0 B13R1.386 C=CCC1=CC=C(C(=C1)OC)OC CNP0137352.0 [0,0,0,0,0,0|0,0,0]=0 1 B13R1.386 CC=CC1=CC=C(C(=C1)OC)OC CNP0286991.0 [0,0,0,0,0,0|0,0,2]=2 2 B13R1.386 CCCC1=CC=C(C(=C1)OC)OC CNP0355885.0 [0,0,0,0,0,0|0,0,2]=2 3 B13R1.386 COC1=CC=C(C=C1OC)C=CO CNP0075049.0 [0,0,0,0,0,0|1,0,1]=2 4 B13R1.386 COC1=CC=C(C=C1OC)C=NO CNP0316088.0 [0,0,0,0,0,0|2,0,1]=3 5 B13R1.386 COC1=CC=C(C=C1OC)CC#N CNP0382012.0 [0,0,0,0,0,0|1,0,1]=2 6 B13R1.386 COC1=CC=C(C=C1OC)CC=O CNP0329009.0 [0,0,0,0,0,0|1,0,0]=1 7 B13R1.386 COC1=CC=C(C=C1OC)CCN CNP0332750.0 [0,0,0,0,0,0|1,0,1]=2 8 B13R1.386 COC1=CC=C(C=C1OC)CCO CNP0225714.0 [0,0,0,0,0,0|1,0,1]=2 9 B12R1.78 C=CC1=CC=C(C(=C1)OC)OC CNP0198714.0 [1,0,0,0,0,0|0,0,0]=1 10 B12R1.78 CCC1=CC=C(C(=C1)CC)CC CNP0612118.0 [1,0,0,0,0,0|2,0,1]=4 11 B12R1.78 CCC1=CC=C(C(=C1)OC)OC CNP0104859.0 [1,0,0,0,0,0|0,0,1]=2 12 B12R1.78 COC1=CC=C(C(=C1)OC)OC CNP0327068.0 [1,0,0,0,0,0|1,0,1]=3 13 B12R1.78 COC1=CC=C(C=C1C=O)C=O CNP0350650.0 [1,0,0,0,0,0|3,0,0]=4 14 B12R1.78 COC1=CC=C(C=C1OC)C=O CNP0216130.0 [1,0,0,0,0,0|1,0,0]=2 15 B12R1.78 COC1=CC=C(C=C1OC)CCl CNP0479327.0 [1,0,0,0,0,0|1,0,0]=2 16 B12R1.78 COC1=CC=C(C=C1OC)CO CNP0202849.0 [1,0,0,0,0,0|1,0,0]=2 17 B12R1.286 C=CCC1=CC(C(=O)C=C1)OC CNP0552207.0 [1,0,0,0,0,0|0,0,2]=3 18 B12R1.286 C=CCC1=CC=C(C(=C1)OC)O CNP0134292.0 [1,0,0,0,0,0|0,0,0]=1 19 B12R1.286 CC#CC1=CC=C(C(=C1)OC)O CNP0612156.0 [1,0,0,0,0,0|0,0,3]=4 20 B12R1.286 CC=CC1=CC=C(C(=C1)OC)O CNP0315621.0 [1,0,0,0,0,0|0,0,2]=3 21 B12R1.286 CCC1=CC(=CC=C1O)CCN CNP0541887.0 [1,0,0,0,0,0|2,0,1]=4 22 B12R1.286 CCC1=CC(=CC=C1O)NC=O CNP0272770.0 [1,0,0,0,0,0|3,0,0]=4 23 B12R1.286 CCCC1=CC=C(C(=C1)OC)O CNP0321309.0 [1,0,0,0,0,0|0,0,2]=3 24 B12R1.286 COC1=CC(=CC=C1O)C=CO CNP0237756.0 [1,0,0,0,0,0|1,0,1]=3 25 B12R1.286 COC1=CC(=CC=C1O)C=NO CNP0416336.0 [1,0,0,0,0,0|2,0,1]=4 26 B12R1.286 COC1=CC(=CC=C1O)CC=O CNP0262632.0 [1,0,0,0,0,0|1,0,0]=2 27 B12R1.286 COC1=CC(=CC=C1O)CCN CNP0308219.0 [1,0,0,0,0,0|1,0,1]=3 28 B12R1.286 COC1=CC(=CC=C1O)CCO CNP0423217.0 [1,0,0,0,0,0|1,0,1]=3 29 B12R1.286 COCC1=CC=C(C(=C1)OC)O CNP0276003.0 [1,0,0,0,0,0|1,0,1]=3 30 B12R1.288 C=CCC1=CC=C(C(=C1)O)OC CNP0181536.0 [1,0,0,0,0,0|0,0,0]=1 31 B12R1.288 CC=CC1=CC=C(C(=C1)O)OC CNP0299210.0 [1,0,0,0,0,0|0,0,2]=3 32 B12R1.288 CCCC1=CC=C(C(=C1)O)OC CNP0214353.0 [1,0,0,0,0,0|0,0,2]=3 33 B12R1.288 COC1=CC=C(C=C1Br)CC#N CNP0197630.0 [1,0,0,0,0,0|2,0,1]=4 34 B12R1.288 COC1=CC=C(C=C1O)CCN CNP0246187.0 [1,0,0,0,0,0|1,0,1]=3 35 B12R1.288 COC1=CC=C(C=C1O)CCO CNP0076040.0 [1,0,0,0,0,0|1,0,1]=3 36 B14R1.793 C=CC=CC1=CC=C(C(=C1)OC)OC