0 B10R1.11 CCCC(=O)C1=CC=CO1 CNP0102871.0 [0,0,0,0,0,0|0,0,0]=0 1 B10R1.11 CCCC(=O)C1=CC=CS1 CNP0318042.0 [0,0,0,0,0,0|0,1,0]=1 2 B10R1.11 CCOC(=O)C1=CC=CN1 CNP0153288.0 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.11 CCOC(=O)C1=CC=CO1 CNP0247126.0 [0,0,0,0,0,0|1,0,0]=1 4 B10R1.11 CCOC(=O)C1=COC=C1 CNP0228529.0 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.11 CCOC(=O)C1=CSN=N1 CNP0040312.0 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.11 CCOC(=O)C1=NNC=C1 CNP0017794.0 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.11 CCOC(=O)N1C=CN=C1 CNP0182750.0 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.11 O=CNC(=O)C1=CC=CN1 CNP0189867.0 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.11 CCC(=O)C1=CC=CN1 CNP0311419.0 [1,0,0,0,0,0|1,0,0]=2 10 B9R1.11 CCC(=O)C1=CC=CO1 CNP0230679.0 [1,0,0,0,0,0|0,0,0]=1 11 B9R1.11 CCC(=O)C1=CC=CS1 CNP0274968.0 [1,0,0,0,0,0|0,1,0]=2 12 B9R1.11 CCC(=O)C1=NC=CS1 CNP0135536.0 [1,0,0,0,0,0|1,1,0]=3 13 B9R1.11 CCC(=O)N1C=CN=C1 CNP0053427.0 [1,0,0,0,0,0|3,0,0]=4 14 B9R1.11 COC(=O)C1=CC=CN1 CNP0239045.0 [1,0,0,0,0,0|2,0,0]=3 15 B9R1.11 COC(=O)C1=CC=CO1 CNP0272116.0 [1,0,0,0,0,0|1,0,0]=2 16 B9R1.11 COC(=O)C1=COC=C1 CNP0209204.0 [1,0,0,0,0,0|3,0,0]=4 17 B9R1.11 COC(=O)C1=NNC=C1 CNP0060175.0 [1,0,0,0,0,0|3,0,0]=4 18 B9R1.11 CSC(=O)C1=CC=CO1 CNP0002776.0 [1,0,0,0,0,0|1,0,0]=2 19 B9R1.11 NNC(=O)C1=CC=CO1 CNP0223197.0 [1,0,0,0,0,0|2,0,0]=3 20 B9R1.11 O=C(CO)C1=CC=CO1 CNP0312445.0 [1,0,0,0,0,0|1,0,0]=2 21 B9R1.11 OC[C@@H](O)C1=CC=CO1 CNP0178385.1 [1,0,0,0,0,0|1,0,2]=4 22 B9R1.12 CCCCC1=CC=CO1 CNP0200391.0 [1,0,0,0,0,0|0,0,1]=2 23 B9R1.12 CCCCC1=CN=CO1 CNP0072036.0 [1,0,0,0,0,0|1,0,1]=3 24 B9R1.12 CCCCC1=COC=N1 CNP0003922.0 [1,0,0,0,0,0|2,0,1]=4 25 B9R1.12 CCCCC1=CSC=C1 CNP0227765.0 [1,0,0,0,0,0|2,0,1]=4 26 B9R1.12 CCCCN1C=CC=C1 CNP0209337.0 [1,0,0,0,0,0|2,0,1]=4 27 B9R1.12 CCOCC1=CC=CO1 CNP0002487.0 [1,0,0,0,0,0|1,0,1]=3 28 B9R1.12 CCSCC1=CC=CO1 CNP0025241.0 [1,0,0,0,0,0|1,0,1]=3 