0 B13R2.435 CC(=O)C1=CC2=C(N1)C=CC=C2 Z1198159037 [0,0,0,0,0,0|3,0,1]=4 1 B13R2.435 CC(=O)C1=CC2=C(O1)C=CC=C2 Z57054215 [0,0,0,0,0,0|2,1,1]=4 2 B13R2.435 CC(=O)C1=CC2=C(S1)C=CC=C2 Z337709350 [0,0,0,0,0,0|2,0,1]=3 3 B13R2.435 CC(=O)C1=NC2=C(S1)C=CC=C2 Z57218968 [0,0,0,0,0,0|3,0,1]=4 4 B13R2.435 CC(N)C1=CC2=C(O1)C=CC=C2 Z90664473 [0,0,0,0,0,0|3,1,0]=4 5 B13R2.435 CC(N)C1=NC2=C(S1)C=CC=C2 Z105197348 [0,0,0,0,0,0|4,0,0]=4 6 B13R2.435 CC(O)C1=NC2=C(S1)C=CC=C2 Z56347071 [0,0,0,0,0,0|3,0,0]=3 7 B13R2.435 C[C@@H](O)C1=CC2=C(O1)C=CC=C2 Z959151760 [0,0,0,0,0,0|2,1,0]=3 8 B13R2.435 C[C@@H](O)C1=NC2=C(N1)C=CC=C2 Z1197664657 [0,0,0,0,0,0|4,0,0]=4 9 B13R2.435 C[C@@H](O)C1=NC2=C(S1)C=CC=C2 Z1127670751 [0,0,0,0,0,0|3,0,0]=3 10 B13R2.435 C[C@H](N)C1=CC2=C(O1)C=CC=C2 Z1795817788 [0,0,0,0,0,0|3,1,0]=4 11 B13R2.435 C[C@H](O)C1=NC2=C(N1)C=CC=C2 Z1197664828 [0,0,0,0,0,0|4,0,0]=4 12 B13R2.435 C[C@H](O)C1=NC2=C(S1)C=CC=C2 Z1127670752 [0,0,0,0,0,0|3,0,0]=3 13 B13R2.435 N=C(N)C1=CC2=C(O1)C=CC=C2 Z1258943398 [0,0,0,0,0,0|3,1,0]=4 14 B13R2.435 NC(=O)C1=CC2=C(N1)C=CC=C2 Z101185700 [0,0,0,0,0,0|3,0,1]=4 15 B13R2.435 O=C(O)C1=CC2=C(C1)C=CC=C2 Z1255423596 [0,0,0,0,0,0|2,0,1]=3 16 B13R2.435 O=C(O)C1=CC2=C(N1)C=CC=C2 Z56347139 [0,0,0,0,0,0|2,0,1]=3 17 B13R2.435 O=C(O)C1=CC2=C(N1)C=CC=N2 Z1198266663 [0,0,0,0,0,0|3,0,1]=4 18 B13R2.435 O=C(O)C1=CC2=C(N1)C=NC=C2 Z1198323516 [0,0,0,0,0,0|3,0,1]=4 19 B13R2.435 O=C(O)C1=CC2=C(O1)C=CC=C2 Z56839706 [0,0,0,0,0,0|1,1,1]=3 20 B13R2.435 O=C(O)C1=CC2=C(O1)C=CC=N2 Z2670715454 [0,0,0,0,0,0|2,1,1]=4 21 B13R2.435 O=C(O)C1=CC2=C(O1)C=CN=C2 Z1255443420 [0,0,0,0,0,0|2,1,1]=4 22 B13R2.435 O=C(O)C1=CC2=C(S1)C=CC=C2 Z89265777 [0,0,0,0,0,0|1,0,1]=2 23 B13R2.435 O=C(O)C1=CC2=C(S1)C=NC=C2 Z1255380800 [0,0,0,0,0,0|2,0,1]=3 24 B13R2.435 O=C(O)C1=NC2=C(N1)C=CC=C2 Z274592454 [0,0,0,0,0,0|3,0,1]=4 25 B13R2.435 O=C(O)C1=NC2=C(S1)C=CC=C2 Z56899149 [0,0,0,0,0,0|2,0,1]=3 26 B13R2.435 O=C(O)C1=NN2C=CC=CC2=C1 Z1171753366 [0,0,0,0,0,0|3,0,1]=4 27 B13R2.435 O=C(O)C1CC2=C(S1)C=CC=C2 Z221583708 [0,0,0,0,0,0|1,0,3]=4 28 B13R2.435 O=[N+]([O-])C1=CC2=C(N1)C=CC=C2 Z1255396542 [0,0,0,0,0,0|2,0,2]=4 29 B13R2.435 OB(O)C1=CC2=C(O1)C=CC=C2 Z1255383399 [0,0,0,0,0,0|0,1,0]=1 30 B13R2.435 OB(O)C1=CC2=C(S1)C=CC=C2 Z1255488387 [0,0,0,0,0,0|0,0,0]=0 31 B13R2.435 OB(O)C1=CC2=C(S1)C=CC=N2 Z3386911677 [0,0,0,0,0,0|1,0,0]=1 32 B13R2.435 OB(O)C1=CC2=C(S1)C=NC=C2 Z3375944176 [0,0,0,0,0,0|1,0,0]=1 33 B13R2.435 OB(O)C1=CC2=C(S1)N=CC=C2 Z1255445708 [0,0,0,0,0,0|1,0,0]=1 34 B12R2.32 CNC1=NC2=C(S1)C=CC=C2 Z235344695 [1,0,0,0,0,0|3,0,0]=4 35 B12R2.32 N#CC1=CC2=C(N1)C=CC=C2 Z1255419551 [1,0,0,0,0,0|3,0,0]=4 36 B12R2.32 N#CC1=CC2=C(O1)C=CC=C2 