0 B13R1.337 C=C(C)CCOCC1=CC=CC=C1 AMY30716 [0,0,0,0,0,0|3,0,0]=3 1 B13R1.337 CC(=O)CCCCC1=CC=CC=C1 AMY15321 [0,0,0,0,0,0|1,0,0]=1 2 B13R1.337 O=C(Cl)CCOCC1=CC=CC=C1 AMY39860 [0,0,0,0,0,0|3,0,0]=3 3 B13R1.337 O=C(O)CCCCC1=CC=CC=C1 AMY2611 [0,0,0,0,0,0|2,0,0]=2 4 B12R1.8 CNCCCOC1=CC=CC=C1 AM807189 [1,0,0,0,0,0|3,0,0]=4 5 B12R1.8 O=CCCOCC1=CC=CC=C1 AMY3580 [1,0,0,0,0,0|2,0,0]=3 6 B14R1.420 O=C(O)CCCC(=O)C1=CC=CC=C1 AMY10729 [0,1,0,0,0,0|2,0,1]=4 7 B14R1.677 O=C(O)CCCCC1=CC=C(F)C=C1 AM803576 [0,1,0,0,0,0|2,0,0]=3 8 B14R1.677 O=C(O)CCCOC1=CC=C(Cl)C=C1 AMY30277 [0,1,0,0,0,0|3,0,0]=4 9 B14R1.818 CC(=O)CC(=O)OCC1=CC=CC=C1 AM20040668 [0,1,0,0,0,0|2,0,1]=4 10 B14R1.6449 N[C@@H](COCC1=CC=CC=C1)C(=O)O AM82237 [0,1,0,0,0,0|3,0,0]=4 11 B14R1.6449 N[C@@H](COCC1=CC=CC=C1)C(=O)O AMY22660 [0,1,0,0,0,0|3,0,0]=4 12 B14R1.6449 N[C@@H](CSCC1=CC=CC=C1)C(=O)O AM81684 [0,1,0,0,0,0|3,0,0]=4 13 B14R2.2 CC(=O)NC1=CCC2=C1C=CC=C2 AM100484 [0,0,0,1,0,0|1,0,2]=4 14 B14R2.2 CC(=O)OC1=CNC2=C1C=CC=C2 AM20040838 [0,0,0,1,0,0|1,0,2]=4 15 B14R2.2 O=C(O)CN1CCC2=C1C=CC=C2 AM803446 [0,0,0,1,0,0|3,0,0]=4 16 B14R2.19 C=C1CCN(CC2=CC=CC=C2)C1 AMY6045 [0,0,0,1,0,0|3,0,0]=4 17 B14R2.19 O=C1CCN(CC2=CC=CC=C2)C1 AM20050515 [0,0,0,1,0,0|2,0,0]=3 18 B14R2.19 O=C1CCN(CC2=CC=CC=C2)C1 AMY22017 [0,0,0,1,0,0|2,0,0]=3 19 B14R2.19 O=C1C[C@H](CC2=CC=CC=C2)CO1 AMY16250 [0,0,0,1,0,0|0,0,0]=1 20 B14R2.19 O=C1N[C@@H](CC2=CC=CC=C2)CO1 AM20060480 [0,0,0,1,0,0|1,0,0]=2 21 B14R2.19 O=C1N[C@@H](CC2=CC=CC=C2)CO1 AM20090806 [0,0,0,1,0,0|1,0,0]=2 22 B14R2.19 S=C1N[C@H](CC2=CC=CC=C2)CS1 AMY14351 [0,0,0,1,0,0|1,2,0]=4 23 B14R2.21 O=C1CCCN(C2=CC=CC=C2)C1 AM807242 [0,0,0,1,0,0|2,0,0]=3 24 B14R2.21 O=C1CCC[C@@H](C2=CC=CC=C2)N1 AM20040437 [0,0,0,1,0,0|2,0,0]=3 25 B14R2.21 O=C1CCO[C@H](C2=CC=CC=C2)C1 AMY6083 [0,0,0,1,0,0|2,0,0]=3 26 B14R2.21 O=C1C[C@@H](C2=CC=CC=C2)CCN1 AM20041201 [0,0,0,1,0,0|1,0,0]=2 