CNP0228103.0 [0,1,0,0,0,0|0,0,1]=2 37 B14R1.793 CCC=CC1=CC=C(C(=C1)OC)OC CNP0242434.0 [0,1,0,0,0,0|0,0,2]=3 38 B14R1.793 CNCCC1=CC=C(C(=C1)OC)OC CNP0390626.0 [0,1,0,0,0,0|0,0,2]=3 39 B14R1.793 COC1=C(CC(C=C1)C=CC=O)OC CNP0170226.0 [0,1,0,0,0,0|0,0,3]=4 40 B14R1.793 COC1=C(C[C@H](C=C1)/C=C/C=O)OC CNP0170226.2 [0,1,0,0,0,0|0,0,3]=4 41 B14R1.793 COC1=C(C[C@H](C=C1)C=CC=O)OC CNP0170226.1 [0,1,0,0,0,0|0,0,3]=4 42 B14R1.793 COC1=CC=C(C=C1OC)C=CC=O CNP0207087.0 [0,1,0,0,0,0|0,0,1]=2 43 B14R1.793 COC1=CC=C(C=C1OC)C=CCO CNP0294314.0 [0,1,0,0,0,0|0,0,2]=3 44 B14R1.793 COC1=CC=C(C=C1OC)CC=NO CNP0350734.0 [0,1,0,0,0,0|1,0,0]=2 45 B14R1.793 COC1=CC=C(C=C1OC)CCC=O CNP0567000.0 [0,1,0,0,0,0|0,0,1]=2 46 B14R1.793 COC1=CC=C(C=C1OC)CCCN CNP0491555.0 [0,1,0,0,0,0|0,0,2]=3 47 B14R1.793 COC1=CC=C(C=C1OC)CCCO CNP0252849.0 [0,1,0,0,0,0|0,0,2]=3 48 B14R1.793 COC1=CC=C(C=C1OC)CN=C=S CNP0354112.0 [0,1,0,0,0,0|1,0,1]=3 49 B14R1.793 COC=CC1=CC=C(C(=C1)OC)OC CNP0222543.0 [0,1,0,0,0,0|0,0,2]=3 50 B14R1.1864 C=C[C@@H](O)C1=CC=C(C(=C1)OC)OC CNP0331683.2 [0,1,0,0,0,0|0,0,0]=1 51 B14R1.1864 C=C[C@H](O)C1=CC=C(C(=C1)OC)OC CNP0331683.1 [0,1,0,0,0,0|0,0,0]=1 52 B14R1.1864 CCC(=O)C1=CC=C(C(=C1)OC)OC CNP0236093.0 [0,1,0,0,0,0|0,0,3]=4 53 B14R1.1864 CNC(=O)C1=CC=C(C(=C1)OC)OC CNP0566333.0 [0,1,0,0,0,0|1,0,2]=4 54 B14R1.1864 COC(=O)C1=CC=C(C(=C1)OC)OC CNP0246255.0 [0,1,0,0,0,0|1,0,2]=4 55 B14R1.1864 COC1=CC=C(C=C1OC)C(=O)CO CNP0214329.0 [0,1,0,0,0,0|1,0,2]=4 56 B14R1.1864 COC1=CC=C(C=C1OC)[C@@H](O)CO CNP0225122.1 [0,1,0,0,0,0|1,0,1]=3 57 B14R1.3237 C=CCC1=CC(=C(C(=C1)OC)OC)O CNP0305147.0 [0,1,0,0,0,0|0,0,0]=1 58 B14R1.3237 CC=CC1=CC(=C(C(=C1)OC)OC)O CNP0120517.0 [0,1,0,0,0,0|0,0,2]=3 59 B14R1.3237 CCCC1=CC(=C(C(=C1)OC)OC)O CNP0485349.0 [0,1,0,0,0,0|0,0,2]=3 60 B14R1.3237 COC1=CC(=CC(=C1OC)O)CCN CNP0334029.0 [0,1,0,0,0,0|1,0,1]=3 61 B14R1.3651 COC1=CC=C(C=C1OC)CC(=O)C CNP0169719.0 [0,1,0,0,0,0|0,0,1]=2 62 B14R1.3651 COC1=CC=C(C=C1OC)CC(=O)O CNP0212917.0 [0,1,0,0,0,0|1,0,0]=2 63 B14R1.6787 CC=CC1=CC=C(C(=C1)OCC)OC CNP0002645.0 [0,1,0,0,0,0|0,0,2]=3 64 B14R1.6788 C=CCC1=CC=C(C(=C1)OC)OC=O CNP0002741.0 [0,1,0,0,0,0|0,0,1]=2 65 B14R1.6788 C=CCC1=CC=C(C(=C1)OC)OCC CNP0328868.0 [0,1,0,0,0,0|0,0,0]=1 66 B14R1.6788 CC=CC1=CC=C(C(=C1)OC)OC=O CNP0101693.0 [0,1,0,0,0,0|0,0,3]=4 67 B14R1.6788 CC=CC1=CC=C(C(=C1)OC)OCC CNP0296838.0 [0,1,0,0,0,0|0,0,2]=3 68 B14R1.14946 C=CCC1=CC(=C(C=C1O)OC)OC CNP0302606.0 [0,1,0,0,0,0|0,0,0]=1 69 B14R2.82 C=CC1=CC2=C(C=C1OC)OC=C2 CNP0330462.0 [0,0,0,1,0,0|2,0,1]=4 70 B14R2.82 CCC1=CC2=C(C=C1CC)OC=C2 