Z381355152 [1,0,0,0,0,0|2,1,0]=4 37 B12R2.32 NCC1=CC2=C(N1)C=CC=C2 Z2106601624 [1,0,0,0,0,0|3,0,0]=4 38 B12R2.32 NCC1=CC2=C(S1)C=CC=C2 Z57206121 [1,0,0,0,0,0|2,0,0]=3 39 B12R2.32 NCC1=CC2=C(S1)C=CC=N2 Z3716577874 [1,0,0,0,0,0|3,0,0]=4 40 B12R2.32 NCC1=NC2=C(S1)C=CC=C2 Z166630948 [1,0,0,0,0,0|3,0,0]=4 41 B12R2.32 NNC1=NC2=C(S1)C=CC=C2 Z56756340 [1,0,0,0,0,0|3,0,0]=4 42 B12R2.32 O=CC1=CC2=C(N1)C=CC=C2 Z1203160203 [1,0,0,0,0,0|2,0,1]=4 43 B12R2.32 O=CC1=CC2=C(O1)C=CC=C2 Z147641868 [1,0,0,0,0,0|1,1,1]=4 44 B12R2.32 O=CC1=CC2=C(S1)C=CC=C2 Z1741961424 [1,0,0,0,0,0|1,0,1]=3 45 B12R2.32 O=CC1=CC2=C(S1)C=CC=N2 Z1216823029 [1,0,0,0,0,0|2,0,1]=4 46 B12R2.32 O=CC1=CC2=C(S1)C=NC=C2 Z1198309374 [1,0,0,0,0,0|2,0,1]=4 47 B12R2.32 O=CC1=CC2=C(S1)N=CC=C2 Z1160905957 [1,0,0,0,0,0|2,0,1]=4 48 B12R2.32 O=CC1=NC2=C(S1)C=CC=C2 Z276151160 [1,0,0,0,0,0|2,0,1]=4 49 B12R2.32 OCC1=CC2=C(N1)C=CC=N2 Z1255398720 [1,0,0,0,0,0|3,0,0]=4 50 B12R2.32 OCC1=CC2=C(O1)C=CC=C2 Z164677912 [1,0,0,0,0,0|1,1,0]=3 51 B12R2.32 OCC1=CC2=C(O1)C=CN=C2 Z1255452234 [1,0,0,0,0,0|2,1,0]=4 52 B12R2.32 OCC1=CC2=C(S1)C=CC=C2 Z816841922 [1,0,0,0,0,0|1,0,0]=2 53 B12R2.32 OCC1=CC2=C(S1)C=CC=N2 Z1216823027 [1,0,0,0,0,0|2,0,0]=3 54 B12R2.32 OCC1=CC2=C(S1)C=NC=C2 Z1198727572 [1,0,0,0,0,0|2,0,0]=3 55 B12R2.32 OCC1=CN2C=CC=CC2=N1 Z228586390 [1,0,0,0,0,0|3,0,0]=4 56 B12R2.32 OCC1=NC2=C(N1)C=CC=C2 Z56791635 [1,0,0,0,0,0|3,0,0]=4 57 B12R2.32 OCC1=NC2=C(O1)C=CC=C2 Z431953250 [1,0,0,0,0,0|2,1,0]=4 58 B12R2.32 OCC1=NC2=C(S1)C=CC=C2 Z56899191 [1,0,0,0,0,0|2,0,0]=3 59 B12R2.32 OCC1=NN2C=CC=CC2=C1 Z3464516042 [1,0,0,0,0,0|3,0,0]=4 60 B12R2.32 ONC1=NC2=C(S1)C=CN=C2 Z2678155164 [1,0,0,0,0,0|3,0,0]=4 61 B14R2.450 CC(=O)C1=C(C2=C(S1)C=CC=C2)C Z118256158 [0,1,0,0,0,0|2,0,1]=4 62 B14R2.450 CC1=C(OC2=C1C=CC=C2)C(=O)O Z56174748 [0,1,0,0,0,0|1,1,1]=4 63 B14R2.450 CC1=C(OC2=C1C=CC=C2)C(C)O Z445987528 [0,1,0,0,0,0|2,1,0]=4 64 B14R2.450 CC1=C(SC2=C1C=CC=C2)C(=O)O Z108595136 [0,1,0,0,0,0|1,0,1]=3 65 B14R2.450 CC1=C(SC2=C1C=CC=C2)C(C)N Z444309862 [0,1,0,0,0,0|3,0,0]=4 66 B14R2.450 CN1C(=CC2=C1C=CC=C2)C(=O)O Z57204959 [0,1,0,0,0,0|2,0,1]=4 67 B14R2.450 NC(=O)C1=C(C2=C(S1)C=CC=C2)N Z1255488178 [0,1,0,0,0,0|2,0,1]=4 68 B14R2.450 NC1=C(SC2=C1C=CC=N2)C(=O)O Z274771330 [0,1,0,0,0,0|2,0,1]=4 69 B14R2.450 NC1=C(SC2=C1N=CC=C2)C(=O)O Z1198342553 [0,1,0,0,0,0|2,0,1]=4 70 B14R2.450 O=C(Cl)C1=C(C2=C(S1)C=CC=C2)Cl Z56853844 [0,1,0,0,0,0|2,0,1]=4 71 B14R2.450 O=C(O)C1=C(C2=C(N1)C=CC=C2)Br Z56796061 [0,1,0,0,0,0|2,0,1]=4 72 B14R2.450 O=C(O)C1=C(C2=C(N1)C=CC=C2)Cl Z366436672 [0,1,0,0,0,0|2,0,1]=4 73 B14R2.450 O=C(O)C1=C(C2=C(N1)C=CC=C2)I Z1269193943 [0,1,0,0,0,0|2,0,1]=4 