0 B14R1.42 COC1=C(F)C=CC(\C=C\C(=O)O)=C1 AM62246 [0,0,0,0,0,0|2,0,2]=4 1 B14R1.42 COC1=C(O)C=CC(CCC(=O)O)=C1 AMY3788 [0,0,0,0,0,0|1,0,0]=1 2 B14R1.42 COC1=C(O)C=CC(\C=C\C(=O)O)=C1 AM20060784 [0,0,0,0,0,0|1,0,2]=3 3 B13R1.511 NC1=C(Br)C=CC(CCC(=O)O)=C1 AM20080646 [1,0,0,0,0,0|3,0,0]=4 4 B13R1.511 O=C(O)CCC1=CC(Cl)=C(F)C=C1 AMY4135 [1,0,0,0,0,0|3,0,0]=4 5 B13R1.511 O=C(O)CCC1=CC(F)=C(F)C=C1 AM9621 [1,0,0,0,0,0|3,0,0]=4 6 B13R1.511 O=C(O)CCC1=CC(O)=C(O)C=C1 AMY3775 [1,0,0,0,0,0|1,0,0]=2 7 B13R1.511 O=C(O)\C=C\C1=CC(O)=C(O)C=C1 AMY3943 [1,0,0,0,0,0|1,0,2]=4 8 B13R1.575 COC1=C(O)C=CC(\C=C\C=O)=C1 AMY25249 [1,0,0,0,0,0|0,0,2]=3 9 B13R1.643 COC1=CC=CC(CCC(=O)O)=C1 AMY3677 [1,0,0,0,0,0|1,0,0]=2 10 B13R1.643 COC1=CC=CC(SCC(=O)O)=C1 AM100771 [1,0,0,0,0,0|2,0,0]=3 11 B13R1.643 N#CC1=CC=CC(CCC(=O)O)=C1 AMY3984 [1,0,0,0,0,0|3,0,0]=4 12 B15R1.4038 COC1=C(O)C=CC(C[C@H](N)C(=O)O)=C1 AM20041134 [0,1,0,0,0,0|1,0,0]=2 13 B15R1.4038 COC1=C(O)C=CC(C[C@H](N)C(=O)O)=C1 AMY4280 [0,1,0,0,0,0|1,0,0]=2 14 B15R1.12854 COC1=C(OC)C=C(CCC(=O)O)C=C1 AM20060962 [0,1,0,0,0,0|1,0,0]=2 15 B15R1.12854 COC1=C(OC)C=C(\C=C\C(=O)O)C=C1 AMY32184 [0,1,0,0,0,0|1,0,2]=4 16 B15R2.7688 O=C(O)C#CC1=CC2=C(C=C1)OCO2 AMY19497 [0,0,0,1,0,0|1,0,2]=4 17 B15R2.7688 O=C(O)CCC1=CC2=C(C=C1)OCC2 AM20030353 [0,0,0,1,0,0|2,0,0]=3 18 B15R2.7688 O=C(O)CCC1=CC2=C(C=C1)OCO2 AM20040080 [0,0,0,1,0,0|1,0,0]=2 19 B13R1.52 COC1=C(F)C=CC(CC(=O)O)=C1 AMY14546 [0,0,0,0,1,0|2,0,0]=3 20 B13R1.52 COC1=C(O)C=CC(CC(=O)O)=C1 AMY18047 [0,0,0,0,1,0|1,0,0]=2 21 B13R1.52 COC1=C(O)C=CC(CC(C)=O)=C1 AMY14494 [0,0,0,0,1,0|0,0,0]=1 22 B12R1.21 CC(=O)CSC1=CC=C(Cl)C=C1 AMY788 [2,0,0,0,0,0|2,0,0]=4 23 B12R1.21 CC1=CC=C(CCC(=O)O)C=C1 AMY3841 [2,0,0,0,0,0|2,0,0]=4 24 B12R1.21 CN(C)CCC1=CC=C(O)C=C1 AMY39490 [2,0,0,0,0,0|2,0,0]=4 25 B12R1.21 O=C(Cl)CCC1=CC=C(Br)C=C1 AM87063 [2,0,0,0,0,0|2,0,0]=4 26 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 AM20061176 [2,0,0,0,0,0|2,0,0]=4 