27 B14R2.436 O=C1CC(OCC2=CC=CC=C2)C1 AMY14671 [0,0,0,1,0,0|2,0,0]=3 28 B14R2.31359 O=C(O)[C@@H]1CCCC2=C1C=CC=C2 AM20061133 [0,0,0,1,0,0|2,0,0]=3 29 B14R2.31359 O=C(O)[C@@H]1CCNC2=C1C=CC=C2 AM20020406 [0,0,0,1,0,0|3,0,0]=4 30 B14R2.31359 O=C(O)[C@@H]1NCCC2=C1C=CC=C2 AM20040432 [0,0,0,1,0,0|3,0,0]=4 31 B14R2.31359 O=C(O)[C@@H]1NCCC2=C1C=CC=C2 AM20120533 [0,0,0,1,0,0|3,0,0]=4 32 B14R2.31359 O=C(O)[C@H]1CCCC2=C1C=CC=C2 AMY4419 [0,0,0,1,0,0|2,0,0]=3 33 B14R2.31359 O=C(O)[C@H]1NCCC2=C1C=CC=C2 AMY37534 [0,0,0,1,0,0|3,0,0]=4 34 B12R1.252 CC(=O)OCCC1=NC=CC=C1 AMY33281 [0,0,0,0,1,0|1,0,0]=2 35 B12R1.252 CN(C)CCOC1=CC=CC=C1 AMY10580 [0,0,0,0,1,0|3,0,0]=4 36 B12R1.252 C[C@@H](O)COCC1=CC=CC=C1 AMY19224 [0,0,0,0,1,0|1,0,2]=4 37 B12R1.252 C[C@H](O)COCC1=CC=CC=C1 AMY37532 [0,0,0,0,1,0|1,0,2]=4 38 B12R1.252 O=C(Cl)CCCC1=CC=CC=C1 AM20030216 [0,0,0,0,1,0|1,0,0]=2 39 B12R1.252 O=C(Cl)COCC1=CC=CC=C1 AMY15053 [0,0,0,0,1,0|2,0,0]=3 40 B12R1.252 O=C(O)CCCC1=CC=CC=C1 AM84635 [0,0,0,0,1,0|1,0,0]=2 41 B12R1.252 O=C(O)CCCC1=CC=NC=C1 AMY16373 [0,0,0,0,1,0|2,0,0]=3 42 B12R1.252 O=C(O)CCCC1=NC=CC=C1 AMY2379 [0,0,0,0,1,0|2,0,0]=3 43 B12R1.252 O=C(O)CCNC1=CC=CC=C1 AM804051 [0,0,0,0,1,0|2,0,0]=3 44 B12R1.252 O=C(O)CCNC1=NC=CC=C1 AM20050630 [0,0,0,0,1,0|3,0,0]=4 45 B12R1.252 O=C(O)CCOC1=CC=CC=C1 AM83175 [0,0,0,0,1,0|2,0,0]=3 46 B12R1.252 O=C(O)CCSC1=CC=CC=C1 AMY32275 [0,0,0,0,1,0|2,0,0]=3 47 B12R1.252 O=C(O)CNCC1=CC=CC=C1 AM803326 [0,0,0,0,1,0|2,0,0]=3 48 B12R1.252 O=C(O)CNCC1=CC=CC=C1 AMY4105 [0,0,0,0,1,0|2,0,0]=3 49 B12R1.252 O=C(O)CNCC1=CC=NC=C1 AM101483 [0,0,0,0,1,0|3,0,0]=4 50 B12R1.252 O=C(O)CNCC1=CN=CC=C1 AM101482 [0,0,0,0,1,0|3,0,0]=4 51 B12R1.252 O=C(O)CNCC1=NC=CC=C1 AM100561 [0,0,0,0,1,0|3,0,0]=4 52 B12R1.252 O=C(O)COCC1=CC=CC=C1 AM20120589 [0,0,0,0,1,0|2,0,0]=3 53 B12R1.252 O=C([O-])CCCC1=CC=CC=C1 AMY13389 [0,0,0,0,1,0|1,0,0]=2 54 B11R1.28 