0 B12R1.286 C=CCC1=CC(OC)=C(O)C=C1 41869 [0,0,0,0,0,0|0,0,0]=0 1 B12R1.286 COC1=C(Br)C=CC(CC#N)=C1 63222 [0,0,0,0,0,0|2,0,1]=3 2 B12R1.286 COC1=C(C)C=CC(CC#N)=C1 67772 [0,0,0,0,0,0|2,0,1]=3 3 B12R1.286 COC1=C(F)C=CC(CC#N)=C1 CK2055 [0,0,0,0,0,0|2,0,1]=3 4 B12R1.286 COC1=C(O)C=CC(CCN)=C1 52803 [0,0,0,0,0,0|1,0,1]=2 5 B12R1.286 COC1=C(O)C=CC(CCO)=C1 D95086 [0,0,0,0,0,0|1,0,1]=2 6 B12R1.286 C\C=C\C1=CC(OC)=C(O)C=C1 42988 [0,0,0,0,0,0|0,0,2]=2 7 B11R1.189 C=CCC1=CC=CC(OC)=C1 AC1287 [1,0,0,0,0,0|0,0,0]=1 8 B11R1.189 CCNC1=CC=CC(OC)=C1 D96049 [1,0,0,0,0,0|1,0,2]=4 9 B11R1.189 CNCC1=CC=CC(OC)=C1 CL9414 [1,0,0,0,0,0|1,0,1]=3 10 B11R1.189 COC1=CC(CC#N)=CC=C1 75866 [1,0,0,0,0,0|1,0,1]=3 11 B11R1.189 COC1=CC(CCN)=CC=C1 F14686 [1,0,0,0,0,0|1,0,1]=3 12 B11R1.189 COC1=CC(CCO)=CC=C1 CK2455 [1,0,0,0,0,0|1,0,1]=3 13 B11R1.189 COC1=CC(CNN)=CC=C1 37013 [1,0,0,0,0,0|2,0,0]=3 14 B11R1.189 COC1=CC=CC(CCBr)=C1 A50690 [1,0,0,0,0,0|1,0,1]=3 15 B11R1.189 COC1=CC=CC(CON)=C1 BL009659 [1,0,0,0,0,0|2,0,0]=3 16 B11R1.189 COC1=CC=CC(N=C=S)=C1 D95713 [1,0,0,0,0,0|2,0,1]=4 17 B11R1.189 COC1=NC(CC#N)=CC=C1 81756 [1,0,0,0,0,0|2,0,1]=4 18 B11R1.192 CC1=C(C)C=C(CCN)C=C1 N12030 [1,0,0,0,0,0|2,0,1]=4 19 B11R1.192 CC1=C(F)C=CC(CC#N)=C1 76112 [1,0,0,0,0,0|2,0,1]=4 20 B11R1.192 CC1=C(O)C=CC(SC#N)=C1 71095 [1,0,0,0,0,0|2,0,1]=4 21 B11R1.192 CCCC1=CC(O)=C(O)C=C1 D80321 [1,0,0,0,0,0|0,0,2]=3 22 B11R1.192 CNCC1=CC(C)=C(C)C=C1 32560 [1,0,0,0,0,0|2,0,1]=4 23 B11R1.192 NCCC1=CC(O)=C(O)C=C1 F10519 [1,0,0,0,0,0|1,0,1]=3 24 B11R1.280 C=CC1=CC(OC)=C(F)C=C1 D82769 [1,0,0,0,0,0|1,0,0]=2 25 B11R1.280 C=CC1=CC(OC)=C(O)C=C1 35331 [1,0,0,0,0,0|0,0,0]=1 26 B11R1.280 CCC1=CC(OC)=C(O)C=C1 D90493 [1,0,0,0,0,0|0,0,1]=2 27 B11R1.280 CNC1=C(O)C=CC(C#N)=C1 F11796 [1,0,0,0,0,0|2,0,1]=4 28 B11R1.280 COC1=C(Br)C=CC(C#N)=C1 63221 [1,0,0,0,0,0|2,0,1]=4 29 B11R1.280 COC1=C(Br)C=CC(C=O)=C1 CL4557 [1,0,0,0,0,0|2,0,0]=3 30 B11R1.280 COC1=C(Br)C=CC(CO)=C1 63215 [1,0,0,0,0,0|2,0,0]=3 31 B11R1.280 COC1=C(C)C=CC(C#N)=C1 35355 [1,0,0,0,0,0|2,0,1]=4 32 B11R1.280 COC1=C(C)C=CC(C=O)=C1 CL8332 [1,0,0,0,0,0|2,0,0]=3 33 B11R1.280 COC1=C(Cl)C=CC(C#N)=C1 31398 [1,0,0,0,0,0|2,0,1]=4 34 B11R1.280 COC1=C(Cl)C=CC(C=O)=C1 CL4138 [1,0,0,0,0,0|2,0,0]=3 35 B11R1.280 COC1=C(F)C=CC(C#N)=C1 CL8213 [1,0,0,0,0,0|2,0,1]=4 36 B11R1.280 