0 B13R1.42 C=COC(=O)C=CC1=CC=CC=C1 CNP0604637.0 [0,0,0,0,0,0|0,0,2]=2 1 B13R1.42 CC#CC(=O)C=CC1=CC=CC=C1 CNP0236750.0 [0,0,0,0,0,0|1,0,1]=2 2 B13R1.42 CC=CC(=O)NNC1=CC=CC=C1 CNP0058334.0 [0,0,0,0,0,0|3,0,1]=4 3 B13R1.42 CC=CC(=O)OCC1=CC=CC=C1 CNP0605482.0 [0,0,0,0,0,0|2,0,2]=4 4 B13R1.42 CCCC(=O)CCC1=CC=CC=C1 CNP0589106.0 [0,0,0,0,0,0|1,0,2]=3 5 B13R1.42 CCCC(=O)NNC1=CC=CC=C1 CNP0167245.0 [0,0,0,0,0,0|3,0,0]=3 6 B13R1.42 CCCC(=O)OCC1=CC=CC=C1 CNP0362696.0 [0,0,0,0,0,0|2,0,1]=3 7 B13R1.42 CCOC(=NCC1=CC=CC=C1)S CNP0609481.0 [0,0,0,0,0,0|1,1,1]=3 8 B13R1.42 CCOC(=O)C=CC1=CC=CC=C1 CNP0238965.0 [0,0,0,0,0,0|0,0,0]=0 9 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 CNP0131457.0 [0,0,0,0,0,0|0,0,2]=2 10 B13R1.42 CCOC(=S)NCC1=CC=CC=C1 CNP0330895.0 [0,0,0,0,0,0|1,1,1]=3 11 B13R1.42 O=C(CCCl)NCC1=CC=CC=C1 CNP0062686.0 [0,0,0,0,0,0|3,0,1]=4 12 B13R1.42 O=C(CCO)CCC1=CC=CC=C1 CNP0150058.0 [0,0,0,0,0,0|2,0,2]=4 13 B12R1.8 CC#CC=CCC1=CC=CC=C1 CNP0173717.0 [1,0,0,0,0,0|1,0,2]=4 14 B12R1.8 CC=CC=CCC1=CC=CC=C1 CNP0076593.0 [1,0,0,0,0,0|1,0,2]=4 15 B12R1.8 O=CC=CC=CC1=CC=CC=C1 CNP0470167.0 [1,0,0,0,0,0|2,0,1]=4 16 B12R1.8 O=COCC=CC1=CC=CC=C1 CNP0186643.0 [1,0,0,0,0,0|1,0,2]=4 17 B12R1.27 CC(=NO)C=CC1=CC=CC=C1 CNP0073914.0 [1,0,0,0,0,0|3,0,0]=4 18 B12R1.27 CCC(=O)CCC1=CC=CC=C1 CNP0536432.0 [1,0,0,0,0,0|0,0,2]=3 19 B12R1.27 CCC(=O)NNC1=CC=CC=C1 CNP0034463.0 [1,0,0,0,0,0|2,0,0]=3 20 B12R1.27 CCC(=O)OCC1=CC=CC=C1 CNP0120803.0 [1,0,0,0,0,0|1,0,1]=3 21 B12R1.27 CNC(=O)C=CC1=CC=CC=C1 CNP0112097.0 [1,0,0,0,0,0|1,0,0]=2 22 B12R1.27 COC(=O)C=CC1=CC=CC=C1 CNP0290830.0 [1,0,0,0,0,0|0,0,0]=1 23 B12R1.27 COC(=O)C=CC1=CC=CN=C1 CNP0057404.0 [1,0,0,0,0,0|1,0,0]=2 24 B12R1.27 COC(=O)CCC1=CC=CC=C1 CNP0253198.0 [1,0,0,0,0,0|0,0,2]=3 25 B12R1.27 COC(=S)NCC1=CC=CC=C1 CNP0103481.0 [1,0,0,0,0,0|1,1,1]=4 26 B12R1.27 NCC(=O)OCC1=CC=CC=C1 CNP0003113.0 [1,0,0,0,0,0|2,0,1]=4 27 B12R1.27 O=C(C=CC1=CC=CC=C1)OO CNP0086495.0 [1,0,0,0,0,0|1,0,0]=2 28 B14R1.29 CCCC(=O)NN(C)C1=CC=CC=C1 CNP0022032.0 [0,1,0,0,0,0|3,0,0]=4 29 B14R1.29 CCCC(=O)OC(C)C1=CC=CC=C1 CNP0002786.0 [0,1,0,0,0,0|2,0,1]=4 30 B14R1.29 CCOC(=O)CC(=O)C1=CC=CC=C1 CNP0238620.0 [0,1,0,0,0,0|0,0,1]=2 31 B14R1.32 CCCC(=O)NNC1=CC=CC(=C1)Cl CNP0047837.0 [0,1,0,0,0,0|3,0,0]=4 32 B14R1.32 CCOC(=O)CSC1=CC=CC(=N1)Cl CNP0173697.0 [0,1,0,0,0,0|2,0,1]=4 33 B14R1.60 CCOC(=O)C(=O)CC1=CC=CC=C1 CNP0350709.0 [0,1,0,0,0,0|0,0,1]=2 34 B14R1.60 CCOC(=O)C(=O)NC1=CC=CC=C1 CNP0299874.0 [0,1,0,0,0,0|1,0,0]=2 35 B14R1.60 CCOC(=O)[C@@H](N)CC1=CC=CC=C1 CNP0259364.1 [0,1,0,0,0,0|0,0,2]=3 36 B14R1.60 CCOC(=O)[C@@H](O)CC1=CC=CC=C1 CNP0127852.1 [0,1,0,0,0,0|0,0,2]=3 37 B14R1.156 C=CCOC(=O)C=CC1=CC=CC=C1 CNP0240721.0 [0,1,0,0,0,0|0,0,1]=2 38 B14R1.156 C=CCOC(=O)COC1=CC=CC=C1 CNP0402399.0 [0,1,0,0,0,0|1,0,2]=4 39 