0 B13R1.348 CC(=O)CC(=CC1=CC=CC=C1)C CNP0258512.0 [0,0,0,0,0,0|2,0,2]=4 1 B13R1.348 CC(=O)CC(=NC1=CC=CC=C1)C CNP0377921.0 [0,0,0,0,0,0|3,0,1]=4 2 B13R1.348 CC(=O)C[C@H](O)CC1=CC=CC=C1 CNP0264298.1 [0,0,0,0,0,0|1,0,3]=4 3 B13R1.348 CC(C)CC(=O)CC1=CC=CC=C1 CNP0319392.0 [0,0,0,0,0,0|0,0,0]=0 4 B13R1.348 CC(C)CC(O)CC1=CC=CC=C1 CNP0003361.0 [0,0,0,0,0,0|0,0,2]=2 5 B13R1.348 CC(C)OC(=O)CC1=CC=CC=C1 CNP0282252.0 [0,0,0,0,0,0|1,0,0]=1 6 B13R1.348 NC(=O)NC(=O)CC1=CC=CC=C1 CNP0191800.0 [0,0,0,0,0,0|3,0,1]=4 7 B13R1.348 O=C(O)CC(=O)NC1=CC=CC=C1 CNP0071010.0 [0,0,0,0,0,0|3,0,1]=4 8 B12R1.32 C=CCC(=O)NC1=CC=CC=C1 CNP0211229.0 [1,0,0,0,0,0|1,0,2]=4 9 B12R1.32 CCCC(=O)CC1=CC=CC=C1 CNP0538882.0 [1,0,0,0,0,0|0,0,0]=1 10 B12R1.32 CCCC(=O)OC1=CC=CC=C1 CNP0002394.0 [1,0,0,0,0,0|1,0,0]=2 11 B12R1.32 CCCC(O)CC1=CC=CC=C1 CNP0005510.0 [1,0,0,0,0,0|0,0,2]=3 12 B12R1.32 CCNC(=O)CC1=CC=CC=C1 CNP0069475.0 [1,0,0,0,0,0|1,0,0]=2 13 B12R1.32 CCOC(=O)CC1=CC=CC=C1 CNP0112866.0 [1,0,0,0,0,0|1,0,0]=2 14 B12R1.32 CCOC(=O)NC1=CC=CC=C1 CNP0116883.0 [1,0,0,0,0,0|2,0,0]=3 15 B12R1.32 CCOC(=S)NC1=CC=CC=C1 CNP0226110.0 [1,0,0,0,0,0|2,1,0]=4 16 B12R1.32 CCSC(=NC1=CC=CC=C1)N CNP0557297.0 [1,0,0,0,0,0|3,0,0]=4 17 B12R1.32 CNNC(=O)CC1=CC=CC=C1 CNP0042437.0 [1,0,0,0,0,0|2,0,0]=3 18 B12R1.252 CC(=CCCC1=CC=CC=C1)C CNP0046365.0 [1,0,0,0,0,0|0,0,3]=4 19 B12R1.252 CC(C)CN=CC1=CC=CC=C1 CNP0478741.0 [1,0,0,0,0,0|1,0,1]=3 20 B14R1.425 CC(C)[C@H](O)[C@@H](O)CC1=CC=CC=C1 CNP0119693.1 [0,1,0,0,0,0|0,0,2]=3 21 B14R1.698 CC(=O)CC(=O)NC1=CC=C(C=C1)Cl CNP0208625.0 [0,1,0,0,0,0|2,0,1]=4 22 B14R1.698 CC(C)NC(C)CC1=CC=C(C=C1)I CNP0349361.0 [0,1,0,0,0,0|2,0,1]=4 23 B14R1.698 CC1=CC=C(C=C1)OC(=O)CC(C)C CNP0002792.0 [0,1,0,0,0,0|1,0,0]=2 24 B14R1.743 CN(CC1=CC=CC=C1)CC(O)CO CNP0492287.0 [0,1,0,0,0,0|3,0,0]=4 25 B14R1.743 CNC(=CC(=O)OC1=CC=CC=C1)C CNP0061493.0 [0,1,0,0,0,0|1,0,2]=4 26 B14R1.743 CNC(=O)CC(=O)CC1=CC=CN=C1 CNP0325410.0 [0,1,0,0,0,0|2,0,1]=4 27 B14R1.5978 CC(C)OC(=O)NC1=CC=CC(=C1)Cl CNP0504266.0 [0,1,0,0,0,0|2,0,0]=3 28 B14R2.598 CC1=NN(C(=O)C1)C2=CC=CC=C2 CNP0361465.0 [0,0,0,1,0,0|2,0,1]=4 29 B14R2.642 CC(=C1C(=O)NC2=CC=CC=C12)C CNP0208782.0 [0,0,0,1,0,0|1,0,2]=4 30 B14R2.768 CC(C)CC1=CC2=CC=CN=C2N1 CNP0360313.0 [0,0,0,1,0,0|2,0,1]=4 31 B12R1.43 CC(=O)C(=O)CC1=CC=CC=C1 CNP0588983.0 [0,0,0,0,1,0|1,0,1]=3 32 B12R1.43 CC(=O)C(=O)NC1=CC=CC=C1 CNP0033092.0 [0,0,0,0,1,0|2,0,1]=4 33 B12R1.43 CC(C)C(=O)OC1=CC=CC=C1 CNP0524813.0 [0,0,0,0,1,0|1,0,0]=2 34 B12R1.43 CC(Cl)C(=O)NC1=CC=CC=C1 CNP0267765.0 [0,0,0,0,1,0|2,0,0]=3 35 B12R1.43 CN(C)C(=O)CC1=CC=CC=C1 CNP0250069.0 [0,0,0,0,1,0|1,0,0]=2 36 B12R1.43 CN(C)C(=O)NC1=CC=CC=C1 CNP0348092.0 [0,0,0,0,1,0|2,0,0]=3 37 B12R1.43 CN(O)C(=O)CC1=CC=CC=C1 CNP0104612.0 [0,0,0,0,1,0|2,0,0]=3 38 B12R1.43 C[C@@H](Cl)C(=O)NC1=CC=CC=C1 CNP0267765.1 [0,0,0,0,1,0|2,0,0]=3 39 B12R1.43 C[C@@H](O)[C@H](O)CC1=CC=CC=C1 CNP0193877.1 [0,0,0,0,1,0|1,0,2]=4 40 B12R1.43 C[C@H](O)[C@@H](N)CC1=CC=CC=C1 CNP0596460.1 [0,0,0,0,1,0|2,0,1]=4 41 B12R1.43 C[C@H](O)[C@@H](O)CC1=CC=CC=C1 CNP0193877.2 [0,0,0,0,1,0|1,0,2]=4 42 B12R1.43 NC(=O)C(=O)CC1=CC=CC=C1 CNP0113488.0 [0,0,0,0,1,0|2,0,1]=4 43 B12R1.43 O=C(O)C(=O)CC1=CC=CC=C1 CNP0177093.0 [0,0,0,0,1,0|2,0,1]=4 44 B12R1.107 CC(=CC(=O)C1=CC=CC=C1)N CNP0032196.0 [0,0,0,0,1,0|1,0,2]=4 45 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 CNP0326732.0 [0,0,0,0,1,0|1,0,1]=3 46 B12R1.107 CC(C)OC(=O)C1=CC=CC=C1 CNP0003326.0 [0,0,0,0,1,0|1,0,0]=2 47 B12R1.107 CN(C)CC(=O)C1=CC=CC=C1 CNP0183220.0 [0,0,0,0,1,0|1,0,0]=2 48 B12R1.107 CN(C)C[C@@H](O)C1=CC=CC=C1 CNP0123139.1 [0,0,0,0,1,0|1,0,2]=4 49 B12R1.107 CN(C)C[C@H](O)C1=CC=CC=C1 CNP0123139.2 [0,0,0,0,1,0|1,0,2]=4 50 B14R1.423 CC(=NOC(=O)NC1=CC=CC=C1)C CNP0317497.0 [0,0,0,0,0,1|2,0,1]=4 51 B14R1.423 CC(C)CNC(=O)CC1=CC=CC=C1 CNP0428187.0 [0,0,0,0,0,1|0,0,0]=1 52 B14R1.423 CC(C)COC(=O)CC1=CC=CC=C1 CNP0003033.0 [0,0,0,0,0,1|0,0,0]=1 53 B14R1.423 O=C(O)CCC(=O)CC1=CC=CC=C1 CNP0167736.0 [0,0,0,0,0,1|2,0,1]=4 54 B14R1.423 O=C(O)CNC(=O)CC1=CC=CC=C1 CNP0183978.0 [0,0,0,0,0,1|2,0,1]=4 55 B14R1.818 CC(=CC(=O)OCC1=CC=CC=C1)C CNP0329881.0 [0,0,0,0,0,1|0,0,2]=3 56 B14R1.818 CC(=O)CC(=O)OCC1=CC=CC=C1 CNP0232463.0 [0,0,0,0,0,1|1,0,1]=3 57 B14R1.818 CC(C)CC(=O)OCC1=CC=CC=C1 CNP0227794.0 [0,0,0,0,0,1|0,0,0]=1 58 B14R1.818 CC(C)OC(=O)C=CC1=CC=CC=C1 CNP0180499.0 [0,0,0,0,0,1|1,0,1]=3 59 B14R1.818 CC(C)OC(=O)CCC1=CC=CC=C1 CNP0542232.0 [0,0,0,0,0,1|1,0,0]=2 60 B11R1.28 CCCC=CC1=CC=CC=C1 CNP0133408.0 [2,0,0,0,0,0|0,0,1]=3 61 B11R1.28 CCCCCC1=CC=CC=C1 CNP0180656.0 [2,0,0,0,0,0|0,0,1]=3 62 B11R1.28 CCCCCC1=CC=CC=N1 CNP0343431.0 [2,0,0,0,0,0|1,0,1]=4 63 B11R1.28 CCCCCC1=CC=CN=C1 CNP0268691.0 [2,0,0,0,0,0|1,0,1]=4 64 B11R1.28 CCCCNC1=CC=CC=C1 CNP0128874.0 [2,0,0,0,0,0|1,0,1]=4 65 B11R1.28 CCCCOC1=CC=CC=C1 CNP0581047.0 [2,0,0,0,0,0|1,0,1]=4 66 B11R1.28 CCNCCC1=CC=CC=C1 CNP0355449.0 [2,0,0,0,0,0|1,0,1]=4 67 B11R1.28 CCOCCC1=CC=CC=C1 CNP0162532.0 [2,0,0,0,0,0|1,0,1]=4 68 B11R1.28 CNCC=CC1=CC=CC=C1 CNP0268805.0 [2,0,0,0,0,0|1,0,1]=4 69 B11R1.28 NCCCCC1=CC=CC=C1 CNP0573837.0 [2,0,0,0,0,0|1,0,1]=4 70 B11R1.28 OCCCCC1=CC=CC=C1 CNP0531159.0 [2,0,0,0,0,0|1,0,1]=4 71 B11R1.40 CCC(=O)CC1=CC=CC=C1 CNP0003461.0 [2,0,0,0,0,0|0,0,0]=2 72 B11R1.40 CCC(=O)NC1=CC=CC=C1 CNP0215971.0 [2,0,0,0,0,0|1,0,0]=3 73 B11R1.40 CCC(=O)OC1=CC=CC=C1 CNP0392371.0 [2,0,0,0,0,0|1,0,0]=3 74 B11R1.40 CC[C@H](N)CC1=CC=CC=C1 CNP0515672.1 [2,0,0,0,0,0|1,0,1]=4 75 B11R1.40 CNC(=O)CC1=CC=CC=C1 CNP0400808.0 [2,0,0,0,0,0|1,0,0]=3 76 B11R1.40 COC(=O)CC1=CC=CC=C1 CNP0328249.0 [2,0,0,0,0,0|1,0,0]=3 77 B11R1.40 N#CC(=O)CC1=CC=CC=C1 CNP0017972.0 [2,0,0,0,0,0|1,0,1]=4 78 B11R1.40 O=C(CC1=CC=CC=C1)NO CNP0275698.0 [2,0,0,0,0,0|2,0,0]=4 79 B11R1.40 O=C(CO)NC1=CC=CC=C1 CNP0492856.0 [2,0,0,0,0,0|2,0,0]=4 80 B13R1.19 CC1=CC=C(C=C1)OC(=O)CCN CNP0457555.0 [1,1,0,0,0,0|2,0,0]=4 81 B13R1.19 CCCC(=O)CC1=CC=C(C=C1)C CNP0277585.0 [1,1,0,0,0,0|0,0,0]=2 82 B13R1.19 CCOC(=O)CC1=CC=C(C=C1)O CNP0301144.0 [1,1,0,0,0,0|1,0,0]=3 83 B13R1.19 CCOC(=O)CN1C=CC(=N)C=C1 CNP0474320.0 [1,1,0,0,0,0|2,0,0]=4 84 B13R1.19 CCOC(=O)CN1C=CC(=[N])C=C1 CNP0605739.0 [1,1,0,0,0,0|2,0,0]=4 85 B13R1.20 CCOC(=O)OC1=CC=CC(=C1)O CNP0514800.0 [1,1,0,0,0,0|2,0,0]=4 86 B13R1.44 C=CCOC(=O)CC1=CC=CC=C1 CNP0293196.0 [1,1,0,0,0,0|0,0,2]=4 87 B13R1.44 CCCOC(=O)CC1=CC=CC=C1 CNP0002493.0 [1,1,0,0,0,0|0,0,0]=2 88 B13R1.47 CCOC(=O)C(=O)C1=CC=CC=C1 CNP0318781.0 [1,1,0,0,0,0|1,0,1]=4 89 B13R1.47 CCOC(=O)C(C)C1=CC=CC=C1 CNP0596138.0 [1,1,0,0,0,0|1,0,0]=3 90 B13R1.47 CCOC(=O)[C@H](O)C1=CC=CC=C1 CNP0145799.1 [1,1,0,0,0,0|1,0,0]=3 91 B13R1.79 CSCC(=CC1=CC=CC=C1)C=O CNP0352550.0 [1,1,0,0,0,0|1,0,1]=4 92 B13R1.135 COC(=O)C(=O)CC1=CC=CC=C1 CNP0210071.0 [1,1,0,0,0,0|1,0,1]=4 93 B13R1.470 CCOC(=O)CC1=CC=CC=C1O CNP0175356.0 [1,1,0,0,0,0|1,0,0]=3 94 B13R1.470 CCOC(=O)C[N+]1=CC=CC=C1Br CNP0579716.0 [1,1,0,0,0,0|2,0,0]=4 95 B13R1.45 CC(C)COC(=O)C1=CC=CC=C1 CNP0127742.0 [1,1,0,0,0,0|1,0,1]=4 96 B13R1.158 CC(C)CN=CC1=CC=CC=C1O CNP0441161.0 [1,1,0,0,0,0|1,0,1]=4 97 B13R1.351 CC(C)C(=O)C=CC1=CC=CC=C1 CNP0418879.0 [1,1,0,0,0,0|0,0,2]=4 98 B13R1.351 CC(C)C(=O)OCC1=CC=CC=C1 CNP0039876.0 [1,1,0,0,0,0|1,0,1]=4 99 B13R1.351 CC(C)[C@@H](O)C#CC1=CC=CC=C1 CNP0024623.2 [1,1,0,0,0,0|0,0,2]=4 100 B13R1.351 CC(C)[C@H](O)C#CC1=CC=CC=C1 CNP0024623.1 [1,1,0,0,0,0|0,0,2]=4 101 B13R1.351 C[C@@H](N)[C@@H](O)/C=C/C1=CC=CC=C1 CNP0287290.1 [1,1,0,0,0,0|1,0,1]=4 102 B13R1.351 C[C@H](N)[C@@H](O)/C=C/C1=CC=CC=C1 CNP0287290.3 [1,1,0,0,0,0|1,0,1]=4 103 B13R1.351 C[C@H](N)[C@H](O)/C=C/C1=CC=CC=C1 CNP0287290.2 [1,1,0,0,0,0|1,0,1]=4 104 B13R1.513 C[C@H](O)CCCC1=CC=C(C=C1)O CNP0310570.1 [1,1,0,0,0,0|1,0,1]=4 105 B13R1.718 CCC(C)CCCC1=CC=CN=C1 CNP0571629.0 [1,1,0,0,0,0|1,0,1]=4 106 B13R1.718 CCC(C)CN=CC1=CC=CC=C1 CNP0438069.0 [1,1,0,0,0,0|1,0,1]=4 107 B13R1.133 CC1=CC=C(C=C1)OC(=O)C(C)C CNP0286519.0 [0,1,0,0,1,0|1,0,0]=3 108 B13R1.202 CC1=CC=CC=C1OC(=O)C(C)C CNP0365706.0 [0,1,0,0,1,0|1,0,0]=3 109 B13R1.11 CCC(C)OC(=O)C1=CC=CC=C1 CNP0609113.0 [0,1,0,0,1,0|1,0,0]=3 110 B13R1.11 CCC(O)CC(=O)C1=CC=CC=C1 CNP0116208.0 [0,1,0,0,1,0|1,0,0]=3 111 B13R1.11 C[C@H](CO)OC(=O)C1=CC=CC=C1 CNP0076498.1 [0,1,0,0,1,0|1,0,0]=3 112 B13R1.132 CC(C)OC(=O)C1=CC=C(C=C1)O CNP0491246.0 [0,1,0,0,1,0|1,0,0]=3 113 B13R1.352 CC(C)(C)NC(=O)C1=CC=CC=C1 CNP0111003.0 [0,1,0,0,1,0|1,0,0]=3 114 B13R1.352 CC(C)(C)OC(=O)C1=CC=CC=C1 CNP0038467.0 [0,1,0,0,1,0|1,0,0]=3 115 B13R1.713 CC(C)C=C(C=O)C1=CC=CC=C1 CNP0154099.0 [0,1,0,0,1,0|0,0,1]=3 116 B15R1.111 CC1=CC=C(C=C1)CC(=O)NCC(C)C CNP0555376.0 [0,1,0,0,0,1|0,0,0]=2 117 B15R1.111 CC1=CC=C(C=C1)NC(=O)CCC(C)C CNP0023410.0 [0,1,0,0,0,1|1,0,0]=3 118 B15R1.496 CC(C)CC(=O)C(=CC1=CC=CC=C1)O CNP0071677.0 [0,1,0,0,0,1|0,0,2]=4 119 B15R1.496 CC(C)CC(=O)[C@@H](O)CC1=CC=CC=C1 CNP0324298.1 [0,1,0,0,0,1|0,0,2]=4 120 B15R1.496 CC(C)CC(=O)[C@H](O)CC1=CC=CC=C1 CNP0324298.2 [0,1,0,0,0,1|0,0,2]=4 121 B15R1.964 CCC(C)CNC(=O)CC1=CC=CC=C1 CNP0432302.0 [0,1,0,0,0,1|0,0,0]=2 122 B15R1.964 O=C(CC1=CC=CC=C1)OC[C@@H](O)CO CNP0228786.1 [0,1,0,0,0,1|1,0,0]=3 123 B15R1.3675 CC(O)C(=O)CC(=O)NC1=CC=CC=C1 CNP0520937.0 [0,1,0,0,0,1|2,0,0]=4 124 B15R1.3675 C[C@H](N)C(=O)NC(=O)CC1=CC=CC=C1 CNP0207061.1 [0,1,0,0,0,1|1,0,1]=4 125 B15R1.130 CC(C)OC(=O)C=CC1=CC=CC=C1O CNP0057461.0 [0,1,0,0,0,1|1,0,1]=4 126 B15R1.741 CCC(C)OC(=O)CCC1=CC=CC=C1 CNP0493756.0 [0,1,0,0,0,1|1,0,0]=3 127 B15R1.870 CC(C)OC(=O)C=CC1=CC=C(C=C1)Cl CNP0059691.0 [0,1,0,0,0,1|1,0,1]=4 128 B15R1.1076 CC(C)CC(=O)NN(C)C1=CC=CC=C1 CNP0069875.0 [0,1,0,0,0,1|1,0,0]=3 129 B15R1.3678 CC(=C(C)C(=O)OCC1=CC=CC=C1)C CNP0242028.0 [0,1,0,0,0,1|0,0,2]=4 130 B15R1.3678 CC(O)C(C)C(=O)C=CC1=CC=CC=C1 CNP0540590.0 [0,1,0,0,0,1|1,0,1]=4 131 B15R1.1145 CC(C)NC(=O)NC1=CC=CC=C1C#N