0 B13R2.435 CC(=O)C1=CC2=C(C=CC=C2)N1 AC-42026 [0,0,0,0,0,0|1,0,0]=1 1 B13R2.435 CC(=O)C1=CN2C=CC=CC2=N1 AC-42758 [0,0,0,0,0,0|2,0,1]=3 2 B13R2.435 CC(=O)C1=NC2=CC=CC=C2N1 AC-14146 [0,0,0,0,0,0|2,0,0]=2 3 B13R2.435 CC(=O)C1=NC2=CC=CC=C2O1 AC-80587 [0,0,0,0,0,0|2,0,1]=3 4 B13R2.435 CC(=O)C1=NC2=CC=CC=C2S1 AC-56771 [0,0,0,0,0,0|2,0,1]=3 5 B13R2.435 CC(C)C1=CC2=C(C=CC=C2)N1 AC-76425 [0,0,0,0,0,0|2,0,1]=3 6 B13R2.435 CC(C)C1=CC2=CC=CC=C2O1 AC-89854 [0,0,0,0,0,0|3,0,1]=4 7 B13R2.435 FC(F)C1=NC2=CC=CC=C2N1 AC-57320 [0,0,0,0,0,0|3,0,1]=4 8 B13R2.435 NC(=O)C1=CC2=CC=CC=C2O1 AC-92158 [0,0,0,0,0,0|2,0,0]=2 9 B13R2.435 NC(=O)C1=CC2=CC=CN=C2N1 AC-75928 [0,0,0,0,0,0|2,0,0]=2 10 B13R2.435 NC(=O)C1=NC2=CC=CC=C2N1 AC-72400 [0,0,0,0,0,0|2,0,0]=2 11 B13R2.435 NC(=S)C1=CC2=C(C=CC=C2)N1 AC-82897 [0,0,0,0,0,0|1,1,0]=2 12 B13R2.435 O=C(Cl)C1=CC2=CC=CC=C2S1 AC-24722 [0,0,0,0,0,0|2,0,0]=2 13 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)N1 AC-10156 [0,0,0,0,0,0|0,0,0]=0 14 B13R2.435 O=C(O)C1=CC2=C(C=NC=C2)N1 AC-75931 [0,0,0,0,0,0|1,0,0]=1 15 B13R2.435 O=C(O)C1=CC2=C(C=NC=C2)S1 AC-89762 [0,0,0,0,0,0|2,0,0]=2 16 B13R2.435 O=C(O)C1=CC2=CC=CC=C2O1 AC-24717 [0,0,0,0,0,0|1,0,0]=1 17 B13R2.435 O=C(O)C1=CC2=CC=CC=C2S1 AC-16567 [0,0,0,0,0,0|1,0,0]=1 18 B13R2.435 O=C(O)C1=CC2=CC=CN=C2N1 AC-43631 [0,0,0,0,0,0|1,0,0]=1 19 B13R2.435 O=C(O)C1=CC2=CC=CN=C2S1 AC-73357 [0,0,0,0,0,0|2,0,0]=2 20 B13R2.435 O=C(O)C1=CC2=NC=CC=C2N1 AC-71385 [0,0,0,0,0,0|1,0,0]=1 21 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 AC-29806 [0,0,0,0,0,0|1,0,1]=2 22 B13R2.435 O=C(O)C1=CN2C=CC=NC2=N1 AC-29821 [0,0,0,0,0,0|2,0,1]=3 23 B13R2.435 O=C(O)C1=CN2N=CC=CC2=C1 AC-86631 [0,0,0,0,0,0|3,0,0]=3 24 B13R2.435 O=C(O)C1=NC2=CC=CC=C2N1 AC-39290 [0,0,0,0,0,0|1,0,0]=1 25 B13R2.435 O=C(O)C1=NN2C=CC=NC2=N1 AC-51046 [0,0,0,0,0,0|3,0,1]=4 26 B13R2.435 O=C(O)C1CC2=CC=CC=C2O1 AC-28056 [0,0,0,0,0,0|1,0,2]=3 27 B13R2.435 O=C(O)[C@@H]1CC2=C(C=CC=C2)N1 AC-13205 [0,0,0,0,0,0|0,0,2]=2 28 B13R2.435 OB(O)C1=CC2=CC=CC=C2O1 AC-16386 [0,0,0,0,0,0|2,0,1]=3 29 B13R2.435 OB(O)C1=CC2=CC=CC=C2S1 AC-20951 [0,0,0,0,0,0|2,0,1]=3 30 B12R2.32 CCC1=CC2=C(C=CC=C2)N1 AC-29123 [1,0,0,0,0,0|1,0,1]=3 31 B12R2.32 CCC1=NC2=CC=CC=C2N1 AC-28893 [1,0,0,0,0,0|2,0,1]=4 32 B12R2.32 ClCC1=CC2=CC=CC=C2O1 AC-89497 [1,0,0,0,0,0|2,0,1]=4 33 B12R2.32 ClCC1=NC2=CC=CC=C2N1 AC-10930 [1,0,0,0,0,0|2,0,1]=4 34 B12R2.32 N#CC1=CC2=C(C=CC=C2)N1 AC-79437 [1,0,0,0,0,0|1,0,1]=3 35 B12R2.32 N#CC1=CC2=CC=CC=C2O1 AC-77118 [1,0,0,0,0,0|2,0,1]=4 36 B12R2.32 N#CC1=CC2=CC=CC=C2S1 AC-24721 [1,0,0,0,0,0|2,0,1]=4 37 B12R2.32 NCC1=CC2=C(C=CC=C2)N1 AC-29880 [1,0,0,0,0,0|1,0,1]=3 38 B12R2.32 NCC1=CC2=C(C=CN=C2)N1 AC-89665 [1,0,0,0,0,0|2,0,1]=4 39 B12R2.32 NCC1=CC2=CC=CC=C2O1 AC-58746 [1,0,0,0,0,0|2,0,1]=4 40 B12R2.32 NCC1=CC2=CC=CC=C2S1 AC-85674 [1,0,0,0,0,0|2,0,1]=4 41 B12R2.32 NCC1=CC2=CC=CN=C2N1 AC-87375 [1,0,0,0,0,0|2,0,1]=4 42 B12R2.32 NCC1=CC2=CC=CN=C2N1 AC-91102 [1,0,0,0,0,0|2,0,1]=4 43 B12R2.32 NCC1=CC2=CC=CN=C2N1 AC-93093 [1,0,0,0,0,0|2,0,1]=4 44 B12R2.32 NCC1=NC2=CC=CC=C2N1 AC-22719 [1,0,0,0,0,0|2,0,1]=4 45 B12R2.32 NCC1=NC2=CC=CC=C2N1 AC-39291 [1,0,0,0,0,0|2,0,1]=4 46 B12R2.32 NNC1=NC2=CC=CC=C2N1 AC-44364 [1,0,0,0,0,0|3,0,0]=4 47 B12R2.32 O=CC1=CC2=C(C=CC=C2)N1 AC-29856 [1,0,0,0,0,0|0,0,0]=1 48 B12R2.32 O=CC1=CC2=C(C=CN=C2)N1 AC-75939 [1,0,0,0,0,0|1,0,0]=2 49 B12R2.32 O=CC1=CC2=C(C=NC=C2)N1 AC-75930 [1,0,0,0,0,0|1,0,0]=2 50 B12R2.32 O=CC1=CC2=C(C=NC=C2)O1 AC-87765 [1,0,0,0,0,0|2,0,0]=3 51 B12R2.32 O=CC1=CC2=CC=CN=C2N1 AC-69430 [1,0,0,0,0,0|1,0,0]=2 52 B12R2.32 O=CC1=CC2=NC=CC=C2N1 AC-75935 [1,0,0,0,0,0|1,0,0]=2 53 B12R2.32 O=CC1=CC2=NC=CN=C2S1 AC-61097 [1,0,0,0,0,0|3,0,0]=4 54 B12R2.32 O=CC1=CN2C=CN=CC2=N1 AC-91944 [1,0,0,0,0,0|2,0,1]=4 55 B12R2.32 O=CC1=NC2=CC=CC=C2N1 AC-16560 [1,0,0,0,0,0|1,0,0]=2 56 B12R2.32 O=CC1=NC2=CC=CC=C2O1 AC-92843 [1,0,0,0,0,0|1,0,1]=3 57 B12R2.32 O=CC1=NC2=NC=CC=C2N1 AC-29805 [1,0,0,0,0,0|2,0,0]=3 58 B12R2.32 OCC1=CC2=C(C=CC=C2)N1 AC-29866 [1,0,0,0,0,0|0,0,1]=2 59 B12R2.32 OCC1=CC2=C(C=NC=C2)N1 AC-75400 [1,0,0,0,0,0|1,0,1]=3 60 B12R2.32 OCC1=CC2=CC=CN=C2S1 AC-75596 [1,0,0,0,0,0|2,0,1]=4 61 B12R2.32 OCC1=CN2C=CC=CC2=N1 AC-42220 [1,0,0,0,0,0|1,0,2]=4 62 B12R2.32 OCC1=NC2=CC=CC=C2O1 AC-79415 [1,0,0,0,0,0|1,0,2]=4 63 B12R2.32 OCC1=NC2=CC=CN=C2N1 AC-56584 [1,0,0,0,0,0|2,0,1]=4 64 B14R2.450 CC1=C(B(O)O)OC2=CC=CC=C21 AC-91554 [0,1,0,0,0,0|2,0,1]=4 65 B14R2.450 CC1=C(C(=O)O)SC2=CC=CC=C21 AC-30698 [0,1,0,0,0,0|1,0,0]=2 66 B14R2.450 CN1C(B(O)O)=CC2=C1C=CC=C2 AC-21516 [0,1,0,0,0,0|1,0,1]=3 67 B14R2.450 CN1C(C(=O)O)=CC2=C1C=CC=C2 AC-21416 [0,1,0,0,0,0|0,0,0]=1 68 