0 B11R1.24 C#CCOC1=CC(C)=CC=C1 W16072 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.24 C#CCOC1=CC=CC(Br)=C1 W16066 [0,0,0,0,0,0|2,1,1]=4 2 B11R1.24 C#CCOC1=CC=CC(Cl)=C1 W16060 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.24 CC1=CC=CC(OCC#N)=C1 31898 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.24 CCCC[N+]1=CC(C)=CC=C1 C93457 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.24 CCCC[N+]1=CC(C)=CC=C1 D93268 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.24 CCCC[N+]1=CC(C)=CC=C1 D95727 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.24 CCNCC1=CC=CC(Br)=C1 29353 [0,0,0,0,0,0|2,1,0]=3 8 B11R1.24 CCNCC1=CC=CC(Cl)=C1 78306 [0,0,0,0,0,0|2,0,0]=2 9 B11R1.24 CCNCC1=CC=CC(Cl)=C1 N10024 [0,0,0,0,0,0|2,0,0]=2 10 B11R1.24 CCNCC1=CC=CC(F)=C1 29329 [0,0,0,0,0,0|2,1,0]=3 11 B11R1.24 CNCCC1=CC=CC(Cl)=C1 29813 [0,0,0,0,0,0|0,0,0]=0 12 B11R1.24 CNCCC1=CC=CC(F)=C1 30539 [0,0,0,0,0,0|0,1,0]=1 13 B11R1.24 COCOC1=CC(N)=CC=C1 H10442 [0,0,0,0,0,0|3,0,0]=3 14 B11R1.24 COCOC1=CC=CC(F)=C1 71969 [0,0,0,0,0,0|2,1,0]=3 15 B11R1.24 ClC1=CC=CC(OCCBr)=C1 34708 [0,0,0,0,0,0|3,0,0]=3 16 B11R1.24 FC1=CC=CC(CCCBr)=C1 AB8465 [0,0,0,0,0,0|2,1,0]=3 17 B11R1.24 FC1=CC=CC(CN=C=S)=C1 75836 [0,0,0,0,0,0|3,1,0]=4 18 B11R1.24 N#CCOC1=CC=CC(Cl)=C1 29588 [0,0,0,0,0,0|3,0,0]=3 19 B11R1.24 N#CCOC1=CC=CC(F)=C1 31836 [0,0,0,0,0,0|3,1,0]=4 20 B11R1.24 NCCOC1=CC=CC(Br)=C1 71826 [0,0,0,0,0,0|3,1,0]=4 21 B11R1.24 NCCOC1=CC=CC(Cl)=C1 30850 [0,0,0,0,0,0|3,0,0]=3 22 B11R1.24 NCCOC1=CC=CC(F)=C1 29764 [0,0,0,0,0,0|3,1,0]=4 23 B11R1.24 O=CCCC1=CC=CC(Cl)=C1 AB6892 [0,0,0,0,0,0|2,0,0]=2 24 B11R1.24 O=C\C=C\C1=CC=CC(Cl)=C1 D75052 [0,0,0,0,0,0|2,0,2]=4 25 B11R1.24 OCCCC1=CC=CC(Br)=C1 AB3205 [0,0,0,0,0,0|2,1,0]=3 26 B11R1.24 OCCCC1=CC=CC(O)=C1 62422 [0,0,0,0,0,0|3,0,0]=3 27 B10R1.10 BrCCC1=CC=CC(Br)=C1 20780 [1,0,0,0,0,0|1,1,0]=3 28 B10R1.10 CC1=CC=CC(CC#N)=C1 CK2045 [1,0,0,0,0,0|1,0,2]=4 29 B10R1.10 CC1=CC=CC(CCBr)=C1 F20015 [1,0,0,0,0,0|2,0,0]=3 30 B10R1.10 CC1=CC=CC(CCN)=C1 66804 [1,0,0,0,0,0|1,0,0]=2 31 B10R1.10 CC1=CC=CC(CCN)=C1 79173 [1,0,0,0,0,0|1,0,0]=2 32 B10R1.10 CC1=CC=CC(CCO)=C1 CK1130 [1,0,0,0,0,0|2,0,0]=3 33 B10R1.10 CC1=CC=CC(CCO)=N1 H11169 [1,0,0,0,0,0|3,0,0]=4 34 B10R1.10 CC1=CC=CC(CNN)=C1 W16033 [1,0,0,0,0,0|2,0,0]=3 35 B10R1.10 CCCC1=CC=CC(N)=N1 79666 [1,0,0,0,0,0|2,0,0]=3 36 B10R1.10 CCCC1=NC=CC(Br)=C1 S10806 [1,0,0,0,0,0|1,1,0]=3 37 B10R1.10 CCNC1=CC=CC(Br)=C1 AC1752 [1,0,0,0,0,0|1,1,0]=3 38 B10R1.10 CCNC1=NC=CC(Cl)=N1 D95569 [1,0,0,0,0,0|3,0,0]=4 39 B10R1.10 CCNC1=NC=CC(N)=C1 26868 [1,0,0,0,0,0|3,0,0]=4 40 B10R1.10 CCOC1=CC(Br)=CN=C1 75772 [1,0,0,0,0,0|2,1,0]=4 41 B10R1.10 CCOC1=CC(Cl)=NC=N1 AT18343 [1,0,0,0,0,0|3,0,0]=4 42 B10R1.10 CCOC1=CC(F)=NC=C1 C73354 [1,0,0,0,0,0|2,1,0]=4 43 B10R1.10 CCOC1=CC(N)=CC=C1 S10428 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.10 CCOC1=CC(N)=NC=C1 29145 [1,0,0,0,0,0|3,0,0]=4 45 B10R1.10 CCOC1=CC=CC(Br)=C1 56094 [1,0,0,0,0,0|1,1,0]=3 46 B10R1.10 CCOC1=CC=CC(Br)=N1 71181 [1,0,0,0,0,0|2,1,0]=4 47 B10R1.10 CCOC1=CC=CC(Cl)=N1 S12367 [1,0,0,0,0,0|2,0,0]=3 48 B10R1.10 CCOC1=CC=CC(F)=C1 N11995 [1,0,0,0,0,0|1,1,0]=3 49 B10R1.10 CCOC1=CN=CC(N)=C1 O11422 [1,0,0,0,0,0|3,0,0]=4 50 B10R1.10 CCOC1=NC=CC(Br)=C1 C75718 [1,0,0,0,0,0|2,1,0]=4 51 B10R1.10 CCOC1=NC=CC(N)=C1 20347 [1,0,0,0,0,0|3,0,0]=4 52 B10R1.10 CNCC1=CC(Br)=CN=C1 C76339 [1,0,0,0,0,0|1,1,0]=3 53 B10R1.10 CNCC1=CC(N)=CC=C1 D84175 [1,0,0,0,0,0|1,0,0]=2 54 B10R1.10 CNCC1=CC=CC(Br)=C1 31843 [1,0,0,0,0,0|0,1,0]=2 55 B10R1.10 CNCC1=CC=CC(Br)=C1 55408 [1,0,0,0,0,0|0,1,0]=2 56 B10R1.10 CNCC1=CC=CC(Cl)=C1 F16150 [1,0,0,0,0,0|0,0,0]=1 57 B10R1.10 CNCC1=CC=CC(F)=C1 36788 [1,0,0,0,0,0|0,1,0]=2 58 B10R1.10 CNCC1=CC=CC(F)=C1 FD7354 [1,0,0,0,0,0|0,1,0]=2 59 B10R1.10 CNCC1=CC=CC(O)=C1 30625 [1,0,0,0,0,0|1,0,0]=2 60 B10R1.10 COCC1=CC=CC(Br)=C1 N10086 [1,0,0,0,0,0|1,1,0]=3 61 B10R1.10 ClC1=CC=CC(CCBr)=C1 31191 [1,0,0,0,0,0|1,0,0]=2 62 B10R1.10 FC1=CC=CC(CCBr)=C1 CL8842 [1,0,0,0,0,0|1,1,0]=3 63 B10R1.10 N#CCC1=CC(N)=CC=C1 26201 [1,0,0,0,0,0|1,0,2]=4 64 B10R1.10 N#CCC1=CC=CC(Br)=C1 67771 [1,0,0,0,0,0|0,1,2]=4 65 B10R1.10 N#CCC1=CC=CC(F)=C1 67625 [1,0,0,0,0,0|0,1,2]=4 66 B10R1.10 N#CCC1=CC=CC(I)=C1 CK2047 [1,0,0,0,0,0|0,1,2]=4 67 B10R1.10 N#CCC1=CC=CC(O)=C1 C74311 [1,0,0,0,0,0|1,0,2]=4 68 B10R1.10 NC1=CC=CC(CCO)=C1 AB8062 [1,0,0,0,0,0|2,0,0]=3 69 B10R1.10 NCCC1=CC=CC(Br)=C1 11061 [1,0,0,0,0,0|0,1,0]=2 70 B10R1.10 NCCC1=CC=CC(Br)=C1 56020 [1,0,0,0,0,0|0,1,0]=2 71 B10R1.10 NCCC1=CC=CC(Cl)=C1 57780 [1,0,0,0,0,0|0,0,0]=1 72 B10R1.10 NCCC1=CC=CC(F)=C1 61108 [1,0,0,0,0,0|0,1,0]=2 73 B10R1.10 NCCC1=CC=CC(N)=C1 51930 [1,0,0,0,0,0|1,0,0]=2 74 B10R1.10 NCCC1=CC=CC(O)=C1 51439 [1,0,0,0,0,0|1,0,0]=2 75 B10R1.10 NCCC1=CC=CC(O)=C1 51440 [1,0,0,0,0,0|1,0,0]=2 76 B10R1.10 NNCC1=CC=CC(Cl)=C1 74964 [1,0,0,0,0,0|1,0,0]=2 77 B10R1.10 NNCC1=CC=CC(F)=C1 37002 [1,0,0,0,0,0|1,1,0]=3 78 B10R1.10 NNCC1=CC=CC(O)=C1 62430 [1,0,0,0,0,0|2,0,0]=3 79 B10R1.10 OC1=CC=CC(CCBr)=C1 D84479 [1,0,0,0,0,0|2,0,0]=3 80 B10R1.10 OCCC1=CC=CC(Br)=C1 AB3194 [1,0,0,0,0,0|1,1,0]=3 81 B10R1.10 OCCC1=CC=CC(Cl)=C1 35417 [1,0,0,0,0,0|1,0,0]=2 82 B10R1.10 OCCC1=CC=CC(F)=C1 AB7288 [1,0,0,0,0,0|1,1,0]=3 83 B10R1.10 OCCC1=CC=CC(O)=C1 52366 [1,0,0,0,0,0|2,0,0]=3 84 B10R1.17 BrCCCC1=CC=CC=C1 D78162 [1,0,0,0,0,0|2,0,0]=3 85 B10R1.17 BrCCOC1=CC=CC=C1 73688 [1,0,0,0,0,0|3,0,0]=4 86 B10R1.17 BrCCSC1=CC=CC=C1 D88892 [1,0,0,0,0,0|3,0,0]=4 87 B10R1.17 C#CCCC1=CC=CC=C1 D74342 [1,0,0,0,0,0|1,0,1]=3 88 B10R1.17 C#CCOC1=CC=CC=C1 F21383 [1,0,0,0,0,0|2,0,1]=4 89 B10R1.17 C=CCNC1=CC=CC=C1 D88344 [1,0,0,0,0,0|2,0,1]=4 90 B10R1.17 C=CCOC1=CC=CC=C1 D77750 [1,0,0,0,0,0|2,0,1]=4 91 B10R1.17 C=CCSC1=CC=CC=C1 S12094 [1,0,0,0,0,0|2,0,1]=4 92 B10R1.17 C=COCC1=CC=CC=C1 P11489 [1,0,0,0,0,0|2,0,1]=4 93 B10R1.17 CCCCC1=CC=CC=C1 H11923 [1,0,0,0,0,0|1,0,0]=2 94 B10R1.17 CCCCC1=CC=CN=C1 F20500 [1,0,0,0,0,0|2,0,0]=3 95 B10R1.17 CCCC[N+]1=CC=CC=C1 C93409 [1,0,0,0,0,0|2,0,0]=3 96 B10R1.17 CCCC[N+]1=CC=CC=C1 C93435 [1,0,0,0,0,0|2,0,0]=3 97 B10R1.17 CCCC[N+]1=CC=CC=C1 C93442 [1,0,0,0,0,0|2,0,0]=3 98 B10R1.17 CCCC[N+]1=CC=CC=C1 C93518 [1,0,0,0,0,0|2,0,0]=3 99 B10R1.17 CCCNC1=CC=CC=C1 D91987 [1,0,0,0,0,0|2,0,0]=3 100 B10R1.17 CCNCC1=CC=CN=C1 30943 [1,0,0,0,0,0|3,0,0]=4 101 B10R1.17 CCNCC1=CC=NC=C1 12139 [1,0,0,0,0,0|3,0,0]=4 102 B10R1.17 CCNCC1=NC=CC=C1 29981 [1,0,0,0,0,0|3,0,0]=4 103 B10R1.17 CCOCC1=CC=CC=C1 F30115 [1,0,0,0,0,0|2,0,0]=3 104 B10R1.17 CNCCC1=CC=CC=C1 AR1058 [1,0,0,0,0,0|0,0,0]=1 105 B10R1.17 CNCCC1=CC=NC=C1 64165 [1,0,0,0,0,0|1,0,0]=2 106 B10R1.17 CNCCC1=CC=NC=C1 AR3935 [1,0,0,0,0,0|1,0,0]=2 107 B10R1.17 CNCCC1=NC=CC=C1 23018 [1,0,0,0,0,0|1,0,0]=2 108 B10R1.17 CNCCC1=NC=CC=C1 AR1013 [1,0,0,0,0,0|1,0,0]=2 109 B10R1.17 CNCCC1=NC=CC=C1 D87714 [1,0,0,0,0,0|1,0,0]=2 110 B10R1.17 COCSC1=CC=CC=C1 D91464 [1,0,0,0,0,0|2,0,0]=3 111 B10R1.17 ClCCCC1=CC=CC=C1 S12344 [1,0,0,0,0,0|2,0,0]=3 112 B10R1.17 ClCCOC1=CC=CC=C1 74955 [1,0,0,0,0,0|3,0,0]=4 113 B10R1.17 ClCCSC1=CC=CC=C1 C10874 [1,0,0,0,0,0|3,0,0]=4 114 B10R1.17 ClCOCC1=CC=CC=C1 76478 [1,0,0,0,0,0|3,0,0]=4 115 B10R1.17 ClCSCC1=CC=CC=C1 D88878 [1,0,0,0,0,0|3,0,0]=4 116 B10R1.17 N#CCCC1=CC=CC=C1 D91984 [1,0,0,0,0,0|2,0,0]=3 117 B10R1.17 N#CCNC1=CC=CC=C1 H12014 [1,0,0,0,0,0|3,0,0]=4 118 B10R1.17 N#CCOC1=CC=CC=C1 29593 [1,0,0,0,0,0|3,0,0]=4 119 B10R1.17 N#CCSC1=CC=CC=C1 D92138 [1,0,0,0,0,0|3,0,0]=4 120 B10R1.17 NCCCC1=CC=CC=C1 S10208 [1,0,0,0,0,0|2,0,0]=3 121 B10R1.17 NCCCC1=NC=CC=C1 70884 [1,0,0,0,0,0|3,0,0]=4 122 B10R1.17 NCCNC1=CC=CC=C1 AC8789 [1,0,0,0,0,0|3,0,0]=4 123 B10R1.17 NCCOC1=CC=CC=C1 33388 [1,0,0,0,0,0|3,0,0]=4 124 B10R1.17 O=C=NCC1=CC=CC=C1 D91149 [1,0,0,0,0,0|3,0,0]=4 125 B10R1.17 O=CCCC1=CC=CC=C1 C10629 [1,0,0,0,0,0|2,0,0]=3 126 B10R1.17 O=CNCC1=CC=CC=C1 D72481 [1,0,0,0,0,0|3,0,0]=4 127 B10R1.17 O=COCC1=CC=CC=C1 D70183 [1,0,0,0,0,0|3,0,0]=4 128 B10R1.17 OCCCC1=CC=CC=C1 AC1807 [1,0,0,0,0,0|2,0,0]=3 129 B10R1.17 OCCCC1=CC=NC=C1 65430 [1,0,0,0,0,0|3,0,0]=4 130 B10R1.17 OCCCC1=CN=CC=C1 D84150 [1,0,0,0,0,0|3,0,0]=4 131 B10R1.17 OCCCC1=NC=CC=C1 31622 [1,0,0,0,0,0|3,0,0]=4 132 B10R1.17 OCCCC1=NC=CC=C1 38162 [1,0,0,0,0,0|3,0,0]=4 133 B10R1.17 OCCNC1=CC=CC=C1 D70504 [1,0,0,0,0,0|3,0,0]=4 134 B10R1.17 OCCSC1=CC=CC=C1 D83749 [1,0,0,0,0,0|3,0,0]=4 135 B10R1.17 S=C=NCC1=CC=CC=C1 F16583 [1,0,0,0,0,0|3,0,0]=4 136 B12R1.17 CC1=CC=CC([C@@H](N)CCO)=C1 66832 [0,1,0,0,0,0|3,0,0]=4 137 B12R1.17 CC1=CC=CC([C@@H](N)CCO)=C1 66833 [0,1,0,0,0,0|3,0,0]=4 138 B12R1.17 CCOC(=O)C1=CC=CC(Cl)=C1 67734 [0,1,0,0,0,0|2,0,1]=4 139 B12R1.17 CNC[C@H](O)C1=CC=CC(O)=C1 80038 [0,1,0,0,0,0|1,0,0]=2 140 B12R1.17 CNC[C@H](O)C1=CC=CC(O)=C1 D70603 [0,1,0,0,0,0|1,0,0]=2 141 B12R1.17 N#CCC(=O)C1=CC=CC(Cl)=C1 CL8860 [0,1,0,0,0,0|2,0,1]=4 142 B12R1.17 N[C@@H](CCO)C1=CC=CC(Br)=C1 55913 [0,1,0,0,0,0|2,1,0]=4 143 B12R1.17 N[C@@H](CCO)C1=CC=CC(Br)=C1 55915 [0,1,0,0,0,0|2,1,0]=4 144 B12R1.17 N[C@@H](CCO)C1=CC=CC(Br)=C1 55917 [0,1,0,0,0,0|2,1,0]=4 145 B12R1.17 N[C@@H](CCO)C1=CC=CC(Br)=C1 55924 [0,1,0,0,0,0|2,1,0]=4 146 B12R1.17 N[C@@H](CCO)C1=CC=CC(Cl)=C1 11352 [0,1,0,0,0,0|2,0,0]=3 147 B12R1.17 N[C@@H](CCO)C1=CC=CC(O)=C1 62479 [0,1,0,0,0,0|3,0,0]=4 148 B12R1.17 N[C@@H](CCO)C1=CC=CC(O)=C1 62483 [0,1,0,0,0,0|3,0,0]=4 149 B12R1.25 CCCOC1=CC=CC(F)=C1F 36947 [0,1,0,0,0,0|2,1,0]=4 150 B12R1.28 CC1=CC=CC(NCCC#N)=C1 D97374 [0,1,0,0,0,0|3,0,0]=4 151 B12R1.28 CCCCOC1=CC(O)=CC=C1 D83059 [0,1,0,0,0,0|2,0,0]=3 152 B12R1.28 COCCNC1=CC=NC(Cl)=N1 W15380 [0,1,0,0,0,0|3,0,0]=4 153 B12R1.28 COCCOC1=CC(Br)=CN=C1 F19756 [0,1,0,0,0,0|2,1,0]=4 154 B12R1.50 COC(=O)CC1=CC(C)=CC=C1 35769 [0,1,0,0,0,0|2,0,1]=4 155 B12R1.50 COC(=O)CC1=CC(N)=CC=C1 CL8810 [0,1,0,0,0,0|2,0,1]=4 156 B12R1.50 COC(=O)CC1=CC(O)=CC=C1 AB3965 [0,1,0,0,0,0|2,0,1]=4 157 B12R1.50 COC(=O)CC1=CC=CC(Br)=C1 AB3931 [0,1,0,0,0,0|1,1,1]=4 158 B12R1.50 COC(=O)CC1=CC=CC(Cl)=C1 AB9674 [0,1,0,0,0,0|1,0,1]=3 159 B12R1.50 COC(=O)CC1=CC=CC(F)=C1 22081 [0,1,0,0,0,0|1,1,1]=4 160 B12R1.50 COC(=O)CC1=CC=CC(I)=C1 P16659 [0,1,0,0,0,0|1,1,1]=4 161 B12R1.50 N\C(CC1=CC=CC(Cl)=C1)=N/O 71744 [0,1,0,0,0,0|1,0,2]=4 162 B12R1.100 OCCCC1=CC(Cl)=CC(Cl)=C1 D93902 [0,1,0,0,0,0|2,0,0]=3 163 B12R1.226 CC1=CC=CC(CCC(=O)O)=C1 66560 [0,1,0,0,0,0|3,0,0]=4 164 B12R1.226 NC1=CC=CC(CCC(=O)O)=C1 I11525 [0,1,0,0,0,0|3,0,0]=4 165 B12R1.226 O=C(O)CCC1=CC(O)=CC=C1 33491 [0,1,0,0,0,0|3,0,0]=4 166 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 33548 [0,1,0,0,0,0|2,1,0]=4 167 B12R1.226 O=C(O)CCC1=CC=CC(Cl)=C1 34301 [0,1,0,0,0,0|2,0,0]=3 168 B12R1.226 O=C(O)CCC1=CC=CC(F)=C1 61032 [0,1,0,0,0,0|2,1,0]=4 169 B12R1.226 O=C(O)COC1=CC=CC(Cl)=C1 37702 [0,1,0,0,0,0|3,0,0]=4 170 B12R1.382 CNCCC1=CC=CC(OC)=C1 C15606 [0,1,0,0,0,0|1,0,0]=2 171 B12R1.382 COC1=CC(CCCO)=CC=C1 C78421 [0,1,0,0,0,0|3,0,0]=4 172 B12R1.385 CCCCC1=CC(C)=C(N)C=C1 D86259 [0,1,0,0,0,0|2,0,0]=3 173 B12R1.385 CCCCC1=CC(O)=C(O)C=C1 D84238 [0,1,0,0,0,0|2,0,0]=3 174 B12R1.385 CCNCC1=CC(C)=C(C)C=C1 30534 [0,1,0,0,0,0|3,0,0]=4 175 B12R1.385 S=C=NCC1=CC(Cl)=C(Cl)C=C1 D94595 [0,1,0,0,0,0|3,0,0]=4 176 B12R2.24 BrC1=CC2=C(C=C1)CCCC2 N10556 [0,0,0,1,0,0|1,1,0]=3 177 B12R2.24 BrC1=CC2=C(C=C1)CCCN2 51828 [0,0,0,1,0,0|2,1,0]=4 178 B12R2.24 BrC1=CC2=C(C=C1)CCCN2 VT1291 [0,0,0,1,0,0|2,1,0]=4 179 B12R2.24 BrC1=CC2=C(C=C1)CCNC2 51827 [0,0,0,1,0,0|2,1,0]=4 180 B12R2.24 BrC1=CC2=C(C=C1)CCNC2 SC2011 [0,0,0,1,0,0|2,1,0]=4 181 B12R2.24 BrC1=CC2=C(C=C1)CNCC2 82299 [0,0,0,1,0,0|0,1,0]=2 182 B12R2.24 BrC1=CC2=C(C=C1)CNCC2 83307 [0,0,0,1,0,0|0,1,0]=2 183 B12R2.24 BrC1=CC2=C(C=C1)NCCC2 69845 [0,0,0,1,0,0|2,1,0]=4 184 B12R2.24 BrC1=CC2=C(C=C1)OCCC2 I11494 [0,0,0,1,0,0|2,1,0]=4 185 B12R2.24 BrC1=CN=C2CCCCC2=C1 55099 [0,0,0,1,0,0|2,1,0]=4 186 B12R2.24 CC1=CC2=C(C=C1)CCNC2 26311 [0,0,0,1,0,0|3,0,0]=4 187 B12R2.24 CC1=CC2=C(C=C1)CCNC2 71799 [0,0,0,1,0,0|3,0,0]=4 188 B12R2.24 CC1=CC2=C(C=C1)CNCC2 64316 [0,0,0,1,0,0|1,0,0]=2 189 B12R2.24 CC1=CC2=C(C=C1)NCCC2 D91482 [0,0,0,1,0,0|3,0,0]=4 190 B12R2.24 CC1=CC=C2CCCCC2=N1 C15437 [0,0,0,1,0,0|3,0,0]=4 191 B12R2.24 ClC1=CC2=C(C=C1)CCCN2 VT1294 [0,0,0,1,0,0|2,0,0]=3 192 B12R2.24 ClC1=CC2=C(C=C1)CNCC2 83051 [0,0,0,1,0,0|0,0,0]=1 193 B12R2.24 ClC1=CC2=C(C=C1)NCCC2 