CNP0247424.0 [0,0,0,1,0,0|3,0,0]=4 71 B14R2.82 COC1=CC2=C(C=C1OC)NC=C2 CNP0018454.0 [0,0,0,1,0,0|1,0,0]=2 72 B14R2.1238 COC1=CC=C2C=CNC2=C1OC CNP0017994.0 [0,0,0,1,0,0|1,0,1]=3 73 B14R2.11593 COC1=CC2=C(C=C1OC)C(=O)C2 CNP0052396.0 [0,0,0,1,0,0|1,0,0]=2 74 B11R1.37 CCC1=CC=C(C=C1CC)C CNP0183897.0 [2,0,0,0,0,0|2,0,0]=4 75 B11R1.37 COC1=C(CN(C=C1)C)OC CNP0265801.0 [2,0,0,0,0,0|1,0,1]=4 76 B11R1.37 COC1=CC=C(C=C1OC)C CNP0142648.0 [2,0,0,0,0,0|0,0,0]=2 77 B11R1.37 COC1=CC=C(C=C1OC)I CNP0034495.0 [2,0,0,0,0,0|1,0,0]=3 78 B11R1.37 COC1=CC=C(C=C1OC)O CNP0220201.0 [2,0,0,0,0,0|1,0,0]=3 79 B11R1.37 COC1=CCN(C=C1OC)C CNP0568941.0 [2,0,0,0,0,0|1,0,1]=4 80 B11R1.279 C=CC1=CC=C(C(=C1)O)OC CNP0342720.0 [2,0,0,0,0,0|0,0,0]=2 81 B11R1.279 CC1=CC(=CC=C1OP)C=O CNP0344714.0 [2,0,0,0,0,0|2,0,0]=4 82 B11R1.279 CCC1=CC=C(C(=C1)C)CC CNP0174684.0 [2,0,0,0,0,0|1,0,1]=4 83 B11R1.279 CCC1=CC=C(C(=C1)O)OC CNP0241141.0 [2,0,0,0,0,0|0,0,1]=3 84 B11R1.279 COC1=CC=C(C(=C1)C)OC CNP0235109.0 [2,0,0,0,0,0|1,0,1]=4 85 B11R1.279 COC1=CC=C(C(=C1)O)OC CNP0373176.0 [2,0,0,0,0,0|1,0,1]=4 86 B11R1.279 COC1=CC=C(C=C1Br)C=O CNP0185743.0 [2,0,0,0,0,0|2,0,0]=4 87 B11R1.279 COC1=CC=C(C=C1Br)CO CNP0163543.0 [2,0,0,0,0,0|2,0,0]=4 88 B11R1.279 COC1=CC=C(C=C1C)C=O CNP0009035.0 [2,0,0,0,0,0|1,0,0]=3 89 B11R1.279 COC1=CC=C(C=C1Cl)C=O CNP0247895.0 [2,0,0,0,0,0|2,0,0]=4 90 B11R1.279 COC1=CC=C(C=C1Cl)CO CNP0187706.0 [2,0,0,0,0,0|2,0,0]=4 91 B11R1.279 COC1=CC=C(C=C1O)C=O CNP0420166.0 [2,0,0,0,0,0|1,0,0]=3 92 B11R1.279 COC1=CC=C(C=C1O)CN CNP0009082.0 [2,0,0,0,0,0|1,0,0]=3 93 B11R1.279 COC1=CC=C(C=C1O)CO CNP0153100.0 [2,0,0,0,0,0|1,0,0]=3 94 B11R1.280 C=CC1=CC=C(C(=C1)OC)O CNP0357819.0 [2,0,0,0,0,0|0,0,0]=2 95 B11R1.280 CCC1=CC=C(C(=C1)CC)C CNP0134602.0 [2,0,0,0,0,0|1,0,1]=4 96 B11R1.280 CCC1=CC=C(C(=C1)OC)C CNP0257657.0 [2,0,0,0,0,0|0,0,1]=3 97 B11R1.280 CCC1=CC=C(C(=C1)OC)O CNP0401902.0 [2,0,0,0,0,0|0,0,1]=3 98 B11R1.280 COC1=CC(=CC=C1Cl)C=O CNP0146169.0 [2,0,0,0,0,0|2,0,0]=4 99 B11R1.280 COC1=CC(=CC=C1O)C#N CNP0252520.0 [2,0,0,0,0,0|1,0,1]=4 100 B11R1.280 COC1=CC(=CC=C1O)C=O CNP0270199.0 [2,0,0,0,0,0|1,0,0]=3 101 B11R1.280 COC1=CC(=CC=C1O)CN CNP0052909.0 [2,0,0,0,0,0|1,0,0]=3 102 B11R1.280 COC1=CC(=CC=C1O)CO CNP0268270.0 [2,0,0,0,0,0|1,0,0]=3 103 B11R1.280 COC1=CC(=CC=C1O)OO CNP0508207.0 [2,0,0,0,0,0|2,0,0]=4 104 B11R1.280 COC1=CC=C(C(=C1)OC)O CNP0124974.0 [2,0,0,0,0,0|1,0,1]=4 105 B11R1.189 COC1=CC=CC(=C1)CC#N CNP0143135.0 [2,0,0,0,0,0|1,0,1]=4 106 B11R1.189 COC1=CC=CC(=C1)CCO CNP0066003.0 [2,0,0,0,0,0|1,0,1]=4 107 B11R1.192 