74 B14R2.450 O=C(O)C1=C(C2=C(O1)C=CC=C2)Br Z1681366744 [0,1,0,0,0,0|1,1,1]=4 75 B14R2.450 O=C(O)C1=C(C2=C(O1)C=CC=C2)Cl Z1262529840 [0,1,0,0,0,0|1,1,1]=4 76 B14R2.450 O=C(O)C1=C(C2=C(S1)C=CC=C2)Br Z1269130056 [0,1,0,0,0,0|1,0,1]=3 77 B14R2.450 O=C(O)C1=C(C2=C(S1)C=CC=C2)Cl Z56899077 [0,1,0,0,0,0|1,0,1]=3 78 B14R2.450 O=C(O)C1=C(C2=C(S1)C=CC=N2)Br Z1725968045 [0,1,0,0,0,0|2,0,1]=4 79 B14R2.450 O=C(O)C1=C(C2=C(S1)N=CC=C2)Cl Z1269181488 [0,1,0,0,0,0|2,0,1]=4 80 B14R2.450 O=C(O)C1=CC2=C(C1O)C=CC=C2 Z1262524053 [0,1,0,0,0,0|2,0,1]=4 81 B14R2.972 C/C(=N\O)/C1=CC2=C(O1)C=CC=C2 Z49568632 [0,1,0,0,0,0|2,1,0]=4 82 B14R2.972 CNC(=O)C1=CC2=C(S1)C=CC=C2 Z135505244 [0,1,0,0,0,0|2,0,1]=4 83 B14R2.972 COC(=O)C1=CC2=C(N1)C=CC=C2 Z17755623 [0,1,0,0,0,0|2,0,1]=4 84 B14R2.972 COC(=O)C1=CC2=C(O1)C=CC=C2 Z15842101 [0,1,0,0,0,0|1,1,1]=4 85 B14R2.972 COC(=O)C1=CC2=C(S1)C=NC=C2 Z1322795864 [0,1,0,0,0,0|2,0,1]=4 86 B14R2.972 NCC(=O)C1=CC2=C(S1)C=CC=C2 Z2739947537 [0,1,0,0,0,0|2,0,1]=4 87 B14R2.972 NCC(O)C1=CC2=C(S1)C=CC=C2 Z1198163906 [0,1,0,0,0,0|2,0,0]=3 88 B14R2.3129 CC(C)(O)C1=NC2=C(S1)C=CC=C2 Z1389026653 [0,1,0,0,0,0|3,0,0]=4 89 B14R2.3129 NS(=O)(=O)C1=CC2=C(S1)C=CC=C2 Z1206805216 [0,1,0,0,0,0|1,0,2]=4 90 B14R2.3129 O=S(=O)(O)C1=NC2=C(S1)C=CC=C2 Z57069969 [0,1,0,0,0,0|2,0,1]=4 91 B14R2.4529 CC(=O)C1=CC2=C(S1)C=CC(=C2)O Z1513833562 [0,1,0,0,0,0|2,0,1]=4 92 B14R2.4529 CC(O)C1=CC2=C(O1)C=CC(=C2)Br Z228586348 [0,1,0,0,0,0|2,1,0]=4 93 B14R2.4529 CC(O)C1=NC2=C(S1)C=CC(=C2)Cl Z1219048848 [0,1,0,0,0,0|3,0,0]=4 94 B14R2.4529 CC1=CC2=C(C=C1)C=C(N2)C(=O)O Z119989628 [0,1,0,0,0,0|2,0,1]=4 95 B14R2.4529 CC1=CC2=C(C=C1)C=C(S2)B(O)O Z1198265989 [0,1,0,0,0,0|0,0,0]=1 96 B14R2.4529 CC1=CC2=C(C=C1)NC(=C2)C(=O)O Z235352033 [0,1,0,0,0,0|2,0,1]=4 97 B14R2.4529 CC1=CC2=C(C=C1)OC(=C2)C(=O)O Z274568060 [0,1,0,0,0,0|1,1,1]=4 98 B14R2.4529 CC1=CC2=C(C=C1)SC(=C2)C(=O)O Z1201623026 [0,1,0,0,0,0|1,0,1]=3 99 B14R2.4529 NC1=CC2=C(C=C1)NC(=C2)C(=O)O Z1198179704 [0,1,0,0,0,0|2,0,1]=4 100 B14R2.4529 NC1=CC2=C(C=C1)OC(=C2)C(=O)O Z426041472 [0,1,0,0,0,0|1,1,1]=4 101 B14R2.4529 NC1=CC2=C(C=C1)SC(=C2)C(=O)O Z406715302 [0,1,0,0,0,0|1,0,1]=3 102 B14R2.4529 O=C(O)C1=CC2=C(N1)C=C(C=C2)Br Z119989542 [0,1,0,0,0,0|2,0,1]=4 103 B14R2.4529 O=C(O)C1=CC2=C(N1)C=C(C=C2)Cl Z119990438 [0,1,0,0,0,0|2,0,1]=4 104 B14R2.4529 O=C(O)C1=CC2=C(N1)C=C(C=C2)F Z119989546 [0,1,0,0,0,0|2,0,1]=4 105 B14R2.4529 O=C(O)C1=CC2=C(N1)C=C(C=C2)I Z1269156950 [0,1,0,0,0,0|2,0,1]=4 106 B14R2.4529 O=C(O)C1=CC2=C(N1)C=CC(=C2)Br Z285234024 [0,1,0,0,0,0|2,0,1]=4 107 B14R2.4529 O=C(O)C1=CC2=C(N1)C=CC(=C2)Cl Z235363065 [0,1,0,0,0,0|2,0,1]=4 108 B14R2.4529 O=C(O)C1=CC2=C(N1)C=CC(=C2)F