0 B14R1.623 CCOC(=O)C1=CC=CC=C1B(O)O AC-28693 [0,0,0,0,0,0|1,0,1]=2 1 B13R1.464 CCOC(=O)C1=C(CBr)N=CC=C1 AC-82026 [1,0,0,0,0,0|2,0,1]=4 2 B13R1.464 CCOC(=O)C1=C(CO)N=CC=C1 AC-88085 [1,0,0,0,0,0|1,0,1]=3 3 B13R1.464 CCOC(=O)C1=CC=CC=C1C#N AC-38357 [1,0,0,0,0,0|1,0,1]=3 4 B13R1.464 CCOC(=O)C1=CC=CC=C1C=O AC-29071 [1,0,0,0,0,0|0,0,0]=1 5 B13R1.464 CCOC(=O)C1=CC=CC=C1CBr AC-28931 [1,0,0,0,0,0|1,0,1]=3 6 B13R1.464 CCOC(=O)C1=CN=CC=C1CBr AC-93475 [1,0,0,0,0,0|2,0,1]=4 7 B13R1.464 CCOC(=O)C1=CN=CC=C1CCl AC-86226 [1,0,0,0,0,0|2,0,1]=4 8 B13R1.464 CCOC(=O)C1=CN=CC=C1OC AC-92420 [1,0,0,0,0,0|3,0,0]=4 9 B13R1.547 COC(=O)C1=C([N+](=O)[O-])C=NC=C1 AC-80031 [1,0,0,0,0,0|2,0,1]=4 10 B13R1.547 COC(=O)C1=CC=CC=C1B(O)O AC-20775 [1,0,0,0,0,0|1,0,1]=3 11 B13R1.547 COC(=O)C1=CC=CC=C1C(F)F AC-92392 [1,0,0,0,0,0|2,0,1]=4 12 B13R1.547 NCC(=O)C1=CC=CC=C1[N+](=O)[O-] AC-88972 [1,0,0,0,0,0|2,0,1]=4 13 B13R1.572 CCCOC1=CC=CC=C1C(=O)O AC-21357 [1,0,0,0,0,0|2,0,0]=3 14 B13R1.572 NCCNC1=CC=CC=C1C(=O)O AC-88168 [1,0,0,0,0,0|3,0,0]=4 15 B15R1.765 CCOC(=O)C1=CC(Br)=CC=C1[N+](=O)[O-] AC-86428 [0,1,0,0,0,0|1,0,1]=3 16 B15R1.811 CCOC(=O)C1=CC=CC=C1S(N)(=O)=O AC-15043 [0,1,0,0,0,0|1,0,1]=3 17 B15R1.10569 CCOC(=O)C1=CC=C(Cl)C=C1B(O)O AC-20698 [0,1,0,0,0,0|1,0,1]=3 18 B15R2.61345 O=C(O)C1=CC=CC2=C1C(=O)NC=N2 AC-87920 [0,0,0,1,0,0|2,0,1]=4 19 B13R1.467 CCOC(=O)C1=C(B(O)O)C=CO1 AC-89222 [0,0,0,0,1,0|2,0,1]=4 20 B13R1.467 CCOC(=O)C1=C(C(=O)O)N=NS1 AC-87468 [0,0,0,0,1,0|3,0,0]=4 21 B15R1.810 CCOC(=O)C1=CC=CC=C1OC(C)=O AC-86714 [0,0,0,0,0,1|1,0,0]=2 22 B12R1.77 C=CC1=C(C(=O)OC)C=CC=N1 AC-87511 [2,0,0,0,0,0|2,0,0]=4 23 B12R1.77 CNC(=O)C1=CC=CC=C1CO AC-72552 [2,0,0,0,0,0|1,0,1]=4 24 B12R1.77 COC(=O)C1=C(C=O)N=CC=C1 AC-93870 [2,0,0,0,0,0|1,0,0]=3 25 B12R1.77 COC(=O)C1=C(CO)N=CC=C1 AC-93165 [2,0,0,0,0,0|1,0,1]=4 26 B12R1.77 COC(=O)C1=CC=CC=C1C#N AC-30863 [2,0,0,0,0,0|1,0,1]=4 27 B12R1.77 COC(=O)C1=CC=CC=C1C=O AC-30943 [2,0,0,0,0,0|0,0,0]=2 28 B12R1.77 COC(=O)C1=CC=CC=C1CBr AC-16768 [2,0,0,0,0,0|1,0,1]=4 29 B12R1.77 COC(=O)C1=NC=CC=C1C=O AC-30956 [2,0,0,0,0,0|1,0,0]=3 30 B12R1.308 CCCC(=O)C1=CC=CC=C1O AC-65621 [2,0,0,0,0,0|1,0,0]=3 