0 B14R1.41 O=C(O)[C@@H](N)C1=CC=C(F)C(OC)=C1 AK172762 [0,0,0,0,0,0|2,0,0]=2 1 B13R1.52 FC1=C(C=C(C=C1)CC(=O)O)OC AK-36387 [1,0,0,0,0,0|1,0,0]=2 2 B15R2.4239 O=C(O)C(C1=CC=C2OCCC2=C1)O AK122481 [0,0,0,1,0,0|1,0,0]=2 3 B15R2.4239 O=C(O)C(N)C1=CC=C2OCOC2=C1 AK-78935 [0,0,0,1,0,0|1,0,0]=2 4 B12R1.56 BrC1=C(C=C(C(=O)O)C=C1)OC AK-35652 [2,0,0,0,0,0|1,0,1]=4 5 B12R1.56 C1=C(C(=CC=C1C(O)=O)N)OC AK-24762 [2,0,0,0,0,0|1,0,1]=4 6 B12R1.56 C1=C(OC)C(=CC=C1C(O)=O)O AK-32998 [2,0,0,0,0,0|0,0,1]=3 7 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)F AK-36487 [2,0,0,0,0,0|1,0,1]=4 8 B12R1.56 FC1=C(C=C(C=C1)B(O)O)OC AK-39808 [2,0,0,0,0,0|2,0,0]=4 9 B12R1.56 O=C(O)C1=CC=C(C)C(OC)=C1 AK-36196 [2,0,0,0,0,0|1,0,1]=4 10 B12R1.56 O=C(O)C1=CC=C(Cl)C(OC)=C1 AK-36584 [2,0,0,0,0,0|1,0,1]=4 11 B12R1.56 OC1=CC=C([N+]([O-])=O)C=C1OC AK-29154 [2,0,0,0,0,0|1,0,1]=4 12 B12R1.286 OC1=CC=C(CCN)C=C1OC AK139276 [2,0,0,0,0,0|1,0,1]=4 13 B12R1.435 COC1=CC([C@H](N)CO)=CC=C1 AK544247 [2,0,0,0,0,0|1,0,1]=4 14 B12R1.435 O=C(C1=CC=CC(OC)=C1)C=O AK-10036 [2,0,0,0,0,0|0,0,2]=4 15 B12R1.19 BrC1=C(C=C(C=C1)CC(=O)O)F AK-36941 [2,0,0,0,0,0|2,0,0]=4 16 B12R1.19 BrC1=C(C=CC(=C1)CC(=O)O)F AK-33922 [2,0,0,0,0,0|2,0,0]=4 17 B12R1.19 C1=C(C=CC(=C1Cl)Cl)CC(O)=O AK-47326 [2,0,0,0,0,0|2,0,0]=4 18 B12R1.19 CC(NC1=CC=C(O)C(C)=C1)=O AK147875 [2,0,0,0,0,0|2,0,0]=4 19 B12R1.19 CC1=C(F)C=C(CC(O)=O)C=C1 AK-34427 [2,0,0,0,0,0|2,0,0]=4 20 B12R1.19 NC1=C(F)C=C(CC(O)=O)C=C1 AK-35348 [2,0,0,0,0,0|2,0,0]=4 21 B12R1.19 O=C(O)CC1=CC=C(Br)C(C)=C1 AK-94397 [2,0,0,0,0,0|1,0,0]=3 22 B12R1.19 O=C(O)CC1=CC=C(Cl)C(Br)=C1 AK119698 [2,0,0,0,0,0|2,0,0]=4 23 B12R1.19 O=C(O)CC1=CC=C(Cl)C(F)=C1 AK-39619 [2,0,0,0,0,0|2,0,0]=4 24 B12R1.19 O=C(O)CC1=CC=C(N)C(C)=C1 AK151433 [2,0,0,0,0,0|1,0,0]=3 25 B12R1.19 O=C(O)CC1=CC=C(O)C(F)=C1 AK-35250 [2,0,0,0,0,0|1,0,0]=3 26 B12R1.19 O=C(O)CC1=CC=C(O)C(O)=C1 AK-45471 [2,0,0,0,0,0|0,0,0]=2 27 B12R1.19 OC(=O)CC1=CC(Br)=C(O)C=C1 AK-34961 [2,0,0,0,0,0|1,0,0]=3 28 B12R1.19 OC(=O)CC1=CC(F)=C(F)C=C1 AK-41956 [2,0,0,0,0,0|2,0,0]=4 29 B12R1.438 O=C(O)CC1=CC(OC)=NC=C1 AK103183 [2,0,0,0,0,0|1,0,0]=3 30 B12R1.438 O=C(O)CC1=CC=CC(C=O)=C1 AK148333 [2,0,0,0,0,0|2,0,0]=4 31 B12R1.438 O=C(O)CC1=CC=CC(OC)=C1 AK-46642 [2,0,0,0,0,0|0,0,0]=2 32 B12R1.438 OC(=O)CC1=CC(=CC=C1)C#N AK-87994 [2,0,0,0,0,0|2,0,0]=4 33 B12R1.20 CC(C1=CC=C(C)C=C1)C(O)=O AK-36931 [2,0,0,0,0,0|2,0,0]=4 34 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Br AK-36176 [2,0,0,0,0,0|2,0,0]=4 35 B12R1.20 NC(C(O)=O)C1=CC=C(O)C=C1 AK-44146 [2,0,0,0,0,0|1,0,0]=3 36 B12R1.20 O=C(O)C(N)C1=CC=C(C)C=C1 AK-44517 [2,0,0,0,0,0|2,0,0]=4 37 B12R1.20 O=C(O)C(N)C1=CC=C(Cl)C=C1 AK-47447 [2,0,0,0,0,0|2,0,0]=4 38 B12R1.20 O=C(O)C(O)C1=CC=C(O)C=C1 AK-88708 [2,0,0,0,0,0|0,0,0]=2 39 B12R1.20 O=C(O)[C@@H](N)C1=CC=C(Cl)C=C1 AK-45149 [2,0,0,0,0,0|2,0,0]=4 40 B12R1.20 O=C(O)[C@@H](N)C1=CC=C(F)C=C1 AK-33958 [2,0,0,0,0,0|2,0,0]=4 41 B12R1.20 O=C(O)[C@@H](N)C1=CC=C(O)C=C1 AK-28583 [2,0,0,0,0,0|1,0,0]=3 42 B12R1.20 O=C(O)[C@H](C1=CC=C(Cl)C=C1)O AK-87117 [2,0,0,0,0,0|1,0,0]=3 43 B12R1.20 O=C(O)[C@H](N)C1=CC=C(Cl)C=C1 AK-44673 [2,0,0,0,0,0|2,0,0]=4 44 B12R1.20 O=C(O)[C@H](N)C1=CC=C(F)C=C1 AK-45454 [2,0,0,0,0,0|2,0,0]=4 45 B12R1.20 O=C(O)[C@H](N)C1=CC=C(F)C=C1 AK-50779 [2,0,0,0,0,0|2,0,0]=4 46 B12R1.20 O=C(O)[C@H](N)C1=CC=C(N)C=C1 AK484894 [2,0,0,0,0,0|2,0,0]=4 47 B12R1.20 O=C(O)[C@H](N)C1=CC=C(O)C=C1 AK-76523 [2,0,0,0,0,0|1,0,0]=3 48 B12R1.20 OC(C([O-])=O)C1=CC=C(O)C=C1 AK104635 [2,0,0,0,0,0|0,0,1]=3 49 B12R1.225 CC(C(O)=O)C1=CC=CC(Cl)=C1 AK-59290 [2,0,0,0,0,0|2,0,0]=4 50 B12R1.225 O=C(O)C(N)C1=CC=CC(Br)=C1 AK-94158 [2,0,0,0,0,0|2,0,0]=4 51 B12R1.225 O=C(O)C(N)C1=CC=CC(Cl)=C1 AK-45445 [2,0,0,0,0,0|2,0,0]=4 52 B12R1.225 O=C(O)C(N)C1=CC=CC(N)=C1 AK158805 [2,0,0,0,0,0|2,0,0]=4 53 B12R1.225 O=C(O)[C@H](N)C1=CC=CC(Cl)=C1 AK167541 [2,0,0,0,0,0|2,0,0]=4 54 B14R1.1864 O=C(C1=CC=C(OC)C(OC)=C1)C=O AK-10012 [1,1,0,0,0,0|0,0,2]=4 55 B14R1.3651 C1=CC(=CC(=C1OC)OC)CC(O)=O AK-26456 [1,1,0,0,0,0|0,0,0]=2 56 B14R1.3651 CC(CC1=CC=C(OC)C(OC)=C1)=O AK117208 [1,1,0,0,0,0|1,0,0]=3 57 B16R1.4273 O=C(O)CC(N)C1=CC=C(OC)C(OC)=C1 AK-45959 [0,1,0,0,0,1|1,0,0]=3 58 B16R1.4274 O=C(O)[C@@H](N)CC1=CC=C(OC)C(OC)=C1 AK-41629 [0,1,0,0,0,1|1,0,0]=3 59 B16R1.10272 O=C(O)[C@@H](N)C1=CC=C(OC)C(OCC)=C1 AK677785 [0,2,0,0,0,0|1,0,0]=3 60 B14R2.966 C1OC2=C(O1)C=C(C=C2)C(=O)C=O AK-10011 [1,0,0,1,0,0|0,0,2]=4 61 B14R2.1008 O=C(O)CC1=CC=C2OCOC2=C1 AK153075 [1,0,0,1,0,0|0,0,0]=2 62 B16R2.11587 O=C(O)C[C@@H](N)C1=CC=C2OCOC2=C1 AK670787 [0,0,0,1,0,1|1,0,0]=3 63 B16R2.6284 O=C(O)C(N)C1=CC=C2OCCOC2=C1 AK-78934 [0,1,0,1,0,0|1,0,0]=3 64 B14R1.42 C1=C(C=CC(O)=O)C=CC(=C1OC)O AK-32258 [1,0,0,0,0,1|0,0,1]=3 65 B14R1.42 C1=C(C=CC(O)=O)C=CC(=C1OC)O AK-49078 [1,0,0,0,0,1|0,0,1]=3 66 B14R1.42 COC1=C(O)C=CC(C=CC([O-])=O)=C1 AK111293 [1,0,0,0,0,1|0,0,2]=4 67 B14R1.42 O=C(O)CCC1=CC=C(O)C(OC)=C1 AK113150 [1,0,0,0,0,1|0,0,0]=2 68 B14R1.685 O=C(O)C[C@@H](N)C1=CC=C(C)C(C)=C1 AK608044 [1,0,0,0,0,1|2,0,0]=4 69 B14R1.74 O=C(O)CC(N)C1=CC=CC(OC)=C1 AK124267 [1,0,0,0,0,1|1,0,0]=3 70 B14R1.75 N[C@H](CC1=CC=CC(OC)=C1)C(O)=O AK-41418 [1,0,0,0,0,1|1,0,0]=3 71 B14R1.75 O=C(O)[C@@H](N)CC1=CC=CC(OC)=C1 AK-41641 [1,0,0,0,0,1|1,0,0]=3