B14R2.450 NC(=O)C1=C(Cl)C2=CC=CC=C2S1 AC-93714 [0,1,0,0,0,0|2,0,0]=3 69 B14R2.450 NC1=C(C(=O)O)OC2=NC=CC=C21 AC-85612 [0,1,0,0,0,0|2,0,0]=3 70 B14R2.450 NC1=C([N+](=O)[O-])OC2=CC=CC=C21 AC-82290 [0,1,0,0,0,0|2,0,1]=4 71 B14R2.450 O=C(Cl)C1=C(Cl)C2=CC=CC=C2S1 AC-19300 [0,1,0,0,0,0|2,0,0]=3 72 B14R2.450 O=C(O)C1=C(Cl)C2=CC=CC=C2O1 AC-87110 [0,1,0,0,0,0|1,0,0]=2 73 B14R2.450 O=C(O)C1=C(Cl)C2=CC=CC=C2S1 AC-19301 [0,1,0,0,0,0|1,0,0]=2 74 B14R2.450 O=C(O)C1=C(I)C2=CC=CC=C2S1 AC-82584 [0,1,0,0,0,0|1,0,0]=2 75 B14R2.450 O=C(O)C1=NN2C=CC=CC2=C1Cl AC-92558 [0,1,0,0,0,0|1,0,1]=3 76 B14R2.972 COC(=O)C1=CC2=C(C=CC=C2)N1 AC-14984 [0,1,0,0,0,0|0,0,0]=1 77 B14R2.972 COC(=O)C1=CC2=CC=CC=C2S1 AC-30696 [0,1,0,0,0,0|1,0,0]=2 78 B14R2.972 COC(=O)C1=CC2=CC=CN=C2N1 AC-69409 [0,1,0,0,0,0|1,0,0]=2 79 B14R2.972 COC(=O)C1=NC2=CC=CC=C2O1 AC-86805 [0,1,0,0,0,0|1,0,1]=3 80 B14R2.972 COC(=O)C1=NN2C=CC=CC2=N1 AC-88625 [0,1,0,0,0,0|2,0,1]=4 81 B14R2.972 NNC(=O)C1=CC2=CC=CN=C2N1 AC-85630 [0,1,0,0,0,0|2,0,0]=3 82 B14R2.972 NNC(=O)C1=NC2=CC=CC=C2O1 AC-93171 [0,1,0,0,0,0|2,0,1]=4 83 B14R2.972 NNC(=O)C1=NN2C=CC=CC2=C1 AC-88230 [0,1,0,0,0,0|2,0,1]=4 84 B14R2.3129 CC(C)(C)C1=CC2=C(C=CC=C2)N1 AC-73347 [0,1,0,0,0,0|2,0,1]=4 85 B14R2.3129 CC(C)(O)C1=CC2=CC=CC=C2O1 AC-85691 [0,1,0,0,0,0|2,0,1]=4 86 B14R2.3129 O=S(=O)(Cl)C1=CC2=CC=CC=C2O1 AC-34295 [0,1,0,0,0,0|2,0,1]=4 87 B14R2.3129 O=S(=O)(Cl)C1=CC2=CC=CC=C2S1 AC-34097 [0,1,0,0,0,0|2,0,1]=4 88 B14R2.3129 O=S(=O)(Cl)C1=NC2=CC=CC=C2N1 AC-81968 [0,1,0,0,0,0|2,0,1]=4 89 B14R2.4529 CC(=O)C1=CC2=C(C=C(F)C=C2)N1 AC-93534 [0,1,0,0,0,0|1,0,0]=2 90 B14R2.4529 CC(=O)C1=CC2=C(C=CC(Br)=C2)N1 AC-93634 [0,1,0,0,0,0|1,0,0]=2 91 B14R2.4529 CC(=O)C1=CC2=C(C=CC(F)=C2)N1 AC-93533 [0,1,0,0,0,0|1,0,0]=2 92 B14R2.4529 CC1=CC2=C(C=C1)C=C(B(O)O)N2 AC-90591 [0,1,0,0,0,0|1,0,1]=3 93 B14R2.4529 CC1=CC2=C(C=C1)C=C(C(=O)O)N2 AC-31073 [0,1,0,0,0,0|0,0,0]=1 94 B14R2.4529 CC1=CC2=C(C=C1)C=C(C(=O)O)N2 AC-39599 [0,1,0,0,0,0|0,0,0]=1 95 B14R2.4529 CC1=CC2=C(C=C1)NC(C(=O)O)=C2 AC-31077 [0,1,0,0,0,0|0,0,0]=1 96 B14R2.4529 CC1=CC2=NC(C(=O)O)=CN2C=C1 AC-42641 [0,1,0,0,0,0|1,0,1]=3 97 B14R2.4529 CC1=CC=C2SC(C(=O)O)=CC2=C1 AC-95095 [0,1,0,0,0,0|1,0,0]=2 98 B14R2.4529 NC(=O)C1=CC2=C(C=C(Br)C=C2)N1 AC-91201 [0,1,0,0,0,0|1,0,0]=2 99 B14R2.4529 NC(=O)C1=CC2=C(C=CC(Cl)=C2)N1 AC-83308 [0,1,0,0,0,0|1,0,0]=2 100 B14R2.4529 O=C(O)C1=CC2=C(C=C(Cl)N=C2)N1 AC-26862 [0,1,0,0,0,0|1,0,0]=2 101 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=C2)N1 AC-10119 [0,1,0,0,0,0|0,0,0]=1 102 B14R2.4529 O=C(O)C1=CC2=C(C=CC(O)=C2)N1 AC-11259 [0,1,0,0,0,0|0,0,0]=1 103 B14R2.4529 O=C(O)C1=CC2=C(C=NC(Br)=C2)N1 AC-33793 [0,1,0,0,0,0|1,0,0]=2 104 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CC=C2O1 AC-58692 [0,1,0,0,0,0|1,0,0]=2 105 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CN=C2N1 AC-69449 [0,1,0,0,0,0|1,0,0]=2 106 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CN=C2S1 AC-88573 [0,1,0,0,0,0|2,0,0]=3 107 B14R2.4529 O=C(O)C1=CC2=CC(Cl)=CC=C2S1 AC-73067 [0,1,0,0,0,0|1,0,0]=2 108 B14R2.4529 O=C(O)C1=CC2=CC(Cl)=CN=C2N1 AC-35435 [0,1,0,0,0,0|1,0,0]=2 109 B14R2.4529 O=C(O)C1=CC2=CC=C(Br)C=C2O1 AC-91929 [0,1,0,0,0,0|1,0,0]=2 110 B14R2.4529 O=C(O)C1=CC2=CC=C(Cl)C=C2O1 AC-83235 [0,1,0,0,0,0|1,0,0]=2 111 B14R2.4529 O=C(O)C1=CC2=NC(Cl)=CC=C2N1 AC-71213 [0,1,0,0,0,0|1,0,0]=2 112 B14R2.4529 O=C(O)C1=CN2C=C(Br)N=CC2=N1 AC-67332 [0,1,0,0,0,0|2,0,1]=4 113 B14R2.4529 O=C(O)C1=CN2C=CC(Br)=CC2=N1 AC-67350 [0,1,0,0,0,0|1,0,1]=3 114 B14R2.4529 O=C(O)C1=NC2=CC(Cl)=CC=C2N1 AC-49673 [0,1,0,0,0,0|1,0,0]=2 115 B14R2.4529 O=C(O)C1=NC2=CC(Cl)=CC=C2S1 AC-91083 [0,1,0,0,0,0|1,0,1]=3 116 B14R2.4529 O=C(O)C1=NC2=CC(F)=CC=C2O1 AC-92570 [0,1,0,0,0,0|1,0,1]=3 117 B14R2.4529 O=C(O)C1CC2=CC(Br)=CC=C2O1 AC-96816 [0,1,0,0,0,0|1,0,2]=4 118 B14R2.4529 O=C([O-])C1=NC2=CC(Cl)=CC=C2S1 AC-87297 [0,1,0,0,0,0|1,0,2]=4 119 B14R2.4529 OB(O)C1=CC2=CC(Cl)=CC=C2O1 AC-87448 [0,1,0,0,0,0|2,0,1]=4 120 B14R2.7969 CC(=O)C1=CC2=C(C=CC=C2Br)N1 AC-94114 [0,1,0,0,0,0|1,0,0]=2 121 B14R2.7969 CC1=C2CC(C(=O)O)OC2=CC=C1 AC-90457 [0,1,0,0,0,0|1,0,2]=4 122 B14R2.7969 CC1=C2OC(C(=O)O)CC2=CC=C1 AC-86038 [0,1,0,0,0,0|1,0,2]=4 123 B14R2.7969 FC1=CC=CC2=C1NC(C(F)F)=C2 AC-85480 [0,1,0,0,0,0|2,0,1]=4 124 B14R2.7969 NC(=O)C1=CC2=C(C=NC=C2Br)S1 AC-91255 [0,1,0,0,0,0|3,0,0]=4 125 B14R2.7969 NC1=CC=CC2=C1NC(C(=O)O)=C2 AC-86623 [0,1,0,0,0,0|0,0,0]=1 126 B14R2.7969 O=C(O)C1=CC2=C(Br)C=CC=C2S1 AC-87575 [0,1,0,0,0,0|1,0,0]=2 127 B14R2.7969 O=C(O)C1=CC2=C(C=NC=C2Cl)S1 AC-93075 [0,1,0,0,0,0|2,0,0]=3 128 B14R2.7969 O=C(O)C1=CC2=C(N1)C(F)=CC=C2 AC-50750 [0,1,0,0,0,0|0,0,0]=1 129 B14R2.7969 