31 B12R1.308 CCOC(=O)C1=C(Br)C=NC=C1 AC-89087 [2,0,0,0,0,0|2,0,0]=4 32 B12R1.308 CCOC(=O)C1=C(Br)N=CC=C1 AC-28935 [2,0,0,0,0,0|2,0,0]=4 33 B12R1.308 CCOC(=O)C1=C(F)N=CC=C1 AC-81837 [2,0,0,0,0,0|2,0,0]=4 34 B12R1.308 CCOC(=O)C1=C(O)C=NC=C1 AC-90992 [2,0,0,0,0,0|1,0,0]=3 35 B12R1.308 CCOC(=O)C1=C(O)N=CN=C1 AC-29106 [2,0,0,0,0,0|2,0,0]=4 36 B12R1.308 CCOC(=O)C1=C(O)N=CN=C1 AC-77097 [2,0,0,0,0,0|2,0,0]=4 37 B12R1.308 CCOC(=O)C1=CC=CC=C1Cl AC-76785 [2,0,0,0,0,0|1,0,0]=3 38 B12R1.308 CCOC(=O)C1=CC=CC=C1F AC-29063 [2,0,0,0,0,0|1,0,0]=3 39 B12R1.308 CCOC(=O)C1=CC=CC=C1I AC-86721 [2,0,0,0,0,0|1,0,0]=3 40 B12R1.308 CCOC(=O)C1=CC=NN=C1O AC-40969 [2,0,0,0,0,0|2,0,0]=4 41 B12R1.308 CCOC(=O)C1=CN=CC=C1Cl AC-79867 [2,0,0,0,0,0|2,0,0]=4 42 B12R1.308 CCOC(=O)C1=CNC=CC1=O AC-83373 [2,0,0,0,0,0|1,0,0]=3 43 B12R1.308 CCOC(=O)C1=NC=CC=C1Br AC-87754 [2,0,0,0,0,0|2,0,0]=4 44 B12R1.308 CCOC(=O)C1=NC=CC=C1F AC-92242 [2,0,0,0,0,0|2,0,0]=4 45 B12R1.261 CC(=O)C1=CC=CC=C1[N+](=O)[O-] AC-14552 [2,0,0,0,0,0|1,0,1]=4 46 B12R1.261 CC(N)C1=CC=CC=C1C(=O)O AC-93155 [2,0,0,0,0,0|1,0,1]=4 47 B12R1.261 CN(C)C1=CC=CC=C1C(=O)O AC-85402 [2,0,0,0,0,0|2,0,0]=4 48 B12R1.261 O=C(O)C1=CC=CC=C1I(=O)=O AC-61145 [2,0,0,0,0,0|1,0,1]=4 49 B12R1.261 O=C(O)C1=CC=CC=C1[N+](=O)[O-] AC-23853 [2,0,0,0,0,0|1,0,1]=4 50 B12R1.261 O=C(O)C1=CC=CN=C1C(=O)O AC-11200 [2,0,0,0,0,0|1,0,0]=3 51 B12R1.283 CCOC1=C(C(=O)O)C=CN=C1 AC-83005 [2,0,0,0,0,0|1,0,0]=3 52 B12R1.283 CCOC1=CC=CC=C1B(O)O AC-20711 [2,0,0,0,0,0|1,0,1]=4 53 B12R1.283 CCOC1=CC=CC=C1C(=N)N AC-19178 [2,0,0,0,0,0|2,0,0]=4 54 B12R1.283 CCOC1=CC=CC=C1C(=O)O AC-14204 [2,0,0,0,0,0|0,0,0]=2 55 B12R1.283 CCOC1=CC=CC=C1C(=O)O AC-23504 [2,0,0,0,0,0|0,0,0]=2 56 B12R1.283 COCC1=CC=CC=C1C(=O)O AC-80472 [2,0,0,0,0,0|0,0,1]=3 57 B14R1.263 CCOC(=O)C1=CC=CC=C1CC#N AC-44483 [1,1,0,0,0,0|1,0,1]=4 58 B14R1.599 CCOC(=O)C1=CC(Br)=CC=C1C=O AC-94676 [1,1,0,0,0,0|0,0,0]=2 59 B14R1.7276 CCOC(=O)C1=C(C)C=CC=C1CBr AC-83359 [1,1,0,0,0,0|1,0,1]=4 60 B14R1.707 COC(=O)C1=CC(Br)=CC=C1[N+](=O)[O-] AC-25343 [1,1,0,0,0,0|1,0,1]=4 61 B14R1.707 COC(=O)C1=CC(C)=CC=C1B(O)O AC-30183 [1,1,0,0,0,0|1,0,1]=4 62 B14R1.746 