Z235348085 [0,1,0,0,0,0|2,0,1]=4 109 B14R2.4529 O=C(O)C1=CC2=C(N1)C=CC(=C2)I Z1269156688 [0,1,0,0,0,0|2,0,1]=4 110 B14R2.4529 O=C(O)C1=CC2=C(N1)C=CC(=C2)O Z2894427530 [0,1,0,0,0,0|2,0,1]=4 111 B14R2.4529 O=C(O)C1=CC2=C(O1)C=C(C=C2)Cl Z1262517550 [0,1,0,0,0,0|1,1,1]=4 112 B14R2.4529 O=C(O)C1=CC2=C(O1)C=CC(=C2)Br Z111570846 [0,1,0,0,0,0|1,1,1]=4 113 B14R2.4529 O=C(O)C1=CC2=C(O1)C=CC(=C2)Cl Z104341200 [0,1,0,0,0,0|1,1,1]=4 114 B14R2.4529 O=C(O)C1=CC2=C(O1)C=CC(=C2)F Z979493270 [0,1,0,0,0,0|1,1,1]=4 115 B14R2.4529 O=C(O)C1=CC2=C(S1)C=C(C=C2)Cl Z1741972044 [0,1,0,0,0,0|1,0,1]=3 116 B14R2.4529 O=C(O)C1=CC2=C(S1)C=C(C=C2)F Z90121766 [0,1,0,0,0,0|1,0,1]=3 117 B14R2.4529 O=C(O)C1=CC2=C(S1)C=CC(=C2)Br Z1269202680 [0,1,0,0,0,0|1,0,1]=3 118 B14R2.4529 O=C(O)C1=CC2=C(S1)C=CC(=C2)Cl Z1269192627 [0,1,0,0,0,0|1,0,1]=3 119 B14R2.4529 O=C(O)C1=CC2=C(S1)C=CC(=C2)F Z90663383 [0,1,0,0,0,0|1,0,1]=3 120 B14R2.4529 O=C(O)C1=CC2=C(S1)N=C(C=C2)O Z2511836887 [0,1,0,0,0,0|2,0,1]=4 121 B14R2.4529 O=C(O)C1=CC2=C(S1)N=CC(=C2)Br Z1269209487 [0,1,0,0,0,0|2,0,1]=4 122 B14R2.4529 OB(O)C1=CC2=C(O1)C=C(C=C2)Cl Z3271145247 [0,1,0,0,0,0|0,1,0]=2 123 B14R2.4529 OB(O)C1=CC2=C(O1)C=C(C=C2)F Z1862025227 [0,1,0,0,0,0|0,1,0]=2 124 B14R2.4529 OB(O)C1=CC2=C(S1)C=CC(=C2)Cl Z969202862 [0,1,0,0,0,0|0,0,0]=1 125 B14R2.7969 CC1=C2C=C(NC2=CC=C1)C(=O)O Z119989626 [0,1,0,0,0,0|2,0,1]=4 126 B14R2.7969 CC1=C2C=C(OC2=CC=C1)C(=O)O Z1262514439 [0,1,0,0,0,0|1,1,1]=4 127 B14R2.7969 CC1=C2NC(=CC2=CC=C1)C(=O)O Z285234008 [0,1,0,0,0,0|2,0,1]=4 128 B14R2.7969 CC1=C2OC(=CC2=CC=C1)C(=O)O Z406682014 [0,1,0,0,0,0|1,1,1]=4 129 B14R2.7969 CC1=C2SC(=CC2=CC=C1)B(O)O Z969202902 [0,1,0,0,0,0|0,0,0]=1 130 B14R2.7969 CC1=C2SC(=CC2=CC=C1)C(=O)O Z1504672143 [0,1,0,0,0,0|1,0,1]=3 131 B14R2.7969 O=C(O)C1=CC2=C(N1)C(=CC=C2)Br Z431558930 [0,1,0,0,0,0|2,0,1]=4 132 B14R2.7969 O=C(O)C1=CC2=C(N1)C(=CC=C2)F Z285234022 [0,1,0,0,0,0|2,0,1]=4 133 B14R2.7969 O=C(O)C1=CC2=C(N1)C(=CC=C2)O Z1201622528 [0,1,0,0,0,0|2,0,1]=4 134 B14R2.7969 O=C(O)C1=CC2=C(N1)C=CC=C2Cl Z119989536 [0,1,0,0,0,0|2,0,1]=4 135 B14R2.7969 O=C(O)C1=CC2=C(N1)C=CC=C2F Z119989618 [0,1,0,0,0,0|2,0,1]=4 136 B14R2.7969 O=C(O)C1=CC2=C(N1)C=CC=C2I Z1269151806 [0,1,0,0,0,0|2,0,1]=4 137 B14R2.7969 O=C(O)C1=CC2=C(O1)C(=CC=C2)Br Z393620108 [0,1,0,0,0,0|1,1,1]=4 138 B14R2.7969 O=C(O)C1=CC2=C(O1)C(=CC=C2)Cl Z406682018 [0,1,0,0,0,0|1,1,1]=4 139 B14R2.7969 O=C(O)C1=CC2=C(O1)C(=CC=C2)F Z406682016 [0,1,0,0,0,0|1,1,1]=4 140 B14R2.7969 O=C(O)C1=CC2=C(S1)C(=CC=C2)Cl Z1269194521 [0,1,0,0,0,0|1,0,1]=3 141 B14R2.7969 O=C(O)C1=CC2=C(S1)C(=CC=C2)F Z1201624111 [0,1,0,0,0,0|1,0,1]=3 142 B14R2.7969 O=C(O)C1=CC2=C(S1)C(=CC=N2)Cl