O=C(O)C1=CC2=C(N1)C(O)=CC=C2 AC-81468 [0,1,0,0,0,0|0,0,0]=1 130 B14R2.7969 O=C(O)C1=CC2=C(N=CN=C2Cl)N1 AC-35361 [0,1,0,0,0,0|2,0,0]=3 131 B14R2.7969 O=C(O)C1=CC2=CC=CC(Cl)=C2O1 AC-87111 [0,1,0,0,0,0|1,0,0]=2 132 B14R2.7969 O=C(O)C1=CN2C=CC=C(Br)C2=N1 AC-67882 [0,1,0,0,0,0|1,0,1]=3 133 B14R2.7969 O=C(O)C1=NC2=C(Br)C=CC=C2S1 AC-90576 [0,1,0,0,0,0|1,0,1]=3 134 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O AC-14523 [0,0,1,0,0,0|1,0,0]=2 135 B12R1.43 C[C@@H](OC1=CC=CC=C1)C(=O)O AC-64126 [0,0,1,0,0,0|1,0,2]=4 136 B12R1.43 C\C(=C\C1=CC=CC=C1)[N+](=O)[O-] AC-88455 [0,0,1,0,0,0|2,0,1]=4 137 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O AC-23950 [0,0,1,0,0,0|0,0,2]=3 138 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O AC-89007 [0,0,1,0,0,0|0,0,2]=3 139 B12R1.43 NC(CC1=CC=CN=C1)C(=O)O AC-90689 [0,0,1,0,0,0|1,0,2]=4 140 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O AC-94314 [0,0,1,0,0,0|1,0,2]=4 141 B12R1.43 NC(CC1=NC=CC=C1)C(=O)O AC-94234 [0,0,1,0,0,0|1,0,2]=4 142 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O AC-77394 [0,0,1,0,0,0|1,0,2]=4 143 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O AC-75590 [0,0,1,0,0,0|1,0,2]=4 144 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O AC-10595 [0,0,1,0,0,0|0,0,2]=3 145 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 AC-93737 [0,0,1,0,0,0|1,0,2]=4 146 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 AC-67256 [0,0,1,0,0,0|1,0,2]=4 147 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 AC-12701 [0,0,1,0,0,0|1,0,2]=4 148 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 AC-12702 [0,0,1,0,0,0|1,0,2]=4 149 B12R1.125 CC(=O)CCC1=CC=CC=C1N AC-88817 [0,0,1,0,0,0|1,0,2]=4 150 B12R1.125 CC1=CC=CC=C1CCC(=O)O AC-20107 [0,0,1,0,0,0|1,0,2]=4 151 B12R1.125 O=C(O)C#CC1=CC=CC=C1F AC-87408 [0,0,1,0,0,0|1,0,2]=4 152 B12R1.125 O=C(O)CCC1=CC=CC=C1I AC-91029 [0,0,1,0,0,0|1,0,2]=4 153 B12R1.125 O=C(O)CNC1=C(Cl)C=CN=C1 AC-85048 [0,0,1,0,0,0|2,0,1]=4 154 B12R1.125 O=C(O)CNC1=CC=CC=C1F AC-76022 [0,0,1,0,0,0|1,0,1]=3 155 B12R1.125 O=C(O)COC1=CC=CC=C1F AC-38430 [0,0,1,0,0,0|2,0,1]=4 156 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Br AC-89273 [0,0,1,0,0,0|1,0,0]=2 157 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Cl AC-19585 [0,0,1,0,0,0|1,0,0]=2 158 B12R1.125 O=[N+]([O-])\C=C\C1=CC=CC=C1Cl AC-26560 [0,0,1,0,0,0|2,0,1]=4 159 B12R2.252 O=C(O)C1=CC2=C(C=CO2)N1 AC-93768 [0,0,0,0,1,0|1,0,0]=2 160 B12R2.252 O=C(O)C1=CC2=C(C=CS2)N1 AC-57748 [0,0,0,0,1,0|1,0,0]=2 161 B12R2.252 O=C(O)C1=CC2=C(C=CS2)S1 AC-19860 [0,0,0,0,1,0|2,0,0]=3 162 B12R2.252 O=C(O)C1=CC2=C(N=CS2)N1 AC-82802 [0,0,0,0,1,0|2,0,0]=3 163 B14R2.768 CC(=O)NC1=CC2=CC=CC=C2O1 AC-90032 [0,0,0,0,0,1|2,0,0]=3 164 B14R2.768 CC(=O)NC1=CC2=CC=CC=C2S1 AC-91253 [0,0,0,0,0,1|2,0,0]=3 165 B14R2.768 NC(=O)CC1=NC2=CC=CC=C2N1 AC-82912 [0,0,0,0,0,1|2,0,0]=3 166 B14R2.768 O=C(O)CC1=CC2=C(C=CC=C2)N1 AC-29849 [0,0,0,0,0,1|0,0,0]=1 167 B14R2.768 O=C(O)CC1=CC2=CC=CC=C2S1 AC-93877 [0,0,0,0,0,1|1,0,0]=2 168 B14R2.768 O=C(O)CC1=CN2C=CC=NC2=N1 AC-91785 [0,0,0,0,0,1|2,0,1]=4 169 B14R2.768 O=C(O)CC1=NC2=CC=CC=C2S1 AC-76077 [0,0,0,0,0,1|1,0,1]=3 170 B14R2.768 O=C(O)CN1C=C2C=CC=CC2=N1 AC-46409 [0,0,0,0,0,1|1,0,1]=3 171 B14R2.781 CC(=O)C1=CC2=CC=CC=C2C=N1 AC-43865 [0,0,0,0,0,1|1,0,1]=3 172 B14R2.781 CC(=O)C1=CC2=CC=CC=C2N=C1 AC-75770 [0,0,0,0,0,1|1,0,1]=3 173 B14R2.781 CC(=O)C1=CC2=CN=CC=C2C=C1 AC-75761 [0,0,0,0,0,1|3,0,0]=4 174 B14R2.781 CC(=O)C1=CN=C2C=CC=CC2=N1 AC-22441 [0,0,0,0,0,1|1,0,1]=3 175 B14R2.781 CC(O)C1=CC=C2C=CC=CC2=C1 AC-21300 [0,0,0,0,0,1|2,0,1]=4 176 B14R2.781 NC(=O)C1=CC2=C(C=CC=C2)OC1 AC-82273 [0,0,0,0,0,1|2,0,0]=3 177 B14R2.781 NC(=O)C1=CC=C2C=CC=CC2=C1 AC-21397 [0,0,0,0,0,1|2,0,0]=3 178 B14R2.781 NC(=O)C1=CC=C2C=NC=CC2=C1 AC-80461 [0,0,0,0,0,1|3,0,0]=4 179 B14R2.781 O=C(Cl)C1=CC=C2C=CC=CC2=C1 AC-14236 [0,0,0,0,0,1|2,0,0]=3 180 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)OC1 AC-57545 [0,0,0,0,0,1|1,0,0]=2 181 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=N1 AC-30074 [0,0,0,0,0,1|0,0,1]=2 182 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=N1 AC-30075 [0,0,0,0,0,1|0,0,1]=2 183 B14R2.781 O=C(O)C1=CC2=CC=CN=C2N=C1 AC-87867 [0,0,0,0,0,1|1,0,1]=3 184 B14R2.781 O=C(O)C1=CC2=CN=CC=C2C=C1 AC-30073 [0,0,0,0,0,1|2,0,0]=3 185 B14R2.781 O=C(O)C1=CC=C2C=CC=CC2=N1 AC-11297 [0,0,0,0,0,1|0,0,1]=2 186 B14R2.781 O=C(O)C1=CC=C2C=CC=NC2=N1 AC-64478 [0,0,0,0,0,1|1,0,1]=3 187 B14R2.781 O=C(O)C1=CC=C2C=NC=CC2=C1 AC-30077 [0,0,0,0,0,1|2,0,0]=3 188 B14R2.781 O=C(O)C1=CC=C2N=CC=CC2=N1 AC-75830 [0,0,0,0,0,1|1,0,1]=3 189 B14R2.781 