29 B9R1.12 CSSCC1=CC=CO1 CNP0002883.0 [1,0,0,0,0,0|2,0,1]=4 30 B9R1.12 O=CC=CC1=CC=CO1 CNP0003159.0 [1,0,0,0,0,0|1,0,2]=4 31 B11R1.15 CCOC(=O)C1=CC(=CN1)C CNP0301824.0 [0,1,0,0,0,0|2,0,0]=3 32 B11R1.15 CCOC(=O)C1=CNC(=O)N1 CNP0282738.0 [0,1,0,0,0,0|3,0,0]=4 33 B11R1.15 CCOC(=O)C1=CSC(=N1)C CNP0046767.0 [0,1,0,0,0,0|3,0,0]=4 34 B11R1.15 CCOC(=O)C1=NC(=O)N=C1 CNP0041998.0 [0,1,0,0,0,0|3,0,0]=4 35 B11R1.15 CCOC(=O)C1=NOC(=C1)C CNP0240524.0 [0,1,0,0,0,0|3,0,0]=4 36 B11R1.29 C=CCOC(=O)C1=CC=CO1 CNP0002876.0 [0,1,0,0,0,0|0,0,2]=3 37 B11R1.29 CCCCC(=O)C1=CC=CO1 CNP0002605.0 [0,1,0,0,0,0|0,0,0]=1 38 B11R1.29 CCCOC(=O)C1=CC=CO1 CNP0083141.0 [0,1,0,0,0,0|0,0,0]=1 39 B11R1.29 COCNC(=O)C1=CC=CN1 CNP0458701.0 [0,1,0,0,0,0|2,0,0]=3 40 B11R1.31 CCC(=O)C(=O)C1=CC=CN1 CNP0132557.0 [0,1,0,0,0,0|1,0,1]=3 41 B11R1.31 CCC(=O)C(=O)C1=CC=CO1 CNP0113129.0 [0,1,0,0,0,0|0,0,1]=2 42 B11R1.77 CC(=O)CC(=O)C1=CC=CO1 CNP0334244.0 [0,1,0,0,0,0|0,0,1]=2 43 B9R0.5 CC=CC=CC(=O)OCC CNP0002481.0 [0,0,1,0,0,0|2,0,0]=3 44 B9R0.5 CC=CCCC(=O)CCC CNP0280412.0 [0,0,1,0,0,0|1,0,2]=4 45 B11R2.2 C1=C(CCC1)C2=CC=CO2 CNP0085898.0 [0,0,0,1,0,0|1,0,0]=2 46 B11R2.2 C1=COC(=C1)C2=NCCC2 CNP0401428.0 [0,0,0,1,0,0|1,0,0]=2 47 B11R2.2 C1=COC(=C1)C2CCCN2 CNP0261874.0 [0,0,0,1,0,0|1,0,1]=3 48 B11R2.106 O=C1CCCC2=C1CCC2 CNP0190267.0 [0,0,0,1,0,0|1,0,2]=4 49 B11R2.106 O=C1CCCC2C1=CCC2 CNP0500543.0 [0,0,0,1,0,0|1,0,2]=4 50 B11R2.106 O=C1CCSC2=C1SC=C2 CNP0047930.0 [0,0,0,1,0,0|1,1,0]=3 51 B11R1.16 CCCC(=O)C1=CC=CC=C1 CNP0079774.0 [0,0,0,0,0,1|1,0,0]=2 52 B11R1.16 CCCC(=S)C1=CC=CC=C1 CNP0467884.0 [0,0,0,0,0,1|1,1,0]=3 53 B11R1.16 CCOC(=O)C1=CC=CC=C1 CNP0341969.0 [0,0,0,0,0,1|2,0,0]=3 54 B11R1.16 CCOC(=O)C1=CC=CC=N1 CNP0298485.0 [0,0,0,0,0,1|2,0,0]=3 55 B11R1.16 CCOC(=O)C1=CC=CN=C1 CNP0104896.0 [0,0,0,0,0,1|2,0,0]=3 56 B11R1.16 CNCC(=O)C1=CC=CC=C1 CNP0199751.0 [0,0,0,0,0,1|2,0,0]=3 57 B11R1.16 COCC(=O)C1=CC=CC=C1 CNP0505302.0 [0,0,0,0,0,1|2,0,0]=3 58 B11R1.16 N#CCC(=O)C1=CC=CC=C1 CNP0039912.0 [0,0,0,0,0,1|2,0,1]=4 59 B11R1.16 O=C(NCO)C1=CC=CN=C1 CNP0259715.0 [0,0,0,0,0,1|3,0,0]=4 60 B11R1.30 CCOC(=O)CC1=CNC=N1 CNP0326437.0 [0,0,0,0,0,1|3,0,0]=4 61 B8R0.1 C=CCOC(=O)CCC CNP0002468.0 [1,0,1,0,0,0|0,0,1]=3 62 B8R0.4 CCCC=CC=CC=O CNP0226923.0 [1,0,1,0,0,0|0,0,1]=3 63 B8R0.4 CCCC=CC=CCO CNP0175481.0 [1,0,1,0,0,0|0,0,1]=3 64 B8R0.6 CC=CC=CC(=O)OC CNP0320063.0 [1,0,1,0,0,0|2,0,0]=4 65 B8R0.11 C=CC(=CCCC)C=O CNP0610785.0 [1,0,1,0,0,0|2,0,0]=4 66 B8R1.7 CC(=C1C=CC=C1)C CNP0510887.0 [2,0,0,0,0,0|2,0,0]=4 67 B8R1.7 CC(=O)C1=CC=CN1 CNP0200282.0 [2,0,0,0,0,0|1,0,0]=3 68 B8R1.7 CC(=O)C1=CC=CO1 CNP0350272.0 [2,0,0,0,0,0|0,0,0]=2 69 B8R1.7 CC(=O)C1=CC=CS1 CNP0328607.0 [2,0,0,0,0,0|0,1,0]=3 70 B8R1.7 CC(=O)C1=CSC=C1 CNP0011841.0 [2,0,0,0,0,0|2,0,0]=4 71 B8R1.7 CC(=O)C1=NC=CO1 CNP0002710.0 [2,0,0,0,0,0|1,0,0]=3 72 B8R1.7 CC(=O)C1=NC=CS1 CNP0309193.0 [2,0,0,0,0,0|1,1,0]=4 73 B8R1.7 CC(=O)C1CC=CO1 CNP0077183.0 [2,0,0,0,0,0|0,0,2]=4 74 B8R1.7 CC(=O)N1C=CC=C1 CNP0238192.0 [2,0,0,0,0,0|2,0,0]=4 75 B8R1.7 CC(C)C1=CC=CO1 CNP0319919.0 [2,0,0,0,0,0|1,0,1]=4 76 B8R1.7 CC(O)C1=CC=CO1 CNP0421357.0 [2,0,0,0,0,0|0,0,2]=4 77 B8R1.7 CC(S)C1=CC=CO1 CNP0002637.0 [2,0,0,0,0,0|0,1,1]=4 78 B8R1.7 NC(=O)C1=CC=CN1 CNP0365861.0 [2,0,0,0,0,0|2,0,0]=4 79 B8R1.7 NC(=O)C1=CC=CO1 CNP0268469.0 [2,0,0,0,0,0|1,0,0]=3 80 B8R1.7 O=C(O)C1=CC=CN1 CNP0331002.0 [2,0,0,0,0,0|2,0,0]=4 81 B8R1.7 O=C(O)C1=CC=CO1 CNP0264313.0 [2,0,0,0,0,0|1,0,0]=3 82 B8R1.8 C=CCC1=CC=CO1 CNP0320251.0 [2,0,0,0,0,0|0,0,2]=4 83 B8R1.8 CC=CC1=CC=CO1 CNP0546810.0 [2,0,0,0,0,0|0,0,1]=3 84 B8R1.8 CCCC1=CC=CO1 CNP0301120.0 [2,0,0,0,0,0|0,0,0]=2 85 B8R1.8 CCCC1=CC=CS1 CNP0076464.0 [2,0,0,0,0,0|0,1,0]=3 86 B8R1.8 CCCN1C=CC=C1 CNP0269776.0 [2,0,0,0,0,0|2,0,0]=4 87 B8R1.8 COCC1=CC=CO1 CNP0352777.0 [2,0,0,0,0,0|1,0,0]=3 88 B8R1.8 CSCC1=CC=CO1 CNP0210832.0 [2,0,0,0,0,0|1,0,0]=3 89 B8R1.8 O=CCC1=CC=CO1 CNP0576959.0 [2,0,0,0,0,0|1,0,1]=4 90 B8R1.8 OCCC1=CC=CS1 CNP0577450.0 [2,0,0,0,0,0|1,1,0]=4 91 B10R1.14 