B14R1.156 CCCCC(=O)OCC1=CC=CC=C1 CNP0222285.0 [0,1,0,0,0,0|2,0,1]=4 40 B14R1.156 CCCOC(=O)C=CC1=CC=CC=C1 CNP0077243.0 [0,1,0,0,0,0|0,0,0]=1 41 B14R1.156 CCCOC(=O)CCC1=CC=CC=C1 CNP0546590.0 [0,1,0,0,0,0|0,0,2]=3 42 B14R1.156 NCCNC(=O)OCC1=CC=CC=C1 CNP0036736.0 [0,1,0,0,0,0|2,0,1]=4 43 B14R1.156 O=C(C=CC1=CC=CC=C1)NCCO CNP0209791.0 [0,1,0,0,0,0|1,0,0]=2 44 B14R1.156 O=C(CCC1=CC=CC=C1)OCCO CNP0364264.0 [0,1,0,0,0,0|0,0,2]=3 45 B14R1.156 O=C(NCCO)OCC1=CC=CC=C1 CNP0242577.0 [0,1,0,0,0,0|2,0,1]=4 46 B14R1.502 CCCC(=O)NNC1=CC=C(C=C1)C CNP0160302.0 [0,1,0,0,0,0|3,0,0]=4 47 B14R1.502 CCOC(=O)C=CC1=CC=C(C=C1)C CNP0157244.0 [0,1,0,0,0,0|0,0,0]=1 48 B14R1.502 CCOC(=O)C=CC1=CC=C(C=C1)O CNP0246158.0 [0,1,0,0,0,0|0,0,0]=1 49 B14R1.502 CCOC(=O)CCC1=CC=C(C=C1)O CNP0586111.0 [0,1,0,0,0,0|0,0,2]=3 50 B14R1.502 CCOC(=O)COC1=CC=C(C=C1)Br CNP0190106.0 [0,1,0,0,0,0|1,0,1]=3 51 B14R1.502 CCOC(=O)COC1=CC=C(C=C1)C CNP0052927.0 [0,1,0,0,0,0|1,0,1]=3 52 B14R1.502 CCOC(=O)COC1=CC=C(C=C1)Cl CNP0111422.0 [0,1,0,0,0,0|1,0,1]=3 53 B14R1.598 CCOC(=O)C=CC1=CC=CC=C1C CNP0298915.0 [0,1,0,0,0,0|0,0,0]=1 54 B14R1.598 CCOC(=O)C=CC1=CC=CC=C1N CNP0070575.0 [0,1,0,0,0,0|0,0,0]=1 55 B14R1.598 CCOC(=O)C=CC1=CC=CC=C1O CNP0145722.0 [0,1,0,0,0,0|0,0,0]=1 56 B14R1.598 CCOC(=O)CCC1=CC=CC=C1O CNP0147042.0 [0,1,0,0,0,0|0,0,2]=3 57 B14R1.598 CCOC(=O)COC1=CC=CC=C1Cl CNP0301851.0 [0,1,0,0,0,0|1,0,1]=3 58 B14R1.756 CC[C@@H](C)C(=O)OCC1=CC=CC=C1 CNP0174832.1 [0,1,0,0,0,0|2,0,1]=4 59 B14R1.818 CC(C)CC(=O)OCC1=CC=CC=C1 CNP0227794.0 [0,1,0,0,0,0|2,0,1]=4 60 B14R1.818 CC(C)OC(=O)C=CC1=CC=CC=C1 CNP0180499.0 [0,1,0,0,0,0|0,0,0]=1 61 B14R1.818 CC(C)OC(=O)CCC1=CC=CC=C1 CNP0542232.0 [0,1,0,0,0,0|0,0,2]=3 62 B14R2.15 CC[C@@H]1C(=O)N[C@@H]1C2=CC=CC=C2 CNP0065289.3 [0,0,0,1,0,0|2,0,1]=4 63 B14R2.15 CC[C@@H]1C(=O)N[C@H]1C2=CC=CC=C2 CNP0065289.1 [0,0,0,1,0,0|2,0,1]=4 64 B14R2.15 CC[C@H]1C(=O)N[C@@H]1C2=CC=CC=C2 CNP0065289.4 [0,0,0,1,0,0|2,0,1]=4 65 B14R2.15 CC[C@H]1C(=O)N[C@H]1C2=CC=CC=C2 CNP0065289.2 [0,0,0,1,0,0|2,0,1]=4 66 B14R2.21 O=C1C=C(SCC1)C2=CC=CC=C2 CNP0044156.0 [0,0,0,1,0,0|2,0,0]=3 67 B14R2.21 O=C1C=COC(=C1)C2=CC=CC=C2 CNP0351593.0 [0,0,0,1,0,0|2,0,1]=4 68 B14R2.21 O=C1CCC=C(O1)C2=CC=CC=C2 CNP0057103.0 [0,0,0,1,0,0|2,0,1]=4 69 B14R2.30 O=C1CCCN1CC2=CC=CC=C2 CNP0071140.0 [0,0,0,1,0,0|2,0,1]=4 70 B14R2.101 C(=CC1OCCO1)C2=CC=CC=C2 CNP0002857.0 [0,0,0,1,0,0|0,0,2]=3 71 B14R2.112 CC=CC1=CC=C2C=CC=CC2=N1 CNP0312111.0 [0,0,0,1,0,0|2,0,1]=4 72 B14R2.112 CCCC1=CC=C2C=CC=CC2=N1 CNP0276038.0 [0,0,0,1,0,0|2,0,0]=3 73 B14R2.112 CCCC1=CN=C2C=CC=CC2=C1 CNP0572034.0 [0,0,0,1,0,0|3,0,0]=4 74 B14R2.112 CCOC1=CC=C2C=CC=CC2=C1 CNP0003641.0 [0,0,0,1,0,0|1,0,0]=2 75 B14R2.112 CSSC1=CC=C2C=CC=CC2=N1 CNP0077863.0 [0,0,0,1,0,0|2,1,0]=4 76 B14R2.203 CCC1=C(C=CC2=CC=CC=C12)C