36162 [0,0,0,1,0,0|2,0,0]=3 194 B12R2.24 ClC1=NC2=C(C=C1)CNCC2 SC2831 [0,0,0,1,0,0|1,0,0]=2 195 B12R2.24 FC1=CC2=C(C=C1)CCNC2 90641 [0,0,0,1,0,0|2,1,0]=4 196 B12R2.24 FC1=CC2=C(C=C1)CNCC2 61244 [0,0,0,1,0,0|0,1,0]=2 197 B12R2.24 FC1=CC2=C(C=C1)CNCC2 W17761 [0,0,0,1,0,0|0,1,0]=2 198 B12R2.24 FC1=CC2=C(C=C1)NCCC2 F11863 [0,0,0,1,0,0|2,1,0]=4 199 B12R2.24 NC1=CC2=C(C=C1)CCCN2 28957 [0,0,0,1,0,0|3,0,0]=4 200 B12R2.24 NC1=CC2=C(C=C1)CCNC2 28043 [0,0,0,1,0,0|3,0,0]=4 201 B12R2.24 NC1=NC2=C(C=N1)CNCC2 27180 [0,0,0,1,0,0|3,0,0]=4 202 B12R2.24 O=C1C=CC2=C(CCCC2)N1 87090 [0,0,0,1,0,0|3,0,0]=4 203 B12R2.24 OC1=CC2=C(C=C1)CCCC2 O11319 [0,0,0,1,0,0|2,0,0]=3 204 B12R2.24 OC1=CC2=C(C=C1)CCCN2 62510 [0,0,0,1,0,0|3,0,0]=4 205 B12R2.24 OC1=CC2=C(C=C1)CNCC2 62444 [0,0,0,1,0,0|1,0,0]=2 206 B12R2.24 OC1=CC2=C(C=C1)CNCC2 62445 [0,0,0,1,0,0|1,0,0]=2 207 B12R2.24 OC1=CC2=C(C=C1)NCCC2 25056 [0,0,0,1,0,0|3,0,0]=4 208 B12R2.24 OC1=CN=C2CCCCC2=C1 F51876 [0,0,0,1,0,0|3,0,0]=4 209 B12R2.203 CC1=C2C(=O)CCC2=CC=C1 Y10476 [0,0,0,1,0,0|3,0,0]=4 210 B12R2.203 CC1=CC=CC2=C1N(C)N=C2 O10357 [0,0,0,1,0,0|2,0,1]=4 211 B12R2.203 CN1N=CC2=C1C(N)=CC=C2 P10815 [0,0,0,1,0,0|2,0,1]=4 212 B12R2.203 O=C1CCC2=CC=CC(Br)=C12 56812 [0,0,0,1,0,0|2,1,0]=4 213 B12R2.203 O=C1CCC2=CC=CC(F)=C12 61630 [0,0,0,1,0,0|2,1,0]=4 214 B12R2.203 O=C1CCC2=CC=CC(O)=C12 82957 [0,0,0,1,0,0|3,0,0]=4 215 B12R2.203 O=C1OCC2=CC=CC(Cl)=C12 N12505 [0,0,0,1,0,0|3,0,0]=4 216 B12R2.612 CC1=CC2=C(C=C1)C(=O)CC2 82920 [0,0,0,1,0,0|3,0,0]=4 217 B12R2.612 CN1C=CC2=C1C=CC(Br)=C2 AB6416 [0,0,0,1,0,0|0,1,2]=4 218 B12R2.612 CN1C=CC2=C1C=CC(N)=C2 56046 [0,0,0,1,0,0|1,0,2]=4 219 B12R2.612 CN1C=NC2=C1C=CC(Br)=C2 71950 [0,0,0,1,0,0|1,1,1]=4 220 B12R2.612 CN1C=NC2=C1C=CC(N)=C2 26197 [0,0,0,1,0,0|2,0,1]=4 221 B12R2.612 CN1C=NC2=C1C=CC(O)=C2 AR2759 [0,0,0,1,0,0|2,0,1]=4 222 B12R2.612 CN1N=CC2=C1C=CC(Br)=C2 BL000063 [0,0,0,1,0,0|1,1,1]=4 223 B12R2.612 CN1N=CC2=C1C=CC(I)=C2 Y10373 [0,0,0,1,0,0|1,1,1]=4 224 B12R2.612 CN1N=CC2=C1C=CC(N)=C2 34671 [0,0,0,1,0,0|2,0,1]=4 225 B12R2.612 NC1=CC2=C(C=C1)C(=O)CC2 36742 [0,0,0,1,0,0|3,0,0]=4 226 B12R2.612 N[C@H]1CCC2=C1C=CC(Cl)=C2 F12583 [0,0,0,1,0,0|2,0,0]=3 227 B12R2.612 O=C1CCC2=C1C=CC(Br)=C2 20447 [0,0,0,1,0,0|2,1,0]=4 228 B12R2.612 O=C1CCC2=C1C=CC(Cl)=C2 F11243 [0,0,0,1,0,0|2,0,0]=3 229 B12R2.612 O=C1CCC2=C1C=CC(F)=C2 28490 [0,0,0,1,0,0|2,1,0]=4 230 B12R2.612 O=C1CCC2=C1C=CC(O)=C2 62264 [0,0,0,1,0,0|3,0,0]=4 231 B12R2.612 O=C1COC2=C1C=CC(Cl)=C2 23871 [0,0,0,1,0,0|3,0,0]=4 232 B12R2.612 O=C1OCC2=C1C=CC(Cl)=C2 50627 [0,0,0,1,0,0|3,0,0]=4 233 B12R2.612 O[C@H]1CCC2=C1C=CC(Br)=C2 71622 [0,0,0,1,0,0|2,1,0]=4 234 B12R2.612 O[C@H]1CCC2=C1C=CC(Cl)=C2 N12515 [0,0,0,1,0,0|2,0,0]=3 235 B12R2.612 O[C@H]1CCC2=C1C=CC(F)=C2 69967 [0,0,0,1,0,0|2,1,0]=4 236 B12R2.1081 BrC1=C2CCCCC2=CC=C1 N12384 [0,0,0,1,0,0|1,1,0]=3 237 B12R2.1081 BrC1=C2CCCNC2=CC=C1 69219 [0,0,0,1,0,0|2,1,0]=4 238 B12R2.1081 BrC1=C2CCCNC2=CC=C1 VT1267 [0,0,0,1,0,0|2,1,0]=4 239 B12R2.1081 BrC1=C2CCNCC2=CC=C1 25481 [0,0,0,1,0,0|2,1,0]=4 240 B12R2.1081 BrC1=C2CCNCC2=CC=C1 54560 [0,0,0,1,0,0|2,1,0]=4 241 B12R2.1081 BrC1=C2CNCCC2=CC=C1 82435 [0,0,0,1,0,0|0,1,0]=2 242 B12R2.1081 BrC1=NC=CC2=C1CCCC2 39103 [0,0,0,1,0,0|2,1,0]=4 243 B12R2.1081 CC1=CC=CC2=C1CCCN2 25700 [0,0,0,1,0,0|3,0,0]=4 244 B12R2.1081 CC1=CC=CC2=C1NCCC2 36744 [0,0,0,1,0,0|3,0,0]=4 245 B12R2.1081 ClC1=C2CCCNC2=CC=C1 25795 [0,0,0,1,0,0|2,0,0]=3 246 B12R2.1081 ClC1=C2CNCCC2=CC=C1 O11670 [0,0,0,1,0,0|0,0,0]=1 247 B12R2.1081 FC1=C2CNCCC2=CC=C1 33398 [0,0,0,1,0,0|0,1,0]=2 248 B12R2.1081 NC1=C2CCCCC2=CC=C1 50818 [0,0,0,1,0,0|2,0,0]=3 249 B12R2.1081 NC1=CC=CC2=C1CCNC2 81637 [0,0,0,1,0,0|3,0,0]=4 250 B12R2.1081 OC1=C2CCCCC2=CC=C1 N11905 [0,0,0,1,0,0|2,0,0]=3 251 B12R2.1081 OC1=C2NCCCC2=CC=C1 23213 [0,0,0,1,0,0|3,0,0]=4 252 B12R2.2313 CC1=NC=CC(C2CNC2)=N1 90173 [0,0,0,1,0,0|3,0,0]=4 253 B10R1.29 CCCCC1=C(Br)SC=C1 F14972 [0,0,0,0,1,0|2,1,0]=4 254 B10R1.29 CCCCN1C=CN=C1Cl 24162 [0,0,0,0,1,0|3,0,0]=4 255 B9R0.45 CCCC\C=C\C=C\C=O D91726 [1,0,1,0,0,0|2,0,0]=4 256 B9R1.2 BrCC1=CC=CC(Br)=C1 67611 [2,0,0,0,0,0|1,1,0]=4 257 B9R1.2 BrCC1=CC=CC(I)=C1 AB3175 [2,0,0,0,0,0|1,1,0]=4 258 B9R1.2 C#CC1=CC=CC(Cl)=C1 98193 [2,0,0,0,0,0|0,0,2]=4 259 B9R1.2 C=CC1=CC=CC(Cl)=C1 28921 [2,0,0,0,0,0|0,0,2]=4 260 B9R1.2 CC1=CC(CN)=NC=C1 28108 [2,0,0,0,0,0|2,0,0]=4 261 B9R1.2 CC1=CC=CC(CBr)=C1 73702 [2,0,0,0,0,0|2,0,0]=4 262 B9R1.2 CC1=CC=CC(CN)=C1 CK2411 [2,0,0,0,0,0|1,0,0]=3 263 B9R1.2 CC1=CC=CC(CN)=N1 20204 [2,0,0,0,0,0|2,0,0]=4 264 B9R1.2 CC1=CC=CC(CN)=N1 D76124 [2,0,0,0,0,0|2,0,0]=4 265 B9R1.2 CC1=CC=CC(CO)=C1 H10820 [2,0,0,0,0,0|2,0,0]=4 266 B9R1.2 CC1=CC=CC(NN)=C1 74116 [2,0,0,0,0,0|2,0,0]=4 267 B9R1.2 CC1=CC=CC(NN)=C1 75882 [2,0,0,0,0,0|2,0,0]=4 268 B9R1.2 CC1=CN=CC(CN)=C1 AB9815 [2,0,0,0,0,0|2,0,0]=4 269 B9R1.2 CC1=NC=CC(CN)=C1 H10984 [2,0,0,0,0,0|2,0,0]=4 270 B9R1.2 CCC1=CC(Br)=NC=C1 P17583 [2,0,0,0,0,0|1,1,0]=4 271 B9R1.2 CCC1=CC(C)=CC=C1 F11740 [2,0,0,0,0,0|1,0,0]=3 272 B9R1.2 CCC1=CC(Cl)=NC=C1 D82379 [2,0,0,0,0,0|1,0,0]=3 273 B9R1.2 CCC1=CC(N)=NC=C1 P17120 [2,0,0,0,0,0|2,0,0]=4 274 B9R1.2 CCC1=CC(O)=CN=C1 D83801 [2,0,0,0,0,0|2,0,0]=4 275 B9R1.2 CCC1=CC=CC(Br)=C1 34711 [2,0,0,0,0,0|0,1,0]=3 276 B9R1.2 CCC1=CC=CC(Cl)=C1 22387 [2,0,0,0,0,0|0,0,0]=2 277 B9R1.2 CCC1=CC=CC(F)=C1 36945 [2,0,0,0,0,0|0,1,0]=3 278 B9R1.2 CCC1=CC=CC(N)=C1 34361 [2,0,0,0,0,0|1,0,0]=3 279 B9R1.2 CCC1=CC=CC(N)=N1 S10311 [2,0,0,0,0,0|2,0,0]=4 280 B9R1.2 CCC1=CC=CC(O)=C1 D78431 [2,0,0,0,0,0|1,0,0]=3 281 B9R1.2 CCC1=NC(C)=CC=C1 S10152 [2,0,0,0,0,0|2,0,0]=4 282 B9R1.2 CCC1=NC=CC(N)=C1 P11358 [2,0,0,0,0,0|2,0,0]=4 283 B9R1.2 CC[N+]1=CC(C)=CC=C1 D90551 [2,0,0,0,0,0|2,0,0]=4 284 B9R1.2 CNC1=CC(Br)=CN=C1 F13822 [2,0,0,0,0,0|1,1,0]=4 285 B9R1.2 CNC1=CC(C)=CC=C1 29078 [2,0,0,0,0,0|1,0,0]=3 286 B9R1.2 CNC1=CC(C)=CN=C1 D81246 [2,0,0,0,0,0|2,0,0]=4 287 B9R1.2 CNC1=CC(Cl)=NC=N1 34877 [2,0,0,0,0,0|2,0,0]=4 288 B9R1.2 CNC1=CC(F)=NC=C1 D82990 [2,0,0,0,0,0|1,1,0]=4 289 B9R1.2 CNC1=CC=CC(Br)=C1 53606 [2,0,0,0,0,0|0,1,0]=3 290 B9R1.2 CNC1=CC=CC(Br)=C1 F14680 [2,0,0,0,0,0|0,1,0]=3 291 B9R1.2 CNC1=CC=CC(Br)=C1 F20988 [2,0,0,0,0,0|0,1,0]=3 292 B9R1.2 CNC1=CC=CC(Cl)=C1 75804 [2,0,0,0,0,0|0,0,0]=2 293 B9R1.2 CNC1=CC=CC(Cl)=N1 F15492 [2,0,0,0,0,0|1,0,0]=3 294 B9R1.2 CNC1=CC=CC(F)=C1 RB3023 [2,0,0,0,0,0|0,1,0]=3 295 B9R1.2 CNC1=CC=CC(I)=C1 C78352 [2,0,0,0,0,0|0,1,0]=3 296 B9R1.2 CNC1=CC=CC(O)=C1 C72795 [2,0,0,0,0,0|1,0,0]=3 297 B9R1.2 CNC1=CC=NC(Cl)=N1 W10444 [2,0,0,0,0,0|2,0,0]=4 298 B9R1.2 CNC1=CN=CC(Cl)=N1 35607 [2,0,0,0,0,0|2,0,0]=4 299 B9R1.2 CNC1=NC(C)=CC=C1 N10112 [2,0,0,0,0,0|2,0,0]=4 300 B9R1.2 CNC1=NC=CC(Cl)=C1 D82658 [2,0,0,0,0,0|1,0,0]=3 301 B9R1.2 COC1=CC(C)=CC=C1 H11854 [2,0,0,0,0,0|2,0,0]=4 302 B9R1.2 COC1=CC(Cl)=CN=C1 64351 [2,0,0,0,0,0|2,0,0]=4 303 B9R1.2 COC1=CC(Cl)=NC=C1 CL0073 [2,0,0,0,0,0|2,0,0]=4 304 B9R1.2 COC1=CC(O)=CC=C1 CK1184 [2,0,0,0,0,0|2,0,0]=4 305 B9R1.2 COC1=CC=CC(Br)=C1 26113 [2,0,0,0,0,0|1,1,0]=4 306 B9R1.2 COC1=CC=CC(Cl)=C1 F13566 [2,0,0,0,0,0|1,0,0]=3 307 B9R1.2 COC1=CC=CC(Cl)=N1 CL0089 [2,0,0,0,0,0|2,0,0]=4 308 B9R1.2 COC1=CC=CC(F)=C1 22018 [2,0,0,0,0,0|1,1,0]=4 309 B9R1.2 COC1=CC=CC(I)=C1 F15426 [2,0,0,0,0,0|1,1,0]=4 310 B9R1.2 COC1=CC=CC(S)=C1 D78387 [2,0,0,0,0,0|2,0,0]=4 311 B9R1.2 COC1=NC=CC(Cl)=C1 63218 [2,0,0,0,0,0|2,0,0]=4 312 B9R1.2 CSC1=CC(N)=CC=C1 C10757 [2,0,0,0,0,0|2,0,0]=4 313 B9R1.2 CSC1=CC=CC(Br)=C1 O10728 [2,0,0,0,0,0|1,1,0]=4 314 B9R1.2 CSC1=CC=CC(Cl)=C1 D89485 [2,0,0,0,0,0|1,0,0]=3 315 B9R1.2 CSC1=NC=CC(Cl)=C1 22724 [2,0,0,0,0,0|2,0,0]=4 316 B9R1.2 ClC1=CC=CC(CBr)=C1 67596 [2,0,0,0,0,0|1,0,0]=3 317 B9R1.2 ClCC1=CC(Cl)=CN=C1 38184 [2,0,0,0,0,0|2,0,0]=4 318 B9R1.2 ClCC1=CC(Cl)=NC=C1 57521 [2,0,0,0,0,0|2,0,0]=4 319 B9R1.2 ClCC1=CC=CC(Br)=C1 67612 [2,0,0,0,0,0|1,1,0]=4 320 B9R1.2 ClCC1=CC=CC(Cl)=C1 75801 [2,0,0,0,0,0|1,0,0]=3 321 B9R1.2 ClCC1=CC=CC(I)=C1 CL8720 [2,0,0,0,0,0|1,1,0]=4 322 B9R1.2 FC1=CC=CC(CBr)=C1 D78091 [2,0,0,0,0,0|1,1,0]=4 323 B9R1.2 FC1=CC=CC(CCl)=C1 36461 [2,0,0,0,0,0|1,1,0]=4 324 B9R1.2 N#CC1=CC=CC(Cl)=C1 CK2125 [2,0,0,0,0,0|0,0,2]=4 325 B9R1.2 NC1=CC=CC(CO)=C1 75749 [2,0,0,0,0,0|2,0,0]=4 326 B9R1.2 NCC1=CC(=O)NC=C1 93445 [2,0,0,0,0,0|2,0,0]=4 327 B9R1.2 NCC1=CC(Br)=CN=C1 56987 [2,0,0,0,0,0|1,1,0]=4 328 B9R1.2 NCC1=CC(Br)=NC=C1 26261 [2,0,0,0,0,0|1,1,0]=4 329 B9R1.2 NCC1=CC(Cl)=NC=C1 25604 [2,0,0,0,0,0|1,0,0]=3 330 B9R1.2 NCC1=CC(F)=CN=C1 38050 [2,0,0,0,0,0|1,1,0]=4 331 B9R1.2 NCC1=CC(F)=NC=C1 78902 [2,0,0,0,0,0|1,1,0]=4 332 B9R1.2 NCC1=CC(N)=NC=C1 O11079 [2,0,0,0,0,0|2,0,0]=4 333 B9R1.2 NCC1=CC=CC(=O)N1 D81574 [2,0,0,0,0,0|2,0,0]=4 334 B9R1.2 NCC1=CC=CC(Br)=C1 34949 [2,0,0,0,0,0|0,1,0]=3 335 B9R1.2 NCC1=CC=CC(Br)=C1 75778 [2,0,0,0,0,0|0,1,0]=3 336 B9R1.2 NCC1=CC=CC(Br)=N1 26223 [2,0,0,0,0,0|1,1,0]=4 337 B9R1.2 NCC1=CC=CC(Br)=N1 Y10846 [2,0,0,0,0,0|1,1,0]=4 338 B9R1.2 NCC1=CC=CC(Cl)=C1 58202 [2,0,0,0,0,0|0,0,0]=2 339 B9R1.2 NCC1=CC=CC(F)=C1 CK2419 [2,0,0,0,0,0|0,1,0]=3 340 B9R1.2 NCC1=CC=CC(I)=C1 35428 [2,0,0,0,0,0|0,1,0]=3 341 B9R1.2 NCC1=CC=CC(N)=C1 29039 [2,0,0,0,0,0|1,0,0]=3 342 B9R1.2 NCC1=CC=CC(O)=C1 30466 [2,0,0,0,0,0|1,0,0]=3 343 B9R1.2 NCC1=CN=CC(N)=C1 79130 [2,0,0,0,0,0|2,0,0]=4 344 B9R1.2 NCC1=NC=CC(Cl)=C1 26748 [2,0,0,0,0,0|1,0,0]=3 345 B9R1.2 NNC1=CC(Cl)=NC=C1 BL010284 [2,0,0,0,0,0|2,0,0]=4 346 B9R1.2 NNC1=CC=CC(Br)=C1 73697 [2,0,0,0,0,0|1,1,0]=4 347 B9R1.2 NNC1=CC=CC(Cl)=C1 73698 [2,0,0,0,0,0|1,0,0]=3 348 B9R1.2 NNC1=CC=CC(Cl)=C1 73732 [2,0,0,0,0,0|1,0,0]=3 349 B9R1.2 NNC1=CC=CC(Cl)=N1 CL0092 [2,0,0,0,0,0|2,0,0]=4 350 B9R1.2 NNC1=CC=CC(F)=C1 73699 [2,0,0,0,0,0|1,1,0]=4 351 B9R1.2 NNC1=NC=CC(Cl)=C1 78590 [2,0,0,0,0,0|2,0,0]=4 352 B9R1.2 O=CC1=CC=CC(Cl)=C1 D70835 [2,0,0,0,0,0|1,0,1]=4 353 B9R1.2 OC1=CC=CC(CBr)=C1 78482 [2,0,0,0,0,0|2,0,0]=4 354 B9R1.2 OCC1=CC(Cl)=NC=C1 CL0096 [2,0,0,0,0,0|2,0,0]=4 355 B9R1.2 OCC1=CC=CC(Br)=C1 AB6445 [2,0,0,0,0,0|1,1,0]=4 356 B9R1.2 OCC1=CC=CC(Cl)=C1 67591 [2,0,0,0,0,0|1,0,0]=3 357 B9R1.2 OCC1=CC=CC(Cl)=N1 CL0094 [2,0,0,0,0,0|2,0,0]=4 358 B9R1.2 OCC1=CC=CC(Cl)=N1 CL0095 [2,0,0,0,0,0|2,0,0]=4 359 B9R1.2 OCC1=CC=CC(F)=C1 67592 [2,0,0,0,0,0|1,1,0]=4 360 B9R1.2 OCC1=CC=CC(I)=C1 CK2476 [2,0,0,0,0,0|1,1,0]=4 361 B9R1.2 OCC1=CC=CC(O)=C1 75844 [2,0,0,0,0,0|2,0,0]=4 362 B9R1.2 OCC1=NC=CC(Cl)=C1 CL0188 [2,0,0,0,0,0|2,0,0]=4 363 B9R1.8 BrCCC1=CC=CC=C1 S12296 [2,0,0,0,0,0|1,0,0]=3 364 B9R1.8 BrCCC1=NC=CC=C1 54525 [2,0,0,0,0,0|2,0,0]=4 365 B9R1.8 C#CCC1=CC=CC=C1 A11825 [2,0,0,0,0,0|0,0,2]=4 366 B9R1.8 C=CCC1=CC=CC=C1 FD14063 [2,0,0,0,0,0|0,0,2]=4 367 B9R1.8 CC#CC1=CC=CC=C1 D71012 [2,0,0,0,0,0|0,0,2]=4 368 B9R1.8 CCCC1=CC=CC=C1 F10002 [2,0,0,0,0,0|0,0,0]=2 369 B9R1.8 CCCC1=CC=NC=C1 D86491 [2,0,0,0,0,0|1,0,0]=3 370 B9R1.8 CCCC1=NC=CC=C1 A10924 [2,0,0,0,0,0|1,0,0]=3 371 B9R1.8 CCCC1=NC=CN=C1 D70525 [2,0,0,0,0,0|2,0,0]=4 372 B9R1.8 CCNC1=NC=CC=C1 H11775 [2,0,0,0,0,0|2,0,0]=4 373 B9R1.8 CCOC1=CC=CC=C1 D78866 [2,0,0,0,0,0|1,0,0]=3 374 B9R1.8 CCOC1=NC=CC=C1 28909 [2,0,0,0,0,0|2,0,0]=4 375 B9R1.8 CCSC1=CC=CC=C1 H10383 [2,0,0,0,0,0|1,0,0]=3 376 B9R1.8 CNCC1=CC=CC=C1 AR1001 [2,0,0,0,0,0|0,0,0]=2 377 B9R1.8 CNCC1=CC=CN=C1 28981 [2,0,0,0,0,0|1,0,0]=3 378 B9R1.8 CNCC1=CC=CN=C1 AR1268 [2,0,0,0,0,0|1,0,0]=3 379 B9R1.8 CNCC1=CC=NC=C1 30756 [2,0,0,0,0,0|1,0,0]=3 380 B9R1.8 CNCC1=NC=CC=C1 29930 [2,0,0,0,0,0|1,0,0]=3 381 B9R1.8 CNCC1=NC=CC=C1 AR1010 [2,0,0,0,0,0|1,0,0]=3 382 B9R1.8 COCC1=CC=CC=C1 D88644 [2,0,0,0,0,0|1,0,0]=3 383 B9R1.8 COCC1=NC=CC=C1 23564 [2,0,0,0,0,0|2,0,0]=4 384 B9R1.8 C\N=C\C1=CC=CC=C1 D94771 [2,0,0,0,0,0|0,0,2]=4 385 B9R1.8 ClCCC1=CC=CC=C1 D70839 [2,0,0,0,0,0|1,0,0]=3 386 B9R1.8 ClCSC1=CC=CC=C1 D89325 [2,0,0,0,0,0|2,0,0]=4 387 B9R1.8 ICCC1=CC=CC=C1 D70924 [2,0,0,0,0,0|1,0,0]=3 388 B9R1.8 NCCC1=CC=CC=C1 D78532 [2,0,0,0,0,0|0,0,0]=2 389 B9R1.8 NCCC1=CC=CN=C1 51507 [2,0,0,0,0,0|1,0,0]=3 390 B9R1.8 NCCC1=CC=CN=C1 51508 [2,0,0,0,0,0|1,0,0]=3 391 B9R1.8 NCCC1=CC=NC=C1 51916 [2,0,0,0,0,0|1,0,0]=3 392 B9R1.8 NCCC1=CC=NC=C1 N12034 [2,0,0,0,0,0|1,0,0]=3 393 B9R1.8 NCCC1=NC=CC=C1 AB1583 [2,0,0,0,0,0|1,0,0]=3 394 B9R1.8 NNCC1=CC=CC=C1 53542 [2,0,0,0,0,0|1,0,0]=3 395 B9R1.8 NNCC1=CC=CC=C1 53594 [2,0,0,0,0,0|1,0,0]=3 396 B9R1.8 NNCC1=CC=CC=C1 