CNP0185118.0 [0,2,0,0,0,0|2,0,0]=4 132 B15R1.973 CC[C@H](C)[C@H](O)[C@@H](O)CC1=CC=CC=C1 CNP0139946.1 [0,2,0,0,0,0|0,0,2]=4 133 B15R1.9101 C/C(=C\C1=CC=CC=C1)/[C@@H](O)C(C)(C)O CNP0547381.2 [0,2,0,0,0,0|1,0,1]=4 134 B15R1.9101 CC(=CC1=CC=CC=C1)[C@@H](O)C(C)(C)O CNP0547381.1 [0,2,0,0,0,0|1,0,1]=4 135 B15R1.3565 CC(C)C[C@H](NC1=CC=CC=C1)C(=O)O CNP0602780.1 [0,2,0,0,0,0|1,0,1]=4 136 B15R1.5446 CC(C)CC(=O)CC1=CC(=CC(=O)O1)O CNP0445675.0 [0,2,0,0,0,0|1,0,0]=3 137 B15R1.5446 CC(O)CC(=O)CC1=CC(=CC(=C1)O)O CNP0151252.0 [0,2,0,0,0,0|1,0,0]=3 138 B15R1.5446 C[C@H](O)CC(=O)CC1=CC(=CC(=C1)O)O CNP0151252.1 [0,2,0,0,0,0|1,0,0]=3 139 B13R1.190 C=C/C=C/C=C/[C@@H]1O[C@@H](CC1=O)C CNP0250086.1 [0,0,1,1,0,0|1,0,0]=3 140 B13R1.190 C=C/C=C/C=C/[C@H]1O[C@@H](CC1=O)C CNP0250086.2 [0,0,1,1,0,0|1,0,0]=3 141 B13R2.15 O=C1CCC=C1C2=CC=CC=C2 CNP0587845.0 [1,0,0,1,0,0|0,0,2]=4 142 B13R2.64 C1=CC=C(C=C1)CC2=NCCN2 CNP0133359.0 [1,0,0,1,0,0|2,0,0]=4 143 B13R2.64 C1=CC=C(C=C1)CC2=[NH+]CCN2 CNP0605683.0 [1,0,0,1,0,0|2,0,0]=4 144 B13R2.135 O=CC1C(=O)CC2=CC=CC=C12 CNP0532845.0 [1,0,0,1,0,0|1,0,1]=4 145 B13R2.328 C[C@@H]1NC(=O)CC2=CC=NC=C12 CNP0192183.1 [1,0,0,1,0,0|2,0,0]=4 146 B13R2.10 CC1COC(O1)C2=CC=CC=C2 CNP0291344.0 [1,0,0,1,0,0|2,0,0]=4 147 B13R2.72 CC(C)C1=CNC2=CC=CC=C12 CNP0247889.0 [1,0,0,1,0,0|1,0,1]=4 148 B13R2.3122 CC1(CN[Se]C2=CC=CC=C12)C CNP0479779.0 [1,0,0,1,0,0|2,0,0]=4 149 B13R2.359 C[C@]1(C(=O)NC2=CC=CC=C12)O CNP0292518.1 [0,0,0,1,1,0|2,0,0]=4 150 B13R2.12159 CC1(CC(=O)C2=CC=CC=C12)C CNP0322287.0 [0,0,0,1,1,0|0,0,0]=2 151 B13R2.12159 CC1(OC(=O)C2=CC=CC=C12)C CNP0053854.0 [0,0,0,1,1,0|1,0,0]=3 152 B15R2.27 C=C1C[C@@H](O[C@H](C1)C2=CC=CC=C2)C CNP0365623.1 [0,0,0,1,0,1|2,0,0]=4 153 B15R2.27 C=C1C[C@H](O[C@@H](C1)C2=CC=CC=C2)C CNP0365623.2 [0,0,0,1,0,1|2,0,0]=4 154 B15R2.27 C=C1C[C@H](O[C@H](C1)C)C2=CC=CC=C2 CNP0365623.3 [0,0,0,1,0,1|2,0,0]=4 155 B15R2.27 C=C1C[C@H](O[C@H](C1)C2=CC=CC=C2)C CNP0365623.4 [0,0,0,1,0,1|2,0,0]=4 156 B15R2.315 CC1(OC(=O)[C@@H](O1)C2=CC=CC=C2)C CNP0526110.1 [0,1,0,1,0,0|1,0,0]=3 157 B15R2.315 CC1(OC(=O)[C@H](O1)C2=CC=CC=C2)C CNP0526110.2 [0,1,0,1,0,0|1,0,0]=3 158 B15R2.629 CN(C)C=C1CC2=CC=CC=C2C1=O CNP0033471.0 [0,1,0,1,0,0|1,0,1]=4 159 B15R2.323 CC1=C(C(=O)CC1O)C2=CC=CC=C2 CNP0334854.0 [0,1,0,1,0,0|1,0,1]=4 160 B11R1.16 CCCC(=O)C1=CC=CC=C1 CNP0079774.0 [1,0,0,0,1,0|0,0,0]=2 161 B11R1.16 CCCC(=S)C1=CC=CC=C1 CNP0467884.0 [1,0,0,0,1,0|0,1,0]=3 162 B11R1.16 CCOC(=O)C1=CC=CC=C1 CNP0341969.0 [1,0,0,0,1,0|1,0,0]=3 163 B11R1.16 CCOC(=O)C1=CC=CC=N1 CNP0298485.0 [1,0,0,0,1,0|2,0,0]=4 164 B11R1.16 CCOC(=O)C1=CC=CN=C1 CNP0104896.0 [1,0,0,0,1,0|2,0,0]=4 165 B11R1.16 CNCC(=O)C1=CC=CC=C1 CNP0199751.0 [1,0,0,0,1,0|1,0,0]=3 166 B11R1.16 COCC(=O)C1=CC=CC=C1 CNP0505302.0 [1,0,0,0,1,0|1,0,0]=3 167 B11R1.16 N#CCC(=O)C1=CC=CC=C1 CNP0039912.0 [1,0,0,0,1,0|1,0,1]=4 168 B11R1.91 CC(=CCC1=CC=CC=C1)C CNP0096741.0 [1,0,0,0,1,0|0,0,1]=3 169 B11R1.91 CC(=O)CCC1=CC=CC=C1 CNP0182353.0 [1,0,0,0,1,0|1,0,1]=4 170 B11R1.91 CC(C)CCC1=CC=CC=C1 CNP0088598.0 [1,0,0,0,1,0|0,0,0]=2 171 B11R1.91 CC(C)CCC1=CN=CC=N1 CNP0076480.0 [1,0,0,0,1,0|2,0,0]=4 172 B11R1.91 CC(O)C=CC1=CC=CC=C1 CNP0091112.0 [1,0,0,0,1,0|1,0,1]=4 173 B11R1.91 CN(C)C=NC1=CC=CC=C1 CNP0489804.0 [1,0,0,0,1,0|2,0,0]=4 174 B11R1.91 CN(C)CCC1=CC=CC=C1 CNP0261348.0 [1,0,0,0,1,0|1,0,0]=3 175 B11R1.91 C[C@H](O)CCC1=CC=CC=C1 CNP0154609.1 [1,0,0,0,1,0|1,0,0]=3 176 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 CNP0302092.0 [0,0,0,0,2,0|1,0,1]=4 177 B11R1.36 CC(C)C(=O)C1=CC=CC=C1 CNP0127365.0 [0,0,0,0,2,0|0,0,0]=2 178 B11R1.36 CC(C)C(=O)C1=CC=CC=N1 CNP0492975.0 [0,0,0,0,2,0|1,0,0]=3 179 B11R1.36 CC(C)[C@@H](C)C1=CC=CC=C1 CNP0042832.2 [0,0,0,0,2,0|1,0,1]=4 180 B11R1.36 CC(C)[C@H](C)C1=CC=CC=C1 CNP0042832.1 [0,0,0,0,2,0|1,0,1]=4 181 B11R1.36 CN(C)C(=S)C1=CC=CC=C1 CNP0071076.0 [0,0,0,0,2,0|1,1,0]=4 182 B11R1.36 