CCC(=O)C1=CC=C(S1)C CNP0030242.0 [1,1,0,0,0,0|0,1,0]=3 92 B10R1.14 CCC(=O)C1=NC(=CS1)C CNP0322098.0 [1,1,0,0,0,0|1,1,0]=4 93 B10R1.14 COC(=O)C1=CC(=CN1)Br CNP0239770.0 [1,1,0,0,0,0|2,0,0]=4 94 B10R1.14 COC(=O)C1=CC(=CN1)C CNP0393568.0 [1,1,0,0,0,0|2,0,0]=4 95 B10R1.14 COC(=O)C1=CC=C(N1)Br CNP0436786.0 [1,1,0,0,0,0|2,0,0]=4 96 B10R1.23 CC(=O)C(=O)C1=CC=CO1 CNP0137174.0 [1,1,0,0,0,0|0,0,1]=3 97 B10R1.23 CC(=O)C(=O)C1=CC=CS1 CNP0002573.0 [1,1,0,0,0,0|0,1,1]=4 98 B10R1.23 CC(C)C(=O)C1=CC=CO1 CNP0536429.0 [1,1,0,0,0,0|0,0,0]=2 99 B10R1.23 O=C(C1=CC=CO1)C(O)O CNP0147414.0 [1,1,0,0,0,0|1,0,0]=3 100 B10R1.149 CCC(=O)C1=CC=CN1C CNP0151134.0 [1,1,0,0,0,0|1,0,0]=3 101 B10R1.149 COC(=O)C1=C(C=CO1)C CNP0325643.0 [1,1,0,0,0,0|1,0,0]=3 102 B10R1.16 CCCCC1=CC(=CO1)C CNP0574167.0 [1,1,0,0,0,0|0,0,1]=3 103 B10R1.21 CCC=CCC1=CC=CO1 CNP0453749.0 [1,1,0,0,0,0|0,0,1]=3 104 B10R1.21 CCCC=CC1=CC=CO1 CNP0062587.0 [1,1,0,0,0,0|0,0,0]=2 105 B10R1.21 CCCCCC1=CC=CO1 CNP0210535.0 [1,1,0,0,0,0|0,0,1]=3 106 B10R1.21 CCCCCC1=CC=CS1 CNP0094840.0 [1,1,0,0,0,0|0,1,1]=4 107 B10R1.21 CCCCCC1=CN=CO1 CNP0197497.0 [1,1,0,0,0,0|1,0,1]=4 108 B10R1.21 CCCCCC1=NC=CO1 CNP0420572.0 [1,1,0,0,0,0|1,0,1]=4 109 B10R1.27 CCC(=O)CC1=CC=CO1 CNP0611998.0 [1,1,0,0,0,0|0,0,2]=4 110 B10R1.66 CC(=O)C=CC1=CC=CO1 CNP0253881.0 [1,1,0,0,0,0|0,0,2]=4 111 B10R1.66 CC(C)SCC1=CC=CO1 CNP0002931.0 [1,1,0,0,0,0|1,0,1]=4 112 B12R1.16 CCCC(=O)C1=CC=C(C=C1)O CNP0055892.0 [0,1,0,0,0,1|1,0,0]=3 113 B12R1.16 CCOC(=O)C1=CC=C(C=C1)C CNP0077252.0 [0,1,0,0,0,1|2,0,0]=4 114 B12R1.16 CCOC(=O)C1=CC=C(C=C1)N CNP0225761.0 [0,1,0,0,0,1|2,0,0]=4 115 B12R1.16 CCOC(=O)C1=CC=C(C=C1)O CNP0179290.0 [0,1,0,0,0,1|2,0,0]=4 116 B12R1.16 COCC(=O)C1=CC=C(C=C1)O CNP0289032.0 [0,1,0,0,0,1|2,0,0]=4 117 B12R1.16 O=C(CCO)C1=CC=C(C=C1)O CNP0268127.0 [0,1,0,0,0,1|2,0,0]=4 118 B12R1.16 [2H]C1=CC=C(C=C1)C(=O)OCC CNP0538660.0 [0,1,0,0,0,1|2,0,0]=4 119 B12R1.17 CCOC(=O)C1=CC=CC(=C1)Br CNP0225819.0 [0,1,0,0,0,1|2,0,0]=4 120 B12R1.17 