Z1269202914 [0,1,0,0,0,0|2,0,1]=4 143 B14R2.7969 O=C(O)C1=CC2=C(S1)C=CC=C2Br Z1269230239 [0,1,0,0,0,0|1,0,1]=3 144 B14R2.7969 O=C(O)C1=CC2=C(S1)C=CC=C2Cl Z90662195 [0,1,0,0,0,0|1,0,1]=3 145 B14R2.7969 O=C(O)C1=CC2=C(S1)C=CC=C2F Z57036343 [0,1,0,0,0,0|1,0,1]=3 146 B14R2.7969 O=C(O)C1=CC2=C(S1)C=NC=C2Cl Z1269153683 [0,1,0,0,0,0|2,0,1]=4 147 B14R2.7969 OB(O)C1=CC2=C(O1)C(=CC=C2)F Z1742195751 [0,1,0,0,0,0|0,1,0]=2 148 B14R2.7969 OB(O)C1=CC2=C(S1)C(=CC=C2)Cl Z934363134 [0,1,0,0,0,0|0,0,0]=1 149 B14R2.7969 OB(O)C1=CC2=C(S1)C(=CC=C2)F Z969202878 [0,1,0,0,0,0|0,0,0]=1 150 B14R2.7969 OB(O)C1=CC2=C(S1)C=CC=C2F Z3300721173 [0,1,0,0,0,0|0,0,0]=1 151 B12R1.43 C/C(=C\C1=CC=CC=C1)/C(=O)O Z2980228149 [0,0,1,0,0,0|2,0,1]=4 152 B12R1.125 CC1=C(C=CC=C1)/C=C/C(=O)O Z2417574586 [0,0,1,0,0,0|2,0,1]=4 153 B12R1.125 O=C(O)/C=C/C1=C(C=CC=C1)Br Z2315575361 [0,0,1,0,0,0|2,0,1]=4 154 B12R1.125 O=C(O)/C=C/C1=C(C=CC=C1)Cl Z57264035 [0,0,1,0,0,0|2,0,1]=4 155 B12R1.125 O=C(O)/C=C/C1=C(C=CC=C1)F Z2573655240 [0,0,1,0,0,0|2,0,1]=4 156 B14R3.14987 C1=CC2=C(C=C1)OC(=C2)C3CO3 Z285186474 [0,0,0,1,0,0|2,1,0]=4 157 B14R3.14987 C1=CC2=C(C=C1)OC(=C2)[C@@H]3CO3 Z1575341648 [0,0,0,1,0,0|2,1,0]=4 158 B14R3.14987 C1=CC2=C(C=C1)OC(=C2)[C@H]3CO3 Z1575341761 [0,0,0,1,0,0|2,1,0]=4 159 B12R2.252 O=C(O)C1=CC2=C(S1)C=CN2 Z235352827 [0,0,0,0,1,0|2,0,1]=4 160 B12R2.252 O=C(O)C1=CC2=C(S1)C=CO2 Z1227757230 [0,0,0,0,1,0|2,0,1]=4 161 B12R2.252 O=C(O)C1=CC2=C(S1)C=CS2 Z666140572 [0,0,0,0,1,0|2,0,1]=4 162 B12R2.252 O=C(O)C1=CC2=C(S1)SC=C2 Z1198150636 [0,0,0,0,1,0|2,0,1]=4 163 B14R2.768 CC(N)CC1=CC2=C(S1)C=CC=C2 Z5470075707 [0,0,0,0,0,1|3,0,0]=4 164 B14R2.768 CC(O)CC1=NC2=C(S1)C=CC=C2 Z1098229000 [0,0,0,0,0,1|3,0,0]=4 165 B14R2.768 O=C(O)CC1=CC2=C(C1)C=CC=C2 Z1262511318 [0,0,0,0,0,1|2,0,1]=4 166 B14R2.768 O=C(O)CC1=CC2=C(O1)C=CC=C2 Z235569554 [0,0,0,0,0,1|1,1,1]=4 167 B14R2.768 O=C(O)CC1=CC2=C(S1)C=CC=C2 Z1198265898 [0,0,0,0,0,1|1,0,1]=3 168 B14R2.768 O=C(O)CC1=NC2=C(S1)C=CC=C2 Z57055798 [0,0,0,0,0,1|2,0,1]=4 169 B14R2.781 CC(O)C1=CC2=C(C=CC=C2)C=C1 Z335245116 [0,0,0,0,0,1|3,0,0]=4 170 B14R2.781 CC(O)C1=CC2=C(C=CC=C2)N=C1 Z608483400 [0,0,0,0,0,1|3,0,0]=4 171 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)C=C1 Z104475600 [0,0,0,0,0,1|2,0,1]=4 172 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)N=C1 Z838909446 [0,0,0,0,0,1|2,0,1]=4 173 B14R2.781 O=C(O)C1=NC2=C(C=CC=C2)C=C1 Z104473458 [0,0,0,0,0,1|2,0,1]=4 174 B14R2.781 O=C(O)C1=NC=C2C=CC=CC2=C1 Z1198150075 [0,0,0,0,0,1|2,0,1]=4 175 B14R2.781 O=C(O)C1=NN=C2C=CC=CC2=C1 Z246671302 [0,0,0,0,0,1|2,0,1]=4 176 B14R2.781 OB(O)C1=CC2=C(C=C1)C=NC=C2 Z1201625563 [0,0,0,0,0,1|2,0,0]=3 177 