C[C@@H](N)C(=O)C1=CC=CC=C1 CNP0277529.2 [0,0,0,0,2,0|1,0,0]=3 183 B11R1.36 C[C@H](N)C(=O)C1=CC=CC=C1 CNP0277529.1 [0,0,0,0,2,0|1,0,0]=3 184 B11R1.36 O=C(C1=CC=CC=C1)C(O)O CNP0177704.0 [0,0,0,0,2,0|2,0,0]=4 185 B13R1.42 CC=CC(=O)OCC1=CC=CC=C1 CNP0605482.0 [1,0,0,0,0,1|0,0,2]=4 186 B13R1.42 CCCC(=O)CCC1=CC=CC=C1 CNP0589106.0 [1,0,0,0,0,1|0,0,0]=2 187 B13R1.42 CCCC(=O)NNC1=CC=CC=C1 CNP0167245.0 [1,0,0,0,0,1|1,0,0]=3 188 B13R1.42 CCCC(=O)OCC1=CC=CC=C1 CNP0362696.0 [1,0,0,0,0,1|0,0,0]=2 189 B13R1.42 CCOC(=NCC1=CC=CC=C1)S CNP0609481.0 [1,0,0,0,0,1|1,1,0]=4 190 B13R1.42 CCOC(=O)C=CC1=CC=CC=C1 CNP0238965.0 [1,0,0,0,0,1|1,0,1]=4 191 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 CNP0131457.0 [1,0,0,0,0,1|1,0,0]=3 192 B13R1.42 CCOC(=S)NCC1=CC=CC=C1 CNP0330895.0 [1,0,0,0,0,1|1,1,0]=4 193 B13R1.42 O=C(CCCl)NCC1=CC=CC=C1 CNP0062686.0 [1,0,0,0,0,1|1,0,0]=3 194 B13R1.42 O=C(CCO)CCC1=CC=CC=C1 CNP0150058.0 [1,0,0,0,0,1|1,0,0]=3 195 B13R1.337 CC(C)CCN=CC1=CC=CC=C1 CNP0477012.0 [1,0,0,0,0,1|0,0,2]=4 196 B13R1.337 C[C@H](O)CC#CCC1=CC=CC=C1 CNP0166956.1 [1,0,0,0,0,1|1,0,1]=4 197 B15R1.1081 CC(C)CCOC(=O)CC1=CC=CC=C1 CNP0279445.0 [0,0,0,0,0,2|0,0,0]=2 198 B15R1.5919 CC(=O)CNC(=O)OCC1=CC=CC=C1 CNP0495564.0 [0,0,0,0,0,2|1,0,1]=4 199 B15R1.5919 CC(C)CNC(=O)C=CC1=CC=CC=C1 CNP0581871.0 [0,0,0,0,0,2|0,0,1]=3 200 B15R1.5919 CC(C)COC(=O)C=CC1=CC=CC=C1 CNP0079856.0 [0,0,0,0,0,2|0,0,1]=3 201 B15R1.5919 CC(C)COC(=O)CCC1=CC=CC=C1 CNP0591880.0 [0,0,0,0,0,2|0,0,0]=2 202 B15R1.9084 CC(=CC(=O)NCCC1=CC=CC=C1)C CNP0350560.0 [0,0,0,0,0,2|0,0,2]=4 203 B15R1.9084 CC(=CC(=O)OCCC1=CC=CC=C1)C CNP0103341.0 [0,0,0,0,0,2|0,0,2]=4 204 B15R1.9084 CC(C)CC(=O)NCCC1=CC=CC=C1 CNP0172321.0 [0,0,0,0,0,2|0,0,0]=2 205 B15R1.9084 CC(C)CC(=O)OCCC1=CC=CC=C1 CNP0350208.0 [0,0,0,0,0,2|0,0,0]=2 206 B15R1.9084 CC(O)CC(=O)NCCC1=CC=CC=C1 CNP0408094.0 [0,0,0,0,0,2|1,0,0]=3 207 B15R1.9084 CC(O)CC(=O)NOCC1=CC=CC=C1 CNP0071182.0 [0,0,0,0,0,2|1,0,0]=3