CNP0567644.0 [0,0,0,1,0,0|2,0,0]=3 77 B14R2.203 NCC1=C(C=CC2=CC=CC=C12)O CNP0452658.0 [0,0,0,1,0,0|2,0,1]=4 78 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1C2=CC=CC=C2 CNP0138800.2 [0,0,0,1,0,0|2,0,1]=4 79 B14R2.598 C[C@@H]1NC(=O)O[C@H]1C2=CC=CC=C2 CNP0138800.4 [0,0,0,1,0,0|2,0,1]=4 80 B14R2.598 C[C@H]1NC(=O)O[C@@H]1C2=CC=CC=C2 CNP0138800.3 [0,0,0,1,0,0|2,0,1]=4 81 B14R2.598 C[C@H]1NC(=O)O[C@H]1C2=CC=CC=C2 CNP0138800.1 [0,0,0,1,0,0|2,0,1]=4 82 B14R2.598 O=C1C=C([C@@H](O1)O)C2=CC=CC=C2 CNP0314934.1 [0,0,0,1,0,0|1,0,0]=2 83 B12R1.32 CCCC(=O)CC1=CC=CC=C1 CNP0538882.0 [0,0,0,0,1,0|1,0,1]=3 84 B12R1.32 CCCC(=O)OC1=CC=CC=C1 CNP0002394.0 [0,0,0,0,1,0|2,0,0]=3 85 B12R1.32 CCNC(=O)CC1=CC=CC=C1 CNP0069475.0 [0,0,0,0,1,0|1,0,1]=3 86 B12R1.32 CCOC(=O)CC1=CC=CC=C1 CNP0112866.0 [0,0,0,0,1,0|0,0,1]=2 87 B12R1.32 CCOC(=O)NC1=CC=CC=C1 CNP0116883.0 [0,0,0,0,1,0|1,0,0]=2 88 B12R1.32 CCOC(=S)NC1=CC=CC=C1 CNP0226110.0 [0,0,0,0,1,0|1,1,0]=3 89 B12R1.32 CCSC(=NC1=CC=CC=C1)N CNP0557297.0 [0,0,0,0,1,0|2,1,0]=4 90 B12R1.32 CNNC(=O)CC1=CC=CC=C1 CNP0042437.0 [0,0,0,0,1,0|2,0,1]=4 91 B12R1.51 CCOC(=O)C=CC1=CC=CO1 CNP0393898.0 [0,0,0,0,1,0|1,0,0]=2 92 B12R1.51 CCOC(=O)C=CC1=CNC=N1 CNP0226961.0 [0,0,0,0,1,0|2,0,0]=3 93 B12R1.51 CCOC(=O)CCC1=CC=CO1 CNP0003158.0 [0,0,0,0,1,0|1,0,2]=4 94 B12R1.51 CCOC(=O)SCC1=CC=CO1 CNP0352515.0 [0,0,0,0,1,0|2,0,1]=4 95 B14R1.520 CC(=CC=CC1=CC=CC=C1)CCO CNP0170958.0 [0,0,0,0,0,1|3,0,0]=4 96 B14R1.520 CCCC(=O)NCCC1=CC=CC=C1 CNP0403031.0 [0,0,0,0,0,1|1,0,2]=4 97 B14R1.520 CCCC(=O)OCCC1=CC=CC=C1 CNP0079810.0 [0,0,0,0,0,1|1,0,2]=4 98 B14R1.520 CCOC(=O)CCCC1=CC=CC=C1 CNP0003357.0 [0,0,0,0,0,1|0,0,2]=3 99 B14R1.520 CCOC(=O)NCCC1=CC=CC=C1 CNP0190638.0 [0,0,0,0,0,1|0,0,2]=3 100 B11R0.3 CC=CC=CC=CC=CCCC CNP0251289.0 [1,0,1,0,0,0|1,0,1]=4 101 B11R0.4 CC=CC=CC=CC(=O)OCC CNP0412321.0 [1,0,1,0,0,0|0,0,1]=3 102 B11R1.28 CC=CC=CC1=CC=CC=N1 CNP0080784.0 [2,0,0,0,0,0|1,0,1]=4 103 B11R1.28 CCC=NNC1=CC=CC=C1 CNP0413398.0 [2,0,0,0,0,0|2,0,0]=4 104 B11R1.28 CCCC=CC1=CC=CC=C1 CNP0133408.0 [2,0,0,0,0,0|0,0,1]=3 105 B11R1.28 CCOCCC1=CC=CC=C1 CNP0162532.0 [2,0,0,0,0,0|0,0,2]=4 106 B11R1.28 CNCC=CC1=CC=CC=C1 CNP0268805.0 [2,0,0,0,0,0|1,0,1]=4 107 B11R1.28 ON=CC=CC1=CC=CC=C1 CNP0222067.0 [2,0,0,0,0,0|2,0,0]=4 108 B11R1.91 CC(=CCC1=CC=CC=C1)C CNP0096741.0 [2,0,0,0,0,0|1,0,1]=4 109 B11R1.91 CC(=O)C=CC1=CC=CC=C1 CNP0331521.0 [2,0,0,0,0,0|0,0,0]=2 110 B11R1.91 CC(=O)CCC1=CC=CC=C1 CNP0182353.0 [2,0,0,0,0,0|0,0,2]=4 111 B11R1.91 CC(=O)OCC1=CC=CC=C1 CNP0361944.0 [2,0,0,0,0,0|1,0,1]=4 112 B11R1.91 CC(=O)ONC1=CC=CC=C1 CNP0256903.0 [2,0,0,0,0,0|2,0,0]=4 113 B11R1.91 CC(O)C=CC1=CC=CC=C1 CNP0091112.0 [2,0,0,0,0,0|0,0,2]=4 114 B11R1.91 NC(=O)C=CC1=CC=CC=C1 CNP0277735.0 [2,0,0,0,0,0|1,0,0]=3 115 B11R1.91 O=C(Cl)C=CC1=CC=CC=C1 CNP0314597.0 [2,0,0,0,0,0|1,0,0]=3 116 B11R1.91 O=C(O)C#CC1=CC=CC=C1 CNP0082220.0 [2,0,0,0,0,0|0,0,2]=4 117 B11R1.91 O=C(O)C=CC1=CC=CC=C1 CNP0390407.0 [2,0,0,0,0,0|0,0,0]=2 118 B11R1.91 O=C(O)C=CC1=CC=CN=C1 CNP0471683.0 [2,0,0,0,0,0|1,0,0]=3 119 B11R1.91 O=C(O)C=CC1C=CC=CC1 CNP0538582.0 [2,0,0,0,0,0|0,0,2]=4 120 B11R1.91 O=C(O)CCC1=CC=CC=C1 CNP0298094.0 [2,0,0,0,0,0|0,0,2]=4 121 B11R1.91 O=C(O)CNC1=CC=CC=C1 CNP0458877.0 [2,0,0,0,0,0|1,0,1]=4 122 B11R1.91 O=C(O)COC1=CC=CC=C1 CNP0231951.0 [2,0,0,0,0,0|1,0,1]=4 123 B11R1.91 O=C(O)NCC1=CC=CC=C1 CNP0176098.0 [2,0,0,0,0,0|1,0,1]=4 124 B13R0.2 CCC=CCC=CC=CC(=O)OCC CNP0018471.0 [0,1,1,0,0,0|0,0,2]=4 125 B13R1.24 CC=CC=CC(=O)C1=CC=CC=C1 CNP0212500.0 [1,1,0,0,0,0|1,0,1]=4 126 B13R1.337 CC(=O)C=CC=CC1=CC=CC=C1 CNP0296768.0 [1,1,0,0,0,0|1,0,1]=4 127 B13R1.337 CC(=O)OCC=CC1=CC=CC=C1 CNP0207222.0 [1,1,0,0,0,0|0,0,2]=4 128 B13R1.11 CCC(=O)NN(C)C1=CC=CC=C1 CNP0040741.0 [1,1,0,0,0,0|2,0,0]=4 129 B13R1.11 CCC(=O)O[C@H](C)C1=CC=CC=C1 CNP0247095.1 [1,1,0,0,0,0|1,0,1]=4 130 B13R1.11 COC(=O)C[C@@H](C)C1=CC=CC=C1 CNP0391081.2 [1,1,0,0,0,0|0,0,2]=4 131 B13R1.11 COC(=O)C[C@@H](N)C1=CC=CC=C1 CNP0474335.1 [1,1,0,0,0,0|0,0,2]=4 132 B13R1.11 COC(=O)C[C@@H](O)C1=CC=CC=C1 CNP0209133.2 [1,1,0,0,0,0|0,0,2]=4 133 B13R1.11 COC(=O)C[C@H](C)C1=CC=CC=C1 CNP0391081.1 [1,1,0,0,0,0|0,0,2]=4 134 B13R1.11 COC(=O)C[C@H](N)C1=CC=CC=C1 CNP0474335.2 [1,1,0,0,0,0|0,0,2]=4 135 B13R1.11 COC(=O)C[C@H](O)C1=CC=CC=C1 CNP0209133.1 [1,1,0,0,0,0|0,0,2]=4 136 B13R1.14 CCC(=O)NNC1=CC=C(C=C1)Br CNP0033506.0 [1,1,0,0,0,0|2,0,0]=4 137 B13R1.14 COC(=O)C=CC1=CC=C(C=C1)Br CNP0066263.0 [1,1,0,0,0,0|0,0,0]=2 138 B13R1.14 COC(=O)C=CC1=CC=C(C=C1)C CNP0331308.0 [1,1,0,0,0,0|0,0,0]=2 139 B13R1.14 COC(=O)C=CC1=CC=C(C=C1)O CNP0173530.0 [1,1,0,0,0,0|0,0,0]=2 140 B13R1.14 COC(=O)CCC1=CC=C(C=C1)O CNP0208741.0 [1,1,0,0,0,0|0,0,2]=4 141 B13R1.14 O=C(C=CC1=CC=C(C=C1)Cl)NO CNP0534943.0 [1,1,0,0,0,0|2,0,0]=4 142 B13R1.15 CCC(=O)C=CC1=CC=CC(=O)O1 CNP0574296.0 [1,1,0,0,0,0|1,0,0]=3 143 B13R1.15 COC(=O)C=CC1=CC=CC(=C1)Cl CNP0033800.0 [1,1,0,0,0,0|0,0,0]=2 144 B13R1.15 COC(=O)C=CC1=CC=CC(=C1)O CNP0082062.0 [1,1,0,0,0,0|0,0,0]=2 145 B13R1.135 CCC(=O)[C@H](O)CC1=CC=CC=C1 CNP0117427.1 [1,1,0,0,0,0|0,0,2]=4 146 B13R1.135 COC(=O)C(=CC1=CC=CC=C1)N CNP0597874.0 [1,1,0,0,0,0|0,0,0]=2 147 B13R1.135 COC(=O)C(=O)CC1=CC=CC=C1 CNP0210071.0 [1,1,0,0,0,0|0,0,1]=3 148 B13R1.135 COC(=O)[C@@H](C)NC1=CC=CC=C1 CNP0588654.2 [1,1,0,0,0,0|1,0,1]=4 149 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 CNP0261581.3 [1,1,0,0,0,0|0,0,2]=4 150 B13R1.135 COC(=O)[C@@H](N)OC1=CC=CC=C1 CNP0170775.1 [1,1,0,0,0,0|1,0,1]=4 151 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 CNP0387243.1 [1,1,0,0,0,0|0,0,2]=4 152 B13R1.135 COC(=O)[C@H](C)NC1=CC=CC=C1 CNP0588654.1 [1,1,0,0,0,0|1,0,1]=4 153 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 CNP0261581.2 [1,1,0,0,0,0|0,0,2]=4 154 B13R1.135 COC(=O)[C@H](O)CC1=CC=CC=C1 CNP0387243.2 [1,1,0,0,0,0|0,0,2]=4 155 B13R1.351 CC(C)C(=O)C=CC1=CC=CC=C1 CNP0418879.0 [1,1,0,0,0,0|0,0,0]=2 156 B13R1.351 CC(C)C(=O)OCC1=CC=CC=C1 CNP0039876.0 [1,1,0,0,0,0|1,0,1]=4 157 B13R1.351 C[C@@H](N)[C@@H](O)/C=C/C1=CC=CC=C1 CNP0287290.1 [1,1,0,0,0,0|0,0,2]=4 158 B13R1.351 C[C@H](N)C(=O)/C=C/C1=CC=CC=C1 CNP0295050.1 [1,1,0,0,0,0|0,0,0]=2 159 B13R1.351 C[C@H](N)[C@@H](O)/C=C/C1=CC=CC=C1 CNP0287290.3 [1,1,0,0,0,0|0,0,2]=4 160 B13R1.351 C[C@H](N)[C@H](O)/C=C/C1=CC=CC=C1 CNP0287290.2 [1,1,0,0,0,0|0,0,2]=4 161 B13R1.417 COC(C=CC1=CC=CC=C1)OC CNP0250710.0 [1,1,0,0,0,0|0,0,2]=4 162 B13R1.528 COC(=O)C=CC1=CC=CC=C1O CNP0476201.0 [1,1,0,0,0,0|0,0,0]=2 163 B13R1.19 CCCC(=O)CC1=CC=C(C=C1)C CNP0277585.0 [0,1,0,0,1,0|1,0,1]=4 164 B13R1.19 CCOC(=O)CC1=CC=C(C=C1)O CNP0301144.0 [0,1,0,0,1,0|0,0,1]=3 165 B13R1.19 CCOC(=O)CN1C=CC(=N)C=C1 CNP0474320.0 [0,1,0,0,1,0|1,0,1]=4 166 B13R1.19 CCOC(=O)CN1C=CC(=[N])C=C1 CNP0605739.0 [0,1,0,0,1,0|1,0,1]=4 167 B13R1.19 CCOC(=S)NC1=CC=C(C=C1)O CNP0104345.0 [0,1,0,0,1,0|1,1,0]=4 168 B13R1.20 CCOC(=O)OC1=CC=CC(=C1)O CNP0514800.0 [0,1,0,0,1,0|1,0,0]=3 169 B13R1.47 CCOC(=O)C(=O)C1=CC=CC=C1 CNP0318781.0 [0,1,0,0,1,0|0,0,0]=2 170 B13R1.47 CCOC(=O)C(C)C1=CC=CC=C1 CNP0596138.0 [0,1,0,0,1,0|0,0,1]=3 171 B13R1.47 CCOC(=O)[C@H](O)C1=CC=CC=C1 CNP0145799.1 [0,1,0,0,1,0|0,0,1]=3 172 B13R1.79 CSCC(=CC1=CC=CC=C1)C=O CNP0352550.0 [0,1,0,0,1,0|2,0,0]=4 173 B13R1.348 CC(C)CC(=O)CC1=CC=CC=C1 CNP0319392.0 [0,1,0,0,1,0|1,0,1]=4 174 B13R1.348 CC(C)OC(=O)CC1=CC=CC=C1 CNP0282252.0 [0,1,0,0,1,0|0,0,1]=3 175 B13R1.470 CCOC(=O)CC1=CC=CC=C1O CNP0175356.0 [0,1,0,0,1,0|0,0,1]=3 176 B13R1.470 CCOC(=O)C[N+]1=CC=CC=C1Br CNP0579716.0 [0,1,0,0,1,0|1,0,1]=4 177 B13R1.33 CCOC(=O)CC(=O)C1=CC=CO1 CNP0520871.0 [0,1,0,0,1,0|1,0,1]=4 178 B13R1.153 CCCOC(=O)C=CC1=CC=CO1 CNP0319640.0 [0,1,0,0,1,0|1,0,0]=3 179 B15R1.89 CCOC(=O)CNC(=O)C1=CC=CC=C1 CNP0392382.0 [0,1,0,0,0,1|0,0,1]=3 180 B15R1.157 CSC=CC(=O)NC=CC1=CC=CC=C1 CNP0332775.0 [0,1,0,0,0,1|1,0,1]=4 181 B15R1.826 CCOC(=O)C(=O)NCC1=CC=CC=N1 CNP0037818.0 [0,1,0,0,0,1|1,0,1]=4 182 B15R1.826 CCOC(=O)C(O)CCC1=CC=CC=C1 CNP0524257.0 [0,1,0,0,0,1|0,0,2]=4 183 B15R1.578 C=C(C(=O)SCC)[C@@H](O)C1=CC=CC=C1 CNP0057742.2 [0,2,0,0,0,0|0,1,1]=4 184 B15R1.578 C=C(C(=O)SCC)[C@H](O)C1=CC=CC=C1 CNP0057742.1 [0,2,0,0,0,0|0,1,1]=4 185 B15R1.578 CCOC(=O)[C@H](Br)[C@H](Br)C1=CC=CC=C1 CNP0324519.1 [0,2,0,0,0,0|0,0,2]=4 186 B15R1.3722 CCOC(=O)C[C@H](O)C1=CC=CC=C1C CNP0296270.1 [0,2,0,0,0,0|0,0,2]=4 187 B15R1.3858 CCOC(=O)C=CC1=CC(=CC=C1O)O CNP0225372.0 [0,2,0,0,0,0|0,0,0]=2 188 B15R1.10390 C=COC(=O)C=CC1=CC=C(C(=C1)O)O CNP0224758.0 [0,2,0,0,0,0|0,0,2]=4 189 B15R1.10390 CCOC(=O)C=CC1=CC=C(C(=C1)O)O CNP0251886.0 [0,2,0,0,0,0|0,0,0]=2 190 B15R1.48 CCOC(=O)[C@@H](N)CC1=CC=C(C=C1)O CNP0395861.2 [0,2,0,0,0,0|0,0,2]=4 191 B15R1.48 CCOC(=O)[C@H](O)CC1=CC=C(C=C1)O CNP0203533.1 [0,2,0,0,0,0|0,0,2]=4 192 B15R1.496 CC(C)CC(=O)C(=CC1=CC=CC=C1)O CNP0071677.0 [0,2,0,0,0,0|1,0,0]=3 193 B15R1.640 CCOC(=O)C(=CC1=CC=CC=C1)C#N CNP0045657.0 [0,2,0,0,0,0|0,0,0]=2 194 B15R1.640 CCOC(=O)C(CC)CC1=CC=CC=C1 CNP0148060.0 [0,2,0,0,0,0|0,0,2]=4 195 B15R1.640 CCOC(=O)[C@H](CC1=CC=CC=C1)NO CNP0231565.1 [0,2,0,0,0,0|0,0,2]=4 196 B15R1.10540 CCOC(=O)[C@@](C)(N)CC1=CC=CC=C1 CNP0501305.1 [0,2,0,0,0,0|0,0,2]=4 197 B15R1.10540 CCOC(=O)[C@](C)(N)CC1=CC=CC=C1 CNP0501305.2 [0,2,0,0,0,0|0,0,2]=4 198 B15R1.78 CCCCOC(=O)C=CC1=CC=CC=C1 CNP0358950.0 [0,2,0,0,0,0|0,0,0]=2 199 B15R1.78 CSC=CNC(=O)C=CC1=CC=CC=C1 CNP0296474.0 [0,2,0,0,0,0|1,0,1]=4 200 B15R1.78 CSCCNC(=O)C=CC1=CC=CC=C1 CNP0304825.0 [0,2,0,0,0,0|1,0,0]=3 201 B15R1.139 O=C(C=CC1=CC=C(C=C1)O)OCCO CNP0209774.0 [0,2,0,0,0,0|0,0,0]=2 202 B15R1.741 CCC(C)OC(=O)CCC1=CC=CC=C1 CNP0493756.0 [0,2,0,0,0,0|0,0,2]=4 203 B15R1.5919 CC(C)CNC(=O)C=CC1=CC=CC=C1 CNP0581871.0 [0,2,0,0,0,0|1,0,0]=3 204 B15R1.5919 CC(C)COC(=O)C=CC1=CC=CC=C1 CNP0079856.0 [0,2,0,0,0,0|0,0,0]=2 205 B15R1.5919 CC(C)COC(=O)CCC1=CC=CC=C1 CNP0591880.0 [0,2,0,0,0,0|0,0,2]=4 206 B15R1.5919 CN(C)C=CC(=O)C=CC1=CC=CC=C1 CNP0287098.0 [0,2,0,0,0,0|1,0,1]=4 207 B15R1.5919 O=C(O)CNC(=O)C=CC1=CC=CC=C1 CNP0001920.0 [0,2,0,0,0,0|1,0,1]=4 208 B15R1.791 CCOC(=O)C=CC1=CC=C(C=C1Cl)Cl CNP0034114.0 [0,2,0,0,0,0|0,0,0]=2 209 B15R1.793 CCOC(=O)C=CC1=CC=C(C=C1)OC CNP0248344.0 [0,2,0,0,0,0|0,0,0]=2 210 B15R1.793 CCOC(=O)CCC1=CC=C(C=C1)OC CNP0481862.0 [0,2,0,0,0,0|0,0,2]=4 211 B15R1.870 CC(=O)CC(=O)C=CC1=CC=C(C=C1)O CNP0250085.0 [0,2,0,0,0,0|1,0,1]=4 212 B15R1.870 CC(C)OC(=O)C=CC1=CC=C(C=C1)Cl CNP0059691.0 [0,2,0,0,0,0|0,0,0]=2 213 B15R1.130 CC(C)OC(=O)C=CC1=CC=CC=C1O CNP0057461.0 [0,2,0,0,0,0|0,0,0]=2 214 B15R1.768 CCOC(=O)C=CC1=CC=CC=C1OC CNP0267158.0 [0,2,0,0,0,0|0,0,0]=2 215 B15R1.3678 CC(O)C(C)C(=O)C=CC1=CC=CC=C1 CNP0540590.0 [0,2,0,0,0,0|1,0,0]=3 216 B15R1.3983 CCOC(C=CC1=CC=CC=C1)OCC CNP0162009.0 [0,2,0,0,0,0|0,0,2]=4 217 B13R1.464 CCOC(=O)C1=CC=CC=C1NC CNP0194191.0 [0,0,1,1,0,0|1,0,1]=4 218 B13R1.464 CCOC(=O)C1=CC=CC=C1OC CNP0254680.0 [0,0,1,1,0,0|1,0,1]=4 219 B13R1.460 CCOC(=O)C1=CC=CC(=C1)OC CNP0127250.0 [0,0,1,1,0,0|1,0,1]=4 220 B13R1.446 CCOC(=O)C1=CC(=CC=C1O)Br CNP0606333.0 [0,0,1,1,0,0|2,0,0]=4 221 B13R1.446 CCOC(=O)C1=CC(=CC=C1O)O CNP0176589.0 [0,0,1,1,0,0|2,0,0]=4 222 B13R2.3 C1=C(CCCC1)C2=CC=CC=C2 CNP0077019.0 [1,0,0,1,0,0|1,0,1]=4 223 B13R2.1613 COC1=CC=CC2=CC=CC=C12 CNP0299075.0 [1,0,0,1,0,0|2,0,0]=4 224 B13R2.1613 OCC1=CC=CC2=CC=CC=C12 CNP0083454.0 [1,0,0,1,0,0|2,0,0]=4 225 B13R2.10 NC1=CC(=NO1)C2=CC=CC=C2 CNP0342622.0 [1,0,0,1,0,0|2,0,0]=4 226 B13R2.10 O=C1C=C(CO1)C2=CC=CC=C2 CNP0352665.0 [1,0,0,1,0,0|0,0,0]=2 227 B13R2.10 O=C1CNC(=N1)C2=CC=CC=C2 CNP0040410.0 [1,0,0,1,0,0|2,0,0]=4 228 B13R2.10 O=C1CSC(=N1)C2=CC=CC=C2 CNP0049999.0 [1,0,0,1,0,0|2,0,0]=4 229 B13R2.32 CC1=CC=C2C=CC=CC2=C1C CNP0125770.0 [1,0,0,1,0,0|1,0,1]=4 230 B13R2.32 CC1=CC=C2C=CC=CC2=[N+]1C CNP0554757.0 [1,0,0,1,0,0|2,0,0]=4 231 B13R2.32 CN1C(=O)C=CC2=CC=CC=C12 CNP0123557.0 [1,0,0,1,0,0|1,0,0]=3 232 B13R2.32 O=C1C=CC2=CC=CC=C2C1=O CNP0033512.0 [1,0,0,1,0,0|1,0,1]=4 233 B13R2.33 O=C1C=CC2=CC=CC=C2C=C1 CNP0470971.0 [1,0,0,1,0,0|0,0,2]=4 234 B13R2.33 O=C1C=CC2=CN=CC=C2CC1 CNP0312086.0 [1,0,0,1,0,0|1,0,0]=3 235 B13R2.33 O=C1CCC2=CC=CC=C2CC1 CNP0327972.0 [1,0,0,1,0,0|0,0,2]=4 236 B13R2.33 O=C1CCC2=CC=CC=C2OC1 CNP0162308.0 [1,0,0,1,0,0|1,0,1]=4 237 B13R2.57 CCC1=CC=C2C=CC=CC2=C1 CNP0389841.0 [1,0,0,1,0,0|1,0,0]=3 238 B13R2.57 CCC1=CN=C2C=CC=CC2=N1 CNP0522044.0 [1,0,0,1,0,0|2,0,0]=4 239 B13R2.57 COC1=CC=C2C=CC=CC2=C1 CNP0110785.0 [1,0,0,1,0,0|1,0,0]=3 240 B13R2.57 OCC1=CC=C2C=CC=CC2=C1 CNP0129350.0 [1,0,0,1,0,0|2,0,0]=4 241 B13R2.57 OCC1=CC=C2C=CC=CC2=N1 CNP0090515.0 [1,0,0,1,0,0|2,0,0]=4 242 B13R2.135 CCN1C(=CC2=CC=CC=C12)O CNP0265807.0 [0,0,0,1,1,0|1,0,1]=4 243 B15R2.31 O=C1C=C(CCC1)NC2=CC=CC=C2 CNP0407968.0 [0,0,0,1,0,1|1,0,0]=3 244 B15R2.55 O=C1OCCC1=CNC2=CC=CC=C2 CNP0525242.0 [0,0,0,1,0,1|0,0,0]=2 245 B15R2.66 CCCC1=NN(C=C1)C2=CC=CC=C2 CNP0127699.0 [0,0,0,1,0,1|2,0,0]=4 246 B15R2.73 CCOC(=O)C1=CN=C2N1C=CC=C2 CNP0374755.0 [0,0,0,1,0,1|1,0,0]=3 247 B15R2.73 CCOC(=O)C1=CNC2=CC=CC=C12 CNP0312846.0 [0,0,0,1,0,1|0,0,0]=2 248 B15R2.1342 CCOC(=O)C1OC1C2=CC=CC=C2 CNP0003356.0 [0,0,0,1,0,1|0,0,2]=4 249 B15R2.1342 CCOC(=O)[C@@H]1C[C@@H]1C2=CC=CC=C2 CNP0406892.4 [0,0,0,1,0,1|0,0,2]=4 250 B15R2.1342 CCOC(=O)[C@@H]1C[C@H]1C2=CC=CC=C2 CNP0406892.2 [0,0,0,1,0,1|0,0,2]=4 251 B15R2.1342 CCOC(=O)[C@H]1C[C@@H]1C2=CC=CC=C2 CNP0406892.3 [0,0,0,1,0,1|0,0,2]=4 252 B15R2.1342 CCOC(=O)[C@H]1C[C@H]1C2=CC=CC=C2 CNP0406892.1 [0,0,0,1,0,1|0,0,2]=4 253 B15R2.27 CC1=CC(=CC(=O)O1)C2=CC=CC=C2 CNP0318618.0 [0,1,0,1,0,0|0,0,1]=3 254 B15R2.27 CC1=CC(=O)C=C(O1)C2=CC=CC=C2 CNP0461658.0 [0,1,0,1,0,0|1,0,1]=4 255 B15R2.612 CC(=CC1OC(O1)C)C2=CC=CC=C2 CNP0344407.0 [0,1,0,1,0,0|0,0,2]=4 256 B15R2.886 CCCC1=CC(=O)C2=CC=CC=C2N1 CNP0309002.0 [0,1,0,1,0,0|2,0,0]=4 257 B15R2.886 CCCC1=CC(=O)C2=CC=CC=C2O1 CNP0590985.0 [0,1,0,1,0,0|1,0,1]=4 258 B15R2.1259 O=C(C=C1SCCS1)C2=CC=CC=C2 CNP0080904.0 [0,1,0,1,0,0|0,2,0]=4 259 B15R2.6124 CCN1C(=CC(=O)C2=CC=CC=C12)O CNP0446802.0 [0,1,0,1,0,0|1,0,1]=4 260 B15R2.32 CC1=C(SCCC1=O)C2=CC=CC=C2 CNP0193905.0 [0,1,0,1,0,0|2,0,0]=4 261 B15R2.38 O=C1C=CCCC1=CC2=CC=CC=C2 CNP0245329.0 [0,1,0,1,0,0|1,0,0]=3 