78678 [2,0,0,0,0,0|1,0,0]=3 397 B9R1.8 NNCC1=CC=CN=C1 37010 [2,0,0,0,0,0|2,0,0]=4 398 B9R1.8 NNCC1=CC=CN=C1 71680 [2,0,0,0,0,0|2,0,0]=4 399 B9R1.8 NNCC1=NC=CC=C1 37011 [2,0,0,0,0,0|2,0,0]=4 400 B9R1.8 NOCC1=CC=CC=C1 54239 [2,0,0,0,0,0|1,0,0]=3 401 B9R1.8 NOCC1=CC=CC=C1 N10409 [2,0,0,0,0,0|1,0,0]=3 402 B9R1.8 O=CCC1=CC=CC=C1 D78329 [2,0,0,0,0,0|1,0,1]=4 403 B9R1.8 OCCC1=CC=CC=C1 D70868 [2,0,0,0,0,0|1,0,0]=3 404 B9R1.8 OCCC1=CC=NC=C1 27360 [2,0,0,0,0,0|2,0,0]=4 405 B9R1.8 OCCC1=CN=CC=C1 29643 [2,0,0,0,0,0|2,0,0]=4 406 B9R1.8 OCCC1=NC=CC=C1 D70485 [2,0,0,0,0,0|2,0,0]=4 407 B9R1.8 ONCC1=CC=CC=C1 23229 [2,0,0,0,0,0|1,0,0]=3 408 B9R1.8 ONCC1=CC=CC=C1 70488 [2,0,0,0,0,0|1,0,0]=3 409 B9R1.8 SCCC1=CC=CC=C1 AC9387 [2,0,0,0,0,0|1,0,0]=3 410 B9R1.8 SCCC1=CC=NC=C1 H11399 [2,0,0,0,0,0|2,0,0]=4 411 B11R1.13 CCOC1=CC=CC(F)=C1F 67904 [1,1,0,0,0,0|1,1,0]=4 412 B11R1.13 N#CCC1=CC=CC(Cl)=C1Br 95681 [1,1,0,0,0,0|0,0,2]=4 413 B11R1.13 N#CCC1=CC=CC(Cl)=C1Cl 22045 [1,1,0,0,0,0|0,0,2]=4 414 B11R1.13 N#CCC1=CC=CC(Cl)=C1F 83816 [1,1,0,0,0,0|0,0,2]=4 415 B11R1.13 OCCC1=CC=CC(Cl)=C1Cl CL8843 [1,1,0,0,0,0|1,0,0]=3 416 B11R1.23 CCC(=O)C1=CC(C)=CC=C1 29743 [1,1,0,0,0,0|1,0,1]=4 417 B11R1.23 CCC(=O)C1=CC(N)=CC=C1 C10213 [1,1,0,0,0,0|1,0,1]=4 418 B11R1.23 CCC(=O)C1=CC(O)=CC=C1 77999 [1,1,0,0,0,0|1,0,1]=4 419 B11R1.23 CCC(=O)C1=CC=CC(Br)=C1 75782 [1,1,0,0,0,0|0,1,1]=4 420 B11R1.23 CCC(=O)C1=CC=CC(Cl)=C1 D70670 [1,1,0,0,0,0|0,0,1]=3 421 B11R1.23 CCC(=O)C1=CC=CC(F)=C1 28848 [1,1,0,0,0,0|0,1,1]=4 422 B11R1.23 CNC(=O)C1=CC(Cl)=NC=C1 D97300 [1,1,0,0,0,0|1,0,1]=4 423 B11R1.23 CNC(=O)C1=CC(N)=CC=C1 51950 [1,1,0,0,0,0|1,0,1]=4 424 B11R1.23 CNC(=O)C1=CC(O)=CC=C1 AB7323 [1,1,0,0,0,0|1,0,1]=4 425 B11R1.23 CNC(=O)C1=CC=CC(Br)=C1 N10158 [1,1,0,0,0,0|0,1,1]=4 426 B11R1.23 CNC(=O)C1=CC=CC(Cl)=N1 D83456 [1,1,0,0,0,0|1,0,1]=4 427 B11R1.23 CNC(=O)C1=CC=CC(I)=C1 D83084 [1,1,0,0,0,0|0,1,1]=4 428 B11R1.23 CNC(=O)C1=NC=CC(Cl)=C1 CL0248 [1,1,0,0,0,0|1,0,1]=4 429 B11R1.23 CNC(=O)C1=NC=CC(Cl)=C1 F15257 [1,1,0,0,0,0|1,0,1]=4 430 B11R1.23 COC(=O)C1=CC=CC(Cl)=C1 F14862 [1,1,0,0,0,0|1,0,1]=4 431 B11R1.23 NCC(=O)C1=CC=CC(Br)=C1 71158 [1,1,0,0,0,0|0,1,1]=4 432 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 VT1055 [1,1,0,0,0,0|0,0,0]=2 433 B11R1.23 NC[C@H](O)C1=CC=CC(F)=C1 F30607 [1,1,0,0,0,0|0,1,0]=3 434 B11R1.23 NNC(=O)C1=CC=CC(Cl)=C1 74895 [1,1,0,0,0,0|1,0,1]=4 435 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 Y10325 [1,1,0,0,0,0|1,1,0]=4 436 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 F14498 [1,1,0,0,0,0|1,0,0]=3 437 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 Y10769 [1,1,0,0,0,0|1,0,0]=3 438 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 Y10906 [1,1,0,0,0,0|1,1,0]=4 439 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 57570 [1,1,0,0,0,0|1,0,1]=4 440 B11R1.23 O=C(CCl)C1=CC=CC(Cl)=C1 34124 [1,1,0,0,0,0|1,0,1]=4 441 B11R1.23 OC[C@H](O)C1=CC=CC(Cl)=C1 FD1214 [1,1,0,0,0,0|1,0,0]=3 442 B11R1.34 CCNC1=CC(Cl)=CC(Cl)=C1 AB1380 [1,1,0,0,0,0|1,0,0]=3 443 B11R1.34 CCOC1=CC(Br)=CC(F)=C1 31913 [1,1,0,0,0,0|1,1,0]=4 444 B11R1.34 N#CCC1=CC(Cl)=CC(Cl)=C1 CL8767 [1,1,0,0,0,0|0,0,2]=4 445 B11R1.34 N#CCC1=CC(Cl)=CC(F)=C1 CL8773 [1,1,0,0,0,0|0,0,2]=4 446 B11R1.34 NCCC1=CC(Cl)=CC(Cl)=C1 36526 [1,1,0,0,0,0|0,0,0]=2 447 B11R1.34 NCCC1=CC(F)=CC(F)=C1 F20077 [1,1,0,0,0,0|0,1,0]=3 448 B11R1.34 NNCC1=CC(F)=CC(F)=C1 O10069 [1,1,0,0,0,0|1,1,0]=4 449 B11R1.157 CC(=O)CC1=CC=CC(Br)=C1 CL8856 [1,1,0,0,0,0|0,1,1]=4 450 B11R1.157 CC(=O)CC1=CC=CC(Cl)=C1 O10275 [1,1,0,0,0,0|0,0,1]=3 451 B11R1.157 CC(=O)CC1=CC=CC(F)=C1 F21360 [1,1,0,0,0,0|0,1,1]=4 452 B11R1.157 CC(=O)NC1=CC=CC(Cl)=C1 D84622 [1,1,0,0,0,0|1,0,1]=4 453 B11R1.157 CC(C)NC1=CC=CC(F)=C1 AB3774 [1,1,0,0,0,0|1,1,0]=4 454 B11R1.157 CC(C)OC1=CC(N)=CC=C1 F17045 [1,1,0,0,0,0|2,0,0]=4 455 B11R1.157 CC(C)OC1=CC=CC(Br)=C1 F17568 [1,1,0,0,0,0|1,1,0]=4 456 B11R1.157 CC1=CC=CC(OC(C)C)=C1 W15987 [1,1,0,0,0,0|2,0,0]=4 457 B11R1.157 CN(C)CC1=CC(N)=CC=C1 71047 [1,1,0,0,0,0|1,0,0]=3 458 B11R1.157 CN(C)CC1=CC=CC(Br)=C1 O10271 [1,1,0,0,0,0|0,1,0]=3 459 B11R1.157 N=C(N)NC1=CC=CC(Cl)=C1 77822 [1,1,0,0,0,0|1,0,1]=4 460 B11R1.157 NC(=O)CC1=CC=CC(Br)=C1 D95102 [1,1,0,0,0,0|0,1,1]=4 461 B11R1.157 NC(=S)NC1=CC=CC(Cl)=C1 D89545 [1,1,0,0,0,0|1,0,1]=4 462 B11R1.157 O=C(O)CC1=CC=CC(Cl)=C1 67684 [1,1,0,0,0,0|1,0,1]=4 463 B11R1.182 CC1=CC(CCO)=C(C)C=C1 CK1129 [1,1,0,0,0,0|2,0,0]=4 464 B11R1.182 CCNC1=C(Cl)C=CC(Cl)=C1 AB1377 [1,1,0,0,0,0|1,0,0]=3 465 B11R1.182 CCOC1=C(C)C=CC(Br)=C1 N10217 [1,1,0,0,0,0|1,1,0]=4 466 B11R1.182 CCOC1=C(Cl)C=CC(Br)=C1 34038 [1,1,0,0,0,0|1,1,0]=4 467 B11R1.182 CCOC1=C(F)C=CC(Cl)=C1 76262 [1,1,0,0,0,0|1,0,0]=3 468 B11R1.182 CCOC1=C(O)C=CC(Br)=C1 W18481 [1,1,0,0,0,0|1,1,0]=4 469 B11R1.182 CNCC1=C(O)C=CC(Br)=C1 32558 [1,1,0,0,0,0|0,1,0]=3 470 B11R1.182 COCC1=C(O)C=CC(F)=C1 D80657 [1,1,0,0,0,0|1,1,0]=4 471 B11R1.182 N#CCC1=C(Br)C=CC(Cl)=C1 35719 [1,1,0,0,0,0|0,0,2]=4 472 B11R1.182 N#CCC1=C(Cl)C=CC(Cl)=C1 67679 [1,1,0,0,0,0|0,0,2]=4 473 B11R1.182 N#CCC1=C(F)C=CC(Cl)=C1 CK1019 [1,1,0,0,0,0|0,0,2]=4 474 B11R1.182 NC1=CC(CCO)=C(N)C=C1 26212 [1,1,0,0,0,0|2,0,0]=4 475 B11R1.182 NCCC1=C(Cl)C=CC(Cl)=C1 CK2437 [1,1,0,0,0,0|0,0,0]=2 476 B11R1.182 NNCC1=C(F)C=CC(Cl)=C1 O10126 [1,1,0,0,0,0|1,0,0]=3 477 B11R1.182 OCCC1=C(Cl)C=CC(Cl)=C1 CK1134 [1,1,0,0,0,0|1,0,0]=3 478 B11R1.189 CCNC1=CC=CC(OC)=C1 D96049 [1,1,0,0,0,0|2,0,0]=4 479 B11R1.189 CCOC1=CC(C#N)=CC=C1 D95712 [1,1,0,0,0,0|2,0,0]=4 480 B11R1.189 CCOC1=CC=CC(C=O)=C1 34604 [1,1,0,0,0,0|2,0,0]=4 481 B11R1.189 CCOC1=CC=CC(CBr)=C1 80226 [1,1,0,0,0,0|1,1,0]=4 482 B11R1.189 CNCC1=CC=CC(OC)=C1 CL9414 [1,1,0,0,0,0|1,0,0]=3 483 B11R1.189 COC1=CC(CCN)=CC=C1 F14686 [1,1,0,0,0,0|1,0,0]=3 484 B11R1.189 COC1=CC(CCO)=CC=C1 CK2455 [1,1,0,0,0,0|2,0,0]=4 485 B11R1.189 COC1=CC(CNN)=CC=C1 37013 [1,1,0,0,0,0|2,0,0]=4 486 B11R1.189 COC1=CC=CC(CCBr)=C1 A50690 [1,1,0,0,0,0|2,0,0]=4 487 B11R1.189 COC1=CC=CC(CON)=C1 BL009659 [1,1,0,0,0,0|2,0,0]=4 488 B11R1.192 CC1=C(C)C=C(CCN)C=C1 N12030 [1,1,0,0,0,0|1,0,0]=3 489 B11R1.192 CCCC1=CC(O)=C(O)C=C1 