B14R2.781 OB(O)C1=CC2=C(C=CC=C2)C=C1 Z381540938 [0,0,0,0,0,1|1,0,0]=2 178 B14R2.781 OB(O)C1=CC2=C(C=CC=C2)N=C1 Z330820004 [0,0,0,0,0,1|1,0,0]=2 179 B14R2.781 OB(O)C1=CC2=C(C=CC=N2)N=C1 Z3710553964 [0,0,0,0,0,1|2,0,0]=3 180 B11R1.91 O=C(O)/C=C/C1=CC=CC=C1 Z104474406 [1,0,1,0,0,0|1,0,1]=4 181 B11R1.91 OB(O)/C=C/C1=CC=CC=C1 Z2315575087 [1,0,1,0,0,0|0,0,0]=2 182 B11R1.91 OB(O)CCC1=CC=CC=C1 Z1147227790 [1,0,1,0,0,0|0,0,2]=4 183 B11R2.10 BrC1=CC2=C(S1)C=NC=C2 Z1269169662 [2,0,0,0,0,0|2,0,0]=4 184 B11R2.10 BrC1=NC2=C(S1)C=CC=C2 Z415645026 [2,0,0,0,0,0|2,0,0]=4 185 B11R2.10 CC1=CC2=C(O1)C=CC=C2 Z1255386706 [2,0,0,0,0,0|1,1,0]=4 186 B11R2.10 CC1=NC2=C(S1)C=CC=C2 Z2854344256 [2,0,0,0,0,0|2,0,0]=4 187 B11R2.10 NC1=NC2=C(S1)C=CC=C2 Z56912586 [2,0,0,0,0,0|2,0,0]=4 188 B11R2.10 O=C1NC2=C(S1)C=CC=C2 Z57728688 [2,0,0,0,0,0|1,0,1]=4 189 B11R2.10 OC1=CN2C=CC=CC2=N1 Z3305157547 [2,0,0,0,0,0|2,0,0]=4 190 B11R2.10 OC1=NN2C=CC=CC2=C1 Z1198235676 [2,0,0,0,0,0|2,0,0]=4 191 B11R2.10 S=C1SC2=C(S1)C=CC=C2 Z1198152357 [2,0,0,0,0,0|1,1,0]=4 192 B11R2.10 SC1=NC2=C(S1)C=CC=C2 Z104499140 [2,0,0,0,0,0|1,1,0]=4 193 B13R2.26 N#CCC1=CC2=C(S1)C=CC=C2 Z1255396401 [1,1,0,0,0,0|2,0,0]=4 194 B13R2.26 OCCC1=CC2=C(N1)C=CC=C2 Z1198729419 [1,1,0,0,0,0|2,0,0]=4 195 B13R2.26 OCCC1=NC2=C(S1)C=CC=C2 Z90122385 [1,1,0,0,0,0|2,0,0]=4 196 B13R2.43 CC1=CC2=C(C=C1)SC(=N2)CO Z1255393536 [1,1,0,0,0,0|2,0,0]=4 197 B13R2.43 NC1=CC2=C(C=C1)OC(=C2)CO Z1262684953 [1,1,0,0,0,0|1,1,0]=4 198 B13R2.43 NCC1=CC2=C(S1)C=CC(=C2)Br Z2375650208 [1,1,0,0,0,0|2,0,0]=4 199 B13R2.43 O=CC1=CC2=C(S1)C=CC(=C2)Br Z1269192528 [1,1,0,0,0,0|1,0,1]=4 200 B13R2.43 O=CC1=CC2=C(S1)C=CC(=C2)Cl Z1201628726 [1,1,0,0,0,0|1,0,1]=4 201 B13R2.43 OCC1=CC2=C(N1)C=C(C=C2)Br Z228589546 [1,1,0,0,0,0|2,0,0]=4 202 B13R2.43 OCC1=NC2=C(S1)C=CC(=C2)Cl Z228584310 [1,1,0,0,0,0|2,0,0]=4 203 B13R2.45 CC1=C(OC2=C1C=CC=C2)CO Z1202142721 [1,1,0,0,0,0|1,1,0]=4 204 B13R2.45 CC1=C(SC2=C1C=CC=C2)C=O Z1255486176 [1,1,0,0,0,0|1,0,1]=4 205 B13R2.45 ClCC1=C(C2=C(S1)C=CC=C2)Cl Z166652082 [1,1,0,0,0,0|2,0,0]=4 206 B13R2.45 N#CC1=C(C2=C(S1)C=CC=C2)Cl Z1198154345 [1,1,0,0,0,0|2,0,0]=4 207 B13R2.45 N#CC1=C(C2=C(S1)C=CC=C2)F Z2935555842 [1,1,0,0,0,0|2,0,0]=4 208 B13R2.45 N#CC1=C(C2=C(S1)C=CC=C2)N Z1201621387 [1,1,0,0,0,0|2,0,0]=4 209 B13R2.45 NCC1=C(C2=C(S1)C=CC=C2)Br Z2934526529 [1,1,0,0,0,0|2,0,0]=4 210 B13R2.45 O=CC1=C(C2=C(S1)C=CC=C2)Br Z1269136159 [1,1,0,0,0,0|1,0,1]=4 211 B13R2.45 O=CC1=C(C2=C(S1)C=CC=C2)Cl Z90122764 [1,1,0,0,0,0|1,0,1]=4 212 B13R2.45 OCC1=C(C2=C(S1)C=CC=C2)Cl Z166631690 [1,1,0,0,0,0|1,0,0]=3 213 B13R2.54 CC1=C2C=C(NC2=CC=C1)CO Z1332263558 [1,1,0,0,0,0|2,0,0]=4 214 B13R2.54 