3 110 B15R1.3664 CC(C)C(=O)OCC=CC1=CC=CC=C1 CNP0002419.0 [0,1,0,0,0,1|1,0,1]=4 111 B15R1.888 CC(=O)OCC=CC1=CC=C(C(=C1)O)O CNP0145945.0 [0,2,0,0,0,0|0,0,0]=2 112 B15R1.84 O=C(O)CCC=CC1=CC=CC=C1CO CNP0245541.0 [0,2,0,0,0,0|2,0,0]=4 113 B15R1.5821 CC(=O)OCC=CC1=C(C=C(CC1)O)O CNP0226545.0 [0,2,0,0,0,0|0,0,2]=4 114 B15R1.8019 CC(=O)NCCC(=O)C1=CC=CC=C1N CNP0353255.0 [0,2,0,0,0,0|1,0,1]=4 115 B15R1.882 C=C(C)CCC=C(C)C1=CC=C(C=C1)C CNP0304562.0 [0,2,0,0,0,0|2,0,0]=4 116 B15R1.959 CCC(=O)CCCC(=O)C1=CC=CC=C1 CNP0212147.0 [0,2,0,0,0,0|1,0,1]=4 117 B15R1.4 COC1=CC=C(C=C1)C=CCOC(=O)C CNP0104493.0 [0,2,0,0,0,0|0,0,0]=2 118 B15R1.4 COC1=CC=C(C=C1)CCCOC(=O)C CNP0417711.0 [0,2,0,0,0,0|0,0,2]=4 119 B15R1.26 COC(=O)C=CC=CC1=CC=C(C=C1)O CNP0255075.0 [0,2,0,0,0,0|1,0,1]=4 120 B15R1.870 CC(=O)C=C(O)C=CC1=CC=C(C=C1)O CNP0159323.0 [0,2,0,0,0,0|1,0,1]=4 121 B15R1.870 CC(=O)CC(=O)C=CC1=CC=C(C=C1)O CNP0250085.0 [0,2,0,0,0,0|1,0,1]=4 122 B15R1.741 COC(=O)C[C@@H](N)/C=C/C1=CC=CC=C1 CNP0448257.2 [0,2,0,0,0,0|1,0,0]=3 123 B15R1.741 COC(=O)C[C@H](N)/C=C/C1=CC=CC=C1 CNP0448257.1 [0,2,0,0,0,0|1,0,0]=3 124 B15R1.778 CCCC(=O)OCC=CC1=CC=CC=C1 CNP0002420.0 [0,2,0,0,0,0|0,0,0]=2 125 B15R1.12240 CC(=O)OC(C)(C)CCC1=CC=CC=C1 CNP0199576.0 [0,2,0,0,0,0|0,0,2]=4 126 B13R1.142 C=CCC1=CC=C(C=C1)OC(=O)C CNP0418020.0 [0,0,1,1,0,0|0,0,2]=4 127 B13R1.653 C=CC1=CC=C(C(=C1)C)OC(=O)C CNP0588232.0 [0,0,1,1,0,0|0,0,2]=4 128 B13R2.3 C1=C(CCCC1)C2=CC=CC=C2 CNP0077019.0 [1,0,0,1,0,0|1,0,1]=4 129 B13R2.15 CC1=CNC=C1C2=CC=CC=C2 CNP0158386.0 [1,0,0,1,0,0|2,0,0]=4 130 B13R2.15 NC1=C(C=NO1)C2=CC=CC=C2 CNP0233548.0 [1,0,0,1,0,0|2,0,0]=4 131 B13R2.15 O=C1CCC=C1C2=CC=CC=C2 CNP0587845.0 [1,0,0,1,0,0|1,0,0]=3 132 B13R2.1613 O=CC1=CC=CC2=CC=CC=C12 CNP0083426.0 [1,0,0,1,0,0|1,0,1]=4 133 B13R2.10 O=C1C=C(CO1)C2=CC=CC=C2 CNP0352665.0 [0,0,0,1,1,0|0,0,1]=3 134 B13R2.10 O=C1CNC(=N1)C2=CC=CC=C2 CNP0040410.0 [0,0,0,1,1,0|2,0,0]=4 135 B13R2.10 O=C1CSC(=N1)C2=CC=CC=C2 CNP0049999.0 [0,0,0,1,1,0|2,0,0]=4 136 