C=CCC1=CC=C(C(=C1)C)O CNP0539736.0 [2,0,0,0,0,0|0,0,0]=2 108 B11R1.192 C=CCC1=CC=C(C(=C1)O)O CNP0278721.0 [2,0,0,0,0,0|0,0,0]=2 109 B11R1.192 C=CCC1=CN=C(C(=N1)C)C CNP0077645.0 [2,0,0,0,0,0|2,0,0]=4 110 B11R1.192 CC=CC1=CC=C(C(=C1)C)C CNP0488892.0 [2,0,0,0,0,0|0,0,2]=4 111 B11R1.192 CC=CC1=CC=C(C(=C1)O)O CNP0370461.0 [2,0,0,0,0,0|0,0,2]=4 112 B11R1.192 CCCC1=CC=C(C(=C1)C)C CNP0295102.0 [2,0,0,0,0,0|0,0,2]=4 113 B11R1.192 COCC1=CC=C(C(=C1)O)O CNP0408139.0 [2,0,0,0,0,0|1,0,1]=4 114 B11R1.192 NCCC1=CC=C(C(=C1)O)O CNP0254743.0 [2,0,0,0,0,0|1,0,1]=4 115 B11R1.192 O=CCC1=CC=C(C(=C1)O)O CNP0123574.0 [2,0,0,0,0,0|1,0,0]=3 116 B11R1.192 OC=CC1=CC=C(C(=C1)O)O CNP0157779.0 [2,0,0,0,0,0|1,0,1]=4 117 B11R1.192 OCCC1=CC=C(C(=C1)O)O CNP0275287.0 [2,0,0,0,0,0|1,0,1]=4 118 B11R1.83 C=CCC1=CC=C(C=C1)OC CNP0191217.0 [2,0,0,0,0,0|0,0,0]=2 119 B11R1.83 CC=CC1=CC=C(C=C1)OC CNP0402035.0 [2,0,0,0,0,0|0,0,2]=4 120 B11R1.83 CCCC1=CC=C(C=C1)OC CNP0255936.0 [2,0,0,0,0,0|0,0,2]=4 121 B11R1.83 CNCC1=CC=C(C=C1)OC CNP0239380.0 [2,0,0,0,0,0|1,0,1]=4 122 B11R1.83 COC1=CC=C(C=C1)CC=O CNP0207724.0 [2,0,0,0,0,0|1,0,0]=3 123 B11R1.83 COC1=CC=C(C=C1)CCN CNP0137581.0 [2,0,0,0,0,0|1,0,1]=4 124 B11R1.83 COC1=CC=C(C=C1)CCO CNP0178762.0 [2,0,0,0,0,0|1,0,1]=4 125 B11R1.83 COCC1=CC=C(C=C1)OC CNP0142961.0 [2,0,0,0,0,0|1,0,1]=4 126 B11R1.83 NOC1=CC=C(C=C1)CC=O CNP0170203.0 [2,0,0,0,0,0|2,0,0]=4 127 B13R1.99 COC1=CC(=CC=C1C(C)C)C=O CNP0565495.0 [1,1,0,0,0,0|2,0,0]=4 128 B13R1.99 COC1=CC(=CC=C1C(C)C)CO CNP0327020.0 [1,1,0,0,0,0|2,0,0]=4 129 B13R1.355 CCOC1=CC(=CC=C1OC)C=O CNP0380632.0 [1,1,0,0,0,0|1,0,0]=3 130 B13R1.434 COC1=CC(=C(C(=C1)OC)OC)C CNP0321950.0 [1,1,0,0,0,0|1,0,1]=4 131 B13R1.434 COC1=CC(=CC(=C1OC)Br)C=O CNP0283025.0 [1,1,0,0,0,0|1,0,0]=3 132 B13R1.434 COC1=CC(=CC(=C1OC)O)C=O CNP0152972.0 [1,1,0,0,0,0|1,0,0]=3 133 B13R1.2200 COC1=CC(=C(C=C1O)OC)OC CNP0202440.0 [1,1,0,0,0,0|1,0,1]=4 134 B13R1.2200 COC1=CC(=C(C=C1OC)C=O)Br CNP0101531.0 [1,1,0,0,0,0|1,0,0]=3 135 B13R1.2200 COC1=CC(=C(C=C1OC)C=O)O CNP0408329.0 [1,1,0,0,0,0|1,0,0]=3 136 B13R1.3091 C=C(C)C1=CC=C(C(=C1)OC)OC CNP0310060.0 [1,1,0,0,0,0|0,0,0]=2 137 B13R1.3091 COC1=CC=C(C=C1OC)C(=O)C CNP0212163.0 [1,1,0,0,0,0|0,0,1]=3 138 B13R1.3091 COC1=CC=C(C=C1OC)C(=O)N CNP0186366.0 [1,1,0,0,0,0|1,0,0]=3 139 B13R1.3091 COC1=CC=C(C=C1OC)C(=O)O CNP0328859.0 [1,1,0,0,0,0|1,0,0]=3 140 B13R1.3091 COC1=CC=C(C=C1OC)C(C)O CNP0521065.0 [1,1,0,0,0,0|0,0,1]=3 141 B13R1.49 CC[C@@H](O)C1=CC=C(C(=C1)OC)O CNP0362761.2 [1,1,0,0,0,0|0,0,2]=4 142 B13R1.49 CC[C@H](O)C1=CC=C(C(=C1)OC)O