CCOC(=O)C1=CC=CC(=C1)C CNP0130932.0 [0,1,0,0,0,1|2,0,0]=4 121 B12R1.17 CCOC(=O)C1=CC=CC(=C1)N CNP0289316.0 [0,1,0,0,0,1|2,0,0]=4 122 B12R1.17 CCOC(=O)C1=CC=CC(=C1)O CNP0114890.0 [0,1,0,0,0,1|2,0,0]=4 123 B12R1.30 CCC=CC(=O)C1=CC=CC=C1 CNP0126866.0 [0,1,0,0,0,1|1,0,1]=4 124 B12R1.30 CCCCC(=O)C1=CC=CC=C1 CNP0346038.0 [0,1,0,0,0,1|1,0,0]=3 125 B12R1.30 CCCN=C(C)C1=CC=CC=C1 CNP0446142.0 [0,1,0,0,0,1|2,0,0]=4 126 B12R1.30 CCCNC(=O)C1=CC=CC=C1 CNP0268362.0 [0,1,0,0,0,1|1,0,0]=3 127 B12R1.30 CCCOC(=O)C1=CC=CC=C1 CNP0261819.0 [0,1,0,0,0,1|1,0,0]=3 128 B12R1.30 NCCCC(=O)C1=CC=CC=N1 CNP0319250.0 [0,1,0,0,0,1|1,0,0]=3 129 B12R1.30 NCCNC(=O)C1=CC=CC=N1 CNP0456305.0 [0,1,0,0,0,1|2,0,0]=4 130 B12R1.30 O=C(CCCCl)C1=CC=CC=C1 CNP0513261.0 [0,1,0,0,0,1|1,0,0]=3 131 B12R1.30 O=C(NCCO)C1=CC=CC=C1 CNP0563015.0 [0,1,0,0,0,1|2,0,0]=4 132 B12R1.30 O=C(OCCO)C1=CC=CC=C1 CNP0577678.0 [0,1,0,0,0,1|2,0,0]=4 133 B12R1.34 COC(O)C(=O)C1=CC=CC=C1 CNP0536152.0 [0,1,0,0,0,1|2,0,0]=4 134 B12R1.34 NC[C@@H](N)C(=O)C1=CC=CC=C1 CNP0340732.2 [0,1,0,0,0,1|2,0,0]=4 135 B12R1.34 NC[C@H](N)C(=O)C1=CC=CC=C1 CNP0340732.1 [0,1,0,0,0,1|2,0,0]=4 136 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 CNP0326732.0 [0,1,0,0,0,1|1,0,1]=4 137 B12R1.107 CC(C)OC(=O)C1=CC=CC=C1 CNP0003326.0 [0,1,0,0,0,1|2,0,0]=4 138 B12R1.107 CN(C)CC(=O)C1=CC=CC=C1 CNP0183220.0 [0,1,0,0,0,1|2,0,0]=4 139 B12R1.308 CCOC(=O)C1=CC=CC=C1N CNP0071170.0 [0,1,0,0,0,1|2,0,0]=4 140 B12R1.308 CCOC(=O)C1=CC=CC=C1O CNP0169358.0 [0,1,0,0,0,1|2,0,0]=4 141 B12R1.308 CCOC(=O)C1=CN=CC=C1C CNP0414274.0 [0,1,0,0,0,1|2,0,0]=4 142 B12R1.308 CCOC(=O)C1=CN=CC=C1N CNP0188449.0 [0,1,0,0,0,1|2,0,0]=4 143 B12R1.308 NCCC(=O)C1=CC=CC=C1N CNP0017946.0 [0,1,0,0,0,1|2,0,0]=4 144 B12R1.31 CCOC(=O)C[C@H]1C=CC(=O)O1 CNP0177712.1 [0,1,0,0,0,1|1,0,1]=4 145 B12R1.36 CCOCC(OC)C1=CC=CO1 CNP0577140.0 [0,2,0,0,0,0|0,0,2]=4 146 B12R1.29 COCNC(=O)C1=CC(=CN1)Br CNP0273248.0 [0,2,0,0,0,0|2,0,0]=4 147 B12R1.29 COCNC(=O)C1=CC=C(N1)Br CNP0325253.0 [0,2,0,0,0,0|2,0,0]=4 148 B12R1.103 CC1=CC(=CO1)C(=O)CC(C)C CNP0358077.0 [0,2,0,0,0,0|2,0,0]=4 149 B12R1.312 CCOC(=O)C1=CC=C(N1)C=O CNP0157838.0 [0,2,0,0,0,0|2,0,0]=4 150 B12R1.314 CCOC(=O)C1=CC(=C(N1)Br)Br CNP0129882.0 [0,2,0,0,0,0|2,0,0]=4 151 B12R1.314 CCOC(=O)C1=CC(=C(O1)Br)Br CNP0167770.0 [0,2,0,0,0,0|1,0,0]=3 152 B12R1.1579 CCOC(=O)C1=C(C(=CN1)Br)Br CNP0429944.0 [0,2,0,0,0,0|2,0,0]=4 153 B12R1.15 CCC(=O)CC(=O)C1=CC=CN1 CNP0583528.0 [0,2,0,0,0,0|1,0,0]=3 154 B12R1.35 CCCCCC(=O)C1=CC=CO1 CNP0086014.0 [0,2,0,0,0,0|0,0,0]=2 155 B12R1.35 CCSCCC(=O)C1=CC=CS1 CNP0369340.0 [0,2,0,0,0,0|0,1,0]=3 156 B12R1.54 CC(=O)CCC(=O)C1=COC=C1 CNP0262889.0 [0,2,0,0,0,0|2,0,0]=4 157 B12R1.54 CC(C)CCC(=O)C1=COC=C1 CNP0108057.0 [0,2,0,0,0,0|2,0,0]=4 158 B12R1.54 C[C@H](O)CCC(=O)C1=COC=C1 CNP0135487.1 [0,2,0,0,0,0|2,0,0]=4 159 B12R1.54 O=C(O)CNC(=O)C1=CC=CO1 CNP0131505.0 [0,2,0,0,0,0|1,0,1]=4 160 B12R1.144 C=C(C)CC(=O)C1=C(C=CO1)C CNP0566600.0 [0,2,0,0,0,0|0,0,1]=3 161 B12R1.144 CC(=CC(=O)C1=C(C=CO1)C)C CNP0158300.0 [0,2,0,0,0,0|0,0,2]=4 162 B12R1.144 CC1=C(OC=C1)C(=O)CC(C)C CNP0309243.0 [0,2,0,0,0,0|0,0,0]=2 163 B12R1.265 CC(C)(O)CC(=O)C1=COC=C1 CNP0395272.0 [0,2,0,0,0,0|2,0,0]=4 164 B10R1.10 CC=CC1=CC(=O)OCC1 CNP0430897.0 [0,0,1,1,0,0|2,0,0]=4 165 B10R1.10 CCCC1=CC=CC(=C1)C CNP0267712.0 [0,0,1,1,0,0|2,0,0]=4 166 B10R1.10 CCCC1=CC=CC(=C1)O CNP0174862.0 [0,0,1,1,0,0|1,0,0]=3 167 B10R1.10 CCCC1=CC=CC(=O)O1 CNP0334569.0 [0,0,1,1,0,0|0,0,2]=4 168 B10R1.10 CCOC1=CC=CC(=C1)O CNP0611695.0 [0,0,1,1,0,0|2,0,0]=4 169 B10R1.10 NCCC1=CC=CC(=C1)O CNP0290010.0 [0,0,1,1,0,0|2,0,0]=4 170 B10R1.10 OCCC1=CC=CC(=C1)O CNP0140785.0 [0,0,1,1,0,0|2,0,0]=4 171 B10R1.130 C/C=C/C1=CC(=O)C[C@@H]1O CNP0356439.1 [0,0,1,1,0,0|2,0,0]=4 172 B10R1.2 CCC1=CC=CC(=C1O)O CNP0002512.0 [0,0,1,1,0,0|0,0,2]=4 173 B10R1.4 CCCC1=CC=CC=C1C CNP0143289.0 [0,0,1,1,0,0|2,0,0]=4 174 B10R1.4 CCCC1=CC=CC=C1N CNP0601076.0 [0,0,1,1,0,0|2,0,0]=4 175 B10R1.4 CCCC1=CC=CC=C1O CNP0092348.0 [0,0,1,1,0,0|1,0,0]=3 