BrCCCCC1=CC=CC=C1 AMY28672 [2,0,0,0,0,0|1,0,1]=4 55 B11R1.28 C=CCNCC1=CC=CC=C1 AM20040479 [2,0,0,0,0,0|1,0,1]=4 56 B11R1.28 C=CCOCC1=CC=CC=C1 AMY5442 [2,0,0,0,0,0|1,0,1]=4 57 B11R1.28 N#CCCCC1=CC=CC=C1 AMY3893 [2,0,0,0,0,0|1,0,1]=4 58 B11R1.28 O=C=NCCC1=CC=CC=C1 AMY37072 [2,0,0,0,0,0|1,0,1]=4 59 B11R1.28 O=CCOCC1=CC=CC=C1 AMY5209 [2,0,0,0,0,0|1,0,0]=3 60 B11R1.28 OCCCCC1=CC=CC=C1 AM20040203 [2,0,0,0,0,0|0,0,2]=4 61 B13R1.6 CCCCCCC1=CC=CC(N)=C1 AM806899 [1,1,0,0,0,0|1,0,1]=4 62 B13R1.6 CCOCCOC1=CC=CC(Br)=C1 AM87958 [1,1,0,0,0,0|1,0,1]=4 63 B13R1.24 CCCCC[C@H](N)C1=CC=CC=C1 AM9238 [1,1,0,0,0,0|1,0,1]=4 64 B13R1.45 N[C@@H](CCC(=O)O)C1=CC=CC=C1 AM20120560 [0,1,0,0,1,0|1,0,0]=3 65 B13R1.45 O=C(O)CCC(=O)C1=CC=CC=C1 AM20030310 [0,1,0,0,1,0|1,0,1]=4 66 B13R1.149 CC1=CC=CC(CNCC(=O)O)=C1 AM100883 [0,1,0,0,1,0|2,0,0]=4 67 B13R1.149 NC1=CC=CC(CCCC(=O)O)=C1 AMY16075 [0,1,0,0,1,0|1,0,0]=3 68 B13R1.149 O=C(O)CCOC1=CC=CC(F)=C1 AMY4724 [0,1,0,0,1,0|2,0,0]=4 69 B13R1.149 O=C(O)CNCC1=CC=CC(Cl)=C1 AM100731 [0,1,0,0,1,0|2,0,0]=4 70 B13R1.149 O=C(O)CNCC1=CC=CC(F)=C1 AM101607 [0,1,0,0,1,0|2,0,0]=4 71 B13R1.158 CC1=C(CNCC(=O)O)C=CC=C1 AM101166 [0,1,0,0,1,0|2,0,0]=4 72 B13R1.158 O=C(O)CCCC1=C(Br)C=CC=C1 AM807649 [0,1,0,0,1,0|1,0,0]=3 73 B13R1.158 O=C(O)CNCC1=C(Cl)C=CC=C1 AM101479 [0,1,0,0,1,0|2,0,0]=4 74 B13R1.158 O=C(O)CNCC1=C(F)C=CC=C1 AM101480 [0,1,0,0,1,0|2,0,0]=4 75 B13R1.158 O=C(O)CNCC1=C(I)C=CC=C1 AM94213 [0,1,0,0,1,0|2,0,0]=4 76 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 AM20060515 [0,1,0,0,1,0|1,0,0]=3 77 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 AM84413 [0,1,0,0,1,0|1,0,0]=3 78 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O AM20041216 [0,1,0,0,1,0|1,0,0]=3 79 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O AM20041444 [0,1,0,0,1,0|1,0,0]=3 80 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O AM20060478 [0,1,0,0,1,0|1,0,0]=3 81 B13R1.351 O=C(O)[C@@H](Br)CCC1=CC=CC=C1 AM805612 [0,1,0,0,1,0|1,0,0]=3 82 B13R1.351 O=C(O)[C@@H](O)CCC1=CC=CC=C1 AM20060598 [0,1,0,0,1,0|1,0,0]=3 83 B13R1.513 CC(=O)NCCC1=CC=C(Br)C=C1 AMY5133 [0,1,0,0,1,0|1,0,0]=3 84 B13R1.513 CC(=O)NCCC1=CC=C(O)C=C1 AMY5135 [0,1,0,0,1,0|1,0,0]=3 85 B13R1.513 CC1=CC=C(CNCC(=O)O)C=C1 AM90694 [0,1,0,0,1,0|2,0,0]=4 86 B13R1.513 NC1=CC=C(CCCC(=O)O)C=C1 AM20060516 [0,1,0,0,1,0|1,0,0]=3 87 B13R1.513 O=C(O)CCCC1=CC=C(Br)C=C1 AMY10501 [0,1,0,0,1,0|1,0,0]=3 88 B13R1.513 O=C(O)CCCC1=CC=C(F)C=C1 AMY32250 [0,1,0,0,1,0|1,0,0]=3 89 B13R1.513 O=C(O)CCOC1=CC=C(Br)C=C1 AM804579 [0,1,0,0,1,0|2,0,0]=4 90 B13R1.513 O=C(O)CCSC1=CC=C(Br)C=C1 AM10265 [0,1,0,0,1,0|2,0,0]=4 91 B13R1.513 O=C(O)CNCC1=CC=C(Br)C=C1 AM100372 [0,1,0,0,1,0|2,0,0]=4 92 B13R1.513 O=C(O)CNCC1=CC=C(Cl)C=C1 AM90693 [0,1,0,0,1,0|2,0,0]=4 93 B13R1.3523 CS(=O)(=O)NCCC1=CC=CC=C1 AM806020 [0,1,0,0,1,0|2,0,0]=4 94 B15R1.119 CC(C)OCCCOC1=CC=CC(Br)=C1 AM87955 [0,1,0,0,0,1|1,0,1]=4 95 B15R1.871 CC(C)OCCOCC1=CC=C(O)C=C1 AMY40365 [0,1,0,0,0,1|1,0,1]=4 96 B15R1.778 CCOC(=O)CCNCC1=CC=CC=C1 AMY24747 [0,2,0,0,0,0|2,0,0]=4 97 B13R2.3 C1=CC=C(C2CCNCC2)C=C1 AM85909 [1,0,0,1,0,0|1,0,1]=4 98 B13R2.3 C1=CC=C(C2CCNCC2)C=C1 AMY724 [1,0,0,1,0,0|1,0,1]=4 99 B13R2.3 C1=CC=C(C2CCOCC2)C=C1 AM20030313 [1,0,0,1,0,0|0,0,1]=3 100 B13R2.3 C1=CC=C(N2CCOCC2)C=C1 AMY2650 [1,0,0,1,0,0|1,0,1]=4 101 B13R2.3 C1=CC=C([C@H]2CCCNC2)C=C1 AM9903 [1,0,0,1,0,0|2,0,0]=4 102 B13R2.15 CC1CCCC1C2=CC=CC=C2 AMY14946 [1,0,0,1,0,0|1,0,1]=4 103 B13R2.15 O=C1OCC[C@@H]1C2=CC=NC=C2 AMY23476 [1,0,0,1,0,0|1,0,0]=3 104 B13R2.15 O=C1OCC[C@@H]1C2=NC=CC=C2 AMY23475 [1,0,0,1,0,0|1,0,0]=3 105 B13R2.64 C1=CC=C(CN2CC=CC2)C=C1 AMY3253 [1,0,0,1,0,0|2,0,0]=4 106 B13R2.67 C1=CC2=C(C=C1)CNCCCC2 AMY21084 [1,0,0,1,0,0|2,0,0]=4 107 B13R2.1613 O=C[C@@H]1CCCC2=C1C=CC=C2 AMY17595 [1,0,0,1,0,0|1,0,0]=3 