O=C(O)C1=CC=C2N=CC=NC2=C1 AC-79803 [0,0,0,0,0,1|3,0,0]=4 190 B14R2.781 O=C(O)C1=CN=C2C=CC=CC2=N1 AC-10926 [0,0,0,0,0,1|0,0,1]=2 191 B14R2.781 O=C(O)C1CC2=C(C=CC=C2)CN1 AC-14847 [0,0,0,0,0,1|0,0,2]=3 192 B14R2.781 O=C(O)C1CCC2=C(C=CC=C2)C1 AC-94428 [0,0,0,0,0,1|1,0,2]=4 193 B14R2.781 O=C(O)C1CCC2=C(C=CC=C2)O1 AC-35437 [0,0,0,0,0,1|1,0,2]=4 194 B14R2.781 O=C(O)C1CNC2=C(C=CC=C2)C1 AC-75793 [0,0,0,0,0,1|0,0,2]=3 195 B14R2.781 O=C(O)C1COC2=C(C=CC=C2)C1 AC-92404 [0,0,0,0,0,1|1,0,2]=4 196 B14R2.781 O=C(O)[C@@H]1CC2=C(C=CC=C2)CN1 AC-76857 [0,0,0,0,0,1|0,0,2]=3 197 B14R2.781 O=C(O)[C@@H]1COC2=CC=CC=C2O1 AC-80656 [0,0,0,0,0,1|1,0,2]=4 198 B14R2.781 OB(O)C1=CC2=C(C=CC=C2)CC1 AC-93221 [0,0,0,0,0,1|2,0,1]=4 199 B14R2.781 OB(O)C1=CC2=CC=CC=C2N=C1 AC-21364 [0,0,0,0,0,1|1,0,2]=4 200 B14R2.781 OB(O)C1=CC=C2C=CC=CC2=C1 AC-12501 [0,0,0,0,0,1|2,0,1]=4 201 B14R2.781 OB(O)C1=CC=C2C=CC=CC2=N1 AC-26607 [0,0,0,0,0,1|1,0,2]=4 202 B11R1.40 O=C\C(Cl)=C\C1=CC=CC=C1 AC-93438 [1,0,1,0,0,0|1,0,0]=3 203 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 AC-37551 [1,0,1,0,0,0|1,0,0]=3 204 B11R1.91 O=C(O)C#CC1=CC=CC=C1 AC-12737 [1,0,1,0,0,0|0,0,2]=4 205 B11R1.91 O=C(O)COC1=CC=CC=C1 AC-64140 [1,0,1,0,0,0|1,0,1]=4 206 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 AC-75552 [1,0,1,0,0,0|1,0,0]=3 207 B11R1.91 O=C([O-])\C=C\C1=CC=CC=C1 AC-15127 [1,0,1,0,0,0|0,0,1]=3 208 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 AC-21381 [1,0,1,0,0,0|1,0,1]=4 209 B11R1.17 CC\C=C\C1=CC=CC=C1N AC-86304 [1,0,1,0,0,0|1,0,1]=4 210 B11R1.17 O=C\C=C\C1=CC=CC=C1F AC-66141 [1,0,1,0,0,0|1,0,0]=3 211 B11R2.10 BrC1=CC2=C(C=CC=C2)C1 AC-20339 [2,0,0,0,0,0|2,0,0]=4 212 B11R2.10 BrC1=CC2=CC=CC=C2O1 AC-24763 [2,0,0,0,0,0|2,0,0]=4 213 B11R2.10 BrC1=CC2=CC=CC=C2S1 AC-85451 [2,0,0,0,0,0|2,0,0]=4 214 B11R2.10 BrC1=CC2=CC=CN=C2N1 AC-79749 [2,0,0,0,0,0|2,0,0]=4 215 B11R2.10 BrC1=NC2=CC=CC=C2N1 AC-33645 [2,0,0,0,0,0|2,0,0]=4 216 B11R2.10 CC1=CC2=C(C=CC=C2)N1 AC-31060 [2,0,0,0,0,0|0,0,1]=3 217 B11R2.10 CC1=CC2=C(C=CN=C2)N1 AC-69961 [2,0,0,0,0,0|1,0,1]=4 218 B11R2.10 CC1=CC2=C(C=NC=C2)N1 AC-90940 [2,0,0,0,0,0|1,0,1]=4 219 B11R2.10 CC1=CC2=C(N=CC=C2)N1 AC-30671 [2,0,0,0,0,0|1,0,1]=4 220 B11R2.10 CC1=CC2=CC=CC=C2O1 AC-93322 [2,0,0,0,0,0|1,0,1]=4 221 B11R2.10 CC1=CC2=CC=CC=C2S1 AC-89528 [2,0,0,0,0,0|1,0,1]=4 222 B11R2.10 CC1=CC2=NC=CC=C2N1 AC-81171 [2,0,0,0,0,0|1,0,1]=4 223 B11R2.10 CC1=NC2=CC=CC=C2N1 AC-14228 [2,0,0,0,0,0|1,0,1]=4 224 B11R2.10 ClC1=NC2=CC=CC=C2N1 AC-10646 [2,0,0,0,0,0|2,0,0]=4 225 B11R2.10 NC1=CC2=C(C=CC=C2)N1 AC-75917 [2,0,0,0,0,0|1,0,0]=3 226 B11R2.10 NC1=CC2=CC=CC=C2O1 AC-89495 [2,0,0,0,0,0|2,0,0]=4 227 B11R2.10 NC1=CC2=CC=CC=C2S1 AC-95147 [2,0,0,0,0,0|2,0,0]=4 228 B11R2.10 NC1=NC2=CC=CC=C2N1 AC-22496 [2,0,0,0,0,0|2,0,0]=4 229 B11R2.10 O=C1CC2=C(C=CC=C2)N1 AC-13485 [2,0,0,0,0,0|0,0,1]=3 230 B11R2.10 O=C1CC2=CC=CC=C2O1 AC-33159 [2,0,0,0,0,0|1,0,1]=4 231 B11R2.10 O=C1CC2=CC=CN=C2N1 AC-45354 [2,0,0,0,0,0|1,0,1]=4 232 B11R2.10 O=C1NC2=CC=CC=C2O1 AC-13871 [2,0,0,0,0,0|1,0,0]=3 233 B11R2.10 O=C1NC2=NC=CC=C2O1 AC-15516 [2,0,0,0,0,0|2,0,0]=4 234 B11R2.10 O=C1OC2=CC=CC=C2O1 AC-80816 [2,0,0,0,0,0|2,0,0]=4 235 B11R2.10 OC1=CC2=C(C=CC=C2)N1 AC-91799 [2,0,0,0,0,0|0,0,0]=2 236 B11R2.10 OC1=NC2=CC=CC=C2N1 AC-11218 [2,0,0,0,0,0|1,0,0]=3 237 B13R1.133 C\C(=C/C1=CC=C(F)C=C1)C(=O)O AC-96497 [0,1,1,0,0,0|1,0,0]=3 238 B13R1.133 NC(CC1=CC=C(Br)C=C1)C(=O)O AC-94496 [0,1,1,0,0,0|0,0,2]=4 239 B13R1.133 NC(CC1=CC=C(F)C=C1)C(=O)O AC-21529 [0,1,1,0,0,0|0,0,2]=4 240 B13R1.133 NC1=CC=C(CC(N)C(=O)O)C=C1 AC-91824 [0,1,1,0,0,0|0,0,2]=4 241 B13R1.133 N[C@@H](CC1=CC=C(Br)C=C1)C(=O)O AC-12690 [0,1,1,0,0,0|0,0,2]=4 242 B13R1.133 N[C@@H](CC1=CC=C(Br)C=C1)C(=O)O AC-25404 [0,1,1,0,0,0|0,0,2]=4 243 B13R1.133 N[C@@H](CC1=CC=C(Cl)C=C1)C(=O)O AC-26475 [0,1,1,0,0,0|0,0,2]=4 244 B13R1.133 N[C@@H](CC1=CC=C(F)C=C1)C(=O)O AC-12691 [0,1,1,0,0,0|0,0,2]=4 245 B13R1.133 N[C@@H](CC1=CC=C(F)C=C1)C(=O)O AC-29622 [0,1,1,0,0,0|0,0,2]=4 246 B13R1.133 N[C@@H](CC1=CC=C(F)C=C1)C(=O)O AC-79490 [0,1,1,0,0,0|0,0,2]=4 247 B13R1.133 N[C@@H](CC1=CC=C(I)C=C1)C(=O)O AC-12686 [0,1,1,0,0,0|0,0,2]=4 248 B13R1.133 N[C@H](CC1=CC=C(Cl)C=C1)C(=O)O AC-12695 [0,1,1,0,0,0|0,0,2]=4 249 B13R1.133 N[C@H](CC1=CC=C(F)C=C1)C(=O)O AC-12694 [0,1,1,0,0,0|0,0,2]=4 250 B13R1.133 N[C@H](CC1=CC=C(I)C=C1)C(=O)O AC-12697 [0,1,1,0,0,0|0,0,2]=4 251 B13R1.133 N[C@H](CC1=CC=C(O)C=C1)C(=O)O AC-62333 [0,1,1,0,0,0|0,0,2]=4 252 B13R1.133 O=C(O)C(=O)CC1=CC=C(O)C=C1 AC-59058 [0,1,1,0,0,0|1,0,1]=4 253 B13R1.148 NC(CC1=CC=CC(I)=C1)C(=O)O AC-94548 [0,1,1,0,0,0|0,0,2]=4 254 B13R1.202 NC(CC1=CC=CC=C1Cl)C(=O)O AC-26468 [0,1,1,0,0,0|0,0,2]=4 255 B13R1.150 O=C(O)\C=C\C1=CC=CC(F)=C1F AC-18176 [0,1,1,0,0,0|1,0,0]=3 256 B13R1.164 CC1=CC=C(\C=C\C(=O)O)C(C)=C1 AC-52659 [0,1,1,0,0,0|1,0,0]=3 257 B13R1.164 O=C(O)CNC1=CC=C(F)C=C1F AC-76222 [0,1,1,0,0,0|1,0,1]=4 258 B13R1.164 O=C(O)\C=C\C1=CC=C(Cl)C=C1Cl AC-20747 [0,1,1,0,0,0|1,0,0]=3 259 B13R1.893 O=C(O)\C=C\C1=CC(O)=CC=C1O AC-88560 [0,1,1,0,0,0|1,0,0]=3 260 B13R1.893 O=C(O)\C=C\C1=CC(O)=CC=C1O AC-93314 [0,1,1,0,0,0|1,0,0]=3 261 B13R1.3787 O=C(O)\C=C\C1=C(Cl)C=CC=C1Cl AC-20748 [0,1,1,0,0,0|1,0,0]=3 262 B13R2.43 CC1=CC2=C(C=C1)NC(C#N)=C2 AC-85600 [1,1,0,0,0,0|1,0,1]=4 263 B13R2.43 CC1=CC=C2N=C(C=O)NC2=C1 AC-84621 [1,1,0,0,0,0|1,0,0]=3 264 B13R2.43 N#CC1=CC2=C(C=CC(Cl)=C2)N1 AC-93039 [1,1,0,0,0,0|1,0,1]=4 265 B13R2.43 NC1=CC=C2NC(CO)=NC2=C1 AC-71574 [1,1,0,0,0,0|1,0,1]=4 266 B13R2.43 NCC1=CC2=C(C=CC(Cl)=C2)N1 AC-80683 [1,1,0,0,0,0|1,0,1]=4 267 B13R2.43 NCC1=CC2=C(C=CC(F)=C2)N1 AC-86516 [1,1,0,0,0,0|1,0,1]=4 268 B13R2.43 O=CC1=CC2=C(C=C(Br)C=C2)N1 AC-39549 [1,1,0,0,0,0|0,0,0]=2 269 B13R2.43 O=CC1=CC2=C(C=CC(Br)=C2)N1 AC-50818 [1,1,0,0,0,0|0,0,0]=2 270 B13R2.43 O=CC1=NC2=CC(Br)=CC=C2S1 AC-82699 [1,1,0,0,0,0|1,0,1]=4 271 B13R2.43 O=CC1=NC2=CC(F)=CC=C2N1 AC-91695 [1,1,0,0,0,0|1,0,0]=3 272 B13R2.43 OCC1=CC2=C(C=C(Br)C=C2)N1 AC-71067 [1,1,0,0,0,0|0,0,1]=3 273 B13R2.43 OCC1=CC2=C(C=CC(Cl)=C2)N1 AC-87458 [1,1,0,0,0,0|0,0,1]=3 274 B13R2.43 OCC1=CC2=CC=C(F)C=C2O1 AC-88352 [1,1,0,0,0,0|1,0,1]=4 275 B13R2.43 OCC1=NC2=CC(Br)=CC=C2N1 AC-49754 [1,1,0,0,0,0|1,0,1]=4 276 B13R2.43 OCC1=NC2=CC(F)=CC=C2N1 AC-57620 [1,1,0,0,0,0|1,0,1]=4 277 B13R2.45 CC1=C(C=O)SC2=CC=CC=C21 AC-86710 [1,1,0,0,0,0|1,0,0]=3 278 B13R2.45 CN1C(C=O)=CC2=C1C=CC=C2 AC-43522 [1,1,0,0,0,0|0,0,0]=2 279 B13R2.45 CN1C(CO)=CC2=C1C=CC=C2 AC-59615 [1,1,0,0,0,0|0,0,1]=3 280 B13R2.45 CNC1=CC2=C(C=CC=C2)N1C AC-92465 [1,1,0,0,0,0|2,0,0]=4 281 B13R2.45 O=C1C2=C(C=CC=C2)C\C1=N/O AC-89584 [1,1,0,0,0,0|2,0,0]=4 282 B13R2.45 O=CC1=C(O)C2=C(C=CC=C2)N1 AC-90469 [1,1,0,0,0,0|0,0,0]=2 283 B13R2.54 CC1=CC=CC2=C1C=C(C=O)N2 AC-92658 [1,1,0,0,0,0|0,0,0]=2 284 B13R2.54 CC1=CC=CC2=C1C=C(CO)N2 AC-88357 [1,1,0,0,0,0|0,0,1]=3 285 B13R2.54 CC1=CC=CN2C=C(C=O)N=C12 AC-31033 [1,1,0,0,0,0|1,0,1]=4 286 B13R2.54 CCC1=CC2=C(N1)C(C)=CC=C2 AC-93244 [1,1,0,0,0,0|1,0,1]=4 287 B13R2.54 N#CC1=CC2=C(C=CC=C2Cl)N1 AC-79478 [1,1,0,0,0,0|1,0,1]=4 288 B13R2.54 N#CC1=CC2=C(N1)C(F)=CC=C2 AC-88814 [1,1,0,0,0,0|1,0,1]=4 289 B13R2.54 O=CC1=CC2=C(C=NC=C2Br)S1 AC-91256 [1,1,0,0,0,0|2,0,0]=4 290 B13R2.54 O=CC1=CC2=C(N1)C(F)=CC=C2 AC-80465 [1,1,0,0,0,0|0,0,0]=2 291 B13R2.54 OCC1=CC2=C(N1)C(F)=CC=C2 AC-91281 [1,1,0,0,0,0|0,0,1]=3 292 B13R2.531 COC(=O)C1=CC2=C(C=CO2)N1 AC-83713 [0,1,0,0,1,0|1,0,0]=3 293 B13R2.3678 O=C(O)C1=CC2=C(N1)C(Br)=CS2 AC-33497 [0,1,0,0,1,0|1,0,0]=3 294 B13R2.15272 COC(=O)C1=CC2=CC=CC=C21 AC-92992 [0,1,0,0,1,0|0,0,0]=2 295 B15R2.7252 O=C(O)CC1=CN2C=C(Br)C=CC2=N1 AC-84396 [0,1,0,0,0,1|1,0,1]=4 296 B15R2.627 O=C(O)C1=C(Br)C2=CC=CC=C2N=C1 AC-86607 [0,1,0,0,0,1|0,0,1]=3 297 B15R2.627 O=C(O)C1=C(O)C2=CC=CC=C2N=C1 AC-41716 [0,1,0,0,0,1|0,0,1]=3 298 B15R2.627 O=C(O)C1=CC=C2C=CC=CC2=C1Br AC-21401 [0,1,0,0,0,1|1,0,0]=3 299 B15R2.627 O=C(O)C1=CN=C2C=CC=CN2C1=O AC-42724 [0,1,0,0,0,1|1,0,1]=4 300 B15R2.627 O=C(O)C1=CNC2=C(C=CC=C2)C1=O AC-41708 [0,1,0,0,0,1|0,0,0]=2 301 B15R2.627 O=C1C([N+](=O)[O-])=CNC2=C1C=CC=C2 AC-56106 [0,1,0,0,0,1|1,0,1]=4 302 B15R2.984 CC(=O)C1=C(C)C=C2C=CC=CC2=N1 AC-87687 [0,1,0,0,0,1|1,0,1]=4 303 B15R2.984 CC(=O)C1=C(N)C=C2C=CC=CC2=C1 AC-83168 [0,1,0,0,0,1|2,0,0]=4 304 B15R2.984 CC(=O)C1=CC2=C(C=CN=C2)NC1=O AC-76577 [0,1,0,0,0,1|2,0,0]=4 305 B15R2.984 CC1=C(C(=O)O)C=C2C=CC=CC2=N1 AC-60334 [0,1,0,0,0,1|0,0,1]=3 306 B15R2.984 CC1=C(C(=O)O)C=C2C=CC=NC2=N1 AC-76435 [0,1,0,0,0,1|1,0,1]=4 307 B15R2.984 CC1=C(C(=O)O)N=C2C=CC=CC2=C1 AC-41727 [0,1,0,0,0,1|0,0,1]=3 308 B15R2.984 CN1CC2=C(C=CC=C2)CC1C(=O)O AC-82320 [0,1,0,0,0,1|0,0,2]=4 309 B15R2.984 NC1=C(C(=O)O)C=C2C=CC=CC2=C1 AC-10402 [0,1,0,0,0,1|1,0,0]=3 310 B15R2.984 O=C(O)C1=C(Cl)N=C2C=CC=CC2=C1 AC-20361 [0,1,0,0,0,1|0,0,1]=3 311 B15R2.984 O=C(O)C1=C(Cl)N=C2C=CC=CC2=N1 AC-73307 [0,1,0,0,0,1|0,0,1]=3 312 B15R2.984 O=C(O)C1=C(O)C=C2C=CC=CC2=C1 AC-61784 [0,1,0,0,0,1|1,0,0]=3 313 B15R2.984 O=C(O)C1=CC2=C(N=CC=C2)NC1=O AC-87135 [0,1,0,0,0,1|1,0,0]=3 314 B15R2.984 O=C(O)C1CC2=C(C=CC=C2)NC1=O AC-62168 [0,1,0,0,0,1|0,0,2]=4 315 B15R2.1601 CCC(=O)C1=CC=C2C=CC=CC2=C1 AC-86278 [0,1,0,0,0,1|2,0,0]=4 316 B15R2.1601 COC(=O)C1=CC=C2C=NC=CC2=C1 AC-42883 [0,1,0,0,0,1|2,0,0]=4 317 B15R2.1601 COC(=O)C1=CN=C2C=CC=CC2=N1 AC-77346 [0,1,0,0,0,1|0,0,1]=3 318 B15R2.1601 COC(=O)C1CC2=C(C=CC=C2)CN1 