0 B10R1.4 CC1=C(CCN)C=CC=C1 C78305 [0,0,0,0,0,0|1,0,0]=1 1 B10R1.4 CC1=CC=CN=C1CCN C80033 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.4 CCNC1=C(N)C=NC=C1 W19029 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.4 CCNC1=C(O)C=CC=C1 I11473 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.4 CCNC1=CC=CN=C1N P19791 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.4 CCOC1=C(N)C=CN=C1 79299 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.4 CCOC1=CC=CN=C1F AC1769 [0,0,0,0,0,0|3,1,0]=4 7 B10R1.4 CCOC1=CC=CNC1=O N13107 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.4 CCOC1=NC=CC=C1O 79061 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.4 CNCC1=CC=CN=C1C AC2519 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.4 COCC1=C(O)C=CC=C1 AC1453 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.4 N#CCC1=C(Br)C=CC=N1 P10900 [0,0,0,0,0,0|1,1,2]=4 12 B10R1.4 N#CCC1=C(Cl)C=NC=C1 AC8798 [0,0,0,0,0,0|1,0,2]=3 13 B10R1.4 N#CCC1=C(Cl)C=NC=N1 A11654 [0,0,0,0,0,0|2,0,2]=4 14 B10R1.4 N#CCC1=C(F)C=CC=N1 O10465 [0,0,0,0,0,0|1,1,2]=4 15 B10R1.4 N#CCC1=C(N)N=CC=C1 D81373 [0,0,0,0,0,0|2,0,2]=4 16 B10R1.4 N#CCC1=C(O)C=CC=C1 32266 [0,0,0,0,0,0|1,0,2]=3 17 B10R1.4 N#CCC1=CC=CN=C1Br C71752 [0,0,0,0,0,0|1,1,2]=4 18 B10R1.4 N#CCC1=NC=CC=C1N C71092 [0,0,0,0,0,0|2,0,2]=4 19 B10R1.4 N#CCC1=NC=CN=C1Cl 38700 [0,0,0,0,0,0|2,0,2]=4 20 B10R1.4 NC1=C(CCO)C=CC=N1 70885 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.4 NCCC1=C(Br)C=CC=N1 P10594 [0,0,0,0,0,0|1,1,0]=2 22 B10R1.4 NCCC1=C(O)C=CC=C1 83456 [0,0,0,0,0,0|1,0,0]=1 23 B10R1.4 NNCC1=C(Br)C=CC=C1 37005 [0,0,0,0,0,0|1,1,0]=2 24 B10R1.4 O=CCC1=C(Br)C=CC=C1 W16824 [0,0,0,0,0,0|1,1,1]=3 25 B10R1.4 O=CCC1=C(F)C=CC=C1 W16825 [0,0,0,0,0,0|1,1,1]=3 26 B10R1.4 OCCC1=C(F)C=CC=N1 P15943 [0,0,0,0,0,0|2,1,0]=3 27 B10R1.4 [BH3-]C1=C(CNC)C=CC=C1 AC8598 [0,0,0,0,0,0|3,0,0]=3 28 B9R1.8 BrC#CC1=CC=CC=C1 A51120 [1,0,0,0,0,0|1,0,2]=4 29 B9R1.8 BrCCC1=CC=NC=C1 C71689 [1,0,0,0,0,0|2,0,0]=3 30 B9R1.8 CCNC1=CC=CN=C1 C15578 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.8 CNCC1=CC=NC=C1 AR1712 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.8 ClCCC1=CC=NC=C1 O11064 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.8 NCCC1=NC=CC=N1 P15951 [1,0,0,0,0,0|2,0,0]=3 34 B9R1.8 NCCC1=NC=CN=C1 AR1061 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.8 NCCC1=NC=NC=C1 P18517 [1,0,0,0,0,0|2,0,0]=3 36 B9R1.8 NNCC1=CC=CN=C1 78930 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.8 NNCC1=CC=NC=C1 37009 [1,0,0,0,0,0|2,0,0]=3 38 B9R1.8 NNCC1=CC=NC=C1 BL009189 [1,0,0,0,0,0|2,0,0]=3 39 B9R1.8 NNCC1=CN=CN=C1 37093 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.8 NNCC1=NC=CC=C1 78929 [1,0,0,0,0,0|2,0,0]=3 41 B9R1.8 NNCC1=NC=CN=C1 37235 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.8 NOCC1=CN=CC=C1 AC6038 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.8 N\N=C\C1=CC=CC=C1 D81797 [1,0,0,0,0,0|1,0,1]=3 44 B9R1.8 OCCC1=CN=CN=C1 27368 [1,0,0,0,0,0|3,0,0]=4 45 B9R1.8 OCCC1=NC=CC=N1 C14218 [1,0,0,0,0,0|3,0,0]=4 46 B9R1.8 O\N=C/C1=CC=CC=C1 N10040 [1,0,0,0,0,0|2,0,1]=4 47 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 C11398 [1,0,0,0,0,0|2,0,0]=3 48 B9R1.15 BrCC1=C(Br)C=CC=N1 N13045 [1,0,0,0,0,0|2,1,0]=4 49 B9R1.15 C#CC1=C(Cl)C=NC=C1 79083 [1,0,0,0,0,0|1,0,2]=4 50 B9R1.15 C=CC1=C(N)C=CC=C1 25265 [1,0,0,0,0,0|1,0,2]=4 51 B9R1.15 CC1=C(CBr)C=CC=N1 F16424 [1,0,0,0,0,0|3,0,0]=4 52 B9R1.15 CC1=C(CCl)C=CC=N1 24248 [1,0,0,0,0,0|3,0,0]=4 53 B9R1.15 CC1=C(CCl)C=NC=C1 C72783 [1,0,0,0,0,0|3,0,0]=4 54 B9R1.15 CC1=C(CO)C=NC=C1 38669 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.15 CC1=C(NN)C=CN=C1 F15970 [1,0,0,0,0,0|3,0,0]=4 56 B9R1.15 CC1=CC=CN=C1CN C72913 [1,0,0,0,0,0|2,0,0]=3 57 B9R1.15 CC1=NC=CC=C1CN 72802 [1,0,0,0,0,0|2,0,0]=3 58 B9R1.15 CC1=NC=CC=C1CN AB7634 [1,0,0,0,0,0|2,0,0]=3 59 B9R1.15 CC1=NC=CN=C1CN E70300 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.15 CC1=NC=CN=C1CN P19746 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.15 CCC1=C(Br)C=CC=N1 P11641 [1,0,0,0,0,0|1,1,0]=3 62 B9R1.15 CCC1=C(Br)C=CN=C1 38064 [1,0,0,0,0,0|1,1,0]=3 63 B9R1.15 CCC1=C(F)C=CC=C1 F20938 [1,0,0,0,0,0|0,1,0]=2 64 B9R1.15 CCC1=C(O)C=CC=N1 71246 [1,0,0,0,0,0|2,0,0]=3 65 B9R1.15 CCC1=CC=CN=C1Br D80252 [1,0,0,0,0,0|1,1,0]=3 66 B9R1.15 CCC1=CC=CN=C1N 55791 [1,0,0,0,0,0|2,0,0]=3 67 B9R1.15 CCC1=CC=NN=C1Cl S11385 [1,0,0,0,0,0|2,0,0]=3 68 B9R1.15 CCC1=CC=NNC1=O S11452 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.15 CCC1=NC=CN=C1N RB3385 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.15 CCC1=NC=CNC1=O S12194 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.15 CNC1=C(C)C=CN=C1 C12398 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.15 CNC1=C(I)C=NC=C1 D83398 [1,0,0,0,0,0|2,1,0]=4 73 B9R1.15 CNC1=C(N)C=CN=C1 F51691 [1,0,0,0,0,0|3,0,0]=4 74 B9R1.15 CNC1=C(N)C=NC=C1 C73540 [1,0,0,0,0,0|3,0,0]=4 75 B9R1.15 CNC1=CC=CN=C1N 94808 [1,0,0,0,0,0|3,0,0]=4 76 B9R1.15 CNC1=NC=CC=C1N 72351 [1,0,0,0,0,0|3,0,0]=4 77 B9R1.15 COC1=C(Br)C=CN=C1 26564 [1,0,0,0,0,0|2,1,0]=4 78 B9R1.15 COC1=C(I)C=CN=C1 D82954 [1,0,0,0,0,0|2,1,0]=4 79 B9R1.15 COC1=C(N)C=CN=C1 35474 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.15 COC1=C(O)C=NC=C1 79066 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.15 COC1=NC=CC=C1C C73664 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.15 CSC1=C(F)N=CC=C1 F50785 [1,0,0,0,0,0|2,1,0]=4 83 B9R1.15 CSC1=C(N)C=CN=C1 W16024 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.15 ClCC1=C(Br)C=CC=N1 W15864 [1,0,0,0,0,0|2,1,0]=4 85 B9R1.15 ClCC1=C(Br)C=NC=C1 32531 [1,0,0,0,0,0|2,1,0]=4 86 B9R1.15 ClCC1=C(Cl)C=CC=N1 86866 [1,0,0,0,0,0|2,0,0]=3 87 B9R1.15 ClCC1=C(Cl)C=CC=N1 C71965 [1,0,0,0,0,0|2,0,0]=3 88 B9R1.15 FC1=C(CBr)C=CC=N1 72213 [1,0,0,0,0,0|2,1,0]=4 89 B9R1.15 FC1=C(CCl)C=CN=C1 72889 [1,0,0,0,0,0|2,1,0]=4 90 B9R1.15 FC1=CC=CN=C1CBr 38126 [1,0,0,0,0,0|2,1,0]=4 91 B9R1.15 FC1=CC=CN=C1CCl AC1446 [1,0,0,0,0,0|2,1,0]=4 92 B9R1.15 NC1=C(CO)C=CN=C1 F13531 [1,0,0,0,0,0|3,0,0]=4 93 B9R1.15 NC1=C(CO)C=NC=C1 28348 [1,0,0,0,0,0|3,0,0]=4 94 B9R1.15 NC1=CC=CN=C1CO H10562 [1,0,0,0,0,0|3,0,0]=4 95 B9R1.15 NCC1=C(Br)C=CC=N1 N13373 [1,0,0,0,0,0|1,1,0]=3 96 B9R1.15 NCC1=C(Br)C=CC=N1 Y13366 [1,0,0,0,0,0|1,1,0]=3 97 B9R1.15 NCC1=C(Br)C=CN=C1 F30244 [1,0,0,0,0,0|1,1,0]=3 98 B9R1.15 NCC1=C(Br)C=NC=C1 O10077 [1,0,0,0,0,0|1,1,0]=3 99 B9R1.15 NCC1=C(Cl)C=CC=N1 20194 [1,0,0,0,0,0|1,0,0]=2 100 B9R1.15 NCC1=C(Cl)C=CN=C1 73185 [1,0,0,0,0,0|1,0,0]=2 101 B9R1.15 NCC1=C(Cl)C=NC=C1 D79765 [1,0,0,0,0,0|1,0,0]=2 102 B9R1.15 NCC1=C(Cl)C=NC=C1 F50132 [1,0,0,0,0,0|1,0,0]=2 103 B9R1.15 NCC1=C(F)C=CC=N1 37501 [1,0,0,0,0,0|1,1,0]=3 104 B9R1.15 NCC1=C(F)C=CC=N1 71993 [1,0,0,0,0,0|1,1,0]=3 105 B9R1.15 NCC1=C(F)C=CC=N1 P10857 [1,0,0,0,0,0|1,1,0]=3 106 B9R1.15 NCC1=C(F)C=NC=C1 26837 [1,0,0,0,0,0|1,1,0]=3 107 B9R1.15 NCC1=C(F)C=NC=C1 78901 [1,0,0,0,0,0|1,1,0]=3 108 B9R1.15 NCC1=C(I)C=CC=C1 C75019 [1,0,0,0,0,0|0,1,0]=2 109 B9R1.15 NCC1=CC=CN=C1Br D82416 [1,0,0,0,0,0|1,1,0]=3 110 B9R1.15 NCC1=CC=CN=C1Cl 51113 [1,0,0,0,0,0|1,0,0]=2 111 B9R1.15 NCC1=CC=CN=C1N 89358 [1,0,0,0,0,0|2,0,0]=3 112 B9R1.15 NCC1=CC=CN=C1O 55767 [1,0,0,0,0,0|2,0,0]=3 113 B9R1.15 NCC1=NC=CC=C1N AC4283 [1,0,0,0,0,0|2,0,0]=3 114 B9R1.15 NCC1=NC=CN=C1N AB3037 [1,0,0,0,0,0|3,0,0]=4 115 B9R1.15 NNC1=C(Br)C=NC=C1 C13755 [1,0,0,0,0,0|2,1,0]=4 116 B9R1.15 NNC1=C(Cl)C=NC=N1 D72722 [1,0,0,0,0,0|3,0,0]=4 117 B9R1.15 NNC1=C(F)C=CC=N1 F20903 [1,0,0,0,0,0|2,1,0]=4 118 B9R1.15 NNC1=C(I)C=CC=C1 C75827 [1,0,0,0,0,0|1,1,0]=3 119 B9R1.15 O=C1NC=CC=C1CO P16012 [1,0,0,0,0,0|3,0,0]=4 120 B9R1.15 O=CC1=C(Cl)C=CC=C1 D77644 [1,0,0,0,0,0|1,0,1]=3 121 B9R1.15 OCC1=C(Br)C=CN=C1 71972 [1,0,0,0,0,0|2,1,0]=4 122 B9R1.15 OCC1=C(F)C=CN=C1 P15839 [1,0,0,0,0,0|2,1,0]=4 123 B9R1.15 OCC1=C(O)C=NC=C1 D84251 [1,0,0,0,0,0|3,0,0]=4 124 B9R1.15 OCC1=NC=CN=C1Cl 80497 [1,0,0,0,0,0|3,0,0]=4 125 B11R1.13 CC1=C(Br)C=CC=C1CC#N CL9699 [0,1,0,0,0,0|1,0,2]=4 126 B11R1.13 CC1=C(F)C=CC=C1CC#N 22476 [0,1,0,0,0,0|1,0,2]=4 127 B11R1.13 CC1=C(I)C=CC=C1CC#N CL9701 [0,1,0,0,0,0|1,0,2]=4 128 B11R1.13 CCNC1=CC=CC(Cl)=C1Cl AB1375 [0,1,0,0,0,0|2,0,0]=3 129 B11R1.13 CCOC1=C(N)C(N)=CC=C1 79683 [0,1,0,0,0,0|3,0,0]=4 130 B11R1.13 CCOC1=CC=CC(F)=C1N D84510 [0,1,0,0,0,0|3,0,0]=4 131 B11R1.13 CNCC1=CC=CC(Cl)=C1Cl 23580 [0,1,0,0,0,0|2,0,0]=3 132 B11R1.13 CNCC1=CC=CC(Cl)=C1F 36790 [0,1,0,0,0,0|2,1,0]=4 133 B11R1.13 CNCC1=CC=CC(Cl)=C1F 76700 [0,1,0,0,0,0|2,1,0]=4 134 B11R1.13 CNCC1=CC=CC(F)=C1F AC1201 [0,1,0,0,0,0|2,1,0]=4 135 B11R1.13 COCC1=CC=CC(Br)=C1F 79640 [0,1,0,0,0,0|2,1,0]=4 136 B11R1.13 NCCC1=CC=CC(F)=C1F Y13621 [0,1,0,0,0,0|0,1,0]=2 137 B11R1.13 OCCC1=CC=CC(F)=C1F A11216 [0,1,0,0,0,0|1,1,0]=3 138 B11R1.17 C#CCOC1=C(O)C=CC=C1 W16056 [0,1,0,0,0,0|2,0,1]=4 139 B11R1.17 C=CCCC1=C(Br)C=CC=C1 20639 [0,1,0,0,0,0|1,1,0]=3 140 B11R1.17 C=CCOC1=C(O)C=CC=C1 H11445 [0,1,0,0,0,0|2,0,1]=4 141 B11R1.17 CC1=C(NCCO)C=CC=C1 29426 [0,1,0,0,0,0|2,0,0]=3 142 B11R1.17 CC1=C(OCCBr)C=CC=C1 71086 [0,1,0,0,0,0|2,0,0]=3 143 B11R1.17 CCNCC1=C(O)C=CC=C1 AC1355 [0,1,0,0,0,0|2,0,0]=3 144 B11R1.17 COCCC1=C(O)C=CC=C1 D94967 [0,1,0,0,0,0|2,0,0]=3 145 B11R1.17 FC1=C(CCCBr)C=CC=C1 AB10312 [0,1,0,0,0,0|1,1,0]=3 146 B11R1.17 FC1=C(OCCBr)C=CC=C1 F50418 [0,1,0,0,0,0|1,1,0]=3 147 B11R1.17 NC1=C(CCCO)C=CC=C1 Y12219 [0,1,0,0,0,0|2,0,0]=3 148 B11R1.17 NCCCC1=C(Br)C=CC=C1 AC1659 [0,1,0,0,0,0|0,1,0]=2 149 B11R1.17 NCCCN1C=CC=CC1=O F15206 [0,1,0,0,0,0|2,0,0]=3 150 B11R1.17 O=CCCC1=C(Cl)C=CC=C1 20776 [0,1,0,0,0,0|1,0,0]=2 151 B11R1.17 OCCCC1=C(Cl)C=CC=C1 AB3571 [0,1,0,0,0,0|1,0,0]=2 152 B11R1.17 OCCCC1=C(F)C=CC=C1 AB3823 [0,1,0,0,0,0|1,1,0]=3 153 B11R1.41 CCSC1=C(C=O)C=CC=C1 W12314 [0,1,0,0,0,0|3,0,0]=4 154 B11R1.41 CNCC1=C(CO)C=CC=C1 31935 [0,1,0,0,0,0|3,0,0]=4 155 B11R1.41 COC1=C(CC=O)C=CC=C1 29933 [0,1,0,0,0,0|2,0,1]=4 156 B11R1.41 COC1=C(CCN)C=CC=C1 C11486 [0,1,0,0,0,0|1,0,0]=2 157 B11R1.41 COC1=C(CCN)C=CN=C1 F13309 [0,1,0,0,0,0|2,0,0]=3 158 B11R1.41 COC1=C(CCN)C=CN=C1 W19534 [0,1,0,0,0,0|2,0,0]=3 159 B11R1.41 COC1=C(CCO)N=CC=C1 52931 [0,1,0,0,0,0|3,0,0]=4 160 B11R1.41 COCC1=C(C=O)C=CC=C1 A11867 [0,1,0,0,0,0|3,0,0]=4 161 B11R1.41 N#CC1=C(CCBr)C=CC=C1 C71089 [0,1,0,0,0,0|2,0,0]=3 162 B11R1.41 N#CCC1=C(CBr)C=CC=C1 C76332 [0,1,0,0,0,0|0,1,2]=4 163 B11R1.41 N#CCC1=C(CCl)C=CC=C1 75268 [0,1,0,0,0,0|0,0,2]=3 164 B11R1.81 CCCC1=C(O)C=C(O)C=C1 C73634 [0,1,0,0,0,0|2,0,0]=3 165 B11R1.81 CCOC1=C(Cl)C=C(N)C=C1 C75445 [0,1,0,0,0,0|2,0,0]=3 166 B11R1.81 CCOC1=C(F)C=C(O)C=C1 36938 [0,1,0,0,0,0|2,1,0]=4 167 B11R1.81 COCC1=C(Br)C=C(F)C=C1 N11828 [0,1,0,0,0,0|2,1,0]=4 168 B11R1.81 COCC1=C(F)C=C(N)C=C1 I10129 [0,1,0,0,0,0|2,1,0]=4 169 B11R1.81 COCC1=C(N)C=C(Br)C=C1 CL9392 [0,1,0,0,0,0|3,0,0]=4 170 B11R1.81 COCC1=CC=C(Cl)N=C1Cl W10447 [0,1,0,0,0,0|3,0,0]=4 171 B11R1.81 ClC1=CC(Br)=C(CCBr)C=C1 O10665 [0,1,0,0,0,0|1,1,0]=3 172 B11R1.81 ClC1=CC(Cl)=C(CCBr)C=C1 C77752 [0,1,0,0,0,0|1,0,0]=2 173 B11R1.81 N#CCC1=CN=C(Cl)C=C1Cl A11213 [0,1,0,0,0,0|1,0,2]=4 174 B11R1.81 O=C1C=C(Br)C=CN1CCF D96693 [0,1,0,0,0,0|3,0,0]=4 175 B11R1.81 OCCC1=C(Cl)C=C(Br)C=C1 F50644 [0,1,0,0,0,0|1,0,0]=2 176 B11R1.81 OCCC1=C(Cl)C=C(F)C=C1 CL8845 [0,1,0,0,0,0|1,0,0]=2 177 B11R1.81 S=C=NC1=C(Cl)C=C(Br)C=C1 CK2076 [0,1,0,0,0,0|2,0,1]=4 178 B11R1.86 CC(C)OC1=C(O)C=CC=C1 D71146 [0,1,0,0,0,0|3,0,0]=4 179 B11R1.86 C[C@H](N)CC1=C(F)C=CC=C1 N10828 [0,1,0,0,0,0|0,1,0]=2 180 B11R1.86 C[C@H](O)CC1=C(Cl)C=CC=C1 D84375 [0,1,0,0,0,0|1,0,0]=2 181 B11R1.86 FC(F)OC1=CC=CN=C1Cl 33631 [0,1,0,0,0,0|3,0,0]=4 182 B11R1.86 NC(=O)NC1=C(Cl)C=CC=C1 W18608 [0,1,0,0,0,0|1,0,1]=3 183 B11R1.86 O=C([O-])CC1=C(Cl)C=CC=N1 27510 [0,1,0,0,0,0|2,0,1]=4 184 B11R1.182 C=CCC1=C(O)C=CC(C)=C1 D96076 [0,1,0,0,0,0|2,0,1]=4 185 B11R1.182 CNCC1=C(O)C=CC(Cl)=C1 31930 [0,1,0,0,0,0|3,0,0]=4 186 B11R1.182 CNCC1=C(O)C=CC(F)=C1 32252 [0,1,0,0,0,0|3,0,0]=4 187 B11R1.182 COCC1=C(F)C=CC(Br)=C1 N10199 [0,1,0,0,0,0|2,1,0]=4 188 B11R1.182 COCC1=C(N)C=CC(N)=C1 C74735 [0,1,0,0,0,0|3,0,0]=4 189 B11R1.182 OCCC1=C(F)C=CC(F)=C1 A50721 [0,1,0,0,0,0|1,1,0]=3 190 B11R1.182 OCCC1=C(O)C=CC(Br)=C1 W15209 [0,1,0,0,0,0|2,0,0]=3 191 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 D80972 [0,1,0,0,0,0|2,0,0]=3 192 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 D81235 [0,1,0,0,0,0|2,0,0]=3 193 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 N11177 [0,1,0,0,0,0|2,0,0]=3 194 B11R1.222 CC1=C([C@@H](O)CN)C=CC=C1 AR2909 [0,1,0,0,0,0|1,0,0]=2 195 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 20083 [0,1,0,0,0,0|2,0,0]=3 196 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 F16885 [0,1,0,0,0,0|2,0,0]=3 197 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 N10518 [0,1,0,0,0,0|2,0,0]=3 198 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 N10519 [0,1,0,0,0,0|2,0,0]=3 199 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 Y10722 [0,1,0,0,0,0|2,0,0]=3 200 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y10294 [0,1,0,0,0,0|1,0,0]=2 201 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y10295 [0,1,0,0,0,0|1,0,0]=2 202 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y10316 [0,1,0,0,0,0|1,0,0]=2 203 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y11207 [0,1,0,0,0,0|1,0,0]=2 204 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y11964 [0,1,0,0,0,0|1,0,0]=2 205 B11R1.222 CC[C@H](N)C1=C(F)C=CC=C1 S10041 [0,1,0,0,0,0|1,1,0]=3 206 B11R1.222 CC[C@H](N)C1=C(F)C=CC=C1 Y10807 [0,1,0,0,0,0|1,1,0]=3 207 B11R1.222 CC[C@H](N)C1=C(O)C=CC=C1 Y14154 [0,1,0,0,0,0|2,0,0]=3 208 B11R1.222 CC[C@H](N)C1=C(O)C=CC=C1 Y14523 [0,1,0,0,0,0|2,0,0]=3 209 B11R1.222 CC[C@H](N)C1=NC=CC=C1C Y11607 [0,1,0,0,0,0|3,0,0]=4 210 B11R1.222 CN[C@@H](C)C1=C(C)C=CC=C1 N13149 [0,1,0,0,0,0|3,0,0]=4 211 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y11428 [0,1,0,0,0,0|2,0,0]=3 212 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y11555 [0,1,0,0,0,0|2,0,0]=3 213 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y12189 [0,1,0,0,0,0|2,0,0]=3 214 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y13379 [0,1,0,0,0,0|2,0,0]=3 215 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y14597 [0,1,0,0,0,0|2,0,0]=3 216 B11R1.222 CN[C@@H](C)C1=C(F)C=CC=C1 H11712 [0,1,0,0,0,0|2,1,0]=4 217 B11R1.222 CN[C@@H](C)C1=C(F)C=CC=C1 N12637 [0,1,0,0,0,0|2,1,0]=4 218 B11R1.222 NC[C@H](O)C1=C(Cl)C=CC=C1 AC1512 [0,1,0,0,0,0|0,0,0]=1 219 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 D81268 [0,1,0,0,0,0|1,1,0]=3 220 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 D81404 [0,1,0,0,0,0|1,1,0]=3 221 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 Y12047 [0,1,0,0,0,0|1,1,0]=3 222 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 Y12048 [0,1,0,0,0,0|1,1,0]=3 223 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 N11089 [0,1,0,0,0,0|1,0,0]=2 224 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 N11090 [0,1,0,0,0,0|1,0,0]=2 225 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 Y10773 [0,1,0,0,0,0|1,0,0]=2 226 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 Y13361 [0,1,0,0,0,0|1,0,0]=2 227 B11R1.222 N[C@@H](CO)C1=C(Cl)C=NC=C1 C73732 [0,1,0,0,0,0|2,0,0]=3 228 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 D83963 [0,1,0,0,0,0|1,1,0]=3 229 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 I11002 [0,1,0,0,0,0|1,1,0]=3 230 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 I11143 [0,1,0,0,0,0|1,1,0]=3 231 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 Y10336 [0,1,0,0,0,0|1,1,0]=3 232 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 Y12049 [0,1,0,0,0,0|1,1,0]=3 233 B11R1.222 N\C(=N\O)C1=C(Cl)C=CC=C1 W10711 [0,1,0,0,0,0|2,0,1]=4 234 B11R1.222 O=C(CBr)C1=C(Cl)N=CC=C1 F10492 [0,1,0,0,0,0|2,0,1]=4 235 B11R1.222 O=C(CF)C1=C(F)C=CC=C1 75535 [0,1,0,0,0,0|1,1,1]=4 236 B11R1.222 O=C(CO)C1=C(Cl)C=CC=C1 AC1212 [0,1,0,0,0,0|1,0,1]=3 237 B11R1.605 CC1=CC=CC(Cl)=C1N=C=S A12201 [0,1,0,0,0,0|2,0,1]=4 238 B11R1.605 CCNC1=C(Cl)C=CC=C1Cl AB1378 [0,1,0,0,0,0|2,0,0]=3 239 B11R1.605 CNCC1=C(Cl)C=CC=C1Cl 23581 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.605 OCCC1=C(Cl)N=CN=C1Cl 30395 [0,1,0,0,0,0|3,0,0]=4 241 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 P16419 [0,0,0,1,0,0|2,0,0]=3 242 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 VT1375 [0,0,0,1,0,0|2,0,0]=3 243 B11R2.10 NC1=CC2=C(C=CC=C2)S1 27373 [0,0,0,1,0,0|1,0,2]=4 244 B11R2.10 NN1N=C2C=CC=CC2=N1 T70369 [0,0,0,1,0,0|3,0,0]=4 245 B11R2.20 C1=CC2=C(C=C1)CCN=C2 F12436 [0,0,0,1,0,0|1,0,1]=3 246 B11R2.20 C1=CC2=C(C=C1)OCC=C2 N13096 [0,0,0,1,0,0|3,0,0]=4 247 B11R2.20 C1=CC2=C(C=N1)CCNC2 27429 [0,0,0,1,0,0|2,0,0]=3 248 B11R2.20 C1=CC2=C(C=N1)CCNC2 F52150 [0,0,0,1,0,0|2,0,0]=3 249 B11R2.20 C1=CC2=C(C=N1)CNCC2 67415 [0,0,0,1,0,0|2,0,0]=3 250 B11R2.20 C1=CN=C2CCCNC2=C1 30555 [0,0,0,1,0,0|3,0,0]=4 251 B11R2.20 C1=CN=C2CNCCC2=C1 67455 [0,0,0,1,0,0|2,0,0]=3 252 B11R2.20 C1=CN=C2OCCCC2=C1 AT22008 [0,0,0,1,0,0|3,0,0]=4 253 B11R2.20 C1=NC=C2CCNCC2=N1 P13445 [0,0,0,1,0,0|3,0,0]=4 254 B11R2.20 C1=NC=C2CNCCC2=N1 24629 [0,0,0,1,0,0|3,0,0]=4 255 B11R2.20 C1=NC=C2CNCCC2=N1 35879 [0,0,0,1,0,0|3,0,0]=4 256 B11R2.20 C1=NC=C2CNCCC2=N1 SC2801 [0,0,0,1,0,0|3,0,0]=4 257 B11R2.55 BrC1=C(C2CC2)N=CC=C1 AC7391 [0,0,0,1,0,0|2,1,0]=4 258 B11R2.55 BrC1=NC=CC=C1C2CC2 O10674 [0,0,0,1,0,0|2,1,0]=4 259 B11R2.55 ClC1=NC=CC=C1C2CC2 C76816 [0,0,0,1,0,0|2,0,0]=3 260 B11R2.55 ClC1=NC=CN=C1C2CC2 96959 [0,0,0,1,0,0|3,0,0]=4 261 B11R2.55 FC1=NC=CC=C1C2CC2 F16374 [0,0,0,1,0,0|2,1,0]=4 262 B11R2.55 NC1=NC=CC=C1C2CC2 92679 [0,0,0,1,0,0|3,0,0]=4 263 B11R2.55 O=C1NC=CC=C1C2CC2 N13207 [0,0,0,1,0,0|3,0,0]=4 264 B11R2.106 BrC1=C2CCCC2=CC=C1 38090 [0,0,0,1,0,0|1,1,0]=3 265 B11R2.106 BrC1=C2OCOC2=CC=C1 67234 [0,0,0,1,0,0|2,1,0]=4 266 B11R2.106 CC1=C2CC=CC2=CC=C1 Y10332 [0,0,0,1,0,0|2,0,1]=4 267 B11R2.106 CC1=C2CCCC2=CC=C1 Y11654 [0,0,0,1,0,0|2,0,0]=3 268 B11R2.106 ClC1=C2C=CNC2=CN=C1 37468 [0,0,0,1,0,0|1,0,2]=4 269 B11R2.106 ClC1=C2C=NNC2=CN=C1 Y10389 [0,0,0,1,0,0|2,0,1]=4 270 B11R2.106 ClC1=C2CC=CC2=CC=C1 C75442 [0,0,0,1,0,0|1,0,1]=3 271 B11R2.106 ClC1=C2CCCC2=NC=C1 85955 [0,0,0,1,0,0|2,0,0]=3 272 B11R2.106 ClC1=C2CCNC2=NC=C1 P15393 [0,0,0,1,0,0|1,0,0]=2 273 B11R2.106 ClC1=C2CCOC2=CC=C1 52389 [0,0,0,1,0,0|1,0,0]=2 274 B11R2.106 ClC1=C2CNCC2=CC=C1 SC1314 [0,0,0,1,0,0|2,0,0]=3 275 B11R2.106 ClC1=C2N=COC2=CC=C1 D76689 [0,0,0,1,0,0|2,0,1]=4 276 B11R2.106 ClC1=C2N=CSC2=CC=C1 25561 [0,0,0,1,0,0|2,0,1]=4 277 B11R2.106 ClC1=C2N=NNC2=NC=C1 C74774 [0,0,0,1,0,0|3,0,0]=4 278 B11R2.106 ClC1=C2NN=NC2=CC=C1 C76113 [0,0,0,1,0,0|2,0,1]=4 279 B11R2.106 ClC1=C2OC=CC2=CC=C1 AC5711 [0,0,0,1,0,0|2,0,1]=4 280 B11R2.106 ClC1=C2SC=CC2=CC=C1 82930 [0,0,0,1,0,0|2,0,1]=4 281 B11R2.106 ClC1=CC=CC2=NSN=C12 D70733 [0,0,0,1,0,0|2,0,1]=4 282 B11R2.106 ClC1=NC=CC2=C1CCN2 38710 [0,0,0,1,0,0|1,0,0]=2 283 B11R2.106 ClC1=NC=CC2=C1CCN2 83058 [0,0,0,1,0,0|1,0,0]=2 284 B11R2.106 ClC1=NC=CC2=C1CNC2 D97048 [0,0,0,1,0,0|3,0,0]=4 285 B11R2.106 ClC1=NC=NC2=C1CCN2 26722 [0,0,0,1,0,0|2,0,0]=3 286 B11R2.106 FC1=C2CCCC2=CC=C1 Y12594 [0,0,0,1,0,0|1,1,0]=3 287 B11R2.106 IC1=C2C=NNC2=CC=C1 P10510 [0,0,0,1,0,0|1,1,1]=4 288 B11R2.106 IC1=C2CCCC2=CC=C1 N13267 [0,0,0,1,0,0|1,1,0]=3 289 B11R2.106 IC1=C2CCNC2=NC=C1 P20936 [0,0,0,1,0,0|1,1,0]=3 290 B11R2.106 IC1=C2CCOC2=NC=C1 P16092 [0,0,0,1,0,0|2,1,0]=4 291 B11R2.106 NC1=C2CCCC2=NC=C1 27386 [0,0,0,1,0,0|3,0,0]=4 292 B11R2.106 NC1=C2CCOC2=NC=C1 97229 [0,0,0,1,0,0|3,0,0]=4 293 B11R2.106 NC1=C2NCCC2=CC=C1 AC5784 [0,0,0,1,0,0|3,0,0]=4 294 B11R2.106 NC1=C2OCCC2=CC=C1 Y10505 [0,0,0,1,0,0|3,0,0]=4 295 B11R2.106 NC1=C2OCOC2=CC=C1 25897 [0,0,0,1,0,0|3,0,0]=4 296 B11R2.106 NC1=CC=CC2=C1CCN2 O11831 [0,0,0,1,0,0|1,0,0]=2 297 B11R2.106 NC1=CC=CC2=C1CNC2 62888 [0,0,0,1,0,0|3,0,0]=4 298 B11R2.106 NC1=CC=CC2=C1CNC2 C90573 [0,0,0,1,0,0|3,0,0]=4 299 B11R2.106 O=C1C=CC=C2NCCN12 O10575 [0,0,0,1,0,0|2,0,0]=3 300 B11R2.106 O=C1NC=CC2=C1CCO2 D96871 [0,0,0,1,0,0|3,0,0]=4 301 B11R2.106 OC1=C2CCNC2=CC=C1 76585 [0,0,0,1,0,0|1,0,0]=2 302 B11R2.106 OC1=C2N=NNC2=CC=C1 H10523 [0,0,0,1,0,0|3,0,0]=4 303 B11R2.106 OC1=C2NCCC2=CC=C1 D82764 [0,0,0,1,0,0|3,0,0]=4 304 B11R2.106 OC1=C2OCOC2=CC=C1 Y13605 [0,0,0,1,0,0|3,0,0]=4 305 B9R1.33 CC1=C(CCN)SC=N1 W16954 [0,0,0,0,1,0|3,0,0]=4 306 B9R1.33 CN1C=CC=C1CCN 70855 [0,0,0,0,1,0|2,0,0]=3 307 B9R1.33 CN1C=CC=C1CCO F13299 [0,0,0,0,1,0|3,0,0]=4 308 B9R1.33 CN1C=NC=C1CCN 70377 [0,0,0,0,1,0|3,0,0]=4 309 B8R1.2 CCC1=NC=NC=C1 F17281 [2,0,0,0,0,0|2,0,0]=4 310 B8R1.2 NCC1=CC=CC=C1 RB3068 [2,0,0,0,0,0|0,0,0]=2 311 B8R1.2 NCC1=CC=CN=N1 36976 [2,0,0,0,0,0|2,0,0]=4 312 B8R1.2 NCC1=CC=CN=N1 AT13034 [2,0,0,0,0,0|2,0,0]=4 313 B8R1.2 NCC1=CC=CN=N1 P15536 [2,0,0,0,0,0|2,0,0]=4 314 B8R1.2 NCC1=CC=NC=C1 35876 [2,0,0,0,0,0|1,0,0]=3 315 B8R1.2 NCC1=CN=CN=C1 26963 [2,0,0,0,0,0|2,0,0]=4 316 B8R1.2 NCC1=CN=NC=C1 27223 [2,0,0,0,0,0|2,0,0]=4 317 B8R1.2 NCC1=CN=NC=C1 36975 [2,0,0,0,0,0|2,0,0]=4 318 B8R1.2 NCC1=NC=CN=C1 67569 [2,0,0,0,0,0|2,0,0]=4 319 B8R1.2 NNC1=CC=CN=C1 S12141 [2,0,0,0,0,0|2,0,0]=4 320 B8R1.2 SCC1=CC=NC=C1 F18336 [2,0,0,0,0,0|2,0,0]=4 321 B8R1.2 SCC1=CN=CC=C1 F18343 [2,0,0,0,0,0|2,0,0]=4 322 B8R1.2 SCC1=NC=CC=C1 Y10072 [2,0,0,0,0,0|2,0,0]=4 323 B8R1.2 [C-]#[N+]C1=CC=CC=C1 AB1473 [2,0,0,0,0,0|1,0,1]=4 324 B8R1.5 CC1=C(Cl)C=NC=N1 F17326 [2,0,0,0,0,0|2,0,0]=4 325 B8R1.5 CC1=C(F)C=CN=C1 F19730 [2,0,0,0,0,0|1,1,0]=4 326 B8R1.5 CC1=C(I)C=CC=N1 F19761 [2,0,0,0,0,0|1,1,0]=4 327 B8R1.5 CC1=C(I)C=NC=C1 C74973 [2,0,0,0,0,0|1,1,0]=4 328 B8R1.5 CC1=CC=NN=C1Cl 38744 [2,0,0,0,0,0|2,0,0]=4 329 B8R1.5 ClC1=CC=CN=C1I 68801 [2,0,0,0,0,0|2,0,0]=4 330 B8R1.5 NC1=C(Cl)C=NC=N1 26794 [2,0,0,0,0,0|2,0,0]=4 331 B8R1.5 NC1=C(Cl)C=NN=C1 P11076 [2,0,0,0,0,0|2,0,0]=4 332 B8R1.5 NC1=C(S)C=CN=C1 AT18151 [2,0,0,0,0,0|2,0,0]=4 333 B8R1.5 NC1=CC=CN=C1I RB1070 [2,0,0,0,0,0|1,1,0]=4 334 B8R1.5 NC1=CC=NN=C1Cl 27714 [2,0,0,0,0,0|2,0,0]=4 335 B8R1.5 NC1=[N+]([O-])C=CC=C1 T70263 [2,0,0,0,0,0|2,0,0]=4 336 B10R1.1 C=CCC1=CC=C(O)C=C1 AC1877 [1,1,0,0,0,0|1,0,1]=4 337 B10R1.1 CC1=CC=C(CNN)C=C1 O10109 [1,1,0,0,0,0|1,0,0]=3 338 B10R1.1 CC1=CN=C(CCN)N=C1 73044 [1,1,0,0,0,0|2,0,0]=4 339 B10R1.1 CC1=NC=C(CCO)C=C1 54746 [1,1,0,0,0,0|2,0,0]=4 340 B10R1.1 CCNC1=CC=C(F)C=C1 AB11321 [1,1,0,0,0,0|2,0,0]=4 341 B10R1.1 CCSC1=CC=C(C)C=C1 H10147 [1,1,0,0,0,0|2,0,0]=4 342 B10R1.1 CNCC1=CC=C(O)C=C1 31972 [1,1,0,0,0,0|2,0,0]=4 343 B10R1.1 COCC1=CC=C(O)C=C1 63646 [1,1,0,0,0,0|2,0,0]=4 344 B10R1.1 CSCC1=CC=C(Br)C=C1 W19176 [1,1,0,0,0,0|2,0,0]=4 345 B10R1.1 CSCC1=CC=C(C)C=C1 W19462 [1,1,0,0,0,0|2,0,0]=4 346 B10R1.1 CSCC1=CC=C(F)C=C1 W18716 [1,1,0,0,0,0|2,0,0]=4 347 B10R1.1 NCCC1=CN=C(Cl)C=C1 85004 [1,1,0,0,0,0|1,0,0]=3 348 B10R1.1 NNCC1=CC=C(F)C=C1 36999 [1,1,0,0,0,0|1,0,0]=3 349 B10R1.1 NNCC1=CN=C(Cl)C=C1 W16788 [1,1,0,0,0,0|2,0,0]=4 350 B10R1.1 NOCC1=CC=C(Cl)C=C1 78769 [1,1,0,0,0,0|1,0,0]=3 351 B10R1.1 O=CCC1=CC=C(Cl)C=C1 74968 [1,1,0,0,0,0|1,0,1]=4 352 B10R1.1 OCCC1=NC=C(Br)C=C1 37598 [1,1,0,0,0,0|2,0,0]=4 353 B10R1.1 OCCC1=NC=C(F)C=C1 P18353 [1,1,0,0,0,0|2,0,0]=4 354 B10R1.10 C=CCC1=CC=CC(O)=C1 AC1729 [1,1,0,0,0,0|1,0,1]=4 355 B10R1.10 CC1=CC=CC(CCCl)=C1 C74996 [1,1,0,0,0,0|1,0,0]=3 356 B10R1.10 CCCC1=CC=CC(Br)=C1 W17019 [1,1,0,0,0,0|1,0,0]=3 357 B10R1.10 CCCC1=CC=CC(N)=C1 S11405 [1,1,0,0,0,0|1,0,0]=3 358 B10R1.10 CCNC1=CC=CC(F)=C1 AB11320 [1,1,0,0,0,0|2,0,0]=4 359 B10R1.10 CCNC1=CC=CC(O)=C1 T71675 [1,1,0,0,0,0|2,0,0]=4 360 B10R1.10 CNCC1=CC(C)=CC=C1 C78188 [1,1,0,0,0,0|2,0,0]=4 361 B10R1.10 CSCC1=CC(F)=CC=C1 A12575 [1,1,0,0,0,0|2,0,0]=4 362 B10R1.10 CSCC1=CC=CC(Br)=C1 W10420 [1,1,0,0,0,0|2,0,0]=4 363 B10R1.10 CSCC1=CC=CC(Cl)=C1 W19463 [1,1,0,0,0,0|2,0,0]=4 364 B10R1.10 NCCC1=CC=CC(N)=C1 51444 [1,1,0,0,0,0|0,0,0]=2 365 B10R1.10 NNCC1=CC=CC(Br)=C1 AC3898 [1,1,0,0,0,0|1,0,0]=3 366 B10R1.10 NNCC1=CC=CC(F)=C1 75837 [1,1,0,0,0,0|1,0,0]=3 367 B10R1.10 O=CCC1=CC=CC(Br)=C1 AB10311 [1,1,0,0,0,0|1,0,1]=4 368 B10R1.10 O=CCC1=CC=CC(F)=C1 W16826 [1,1,0,0,0,0|1,0,1]=4 369 B10R1.10 OCCC1=CC(Cl)=NC=C1 70307 [1,1,0,0,0,0|2,0,0]=4 370 B10R1.10 OCCC1=CC=CC(Br)=N1 AC1439 [1,1,0,0,0,0|2,0,0]=4 371 B10R1.10 OCCC1=NC=CC(Br)=C1 73397 [1,1,0,0,0,0|2,0,0]=4 372 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 31291 [1,1,0,0,0,0|1,0,1]=4 373 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 32646 [1,1,0,0,0,0|1,0,1]=4 374 B10R1.15 C=C(CBr)C1=CC=CC=C1 35089 [1,1,0,0,0,0|1,0,1]=4 375 B10R1.15 C=C(CC)C1=CC=CC=C1 C73845 [1,1,0,0,0,0|1,0,1]=4 376 B10R1.15 C=C[C@H](N)C1=CC=CC=C1 Y11941 [1,1,0,0,0,0|1,0,1]=4 377 B10R1.15 C=C[C@H](N)C1=CC=CC=C1 Y11942 [1,1,0,0,0,0|1,0,1]=4 378 B10R1.15 C=C[C@H](N)C1=CC=CC=C1 Y12425 [1,1,0,0,0,0|1,0,1]=4 379 B10R1.15 CCN(C)C1=CC=CC=C1 S10715 [1,1,0,0,0,0|2,0,0]=4 380 B10R1.15 CC[C@H](Br)C1=CC=CC=C1 A11640 [1,1,0,0,0,0|1,0,0]=3 381 B10R1.15 CC[C@H](N)C1=CC=CN=C1 31586 [1,1,0,0,0,0|2,0,0]=4 382 B10R1.15 CC[C@H](N)C1=CC=CN=C1 74009 [1,1,0,0,0,0|2,0,0]=4 383 B10R1.15 CC[C@H](N)C1=CC=NC=C1 31287 [1,1,0,0,0,0|2,0,0]=4 384 B10R1.15 CC[C@H](N)C1=CC=NC=C1 74015 [1,1,0,0,0,0|2,0,0]=4 385 B10R1.15 CC[C@H](N)C1=CC=NC=C1 74017 [1,1,0,0,0,0|2,0,0]=4 386 B10R1.15 CC[C@H](N)C1=CC=NC=C1 D81379 [1,1,0,0,0,0|2,0,0]=4 387 B10R1.15 CC[C@H](N)C1=NC=CC=C1 F16910 [1,1,0,0,0,0|2,0,0]=4 388 B10R1.15 CC[C@H](N)C1=NC=CC=C1 I11245 [1,1,0,0,0,0|2,0,0]=4 389 B10R1.15 CC[C@H](N)C1=NC=CC=C1 N10610 [1,1,0,0,0,0|2,0,0]=4 390 B10R1.15 CC[C@H](N)C1=NC=CC=C1 Y11176 [1,1,0,0,0,0|2,0,0]=4 391 B10R1.15 CC[C@H](N)C1=NC=CC=C1 Y11466 [1,1,0,0,0,0|2,0,0]=4 392 B10R1.15 CC[C@H](N)C1=NC=CC=C1 Y12115 [1,1,0,0,0,0|2,0,0]=4 393 B10R1.15 CC[C@H](O)C1=CC=CC=C1 T71858 [1,1,0,0,0,0|1,0,0]=3 394 B10R1.15 CC[C@H](O)C1=CC=CC=C1 T72707 [1,1,0,0,0,0|1,0,0]=3 395 B10R1.15 F[C@@H](CBr)C1=CC=CC=C1 32835 [1,1,0,0,0,0|1,0,0]=3 396 B10R1.15 N=C(NN)C1=CC=CC=C1 D97377 [1,1,0,0,0,0|1,0,1]=4 397 B10R1.15 NC[C@H](N)C1=CC=CC=C1 N12631 [1,1,0,0,0,0|0,0,0]=2 398 B10R1.15 NC[C@H](O)C1=NC=CC=C1 C77057 [1,1,0,0,0,0|1,0,0]=3 399 B10R1.15 NNC(=S)C1=CC=CC=C1 W10972 [1,1,0,0,0,0|1,0,1]=4 400 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 32217 [1,1,0,0,0,0|2,0,0]=4 401 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y11463 [1,1,0,0,0,0|2,0,0]=4 402 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y12121 [1,1,0,0,0,0|2,0,0]=4 403 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y13389 [1,1,0,0,0,0|2,0,0]=4 404 B10R1.15 N[C@@H](CO)C1=CN=CC=C1 F13354 [1,1,0,0,0,0|2,0,0]=4 405 B10R1.15 N[C@@H](CO)C1=CN=CC=C1 Y12482 [1,1,0,0,0,0|2,0,0]=4 406 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 D85222 [1,1,0,0,0,0|2,0,0]=4 407 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y13398 [1,1,0,0,0,0|2,0,0]=4 408 B10R1.15 O=C[C@H](Br)C1=CC=CC=C1 F13390 [1,1,0,0,0,0|1,0,1]=4 409 B10R1.15 O[C@@H](CF)C1=CC=CC=C1 C91661 [1,1,0,0,0,0|1,0,0]=3 410 B10R1.17 CCCCC1=CC=NC=C1 BL000376 [1,1,0,0,0,0|2,0,0]=4 411 B10R1.17 CCCOC1=CC=CC=C1 C75927 [1,1,0,0,0,0|1,0,0]=3 412 B10R1.17 CCNCC1=CC=CC=C1 D77748 [1,1,0,0,0,0|1,0,0]=3 413 B10R1.17 CNCCC1=CC=CN=C1 AR1271 [1,1,0,0,0,0|1,0,0]=3 414 B10R1.17 CNNCC1=CC=CC=C1 30192 [1,1,0,0,0,0|1,0,0]=3 415 B10R1.17 CNNCC1=CC=CN=C1 30189 [1,1,0,0,0,0|2,0,0]=4 416 B10R1.17 ICCCC1=CC=CC=C1 AC6098 [1,1,0,0,0,0|1,0,0]=3 417 B10R1.17 N#CCCC1=CC=NC=C1 P16939 [1,1,0,0,0,0|1,0,1]=4 418 B10R1.17 NCC#CC1=CC=CC=C1 AB10164 [1,1,0,0,0,0|0,0,1]=3 419 B10R1.17 NCCCC1=CC=CN=C1 31799 [1,1,0,0,0,0|1,0,0]=3 420 B10R1.17 NCCCC1=CC=NC=C1 S12068 [1,1,0,0,0,0|1,0,0]=3 421 B10R1.17 NCCNC1=NC=CC=N1 C72507 [1,1,0,0,0,0|2,0,0]=4 422 B10R1.17 NCCOC1=CC=NC=C1 F31099 [1,1,0,0,0,0|1,0,0]=3 423 B10R1.17 NCCOC1=CC=NC=C1 Y10522 [1,1,0,0,0,0|1,0,0]=3 424 B10R1.17 OCCOC1=CN=CC=C1 D86242 [1,1,0,0,0,0|2,0,0]=4 425 B10R1.17 SCCCC1=CC=NC=C1 F18251 [1,1,0,0,0,0|2,0,0]=4 426 B10R1.17 [C-]#[N+]CCC1=CC=CC=C1 50056 [1,1,0,0,0,0|0,0,1]=3 427 B10R1.18 C[C@H](N)CC1=NC=CC=C1 C80024 [1,1,0,0,0,0|1,0,0]=3 428 B10R1.18 FC(F)SC1=CC=CC=C1 I11988 [1,1,0,0,0,0|2,0,0]=4 429 B10R1.18 N=C(N)CC1=CC=CC=C1 F19863 [1,1,0,0,0,0|0,0,1]=3 430 B10R1.18 NC(=S)CC1=CC=CC=C1 71029 [1,1,0,0,0,0|0,0,1]=3 431 B10R1.2 BrCC1=CC=CC(I)=C1Br