CNP0362761.1 [1,1,0,0,0,0|0,0,2]=4 143 B13R1.49 COC1=CC(=CC=C1O)C(O)C=O CNP0022427.0 [1,1,0,0,0,0|1,0,0]=3 144 B13R1.49 COC1=CC(=CC=C1O)[C@@H](O)CN CNP0113388.2 [1,1,0,0,0,0|1,0,1]=4 145 B13R1.49 COC1=CC(=CC=C1O)[C@@H](O)CO CNP0116546.1 [1,1,0,0,0,0|1,0,1]=4 146 B13R1.49 COC1=CC(=CC=C1O)[C@H](O)CN CNP0113388.1 [1,1,0,0,0,0|1,0,1]=4 147 B13R1.49 COC1=CC(=CC=C1O)[C@H](O)CO CNP0116546.2 [1,1,0,0,0,0|1,0,1]=4 148 B13R1.52 COC1=CC(=CC=C1Br)CC(=O)O CNP0473704.0 [1,1,0,0,0,0|2,0,0]=4 149 B13R1.52 COC1=CC(=CC=C1O)CC(=O)C CNP0185438.0 [1,1,0,0,0,0|0,0,1]=3 150 B13R1.52 COC1=CC(=CC=C1O)CC(=O)O CNP0188137.0 [1,1,0,0,0,0|1,0,0]=3 151 B13R1.52 COC1=CC(=CC=C1O)CC(C)N CNP0310601.0 [1,1,0,0,0,0|0,0,2]=4 152 B13R1.52 COC1=CC(=CC=C1O)C[C@H](C)O CNP0207715.1 [1,1,0,0,0,0|0,0,2]=4 153 B13R1.384 C=CCC1=CC=C(C(=C1)OCC)O CNP0242687.0 [1,1,0,0,0,0|0,0,0]=2 154 B13R1.384 CC=CC1=CC=C(C(=C1)OCC)O CNP0328675.0 [1,1,0,0,0,0|0,0,2]=4 155 B13R1.384 CCOC1=CC(=CC=C1O)COC CNP0002699.0 [1,1,0,0,0,0|1,0,1]=4 156 B13R1.575 CCOCC1=CC=C(C(=C1)OC)O CNP0232060.0 [1,1,0,0,0,0|0,0,2]=4 157 B13R1.575 CNCCC1=CC=C(C(=C1)OC)O CNP0212498.0 [1,1,0,0,0,0|0,0,2]=4 158 B13R1.575 COC1=CC(=CC=C1C)CCCO CNP0541498.0 [1,1,0,0,0,0|0,0,2]=4 159 B13R1.575 COC1=CC(=CC=C1O)C=CC=O CNP0326347.0 [1,1,0,0,0,0|0,0,1]=3 160 B13R1.575 COC1=CC(=CC=C1O)C=CCO CNP0239078.0 [1,1,0,0,0,0|0,0,2]=4 161 B13R1.575 COC1=CC(=CC=C1O)CC=C=O CNP0144019.0 [1,1,0,0,0,0|0,0,1]=3 162 B13R1.575 COC1=CC(=CC=C1O)CC=CO CNP0508330.0 [1,1,0,0,0,0|0,0,0]=2 163 B13R1.575 COC1=CC(=CC=C1O)CCC=O CNP0299379.0 [1,1,0,0,0,0|0,0,1]=3 164 B13R1.575 COC1=CC(=CC=C1O)CCCO CNP0140320.0 [1,1,0,0,0,0|0,0,2]=4 165 B13R1.1255 C=CCC1=CC=C(C(=C1C)OC)O CNP0138858.0 [1,1,0,0,0,0|0,0,0]=2 166 B13R1.1310 C=CCC1=CC(C(C=C1)(C)O)OC CNP0479122.0 [1,1,0,0,0,0|0,0,2]=4 167 B13R1.2900 CCCC1=CC(=C(C=C1S)O)OC CNP0075893.0 [1,1,0,0,0,0|0,0,2]=4 168 B13R1.4030 C=CCC1=CC(=C(C(=C1)OC)O)C CNP0558691.0 [1,1,0,0,0,0|0,0,0]=2 169 B13R1.4030 C=CCC1=CC(=C(C(=C1)OC)O)O CNP0312607.0 [1,1,0,0,0,0|0,0,0]=2 170 B13R1.4030 CC=CC1=CC(=C(C(=C1)OC)O)C CNP0555699.0 [1,1,0,0,0,0|0,0,2]=4 171 B13R1.4030 CCCC1=CC(=C(C(=C1)OC)O)O CNP0395113.0 [1,1,0,0,0,0|0,0,2]=4 172 B13R1.4030 COC1=CC(=CC(=C1O)O)CCN CNP0270967.0 [1,1,0,0,0,0|1,0,1]=4 173 B13R1.35 COC1=CC=C(C=C1Br)CC(=O)O CNP0165426.0 [1,1,0,0,0,0|2,0,0]=4 174 B13R1.35 COC1=CC=C(C=C1O)CC(=O)O CNP0071040.0 [1,1,0,0,0,0|1,0,0]=3 175 B13R1.388 CC=CC1=CC=C(C(=C1)O)OCC CNP0359595.0 [1,1,0,0,0,0|0,0,2]=4 176 B13R1.577 CNCCC1=CC=C(C(=C1)O)OC CNP0506314.0 [1,1,0,0,0,0|0,0,2]=4 177 