D80321 [1,1,0,0,0,0|1,0,0]=3 490 B11R1.192 CCOC1=CC(C)=C(Br)C=C1 D82407 [1,1,0,0,0,0|2,0,0]=4 491 B11R1.192 CCOC1=CC(Cl)=C(Br)C=C1 36384 [1,1,0,0,0,0|1,0,0]=3 492 B11R1.192 CCOC1=CC(F)=C(Br)C=C1 C71291 [1,1,0,0,0,0|1,1,0]=4 493 B11R1.192 CNCC1=CC(C)=C(C)C=C1 32560 [1,1,0,0,0,0|1,0,0]=3 494 B11R1.192 CNCC1=CC(Cl)=C(Cl)C=C1 35819 [1,1,0,0,0,0|0,0,0]=2 495 B11R1.192 COCC1=CC(F)=C(Br)C=C1 CK1208 [1,1,0,0,0,0|1,1,0]=4 496 B11R1.192 FC1=C(Cl)C=C(CCBr)C=C1 CL8859 [1,1,0,0,0,0|1,0,0]=3 497 B11R1.192 FC1=C(F)C=C(CCBr)C=C1 CL9053 [1,1,0,0,0,0|1,1,0]=4 498 B11R1.192 N#CCC1=CC(Cl)=C(Cl)C=C1 D77685 [1,1,0,0,0,0|0,0,2]=4 499 B11R1.192 N#CCC1=CC(Cl)=C(F)C=C1 22090 [1,1,0,0,0,0|0,0,2]=4 500 B11R1.192 NCCC1=CC(Cl)=C(Cl)C=C1 28812 [1,1,0,0,0,0|0,0,0]=2 501 B11R1.192 NCCC1=CC(F)=C(F)C=C1 CL9555 [1,1,0,0,0,0|0,1,0]=3 502 B11R1.192 NCCC1=CC(O)=C(O)C=C1 F10519 [1,1,0,0,0,0|1,0,0]=3 503 B11R1.192 OCCC1=CC(Cl)=C(Cl)C=C1 CK2456 [1,1,0,0,0,0|1,0,0]=3 504 B11R1.192 OCCC1=CC(Cl)=C(F)C=C1 56097 [1,1,0,0,0,0|1,0,0]=3 505 B11R1.192 OCCC1=CC(F)=C(Cl)C=C1 95695 [1,1,0,0,0,0|1,1,0]=4 506 B11R1.1 BrCCCC1=CC=C(Br)C=C1 AB12305 [1,1,0,0,0,0|2,0,0]=4 507 B11R1.1 CCCCC1=CC=C(Br)C=C1 28617 [1,1,0,0,0,0|1,0,0]=3 508 B11R1.1 CCCCC1=CC=C(Cl)C=C1 D88987 [1,1,0,0,0,0|1,0,0]=3 509 B11R1.1 CCCCC1=CC=C(I)C=C1 O10393 [1,1,0,0,0,0|1,0,0]=3 510 B11R1.1 CCCCC1=CC=C(O)C=C1 D88733 [1,1,0,0,0,0|1,0,0]=3 511 B11R1.1 CCCC[N+]1=CC=C(C)C=C1 A51103 [1,1,0,0,0,0|2,0,0]=4 512 B11R1.1 CCCC[N+]1=CC=C(C)C=C1 C93467 [1,1,0,0,0,0|2,0,0]=4 513 B11R1.1 CCCC[N+]1=CC=C(C)C=C1 C93476 [1,1,0,0,0,0|2,0,0]=4 514 B11R1.1 CCCC[N+]1=CC=C(C)C=C1 S11229 [1,1,0,0,0,0|2,0,0]=4 515 B11R1.1 CCCOC1=CC=C(Br)C=C1 AC8402 [1,1,0,0,0,0|2,0,0]=4 516 B11R1.1 CCCOC1=CC=C(O)C=C1 D70163 [1,1,0,0,0,0|2,0,0]=4 517 B11R1.1 CCNCC1=CC=C(Br)C=C1 30536 [1,1,0,0,0,0|2,0,0]=4 518 B11R1.1 CCNCC1=CC=C(Cl)C=C1 30537 [1,1,0,0,0,0|2,0,0]=4 519 B11R1.1 CCNCC1=CC=C(F)C=C1 31187 [1,1,0,0,0,0|2,0,0]=4 520 B11R1.1 CCOCC1=CC=C(F)C=C1 I12057 [1,1,0,0,0,0|2,0,0]=4 521 B11R1.1 CNCCC1=CC=C(O)C=C1 W16881 [1,1,0,0,0,0|0,0,0]=2 522 B11R1.1 COCCC1=CC=C(O)C=C1 F11255 [1,1,0,0,0,0|1,0,0]=3 523 B11R1.1 COCOC1=CC=C(Br)C=C1 29154 [1,1,0,0,0,0|2,0,0]=4 524 B11R1.1 COCOC1=CC=C(O)C=C1 D93617 [1,1,0,0,0,0|2,0,0]=4 525 B11R1.1 CONCC1=CC=C(Cl)C=C1 D80709 [1,1,0,0,0,0|2,0,0]=4 526 B11R1.1 ClCCCC1=CC=C(Br)C=C1 C13894 [1,1,0,0,0,0|2,0,0]=4 527 B11R1.1 ClCCCC1=CC=C(Cl)C=C1 S10875 [1,1,0,0,0,0|2,0,0]=4 528 B11R1.1 N#CCCC1=CC=C(Cl)C=C1 F16130 [1,1,0,0,0,0|2,0,0]=4 529 B11R1.1 NCCCC1=CC=C(Cl)C=C1 F20044 [1,1,0,0,0,0|2,0,0]=4 530 B11R1.1 O=CCCC1=CC=C(F)C=C1 CL8850 [1,1,0,0,0,0|2,0,0]=4 531 B11R1.1 OCCCC1=CC=C(Br)C=C1 AB3206 [1,1,0,0,0,0|2,0,0]=4 532 B11R1.1 OCCCC1=CC=C(Cl)C=C1 W10512 [1,1,0,0,0,0|2,0,0]=4 533 B11R1.1 OCCCC1=CC=C(F)C=C1 AB3825 [1,1,0,0,0,0|2,0,0]=4 534 B11R1.1 OCCCC1=CC=C(O)C=C1 FD10610 [1,1,0,0,0,0|2,0,0]=4 535 B11R1.16 C=CC[C@H](O)C1=CC=CC=C1 D92112 [1,1,0,0,0,0|1,0,1]=4 536 B11R1.16 CCC[C@H](O)C1=CC=CC=C1 D81704 [1,1,0,0,0,0|1,0,0]=3 537 B11R1.16 ClCC[C@H](Br)C1=CC=CC=C1 AB10338 [1,1,0,0,0,0|2,0,0]=4 538 B11R1.16 NCC[C@H](O)C1=CC=CC=C1 20164 [1,1,0,0,0,0|2,0,0]=4 539 B11R1.16 NCC[C@H](O)C1=CC=CC=C1 AB10355 [1,1,0,0,0,0|2,0,0]=4 540 B11R1.16 NCC[C@H](O)C1=CC=CC=C1 D83101 [1,1,0,0,0,0|2,0,0]=4 541 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 65209 [1,1,0,0,0,0|2,0,0]=4 542 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 65210 [1,1,0,0,0,0|2,0,0]=4 543 B11R1.16 OCC[C@H](O)C1=CC=CC=C1 D80419 [1,1,0,0,0,0|2,0,0]=4 544 B11R1.16 O[C@@H](CCCl)C1=CC=CC=C1 58104 [1,1,0,0,0,0|2,0,0]=4 545 B11R1.16 O[C@@H](CCCl)C1=CC=CC=C1 58184 [1,1,0,0,0,0|2,0,0]=4 546 B11R1.16 O[C@@H](CCCl)C1=CC=CC=C1 58185 [1,1,0,0,0,0|2,0,0]=4 547 B11R1.17 CCCCC1=C(N)C=CC=C1 D88855 [1,1,0,0,0,0|1,0,0]=3 548 B11R1.17 CCCOC1=C(N)C=CC=C1 31375 [1,1,0,0,0,0|2,0,0]=4 549 B11R1.17 CCCOC1=C(O)C=CC=C1 D95014 [1,1,0,0,0,0|2,0,0]=4 550 B11R1.17 CNCCC1=C(F)C=CC=C1 30544 [1,1,0,0,0,0|0,0,0]=2 551 B11R1.17 N#CCCC1=C(Cl)C=CC=C1 D84144 [1,1,0,0,0,0|2,0,0]=4 552 B11R1.17 O=CCCC1=C(F)C=CC=C1 CL8848 [1,1,0,0,0,0|2,0,0]=4 553 B11R1.17 OCCCC1=C(Br)C=CC=C1 AB3204 [1,1,0,0,0,0|2,0,0]=4 554 B11R1.28 BrCCCCC1=CC=CC=C1 70737 [1,1,0,0,0,0|1,0,0]=3 555 B11R1.28 BrCCCOC1=CC=CC=C1 73704 [1,1,0,0,0,0|2,0,0]=4 556 B11R1.28 BrCCOCC1=CC=CC=C1 29418 [1,1,0,0,0,0|2,0,0]=4 557 B11R1.28 C#CCOCC1=CC=CC=C1 H11649 [1,1,0,0,0,0|1,0,1]=4 558 B11R1.28 C=CCNCC1=CC=CC=C1 51314 [1,1,0,0,0,0|1,0,1]=4 559 B11R1.28 C=CCNCC1=CC=CC=C1 51315 [1,1,0,0,0,0|1,0,1]=4 560 B11R1.28 C=CCOCC1=CC=CC=C1 CS1050 [1,1,0,0,0,0|1,0,1]=4 561 B11R1.28 CCCC#CC1=CC=CC=C1 D97343 [1,1,0,0,0,0|1,0,1]=4 562 B11R1.28 CCCCCC1=CC=CC=C1 D88261 [1,1,0,0,0,0|1,0,0]=3 563 B11R1.28 CCCCOC1=NC=CC=C1 D88876 [1,1,0,0,0,0|2,0,0]=4 564 B11R1.28 CCCNCC1=CC=CC=C1 C78030 [1,1,0,0,0,0|1,0,0]=3 565 B11R1.28 CCNCCC1=CC=CC=C1 F20148 [1,1,0,0,0,0|0,0,0]=2 566 B11R1.28 CNCCCC1=CC=CC=C1 AR1442 [1,1,0,0,0,0|0,0,0]=2 567 B11R1.28 CNC\C=C\C1=CC=CC=C1 A11412 [1,1,0,0,0,0|0,0,1]=3 568 B11R1.28 COCCNC1=NC=CC=C1 D94270 [1,1,0,0,0,0|2,0,0]=4 569 B11R1.28 COCCSC1=CC=CC=C1 W18561 [1,1,0,0,0,0|1,0,0]=3 570 B11R1.28 ClCCCCC1=CC=CC=C1 D92122 [1,1,0,0,0,0|1,0,0]=3 571 B11R1.28 ClCCCCC1=CC=NC=C1 56205 [1,1,0,0,0,0|2,0,0]=4 572 B11R1.28 ClCCNCC1=CC=CC=C1 AB2649 [1,1,0,0,0,0|2,0,0]=4 573 B11R1.28 N#CCCNC1=CC=CC=C1 E70307 [1,1,0,0,0,0|2,0,0]=4 574 B11R1.28 N#CCCOC1=CC=CC=C1 AB7705 [1,1,0,0,0,0|2,0,0]=4 575 B11R1.28 N#CCOCC1=CC=CC=C1 AC3964 [1,1,0,0,0,0|2,0,0]=4 576 B11R1.28 NCCCCC1=CC=CC=C1 D88381 [1,1,0,0,0,0|1,0,0]=3 577 B11R1.28 NCCNCC1=CC=CC=C1 20546 [1,1,0,0,0,0|2,0,0]=4 578 B11R1.28 NCCOCC1=CC=CC=C1 CL4561 [1,1,0,0,0,0|2,0,0]=4 579 B11R1.28 NCCOCC1=CC=CC=C1 CL4570 [1,1,0,0,0,0|2,0,0]=4 580 B11R1.28 O=C=NCCC1=CC=CC=C1 D92144 [1,1,0,0,0,0|0,0,2]=4 581 B11R1.28 O=CCCCC1=CC=CC=C1 D71263 [1,1,0,0,0,0|1,0,1]=4 582 B11R1.28 O=CCOCC1=CC=CC=C1 35646 [1,1,0,0,0,0|2,0,0]=4 583 B11R1.28 OCCCCC1=CC=CC=C1 70774 [1,1,0,0,0,0|1,0,0]=3 584 B11R1.28 OCCCCC1=CC=NC=C1 30651 [1,1,0,0,0,0|2,0,0]=4 585 B11R1.28 OCCCCC1=CN=CC=C1 