27 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 AMY3667 [2,0,0,0,0,0|2,0,0]=4 28 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 AM1009 [2,0,0,0,0,0|2,0,0]=4 29 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 AMY10997 [2,0,0,0,0,0|2,0,0]=4 30 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 AM20050166 [2,0,0,0,0,0|1,0,0]=3 31 B12R1.21 O=C(O)CNC1=CC=C(O)C=C1 AMY8920 [2,0,0,0,0,0|2,0,0]=4 32 B12R1.226 CC(=O)SCC1=CC(F)=CC=C1 AM101359 [2,0,0,0,0,0|2,0,0]=4 33 B12R1.226 CC(=O)SCC1=CC=CC(Cl)=C1 AM101429 [2,0,0,0,0,0|2,0,0]=4 34 B12R1.226 CC1=CC=CC(CCC(=O)O)=C1 AMY3959 [2,0,0,0,0,0|1,0,0]=3 35 B12R1.226 CC1=CC=CC(SCC(=O)O)=C1 AM100770 [2,0,0,0,0,0|2,0,0]=4 36 B12R1.226 NC1=CC=CC(CCC(=O)O)=C1 AMY3860 [2,0,0,0,0,0|2,0,0]=4 37 B12R1.226 O=C(O)CCC1=CC(O)=CC=C1 AM20040880 [2,0,0,0,0,0|1,0,0]=3 38 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 AM20040447 [2,0,0,0,0,0|2,0,0]=4 39 B12R1.226 O=C(O)CCC1=CC=CC(Cl)=C1 AM20061104 [2,0,0,0,0,0|2,0,0]=4 40 B12R1.226 O=C(O)CCC1=CC=CC(F)=C1 AM20040514 [2,0,0,0,0,0|2,0,0]=4 41 B12R1.385 CNCCC1=CC(O)=C(O)C=C1 AMY32024 [2,0,0,0,0,0|1,0,0]=3 42 B12R1.286 COC1=C(O)C=CC(CCN)=C1 AMY4299 [2,0,0,0,0,0|1,0,0]=3 43 B12R1.286 COC1=C(O)C=CC(CCN)=C1 AMY5037 [2,0,0,0,0,0|1,0,0]=3 44 B12R1.382 COC1=CC=CC(CCC=O)=C1 AMY20212 [2,0,0,0,0,0|0,0,0]=2 45 B14R1.686 CC1=C(Br)C=CC(C[C@H](N)C(=O)O)=C1 AM9089 [1,1,0,0,0,0|2,0,0]=4 46 B14R1.686 CC1=C(C)C=C(C[C@H](N)C(=O)O)C=C1 AM83309 [1,1,0,0,0,0|2,0,0]=4 47 B14R1.686 NC1=C(O)C=CC(C[C@H](N)C(=O)O)=C1 AM83541 [1,1,0,0,0,0|2,0,0]=4 48 B14R1.686 N[C@@H](CC1=CC(Cl)=C(O)C=C1)C(=O)O AM83547 [1,1,0,0,0,0|2,0,0]=4 49 B14R1.686 N[C@@H](CC1=CC(F)=C(O)C=C1)C(=O)O AM83571 [1,1,0,0,0,0|2,0,0]=4 50 B14R1.686 N[C@@H](CC1=CC(I)=C(O)C=C1)C(=O)O AM83577 [1,1,0,0,0,0|2,0,0]=4 51 B14R1.686 N[C@@H](CC1=CC(O)=C(O)C=C1)C(=O)O AM82124 [1,1,0,0,0,0|1,0,0]=3 52 B14R1.686 N[C@H](CC1=CC(I)=C(O)C=C1)C(=O)O AMY41818 [1,1,0,0,0,0|2,0,0]=4 53 B14R1.686 N[C@H](CC1=CC(O)=C(O)C=C1)C(=O)O AMY22155 [1,1,0,0,0,0|1,0,0]=3 54 B14R1.3653 COC1=C(F)C=C(CCC(=O)O)C=C1 AMY4087 [1,1,0,0,0,0|2,0,0]=4 55 B14R1.75 COC1=CC=CC(C[C@H](N)C(=O)O)=C1 AM83392 [1,1,0,0,0,0|1,0,0]=3 56 B14R1.75 COC1=CC=CC(C[C@H](N)C(=O)O)=C1 AM83393 [1,1,0,0,0,0|1,0,0]=3 57 B14R1.75 COC1=CC=CC(C[C@H](N)C(=O)O)=C1 AM83394 [1,1,0,0,0,0|1,0,0]=3 58 B14R1.75 COC1=CC=CC(O[C@@H](C)C(=O)O)=C1 AMY20102 [1,1,0,0,0,0|2,0,0]=4 59 B14R1.77 COC1=CC=CC(CNC(=O)CCl)=C1 AM100773 [1,1,0,0,0,0|1,0,0]=3 60 B14R1.77 COC1=CC=CC(CNC(=O)CN)=C1 AM90765 [1,1,0,0,0,0|1,0,0]=3 61 B14R1.376 COC1=CC(C)=CC(OCC(=O)O)=C1 AM20080592 [1,1,0,0,0,0|2,0,0]=4 62 B14R1.2335 COC1=CC(CCC(=O)O)=C(Br)C=C1 AM806860 [1,1,0,0,0,0|1,0,0]=3 63 B14R1.705 CC(=O)NC1=CC(C(C)=O)=C(O)C=C1 AMY641 [0,1,0,0,1,0|2,0,0]=4 64 B14R1.3651 COC1=C(OC)C=C(CC(=O)O)C=C1 AM20060235 [0,1,0,0,1,0|1,0,0]=3 65 B16R1.4275 COC1=C(OC)C=C(CCCC(=O)O)C=C1 AM20020434 [0,1,0,0,0,1|1,0,0]=3 66 B16R1.27683 COC1=C(O)C=CC(C[C@](C)(N)C(=O)O)=C1 AM9544 [0,2,0,0,0,0|1,0,0]=3 67 B14R2.8239 O=C1CCC2=CC(Cl)=C(Cl)C=C2C1 AM9209 [1,0,0,1,0,0|2,0,0]=4 68 B14R2.8239 O=C1CCC2=CC(F)=C(F)C=C2C1 AM9371 [1,0,0,1,0,0|2,0,0]=4 69 B14R2.991 NCCCC1=CC2=C(C=C1)OCO2 AM20040904 [1,0,0,1,0,0|1,0,1]=4 70 B14R2.1128 COC1=C(O)C=C2C=NCCC2=C1 AMY11989 [1,0,0,1,0,0|1,0,1]=4 71 B14R2.1416 COC1=C(Cl)C=C2C(=O)CCC2=C1 AM9333 [1,0,0,1,0,0|1,0,0]=3 72 B14R2.1416 COC1=C(F)C=C2C(=O)CCC2=C1 AM9273 [1,0,0,1,0,0|1,0,0]=3 73 B14R2.2332 COC1=CC2=C(C=C1)CC(=O)CC2 AM9252 [1,0,0,1,0,0|0,0,0]=2 74 B14R2.2332 COC1=CC2=C(C=C1)CN(C)CC2 AMY16209 [1,0,0,1,0,0|2,0,0]=4 75 B14R2.2332 COC1=CC2=C(C=C1)C[C@@H](N)CC2 AMY15315 [1,0,0,1,0,0|1,0,1]=4 76 B14R2.2332 COC1=CC2=C(C=C1)NC(=O)CC2 AM807256 [1,0,0,1,0,0|1,0,0]=3 77 B14R2.11684 COC1=C2CC(=O)CCC2=CC=C1 AM9359 [1,0,0,1,0,0|0,0,0]=2 78 B14R2.1008 O=C(Cl)CC1=CC2=C(C=C1)OCO2 AM20041006 [0,0,0,1,1,0|1,0,0]=3 79 B14R2.1008 O=C(O)CC1=CC2=C(C=C1)CCO2 