108 B13R2.5252 O=C1CCCCC2=C1C=CC=C2 AMY15552 [1,0,0,1,0,0|1,0,0]=3 109 B13R2.5252 O=C1CCCNC2=C1C=CC=C2 AM20061031 [1,0,0,1,0,0|2,0,0]=4 110 B13R2.5252 O=C1NCCOC2=C1C=CC=C2 AM804252 [1,0,0,1,0,0|2,0,0]=4 111 B13R2.10 O=C1C[C@H](C2=CC=CC=C2)CN1 AM803027 [0,0,0,1,1,0|1,0,0]=3 112 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CO1 AM20060750 [0,0,0,1,1,0|1,0,0]=3 113 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CO1 AM20060772 [0,0,0,1,1,0|1,0,0]=3 114 B13R2.10 S=C1N[C@H](C2=CC=CC=C2)CO1 AMY36758 [0,0,0,1,1,0|1,1,0]=4 115 B13R2.31 O=C1CN(CC2=CC=CC=C2)C1 AMY15021 [0,0,0,1,1,0|1,0,0]=3 116 B13R2.72 O=C(O)[C@@H]1CCC2=C1C=CC=C2 AMY38116 [0,0,0,1,1,0|1,0,0]=3 117 B13R2.72 O=C(O)[C@@H]1NCC2=C1C=CC=C2 AM20040989 [0,0,0,1,1,0|2,0,0]=4 118 B13R2.163 O=C1CCCC2=C(C=CC=C2)N1 AM20061147 [0,0,0,1,1,0|1,0,0]=3 119 B13R2.163 O=C1CCCC2=CC=CN=C2N1 AMY7806 [0,0,0,1,1,0|2,0,0]=4 120 B13R2.163 O=C1CCNC2=C(C=CC=C2)N1 AM806818 [0,0,0,1,1,0|2,0,0]=4 121 B13R2.163 O=C1NCCC2=C(C=CC=C2)N1 AMY25863 [0,0,0,1,1,0|2,0,0]=4 122 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 AMY23723 [0,0,0,1,1,0|1,0,0]=3 123 B13R2.423 O=C(O)[C@H]1C[C@H]1C2=CC=CC=C2 AMY23733 [0,0,0,1,1,0|1,0,0]=3 124 B15R2.6 O=C(O)CCN1CCC2=C1C=CC=C2 AM804638 [0,0,0,1,0,1|2,0,0]=4 125 B15R2.31 O=C1CCCN(CC2=CC=CC=C2)C1 AM20040403 [0,0,0,1,0,1|1,0,0]=3 126 B15R2.31 O=C1CCCN(CC2=CC=CC=C2)C1 AM20040582 [0,0,0,1,0,1|1,0,0]=3 127 B15R2.31 O=C1CN(CC2=CC=CC=C2)CCN1 AM20020451 [0,0,0,1,0,1|1,0,0]=3 128 B15R2.63 O=C(O)C1CNCC1C2=CC=CC=C2 AMY19312 [0,0,0,1,0,1|2,0,0]=4 129 B15R2.63 O=C(O)[C@H]1NCC[C@@H]1C2=CC=CC=C2 AMY23724 [0,0,0,1,0,1|2,0,0]=4 130 B15R2.388 O=S1(=O)OCC[C@@H]1CC2=CC=CC=C2 AMY39200 [0,0,0,1,0,1|2,0,0]=4 131 B15R2.617 C=C1CC(COCC2=CC=CC=C2)C1 AM85360 [0,0,0,1,0,1|2,0,0]=4 132 B15R2.617 O=C1CC(COCC2=CC=CC=C2)C1 AM85361 [0,0,0,1,0,1|1,0,0]=3 133 B15R2.384 CC(=O)N1CCCC2=C1C=CC(Br)=C2 