AC-31826 [0,1,0,0,0,1|0,0,2]=4 319 B15R2.1601 NNC(=O)C1=CC2=CC=CC=C2C=N1 AC-95552 [0,1,0,0,0,1|1,0,1]=4 320 B15R2.1601 NNC(=O)C1=CC=C2C=CC=CC2=C1 AC-16414 [0,1,0,0,0,1|2,0,0]=4 321 B15R2.1601 O=CC(=O)C1=CC=C2C=CC=CC2=C1 AC-94802 [0,1,0,0,0,1|1,0,1]=4 322 B15R2.4441 O=S(=O)(O)C1=CC=C2C=CC=CC2=C1 AC-76830 [0,1,0,0,0,1|2,0,0]=4 323 B15R2.4441 O=S(=O)(O)C1=CC=C2C=CC=CC2=C1 AC-76981 [0,1,0,0,0,1|2,0,0]=4 324 B15R2.7174 CC1=CC=C2C=NC(C(=O)O)=CC2=C1 AC-94075 [0,1,0,0,0,1|0,0,1]=3 325 B15R2.7174 NC(=O)C1=CC2=CC(Cl)=CC=C2N=C1 AC-96679 [0,1,0,0,0,1|1,0,1]=4 326 B15R2.7174 NC1=CC=C2C=CC(C(=O)O)=CC2=N1 AC-89002 [0,1,0,0,0,1|2,0,0]=4 327 B15R2.7174 O=C(O)C1=CC2=CC(O)=CC=C2C=N1 AC-93519 [0,1,0,0,0,1|0,0,1]=3 328 B15R2.7174 O=C(O)C1=CC=C2C=CC(Br)=CC2=N1 AC-80736 [0,1,0,0,0,1|0,0,1]=3 329 B15R2.7174 O=C(O)C1=CC=C2C=NC(Cl)=CC2=C1 AC-76705 [0,1,0,0,0,1|2,0,0]=4 330 B15R2.7174 O=C(O)C1=CC=C2N=CC(Br)=CC2=C1 AC-76666 [0,1,0,0,0,1|2,0,0]=4 331 B15R2.7174 O=C(O)C1CC2=C(C=CC(O)=C2)CN1 AC-93518 [0,1,0,0,0,1|0,0,2]=4 332 B15R2.7180 CC(=O)C1=CC2=CC=C(O)C=C2C=C1 AC-24195 [0,1,0,0,0,1|2,0,0]=4 333 B15R2.7180 CC(=O)C1=CC=C2C=C(Br)C=CC2=C1 AC-91495 [0,1,0,0,0,1|2,0,0]=4 334 B15R2.7180 CC(=O)C1=CC=C2C=C(F)C=CC2=C1 AC-83171 [0,1,0,0,0,1|2,0,0]=4 335 B15R2.7180 CC(=O)C1=CC=C2C=C(O)C=CC2=C1 AC-91038 [0,1,0,0,0,1|2,0,0]=4 336 B15R2.7180 CC1=CC=C2C=C(C(=O)O)C=CC2=N1 AC-26609 [0,1,0,0,0,1|2,0,0]=4 337 B15R2.7180 NC1=CC=C2C=C(C(=O)O)C=CC2=N1 AC-87192 [0,1,0,0,0,1|2,0,0]=4 338 B15R2.7180 O=C(O)C1=CC2=CC=C(Br)C=C2N=C1 AC-60354 [0,1,0,0,0,1|0,0,1]=3 339 B15R2.7180 O=C(O)C1=CC2=CC=C(Br)N=C2C=C1 AC-85737 [0,1,0,0,0,1|2,0,0]=4 340 B15R2.7180 O=C(O)C1=CC2=CC=C(Cl)C=C2C=N1 AC-89687 [0,1,0,0,0,1|0,0,1]=3 341 B15R2.7180 O=C(O)C1=CC2=CC=C(Cl)N=C2C=C1 AC-45910 [0,1,0,0,0,1|2,0,0]=4 342 B15R2.7180 O=C(O)C1=CC2=NC=C(Br)C=C2N=C1 AC-96127 [0,1,0,0,0,1|1,0,1]=4 343 B15R2.7180 O=C(O)C1=CC=C2C=C(Br)C=CC2=C1 AC-11260 [0,1,0,0,0,1|1,0,0]=3 344 B15R2.7180 O=C(O)C1=CC=C2C=C(Br)C=NC2=C1 AC-76667 [0,1,0,0,0,1|2,0,0]=4 345 B15R2.7180 O=C(O)C1=CC=C2C=C(Cl)N=CC2=C1 AC-76708 [0,1,0,0,0,1|2,0,0]=4 346 B15R2.13598 O=C(O)C1=CC2=CC=CC(Br)=C2C=N1 AC-94379 [0,1,0,0,0,1|0,0,1]=3 347 B15R2.13598 O=C(O)C1=CC2=CC=CC(Br)=C2N=C1 AC-87189 [0,1,0,0,0,1|0,0,1]=3 348 B15R2.13598 O=C(O)C1=CC2=CC=NC(Cl)=C2C=C1 AC-75889 [0,1,0,0,0,1|2,0,0]=4 349 B15R2.13598 O=C(O)C1=CC2=NC=CC(O)=C2C=C1 AC-94844 [0,1,0,0,0,1|2,0,0]=4 350 B15R2.13598 O=C(O)C1=CC=C2C(Br)=CC=CC2=C1 AC-38183 [0,1,0,0,0,1|1,0,0]=3 351 B15R2.13598 O=C(O)C1=CC=C2C(Cl)=CC=CC2=C1 AC-87478 [0,1,0,0,0,1|1,0,0]=3 352 B15R2.13598 O=C(O)C1=CC=C2C(Cl)=CC=CC2=N1 AC-85864 [0,1,0,0,0,1|0,0,1]=3 353 B15R2.14951 CC(=O)C1=CC(Br)=C2C=CC=CC2=C1 AC-91267 [0,1,0,0,0,1|2,0,0]=4 354 B15R2.14951 CC(=O)C1=CC(C)=C2C=CC=CC2=N1 AC-94012 [0,1,0,0,0,1|1,0,1]=4 355 B15R2.14951 CC(=O)C1=NC2=C(C=CC=C2)C(=O)N1 AC-92288 [0,1,0,0,0,1|1,0,1]=4 356 B15R2.14951 CC1=C2C=CC=CC2=NC(C(=O)O)=C1 AC-42737 [0,1,0,0,0,1|0,0,1]=3 357 B15R2.14951 NC(=O)C1=CC(Br)=C2C=CC=CC2=C1 AC-87401 [0,1,0,0,0,1|2,0,0]=4 358 B15R2.14951 NC(=O)C1=CC(N)=C2C=CC=CC2=N1 AC-95704 [0,1,0,0,0,1|1,0,1]=4 359 B15R2.14951 O=C(O)C1=CC(=O)C2=C(C=CC=C2)O1 AC-13012 [0,1,0,0,0,1|1,0,0]=3 360 B15R2.14951 O=C(O)C1=CC(O)=C2C=CC=CC2=N1 AC-56324 [0,1,0,0,0,1|0,0,1]=3 361 B15R2.14951 O=C(O)C1=NC2=C(C=CC=C2)C(=O)N1 AC-45861 [0,1,0,0,0,1|0,0,1]=3 362 B15R2.61353 NC1=C2C=C(C(=O)O)N=CC2=CC=C1 AC-84926 [0,1,0,0,0,1|0,0,1]=3 363 B15R2.61353 O=C(O)C1=CC2=C(Cl)C=CC=C2C=N1 AC-93966 [0,1,0,0,0,1|0,0,1]=3 364 B15R2.61353 O=C(O)C1=CC2=C(Cl)N=CC=C2C=C1 AC-75891 [0,1,0,0,0,1|2,0,0]=4 365 B15R2.61353 O=C(O)C1=CC2=C(O)N=CC=C2C=C1 AC-75947 [0,1,0,0,0,1|2,0,0]=4 366 B15R2.61353 O=C(O)C1=CC=C2C=CC=C(O)C2=N1 AC-57813 [0,1,0,0,0,1|0,0,1]=3 367 B15R2.1592 COC(=O)C1=C(Br)C2=NC=CC=C2N1 AC-88717 [0,2,0,0,0,0|1,0,0]=3 368 B15R2.1592 COC(=O)C1=C(Cl)C2=CC=CC=C2S1 AC-83687 [0,2,0,0,0,0|1,0,0]=3 369 B15R2.1592 COC(=O)C1=C(N)C2=C(C=CN=C2)S1 AC-88438 [0,2,0,0,0,0|2,0,0]=4 370 B15R2.1592 COC(=O)C1=C(N)C2=CC=CN=C2O1 AC-92712 [0,2,0,0,0,0|2,0,0]=4 371 B15R2.1592 NNC(=O)C1=C(Cl)C2=CC=CC=C2S1 AC-19302 [0,2,0,0,0,0|2,0,0]=4 372 B15R2.7203 CC1=C(C(N)=O)OC2=CC=C(Br)C=C21 AC-82451 [0,2,0,0,0,0|2,0,0]=4 373 B15R2.7203 NC(=O)C1=C(O)C2=CC(Cl)=CC=C2O1 AC-90055 [0,2,0,0,0,0|2,0,0]=4 374 B15R2.13629 CC1=C(C(=O)O)SC2=CC=CC(Cl)=C21 AC-82582 [0,2,0,0,0,0|1,0,0]=3 375 B15R2.1356 CCOC(=O)C1=CC2=C(C=CC=N2)N1 AC-28885 [0,2,0,0,0,0|1,0,0]=3 376 B15R2.1356 CCOC(=O)C1=CC2=C(C=CN=C2)N1 AC-29279 [0,2,0,0,0,0|1,0,0]=3 377 B15R2.1356 CCOC(=O)C1=CC2=C(N=CN=C2)N1 AC-92750 [0,2,0,0,0,0|2,0,0]=4 378 B15R2.1356 CCOC(=O)C1=CC2=CC=CC=C2O1 