B13R2.31 O=C1C[C@H](N1)SC2=CC=CC=C2 CNP0064455.1 [0,0,0,1,1,0|2,0,0]=4 137 B13R2.72 CC(=O)C1=CNC2=CC=CC=C12 CNP0402989.0 [0,0,0,1,1,0|1,0,1]=4 138 B13R2.72 CC(=O)N1C=CC2=CC=CC=C12 CNP0113091.0 [0,0,0,1,1,0|1,0,0]=3 139 B13R2.72 O=C(O)C1C=CC2=CC=CC=C12 CNP0085963.0 [0,0,0,1,1,0|1,0,0]=3 140 B13R2.5881 CC(=O)C=C1CC2=CC=CC=C12 CNP0132730.0 [0,0,0,1,1,0|0,0,2]=4 141 B13R2.5881 CC(=O)N[C@@H]1CC2=CC=CC=C12 CNP0067507.2 [0,0,0,1,1,0|1,0,1]=4 142 B13R2.5881 CC(=O)N[C@H]1CC2=CC=CC=C12 CNP0067507.1 [0,0,0,1,1,0|1,0,1]=4 143 B13R2.5881 CC(=O)O[C@@H]1CC2=CC=CC=C12 CNP0044409.1 [0,0,0,1,1,0|0,0,1]=3 144 B13R2.5881 CC(=O)O[C@H]1CC2=CC=CC=C12 CNP0044409.2 [0,0,0,1,1,0|0,0,1]=3 145 B15R2.6 CC(=CCC1=CNC2=CC=CC=C12)C CNP0151197.0 [0,0,0,1,0,1|2,0,0]=4 146 B15R2.6 CC(=O)C=CC1=CNC2=CC=CC=C12 CNP0342015.0 [0,0,0,1,0,1|1,0,1]=4 147 B15R2.6 CC(=O)CCC1=CNC2=CC=CC=C12 CNP0368025.0 [0,0,0,1,0,1|1,0,0]=3 148 B15R2.6 CC(=O)OCC1C=CC2=CC=CC=C12 CNP0489008.0 [0,0,0,1,0,1|0,0,0]=2 149 B15R2.6 NC(=O)CCC1=CNC2=CC=CC=C12 CNP0137051.0 [0,0,0,1,0,1|2,0,0]=4 150 B15R2.6 O=C(O)CCC1=CNC2=CC=CC=C12 CNP0213541.0 [0,0,0,1,0,1|2,0,0]=4 151 B15R2.83023 CC(=O)NC1=CC=C2C1=CC=CC=C2 CNP0029340.0 [0,0,0,1,0,1|1,0,1]=4 152 B15R2.1668 CC(=O)OC1=CC=C2C=CC=CC2=C1 CNP0193755.0 [0,1,0,1,0,0|0,0,1]=3 153 B15R2.59 CC(=O)N1CCC(=N1)C2=CC=CC=C2 CNP0040779.0 [0,1,0,1,0,0|1,0,1]=4 154 B15R2.612 CC(=CC1OC(O1)C)C2=CC=CC=C2 CNP0344407.0 [0,1,0,1,0,0|0,0,2]=4 155 B15R2.53147 CC(=O)OC1=C[C@@H](C2=CC=CC=C12)C CNP0023443.1 [0,1,0,1,0,0|0,0,2]=4 156 B15R2.53147 CC(=O)OC1=C[C@H](C2=CC=CC=C12)C CNP0023443.2 [0,1,0,1,0,0|0,0,2]=4 157 B15R2.53147 CC(=O)O[C@@H]1C=C(C2=CC=CC=C12)C CNP0151301.1 [0,1,0,1,0,0|0,0,0]=2 158 B15R2.53147 CC(=O)O[C@@H]1OC(=O)C2=CC=CC=C12 CNP0051044.1 [0,1,0,1,0,0|1,0,0]=3 159 B15R2.53147 CC(=O)O[C@H]1C=C(C2=CC=CC=C12)C CNP0151301.2 [0,1,0,1,0,0|0,0,0]=2 160 B15R2.53147 CC(=O)O[C@H]1OC(=O)C2=CC=CC=C12 CNP0051044.2 [0,1,0,1,0,0|1,0,0]=3 161 B15R2.33 CC1=C(NC(=O)CC1)C2=CC=CC=C2 CNP0358281.0 [0,1,0,1,0,0|2,0,0]=4 162 B15R2.9410 CC(=O)OC1=CNC2=CC=C(C=C12)Br CNP0138013.0 [0,1,0,1,0,0|1,0,1]=4 163 B15R2.32 CC1=C(SCCC1=O)C2=CC=CC=C2 CNP0193905.0 [0,1,0,1,0,0|2,0,0]=4 164 B15R2.32 CN1C(=CC=CC1=O)C2=CC=CC=C2 CNP0023431.0 [0,1,0,1,0,0|1,0,1]=4 165 B15R2.27 CC1=CC(=CC(=O)O1)C2=CC=CC=C2 CNP0318618.0 [0,1,0,1,0,0|0,0,2]=4 166 B15R2.27 CC1=C[C@@H](CC(=O)O1)C2=CC=CC=C2 CNP0246599.2 [0,1,0,1,0,0|0,0,2]=4 167 B15R2.27 CC1=C[C@H](CC(=O)O1)C2=CC=CC=C2 CNP0246599.1 [0,1,0,1,0,0|0,0,2]=4 168 B15R2.325 CC1=NC(=CC2=CC=CC=C2)C(=O)O1 CNP0284552.0 [0,1,0,1,0,0|1,0,1]=4 169 B15R3.15114 O=C1CC2=CC=C3C=CC=CC3=C12 CNP0058394.0 [0,0,0,2,0,0|1,0,1]=4 170 B11R1.91 CC(=CCC1=CC=CC=C1)C CNP0096741.0 [0,0,0,0,2,0|1,0,1]=4 171 B11R1.91 CC(=O)C=CC1=CC=CC=C1 CNP0331521.0 [0,0,0,0,2,0|0,0,0]=2 172 B11R1.91 CC(=O)CCC1=CC=CC=C1 CNP0182353.0 [0,0,0,0,2,0|0,0,1]=3 173 B11R1.91 CC(=O)OCC1=CC=CC=C1 CNP0361944.0 [0,0,0,0,2,0|0,0,0]=2 174 B11R1.91 CC(=O)ONC1=CC=CC=C1 CNP0256903.0 [0,0,0,0,2,0|1,0,0]=3 175 B11R1.91 CC(O)C=CC1=CC=CC=C1 CNP0091112.0 [0,0,0,0,2,0|0,0,2]=4 176 B11R1.91 NC(=O)C=CC1=CC=CC=C1 CNP0277735.0 [0,0,0,0,2,0|1,0,0]=3 177 B11R1.91 NC(=O)CCC1=CC=CC=C1 CNP0190126.0 [0,0,0,0,2,0|1,0,1]=4 178 B11R1.91 NC(=O)COC1=CC=CC=C1 CNP0071085.0 [0,0,0,0,2,0|2,0,0]=4 179 B11R1.91 NC(=O)NCC1=CC=CC=C1 CNP0071045.0 [0,0,0,0,2,0|2,0,0]=4 180 B11R1.91 O=C(Cl)C=CC1=CC=CC=C1 CNP0314597.0 [0,0,0,0,2,0|1,0,0]=3 181 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 CNP0330120.0 [0,0,0,0,2,0|1,0,1]=4 182 B11R1.91 O=C(O)C=CC1=CC=CC=C1 CNP0390407.0 [0,0,0,0,2,0|1,0,0]=3 183 B11R1.91 O=C(O)C=CC1=CC=CN=C1 CNP0471683.0 [0,0,0,0,2,0|2,0,0]=4 184 B11R1.91 O=C(O)CCC1=CC=CC=C1 CNP0298094.0 [0,0,0,0,2,0|1,0,1]=4 185 B11R1.91 O=C(O)CNC1=CC=CC=C1 CNP0458877.0 [0,0,0,0,2,0|2,0,0]=4 186 B11R1.91 O=C(O)COC1=CC=CC=C1 CNP0231951.0 [0,0,0,0,2,0|2,0,0]=4 187 B11R1.91 O=C(O)NCC1=CC=CC=C1 CNP0176098.0 [0,0,0,0,2,0|2,0,0]=4 188 B11R1.172 C=C(C)CC=CC1=COC=C1 CNP0238080.0 [0,0,0,0,2,0|2,0,0]=4