AMY20051 [0,1,0,1,0,0|1,0,0]=3 134 B15R2.384 CC(=O)N1CCOC2=C1C=CC(Br)=C2 AM20040077 [0,1,0,1,0,0|2,0,0]=4 135 B15R2.29 O=C1CCN(CC2=CC=CC=C2)CC1 AM85336 [0,1,0,1,0,0|2,0,0]=4 136 B15R2.29 O=C1CCN(CC2=CC=CC=C2)CC1 AMY905 [0,1,0,1,0,0|2,0,0]=4 137 B15R2.28 O=C1C[C@@H](C2=CC=C(Cl)C=C2)CCN1 AMY38355 [0,1,0,1,0,0|1,0,0]=3 138 B15R2.28 O=C1C[C@@H](C2=CC=C(Cl)C=C2)CCO1 AMY38356 [0,1,0,1,0,0|0,0,0]=2 139 B15R2.98 NC1=CC=C(C[C@H]2COC(=O)N2)C=C1 AM20060519 [0,1,0,1,0,0|1,0,0]=3 140 B15R2.325 O=C1N[C@@H](CC2=CC=CC=C2)C(=O)O1 AMY20334 [0,1,0,1,0,0|1,0,1]=4 141 B15R2.314 C[C@H]1CN(CC2=CC=CC=C2)CC1=O AMY15969 [0,1,0,1,0,0|2,0,0]=4 142 B15R2.1255 NC(C(=O)O)C1CCC2=C1C=CC=C2 AM20030189 [0,1,0,1,0,0|2,0,0]=4 143 B11R1.91 CC(=O)C#CC1=CC=CC=C1 AMY9693 [0,0,0,0,2,0|0,0,2]=4 144 B11R1.91 CC(=O)COC1=CC=CC=C1 AMY28242 [0,0,0,0,2,0|1,0,0]=3 145 B11R1.91 CC(=O)NCC1=CC=CC=C1 AM20040788 [0,0,0,0,2,0|1,0,0]=3 146 B11R1.91 CC(=O)OCC1=CC=CC=C1 AMY3828 [0,0,0,0,2,0|0,0,0]=2 147 B11R1.91 CC(=O)SCC1=CN=CC=C1 AM91140 [0,0,0,0,2,0|1,1,0]=4 148 B11R1.91 CC(=O)SCC1=NC=CC=C1 AM100707 [0,0,0,0,2,0|1,1,0]=4 149 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 AMY6963 [0,0,0,0,2,0|0,0,2]=4 150 B11R1.91 CN(C)CCC1=CC=CC=C1 AMY25101 [0,0,0,0,2,0|2,0,0]=4 151 B11R1.91 C[C@H](N)CCC1=CC=CC=C1 AMY40882 [0,0,0,0,2,0|1,0,1]=4 152 B11R1.91 C[C@H](O)CCC1=CC=CC=C1 AMY25612 [0,0,0,0,2,0|0,0,2]=4 153 B11R1.91 NC(=O)CNC1=CC=CC=C1 AM803529 [0,0,0,0,2,0|2,0,0]=4 154 B11R1.91 NC(=O)OCC1=CC=CC=C1 AM83877 [0,0,0,0,2,0|1,0,0]=3 155 B11R1.91 O=C(Cl)COC1=CC=CC=C1 AMY202100119 [0,0,0,0,2,0|2,0,0]=4 156 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 AM83876 [0,0,0,0,2,0|1,0,0]=3 157 B11R1.91 O=C(O)CCC1=CC=CC=C1 AMY39410 [0,0,0,0,2,0|1,0,0]=3 158 B11R1.91 O=C(O)CCC1=NC=CC=C1 AM806795 [0,0,0,0,2,0|2,0,0]=4 159 B11R1.91 O=C(O)CNC1=CC=CC=C1 AM81798 [0,0,0,0,2,0|2,0,0]=4