CL8690 [1,1,0,0,0,0|1,1,0]=4 432 B10R1.2 CC1=C(Br)C=CC=C1CBr 54940 [1,1,0,0,0,0|2,0,0]=4 433 B10R1.2 CC1=C(Br)C=CC=C1CN 98269 [1,1,0,0,0,0|1,0,0]=3 434 B10R1.2 CC1=C(I)C=CC=C1CBr CL9688 [1,1,0,0,0,0|2,0,0]=4 435 B10R1.2 CC1=C(I)C=CC=C1CO CL9687 [1,1,0,0,0,0|2,0,0]=4 436 B10R1.2 CC1=CC=CC(CN)=C1F CL9718 [1,1,0,0,0,0|0,1,0]=3 437 B10R1.2 CC1=CC=CC(CN)=C1O Y10488 [1,1,0,0,0,0|1,0,0]=3 438 B10R1.2 CC1=CC=CC(CO)=C1Br 74396 [1,1,0,0,0,0|1,1,0]=4 439 B10R1.2 CC1=CC=CC(CO)=C1O F20046 [1,1,0,0,0,0|2,0,0]=4 440 B10R1.2 CC1=CC=CC(NN)=C1C A11966 [1,1,0,0,0,0|2,0,0]=4 441 B10R1.2 CCC1=CC=CC(O)=C1O C77203 [1,1,0,0,0,0|1,0,0]=3 442 B10R1.2 CCC1=CC=NC(N)=C1Br F50948 [1,1,0,0,0,0|1,1,0]=4 443 B10R1.2 CCC1=NC=NC(O)=C1Cl F30102 [1,1,0,0,0,0|2,0,0]=4 444 B10R1.2 CN1C=CC=C(CN)C1=O P19942 [1,1,0,0,0,0|2,0,0]=4 445 B10R1.2 CNC1=CC=CC(Br)=C1N 79197 [1,1,0,0,0,0|2,0,0]=4 446 B10R1.2 COC1=C(Cl)C(Cl)=CC=N1 D83251 [1,1,0,0,0,0|2,0,0]=4 447 B10R1.2 COC1=C(Cl)C(Cl)=NC=C1 P17363 [1,1,0,0,0,0|2,0,0]=4 448 B10R1.2 COC1=C(Cl)C(N)=CC=C1 C12073 [1,1,0,0,0,0|1,0,0]=3 449 B10R1.2 COC1=C(I)C(N)=CC=C1 34421 [1,1,0,0,0,0|1,1,0]=4 450 B10R1.2 COC1=C(N)C(N)=CC=C1 35991 [1,1,0,0,0,0|2,0,0]=4 451 B10R1.2 COC1=C(N)C(N)=CC=C1 Y10418 [1,1,0,0,0,0|2,0,0]=4 452 B10R1.2 COC1=C(O)C(N)=CC=C1 O10656 [1,1,0,0,0,0|2,0,0]=4 453 B10R1.2 COC1=CC=CC(Br)=C1Br CL8946 [1,1,0,0,0,0|1,1,0]=4 454 B10R1.2 COC1=CC=CC(Cl)=C1Br F20980 [1,1,0,0,0,0|1,1,0]=4 455 B10R1.2 COC1=CC=CC(Cl)=C1O O10746 [1,1,0,0,0,0|2,0,0]=4 456 B10R1.2 COC1=CC=CC(F)=C1I 34512 [1,1,0,0,0,0|1,1,0]=4 457 B10R1.2 COC1=CC=CC(I)=C1N S10846 [1,1,0,0,0,0|2,0,0]=4 458 B10R1.2 COC1=CC=CC(I)=C1O 84030 [1,1,0,0,0,0|2,0,0]=4 459 B10R1.2 COC1=NC=CC(I)=C1Cl 92374 [1,1,0,0,0,0|2,0,0]=4 460 B10R1.2 CSC1=CC=CC(Cl)=C1C F14681 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.2 N#CC1=CC=CC(N)=C1Cl 98212 [1,1,0,0,0,0|0,0,2]=4 462 B10R1.2 N#CC1=CC=CC(O)=C1Cl C10157 [1,1,0,0,0,0|0,0,2]=4 463 B10R1.2 NC1=C(F)C=CC=C1CO W11419 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.2 NCC1=CC=CC(Br)=C1F N13145 [1,1,0,0,0,0|0,1,0]=3 465 B10R1.2 NCC1=CC=CC(Br)=C1F O10075 [1,1,0,0,0,0|0,1,0]=3 466 B10R1.2 NCC1=CC=CC(F)=C1Br C71791 [1,1,0,0,0,0|0,1,0]=3 467 B10R1.2 NCC1=CC=CC(I)=C1Br C72076 [1,1,0,0,0,0|0,1,0]=3 468 B10R1.2 NCC1=CC=CC(O)=C1O S10740 [1,1,0,0,0,0|1,0,0]=3 469 B10R1.2 OCC1=C(Cl)C(Cl)=NC=C1 W18487 [1,1,0,0,0,0|2,0,0]=4 470 B10R1.2 OCC1=CC=CC(F)=C1Br 35519 [1,1,0,0,0,0|1,1,0]=4 471 B10R1.2 OCC1=CC=CC(F)=C1Cl CL8694 [1,1,0,0,0,0|1,0,0]=3 472 B10R1.2 OCC1=CC=CC(F)=C1I 79245 [1,1,0,0,0,0|1,1,0]=4 473 B10R1.2 OCC1=CC=CC(I)=C1Br CL8691 [1,1,0,0,0,0|1,1,0]=4 474 B10R1.20 C=CC1=C(CO)C=CC=C1 C74805 [1,1,0,0,0,0|2,0,0]=4 475 B10R1.20 CNC1=C(C#N)C=CC=C1 C77665 [1,1,0,0,0,0|2,0,0]=4 476 B10R1.20 CNC1=C(C=O)C=CC=C1 O10528 [1,1,0,0,0,0|2,0,0]=4 477 B10R1.20 CNC1=C(CCl)C=CC=C1 D93985 [1,1,0,0,0,0|1,0,0]=3 478 B10R1.20 COC1=C(CN)C=CN=C1 C73553 [1,1,0,0,0,0|2,0,0]=4 479 B10R1.20 COC1=C(CN)N=CC=C1 AC6429 [1,1,0,0,0,0|2,0,0]=4 480 B10R1.20 COC1=C(CN)N=CC=C1 D94536 [1,1,0,0,0,0|2,0,0]=4 481 B10R1.20 COC1=CC=CN=C1CCl 60117 [1,1,0,0,0,0|2,0,0]=4 482 B10R1.20 COC1=NC=CC=C1CN 37576 [1,1,0,0,0,0|2,0,0]=4 483 B10R1.20 CSC1=C(C=O)C=CC=C1 T72851 [1,1,0,0,0,0|2,0,0]=4 484 B10R1.20 N#CC1=C(CN)C=CC=C1 A51071 [1,1,0,0,0,0|1,0,0]=3 485 B10R1.20 N#CC1=C(NN)C=CC=C1 C10139 [1,1,0,0,0,0|2,0,0]=4 486 B10R1.20 NCC1=C(CN)C=CC=C1 20182 [1,1,0,0,0,0|1,0,0]=3 487 B10R1.20 OCC1=C(CBr)C=CC=C1 O10024 [1,1,0,0,0,0|1,1,0]=4 488 B10R1.20 OCC1=C(CF)C=CC=C1 W10520 [1,1,0,0,0,0|1,1,0]=4 489 B10R1.25 C#CC1=C(Cl)C=C(N)C=C1 C76583 [1,1,0,0,0,0|0,0,2]=4 490 B10R1.25 CC1=C(CBr)C=CC(Br)=C1 93716 [1,1,0,0,0,0|2,0,0]=4 491 B10R1.25 CC1=C(CCl)C=CC(Br)=C1 AB10222 [1,1,0,0,0,0|2,0,0]=4 492 B10R1.25 CC1=C(CF)C=CC(Br)=C1 C73525 [1,1,0,0,0,0|2,0,0]=4 493 B10R1.25 CC1=C(CN)C=CC(Br)=C1 C71550 [1,1,0,0,0,0|1,0,0]=3 494 B10R1.25 CC1=C(CN)C=CC(N)=N1 D93406 [1,1,0,0,0,0|2,0,0]=4 495 B10R1.25 CC1=C(CO)C=CC(N)=C1 F19834 [1,1,0,0,0,0|2,0,0]=4 496 B10R1.25 CC1=CC(Br)=C(CN)C=C1 W19042 [1,1,0,0,0,0|0,1,0]=3 497 B10R1.25 CC1=CC(Br)=C(CN)N=C1 24111 [1,1,0,0,0,0|1,1,0]=4 498 B10R1.25 CC1=CC(Br)=CN=C1CN 24121 [1,1,0,0,0,0|2,0,0]=4 499 B10R1.25 CC1=CC(C)=C(CBr)C=C1 24686 [1,1,0,0,0,0|2,0,0]=4 500 B10R1.25 CC1=CC(Cl)=C(CN)C=C1 N12896 [1,1,0,0,0,0|0,0,0]=2 501 B10R1.25 CC1=CC(Cl)=CN=C1CN 24127 [1,1,0,0,0,0|2,0,0]=4 502 B10R1.25 CC1=CC(F)=C(NN)C=C1 D82866 [1,1,0,0,0,0|1,1,0]=4 503 B10R1.25 CC1=CC(F)=C(NN)C=C1 W17784 [1,1,0,0,0,0|1,1,0]=4 504 B10R1.25 CC1=CC=C(CO)C(Cl)=N1 W17836 [1,1,0,0,0,0|2,0,0]=4 505 B10R1.25 CC1=CN=C(CN)C(C)=C1 D83303 [1,1,0,0,0,0|2,0,0]=4 506 B10R1.25 CCC1=C(Br)C=C(N)C=C1 27953 [1,1,0,0,0,0|0,1,0]=3 507 B10R1.25 CCC1=C(Br)C=C(O)C=C1 Y11628 [1,1,0,0,0,0|0,1,0]=3 508 B10R1.25 CCC1=C(Cl)C=C(N)C=C1 W17033 [1,1,0,0,0,0|0,0,0]=2 509 B10R1.25 CCC1=C(F)C=C(Br)C=C1 D82415 [1,1,0,0,0,0|0,1,0]=3 510 B10R1.25 CCC1=C(F)C=C(O)C=C1 C11362 [1,1,0,0,0,0|0,1,0]=3 511 B10R1.25 CCC1=C(N)C=C(Br)C=C1 C72839 [1,1,0,0,0,0|1,0,0]=3 512 B10R1.25 CCC1=C(N)C=C(Cl)C=C1 C74962 [1,1,0,0,0,0|1,0,0]=3 513 B10R1.25 CCC1=NC=C(Br)C=C1N 38360 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.25 CCC1=NC=C(Cl)N=C1Cl C72268 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.25 CCN1C=CC(Br)=CC1=O P13647 [1,1,0,0,0,0|2,0,0]=4 516 B10R1.25 CNC1=C(Br)C=C(F)C=C1 71883 [1,1,0,0,0,0|1,1,0]=4 517 B10R1.25 CNC1=C(C)C=C(O)C=C1 C16321 [1,1,0,0,0,0|2,0,0]=4 518 B10R1.25 COC1=C(C)C=C(O)C=C1 95659 [1,1,0,0,0,0|2,0,0]=4 519 B10R1.25 COC1=C(Cl)C=C(C)C=N1 C71882 [1,1,0,0,0,0|2,0,0]=4 520 B10R1.25 COC1=C(Cl)C=C(I)C=C1 F15482 [1,1,0,0,0,0|1,0,0]=3 521 B10R1.25 COC1=C(Cl)C=C(N)N=C1 37736 [1,1,0,0,0,0|2,0,0]=4 522 B10R1.25 COC1=C(Cl)N=C(I)C=C1 72074 [1,1,0,0,0,0|2,0,0]=4 523 B10R1.25 COC1=CC=C(C)N=C1Cl C73850 [1,1,0,0,0,0|2,0,0]=4 524 B10R1.25 COC1=CC=C(Cl)N=C1Cl 81824 [1,1,0,0,0,0|2,0,0]=4 525 B10R1.25 COC1=CC=C(N)N=C1Cl F19661 [1,1,0,0,0,0|2,0,0]=4 526 B10R1.25 COC1=CN=C(Br)C=C1Cl F16734 [1,1,0,0,0,0|2,0,0]=4 527 B10R1.25 CSC1=C(Br)C=C(F)C=C1 69928 [1,1,0,0,0,0|1,1,0]=4 528 B10R1.25 CSC1=C(Cl)C=C(Br)C=C1 Y11168 [1,1,0,0,0,0|1,0,0]=3 529 B10R1.25 CSC1=C(F)C=C(N)C=C1 94984 [1,1,0,0,0,0|1,1,0]=4 530 B10R1.25 ClCC1=CC=C(Cl)N=C1Cl F19959 [1,1,0,0,0,0|2,0,0]=4 531 B10R1.25 ClCC1=CN=C(Cl)C=C1Cl F12172 [1,1,0,0,0,0|2,0,0]=4 532 B10R1.25 FC1=C(CBr)C=CC(I)=C1 55991 [1,1,0,0,0,0|1,1,0]=4 533 B10R1.25 FC1=CC(Cl)=C(CCl)N=C1 BL010215 [1,1,0,0,0,0|2,0,0]=4 534 B10R1.25 FC1=CC(I)=C(CBr)C=C1 56051 [1,1,0,0,0,0|1,1,0]=4 535 B10R1.25 N#CC1=C(Cl)C=C(I)C=C1 95932 [1,1,0,0,0,0|0,0,2]=4 536 B10R1.25 NCC1=C(Br)C=C(Cl)C=C1 C73878 [1,1,0,0,0,0|0,1,0]=3 537 B10R1.25 NCC1=C(Br)C=C(Cl)C=N1 87902 [1,1,0,0,0,0|1,1,0]=4 538 B10R1.25 NCC1=C(Br)C=C(F)C=C1 Y11612 [1,1,0,0,0,0|0,1,0]=3 539 B10R1.25 NCC1=C(Br)C=C(F)C=N1 D79768 [1,1,0,0,0,0|1,1,0]=4 540 B10R1.25 NCC1=C(Cl)C=C(Br)C=C1 Y12485 [1,1,0,0,0,0|0,0,0]=2 541 B10R1.25 NCC1=C(F)C=C(O)C=C1 N14725 [1,1,0,0,0,0|0,1,0]=3 542 B10R1.25 NCC1=C(O)C=C(Br)C=C1 N13143 [1,1,0,0,0,0|1,0,0]=3 543 B10R1.25 NCC1=NC=C(Br)C=C1Cl AT10811 [1,1,0,0,0,0|1,0,0]=3 544 B10R1.25 NCC1=NC=C(Cl)C=C1F 24125 [1,1,0,0,0,0|1,1,0]=4 545 B10R1.25 NNC1=C(Cl)C=C(Br)C=C1 D83061 [1,1,0,0,0,0|1,0,0]=3 546 B10R1.25 NNC1=C(Cl)C=C(I)C=C1 27583 [1,1,0,0,0,0|1,0,0]=3 547 B10R1.25 OCC1=C(Br)C=C(O)C=C1 98273 [1,1,0,0,0,0|1,1,0]=4 548 B10R1.25 OCC1=C(Cl)C=C(F)C=N1 BL010214 [1,1,0,0,0,0|2,0,0]=4 549 B10R1.25 OCC1=C(Cl)C=C(O)C=C1 CL9122 [1,1,0,0,0,0|1,0,0]=3 550 B10R1.25 OCC1=C(I)C=C(Cl)C=C1 95677 [1,1,0,0,0,0|1,1,0]=4 551 B10R1.25 OCC1=C(O)C=C(Br)C=C1 35526 [1,1,0,0,0,0|2,0,0]=4 552 B10R1.25 OCC1=NC=C(Br)C=C1Cl 97688 [1,1,0,0,0,0|2,0,0]=4 553 B10R1.30 CC1=C(CCl)C=C(Cl)C=C1 AT13353 [1,1,0,0,0,0|2,0,0]=4 554 B10R1.30 CC1=C(CO)C=C(Cl)C=C1 70915 [1,1,0,0,0,0|2,0,0]=4 555 B10R1.30 CC1=C(CO)C=C(I)C=C1 F20542 [1,1,0,0,0,0|2,0,0]=4 556 B10R1.30 CC1=C(NN)C=C(Br)C=C1 O10123 [1,1,0,0,0,0|2,0,0]=4 557 B10R1.30 CC1=C(NN)C=C(Cl)C=C1 C75556 [1,1,0,0,0,0|2,0,0]=4 558 B10R1.30 CC1=CC(CBr)=C(C)C=C1 CL9683 [1,1,0,0,0,0|2,0,0]=4 559 B10R1.30 CC1=CC(CN)=C(F)C=C1 W18911 [1,1,0,0,0,0|0,1,0]=3 560 B10R1.30 CC1=CC(CO)=C(Br)C=C1 78891 [1,1,0,0,0,0|1,1,0]=4 561 B10R1.30 CC1=CC(CO)=C(O)C=C1 A11080 [1,1,0,0,0,0|2,0,0]=4 562 B10R1.30 CC1=CC(NN)=C(Cl)C=C1 C77156 [1,1,0,0,0,0|1,0,0]=3 563 B10R1.30 CC1=NC(CCl)=C(Cl)C=C1 D83946 [1,1,0,0,0,0|2,0,0]=4 564 B10R1.30 CC1=NC=C(Br)C=C1CN AC1104 [1,1,0,0,0,0|2,0,0]=4 565 B10R1.30 CCC1=C(N)C=CC(F)=C1 D83440 [1,1,0,0,0,0|1,0,0]=3 566 B10R1.30 CCC1=C(O)C=CC(C)=N1 T71674 [1,1,0,0,0,0|2,0,0]=4 567 B10R1.30 CCC1=CC(=O)NN=C1Cl S11537 [1,1,0,0,0,0|2,0,0]=4 568 B10R1.30 CCC1=CC(Cl)=NN=C1Cl S11033 [1,1,0,0,0,0|2,0,0]=4 569 B10R1.30 CCN1C=C(Br)C=CC1=O AC2035 [1,1,0,0,0,0|2,0,0]=4 570 B10R1.30 CNC1=C(C)C=CC(Cl)=C1 W16029 [1,1,0,0,0,0|2,0,0]=4 571 B10R1.30 CNC1=C(C)C=CC(O)=C1 C75943 [1,1,0,0,0,0|2,0,0]=4 572 B10R1.30 CNC1=C(N)C=CC(C)=C1 N12938 [1,1,0,0,0,0|2,0,0]=4 573 B10R1.30 COC1=C(Cl)C=CC(Br)=N1 D83067 [1,1,0,0,0,0|2,0,0]=4 574 B10R1.30 COC1=C(Cl)C=NC(N)=C1 A10702 [1,1,0,0,0,0|2,0,0]=4 575 B10R1.30 COC1=C(I)C=CC(C)=C1 Y14673 [1,1,0,0,0,0|1,1,0]=4 576 B10R1.30 COC1=C(I)C=CC(N)=C1 C71377 [1,1,0,0,0,0|1,1,0]=4 577 B10R1.30 COC1=C(N)C=CC(Cl)=C1 AB2767 [1,1,0,0,0,0|2,0,0]=4 578 B10R1.30 COC1=C(N)C=CC(N)=C1 E10141 [1,1,0,0,0,0|2,0,0]=4 579 B10R1.30 COC1=C(N)C=CC(O)=C1 30482 [1,1,0,0,0,0|2,0,0]=4 580 B10R1.30 COC1=CC(Cl)=NC=C1Cl 26260 [1,1,0,0,0,0|2,0,0]=4 581 B10R1.30 COC1=CC(N)=CN=C1Cl 54845 [1,1,0,0,0,0|2,0,0]=4 582 B10R1.30 CSC1=C(C)C=CC(Cl)=C1 D83340 [1,1,0,0,0,0|2,0,0]=4 583 B10R1.30 CSC1=CC(Cl)=CN=C1Cl 79286 [1,1,0,0,0,0|2,0,0]=4 584 B10R1.30 ClCC1=C(Br)C=CC(Br)=C1 68638 [1,1,0,0,0,0|1,1,0]=4 585 B10R1.30 ClCC1=C(Cl)C=CC(Br)=C1 35517 [1,1,0,0,0,0|1,0,0]=3 586 B10R1.30 NC1=CC(CO)=C(Cl)C=C1 35510 [1,1,0,0,0,0|1,0,0]=3 587 B10R1.30 NCC1=C(Br)C=CC(Br)=C1 N12804 [1,1,0,0,0,0|0,1,0]=3 588 B10R1.30 NCC1=C(F)C=CC(Cl)=C1 CK1118 [1,1,0,0,0,0|0,1,0]=3 589 B10R1.30 NCC1=C(N)C=CC(Br)=C1 C71032 [1,1,0,0,0,0|1,0,0]=3 590 B10R1.30 NCC1=C(O)C=CC(Br)=C1 O10496 [1,1,0,0,0,0|1,0,0]=3 591 B10R1.30 NNC1=C(F)C=CC(Br)=C1 C74046 [1,1,0,0,0,0|1,1,0]=4 592 B10R1.30 OCC1=C(Cl)C=CC(O)=C1 C76883 [1,1,0,0,0,0|1,0,0]=3 593 B10R1.30 OCC1=CC(Cl)=CN=C1Cl 55139 [1,1,0,0,0,0|2,0,0]=4 594 B10R1.61 C=C(C)C1=C(Br)C=CC=C1 W17018 [1,1,0,0,0,0|0,1,1]=4 595 B10R1.61 CC(=O)C1=C(Cl)C=CC=N1 27067 [1,1,0,0,0,0|1,0,1]=4 596 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 Y14823 [1,1,0,0,0,0|1,0,1]=4 597 B10R1.61 CC(=O)C1=C(Cl)C=NC=C1 N12959 [1,1,0,0,0,0|1,0,1]=4 598 B10R1.61 CC(C)C1=C(N)C=CN=C1 C77054 [1,1,0,0,0,0|2,0,0]=4 599 B10R1.61 CC(C)C1=C(O)C=CC=N1 72523 [1,1,0,0,0,0|2,0,0]=4 600 B10R1.61 CC(C)C1=C(S)C=CC=C1 29274 [1,1,0,0,0,0|1,0,0]=3 601 B10R1.61 CC(C)C1=CC=CN=C1Br C72641 [1,1,0,0,0,0|1,1,0]=4 602 B10R1.61 CC(C)C1=CC=CN=C1N 60027 [1,1,0,0,0,0|2,0,0]=4 603 B10R1.61 CC(C)C1=NC=CC=C1N C72482 [1,1,0,0,0,0|2,0,0]=4 604 B10R1.61 CC1=C(C(=N)N)C=CC=C1 28690 [1,1,0,0,0,0|1,0,1]=4 605 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 52748 [1,1,0,0,0,0|1,0,0]=3 606 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 52749 [1,1,0,0,0,0|1,0,0]=3 607 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 N10464 [1,1,0,0,0,0|1,0,0]=3 608 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 Y10511 [1,1,0,0,0,0|1,0,0]=3 609 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y11090 [1,1,0,0,0,0|2,0,0]=4 610 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y12107 [1,1,0,0,0,0|2,0,0]=4 611 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y12108 [1,1,0,0,0,0|2,0,0]=4 612 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y13392 [1,1,0,0,0,0|2,0,0]=4 613 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y13393 [1,1,0,0,0,0|2,0,0]=4 614 B10R1.61 CC1=CC=CN=C1[C@H](C)O 21080 [1,1,0,0,0,0|2,0,0]=4 615 B10R1.61 CC1=NC=CC=C1[C@H](C)N Y12491 [1,1,0,0,0,0|2,0,0]=4 616 B10R1.61 C[C@H](Cl)C1=C(F)C=NC=C1 W10402 [1,1,0,0,0,0|1,1,0]=4 617 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 21516 [1,1,0,0,0,0|0,1,0]=3 618 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 21517 [1,1,0,0,0,0|0,1,0]=3 619 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 Y10364 [1,1,0,0,0,0|0,1,0]=3 620 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 70080 [1,1,0,0,0,0|1,1,0]=4 621 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 90519 [1,1,0,0,0,0|1,1,0]=4 622 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 D81561 [1,1,0,0,0,0|1,1,0]=4 623 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 20095 [1,1,0,0,0,0|0,0,0]=2 624 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 SC1344 [1,1,0,0,0,0|0,0,0]=2 625 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 SC1353 [1,1,0,0,0,0|0,0,0]=2 626 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=N1 90516 [1,1,0,0,0,0|1,0,0]=3 627 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 52754 [1,1,0,0,0,0|0,1,0]=3 628 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 52755 [1,1,0,0,0,0|0,1,0]=3 629 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 I10701 [1,1,0,0,0,0|0,1,0]=3 630 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 Y10447 [1,1,0,0,0,0|0,1,0]=3 631 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 Y11656 [1,1,0,0,0,0|0,1,0]=3 632 B10R1.61 C[C@H](N)C1=C(F)C=CC=N1 N13070 [1,1,0,0,0,0|1,1,0]=4 633 B10R1.61 C[C@H](N)C1=C(F)C=CC=N1 N13095 [1,1,0,0,0,0|1,1,0]=4 634 B10R1.61 C[C@H](N)C1=C(N)C=CC=C1 C78195 [1,1,0,0,0,0|1,0,0]=3 635 B10R1.61 C[C@H](O)C1=C(Br)C=CC=C1 SC1257 [1,1,0,0,0,0|0,1,0]=3 636 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 SC1230 [1,1,0,0,0,0|0,0,0]=2 637 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 SC1233 [1,1,0,0,0,0|0,0,0]=2 638 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=N1 P19330 [1,1,0,0,0,0|1,0,0]=3 639 B10R1.61 C[C@H](O)C1=C(F)C=CC=N1 F13157 [1,1,0,0,0,0|1,1,0]=4 640 B10R1.61 C[C@H](O)C1=C(O)C=CC=C1 W16007 [1,1,0,0,0,0|1,0,0]=3 641 B10R1.61 C[C@H](O)C1=CC=CN=C1F F15555 [1,1,0,0,0,0|1,1,0]=4 642 B10R1.61 N=C(N)C1=C(Cl)C=CC=C1 71514 [1,1,0,0,0,0|0,0,1]=3 643 B10R1.61 NC1=C(C(F)F)C=CC=C1 72620 [1,1,0,0,0,0|2,0,0]=4 644 B10R1.245 BrCC1=C(Br)C=CC=C1Br 96245 [1,1,0,0,0,0|1,1,0]=4 645 B10R1.245 C=CC1=C(Cl)C=CC=C1Cl CK2536 [1,1,0,0,0,0|0,0,2]=4 646 B10R1.245 CC1=CC=CC(Cl)=C1CN Y12256 [1,1,0,0,0,0|0,0,0]=2 647 B10R1.245 CC1=CC=CC(F)=C1CO W16613 [1,1,0,0,0,0|1,1,0]=4 648 B10R1.245 CC1=CC=CC(O)=C1CO C74535 [1,1,0,0,0,0|2,0,0]=4 649 B10R1.245 CC1=CN=CC(Cl)=C1CO D97003 [1,1,0,0,0,0|2,0,0]=4 650 B10R1.245 CCC1=C(Br)C=CC=C1Br 86463 [1,1,0,0,0,0|0,1,0]=3 651 B10R1.245 CNC1=C(Br)C=CC=C1N C71480 [1,1,0,0,0,0|1,1,0]=4 652 B10R1.245 CNC1=C(F)C=CC=C1F C77614 [1,1,0,0,0,0|1,1,0]=4 653 B10R1.245 COC1=C(Br)C=CC=C1C F52555 [1,1,0,0,0,0|1,1,0]=4 654 B10R1.245 COC1=C(Cl)C=CC=C1O 95656 [1,1,0,0,0,0|1,0,0]=3 655 B10R1.245 COC1=C(Cl)C=CN=C1N F51098 [1,1,0,0,0,0|2,0,0]=4 656 B10R1.245 COC1=C(N)C=CC=C1N A12416 [1,1,0,0,0,0|2,0,0]=4 657 B10R1.245 COC1=C(N)C=CN=C1Cl F17572 [1,1,0,0,0,0|2,0,0]=4 658 B10R1.245 ClC1=CC=NC(Cl)=C1CBr 79158 [1,1,0,0,0,0|2,0,0]=4 659 B10R1.245 ClC1=CN=CC(Cl)=C1CBr AB8399 [1,1,0,0,0,0|2,0,0]=4 660 B10R1.245 NC1=CC=CC(Br)=C1CO 90066 [1,1,0,0,0,0|1,1,0]=4 661 B10R1.245 NCC1=C(Br)C=CC=C1Br O10035 [1,1,0,0,0,0|0,1,0]=3 662 B10R1.245 NCC1=C(Cl)C=NC=C1Cl 78984 [1,1,0,0,0,0|1,0,0]=3 663 B10R1.245 NNC1=C(Br)C=CC=C1F O10042 [1,1,0,0,0,0|1,1,0]=4 664 B10R1.245 NNC1=C(F)C=CC=C1F 35832 [1,1,0,0,0,0|1,1,0]=4 665 B10R1.245 O=CC1=C(I)C=CC=C1Cl C75422 [1,1,0,0,0,0|1,0,1]=4 666 B10R1.245 OCC1=C(Br)C=NC=C1Cl W17641 [1,1,0,0,0,0|2,0,0]=4 667 B12R1.24 CC1=C(F)C=CC=C1[C@@H](N)CO 90494 [0,2,0,0,0,0|2,0,0]=4 668 B12R1.24 CC1=C(F)C=CC=C1[C@@H](N)CO 90495 [0,2,0,0,0,0|2,0,0]=4 669 B12R1.24 CC1=C(F)C=CC=C1[C@@H](N)CO 90496 [0,2,0,0,0,0|2,0,0]=4 670 B12R1.24 CC1=C(F)C=CC=C1[C@@H](N)CO N11446 [0,2,0,0,0,0|2,0,0]=4 671 B12R1.24 CC1=C(F)C=CC=C1[C@@H](N)CO Y11191 [0,2,0,0,0,0|2,0,0]=4 672 B12R1.24 CC1=CC=CC([C@@H](N)CO)=C1Cl Y12302 [0,2,0,0,0,0|1,0,0]=3 673 B12R1.24 CC1=CC=CC([C@@H](N)CO)=C1Cl Y12303 [0,2,0,0,0,0|1,0,0]=3 674 B12R1.24 CC1=CC=CC([C@@H](N)CO)=C1Cl Y13299 [0,2,0,0,0,0|1,0,0]=3 675 B12R1.24 CC[C@H](N)C1=CC=CC(F)=C1F Y11776 [0,2,0,0,0,0|1,1,0]=4 676 B12R1.24 CC[C@H](N)C1=CC=CC(F)=C1F Y12448 [0,2,0,0,0,0|1,1,0]=4 677 B12R1.24 CC[C@H](O)C1=CC=CC(F)=C1C W10780 [0,2,0,0,0,0|2,0,0]=4 678 B12R1.24 N#C[C@@H](O)C1=CC=CC(Cl)=C1Cl W15227 [0,2,0,0,0,0|0,0,2]=4 679 B12R1.24 NNC(=O)C1=CC=CC(Cl)=C1Cl C75178 [0,2,0,0,0,0|1,0,1]=4 680 B12R1.24 N[C@@H](CO)C1=CC=CC(Cl)=C1F N11440 [0,2,0,0,0,0|1,1,0]=4 681 B12R1.24 N[C@@H](CO)C1=CC=CC(Cl)=C1F N11445 [0,2,0,0,0,0|1,1,0]=4 682 B12R1.24 N[C@@H](CO)C1=CC=CC(Cl)=C1F Y10836 [0,2,0,0,0,0|1,1,0]=4 683 B12R1.24 N[C@@H](CO)C1=CC=CC(Cl)=C1F Y12982 [0,2,0,0,0,0|1,1,0]=4 684 B12R1.25 CCNCC1=CC=CC(F)=C1F AC2475 [0,2,0,0,0,0|1,1,0]=4 685 B12R1.224 FC1=C(Cl)C(OC(F)F)=CC=C1 F18981 [0,2,0,0,0,0|2,0,0]=4 686 B12R1.224 O=C(O)CC1=CC=CC(Br)=C1Cl CL9124 [0,2,0,0,0,0|1,0,1]=4 687 B12R1.69 CC1=CC(N)=C(CCCO)C=C1 W12077 [0,2,0,0,0,0|2,0,0]=4 688 B12R1.69 ClCCOC1=C(Cl)C=C(Br)C=C1 W16058 [0,2,0,0,0,0|1,0,0]=3 689 B12R1.69 FC1=CC(F)=C(OCCBr)C=C1 W16558 [0,2,0,0,0,0|1,1,0]=4 690 B12R1.69 OCCNC1=C(F)C=C(F)C=C1 D95134 [0,2,0,0,0,0|1,1,0]=4 691 B12R1.121 COC1=C(CCC=O)C=CC=C1 F19725 [0,2,0,0,0,0|2,0,0]=4 692 B12R1.121 COC1=C(CCCO)C=CC=C1 F19813 [0,2,0,0,0,0|2,0,0]=4 693 B12R1.121 O=CC1=C(OCCBr)C=CC=C1 W17985 [0,2,0,0,0,0|2,0,0]=4 694 B12R1.125 CC1=C(CNC(C)C)C=CC=C1 C78577 [0,2,0,0,0,0|2,0,0]=4 695 B12R1.125 O=C(O)CNC1=C(Cl)C=CC=C1 E70332 [0,2,0,0,0,0|1,0,1]=4 696 B12R1.267 FC1=C(OCCCBr)C=CC=C1 F50437 [0,2,0,0,0,0|1,1,0]=4 697 B12R1.267 N#CCCCC1=C(F)C=CC=C1 20843 [0,2,0,0,0,0|0,1,1]=4 698 B12R1.267 OCCCCC1=C(Br)C=CC=C1 21173 [0,2,0,0,0,0|1,1,0]=4 699 B12R1.308 CCC[C@H](N)C1=C(C)C=CC=C1 20117 [0,2,0,0,0,0|2,0,0]=4 700 B12R1.308 CCC[C@H](N)C1=C(C)C=CC=C1 20119 [0,2,0,0,0,0|2,0,0]=4 701 B12R1.308 CCC[C@H](N)C1=C(C)C=CC=C1 N13254 [0,2,0,0,0,0|2,0,0]=4 702 B12R1.308 N#CC[C@H](N)C1=C(Br)C=CC=C1 Y14255 [0,2,0,0,0,0|0,1,1]=4 703 B12R1.308 N#CC[C@H](N)C1=C(Cl)C=CC=C1 Y14266 [0,2,0,0,0,0|0,0,1]=3 704 B12R1.308 NC1=C([C@@H](N)CCO)C=CC=C1 51813 [0,2,0,0,0,0|2,0,0]=4 705 B12R1.308 N[C@@H](CCO)C1=C(Cl)C=CC=C1 58179 [0,2,0,0,0,0|1,0,0]=3 706 B12R1.308 O=C(CCCl)C1=C(F)C=CC=C1 AC7173 [0,2,0,0,0,0|1,1,0]=4 707 B12R1.371 CC1=C(C\C(N)=N/O)C=CC=C1 W10713 [0,2,0,0,0,0|1,0,1]=4 708 B12R1.371 CCC(=O)CC1=C(F)C=CC=C1 N14134 [0,2,0,0,0,0|1,1,0]=4 709 B12R1.371 CNC(=O)CC1=C(Cl)C=CC=C1 W10824 [0,2,0,0,0,0|0,0,1]=3 710 B12R1.371 C[C@@H](CN)OC1=C(Cl)C=CC=C1 AR3974 [0,2,0,0,0,0|0,0,0]=2 711 B12R1.371 NNC(=O)CC1=C(Br)C=CC=C1 AB10425 [0,2,0,0,0,0|0,1,1]=4 712 B12R1.371 