262 B15R2.1356 CCOC(=O)C1=CC2=CC=CC=C2N1 CNP0199365.0 [0,1,0,1,0,0|0,0,0]=2 263 B15R2.1356 CCOC(=O)C1CC2=CC=CC=C2O1 CNP0003388.0 [0,1,0,1,0,0|0,0,2]=4 264 B15R2.33 CC1=C(NC(=O)CC1)C2=CC=CC=C2 CNP0358281.0 [0,1,0,1,0,0|2,0,0]=4 265 B15R2.309 O=C1C=C([C@@H](O1)O)C2=CC=C(C=C2)O CNP0164422.2 [0,1,0,1,0,0|1,0,0]=3 266 B15R2.309 O=C1C=C([C@H](O1)O)C2=CC=C(C=C2)O CNP0164422.1 [0,1,0,1,0,0|1,0,0]=3 267 B15R2.1282 CCOC1=CC=C2C=CC(=O)OC2=C1 CNP0251847.0 [0,1,0,1,0,0|2,0,0]=4 268 B15R2.562 CC1=CC=CC=C1C=CC2=NCCN2 CNP0347113.0 [0,1,0,1,0,0|2,0,0]=4 269 B15R2.1846 CCC1=CC2=CC=CC=C2C=CC1=O CNP0063637.0 [0,1,0,1,0,0|1,0,0]=3 270 B15R2.54379 CCCC1=CC=C2C(=CC=CC2=N1)C CNP0308745.0 [0,1,0,1,0,0|2,0,0]=4 271 B15R2.24493 C[C@@]1(CO1)C(=O)/C=C/C2=CC=CC=C2 CNP0173808.1 [0,1,0,1,0,0|2,0,0]=4 272 B15R2.24493 C[C@]1(CO1)C(=O)/C=C/C2=CC=CC=C2 CNP0173808.2 [0,1,0,1,0,0|2,0,0]=4 273 B15R2.1668 CC(=O)OC1=CC=C2C=CC=CC2=C1 CNP0193755.0 [0,1,0,1,0,0|1,0,1]=4 274 B15R2.17 ON=C1C=C(CCC1)C2=CC=CC=C2 CNP0130348.0 [0,1,0,1,0,0|1,0,1]=4 275 B15R2.2115 CCC1=CC=C2C=CC=CC2=C1CC CNP0590455.0 [0,1,0,1,0,0|2,0,0]=4 276 B15R3.4266 C1=CC=C2C=C3OCOC3=CC2=C1 CNP0311955.0 [0,0,0,2,0,0|2,0,0]=4 277 B15R3.1739 C1=CC=C2C3=C(C=CC2=C1)CCC3 CNP0218303.0 [0,0,0,2,0,0|2,0,0]=4 278 B11R1.25 COC(=O)C=CC1=CC=CO1 CNP0003236.0 [1,0,0,0,1,0|1,0,0]=3 279 B11R1.25 COC(=O)C=CC1=CNC=C1 CNP0269800.0 [1,0,0,0,1,0|1,0,0]=3 280 B11R1.25 COC(=O)C=CC1=CNC=N1 CNP0271540.0 [1,0,0,0,1,0|2,0,0]=4 281 B11R1.40 CCC(=CC1=CC=CN=C1)C CNP0085320.0 [1,0,0,0,1,0|2,0,0]=4 282 B11R1.40 CCC(=O)CC1=CC=CC=C1 CNP0003461.0 [1,0,0,0,1,0|0,0,1]=3 283 B11R1.40 CCC(=O)NC1=CC=CC=C1 CNP0215971.0 [1,0,0,0,1,0|1,0,0]=3 284 B11R1.40 CCC(=O)OC1=CC=CC=C1 CNP0392371.0 [1,0,0,0,1,0|1,0,0]=3 285 B11R1.40 CNC(=O)CC1=CC=CC=C1 CNP0400808.0 [1,0,0,0,1,0|1,0,1]=4 286 B11R1.40 COC(=O)CC1=CC=CC=C1 CNP0328249.0 [1,0,0,0,1,0|0,0,1]=3 287 B11R1.40 COC(=S)NC1=CC=CC=C1 CNP0050030.0 [1,0,0,0,1,0|1,1,0]=4 288 B11R1.40 NOC(=O)NC1=CC=CC=C1 CNP0579392.0 [1,0,0,0,1,0|2,0,0]=4 289 B11R1.40 O=C(CO)NC1=CC=CC=C1 CNP0492856.0 [1,0,0,0,1,0|2,0,0]=4 290 B11R1.16 C=COC(=O)C1=CC=CC=C1 CNP0083042.0 [0,0,0,0,2,0|0,0,2]=4 291 B11R1.16 CCCC(=O)C1=CC=CC=C1 CNP0079774.0 [0,0,0,0,2,0|1,0,0]=3 292 B11R1.16 CCCC(=S)C1=CC=CC=C1 CNP0467884.0 [0,0,0,0,2,0|1,1,0]=4 293 B11R1.16 CCOC(=O)C1=CC=CC=C1 CNP0341969.0 [0,0,0,0,2,0|0,0,0]=2 294 B11R1.16 CCOC(=O)C1=CC=CC=N1 CNP0298485.0 [0,0,0,0,2,0|1,0,0]=3 295 B11R1.16 CCOC(=O)C1=CC=CN=C1 CNP0104896.0 [0,0,0,0,2,0|1,0,0]=3 296 B11R1.16 CCO[C@H](C)C1=CC=CC=C1 CNP0384490.1 [0,0,0,0,2,0|1,0,1]=4 297 B11R1.16 CNCC(=O)C1=CC=CC=C1 CNP0199751.0 [0,0,0,0,2,0|2,0,0]=4 298 B11R1.16 COCC(=O)C1=CC=CC=C1 CNP0505302.0 [0,0,0,0,2,0|2,0,0]=4 299 B15R1.778 CCCC(=O)OCC=CC1=CC=CC=C1 CNP0002420.0 [0,0,0,0,0,2|1,0,0]=3