B13R1.577 COC1=CC=C(C=C1C)C=CC=O CNP0119255.0 [1,1,0,0,0,0|0,0,1]=3 178 B13R1.577 COC1=CC=C(C=C1O)C=CC=O CNP0158241.0 [1,1,0,0,0,0|0,0,1]=3 179 B13R1.577 COC1=CC=C(C=C1O)C=CCO CNP0270945.0 [1,1,0,0,0,0|0,0,2]=4 180 B13R1.577 COC1=CC=C(C=C1O)CCCO CNP0221328.0 [1,1,0,0,0,0|0,0,2]=4 181 B13R1.3088 COC1=CC=C(C=C1O)[C@@H](O)CO CNP0150126.1 [1,1,0,0,0,0|1,0,1]=4 182 B13R1.4031 COC1=C(C=C(C=C1O)CCO)O CNP0374339.0 [1,1,0,0,0,0|1,0,1]=4 183 B15R1.815 CNC[C@H](O)C1=CC=C(C(=C1)OC)OC CNP0142566.1 [0,2,0,0,0,0|0,0,2]=4 184 B15R1.815 COC1=CC=C(C=C1OC)C(=O)CC#N CNP0497454.0 [0,2,0,0,0,0|1,0,1]=4 185 B15R1.815 COC1=CC=C(C=C1OC)[C@@H](O)CCO CNP0327277.2 [0,2,0,0,0,0|0,0,2]=4 186 B15R1.815 COC1=CC=C(C=C1OC)[C@H](O)CCO CNP0327277.1 [0,2,0,0,0,0|0,0,2]=4 187 B15R1.815 COCC(=O)C1=CC=C(C(=C1)OC)OC CNP0167502.0 [0,2,0,0,0,0|1,0,1]=4 188 B15R1.1195 COC1=CC=C(C=C1OC)C=CCCO CNP0191833.0 [0,2,0,0,0,0|0,0,2]=4 189 B15R1.1195 COCC=CC1=CC=C(C(=C1)OC)OC CNP0199393.0 [0,2,0,0,0,0|0,0,2]=4 190 B15R1.3769 CNC(C)CC1=CC=C(C(=C1)OC)OC CNP0588244.0 [0,2,0,0,0,0|0,0,2]=4 191 B15R1.3769 COC(=O)CC1=CC=C(C(=C1)OC)OC CNP0391240.0 [0,2,0,0,0,0|0,0,1]=3 192 B15R1.3769 COC1=CC=C(C=C1OC)CC(=NO)N CNP0554903.0 [0,2,0,0,0,0|1,0,0]=3 193 B15R1.3769 COC1=CC=C(C=C1OC)C[C@@H](O)CO CNP0175731.1 [0,2,0,0,0,0|0,0,2]=4 194 B15R1.5537 CNCCC1=CC(=C(C(=C1)OC)OC)O CNP0272147.0 [0,2,0,0,0,0|0,0,2]=4 195 B15R1.5537 COC1=CC(=CC(=C1OC)O)C=CCO CNP0212102.0 [0,2,0,0,0,0|0,0,2]=4 196 B15R1.5537 COC1=CC(=CC(=C1OC)O)CCC=O CNP0291449.0 [0,2,0,0,0,0|0,0,1]=3 197 B15R1.5537 COC1=CC(=CC(=C1OC)O)CCCO CNP0568265.0 [0,2,0,0,0,0|0,0,2]=4 198 B15R1.12854 COC1=CC=C(C=C1OC)/C=C/[C@H](C)O CNP0205385.1 [0,2,0,0,0,0|0,0,2]=4 199 B15R1.12854 COC1=CC=C(C=C1OC)C=CC(=O)N CNP0348149.0 [0,2,0,0,0,0|0,0,1]=3 200 B15R1.12854 COC1=CC=C(C=C1OC)C=CC(=O)O CNP0235910.0 [0,2,0,0,0,0|0,0,1]=3 201 B15R1.12854 COC1=CC=C(C=C1OC)C=C[N+](=O)[O-] CNP0591112.0 [0,2,0,0,0,0|1,0,1]=4 202 B15R1.12854 COC1=CC=C(C=C1OC)CCC(=O)C CNP0267914.0 [0,2,0,0,0,0|0,0,1]=3 203 B15R1.12854 COC1=CC=C(C=C1OC)CCC(=O)N CNP0339075.0 [0,2,0,0,0,0|0,0,1]=3 204 B15R1.12854 COC1=CC=C(C=C1OC)CCC(=O)O CNP0228435.0 [0,2,0,0,0,0|0,0,1]=3 205 B15R1.12854 COC1=CC=C(C=C1OC)CCN(C)C CNP0192406.0 [0,2,0,0,0,0|0,0,2]=4 206 B15R1.12854 COC1=CC=C(C=C1OC)CNC(=S)N CNP0220802.0 [0,2,0,0,0,0|1,0,0]=3 207 B15R1.1827 COC1=CC(=C(C=C1OC)[C@@H](O)C#N)C CNP0051960.2 [0,2,0,0,0,0|1,0,1]=4 208 B15R1.1827 COC1=CC(=C(C=C1OC)[C@H](O)C#N)C CNP0051960.1 [0,2,0,0,0,0|1,0,1]=4 209 B15R1.12853 COC1=CC=C(C=C1OC)C(=O)C(=O)C CNP0373588.0 [0,2,0,0,0,0|0,0,2]=4 210 B15R1.12853 COC1=CC=C(C=C1OC)C(=O)C(=O)O CNP0376734.0 [0,2,0,0,0,0|1,0,1]=4 211 B15R1.12853 COC1=CC=C(C=C1OC)[C@@H](N)C(=O)O CNP0592477.1 [0,2,0,0,0,0|1,0,0]=3 212 B15R1.12853 COC1=CC=C(C=C1OC)[C@@H](N)C(C)C CNP0400422.2 [0,2,0,0,0,0|0,0,2]=4 213 B15R1.12853 COC1=CC=C(C=C1OC)[C@@H](O)[C@@H](C)O CNP0584673.2 [0,2,0,0,0,0|0,0,2]=4 214 B15R1.12853 COC1=CC=C(C=C1OC)[C@@H](O)[C@H](C)O CNP0584673.4 [0,2,0,0,0,0|0,0,2]=4 215 B15R1.12853 COC1=CC=C(C=C1OC)[C@H](N)C(=O)O CNP0592477.2 [0,2,0,0,0,0|1,0,0]=3 216 B15R1.12853 COC1=CC=C(C=C1OC)[C@H](N)C(C)C CNP0400422.1 [0,2,0,0,0,0|0,0,2]=4 217 B15R1.12853 COC1=CC=C(C=C1OC)[C@H](O)[C@@H](C)O CNP0584673.1 [0,2,0,0,0,0|0,0,2]=4 218 B15R1.12853 COC1=CC=C(C=C1OC)[C@H](O)[C@H](C)O CNP0584673.3 [0,2,0,0,0,0|0,0,2]=4 219 B15R1.12855 C=C[C@@H](OC)C1=CC=C(C(=C1)OC)OC CNP0177270.1 [0,2,0,0,0,0|0,0,0]=2 220 B15R1.12855 COC1=CC=C(C=C1OC)C(OC)OC CNP0152676.0 [0,2,0,0,0,0|1,0,1]=4 221 B15R1.369 COC1=C(C(=O)CC(=C1)CC(=O)C)OC CNP0088314.0 [0,2,0,0,0,0|0,0,2]=4 222 B15R1.3695 CCCC1=CC(=C(C(=C1O)OC)OC)O CNP0117060.0 [0,2,0,0,0,0|0,0,2]=4 223 B15R1.3695 CCCC1=CC(=O)C(=C(C1=O)OC)OC CNP0102876.0 [0,2,0,0,0,0|0,0,2]=4 224 B15R1.3705 C=CCC1=CC(=C(C(=C1)OC)OC)OC CNP0286854.0 [0,2,0,0,0,0|0,0,0]=2 225 B15R1.3705 CC=CC1=CC(=C(C(=C1)OC)OC)OC CNP0214823.0 [0,2,0,0,0,0|0,0,2]=4 226 B15R1.3705 COC1=CC(=CC(=C1OC)OC)CC#N CNP0518738.0 [0,2,0,0,0,0|1,0,1]=4 227 B15R1.3705 COC1=CC(=CC(=C1OC)OC)CCN CNP0133870.0 [0,2,0,0,0,0|1,0,1]=4 228 B15R1.3768 COC1=CC=C(C=C1OC)CC(C)(C)O CNP0166123.0 [0,2,0,0,0,0|0,0,2]=4 229 B15R1.9641 C=CCC1=CC=C(C(=C1)OCC)OCC CNP0081615.0 [0,2,0,0,0,0|0,0,0]=2 230 B15R1.9656 C=CCC1=CC=C(C(=C1)OC(=O)C)OC CNP0171763.0 [0,2,0,0,0,0|0,0,0]=2 231 B15R1.9656 CC=CC1=CC=C(C(=C1)OC(=O)C)OC CNP0385767.0 [0,2,0,0,0,0|0,0,2]=4 232 B15R1.594 C=CCC1=CC=C(C(=C1)OC)OC(=O)C CNP0316524.0 [0,2,0,0,0,0|0,0,0]=2 233 B15R1.594 CC=CC1=CC=C(C(=C1)OC)OC(=O)C CNP0154253.0 [0,2,0,0,0,0|0,0,2]=4 234 B15R1.594 CCCC1=CC=C(C(=C1)OC)OC(=O)C CNP0412953.0 [0,2,0,0,0,0|0,0,2]=4 235 B15R1.27355 C=CCC1=CC(=C(C=C1O)OCC)OC CNP0541781.0 [0,2,0,0,0,0|0,0,0]=2 236 B15R1.16568 CC=CC1=CC=C(C(=C1OC)OC)OC CNP0265837.0 [0,2,0,0,0,0|0,0,2]=4 237 B15R1.16587 C=CCC1=CC(C(C=C1)OC)(OC)OC CNP0521947.0 [0,2,0,0,0,0|0,0,2]=4 238 B15R1.27356 C=CCC1=CC(=C(C=C1OC)OC)OC CNP0143891.0 [0,2,0,0,0,0|0,0,0]=2 239 B15R1.27356 CC=CC1=CC(=C(C=C1OC)OC)OC CNP0204500.0 [0,2,0,0,0,0|0,0,2]=4 240 B13R2.1419 COC1=CC2=C(C=C1OC)CC2 CNP0045450.0 [1,0,0,1,0,0|0,0,1]=3 241 B13R2.449 C=CCC1=CC=C2OCOC2=C1 CNP0320423.0 [1,0,0,1,0,0|0,0,0]=2 242 B13R2.449 C=CC[14C]1=[14CH][14CH]=[14C]2OCO[14C]2=[14CH]1 CNP0508090.0 [1,0,0,1,0,0|0,0,0]=2 243 B13R2.449 CC=CC1=CC=C2OCOC2=C1 CNP0416776.0 [1,0,0,1,0,0|0,0,2]=4 244 B13R2.449 NCCC1=CC=C2OCOC2=C1 CNP0480168.0 [1,0,0,1,0,0|1,0,1]=4 245 B13R2.449 O=CCC1=CC=C2OCOC2=C1 CNP0277871.0 [1,0,0,1,0,0|1,0,0]=3 246 B13R2.449 OCCC1=CC=C2OCOC2=C1 CNP0131322.0 [1,0,0,1,0,0|1,0,1]=4 247 B13R2.599 COC1=CC2=C(C=C1O)NC=C2 CNP0018089.0 [1,0,0,1,0,0|1,0,1]=4 248 B13R2.599 COC1=CC2=C(C=CN2)C=C1Br CNP0169346.0 [1,0,0,1,0,0|2,0,0]=4 249 B13R2.599 COC1=CC2=C(C=CN2)C=C1O CNP0094755.0 [1,0,0,1,0,0|1,0,0]=3 250 B13R2.1590 COC1=CC2=C(C=C1C)C(=O)C2 CNP0035660.0 [1,0,0,1,0,0|1,0,0]=3 251 B13R2.1590 COC1=CC2=C(C=C1C)[C@@H](C2)Cl CNP0414182.1 [1,0,0,1,0,0|1,0,1]=4 252 B13R2.1590 COC1=CC2=C(C=C1C)[C@H](C2)Cl CNP0414182.2 [1,0,0,1,0,0|1,0,1]=4 253 B13R2.2749 COC1=C(C=CC2=C1C(=O)C2)Br CNP0157320.0 [1,0,0,1,0,0|2,0,0]=4 254 B15R2.20730 COC1=CC2=C(C=C1C(C)C)C(=O)C2 CNP0224237.0 [0,1,0,1,0,0|2,0,0]=4 255 B15R2.117 COC1=CC2=C(C=C1OC)CCN=C2 CNP0238346.0 [0,1,0,1,0,0|0,0,1]=3 256 B15R2.117 COC1=CC2=C(C=C1OC)CNCC2 CNP0138269.0 [0,1,0,1,0,0|0,0,2]=4 257 B15R2.117 COC1=CC2=C(C=C1OC)OC=CC2 CNP0288365.0 [0,1,0,1,0,0|0,0,0]=2 258 B15R2.117 COC1=CC2=CC=NC=C2C=C1OC CNP0175986.0 [0,1,0,1,0,0|0,0,1]=3 259 B15R2.2115 COC1=CC=C2C=CN=CC2=C1OC CNP0129490.0 [0,1,0,1,0,0|0,0,1]=3 260 B15R2.2115 COC1=CC=C2CCNCC2=C1OC CNP0286844.0 [0,1,0,1,0,0|0,0,2]=4 261 B15R2.3136 COC1=CC=C2COC(=O)C2=C1OC CNP0295959.0 [0,1,0,1,0,0|1,0,0]=3 262 B15R2.4299 COC1=CC=C(C=C1OC)[C@@H]2O[C@H]2C CNP0410034.1 [0,1,0,1,0,0|0,0,2]=4 263 B15R2.20737 COC1=CC2=C(C=C1OC)[C@@H](C2)C#N CNP0026120.2 [0,1,0,1,0,0|0,0,2]=4 264 B15R2.20737 COC1=CC2=C(C=C1OC)[C@H](C2)C#N CNP0026120.1 [0,1,0,1,0,0|0,0,2]=4 265 B15R2.21574 COC1=CC2=C(C=C1OC)C(=O)CC2 CNP0415863.0 [0,1,0,1,0,0|0,0,1]=3 266 B15R2.21574 COC1=CC2=C(C=C1OC)C(=O)OC2 CNP0193379.0 [0,1,0,1,0,0|1,0,0]=3 267 B15R2.21574 COC1=CC2=C(C=C1OC)N(C=C2)C CNP0017616.0 [0,1,0,1,0,0|1,0,0]=3 268 B15R2.4367 C=CCC1=CC(=C2OCOC2=C1)OC CNP0188030.0 [0,1,0,1,0,0|0,0,0]=2 269 B15R2.4367 CC=CC1=CC(=C2OCOC2=C1)OC CNP0150482.0 [0,1,0,1,0,0|0,0,2]=4 270 B15R2.4367 CCCC1=CC(=C2OCOC2=C1)OC CNP0023965.0 [0,1,0,1,0,0|0,0,2]=4 271 B15R2.2035 COC1=CC2=C(C=C1OC)OC(=O)N2 CNP0157367.0 [0,1,0,1,0,0|2,0,0]=4 272 B15R2.4833 COC1=CC=C2N=C(OC2=C1OC)O CNP0608860.0 [0,1,0,1,0,0|2,0,0]=4 273 B15R2.4833 COC1=CC=C2NC(=O)OC2=C1OC CNP0186738.0 [0,1,0,1,0,0|2,0,0]=4 274 B13R1.358 C=CCC1=CC(=CC(=C1)OC)OC CNP0132145.0 [0,0,0,0,1,1|0,0,0]=2