O=CC1=CC2=C(C=CC=C2S1)Br Z1269222589 [1,1,0,0,0,0|1,0,1]=4 215 B13R2.54 O=CC1=CC2=C(C=CC=C2S1)Cl Z1201625806 [1,1,0,0,0,0|1,0,1]=4 216 B13R2.54 O=CC1=CC2=C(C=CC=C2S1)O Z2582393476 [1,1,0,0,0,0|1,0,1]=4 217 B13R2.54 OCC1=CC2=C(N1)C=CC=C2Cl Z1251357721 [1,1,0,0,0,0|2,0,0]=4 218 B15R2.629 CC1=C(SC2=C1C=CC=C2)CC(=O)O Z1269128994 [0,1,0,0,0,1|1,0,1]=4 219 B15R2.627 OB(O)C1=C(C2=C(C=CC=C2)C=C1)F Z1255390304 [0,1,0,0,0,1|1,0,0]=3 220 B15R2.627 OB(O)C1=C(C2=C(C=CC=C2)N=C1)F Z1255442977 [0,1,0,0,0,1|1,0,0]=3 221 B15R2.984 OB(O)C1=C(C=C2C=CC=CC2=C1)Br Z1269159305 [0,1,0,0,0,1|1,0,0]=3 222 B15R2.984 OB(O)C1=C(C=C2C=CC=CC2=C1)Cl Z1269213232 [0,1,0,0,0,1|1,0,0]=3 223 B15R2.984 OB(O)C1=C(N=C2C=CC=CC2=C1)O Z1198276711 [0,1,0,0,0,1|1,0,0]=3 224 B15R2.7174 NC1=CC2=C(C=C1)C=CC(=C2)B(O)O Z1255419055 [0,1,0,0,0,1|1,0,0]=3 225 B15R2.7174 O=C(O)C1=CC2=C(C=CC(=C2)Br)SC1 Z4663240794 [0,1,0,0,0,1|1,0,1]=4 226 B15R2.7174 OB(O)C1=CC2=C(C=CC(=C2)F)N=C1 Z1504685230 [0,1,0,0,0,1|1,0,0]=3 227 B15R2.7174 OB(O)C1=CC2=C(C=CC(=C2)O)C=C1 Z1255376086 [0,1,0,0,0,1|1,0,0]=3 228 B15R2.7180 CC1=NC2=C(C=C1)C=C(C=C2)B(O)O Z1198175897 [0,1,0,0,0,1|2,0,0]=4 229 B15R2.7180 OB(O)C1=CC2=C(C=C1)C=C(C=C2)Cl Z1269142101 [0,1,0,0,0,1|1,0,0]=3 230 B15R2.7180 OB(O)C1=CC2=C(C=C1)C=C(C=C2)O Z1201619060 [0,1,0,0,0,1|1,0,0]=3 231 B15R2.13598 CC1=C2N=CC(=CC2=CC=C1)B(O)O Z1723815218 [0,1,0,0,0,1|1,0,0]=3 232 B15R2.13598 OB(O)C1=CC2=C(N=C1)C(=CC=C2)Cl Z1504680559 [0,1,0,0,0,1|1,0,0]=3 233 B15R2.13598 OB(O)C1=CC2=C(N=C1)C(=CC=C2)F Z1255464735 [0,1,0,0,0,1|1,0,0]=3 234 B15R2.1592 COC(=O)C1=C(C2=C(S1)C=CC=C2)Cl Z18785097 [0,2,0,0,0,0|1,0,1]=4 235 B15R2.1592 COC(=O)C1=C(C2=C(S1)C=CC=C2)N Z119894754 [0,2,0,0,0,0|1,0,1]=4 236 B15R2.1592 COC(=O)C1=C(C2=C(S1)C=CC=C2)O Z1269129693 [0,2,0,0,0,0|1,0,1]=4 237 B15R2.4190 CCC1=C(SC2=C1C=CC=C2)C(=O)O Z1416180722 [0,2,0,0,0,0|1,0,1]=4 238 B15R2.4190 NCC1=C(SC2=C1C=CC=C2)C(=O)O Z4879384327 [0,2,0,0,0,0|1,0,1]=4 239 B15R2.7203 CC1=C(SC2=C1C=C(C=C2)Br)C(=O)O Z390053050 [0,2,0,0,0,0|1,0,1]=4 240 B15R2.7203 CC1=C(SC2=C1C=C(C=C2)Cl)C(=O)O Z384973622 [0,2,0,0,0,0|1,0,1]=4 241 B15R2.7203 CC1=C(SC2=C1C=C(C=C2)F)C(=O)O Z384973626 [0,2,0,0,0,0|1,0,1]=4 242 B15R2.13463 NC1=C(SC2=C1C=CC=C2Br)C(=O)O Z2313760653 [0,2,0,0,0,0|1,0,1]=4 243 B15R2.13629 CC1=C(SC2=C1C(=CC=C2)F)C(=O)O Z90124531 [0,2,0,0,0,0|1,0,1]=4 244 B15R2.13629 CC1=C2C(=CC=C1)SC(=C2Cl)C(=O)O Z228588438 [0,2,0,0,0,0|1,0,1]=4 245 B15R2.13629 O=C(O)C1=C(C2=C(S1)C=CC=C2Cl)Cl Z228589014 [0,2,0,0,0,0|1,0,1]=4 246 B15R2.13629 O=C(O)C1=C(C2=C(S1)C=CC=C2F)Cl Z363995698 [0,2,0,0,0,0|1,0,1]=4 247 B15R2.14758 CC1=C(SC2=C1C=CC(=C2)F)C(=O)O Z905065780 [0,2,0,0,0,0|1,0,1]=4 248 