N[C@H](CO)CC1=C(F)C=CC=C1 N10850 [0,2,0,0,0,0|0,1,0]=3 713 B12R1.371 N[C@H](CO)CC1=C(F)C=CC=C1 N11125 [0,2,0,0,0,0|0,1,0]=3 714 B12R1.371 N\C(CC1=C(Br)C=CC=C1)=N\O W10717 [0,2,0,0,0,0|0,1,1]=4 715 B12R1.374 BrCCOC1=C(Br)C=CC(Br)=C1 33706 [0,2,0,0,0,0|1,1,0]=4 716 B12R1.374 CCNCC1=C(O)C=CC(Br)=C1 31606 [0,2,0,0,0,0|2,0,0]=4 717 B12R1.374 CCNCC1=C(O)C=CC(Cl)=C1 31829 [0,2,0,0,0,0|2,0,0]=4 718 B12R1.374 CCNCC1=C(O)C=CC(F)=C1 31723 [0,2,0,0,0,0|2,0,0]=4 719 B12R1.374 NC1=C(OCCO)C=C(F)C=C1 F20198 [0,2,0,0,0,0|2,0,0]=4 720 B12R1.1631 BrCCOC1=C(Br)C=CC=C1Br W19061 [0,2,0,0,0,0|1,1,0]=4 721 B12R1.1631 CCNCC1=C(Cl)C=CC=C1F I11017 [0,2,0,0,0,0|1,0,0]=3 722 B12R1.77 CC[C@H](N)C1=C(OC)C=CC=C1 Y10282 [0,2,0,0,0,0|2,0,0]=4 723 B12R1.77 CC[C@H](N)C1=C(OC)C=CC=C1 Y10283 [0,2,0,0,0,0|2,0,0]=4 724 B12R1.77 CC[C@H](N)C1=C(OC)C=CC=C1 Y10315 [0,2,0,0,0,0|2,0,0]=4 725 B12R1.77 CC[C@H](N)C1=C(OC)C=CC=C1 Y11966 [0,2,0,0,0,0|2,0,0]=4 726 B12R1.77 CC[C@H](N)C1=C(OC)C=CC=C1 Y11967 [0,2,0,0,0,0|2,0,0]=4 727 B12R1.77 CC[C@H](N)C1=C(OC)C=CC=C1 Y12173 [0,2,0,0,0,0|2,0,0]=4 728 B12R1.77 COC1=C([C@@H](N)CO)C=CC=C1 A12272 [0,2,0,0,0,0|2,0,0]=4 729 B12R1.77 COC1=C([C@@H](N)CO)C=CC=C1 Y10337 [0,2,0,0,0,0|2,0,0]=4 730 B12R1.77 COC1=C([C@@H](N)CO)C=CC=C1 Y11070 [0,2,0,0,0,0|2,0,0]=4 731 B12R1.77 COC1=C([C@@H](N)CO)C=CC=C1 Y11299 [0,2,0,0,0,0|2,0,0]=4 732 B12R1.77 COC1=C([C@@H](O)CN)C=CC=C1 AR2903 [0,2,0,0,0,0|1,0,0]=3 733 B12R1.268 COC1=C(CCN)C=C(F)C=C1 I11946 [0,2,0,0,0,0|1,0,0]=3 734 B12R1.283 NCCC1=C(C(=O)O)C=CC=C1 52097 [0,2,0,0,0,0|1,0,0]=3 735 B12R1.114 CCOC1=C(Cl)C=C(C#N)C=C1 AB8875 [0,2,0,0,0,0|2,0,0]=4 736 B12R1.114 COC1=CC(Cl)=C(CC#N)C=C1 D87952 [0,2,0,0,0,0|0,0,2]=4 737 B12R1.114 COC1=CC(F)=C(CCN)C=C1 F20047 [0,2,0,0,0,0|0,1,0]=3 738 B12R1.114 N#CCC1=C(Cl)C=C(C#N)C=C1 C72083 [0,2,0,0,0,0|0,0,2]=4 739 B12R1.233 N=C(N)NC1=C(Cl)C=C(F)C=C1 C12558 [0,2,0,0,0,0|1,0,1]=4 740 B12R1.233 NC(=S)CC1=C(F)C=C(F)C=C1 W19208 [0,2,0,0,0,0|0,1,1]=4 741 B12R1.1095 FC1=CC(F)=C(CCBr)C(F)=C1 39117 [0,2,0,0,0,0|1,1,0]=4 742 B12R1.1123 N#CCC1=CC(Br)=C(F)C=C1Cl 76227 [0,2,0,0,0,0|0,0,2]=4 743 B12R1.1123 NCCC1=CC(O)=C(O)C=C1O 73849 [0,2,0,0,0,0|1,0,0]=3 744 B12R1.1703 CC1=C([C@@H](N)CO)C=CC(Br)=C1 Y12565 [0,2,0,0,0,0|2,0,0]=4 745 B12R1.1703 CC1=C([C@@H](N)CO)C=CC(Br)=C1 Y12566 [0,2,0,0,0,0|2,0,0]=4 746 B12R1.1703 CC1=C([C@@H](N)CO)C=CC(Br)=C1 Y13423 [0,2,0,0,0,0|2,0,0]=4 747 B12R1.1703 CC1=C([C@@H](N)CO)C=CC(Br)=C1 Y13424 [0,2,0,0,0,0|2,0,0]=4 748 B12R1.1703 CC1=C([C@@H](N)CO)C=CC(F)=C1 Y11554 [0,2,0,0,0,0|2,0,0]=4 749 B12R1.1703 CC1=C([C@@H](N)CO)C=CC(F)=C1 Y12453 [0,2,0,0,0,0|2,0,0]=4 750 B12R1.1703 CC1=CC(C)=C([C@@H](N)CO)C=C1 N11078 [0,2,0,0,0,0|2,0,0]=4 751 B12R1.1703 CC1=CC(Cl)=C([C@@H](N)CO)C=C1 Y12304 [0,2,0,0,0,0|1,0,0]=3 752 B12R1.1703 CC1=CC(Cl)=C([C@@H](N)CO)C=C1 Y12305 [0,2,0,0,0,0|1,0,0]=3 753 B12R1.1703 CC1=CC(Cl)=C([C@@H](N)CO)C=C1 Y12992 [0,2,0,0,0,0|1,0,0]=3 754 B12R1.1703 CCC(=O)C1=C(Cl)C=C(Cl)C=C1 T70851 [0,2,0,0,0,0|1,0,1]=4 755 B12R1.1703 CC[C@H](N)C1=C(C)C=C(C)C=C1 Y10891 [0,2,0,0,0,0|2,0,0]=4 756 B12R1.1703 CC[C@H](N)C1=C(C)C=C(C)C=C1 Y11488 [0,2,0,0,0,0|2,0,0]=4 757 B12R1.1703 CC[C@H](N)C1=C(C)C=C(F)C=C1 N11313 [0,2,0,0,0,0|2,0,0]=4 758 B12R1.1703 CC[C@H](N)C1=C(C)C=C(F)C=C1 Y11983 [0,2,0,0,0,0|2,0,0]=4 759 B12R1.1703 CC[C@H](N)C1=C(C)C=C(F)C=C1 Y11984 [0,2,0,0,0,0|2,0,0]=4 760 B12R1.1703 CC[C@H](N)C1=C(F)C=C(F)C=C1 F21058 [0,2,0,0,0,0|1,1,0]=4 761 B12R1.1703 CC[C@H](N)C1=C(F)C=C(F)C=C1 Y10296 [0,2,0,0,0,0|1,1,0]=4 762 B12R1.1703 CC[C@H](N)C1=C(F)C=C(F)C=C1 Y11754 [0,2,0,0,0,0|1,1,0]=4 763 B12R1.1703 N[C@@H](CO)C1=C(Cl)C=C(Br)C=C1 Y12563 [0,2,0,0,0,0|1,0,0]=3 764 B12R1.1703 N[C@@H](CO)C1=C(Cl)C=C(Br)C=C1 Y12564 [0,2,0,0,0,0|1,0,0]=3 765 B12R1.1703 N[C@@H](CO)C1=C(Cl)C=C(Br)C=C1 Y12968 [0,2,0,0,0,0|1,0,0]=3 766 B12R1.1703 N[C@@H](CO)C1=C(Cl)C=C(Cl)C=C1 F16990 [0,2,0,0,0,0|1,0,0]=3 767 B12R1.1703 N[C@@H](CO)C1=C(Cl)C=C(Cl)C=C1 W19249 [0,2,0,0,0,0|1,0,0]=3 768 B12R1.1703 N[C@@H](CO)C1=C(Cl)C=C(Cl)C=C1 Y11110 [0,2,0,0,0,0|1,0,0]=3 769 B12R1.1703 N[C@@H](CO)C1=C(Cl)C=C(F)C=C1 Y12156 [0,2,0,0,0,0|1,0,0]=3 770 B12R1.1703 N[C@@H](CO)C1=C(Cl)C=C(F)C=C1 Y12157 [0,2,0,0,0,0|1,0,0]=3 771 B12R1.1703 N[C@@H](CO)C1=C(Cl)C=C(O)C=C1 Y12208 [0,2,0,0,0,0|1,0,0]=3 772 B12R1.1703 N[C@@H](CO)C1=C(Cl)C=C(O)C=C1 Y12209 [0,2,0,0,0,0|1,0,0]=3 773 B12R1.1703 N[C@@H](CO)C1=C(F)C=C(F)C=C1 N11181 [0,2,0,0,0,0|1,1,0]=4 774 B12R1.1703 N[C@@H](CO)C1=C(F)C=C(F)C=C1 Y11436 [0,2,0,0,0,0|1,1,0]=4 775 B12R1.1703 N[C@@H](CO)C1=C(F)C=C(F)C=C1 Y11600 [0,2,0,0,0,0|1,1,0]=4 776 B12R1.1703 O=C(CBr)C1=C(Cl)C=C(F)C=C1 78988 [0,2,0,0,0,0|1,0,1]=4 777 B12R1.1703 O=C(CO)C1=C(Cl)C=C(Cl)C=C1 AC4055 [0,2,0,0,0,0|1,0,1]=4 778 B12R1.1703 O[C@@H](CCl)C1=C(Cl)C=C(Cl)C=C1 12102 [0,2,0,0,0,0|1,0,0]=3 779 B12R1.1703 O[C@@H](CCl)C1=C(Cl)C=C(Cl)C=C1 A11909 [0,2,0,0,0,0|1,0,0]=3 780 B12R1.124 CC(C)C(=O)C1=C(Cl)C=CC=C1 N12696 [0,2,0,0,0,0|1,0,1]=4 781 B12R1.124 N[C@@H](C(=O)O)C1=C(Cl)C=CC=C1 Y11747 [0,2,0,0,0,0|1,0,1]=4 782 B12R1.124 N[C@@H](C(=O)O)C1=C(Cl)C=CC=C1 Y11901 [0,2,0,0,0,0|1,0,1]=4 783 B12R1.124 O=C(O)[C@H](F)C1=C(Cl)C=CC=C1 98561 [0,2,0,0,0,0|1,0,1]=4 784 B12R1.127 CC(C)CC1=C(O)C=CC(O)=C1 A11730 [0,2,0,0,0,0|2,0,0]=4 785 B12R1.151 CC(C)(O)CC1=C(Br)C=CC=C1 D76801 [0,2,0,0,0,0|1,1,0]=4 786 B12R1.151 CC(C)(O)CC1=C(Cl)C=CC=C1 P11161 [0,2,0,0,0,0|1,0,0]=3 787 B12R1.151 CC1=C(CC(C)(C)N)C=CC=C1 53104 [0,2,0,0,0,0|1,0,0]=3 788 B12R1.151 NC1=C(CC(F)(F)F)C=CC=C1 D82830 [0,2,0,0,0,0|2,0,0]=4 789 B12R1.151 NS(=O)(=O)CC1=C(Cl)C=CC=C1 71287 [0,2,0,0,0,0|1,0,0]=3 790 B12R1.1009 NC(=O)CC1=C(Cl)C=CC=C1Cl A12848 [0,2,0,0,0,0|0,0,1]=3 791 B12R1.270 COC1=CC(CCN)=C(Br)C=C1 W10180 [0,2,0,0,0,0|0,1,0]=3 792 B12R1.270 COC1=CC(CCO)=C(Br)C=C1 C10727 [0,2,0,0,0,0|1,1,0]=4 793 B12R1.354 C=C[C@H](N)C1=C(Cl)C=CC(F)=C1 Y12160 [0,2,0,0,0,0|1,0,1]=4 794 B12R1.354 C=C[C@H](N)C1=C(Cl)C=CC(F)=C1 Y12161 [0,2,0,0,0,0|1,0,1]=4 795 B12R1.354 C=C[C@H](N)C1=C(Cl)C=CC(F)=C1 Y12935 [0,2,0,0,0,0|1,0,1]=4 796 B12R1.354 CC1=C([C@@H](N)CO)C=C(F)C=C1 Y12451 [0,2,0,0,0,0|2,0,0]=4 797 B12R1.354 CC1=C([C@@H](N)CO)C=C(F)C=C1 Y12452 [0,2,0,0,0,0|2,0,0]=4 798 B12R1.354 CC1=C([C@@H](N)CO)C=C(F)C=C1 Y12973 [0,2,0,0,0,0|2,0,0]=4 799 B12R1.354 CC1=CC([C@@H](N)CO)=C(C)C=C1 Y12056 [0,2,0,0,0,0|2,0,0]=4 800 B12R1.354 CC1=CC([C@@H](N)CO)=C(C)C=C1 Y12057 [0,2,0,0,0,0|2,0,0]=4 801 B12R1.354 CC1=CC([C@@H](N)CO)=C(C)C=C1 Y12284 [0,2,0,0,0,0|2,0,0]=4 802 B12R1.354 CC[C@H](N)C1=C(Br)C=CC(Br)=C1 Y12263 [0,2,0,0,0,0|1,1,0]=4 803 B12R1.354 CC[C@H](N)C1=C(Br)C=CC(Br)=C1 Y13195 [0,2,0,0,0,0|1,1,0]=4 804 B12R1.354 CC[C@H](N)C1=C(Br)C=CC(Br)=C1 Y13210 [0,2,0,0,0,0|1,1,0]=4 805 B12R1.354 CC[C@H](N)C1=C(Br)C=CC(Br)=C1 Y13294 [0,2,0,0,0,0|1,1,0]=4 806 B12R1.354 CC[C@H](N)C1=C(Br)C=CC(F)=C1 Y11974 [0,2,0,0,0,0|1,1,0]=4 807 B12R1.354 CC[C@H](N)C1=C(Br)C=CC(F)=C1 Y12040 [0,2,0,0,0,0|1,1,0]=4 808 B12R1.354 CC[C@H](N)C1=C(Br)C=CC(F)=C1 Y13015 [0,2,0,0,0,0|1,1,0]=4 809 B12R1.354 CC[C@H](N)C1=C(C)C=CC(C)=C1 Y12442 [0,2,0,0,0,0|2,0,0]=4 810 B12R1.354 CC[C@H](N)C1=C(C)C=CC(C)=C1 Y12443 [0,2,0,0,0,0|2,0,0]=4 811 B12R1.354 CC[C@H](N)C1=C(C)C=CC(F)=C1 Y12600 [0,2,0,0,0,0|2,0,0]=4 812 B12R1.354 CC[C@H](N)C1=C(C)C=CC(F)=C1 Y13263 [0,2,0,0,0,0|2,0,0]=4 813 B12R1.354 CC[C@H](N)C1=C(C)C=CC(F)=C1 Y13286 [0,2,0,0,0,0|2,0,0]=4 814 B12R1.354 CC[C@H](N)C1=C(Cl)C=CC(F)=C1 Y12154 [0,2,0,0,0,0|1,0,0]=3 815 B12R1.354 CC[C@H](N)C1=C(Cl)C=CC(F)=C1 Y12155 [0,2,0,0,0,0|1,0,0]=3 816 B12R1.354 CC[C@H](N)C1=C(Cl)C=CC(F)=C1 Y12930 [0,2,0,0,0,0|1,0,0]=3 817 B12R1.354 CC[C@H](N)C1=C(F)C=CC(Br)=C1 Y11972 [0,2,0,0,0,0|1,1,0]=4 818 B12R1.354 CC[C@H](N)C1=C(F)C=CC(Br)=C1 Y11973 [0,2,0,0,0,0|1,1,0]=4 819 B12R1.354 CC[C@H](N)C1=C(F)C=CC(Br)=C1 Y12947 [0,2,0,0,0,0|1,1,0]=4 820 B12R1.354 CC[C@H](N)C1=C(F)C=CC(F)=C1 S10040 [0,2,0,0,0,0|1,1,0]=4 821 B12R1.354 CC[C@H](N)C1=C(O)C=CC(F)=C1 Y11981 [0,2,0,0,0,0|2,0,0]=4 822 B12R1.354 CC[C@H](N)C1=C(O)C=CC(F)=C1 Y11982 [0,2,0,0,0,0|2,0,0]=4 823 B12R1.354 CC[C@H](N)C1=C(O)C=CC(F)=C1 Y13005 [0,2,0,0,0,0|2,0,0]=4 824 B12R1.354 CC[C@H](O)C1=C(C)C=CC(Cl)=C1 W17964 [0,2,0,0,0,0|2,0,0]=4 825 B12R1.354 N[C@@H](CO)C1=C(Br)C=CC(F)=C1 Y11674 [0,2,0,0,0,0|1,1,0]=4 826 B12R1.354 N[C@@H](CO)C1=C(Br)C=CC(F)=C1 Y12070 [0,2,0,0,0,0|1,1,0]=4 827 B12R1.354 N[C@@H](CO)C1=C(Br)C=CC(F)=C1 Y13021 [0,2,0,0,0,0|1,1,0]=4 828 B12R1.354 N[C@@H](CO)C1=C(Cl)C=CC(Br)=C1 Y14317 [0,2,0,0,0,0|1,0,0]=3 829 B12R1.354 N[C@@H](CO)C1=C(Cl)C=CC(Cl)=C1 N17025 [0,2,0,0,0,0|1,0,0]=3 830 B12R1.354 N[C@@H](CO)C1=C(Cl)C=CC(Cl)=C1 N17026 [0,2,0,0,0,0|1,0,0]=3 831 B12R1.354 N[C@@H](CO)C1=C(Cl)C=CC(Cl)=C1 Y12073 [0,2,0,0,0,0|1,0,0]=3 832 B12R1.354 N[C@@H](CO)C1=C(Cl)C=CC(Cl)=C1 Y12074 [0,2,0,0,0,0|1,0,0]=3 833 B12R1.354 N[C@@H](CO)C1=C(Cl)C=CC(Cl)=C1 Y12994 [0,2,0,0,0,0|1,0,0]=3 834 B12R1.354 N[C@@H](CO)C1=C(Cl)C=CC(Cl)=C1 Y14861 [0,2,0,0,0,0|1,0,0]=3 835 B12R1.354 N[C@@H](CO)C1=C(Cl)C=CC(F)=C1 Y12159 [0,2,0,0,0,0|1,0,0]=3 836 B12R1.354 N[C@@H](CO)C1=C(Cl)C=CC(F)=C1 Y12938 [0,2,0,0,0,0|1,0,0]=3 837 B12R1.354 N[C@@H](CO)C1=C(F)C=CC(Br)=C1 N11208 [0,2,0,0,0,0|1,1,0]=4 838 B12R1.354 N[C@@H](CO)C1=C(F)C=CC(F)=C1 N10532 [0,2,0,0,0,0|1,1,0]=4 839 B12R1.354 N[C@@H](CO)C1=C(F)C=CC(F)=C1 N11176 [0,2,0,0,0,0|1,1,0]=4 840 B12R1.354 N[C@@H](CO)C1=C(F)C=CC(F)=C1 Y10339 [0,2,0,0,0,0|1,1,0]=4 841 B12R1.354 N[C@@H](CO)C1=C(F)C=CC(F)=C1 Y10340 [0,2,0,0,0,0|1,1,0]=4 842 B12R1.354 N[C@@H](CO)C1=C(F)C=CC(F)=C1 Y12064 [0,2,0,0,0,0|1,1,0]=4 843 B12R1.354 N[C@@H](CO)C1=CC(F)=CN=C1Cl Y13447 [0,2,0,0,0,0|2,0,0]=4 844 B12R1.195 CC(C)(C#N)C1=C(Cl)C=CC=C1 A12772 [0,2,0,0,0,0|0,0,2]=4 845 B12R1.195 CC(C)(CO)C1=C(Cl)C=CC=C1 P11280 [0,2,0,0,0,0|1,0,0]=3 846 B12R1.195 NNS(=O)(=O)C1=C(Cl)C=CC=C1 C75760 [0,2,0,0,0,0|2,0,0]=4 847 B12R1.3441 CC1=CC=CC(C)=C1[C@@H](N)CO D81368 [0,2,0,0,0,0|2,0,0]=4 848 B12R1.3441 CC[C@H](N)C1=C(Br)C=CC=C1F Y12854 [0,2,0,0,0,0|1,1,0]=4 849 B12R1.3441 CC[C@H](N)C1=C(Br)C=CC=C1F Y13254 [0,2,0,0,0,0|1,1,0]=4 850 B12R1.3441 CC[C@H](N)C1=C(Br)C=CC=C1F Y13276 [0,2,0,0,0,0|1,1,0]=4 851 B12R1.3441 CC[C@H](N)C1=C(Cl)C=CC=C1Cl Y11511 [0,2,0,0,0,0|1,0,0]=3 852 B12R1.3441 CC[C@H](N)C1=C(Cl)C=CC=C1Cl Y11553 [0,2,0,0,0,0|1,0,0]=3 853 B12R1.3441 CC[C@H](N)C1=C(Cl)C=CC=C1Cl Y11578 [0,2,0,0,0,0|1,0,0]=3 854 B12R1.3441 CC[C@H](N)C1=C(Cl)C=CC=C1Cl Y11580 [0,2,0,0,0,0|1,0,0]=3 855 B12R1.3441 CC[C@H](N)C1=C(Cl)C=CC=C1F Y11509 [0,2,0,0,0,0|1,0,0]=3 856 B12R1.3441 CC[C@H](N)C1=C(Cl)C=CC=C1F Y11510 [0,2,0,0,0,0|1,0,0]=3 857 B12R1.3441 CC[C@H](N)C1=C(Cl)C=CC=C1F Y11569 [0,2,0,0,0,0|1,0,0]=3 858 B12R1.3441 CC[C@H](N)C1=C(Cl)C=CC=C1F Y11576 [0,2,0,0,0,0|1,0,0]=3 859 B12R1.3441 CC[C@H](N)C1=C(Cl)C=CC=C1F Y11965 [0,2,0,0,0,0|1,0,0]=3 860 B12R1.3441 CC[C@H](N)C1=C(Cl)C=CC=C1F Y12449 [0,2,0,0,0,0|1,0,0]=3 861 B12R1.3441 N[C@@H](CO)C1=C(Br)C=CC=C1Cl Y13038 [0,2,0,0,0,0|1,0,0]=3 862 B12R1.3441 N[C@@H](CO)C1=C(Br)C=CC=C1Cl Y13065 [0,2,0,0,0,0|1,0,0]=3 863 B12R1.3441 N[C@@H](CO)C1=C(Br)C=CC=C1Cl Y13311 [0,2,0,0,0,0|1,0,0]=3 864 B12R1.3441 N[C@@H](CO)C1=C(Cl)C=CC=C1F Y12050 [0,2,0,0,0,0|1,0,0]=3 865 B12R1.3441 N[C@@H](CO)C1=C(Cl)C=CC=C1F Y12051 [0,2,0,0,0,0|1,0,0]=3 866 B12R1.3441 N[C@@H](CO)C1=C(Cl)C=CC=C1F Y12460 [0,2,0,0,0,0|1,0,0]=3 867 B12R1.3441 N[C@@H](CO)C1=C(F)C=CC=C1F N12984 [0,2,0,0,0,0|1,1,0]=4 868 B12R1.3441 N[C@@H](CO)C1=C(F)C=CC=C1F Y12282 [0,2,0,0,0,0|1,1,0]=4 869 B12R1.3441 O=C(CCl)C1=C(Cl)C=CC=C1Cl Y13245 [0,2,0,0,0,0|1,0,1]=4 870 B10R2.7 C1=CC2=C(C=N1)CCN2 86683 [1,0,0,1,0,0|1,0,0]=3 871 B10R2.7 C1=CC2=C(C=N1)NCC2 A10607 [1,0,0,1,0,0|1,0,0]=3 872 B10R2.7 C1=CC2=C(C=N1)NCC2 C73056 [1,0,0,1,0,0|1,0,0]=3 873 B10R2.7 C1=CN=C2CCNC2=C1 70854 [1,0,0,1,0,0|1,0,0]=3 874 B10R2.320 O=C1CC2=C1C=CC=C2 67963 [1,0,0,1,0,0|1,0,1]=4 875 B12R2.81 CC1=CC=CC(C2CC2)=C1O 91443 [0,1,0,1,0,0|2,0,0]=4 876 B12R2.82 ClC1=C(Br)C=CC2=C1C=CN2 AC9269 [0,1,0,1,0,0|0,0,2]=4 877 B12R2.82 ClC1=C(Cl)C2=C(C=C1)NC=C2 I11442 [0,1,0,1,0,0|0,0,2]=4 878 B12R2.82 ClC1=C(I)C=CC2=C1C=NN2 I11354 [0,1,0,1,0,0|1,0,1]=4 879 B12R2.82 FC1=C(Br)C=CC2=C1CCN2 36640 [0,1,0,1,0,0|0,1,0]=3 880 B12R2.82 NC1=C(Br)C2=C(C=C1)CCC2 AC6580 [0,1,0,1,0,0|1,1,0]=4 881 B12R2.82 NC1=C(Cl)C2=C(C=C1)NN=C2 I11352 [0,1,0,1,0,0|1,0,1]=4 882 B12R2.82 OC1=C(Cl)C2=C(C=C1)NN=C2 I11410 [0,1,0,1,0,0|1,0,1]=4 883 B12R2.202 C[C@H]1CC2=CC=CC(N)=C2N1 P20141 [0,1,0,1,0,0|2,0,0]=4 884 B12R2.202 NC1=CC=CC2=C1CC(=O)N2 82071 [0,1,0,1,0,0|1,0,1]=4 885 B12R2.202 NC1=NC2=C(Cl)C=CC=C2N1 O11197 [0,1,0,1,0,0|1,0,1]=4 886 B12R2.202 NC1=NC2=CC=CC(Cl)=C2S1 W10162 [0,1,0,1,0,0|1,0,1]=4 887 B12R2.202 O=C1CC2=CC=CC(Cl)=C2C1 27432 [0,1,0,1,0,0|1,0,1]=4 888 B12R2.202 O[C@H]1CC2=CC=CC(Br)=C2C1 31670 [0,1,0,1,0,0|1,1,0]=4 889 B12R2.202 S=C1NC2=CC=CC(Cl)=C2S1 O11649 [0,1,0,1,0,0|1,0,1]=4 890 B12R2.1081 BrC1=C2CCCNC2=NC=C1 W14857 [0,1,0,1,0,0|1,1,0]=4 891 B12R2.1081 BrC1=C2CCCOC2=CC=C1 I11493 [0,1,0,1,0,0|1,1,0]=4 892 B12R2.1081 BrC1=C2CCOCC2=CC=C1 N13086 [0,1,0,1,0,0|1,1,0]=4 893 B12R2.1081 BrC1=C2CNCCC2=CC=C1 P10908 [0,1,0,1,0,0|1,0,0]=3 894 B12R2.1081 BrC1=C2COCCC2=CC=C1 72830 [0,1,0,1,0,0|1,1,0]=4 895 B12R2.1081 BrC1=C2NCCCC2=CC=C1 D82984 [0,1,0,1,0,0|1,1,0]=4 896 B12R2.1081 BrC1=C2OCCCC2=CC=C1 I11496 [0,1,0,1,0,0|1,1,0]=4 897 B12R2.1081 BrC1=C2OCCNC2=CC=C1 69215 [0,1,0,1,0,0|0,1,0]=3 898 B12R2.1081 CC1=CC=CC2=C1CCCC2 N10858 [0,1,0,1,0,0|2,0,0]=4 899 B12R2.1081 CC1=CC=CC2=C1CCCO2 Y13226 [0,1,0,1,0,0|2,0,0]=4 900 B12R2.1081 CC1=CC=CC2=C1CCNC2 71743 [0,1,0,1,0,0|1,0,0]=3 901 B12R2.1081 CC1=CC=CC2=C1OCCC2 Y13223 [0,1,0,1,0,0|2,0,0]=4 902 B12R2.1081 C[C@H]1CCNC2=C1C=CC=C2 36617 [0,1,0,1,0,0|2,0,0]=4 903 B12R2.1081 C[C@H]1CCNC2=C1C=CC=C2 A10659 [0,1,0,1,0,0|2,0,0]=4 904 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 64901 [0,1,0,1,0,0|1,0,0]=3 905 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 72471 [0,1,0,1,0,0|1,0,0]=3 906 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 W10122 [0,1,0,1,0,0|1,0,0]=3 907 B12R2.1081 ClC1=C2CCCCC2=CC=C1 Y13222 [0,1,0,1,0,0|1,0,0]=3 908 B12R2.1081 ClC1=C2CCNCC2=CC=C1 F52623 [0,1,0,1,0,0|0,0,0]=2 909 B12R2.1081 ClC1=C2CNCCC2=CC=C1 24214 [0,1,0,1,0,0|1,0,0]=3 910 B12R2.1081 ClC1=C2NCCCC2=CC=C1 F16849 [0,1,0,1,0,0|1,0,0]=3 911 B12R2.1081 ClC1=C2NCCOC2=NC=C1 84595 [0,1,0,1,0,0|2,0,0]=4 912 B12R2.1081 ClC1=C2OCCCC2=CC=C1 N10904 [0,1,0,1,0,0|1,0,0]=3 913 B12R2.1081 ClC1=C2OCCNC2=CC=C1 W10055 [0,1,0,1,0,0|0,0,0]=2 914 B12R2.1081 ClC1=NC=CC2=C1CCCN2 67470 [0,1,0,1,0,0|1,0,0]=3 915 B12R2.1081 ClC1=NC=CC2=C1NCCO2 80151 [0,1,0,1,0,0|2,0,0]=4 916 B12R2.1081 ClC1=NC=CC2=C1OCCN2 80149 [0,1,0,1,0,0|1,0,0]=3 917 B12R2.1081 FC1=C2CCCNC2=CC=C1 SC2341 [0,1,0,1,0,0|0,1,0]=3 918 B12R2.1081 FC1=C2CCCNC2=CC=C1 Y12021 [0,1,0,1,0,0|0,1,0]=3 919 B12R2.1081 FC1=C2CCNCC2=CC=C1 26908 [0,1,0,1,0,0|0,1,0]=3 920 B12R2.1081 FC1=C2CCNCC2=CC=C1 F13835 [0,1,0,1,0,0|0,1,0]=3 921 B12R2.1081 FC1=C2NCCCC2=CC=C1 N12833 [0,1,0,1,0,0|1,1,0]=4 922 B12R2.1081 FC1=C2OCCCC2=CC=C1 N11406 [0,1,0,1,0,0|1,1,0]=4 923 B12R2.1081 FC1=C2OCCNC2=CC=C1 70451 [0,1,0,1,0,0|0,1,0]=3 924 B12R2.1081 NC1=C2CNCCC2=CC=C1 81638 [0,1,0,1,0,0|1,0,0]=3 925 B12R2.1081 NC1=C2OCCCC2=CC=C1 N13184 [0,1,0,1,0,0|2,0,0]=4 926 B12R2.1081 NC1=CC=CC2=C1CCCN2 21021 [0,1,0,1,0,0|1,0,0]=3 927 B12R2.1081 NC1=CC=CC2=C1CCCO2 S11588 [0,1,0,1,0,0|2,0,0]=4 928 B12R2.1081 NC1=CC=CC2=C1CCCO2 S12176 [0,1,0,1,0,0|2,0,0]=4 929 B12R2.1081 N[C@H]1CCNC2=C1C=CC=C2 C76564 [0,1,0,1,0,0|2,0,0]=4 930 B12R2.1081 N[C@H]1CCNC2=C1C=CC=C2 F53442 [0,1,0,1,0,0|2,0,0]=4 931 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 71737 [0,1,0,1,0,0|2,0,0]=4 932 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 87775 [0,1,0,1,0,0|2,0,0]=4 933 B12R2.1081 N[C@H]1CNCC2=C1C=CC=C2 52240 [0,1,0,1,0,0|1,0,0]=3 934 B12R2.1081 N[C@H]1COCC2=C1C=CC=C2 37330 [0,1,0,1,0,0|2,0,0]=4 935 B12R2.1081 N[C@H]1COCC2=C1C=CC=C2 SC2561 [0,1,0,1,0,0|2,0,0]=4 936 B12R2.1081 O=C1CNNC2=C1C=CC=C2 H10992 [0,1,0,1,0,0|1,0,1]=4 937 B12R2.1081 O=C1NC=CC2=C1CCNC2 67507 [0,1,0,1,0,0|2,0,0]=4 938 B12R2.1081 O=C1NCCC2=C1C=CC=N2 78448 [0,1,0,1,0,0|2,0,0]=4 939 B12R2.1081 O=C1NCCC2=C1C=NC=C2 P11596 [0,1,0,1,0,0|2,0,0]=4 940 B12R2.1081 OC1=C2CCCNC2=CC=C1 F30097 [0,1,0,1,0,0|1,0,0]=3 941 B12R2.1081 OC1=C2CCNCC2=CC=C1 71954 [0,1,0,1,0,0|1,0,0]=3 942 B12R2.1081 OC1=C2CCNCC2=CC=C1 D80201 [0,1,0,1,0,0|1,0,0]=3 943 B12R2.1081 OC1=C2CNCCC2=CC=C1 F19176 [0,1,0,1,0,0|1,0,0]=3 944 B12R2.1081 O[C@H]1CCCC2=C1C=CC=C2 T72122 [0,1,0,1,0,0|2,0,0]=4 945 B12R2.1081 O[C@H]1CCCC2=C1C=CC=C2 T72587 [0,1,0,1,0,0|2,0,0]=4 946 B12R2.1081 O[C@H]1CCNC2=C1C=CC=C2 75128 [0,1,0,1,0,0|2,0,0]=4 947 B12R2.1081 O[C@H]1CCOC2=C1C=CC=C2 A12066 [0,1,0,1,0,0|2,0,0]=4 948 B12R2.1081 O[C@H]1COCC2=C1C=CC=C2 N13051 [0,1,0,1,0,0|2,0,0]=4 949 B12R2.24 BrC1=CC2=C(C=C1)CCCO2 I11495 [0,1,0,1,0,0|2,0,0]=4 950 B12R2.24 BrC1=CC2=C(C=C1)CCOC2 O11641 [0,1,0,1,0,0|2,0,0]=4 951 B12R2.24 BrC1=CC2=C(C=C1)COCC2 72150 [0,1,0,1,0,0|2,0,0]=4 952 B12R2.24 BrC1=CN=C2CCNCC2=C1 21007 [0,1,0,1,0,0|2,0,0]=4 953 B12R2.24 BrC1=CN=C2CCNCC2=C1 P19234 [0,1,0,1,0,0|2,0,0]=4 954 B12R2.24 BrC1=CN=C2CCNCC2=C1 SC2711 [0,1,0,1,0,0|2,0,0]=4 955 B12R2.24 CC1=CC2=C(C=C1)CCCC2 I10992 [0,1,0,1,0,0|2,0,0]=4 956 B12R2.24 CC1=CC2=C(C=C1)CCCN2 26368 [0,1,0,1,0,0|2,0,0]=4 957 B12R2.24 CC1=CC2=C(C=C1)CCCN2 H11139 [0,1,0,1,0,0|2,0,0]=4 958 B12R2.24 CC1=CC2=C(C=C1)CCCO2 Y13225 [0,1,0,1,0,0|2,0,0]=4 959 B12R2.24 CC1=CC2=C(C=C1)CCOC2 N14607 [0,1,0,1,0,0|2,0,0]=4 960 B12R2.24 CN1CCC2=C(C=CC=C2)C1 66638 [0,1,0,1,0,0|1,0,0]=3 961 B12R2.24 CN1CCC2=C(C=CC=C2)C1 O10829 [0,1,0,1,0,0|1,0,0]=3 962 B12R2.24 C[C@H]1CNC2=C(C=CC=C2)O1 71634 [0,1,0,1,0,0|2,0,0]=4 963 B12R2.24 C[C@H]1COC2=C(C=CC=C2)N1 71352 [0,1,0,1,0,0|2,0,0]=4 964 B12R2.24 ClC1=CC2=C(C=C1)CCCC2 N11405 [0,1,0,1,0,0|2,0,0]=4 965 B12R2.24 ClC1=CC2=C(C=C1)CCCN2 C10821 [0,1,0,1,0,0|2,0,0]=4 966 B12R2.24 ClC1=CC2=C(C=C1)CCCO2 Y13230 [0,1,0,1,0,0|2,0,0]=4 967 B12R2.24 ClC1=CC2=C(C=C1)CCN=C2 F10402 [0,1,0,1,0,0|1,0,1]=4 968 B12R2.24 ClC1=CC2=C(C=C1)CCNC2 28104 [0,1,0,1,0,0|1,0,0]=3 969 B12R2.24 ClC1=CC2=C(C=C1)CCNC2 O11644 [0,1,0,1,0,0|1,0,0]=3 970 B12R2.24 ClC1=CC2=C(C=C1)CNCC2 83052 [0,1,0,1,0,0|1,0,0]=3 971 B12R2.24 ClC1=CC2=C(C=C1)OCCC2 N11282 [0,1,0,1,0,0|2,0,0]=4 972 B12R2.24 ClC1=NC2=C(C=C1)CNCC2 F11138 [0,1,0,1,0,0|2,0,0]=4 973 B12R2.24 FC1=CC2=C(C=C1)CCCC2 N10855 [0,1,0,1,0,0|2,0,0]=4 974 B12R2.24 FC1=CC2=C(C=C1)CCCN2 N12847 [0,1,0,1,0,0|2,0,0]=4 975 B12R2.24 FC1=CC2=C(C=C1)CCCO2 Y13024 [0,1,0,1,0,0|2,0,0]=4 976 B12R2.24 FC1=CC2=C(C=C1)OCCC2 Y11947 [0,1,0,1,0,0|2,0,0]=4 977 B12R2.24 IC1=CC2=C(C=C1)OCCC2 32826 [0,1,0,1,0,0|2,0,0]=4 978 B12R2.24 NC1=CC2=C(C=C1)CCCN2 F21389 [0,1,0,1,0,0|2,0,0]=4 979 B12R2.24 NC1=CC2=C(C=C1)CCCO2 Y13028 [0,1,0,1,0,0|2,0,0]=4 980 B12R2.24 NC1=CC2=C(C=C1)CCNC2 F19187 [0,1,0,1,0,0|1,0,0]=3 