AC-39229 [0,2,0,0,0,0|1,0,0]=3 379 B15R2.1590 COC(=O)C1=CC2=C(C=C(Br)C=C2)N1 AC-52182 [0,2,0,0,0,0|0,0,0]=2 380 B15R2.1590 COC(=O)C1=CC2=C(C=C(Cl)C=C2)N1 AC-94606 [0,2,0,0,0,0|0,0,0]=2 381 B15R2.1590 COC(=O)C1=CC2=C(C=C(O)C=C2)N1 AC-30967 [0,2,0,0,0,0|0,0,0]=2 382 B15R2.1590 COC(=O)C1=CC2=C(C=CC(C)=C2)N1 AC-83320 [0,2,0,0,0,0|0,0,0]=2 383 B15R2.1590 COC(=O)C1=CC2=CC(Br)=CC=C2O1 AC-61873 [0,2,0,0,0,0|1,0,0]=3 384 B15R2.1590 COC(=O)C1=CC2=CC(Br)=CC=C2S1 AC-30729 [0,2,0,0,0,0|1,0,0]=3 385 B15R2.1590 COC(=O)C1=CC2=CC(Br)=CN=C2S1 AC-83148 [0,2,0,0,0,0|2,0,0]=4 386 B15R2.1590 COC(=O)C1=CC2=CC(Cl)=CC=C2S1 AC-73071 [0,2,0,0,0,0|1,0,0]=3 387 B15R2.1590 COC(=O)C1=CC2=CC(Cl)=CN=C2N1 AC-30850 [0,2,0,0,0,0|1,0,0]=3 388 B15R2.1590 COC(=O)C1=NC2=CC(Br)=CC=C2N1 AC-39299 [0,2,0,0,0,0|1,0,0]=3 389 B15R2.1590 COC(=O)C1=NC2=CC(Br)=CC=C2O1 AC-91822 [0,2,0,0,0,0|1,0,1]=4 390 B15R2.1590 COC(=O)C1=NC2=CC(Br)=CC=C2S1 AC-85632 [0,2,0,0,0,0|1,0,1]=4 391 B15R2.1590 COC(=O)C1=NC2=CC(C)=CC=C2O1 AC-92199 [0,2,0,0,0,0|1,0,1]=4 392 B15R2.1590 COC(=O)C1=NC2=CC=C(Br)C=C2O1 AC-83924 [0,2,0,0,0,0|1,0,1]=4 393 B15R2.1590 COC(=O)C1=NC2=CC=C(C)C=C2N1 AC-30685 [0,2,0,0,0,0|1,0,0]=3 394 B15R2.1590 COC(=O)C1=NC2=CC=C(Cl)C=C2S1 AC-92613 [0,2,0,0,0,0|1,0,1]=4 395 B15R2.1590 COC(=O)C1=NC2=NC(Br)=CC=C2N1 AC-80749 [0,2,0,0,0,0|2,0,0]=4 396 B15R2.1590 COC(=O)C1=NC2=NC(Cl)=CC=C2N1 AC-95041 [0,2,0,0,0,0|2,0,0]=4 397 B15R2.1598 COC(=O)C1=CC2=C(C=CC=C2Br)N1 AC-52695 [0,2,0,0,0,0|0,0,0]=2 398 B15R2.1598 COC(=O)C1=CC2=C(C=CN=C2Cl)N1 AC-73069 [0,2,0,0,0,0|1,0,0]=3 399 B15R2.1598 COC(=O)C1=CC2=C(C=NC=C2F)S1 AC-91257 [0,2,0,0,0,0|2,0,0]=4 400 B15R2.1598 COC(=O)C1=CC2=C(Cl)C=CC=C2S1 AC-73333 [0,2,0,0,0,0|1,0,0]=3 401 B15R2.1598 COC(=O)C1=CC2=C(F)C=CC=C2S1 AC-72824 [0,2,0,0,0,0|1,0,0]=3 402 B15R2.1598 COC(=O)C1=CC2=C(N1)C(Br)=CC=C2 AC-80138 [0,2,0,0,0,0|0,0,0]=2 403 B15R2.1598 COC(=O)C1=CC2=C(N1)C(F)=CC=C2 AC-84549 [0,2,0,0,0,0|0,0,0]=2 404 B15R2.1598 COC(=O)C1=CC2=C(N=CC=C2Cl)N1 AC-30803 [0,2,0,0,0,0|1,0,0]=3 405 B15R2.1598 COC(=O)C1=CC2=C(N=CN=C2Cl)N1 AC-68978 [0,2,0,0,0,0|2,0,0]=4 406 B15R2.1598 COC(=O)C1=CC2=CC=CC(Br)=C2S1 AC-71108 [0,2,0,0,0,0|1,0,0]=3 407 B15R2.1598 COC(=O)C1=NC2=C(Br)C=CC=C2S1 AC-96296 [0,2,0,0,0,0|1,0,1]=4 408 B15R2.1598 COC(=O)C1=NC2=C(Cl)C=CC=C2S1 AC-94652 [0,2,0,0,0,0|1,0,1]=4 409 B15R2.1102 CC(=O)C1=NC2=CC(Cl)=C(Cl)C=C2N1 AC-90511 [0,2,0,0,0,0|2,0,0]=4 410 B15R2.1102 O=C(O)C1=CC2=C(C=C(Cl)C(Br)=C2)N1 AC-80626 [0,2,0,0,0,0|0,0,0]=2 411 B15R2.1102 O=C(O)C1=CC2=C(C=C(O)C(O)=C2)N1 AC-80742 [0,2,0,0,0,0|0,0,0]=2 412 B15R2.4834 COC1=CC2=C(C=N1)NC(C(=O)O)=C2 AC-90624 [0,2,0,0,0,0|1,0,0]=3 413 B15R2.4834 COC1=CC=C2NC(C(=O)O)=CC2=N1 AC-87586 [0,2,0,0,0,0|1,0,0]=3 414 B15R2.4834 COC1=CC=C2OC(C(=O)O)=CC2=C1 AC-26586 [0,2,0,0,0,0|1,0,0]=3 415 B15R2.4834 N#CC1=CC2=C(C=C1)NC(C(=O)O)=C2 AC-80563 [0,2,0,0,0,0|0,0,0]=2 416 B15R2.15633 O=C(O)C1=CC2=C(C=C(Cl)C=C2Cl)N1 AC-21940 [0,2,0,0,0,0|0,0,0]=2 417 B15R2.15633 O=C(O)C1=CC2=C(C=C(O)C=C2O)N1 AC-94204 [0,2,0,0,0,0|0,0,0]=2 418 B15R2.15633 O=C(O)C1=CC2=C(N1)C(Cl)=CC(Cl)=C2 AC-84198 [0,2,0,0,0,0|0,0,0]=2 419 B15R2.20824 COC1=C2C=C(C(=O)O)SC2=CC=C1 AC-87562 [0,2,0,0,0,0|1,0,0]=3 420 B15R2.20824 COC1=C2N=C(C(=O)O)SC2=CC=C1 AC-85235 [0,2,0,0,0,0|1,0,1]=4 421 B15R2.20824 COC1=C2SC(C(=O)O)=CC2=CC=C1 AC-80396 [0,2,0,0,0,0|1,0,0]=3 422 B15R2.20824 COC1=CC=CC2=C1C=C(C(=O)O)N2 AC-21916 [0,2,0,0,0,0|0,0,0]=2 423 B13R2.369 NC1=C(O)C=C2C=CC=CC2=C1 AC-21246 [0,0,1,1,0,0|1,0,0]=3 424 B13R2.369 NC1=CC2=C(C=CC=C2)NC1=O AC-96431 [0,0,1,1,0,0|1,0,0]=3 425 B13R2.369 NC1=CC2=C(C=CC=C2)OC1=O AC-22585 [0,0,1,1,0,0|0,0,0]=2 426 B13R2.369 O=C1CC2=C(C=CC=C2)OC1=O AC-86200 [0,0,1,1,0,0|1,0,1]=4 427 B13R2.369 O=C1NC2=C(C=CC=C2)C=C1F AC-96755 [0,0,1,1,0,0|2,0,0]=4 428 B13R2.369 O=C1OC2=CC=CC=C2N=C1O AC-85243 [0,0,1,1,0,0|1,0,1]=4 429 B13R2.5179 NC1=CC=CC2=NC(Cl)=CC=C12 AC-80574 [0,0,1,1,0,0|2,0,0]=4 430 B13R2.5179 O=C1C=CC2=C(C=CC=C2Br)N1 AC-84032 [0,0,1,1,0,0|2,0,0]=4 431 B13R2.5179 O=C1C=CC2=C(C=CC=C2Cl)O1 AC-88362 [0,0,1,1,0,0|1,0,0]=3 432 B13R2.5179 O=C1C=CC2=C(C=CC=C2F)O1 AC-88399 [0,0,1,1,0,0|1,0,0]=3 433 B13R2.5179 O=C1C=CC2=C(C=CC=C2O)N1 AC-84201 [0,0,1,1,0,0|2,0,0]=4 434 B13R2.5179 OC1=CC2=CC=CC(O)=C2C=C1 AC-23317 [0,0,1,1,0,0|2,0,0]=4 435 B13R2.72 NC(=O)C1=CN=C2C=CC=CN12 AC-90797 [0,0,1,1,0,0|2,0,0]=4 436 B13R2.72 O=C(O)C1=C2C=CC=CC2=NO1 AC-93239 [0,0,1,1,0,0|2,0,0]=4 437 B13R2.72 O=C(O)C1=C2C=CC=CN2C=N1 AC-69814 [0,0,1,1,0,0|1,0,1]=4 438 B13R2.72 O=C(O)C1=CN=C2C=CC=CN12 AC-29810 [0,0,1,1,0,0|1,0,0]=3 439 B13R2.72 O=C(O)C1=CN=C2N=CC=CN12 AC-29820 [0,0,1,1,0,0|2,0,0]=4 440 B13R2.72 