32381 [1,1,0,0,0,0|2,0,0]=4 586 B11R1.28 OCCCNC1=CC=CC=C1 D88515 [1,1,0,0,0,0|2,0,0]=4 587 B11R1.28 OCCCOC1=CC=CC=C1 A50719 [1,1,0,0,0,0|2,0,0]=4 588 B11R1.28 OCCNCC1=CC=CC=C1 AC7917 [1,1,0,0,0,0|2,0,0]=4 589 B11R1.28 OCCOCC1=CC=CC=C1 P17494 [1,1,0,0,0,0|2,0,0]=4 590 B11R1.28 S=C=NCCC1=CC=CC=C1 D92051 [1,1,0,0,0,0|0,0,2]=4 591 B11R1.40 CCC(=O)CC1=CC=CC=C1 75226 [1,1,0,0,0,0|1,0,1]=4 592 B11R1.40 CC[C@H](O)CC1=CC=CC=C1 D94692 [1,1,0,0,0,0|1,0,0]=3 593 B11R1.40 CN[C@@H](C)CC1=NC=CC=C1 D82185 [1,1,0,0,0,0|1,0,0]=3 594 B11R1.40 COC(=O)CC1=CC=CC=C1 D77850 [1,1,0,0,0,0|1,0,1]=4 595 B11R1.40 C[C@H](CO)CC1=CC=CC=C1 D86956 [1,1,0,0,0,0|2,0,0]=4 596 B11R1.40 N=C(CC1=CC=CC=C1)NO S10392 [1,1,0,0,0,0|1,0,1]=4 597 B11R1.40 NC[C@@H](O)CC1=CC=CC=C1 AR3947 [1,1,0,0,0,0|2,0,0]=4 598 B11R1.40 NNC(=O)CC1=CC=CC=C1 AC1644 [1,1,0,0,0,0|1,0,1]=4 599 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 26243 [1,1,0,0,0,0|2,0,0]=4 600 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 26245 [1,1,0,0,0,0|2,0,0]=4 601 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 F10667 [1,1,0,0,0,0|2,0,0]=4 602 B11R1.91 CC(=N)SCC1=CC=CC=C1 77568 [1,1,0,0,0,0|2,0,0]=4 603 B11R1.91 CC(=O)CCC1=CC=CC=C1 P17497 [1,1,0,0,0,0|1,0,0]=3 604 B11R1.91 CC(=O)COC1=CC=CC=C1 34157 [1,1,0,0,0,0|2,0,0]=4 605 B11R1.91 CC(=O)NCC1=CC=CC=C1 D70359 [1,1,0,0,0,0|2,0,0]=4 606 B11R1.91 CC(C)NCC1=CC=CC=C1 C11247 [1,1,0,0,0,0|2,0,0]=4 607 B11R1.91 CN(C)CCC1=CC=CC=C1 F12470 [1,1,0,0,0,0|0,0,0]=2 608 B11R1.91 CN(C)\N=C\C1=CC=CC=C1 D95776 [1,1,0,0,0,0|1,0,1]=4 609 B11R1.91 C[C@H](Cl)COC1=CC=CC=C1 D91900 [1,1,0,0,0,0|2,0,0]=4 610 B11R1.91 C[C@H](O)CCC1=CC=CC=C1 28916 [1,1,0,0,0,0|1,0,0]=3 611 B11R1.91 C[C@H](O)COC1=CC=CC=C1 D77637 [1,1,0,0,0,0|2,0,0]=4 612 B11R1.91 N=C(N)CCC1=CC=CC=C1 C15393 [1,1,0,0,0,0|2,0,0]=4 613 B11R1.91 NC(=O)CCC1=CC=CC=C1 S11404 [1,1,0,0,0,0|2,0,0]=4 614 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 78923 [1,1,0,0,0,0|2,0,0]=4 615 B11R1.91 O=C(O)CCC1=CC=CC=C1 65006 [1,1,0,0,0,0|2,0,0]=4 616 B11R1.91 OB(O)CCC1=CC=CC=C1 28933 [1,1,0,0,0,0|2,0,0]=4 617 B13R1.147 N[C@@H](CC(=O)O)C1=CC=CC(Cl)=C1 58170 [0,2,0,0,0,0|2,0,0]=4 618 B13R1.147 O=C(O)C[C@H](O)C1=CC=CC(Cl)=C1 D80788 [0,2,0,0,0,0|2,0,0]=4 619 B13R1.466 CNCC(=O)C1=CC(O)=C(O)C=C1 D88399 [0,2,0,0,0,0|1,0,1]=4 620 B13R1.466 CNC[C@H](O)C1=CC(O)=C(O)C=C1 D88221 [0,2,0,0,0,0|1,0,0]=3 621 B13R1.466 CNC[C@H](O)C1=CC(O)=C(O)C=C1 D88223 [0,2,0,0,0,0|1,0,0]=3 622 B13R1.16 CCCCOC1=CC=CC(F)=C1F 36600 [0,2,0,0,0,0|1,1,0]=4 623 B13R1.40 COC(=O)CC1=CC=CC(Cl)=C1Br 73798 [0,2,0,0,0,0|1,0,1]=4 624 B13R1.40 COC(=O)CC1=CC=CC(Cl)=C1Cl 29949 [0,2,0,0,0,0|1,0,1]=4 625 B13R1.150 O=C(O)CCC1=CC=CC(Cl)=C1Cl F52816 [0,2,0,0,0,0|2,0,0]=4 626 B13R1.150 O=C(O)CCC1=CC=CC(Cl)=C1F 84076 [0,2,0,0,0,0|2,0,0]=4 627 B13R1.15 COC(=O)CCC1=CC=CC(Br)=C1 AB7481 [0,2,0,0,0,0|1,1,0]=4 628 B13R1.15 COC(=O)CCC1=CC=CC(Cl)=C1 AB7499 [0,2,0,0,0,0|1,0,0]=3 629 B13R1.20 CCOC(=O)CC1=CC=CC(Cl)=C1 60913 [0,2,0,0,0,0|1,0,1]=4 630 B13R1.55 CCCCCC1=CC(F)=CC(F)=C1 36003 [0,2,0,0,0,0|1,1,0]=4 631 B13R1.55 CCCCCC1=CC(O)=CC(O)=C1 FD7124 [0,2,0,0,0,0|2,0,0]=4 632 B13R1.148 N[C@@H](CC1=CC=CC(Cl)=C1)C(=O)O 39323 [0,2,0,0,0,0|2,0,0]=4 633 B13R1.148 N[C@@H](CC1=CC=CC(Cl)=C1)C(=O)O 58264 [0,2,0,0,0,0|2,0,0]=4 634 B13R1.148 N[C@@H](CC1=CC=CC(Cl)=C1)C(=O)O 76518 [0,2,0,0,0,0|2,0,0]=4 635 B13R1.2872 COC(=O)CC1=C(Br)C=CC(Cl)=C1 CL9452 [0,2,0,0,0,0|1,0,1]=4 636 B13R1.2879 CNC(=O)NC1=CC(Cl)=C(Cl)C=C1 A10871 [0,2,0,0,0,0|1,0,1]=4 637 B13R1.2879 COC(=O)CC1=CC(Cl)=C(Cl)C=C1 A51104 [0,2,0,0,0,0|1,0,1]=4 638 B13R1.3420 O=C(O)CCC1=CC(Cl)=CC(Cl)=C1 60378 [0,2,0,0,0,0|2,0,0]=4 639 B13R1.511 O=C(O)CCC1=CC(Cl)=C(Cl)C=C1 Y10268 [0,2,0,0,0,0|2,0,0]=4 640 B13R1.893 O=C(O)CCC1=C(Cl)C=CC(Cl)=C1 F52818 [0,2,0,0,0,0|2,0,0]=4 641 B11R1.81 CNCC1=C(Cl)C=C(Cl)C=C1 29201 [0,0,1,1,0,0|1,0,1]=4 642 B11R1.81 CNCC1=C(Cl)C=C(Cl)C=C1 FD7352 [0,0,1,1,0,0|1,0,1]=4 643 B11R2.35 BrC1=CC(C2CC2)=CC=C1 BL003565 [1,0,0,1,0,0|0,1,0]=3 644 B11R2.35 BrC1=NC(C2CC2)=CC=C1 AT21506 [1,0,0,1,0,0|1,1,0]=4 645 B11R2.35 ClC1=CC([C@@H]2CO2)=CC=C1 58250 [1,0,0,1,0,0|1,0,0]=3 646 B11R2.36 BrC1=CC2=C(C=C1)CCN2 24349 [1,0,0,1,0,0|1,1,0]=4 647 B11R2.36 BrC1=CC2=C(C=C1)CCO2 C10009 [1,0,0,1,0,0|1,1,0]=4 648 B11R2.36 BrC1=CC2=C(C=C1)CNC2 54820 [1,0,0,1,0,0|0,1,0]=3 649 B11R2.36 BrC1=CC2=C(C=C1)CNC2 AB3161 [1,0,0,1,0,0|0,1,0]=3 650 B11R2.36 BrC1=CC2=C(C=C1)NCC2 80993 [1,0,0,1,0,0|0,1,0]=3 651 B11R2.36 BrC1=CC2=C(C=C1)OCC2 56872 [1,0,0,1,0,0|1,1,0]=4 652 B11R2.36 BrC1=CN=C2NCCC2=C1 67468 [1,0,0,1,0,0|1,1,0]=4 653 B11R2.36 BrC1=CN=C2NCCC2=C1 P15409 [1,0,0,1,0,0|1,1,0]=4 654 B11R2.36 CC1=CC2=C(C=C1)CCN2 W10106 [1,0,0,1,0,0|2,0,0]=4 655 B11R2.36 CC1=CC2=C(C=C1)NCC2 63434 [1,0,0,1,0,0|1,0,0]=3 656 B11R2.36 ClC1=CC2=C(C=C1)CCN2 83459 [1,0,0,1,0,0|1,0,0]=3 657 B11R2.36 ClC1=CC2=C(C=C1)CNC2 SC1305 [1,0,0,1,0,0|0,0,0]=2 658 B11R2.36 ClC1=CC2=C(C=C1)NC=C2 28165 [1,0,0,1,0,0|0,0,2]=4 659 B11R2.36 ClC1=CC2=C(C=C1)NC=N2 58198 [1,0,0,1,0,0|1,0,1]=4 660 B11R2.36 ClC1=CC2=C(C=C1)NCC2 33885 [1,0,0,1,0,0|0,0,0]=2 661 B11R2.36 ClC1=CC2=C(C=C1)NN=C2 52860 [1,0,0,1,0,0|1,0,1]=4 662 B11R2.36 ClC1=CC2=C(C=C1)NN=N2 A11419 [1,0,0,1,0,0|2,0,0]=4 663 B11R2.36 ClC1=CC2=C(C=C1)OCO2 58038 [1,0,0,1,0,0|2,0,0]=4 664 B11R2.36 ClC1=NC2=C(C=C1)CCC2 57898 [1,0,0,1,0,0|1,0,0]=3 665 B11R2.36 FC1=CC2=C(C=C1)CNC2 68673 [1,0,0,1,0,0|0,1,0]=3 666 B11R2.36 FC1=CC2=C(C=C1)NCC2 FD7362 [1,0,0,1,0,0|0,1,0]=3 667 B11R2.36 FC1=CC2=C(C=C1)OCC2 88995 [1,0,0,1,0,0|1,1,0]=4 668 B11R2.36 IC1=CC2=C(C=C1)CCN2 78383 [1,0,0,1,0,0|1,1,0]=4 669 B11R2.36 IC1=CC2=C(C=C1)OCC2 D92867 [1,0,0,1,0,0|1,1,0]=4 670 B11R2.36 IC1=CN=C2CCCC2=C1 D82276 [1,0,0,1,0,0|1,1,0]=4 671 B11R2.36 NC1=CC2=C(C=C1)CCC2 74038 [1,0,0,1,0,0|1,0,0]=3 672 B11R2.36 NC1=CC2=C(C=C1)COC2 26191 [1,0,0,1,0,0|2,0,0]=4 673 B11R2.36 NC1=CC2=C(C=C1)OCC2 Y10191 [1,0,0,1,0,0|2,0,0]=4 674 B11R2.36 OC1=CC2=C(C=C1)CCC2 A10309 [1,0,0,1,0,0|1,0,0]=3 675 B11R2.36 OC1=CC2=C(C=C1)NCC2 F15641 [1,0,0,1,0,0|1,0,0]=3 676 B11R2.106 BrC1=C2CCNC2=CC=C1 24296 [1,0,0,1,0,0|1,1,0]=4 677 