176 B10R1.4 NCCC1=CC=CC=C1O CNP0611654.0 [0,0,1,1,0,0|2,0,0]=4 177 B10R1.4 OCCC1=CC=CC=C1O CNP0110289.0 [0,0,1,1,0,0|2,0,0]=4 178 B10R1.256 CCC1=C(C(=O)C[C@@H]1C)O CNP0105899.1 [0,0,1,1,0,0|0,0,2]=4 179 B10R2.32 O=C1CCC2=C1C=CS2 CNP0047284.0 [1,0,0,1,0,0|2,0,0]=4 180 B12R2.2 C1=CC=C(C=C1)C2=NCCC2 CNP0036375.0 [0,0,0,1,0,1|2,0,0]=4 181 B12R2.2 C1=CC=C(N=C1)C2=NCCC2 CNP0240806.0 [0,0,0,1,0,1|2,0,0]=4 182 B12R2.2 C1=CN=CC(=C1)C2=NCCC2 CNP0187035.0 [0,0,0,1,0,1|2,0,0]=4 183 B12R2.1081 O=C1CCCC2=CC=CC=C12 CNP0265726.0 [0,0,0,1,0,1|1,0,0]=3 184 B12R2.1081 O=C1CCNC2=CC=CC=C12 CNP0329955.0 [0,0,0,1,0,1|2,0,0]=4 185 B12R2.1081 O=C1CCOC2=CC=CC=C12 CNP0350030.0 [0,0,0,1,0,1|2,0,0]=4 186 B12R2.1081 O=C1COCC2=CC=CC=C12 CNP0581106.0 [0,0,0,1,0,1|2,0,0]=4 187 B12R2.1081 O=C1NCCC2=CC=CC=C12 CNP0436374.0 [0,0,0,1,0,1|2,0,0]=4 188 B12R2.1081 O=C1OCCC2=CC=CC=C12 CNP0492778.0 [0,0,0,1,0,1|2,0,0]=4 189 B12R2.1081 O=C1OCCC2=CC=NC=C12 CNP0118387.0 [0,0,0,1,0,1|2,0,0]=4 190 B12R2.2028 C[C@@H]1CC(=O)C2=CC=CC=C12 CNP0276144.2 [0,0,0,1,0,1|1,0,0]=3 191 B12R2.2028 C[C@@H]1CC(=O)C2=CC=NC=C12 CNP0213370.1 [0,0,0,1,0,1|1,0,0]=3 192 B12R2.2028 C[C@H]1CC(=O)C2=CC=CC=C12 CNP0276144.1 [0,0,0,1,0,1|1,0,0]=3 193 B12R2.2028 C[C@H]1CC(=O)C2=CC=NC=C12 CNP0213370.2 [0,0,0,1,0,1|1,0,0]=3 194 B12R2.2075 O=C(C1=CC=CC=C1)C2CC2 CNP0172198.0 [0,0,0,1,0,1|1,0,0]=3 195 B12R2.98 C(=C1CCNC1)C2=CC=CO2 CNP0002557.0 [0,0,0,1,0,1|2,0,0]=4 196 B12R2.98 C1=COC(=C1)CN2CCCC2 CNP0134055.0 [0,0,0,1,0,1|2,0,0]=4 197 B12R2.98 C1=NCCC1=CC2=CC=CO2 CNP0002568.0 [0,0,0,1,0,1|2,0,0]=4 198 B12R2.6 CC1=CC=C(O1)C2=NCCC2 CNP0002554.0 [0,1,0,1,0,0|1,0,0]=3 199 B12R2.6 CC1=CC=C(O1)C2CCCN2 CNP0325112.0 [0,1,0,1,0,0|1,0,1]=4 200 B12R2.196 CC1=CN=C2N1CCCC2=O CNP0577075.0 [0,1,0,1,0,0|2,0,0]=4 201 B12R2.196 CN1C=CC2=C1CCCC2=O CNP0047001.0 [0,1,0,1,0,0|2,0,0]=4 202 B12R2.221 O=C1NC[C@@H](N2C1=CC=C2)O CNP0430739.1 [0,1,0,1,0,0|2,0,0]=4 203 B12R2.221 O=C1NC[C@H](N2C1=CC=C2)O CNP0430739.2 [0,1,0,1,0,0|2,0,0]=4 204 B12R2.82 O=C1C2=C(CC[C@H]1O)NC=C2 CNP0340577.1 [0,1,0,1,0,0|2,0,0]=4 205 B10R1.15 CCC(=O)C1=CC=CC=C1 CNP0320895.0 [1,0,0,0,0,1|1,0,0]=3 206 B10R1.15 CCC(=O)C1=CC=CN=C1 CNP0114571.0 [1,0,0,0,0,1|1,0,0]=3 207 B10R1.15 CNC(=O)C1=CC=CC=C1 CNP0491778.0 [1,0,0,0,0,1|2,0,0]=4 208 B10R1.15 CNC(=O)C1=CC=CN=C1 CNP0108098.0 [1,0,0,0,0,1|2,0,0]=4 209 B10R1.15 COC(=O)C1=CC=CC=C1 CNP0233777.0 [1,0,0,0,0,1|2,0,0]=4 210 B10R1.15 COC(=O)C1=CC=CC=N1 CNP0214824.0 [1,0,0,0,0,1|2,0,0]=4 211 B10R1.15 COC(=O)C1=CC=CN=C1 CNP0284518.0 [1,0,0,0,0,1|2,0,0]=4 212 B10R1.15 COC(=O)C1=CN=CC=N1 CNP0080083.0 [1,0,0,0,0,1|2,0,0]=4 213 B10R1.15 CSC(=O)C1=CC=CC=C1 CNP0351124.0 [1,0,0,0,0,1|2,0,0]=4 214 B10R1.15 NCC(=O)C1=CC=CC=C1 CNP0357301.0 [1,0,0,0,0,1|2,0,0]=4 215 B10R1.15 O=C(CBr)C1=CC=CC=C1 CNP0204252.0 [1,0,0,0,0,1|2,0,0]=4 216 B10R1.15 O=C(CO)C1=CC=CC=C1 CNP0334071.0 [1,0,0,0,0,1|2,0,0]=4 217 B10R1.17 CCC=CC1=CC=CC=C1 CNP0551806.0 [1,0,0,0,0,1|1,0,1]=4 218 B10R1.17 CCCCC1=CC=CC=C1 CNP0386206.0 [1,0,0,0,0,1|1,0,1]=4 219 B10R1.17 CCCCC1=CC=CC=N1 CNP0514924.0 [1,0,0,0,0,1|1,0,1]=4 220 B10R1.17 CCCCC1=CC=CN=C1 CNP0003155.0 [1,0,0,0,0,1|1,0,1]=4 221 B10R1.17 CCCCC1=CC=NC=C1 CNP0498690.0 [1,0,0,0,0,1|1,0,1]=4 222 B10R1.17 CCCSC1=CC=NC=C1 CNP0522947.0 [1,0,0,0,0,1|2,0,0]=4 223 B12R1.32 CCCC(=O)CC1=CC=CC=C1 CNP0538882.0 [0,0,0,0,0,2|1,0,0]=3 224 B12R1.32 CCCC(=O)OC1=CC=CC=C1 CNP0002394.0 [0,0,0,0,0,2|1,0,0]=3 225 B12R1.32 CCNC(=O)CC1=CC=CC=C1 CNP0069475.0 [0,0,0,0,0,2|2,0,0]=4 226 B12R1.32 CCOC(=O)CC1=CC=CC=C1 CNP0112866.0 [0,0,0,0,0,2|2,0,0]=4 227 B12R1.32 CCOC(=O)NC1=CC=CC=C1 CNP0116883.0 [0,0,0,0,0,2|2,0,0]=4 228 B12R1.51 CC=CC(=O)OCC1=CC=CO1 CNP0506624.0 [0,0,0,0,0,2|0,0,2]=4 229 B12R1.51 CCCC(=O)OCC1=CC=CO1 CNP0002783.0 [0,0,0,0,0,2|0,0,0]=2 230 B12R1.51 CCOC(=O)C=CC1=CC=CO1 CNP0393898.0 [0,0,0,0,0,2|1,0,0]=3 231 B12R1.51 CCOC(=O)CCC1=CC=CO1 CNP0003158.0 [0,0,0,0,0,2|1,0,0]=3 232 B12R1.51 CCOC(=O)SCC1=CC=CO1 CNP0352515.0 [0,0,0,0,0,2|1,0,0]=3