COC(=O)C1=CC=CN=C1C(=O)OC AC-63759 [1,1,0,0,0,0|1,0,0]=3 63 B14R1.1126 COC(=O)C1=CC=C(Br)C=C1[N+](=O)[O-] AC-83877 [1,1,0,0,0,0|1,0,1]=4 64 B14R1.1153 COC(=O)C1=CC=CC(C)=C1[N+](=O)[O-] AC-31162 [1,1,0,0,0,0|1,0,1]=4 65 B16R1.13671 CCCC(=O)NC1=CC=C(Br)C=C1C(=O)O AC-81925 [0,1,0,0,0,1|1,0,0]=3 66 B16R1.13671 CCOC(=O)CC1=CC=C(Br)C=C1[N+](=O)[O-] AC-28937 [0,1,0,0,0,1|1,0,1]=4 67 B16R1.4547 CC(C)COC(=O)C1=CC=CC=C1B(O)O AC-95401 [0,2,0,0,0,0|1,0,1]=4 68 B14R1.32 CCOC(=O)\C=C\C1=CC=CC(N)=C1 AC-84634 [0,0,1,1,0,0|2,0,0]=4 69 B14R2.11635 O=CC1=CC=CC2=C1C(=O)N=CC2 AC-75803 [1,0,0,1,0,0|1,0,1]=4 70 B14R2.11635 O=CC1=CC=CC2=C1C(=O)NCC2 AC-93678 [1,0,0,1,0,0|1,0,0]=3 71 B14R2.24350 NC(=O)C1=CC=CC2=C1C(=O)NC2 AC-95364 [1,0,0,1,0,0|2,0,0]=4 72 B14R2.24350 O=C(O)C1=CC=CC2=C1C(=O)NC2 AC-96275 [1,0,0,1,0,0|1,0,0]=3 73 B14R2.4 CN1N=CC2=C1C=CC=C2C(=O)O AC-44381 [1,0,0,1,0,0|2,0,0]=4 74 B14R2.31359 O=C(O)C1=C2CCCCC2=CC=C1 AC-14660 [1,0,0,1,0,0|1,0,1]=4 75 B16R2.29743 CCOC(=O)C1=C2N=C(Cl)OC2=CC=C1 AC-88958 [0,0,0,1,0,1|1,0,0]=3 76 B16R2.29743 CCOC(=O)C1=C2SC(N)=NC2=CC=C1 AC-85045 [0,0,0,1,0,1|2,0,0]=4 77 B16R2.29743 CCOC(=O)C1=CC=CC2=C1NC(=O)C2 AC-87466 [0,0,0,1,0,1|1,0,0]=3 78 B16R2.154585 CCOC(=O)C1NC(=O)C2=C1C=CC=C2 AC-89957 [0,0,0,1,0,1|1,0,0]=3 79 B16R2.154585 CCOC(=O)N1NC(=O)C2=C1C=CC=C2 AC-92506 [0,0,0,1,0,1|1,0,0]=3 80 B12R1.316 CCOC(=O)C1=CSC=C1C=O AC-91341 [1,0,0,0,1,0|1,0,0]=3 81 B14R1.965 CCOC(=O)CC1=CC=CC=C1C#N AC-81033 [1,0,0,0,0,1|1,0,1]=4 82 B14R1.617 CCOC(=O)C1=CC(B(O)O)=CC=C1 AC-20733 [0,0,0,0,1,1|1,0,1]=4 83 B14R1.617 CCOC(=O)C1=CC(C(=O)O)=CN=C1 AC-80426 [0,0,0,0,1,1|1,0,0]=3 84 B14R1.617 CCOC(=O)C1=CC(C(N)=O)=NC=C1 AC-84515 [0,0,0,0,1,1|2,0,0]=4 85 B14R1.617 CCOC(=O)C1=CC=CC(C(=O)O)=N1 AC-57743 [0,0,0,0,1,1|0,0,0]=2 86 B14R1.617 CCOC(=O)C1=CC=CC(C(C)=O)=C1 AC-81974 [0,0,0,0,1,1|1,0,0]=3 87 B14R1.617 CCOC(=O)C1=NC=CC(C(C)=O)=C1 AC-90200 [0,0,0,0,1,1|2,0,0]=4 88 B16R1.959 CCOC(=O)C1=C(COC(C)=O)N=CC=C1 AC-76952 [0,0,0,0,0,2|2,0,0]=4 89 B16R1.4440 CCOC(=O)CCC1=CC=CC=C1[N+](=O)[O-] AC-71778 [0,0,0,0,0,2|1,0,1]=4 90 B16R1.4440 CCOC(=O)\C=C\C1=CC=CC=C1[N+](=O)[O-] AC-96609 [0,0,0,0,0,2|1,0,1]=4