B15R2.14758 CC1=CC2=C(C=C1)C(=C(S2)C(=O)O)Cl Z228588844 [0,2,0,0,0,0|1,0,1]=4 249 B15R2.14758 O=C(O)C1=C(C2=C(S1)C=C(C=C2)Br)Cl Z228589152 [0,2,0,0,0,0|1,0,1]=4 250 B15R2.14758 O=C(O)C1=C(C2=C(S1)C=C(C=C2)Cl)Cl Z56896343 [0,2,0,0,0,0|1,0,1]=4 251 B15R2.14758 O=C(O)C1=C(C2=C(S1)C=C(C=C2)F)Cl Z56794113 [0,2,0,0,0,0|1,0,1]=4 252 B15R2.1356 COCC(=O)C1=CC2=C(S1)C=CC=C2 Z1763865400 [0,2,0,0,0,0|1,0,1]=4 253 B15R2.1590 COC(=O)C1=CC2=C(S1)C=C(C=C2)F Z90089811 [0,2,0,0,0,0|1,0,1]=4 254 B15R2.1590 COC(=O)C1=CC2=C(S1)C=CC(=C2)Br Z1269233055 [0,2,0,0,0,0|1,0,1]=4 255 B15R2.1598 COC(=O)C1=CC2=C(S1)C(=CC=C2)F Z1269207136 [0,2,0,0,0,0|1,0,1]=4 256 B15R2.1598 COC(=O)C1=CC2=C(S1)C(=CC=C2)N Z1269214255 [0,2,0,0,0,0|1,0,1]=4 257 B15R2.1598 COC(=O)C1=CC2=C(S1)C(=CC=C2)O Z1513905174 [0,2,0,0,0,0|1,0,1]=4 258 B15R2.1598 COC(=O)C1=CC2=C(S1)C=CC=C2Cl Z24220486 [0,2,0,0,0,0|1,0,1]=4 259 B15R2.1598 COC(=O)C1=CC2=C(S1)C=CC=C2F Z24634237 [0,2,0,0,0,0|1,0,1]=4 260 B15R2.1598 COC(=O)C1=CC2=C(S1)C=CC=C2O Z1322793552 [0,2,0,0,0,0|1,0,1]=4 261 B15R2.1102 O=C(O)C1=CC2=C(S1)C=C(C(=C2)O)O Z1508955328 [0,2,0,0,0,0|1,0,1]=4 262 B15R2.1102 OB(O)C1=CC2=C(S1)C=C(C(=C2)F)F Z2313582051 [0,2,0,0,0,0|0,0,0]=2 263 B15R2.4834 COC1=CC2=C(C=C1)C=C(S2)B(O)O Z1269238917 [0,2,0,0,0,0|0,0,0]=2 264 B15R2.4834 COC1=CC2=C(C=C1)C=C(S2)C(=O)O Z1269174646 [0,2,0,0,0,0|1,0,1]=4 265 B15R2.4834 COC1=CC2=C(C=C1)OC(=C2)B(O)O Z1198170834 [0,2,0,0,0,0|0,1,0]=3 266 B15R2.4834 COC1=CC2=C(C=C1)SC(=C2)B(O)O Z969202886 [0,2,0,0,0,0|0,0,0]=2 267 B15R2.7254 O=C(O)C1=CC2=C(S1)C=CC(=C2Br)Cl Z2313616098 [0,2,0,0,0,0|1,0,1]=4 268 B15R2.7254 O=C(O)C1=CC2=C(S1)C=CC(=C2F)F Z2313581691 [0,2,0,0,0,0|1,0,1]=4 269 B15R2.14566 O=C(O)C1=CC2=C(S1)C(=CC=C2F)F Z2313581708 [0,2,0,0,0,0|1,0,1]=4 270 B15R2.20824 COC1=C2C=C(SC2=CC=C1)C(=O)O Z1269138553 [0,2,0,0,0,0|1,0,1]=4 271 B15R2.20824 COC1=C2OC(=CC2=CC=C1)B(O)O Z945785254 [0,2,0,0,0,0|0,1,0]=3 272 B15R2.20824 O=CC1=CC=CC2=C1C=C(S2)C(=O)O Z1509033676 [0,2,0,0,0,0|1,0,1]=4 273 B13R2.72 OB(O)C1=CSC2=C1C=CC=C2 Z1255383526 [0,0,1,1,0,0|2,0,0]=4 274 B13R2.430 OB(O)C1=CC2=C(C=C1)OC=C2 Z1198163987 [0,0,1,1,0,0|2,0,0]=4 275 B13R2.430 OB(O)C1=CC2=C(C=CO2)C=C1 Z1255393490 [0,0,1,1,0,0|2,0,0]=4 276 B13R2.5569 OB(O)C1=C2C=COC2=CC=C1 Z1201628916 [0,0,1,1,0,0|2,0,0]=4 277 B13R2.5569 OB(O)C1=C2SC=CC2=CC=C1 Z1198170057 [0,0,1,1,0,0|2,0,0]=4 278 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 Z1201618094 [0,0,1,0,1,0|1,0,1]=4 279 B11R1.86 OB(O)CC1=C(C=CC=C1)Cl Z1147227737 [0,0,1,0,1,0|1,0,1]=4 280 B11R2.15 OCC1=CC2=C(S1)C=CS2 Z1198175580 [1,0,0,0,1,0|2,0,0]=4 281 B13R2.57 OCC1=CC2=C(C=CC=C2)N=C1 Z1069472334 [1,0,0,0,0,1|2,0,0]=4