AMY4277 [0,0,0,1,1,0|2,0,0]=4 80 B14R2.1008 O=C(O)CC1=CC2=C(C=C1)OCC2 AMY17835 [0,0,0,1,1,0|2,0,0]=4 81 B14R2.1008 O=C(O)CC1=CC2=C(C=C1)OCO2 AM84883 [0,0,0,1,1,0|1,0,0]=3 82 B12R1.19 CC(=O)NC1=CC(C)=C(Br)C=C1 AMY38825 [1,0,0,0,1,0|2,0,0]=4 83 B12R1.19 CC(=O)NC1=CC(C)=C(C)C=C1 AMY28150 [1,0,0,0,1,0|2,0,0]=4 84 B12R1.19 CC(=O)NC1=CC(Cl)=C(O)C=C1 AM20040376 [1,0,0,0,1,0|2,0,0]=4 85 B12R1.19 CC1=C(C)C=C(CC(=O)O)C=C1 AM62268 [1,0,0,0,1,0|2,0,0]=4 86 B12R1.19 CC1=C(O)C=CC(CC(=O)O)=C1 AM84028 [1,0,0,0,1,0|1,0,0]=3 87 B12R1.19 O=C(O)CC1=CC(Cl)=C(O)C=C1 AMY28184 [1,0,0,0,1,0|2,0,0]=4 88 B12R1.19 O=C(O)CC1=CC(F)=C(O)C=C1 AM82964 [1,0,0,0,1,0|2,0,0]=4 89 B12R1.19 O=C(O)CC1=CC(O)=C(O)C=C1 AM20020093 [1,0,0,0,1,0|1,0,0]=3 90 B12R1.438 COC1=CC=CC(CC(=O)O)=C1 AM20050568 [1,0,0,0,1,0|1,0,0]=3 91 B12R1.438 COC1=CC=CC(CC(C)=O)=C1 AMY3930 [1,0,0,0,1,0|0,0,0]=2 92 B12R1.438 COC1=CC=CC(NC(C)=O)=C1 AM804096 [1,0,0,0,1,0|1,0,0]=3 93 B12R1.438 COC1=CC=CC(NC(N)=O)=C1 AMY10463 [1,0,0,0,1,0|2,0,0]=4 94 B12R1.56 CC(=O)C1=CC(CCl)=C(O)C=C1 AMY27954 [0,0,0,0,2,0|2,0,0]=4 95 B12R1.56 COC1=C(Br)C=CC(C(=O)O)=C1 AM84179 [0,0,0,0,2,0|2,0,0]=4 96 B12R1.56 COC1=C(Br)C=CC(C(C)=O)=C1 AMY28181 [0,0,0,0,2,0|1,0,0]=3 97 B12R1.56 COC1=C(C)C=CC(C(=O)O)=C1 AM20061093 [0,0,0,0,2,0|2,0,0]=4 98 B12R1.56 COC1=C(Cl)C=CC(C(=O)O)=C1 AM20041251 [0,0,0,0,2,0|2,0,0]=4 99 B12R1.56 COC1=C(F)C=CC(C(=O)O)=C1 AM20041220 [0,0,0,0,2,0|2,0,0]=4 100 B12R1.56 COC1=C(F)C=CC(C(C)=O)=C1 AM20080776 [0,0,0,0,2,0|1,0,0]=3 101 B12R1.56 COC1=C(N)C=CC(C(=O)O)=C1 AM20060572 [0,0,0,0,2,0|2,0,0]=4 102 B12R1.56 COC1=C(O)C=CC(C(=O)O)=C1 AM20050239 [0,0,0,0,2,0|1,0,0]=3 103 B12R1.56 COC1=C(O)C=CC(C(C)=O)=C1 AM20090774 [0,0,0,0,2,0|0,0,0]=2 104 B12R1.56 COC1=C(O)C=CC([C@H](C)O)=C1 AMY202100058 [0,0,0,0,2,0|0,0,2]=4 105 B12R1.56 COC1=C(O)C=CC([N+](=O)[O-])=C1 AM808244 [0,0,0,0,2,0|2,0,0]=4 106 B14R1.76 COC1=CC=CC(OCCC(=O)O)=C1 AMY4726 [1,0,0,0,0,1|1,0,0]=3