0 B12R1.19 O=C(O)CC1=CC=C(O)C(O)=C1 AK-45471 [1,0,0,0,0,0|2,0,1]=4 1 B12R1.20 CC(C)[C@@H](C1=CC=C(Br)C=C1)N AK684523 [1,0,0,0,0,0|3,0,0]=4 2 B12R1.20 O=C(O)C(O)C1=CC=C(O)C=C1 AK-88708 [1,0,0,0,0,0|2,0,1]=4 3 B12R1.20 OC(C([O-])=O)C1=CC=C(O)C=C1 AK104635 [1,0,0,0,0,0|2,0,1]=4 4 B12R1.225 OC1=CC=CC(C(N(C)C)C)=C1 AK-32756 [1,0,0,0,0,0|3,0,0]=4 5 B12R1.225 OC1=CC=CC([C@@H](N(C)C)C)=C1 AK-51758 [1,0,0,0,0,0|3,0,0]=4 6 B12R1.225 OC1=CC=CC([C@H](N(C)C)C)=C1 AK-36564 [1,0,0,0,0,0|3,0,0]=4 7 B12R1.367 CC[C@@H](C1=CC=C(F)C(F)=C1)N AK133446 [1,0,0,0,0,0|3,0,0]=4 8 B12R1.367 CC[C@H](C1=CC=C(F)C(F)=C1)N AK133434 [1,0,0,0,0,0|3,0,0]=4 9 B12R1.367 O=C(OC)C1=CC=C(O)C(O)=C1 AK-73115 [1,0,0,0,0,0|1,0,2]=4 10 B12R1.367 OC1=CC=C(C(CCl)=O)C=C1O AK-88433 [1,0,0,0,0,0|1,0,2]=4 11 B14R1.686 O=C(O)[C@H](O)CC1=CC=C(O)C(O)=C1 AK119798 [0,0,0,0,0,1|2,0,1]=4 12 B14R1.686 O=C([O-])C(O)CC1=CC=C(O)C(O)=C1 AK310631 [0,0,0,0,0,1|2,0,1]=4 13 B11R1.157 CC(C)CC1=CC(Br)=CC=C1 AK148389 [2,0,0,0,0,0|2,0,0]=4 14 B11R1.192 CC1=CC=C(CCN)C=C1C AK-33676 [2,0,0,0,0,0|2,0,0]=4 15 B11R1.192 CCCC1=CC=C(Br)C(F)=C1 AK-86763 [2,0,0,0,0,0|2,0,0]=4 16 B11R1.192 FC1=CC=C(CCN)C=C1F AK120581 [2,0,0,0,0,0|2,0,0]=4 17 B11R1.192 OC1=CC=C(CCN)C=C1O AK142758 [2,0,0,0,0,0|0,0,0]=2 18 B11R1.22 CCC(C1=CC=C(Br)C=C1)N AK116183 [2,0,0,0,0,0|2,0,0]=4 19 B11R1.22 CCC(C1=CC=C(O)C=C1)=O AK-44068 [2,0,0,0,0,0|0,0,2]=4 20 B11R1.22 CC[C@@H](C1=CC=C(Br)C=C1)N AK607954 [2,0,0,0,0,0|2,0,0]=4 21 B11R1.22 CC[C@@H](C1=CC=C(Cl)C=C1)N AK-53923 [2,0,0,0,0,0|2,0,0]=4 22 B11R1.22 CC[C@H](C1=CC=C(Br)C=C1)N AK172711 [2,0,0,0,0,0|2,0,0]=4 23 B11R1.22 CC[C@H](C1=CC=C(C)C=C1)N AK-93290 [2,0,0,0,0,0|2,0,0]=4 24 B11R1.22 CC[C@H](C1=CC=C(Cl)C=C1)N AK133438 [2,0,0,0,0,0|2,0,0]=4 25 B11R1.22 NC(C1=CC=C(F)C=C1)CC AK470003 [2,0,0,0,0,0|2,0,0]=4 26 B11R1.22 NC1=CC=C(C(C)CC)C=C1 AK-76838 [2,0,0,0,0,0|2,0,0]=4 27 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 AK101127 [2,0,0,0,0,0|0,0,2]=4 28 B11R1.22 NCC(O)C1=CC=C(O)C=C1 AK163650 [2,0,0,0,0,0|0,0,0]=2 29 B11R1.22 N[C@@H](C1=CC=C(F)C=C1)CC AK-42100 [2,0,0,0,0,0|2,0,0]=4 30 B11R1.22 N[C@H](C1=CC=C(F)C=C1)CC AK-42091 [2,0,0,0,0,0|2,0,0]=4 31 B11R1.22 OC1=CC=C(C(C)CN)C=C1 AK-47813 [2,0,0,0,0,0|1,0,0]=3 32 B11R1.22 OC1=CC=C([C@@H](N)CO)C=C1 AK544250 [2,0,0,0,0,0|2,0,0]=4 33 B11R1.22 OC1=CC=C([C@H](N)CO)C=C1 AK608028 [2,0,0,0,0,0|2,0,0]=4 34 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 AK110007 [2,0,0,0,0,0|2,0,0]=4 35 B11R1.36 CC(C)[C@@H](C1=CC=CC=C1)N AK-42222 [2,0,0,0,0,0|2,0,0]=4 36 B11R1.36 CC(C)[C@H](C1=CC=CC=C1)N AK-41685 [2,0,0,0,0,0|2,0,0]=4 37 B11R1.36 C[C@@H](O)[C@H](N)C1=CC=CC=C1 AK608029 [2,0,0,0,0,0|2,0,0]=4 38 B11R1.36 C[C@H](O)[C@H](N)C1=CC=CC=C1 AK608030 [2,0,0,0,0,0|2,0,0]=4 39 B11R1.36 O=C(N)C(O)C1=CC=CC=C1 AK198609 [2,0,0,0,0,0|1,0,1]=4 40 B11R1.23 CCC(C1=CC=CC(O)=C1)=O AK-45536 [2,0,0,0,0,0|0,0,2]=4 41 B11R1.23 CC[C@@H](C1=CC=CC(Br)=C1)N AK687502 [2,0,0,0,0,0|2,0,0]=4 42 B11R1.23 CC[C@@H](C1=CC=CC(F)=C1)N AK134091 [2,0,0,0,0,0|2,0,0]=4 43 B11R1.23 CC[C@H](C1=CC=CC(C)=C1)N AK134022 [2,0,0,0,0,0|2,0,0]=4 44 B11R1.23 CC[C@H](C1=CC=CC(Cl)=C1)N AK153385 [2,0,0,0,0,0|2,0,0]=4 45 B11R1.23 CC[C@H](C1=CC=CC(F)=C1)N AK-42095 [2,0,0,0,0,0|2,0,0]=4 46 B11R1.23 OC1=CC=CC(C(N)CO)=C1 AK608024 [2,0,0,0,0,0|2,0,0]=4 47 B11R1.23 OC[C@H](O)C1=CC(Cl)=CC=C1 AK-45027 [2,0,0,0,0,0|2,0,0]=4 48 B11R1.23 O[C@@H](CCl)C1=CC(Cl)=CC=C1 AK-79203 [2,0,0,0,0,0|2,0,0]=4 49 B11R1.21 C1=C(C=CC(=C1O)O)C(O)=O AK-47644 [2,0,0,0,0,0|1,0,1]=4 50 B11R1.21 CC(C1=CC=C(O)C(O)=C1)=O AK-42350 [2,0,0,0,0,0|0,0,2]=4 51 B13R1.36 CC(C)C(C1=CC=C(OC)C=C1)O AK147299 [1,1,0,0,0,0|1,0,0]=3 52 B13R1.49 CCC(=O)C1=CC(OC)=C(O)C=C1 AK-46437 [1,1,0,0,0,0|0,0,2]=4 53 B13R1.272 CCC(C)(C)C1=CC(Cl)=C(O)C=C1 AK-81675 [1,1,0,0,0,0|2,0,0]=4 54 B13R1.466 O=C(OCC)C1=CC=C(O)C(O)=C1 AK-48218 [1,1,0,0,0,0|0,0,2]=4 55 B13R2.522 N[C@H]1[C@H](C2=CC=C(F)C(F)=C2)C1 AK102386 [1,0,0,1,0,0|2,0,0]=4 56 B13R2.522 N[C@H]1[C@H](C2=CC=C(F)C(F)=C2)C1 AK144635 [1,0,0,1,0,0|2,0,0]=4 57 B13R2.522 N[C@H]1[C@H](C2=CC=C(F)C(F)=C2)C1 AK144636 [1,0,0,1,0,0|2,0,0]=4 58 B13R2.11634 OC1=C(O)C=C2C(=O)CCC2=C1 AK-49336 [1,0,0,1,0,0|0,0,2]=4