B11R2.106 BrC1=C2CCNC2=CC=C1 BL008582 [1,0,0,1,0,0|1,1,0]=4 678 B11R2.106 BrC1=C2CNCC2=CC=C1 20840 [1,0,0,1,0,0|0,1,0]=3 679 B11R2.106 BrC1=C2CNCC2=CC=C1 54657 [1,0,0,1,0,0|0,1,0]=3 680 B11R2.106 BrC1=C2COCC2=CC=C1 31921 [1,0,0,1,0,0|1,1,0]=4 681 B11R2.106 BrC1=C2NCCC2=CC=C1 F15646 [1,0,0,1,0,0|0,1,0]=3 682 B11R2.106 BrC1=C2OCCC2=CC=C1 26270 [1,0,0,1,0,0|1,1,0]=4 683 B11R2.106 CC1=CC=CC2=C1CCN2 28584 [1,0,0,1,0,0|2,0,0]=4 684 B11R2.106 ClC1=C2CCNC2=CC=C1 33919 [1,0,0,1,0,0|1,0,0]=3 685 B11R2.106 ClC1=C2NC=CC2=CC=C1 28167 [1,0,0,1,0,0|0,0,2]=4 686 B11R2.106 ClC1=C2NC=NC2=CC=C1 CL3514 [1,0,0,1,0,0|1,0,1]=4 687 B11R2.106 ClC1=C2NN=CC2=CC=C1 BL000561 [1,0,0,1,0,0|1,0,1]=4 688 B11R2.106 ClC1=NC=NC2=C1CCC2 87017 [1,0,0,1,0,0|2,0,0]=4 689 B11R2.106 FC1=C2CCNC2=CC=C1 35695 [1,0,0,1,0,0|1,1,0]=4 690 B11R2.106 FC1=C2CNCC2=CC=C1 61210 [1,0,0,1,0,0|0,1,0]=3 691 B11R2.106 NC1=C2CCCC2=CC=C1 93741 [1,0,0,1,0,0|1,0,0]=3 692 B11R2.106 NC1=CC=CC2=C1CCO2 25623 [1,0,0,1,0,0|2,0,0]=4 693 B11R2.106 NC1=CC=CC2=C1CNC2 D79115 [1,0,0,1,0,0|1,0,0]=3 694 B11R2.106 NC1=CC=CC2=C1COC2 31679 [1,0,0,1,0,0|2,0,0]=4 695 B11R2.106 OC1=C2CCCC2=CC=C1 24536 [1,0,0,1,0,0|1,0,0]=3 696 B11R2.1 CN1C=CC2=C1C=CC=C2 F11257 [1,0,0,1,0,0|0,0,2]=4 697 B11R2.1 CN1C=NC2=C1C=CC=C2 F10497 [1,0,0,1,0,0|1,0,1]=4 698 B11R2.1 CN1N=NC2=C1C=CC=C2 S10077 [1,0,0,1,0,0|2,0,0]=4 699 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 36655 [1,0,0,1,0,0|2,0,0]=4 700 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 41002 [1,0,0,1,0,0|2,0,0]=4 701 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 67750 [1,0,0,1,0,0|2,0,0]=4 702 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 67775 [1,0,0,1,0,0|2,0,0]=4 703 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 67878 [1,0,0,1,0,0|2,0,0]=4 704 B11R2.1 O=C1CCC2=C1C=CC=C2 73679 [1,0,0,1,0,0|2,0,0]=4 705 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 I10213 [1,0,0,1,0,0|2,0,0]=4 706 B11R2.4 NC1CC1C2=CC=CC=C2 74589 [1,0,0,1,0,0|2,0,0]=4 707 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 D81815 [1,0,0,1,0,0|2,0,0]=4 708 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 FD9050 [1,0,0,1,0,0|2,0,0]=4 709 B11R2.20 C1=CC2=C(C=C1)CC=CC2 O10351 [1,0,0,1,0,0|1,0,1]=4 710 B11R2.20 C1=CC2=C(C=C1)CCC=C2 H10885 [1,0,0,1,0,0|1,0,1]=4 711 B11R2.20 C1=CC2=C(C=C1)CNCC2 66636 [1,0,0,1,0,0|0,0,0]=2 712 B11R2.20 C1=CC2=C(C=C1)CNCC2 66637 [1,0,0,1,0,0|0,0,0]=2 713 B11R2.20 C1=CC2=C(C=C1)CNNC2 31576 [1,0,0,1,0,0|1,0,0]=3 714 B11R2.20 C1=CC2=C(C=C1)COCC2 25404 [1,0,0,1,0,0|1,0,0]=3 715 B11R2.20 C1=CC2=C(C=C1)NCCC2 66632 [1,0,0,1,0,0|2,0,0]=4 716 B11R2.20 C1=CC2=C(C=C1)OCCC2 F13522 [1,0,0,1,0,0|2,0,0]=4 717 B11R2.20 C1=CC2=C(C=N1)CCCC2 67092 [1,0,0,1,0,0|2,0,0]=4 718 B11R2.20 C1=CN=C2CCCCC2=C1 66526 [1,0,0,1,0,0|2,0,0]=4 719 B11R2.20 C1=CN=C2CCNCC2=C1 SC2731 [1,0,0,1,0,0|1,0,0]=3 720 B11R2.20 C1=CN=C2CNCCC2=C1 37895 [1,0,0,1,0,0|1,0,0]=3 721 B11R2.238 C1=CC=C(NC2CC2)C=C1 D82826 [1,0,0,1,0,0|2,0,0]=4 722 B11R2.238 C1=CC=C(SC2CC2)C=C1 87296 [1,0,0,1,0,0|2,0,0]=4 723 B13R2.13 BrC1=CC(N2CCCC2)=CC=C1 23748 [0,1,0,1,0,0|1,1,0]=4 724 B13R2.13 BrC1=CC([C@@H]2CCCN2)=CC=C1 Y10806 [0,1,0,1,0,0|1,1,0]=4 725 B13R2.13 CC1=CC=CC([C@@H]2CCCN2)=C1 23209 [0,1,0,1,0,0|2,0,0]=4 726 B13R2.13 ClC1=CC(C2=NCCC2)=CC=C1 AB2776 [0,1,0,1,0,0|1,0,1]=4 727 B13R2.13 ClC1=CC([C@@H]2CCCN2)=CC=C1 24226 [0,1,0,1,0,0|1,0,0]=3 728 B13R2.13 FC1=CC([C@@H]2CCCN2)=CC=C1 31367 [0,1,0,1,0,0|1,1,0]=4 729 B13R2.13 FC1=CC([C@@H]2CCCN2)=CC=C1 32526 [0,1,0,1,0,0|1,1,0]=4 730 B13R2.13 FC1=CC([C@@H]2CCCN2)=CC=C1 N10477 [0,1,0,1,0,0|1,1,0]=4 731 B13R2.13 NC1=CC=CC(N2CCCC2)=C1 AC1700 [0,1,0,1,0,0|2,0,0]=4 732 B13R2.162 NC1=C2C[C@@H](O)CCC2=CC=C1 C12074 [0,1,0,1,0,0|2,0,0]=4 733 B13R2.162 NC1=CC2=C(C=C1)CCC[C@@H]2O 31461 [0,1,0,1,0,0|2,0,0]=4 734 B13R2.162 O=C1CCCC2=C1C=C(Cl)C=C2 52466 [0,1,0,1,0,0|1,0,1]=4 735 B13R2.342 O=C1CCCC2=C(Cl)C=CC=C12 I10912 [0,1,0,1,0,0|1,0,1]=4 736 B13R2.342 OC1=C2CCC[C@H](O)C2=CC=C1 D97759 [0,1,0,1,0,0|2,0,0]=4 737 B13R2.5324 N[C@H](C1=CC(Cl)=NC=C1)C2CC2 D83584 [0,1,0,1,0,0|2,0,0]=4 738 B13R2.5180 O=C1CCC2=C1C=CC(Cl)=C2Cl I10940 [0,1,0,1,0,0|2,0,0]=4 739 B13R2.3021 FC1=CC(OC2CNC2)=CC=C1 88514 [0,1,0,1,0,0|0,1,0]=3 740 B13R2.3729 ClC1=CC2=C(C=C1)CNCCN2 57774 [0,1,0,1,0,0|0,0,0]=2 741 B13R2.3729 FC1=CC2=C(C=C1)CNCCN2 61104 [0,1,0,1,0,0|0,1,0]=3 742 B13R2.5179 CN1CCNC2=C1C=CC(Br)=C2 O11534 [0,1,0,1,0,0|0,1,0]=3 743 B13R2.5179 CN1CCOC2=C1C=CC(Br)=C2 30277 [0,1,0,1,0,0|0,1,0]=3 744 B13R2.5179 O=C1CCCC2=C1C=CC(Cl)=C2 I10915 [0,1,0,1,0,0|1,0,1]=4 745 B13R2.5179 O=C1CCOC2=C1C=CC(Cl)=C2 35618 [0,1,0,1,0,0|2,0,0]=4 746 B13R2.5179 O=C1NCCC2=C1C=CC(Br)=C2 21522 [0,1,0,1,0,0|0,1,1]=4 747 B13R2.5179 O=C1NCCC2=C1C=CC(F)=C2 25410 [0,1,0,1,0,0|0,1,1]=4 748 B13R2.5179 O=C1NCCC2=C1C=CC(O)=C2 69896 [0,1,0,1,0,0|1,0,1]=4 749 B13R2.155 O=C1CCC2=C(C=C(Cl)C=C2)C1 24200 [0,1,0,1,0,0|1,0,1]=4 750 B13R2.11642 O=C1CCC2=CC(Cl)=CC(F)=C12 N11343 [0,1,0,1,0,0|2,0,0]=4 751 B13R2.3683 C[C@H]1CCC2=C(C=CC(F)=C2)N1 26211 [0,1,0,1,0,0|1,1,0]=4 752 B13R2.3683 O=C1CCC2=C(C=CC(Br)=C2)C1 29462 [0,1,0,1,0,0|1,1,0]=4 753 B13R2.3683 O=C1CCC2=C(C=CC(Cl)=C2)C1 I10916 [0,1,0,1,0,0|1,0,0]=3 754 B13R2.3683 O=C1CCC2=C(C=CC(O)=C2)C1 35609 [0,1,0,1,0,0|2,0,0]=4 755 B13R2.5151 O=C1CCC2=C(Br)C=CC(Cl)=C12 N11319 [0,1,0,1,0,0|2,0,0]=4 756 B13R2.57 COC1=CC2=C(C=C1)CNCC2 64310 [0,1,0,1,0,0|1,0,0]=3 757 B13R2.57 COC1=CC2=C(C=C1)CNCC2 64311 [0,1,0,1,0,0|1,0,0]=3 758 B13R2.57 N#CC1=CC2=C(C=C1)CNCC2 35120 [0,1,0,1,0,0|1,0,0]=3 759 B13R2.57 O=CC1=CC2=C(C=C1)CCCC2 N12349 [0,1,0,1,0,0|2,0,0]=4 760 B13R2.1613 O=CC1=C2CCCCC2=CC=C1 36390 [0,1,0,1,0,0|2,0,0]=4 761 B13R2.11634 O=C1CCC2=CC(Cl)=C(Cl)C=C12 23865 [0,1,0,1,0,0|2,0,0]=4 762 B9R1.7 CCCC1=CC=C(Br)S1 F17551 [1,0,0,0,1,0|1,1,0]=4 763 B9R1.7 CNCC1=CN=C(Cl)S1 36645 [1,0,0,0,1,0|2,0,0]=4 764 B9R1.7 NCCC1=CC=C(Br)S1 AC1431 [1,0,0,0,1,0|1,1,0]=4 765 B9R1.12 CCCCC1=CC=CO1 D88935 [1,0,0,0,1,0|2,0,0]=4 766 B9R1.12 CCCCC1=CC=CS1 F15458 [1,0,0,0,1,0|2,0,0]=4 767 B9R1.12 CCCCC1=CSC=C1 F10859 [1,0,0,0,1,0|2,0,0]=4