O=C(O)C1=CNC2=C1C=CC=C2 AC-10158 [0,0,1,1,0,0|2,0,0]=4 441 B13R2.72 O=C(O)C1=NOC2=CC=CC=C21 AC-60275 [0,0,1,1,0,0|1,0,1]=4 442 B13R2.72 O=C(O)C1=NSC2=CC=CC=C21 AC-90931 [0,0,1,1,0,0|1,0,1]=4 443 B13R2.430 O=C(O)C1=CC2=C(C=C1)NC=C2 AC-10160 [0,0,1,1,0,0|2,0,0]=4 444 B13R2.430 O=C(O)C1=CC2=C(C=CN2)C=C1 AC-10161 [0,0,1,1,0,0|2,0,0]=4 445 B13R2.430 O=C(O)C1=CC2=C(C=CN2)C=N1 AC-75941 [0,0,1,1,0,0|1,0,1]=4 446 B13R2.430 O=C(O)C1=CC2=C(C=N1)NC=C2 AC-75934 [0,0,1,1,0,0|1,0,1]=4 447 B13R2.430 O=C(O)C1=CC2=C(C=N1)OC=C2 AC-79373 [0,0,1,1,0,0|1,0,1]=4 448 B13R2.430 O=C(O)C1=CC2=CC=CN2C=N1 AC-44247 [0,0,1,1,0,0|1,0,1]=4 449 B13R2.430 O=C(O)C1=CC=C2NC=CC2=N1 AC-69794 [0,0,1,1,0,0|1,0,1]=4 450 B13R2.430 O=C(O)C1=CC=C2OC=CC2=C1 AC-34298 [0,0,1,1,0,0|2,0,0]=4 451 B13R2.430 O=C(O)C1=CC=C2SC=CC2=C1 AC-33282 [0,0,1,1,0,0|2,0,0]=4 452 B13R2.430 O=C(O)C1=CN2C=CC=C2C=C1 AC-95099 [0,0,1,1,0,0|2,0,0]=4 453 B13R2.5569 O=C(O)C1=C2C=COC2=CC=C1 AC-93433 [0,0,1,1,0,0|2,0,0]=4 454 B13R2.5569 O=C(O)C1=C2C=CSC2=CC=C1 AC-79983 [0,0,1,1,0,0|2,0,0]=4 455 B13R2.5569 O=C(O)C1=C2OC=CC2=CC=C1 AC-83658 [0,0,1,1,0,0|2,0,0]=4 456 B13R2.5569 O=C(O)C1=CC=CC2=C1C=CC2 AC-82589 [0,0,1,1,0,0|1,0,1]=4 457 B13R2.5569 O=C(O)C1=CC=CC2=C1NC=C2 AC-13160 [0,0,1,1,0,0|2,0,0]=4 458 B13R2.5569 O=C(O)C1=CC=CC2=CC=NN21 AC-85130 [0,0,1,1,0,0|1,0,0]=3 459 B13R2.5569 O=C(O)C1=NC=CC2=C1C=CN2 AC-75940 [0,0,1,1,0,0|1,0,1]=4 460 B13R2.5569 O=C(O)C1=NC=CC2=C1NC=C2 AC-69805 [0,0,1,1,0,0|1,0,1]=4 461 B11R1.36 C=C(B(O)O)C1=CC=CC=C1 AC-85302 [0,0,1,0,1,0|1,0,1]=4 462 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 AC-75835 [0,0,1,0,1,0|1,0,1]=4 463 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 AC-11561 [0,0,1,0,1,0|0,0,2]=4 464 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 AC-32405 [0,0,1,0,1,0|1,0,1]=4 465 B11R1.36 NC(=O)[C@@H](N)C1=CC=CC=C1 AC-83167 [0,0,1,0,1,0|1,0,1]=4 466 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 AC-24682 [0,0,1,0,1,0|0,0,1]=3 467 B11R1.36 NC(C(=O)O)C1=CC=CN=C1 AC-91735 [0,0,1,0,1,0|1,0,1]=4 468 B11R1.36 NC(C(=O)O)C1=CC=CN=C1 AC-96576 [0,0,1,0,1,0|1,0,1]=4 469 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 AC-77311 [0,0,1,0,1,0|0,0,1]=3 470 B11R1.36 N[C@H](C(=O)Cl)C1=CC=CC=C1 AC-64035 [0,0,1,0,1,0|1,0,1]=4 471 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 AC-38080 [0,0,1,0,1,0|1,0,0]=3 472 B11R1.36 O=C(O)C(Br)C1=CC=CC=C1 AC-14893 [0,0,1,0,1,0|1,0,1]=4 473 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 AC-81118 [0,0,1,0,1,0|1,0,1]=4 474 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 AC-76874 [0,0,1,0,1,0|1,0,1]=4 475 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 AC-11550 [0,0,1,0,1,0|1,0,1]=4 476 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 AC-11551 [0,0,1,0,1,0|1,0,1]=4 477 B11R1.86 CC(=O)NC1=CC=CC=C1F AC-23564 [0,0,1,0,1,0|2,0,0]=4 478 B11R1.86 CC(=O)NC1=CC=CC=C1N AC-51500 [0,0,1,0,1,0|2,0,0]=4 479 B11R1.86 CC(=O)NC1=CC=CC=C1O AC-14143 [0,0,1,0,1,0|2,0,0]=4 480 B11R1.86 CC1=CC=CC=C1CC(=O)O AC-31317 [0,0,1,0,1,0|0,0,2]=4 481 B11R1.86 NC1=CC=CC=C1CC(=O)O AC-24683 [0,0,1,0,1,0|0,0,1]=3 482 B11R1.86 O=C(O)CC1=CC=CC=C1O AC-11219 [0,0,1,0,1,0|1,0,1]=4 483 B13R1.348 CC(=O)\C=C(\C)NC1=CC=CC=C1 AC-86777 [0,0,1,0,0,1|1,0,1]=4 484 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 AC-15170 [0,0,1,0,0,1|0,0,2]=4 485 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 AC-15171 [0,0,1,0,0,1|0,0,2]=4 486 B13R1.351 O=C(O)C(=O)CCC1=CC=CC=C1 AC-56539 [0,0,1,0,0,1|1,0,1]=4 487 B13R1.158 NC1=CC=CC=C1OCCC(=O)O AC-32414 [0,0,1,0,0,1|0,0,2]=4 488 B13R1.158 NC1=CC=CC=C1OCCC(=O)O AC-90420 [0,0,1,0,0,1|0,0,2]=4 489 B13R2.57 O=CC1=CC2=CC=CC=C2N=C1 AC-24048 [1,0,0,0,0,1|0,0,1]=3 490 B13R2.57 O=CC1=CC2=CC=CC=C2N=N1 AC-27041 [1,0,0,0,0,1|0,0,1]=3 491 B13R2.57 O=CC1=CC2=CN=CC=C2C=C1 AC-94892 [1,0,0,0,0,1|2,0,0]=4 492 B13R2.57 O=CC1=CC=C2C=CC=CC2=C1 AC-14231 [1,0,0,0,0,1|1,0,0]=3 493 B13R2.57 O=CC1=CC=C2C=CC=CC2=N1 AC-14243 [1,0,0,0,0,1|0,0,1]=3 494 B13R2.57 OCC1=CC2=CC=CC=C2C=N1 AC-75563 [1,0,0,0,0,1|0,0,2]=4 495 B13R2.57 OCC1=CC=C2C=CC=CC2=C1 AC-14232 [1,0,0,0,0,1|1,0,1]=4 496 B13R2.57 OCC1=CC=C2C=CC=CC2=N1 AC-65477 [1,0,0,0,0,1|0,0,2]=4 497 B15R2.1668 CC(=O)OC1=CC=C2C=CC=CC2=C1 AC-23837 [0,0,0,0,0,2|2,0,0]=4 498 B15R2.1668 O=C(O)CC1=CC2=CC=CC=C2N=C1 AC-76135 [0,0,0,0,0,2|0,0,1]=3 499 B15R2.1668 O=C(O)CC1=CC2=CN=CC=C2C=C1 AC-87772 [0,0,0,0,0,2|2,0,0]=4 500 B15R2.1668 O=C(O)CC1=CC=C2C=CC=CC2=C1 AC-14233 [0,0,0,0,0,2|1,0,0]=3 501 B15R2.1668 O=C(O)CC1=CC=C2C=CC=CC2=N1 AC-91892 [0,0,0,0,0,2|0,0,1]=3 502 B15R2.1668 O=C(O)CC1=CC=C2N=CC=CC2=C1 AC-45363 [0,0,0,0,0,2|2,0,0]=4