981 B12R2.24 NC1=CC2=C(C=C1)CNCC2 51458 [0,1,0,1,0,0|1,0,0]=3 982 B12R2.24 NC1=CC2=C(C=C1)CNCC2 52057 [0,1,0,1,0,0|1,0,0]=3 983 B12R2.24 NC1=CC2=C(C=C1)OCCC2 Y12467 [0,1,0,1,0,0|2,0,0]=4 984 B12R2.24 NC1=CC2=C(C=C1)OCCC2 Y13365 [0,1,0,1,0,0|2,0,0]=4 985 B12R2.24 NC1=CN=C2CCNCC2=C1 67454 [0,1,0,1,0,0|2,0,0]=4 986 B12R2.24 NC1=CN=C2CCNCC2=C1 FD7018 [0,1,0,1,0,0|2,0,0]=4 987 B12R2.24 N[C@@H]1COC2=C(C=CC=C2)C1 20328 [0,1,0,1,0,0|1,0,0]=3 988 B12R2.24 N[C@@H]1COC2=C(C=CC=C2)C1 D86156 [0,1,0,1,0,0|1,0,0]=3 989 B12R2.24 N[C@@H]1COC2=C(C=CC=C2)C1 Y11370 [0,1,0,1,0,0|1,0,0]=3 990 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 69307 [0,1,0,1,0,0|1,0,0]=3 991 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 69309 [0,1,0,1,0,0|1,0,0]=3 992 B12R2.24 O=C1C=CC2=C(CCNC2)N1 89007 [0,1,0,1,0,0|2,0,0]=4 993 B12R2.24 O=C1C=CC2=C(CCNC2)N1 C76139 [0,1,0,1,0,0|2,0,0]=4 994 B12R2.24 O=C1CC2=C(C=CC=C2)CN1 C15389 [0,1,0,1,0,0|1,0,1]=4 995 B12R2.24 OC1=CC2=C(C=C1)CCCO2 Y11632 [0,1,0,1,0,0|2,0,0]=4 996 B12R2.24 OC1=CC2=C(C=C1)CCNC2 S11181 [0,1,0,1,0,0|1,0,0]=3 997 B12R2.24 OC1=CC2=C(C=C1)CCOC2 Y13231 [0,1,0,1,0,0|2,0,0]=4 998 B12R2.24 OC1=CC2=C(C=C1)COCC2 N13209 [0,1,0,1,0,0|2,0,0]=4 999 B12R2.24 OC1=CC2=C(C=C1)OCCC2 N12986 [0,1,0,1,0,0|2,0,0]=4 1000 B12R2.24 OC1=CN=C2CCNCC2=C1 S11487 [0,1,0,1,0,0|2,0,0]=4 1001 B12R2.24 OC1=CN=C2CCNCC2=C1 SC1341 [0,1,0,1,0,0|2,0,0]=4 1002 B12R2.24 O[C@@H]1CNC2=C(C=CC=C2)C1 P11165 [0,1,0,1,0,0|2,0,0]=4 1003 B12R2.24 O[C@@H]1CNC2=C(C=CC=C2)C1 P12593 [0,1,0,1,0,0|2,0,0]=4 1004 B12R2.24 O[C@@H]1CNC2=C(C=CC=C2)C1 P17350 [0,1,0,1,0,0|2,0,0]=4 1005 B12R2.32 BrCC1CC2=C(C=CC=C2)C1 83149 [0,1,0,1,0,0|2,0,0]=4 1006 B12R2.32 NCC1=CC2=C(C=CC=C2)N1 25413 [0,1,0,1,0,0|1,0,1]=4 1007 B12R2.32 NCC1=CC2=C(C=CC=C2)O1 AC2210 [0,1,0,1,0,0|1,0,1]=4 1008 B12R2.32 NCC1=NC2=C(C=CC=C2)O1 AC2205 [0,1,0,1,0,0|1,0,1]=4 1009 B12R2.32 NCC1=NC2=C(C=CC=C2)S1 C15505 [0,1,0,1,0,0|1,0,1]=4 1010 B12R2.32 NCC1OC2=C(C=CC=C2)O1 AC2204 [0,1,0,1,0,0|1,0,0]=3 1011 B12R2.32 OC[C@H]1CC2=C(C=CC=C2)N1 30218 [0,1,0,1,0,0|2,0,0]=4 1012 B12R2.32 OC[C@H]1CC2=C(C=CC=C2)N1 P12564 [0,1,0,1,0,0|2,0,0]=4 1013 B12R2.32 OC[C@H]1CC2=C(C=CC=C2)O1 25158 [0,1,0,1,0,0|2,0,0]=4 1014 B12R2.196 CC1=CC=CC2=C1CC[C@@H]2N Y11246 [0,1,0,1,0,0|1,0,0]=3 1015 B12R2.196 CC1=CC=CC2=C1CC[C@@H]2N Y13340 [0,1,0,1,0,0|1,0,0]=3 1016 B12R2.196 CC1=CC=CC2=C1CC[C@@H]2O Y10331 [0,1,0,1,0,0|2,0,0]=4 1017 B12R2.196 C[C@H]1CNC2=C(N)C=CC=C21 P20144 [0,1,0,1,0,0|2,0,0]=4 1018 B12R2.196 N[C@H]1CCC2=C(Br)C=CC=C21 F16950 [0,1,0,1,0,0|0,1,0]=3 1019 B12R2.196 N[C@H]1CCC2=C(Br)C=CC=C21 I10898 [0,1,0,1,0,0|0,1,0]=3 1020 B12R2.196 N[C@H]1CCC2=C(Br)C=CC=C21 I10901 [0,1,0,1,0,0|0,1,0]=3 1021 B12R2.196 N[C@H]1CCC2=C(Br)C=CC=C21 I11061 [0,1,0,1,0,0|0,1,0]=3 1022 B12R2.196 N[C@H]1CCC2=C(Br)C=CC=C21 Y10107 [0,1,0,1,0,0|0,1,0]=3 1023 B12R2.196 N[C@H]1CCC2=C(Br)C=CC=C21 Y10458 [0,1,0,1,0,0|0,1,0]=3 1024 B12R2.196 N[C@H]1CCC2=C(Cl)C=CC=C21 N12980 [0,1,0,1,0,0|0,0,0]=2 1025 B12R2.196 N[C@H]1CCC2=C(Cl)C=CC=C21 Y11443 [0,1,0,1,0,0|0,0,0]=2 1026 B12R2.196 N[C@H]1CCC2=C(F)C=CC=C21 20085 [0,1,0,1,0,0|0,1,0]=3 1027 B12R2.196 N[C@H]1CCC2=C(F)C=CC=C21 I10598 [0,1,0,1,0,0|0,1,0]=3 1028 B12R2.196 N[C@H]1CCC2=C(F)C=CC=C21 Y10916 [0,1,0,1,0,0|0,1,0]=3 1029 B12R2.196 N[C@H]1CCC2=C(O)C=CC=C21 D80589 [0,1,0,1,0,0|1,0,0]=3 1030 B12R2.196 N[C@H]1CCC2=C(O)C=CC=C21 N11146 [0,1,0,1,0,0|1,0,0]=3 1031 B12R2.196 N[C@H]1CCC2=C(O)C=CC=C21 N12632 [0,1,0,1,0,0|1,0,0]=3 1032 B12R2.196 N[C@H]1COC2=C(Br)C=CC=C21 N11159 [0,1,0,1,0,0|0,1,0]=3 1033 B12R2.196 N[C@H]1COC2=C(Br)C=CC=C21 N11250 [0,1,0,1,0,0|0,1,0]=3 1034 B12R2.196 N[C@H]1COC2=C(Cl)C=CC=C21 N11240 [0,1,0,1,0,0|0,0,0]=2 1035 B12R2.196 N[C@H]1COC2=C(Cl)C=CC=C21 N16512 [0,1,0,1,0,0|0,0,0]=2 1036 B12R2.196 N[C@H]1COC2=C(F)C=CC=C21 N11235 [0,1,0,1,0,0|0,1,0]=3 1037 B12R2.196 N[C@H]1COC2=C(F)C=CC=C21 N16511 [0,1,0,1,0,0|0,1,0]=3 1038 B12R2.196 O=C1COC2=C(Cl)C=CC=C12 AT10339 [0,1,0,1,0,0|1,0,1]=4 1039 B12R2.196 O=C1NCC2=C(Cl)C=CC=C12 F17918 [0,1,0,1,0,0|1,0,1]=4 1040 B12R2.196 O[C@H]1CCC2=C(Cl)C=CC=C21 N12836 [0,1,0,1,0,0|1,0,0]=3 1041 B12R2.196 O[C@H]1CCC2=C(Cl)C=CN=C21 26883 [0,1,0,1,0,0|2,0,0]=4 1042 B12R2.196 O[C@H]1CCC2=C(F)C=CC=C21 N13047 [0,1,0,1,0,0|1,1,0]=4 1043 B12R2.196 O[C@H]1COC2=C(Br)C=CC=C21 Y10971 [0,1,0,1,0,0|1,1,0]=4 1044 B12R2.225 BrC1=C(OC2CC2)C=CC=C1 AT13881 [0,1,0,1,0,0|1,1,0]=4 1045 B12R2.517 ClC1=C(C2CCC2)N=CC=C1 86870 [0,1,0,1,0,0|2,0,0]=4 1046 B12R2.517 ClC1=C(C2CNC2)C=CC=C1 85612 [0,1,0,1,0,0|0,0,0]=2 1047 B12R2.517 IC1=C(C2COC2)C=CC=C1 86794 [0,1,0,1,0,0|1,1,0]=4 1048 B12R2.1 NCC1=CSC2=C1C=CC=C2 AC2201 [0,1,0,1,0,0|1,0,1]=4 1049 B12R2.1 NCC1=CSC2=C1C=CC=C2 D94984 [0,1,0,1,0,0|1,0,1]=4 1050 B12R2.1 NCC1=NNC2=C1C=CC=C2 26320 [0,1,0,1,0,0|1,0,1]=4 1051 B12R2.1 NCC1=NNC2=C1C=CC=C2 C71652 [0,1,0,1,0,0|1,0,1]=4 1052 B12R2.1 NC[C@H]1CNC2=C1C=CC=C2 31906 [0,1,0,1,0,0|1,0,0]=3 1053 B12R2.1 OC[C@H]1CNC2=C1C=CC=C2 AB9481 [0,1,0,1,0,0|2,0,0]=4 1054 B12R2.18 CC1NC2=C(C=CC=C2)C1C C74121 [0,1,0,1,0,0|2,0,0]=4 1055 B12R2.18 N[C@@H]1C2=C(C=CC=C2)C[C@H]1O C10104 [0,1,0,1,0,0|2,0,0]=4 1056 B12R2.315 ClCC1=C2C=NNC2=CC=C1 P16572 [0,1,0,1,0,0|1,0,1]=4 1057 B12R2.315 N#CC1=C2CCNC2=CC=C1 90572 [0,1,0,1,0,0|1,0,0]=3 1058 B12R2.315 O=CC1=C2CCOC2=CC=C1 F31107 [0,1,0,1,0,0|2,0,0]=4 1059 B12R2.315 OCC1=C2CCNC2=CC=C1 26617 [0,1,0,1,0,0|1,0,0]=3 1060 B12R2.2048 COC1=C([C@@H]2CO2)C=CC=C1 P17977 [0,1,0,1,0,0|2,0,0]=4 1061 B12R2.2048 O=CC1=C(C2CC2)C=CC=C1 D77069 [0,1,0,1,0,0|2,0,0]=4 1062 B12R2.2048 OCC1=C(C2CC2)C=CC=C1 O10045 [0,1,0,1,0,0|2,0,0]=4 1063 B12R2.246 CC1=CC(Cl)=C2C=CNC2=C1 C76939 [0,1,0,1,0,0|0,0,2]=4 1064 B12R2.246 CC1=CC(Cl)=C2C=NNC2=C1 51629 [0,1,0,1,0,0|1,0,1]=4 1065 B12R2.246 CC1=CC(N)=C2CCCC2=C1 Y11353 [0,1,0,1,0,0|2,0,0]=4 1066 B12R2.246 CC1=CC(N)=C2CCCC2=C1 Y11354 [0,1,0,1,0,0|2,0,0]=4 1067 B12R2.246 ClC1=C2C=CNC2=CC(Br)=C1 C76935 [0,1,0,1,0,0|0,0,2]=4 1068 B12R2.246 ClC1=C2C=NNC2=CC(I)=C1 C76973 [0,1,0,1,0,0|1,0,1]=4 1069 B12R2.246 ClC1=CC(Cl)=C2C=CNC2=C1 48413 [0,1,0,1,0,0|0,0,2]=4 1070 B12R2.246 ClC1=CC(Cl)=C2CCNC2=C1 C71743 [0,1,0,1,0,0|0,0,0]=2 1071 B12R2.246 ClC1=CC(Cl)=NC2=C1CCC2 36547 [0,1,0,1,0,0|2,0,0]=4 1072 B12R2.246 FC1=CC(Cl)=C2C=CNC2=C1 82116 [0,1,0,1,0,0|0,0,2]=4 1073 B12R2.246 FC1=CC(F)=C2CCNC2=C1 C73447 [0,1,0,1,0,0|0,1,0]=3 1074 B12R2.246 NC1=CC(Cl)=C2C=NNC2=C1 35605 [0,1,0,1,0,0|1,0,1]=4 1075 B12R2.606 CC1=CC2=C(C=C1)N[C@@H](C)C2 D78738 [0,1,0,1,0,0|2,0,0]=4 1076 B12R2.606 C[C@H]1CC2=C(C=CC(Br)=C2)O1 72190 [0,1,0,1,0,0|2,0,0]=4 1077 B12R2.606 C[C@H]1CC2=C(C=CC(F)=C2)N1 C76645 [0,1,0,1,0,0|2,0,0]=4 1078 B12R2.606 N[C@H]1CC2=C(C=C(Br)C=C2)C1 AT10840 [0,1,0,1,0,0|1,0,0]=3 1079 B12R2.1317 CC1=C(C2CC2)C=CC(N)=C1 33444 [0,1,0,1,0,0|2,0,0]=4 1080 B12R2.1317 OC1=CC(Cl)=C(C2CC2)N=C1 68803 [0,1,0,1,0,0|2,0,0]=4 1081 B12R2.95 CC1(N)CC2=C(C=CC=C2)C1 O11950 [0,1,0,1,0,0|1,0,0]=3 1082 B12R2.221 CC1=C2CCNC2=C(N)C=C1 P20143 [0,1,0,1,0,0|1,0,0]=3 1083 B12R2.221 CC1=C2NN=CC2=C(Cl)C=C1 51647 [0,1,0,1,0,0|1,0,1]=4 1084 B12R2.221 ClC1=C2C=CNC2=C(Br)C=C1 90317 [0,1,0,1,0,0|0,0,2]=4 1085 B12R2.221 ClC1=C2C=CNC2=C(Cl)C=C1 AC1873 [0,1,0,1,0,0|0,0,2]=4 1086 B12R2.221 NC1=C2NC=CC2=C(Cl)C=C1 I11397 [0,1,0,1,0,0|0,0,2]=4 1087 B12R2.221 NC1=C2NCCC2=C(Br)C=C1 P20138 [0,1,0,1,0,0|0,1,0]=3 1088 B12R2.221 NC1=C2NCCC2=C(F)C=C1 P20145 [0,1,0,1,0,0|0,1,0]=3 1089 B12R2.221 NC1=C2NN=CC2=C(Cl)C=C1 38296 [0,1,0,1,0,0|1,0,1]=4 1090 B12R2.88 CC1(C2=C(Br)C=CC=C2)CC1 W16978 [0,1,0,1,0,0|1,1,0]=4 1091 B12R2.88 CC1=C(C2(N)CC2)C=CC=C1 C78262 [0,1,0,1,0,0|2,0,0]=4 1092 B12R2.88 NC1(C2=C(Br)C=CC=C2)CC1 C78336 [0,1,0,1,0,0|1,1,0]=4 1093 B12R2.203 CC1=C2C(=CC=C1)CC[C@@H]2N F16924 [0,1,0,1,0,0|2,0,0]=4 1094 B12R2.203 CC1=C2C(=CC=C1)CC[C@@H]2N N11228 [0,1,0,1,0,0|2,0,0]=4 1095 B12R2.203 CC1=C2C(=CC=C1)CC[C@@H]2O 72767 [0,1,0,1,0,0|2,0,0]=4 1096 B12R2.203 CC1=NNC2=CC=CC(Cl)=C21 F18361 [0,1,0,1,0,0|1,0,1]=4 1097 B12R2.203 ClC1=C2C(=CC=C1)NN=C2Br 78676 [0,1,0,1,0,0|1,0,1]=4 1098 B12R2.203 ClC1=C2C(=CC=C1)NN=C2I O11212 [0,1,0,1,0,0|1,0,1]=4 1099 B12R2.203 N[C@H]1CCC2=CC=CC(Br)=C21 N11312 [0,1,0,1,0,0|1,1,0]=4 1100 B12R2.203 N[C@H]1CCC2=CC=CC(Br)=C21 Y11358 [0,1,0,1,0,0|1,1,0]=4 1101 B12R2.203 N[C@H]1CCC2=CC=CC(F)=C21 Y10796 [0,1,0,1,0,0|1,1,0]=4 1102 B12R2.203 N[C@H]1CCC2=CC=CC(F)=C21 Y11442 [0,1,0,1,0,0|1,1,0]=4 1103 B12R2.203 N[C@H]1CCC2=CC=CC(F)=C21 Y11534 [0,1,0,1,0,0|1,1,0]=4 1104 B12R2.203 N[C@H]1CCC2=CC=CC(O)=C21 F31358 [0,1,0,1,0,0|2,0,0]=4 1105 B12R2.203 O=C1CCC2=CC=CC(Cl)=C12 58274 [0,1,0,1,0,0|1,0,1]=4 1106 B8R1.8 BrCCC1=CSC=C1 F20032 [1,0,0,0,1,0|2,0,0]=4 1107 B8R1.8 NCCC1=CC=CN1 31556 [1,0,0,0,1,0|1,0,0]=3 1108 B8R1.8 NCCC1=CC=CN1 F10331 [1,0,0,0,1,0|1,0,0]=3 1109 B8R1.8 NCCC1=CSC=C1 P10092 [1,0,0,0,1,0|1,0,0]=3 1110 B8R1.8 NCCC1=NC=CN1 F18351 [1,0,0,0,1,0|2,0,0]=4 1111 B8R1.8 NCCC1=NC=CS1 70863 [1,0,0,0,1,0|2,0,0]=4 1112 B8R1.8 NCCC1=NNC=C1 AC1362 [1,0,0,0,1,0|2,0,0]=4 1113 B8R1.8 NCCN1C=CC=N1 28356 [1,0,0,0,1,0|2,0,0]=4 1114 B8R1.8 NCCN1C=CN=C1 30762 [1,0,0,0,1,0|2,0,0]=4 1115 B8R1.8 OCCC1=CC=CN1 AB10351 [1,0,0,0,1,0|2,0,0]=4 1116 B8R1.8 OCCC1=CC=CO1 W10532 [1,0,0,0,1,0|2,0,0]=4 1117 B8R1.8 OCCC1=COC=C1 D93026 [1,0,0,0,1,0|2,0,0]=4 1118 B8R1.11 CN1C=CC=C1CN 88916 [1,0,0,0,1,0|2,0,0]=4 1119 B8R1.11 ClC1=C(CBr)C=CS1 24714 [1,0,0,0,1,0|2,0,0]=4 1120 B8R1.11 NCC1=C(Cl)C=CS1 38405 [1,0,0,0,1,0|1,0,0]=3