COC1=C(F)C=CC(C=O)=C1 CL8357 [1,0,0,0,0,0|2,0,0]=3 37 B11R1.280 COC1=C(F)C=CC(CBr)=C1 CL8729 [1,0,0,0,0,0|2,0,0]=3 38 B11R1.280 COC1=C(F)C=CC(CN)=C1 31271 [1,0,0,0,0,0|2,0,0]=3 39 B11R1.280 COC1=C(F)C=CC(CO)=C1 CL8731 [1,0,0,0,0,0|2,0,0]=3 40 B11R1.280 COC1=C(I)C=CC(C=O)=C1 97842 [1,0,0,0,0,0|2,0,0]=3 41 B11R1.280 COC1=C(N)C=CC(C#N)=C1 50150 [1,0,0,0,0,0|2,0,1]=4 42 B11R1.280 COC1=C(O)C=CC(C#N)=C1 73713 [1,0,0,0,0,0|1,0,1]=3 43 B11R1.280 COC1=C(O)C=CC(CN)=C1 41184 [1,0,0,0,0,0|1,0,0]=2 44 B11R1.280 COC1=C(O)C=CC(CN)=C1 D94459 [1,0,0,0,0,0|1,0,0]=2 45 B11R1.280 COC1=C(O)C=CC(CO)=C1 D71248 [1,0,0,0,0,0|1,0,0]=2 46 B11R1.280 COC1=CC(OC)=C(Br)C=C1 F21465 [1,0,0,0,0,0|2,0,1]=4 47 B11R1.280 COC1=CC(OC)=C(F)C=C1 61084 [1,0,0,0,0,0|2,0,1]=4 48 B11R1.280 COC1=CC(OC)=C(I)C=C1 F21463 [1,0,0,0,0,0|2,0,1]=4 49 B11R1.280 COC1=CC(OC)=C(N)C=C1 D87859 [1,0,0,0,0,0|2,0,1]=4 50 B11R1.280 COC1=CC(OC)=C(O)C=C1 24098 [1,0,0,0,0,0|1,0,1]=3 51 B11R1.280 COC1=CC(OC)=C(S)C=C1 D82218 [1,0,0,0,0,0|1,1,1]=4 52 B11R1.280 N#CC1=C(O)C=CC(C=O)=C1 C10581 [1,0,0,0,0,0|3,0,0]=4 53 B11R1.280 O=CC1=C(O)C=CC(CCl)=C1 D83586 [1,0,0,0,0,0|3,0,0]=4 54 B11R1.280 O=CC1=CC(C=O)=C(O)C=C1 T72316 [1,0,0,0,0,0|3,0,0]=4 55 B13R1.49 COC(=O)C1=CC(OC)=C(O)C=C1 23010 [0,1,0,0,0,0|1,0,2]=4 56 B13R1.49 COC1=C(O)C=CC(C(=O)NN)=C1 D85836 [0,1,0,0,0,0|2,0,1]=4 57 B13R1.52 COC1=C(F)C=CC(CC(=O)O)=C1 CL8790 [0,1,0,0,0,0|2,0,0]=3 58 B13R1.52 COC1=C(F)C=CC(NC(N)=S)=C1 D83541 [0,1,0,0,0,0|3,0,0]=4 59 B13R1.52 COC1=C(O)C=CC(CC(=O)O)=C1 35759 [0,1,0,0,0,0|1,0,0]=2 60 B13R1.52 COC1=C(O)C=CC(CC(C)=O)=C1 C13334 [0,1,0,0,0,0|0,0,1]=2 61 B13R1.386 CNCC1=CC(OC)=C(OC)C=C1 29205 [0,1,0,0,0,0|1,0,1]=3 62 B13R1.386 COC1=C(OC)C=C(CC#N)C=C1 67585 [0,1,0,0,0,0|1,0,1]=3 63 B13R1.386 COC1=C(OC)C=C(CCN)C=C1 67622 [0,1,0,0,0,0|1,0,1]=3 64 B13R1.386 COC1=C(OC)C=C(CCO)C=C1 68692 [0,1,0,0,0,0|1,0,1]=3 65 B13R1.386 COC1=C(OC)C=C(N=C=S)C=C1 D91178 [0,1,0,0,0,0|2,0,1]=4 66 B13R1.386 C\C=C\C1=CC(OC)=C(OC)C=C1 42472 [0,1,0,0,0,0|0,0,2]=3 67 B13R1.575 CCOCC1=CC(OC)=C(O)C=C1 D81914 [0,1,0,0,0,0|0,0,2]=3 68 B13R1.575 COC1=C(O)C=CC(CCCO)=C1 F17046 [0,1,0,0,0,0|0,0,2]=3 69 B13R1.575 COC1=C(O)C=CC(\C=C\CO)=C1 D93191 [0,1,0,0,0,0|0,0,2]=3 70 B13R2.449 BrCCC1=CC2=C(C=C1)OCC2 54598 [0,0,0,1,0,0|2,0,1]=4 71 B13R2.449 N#CCC1=CC2=C(C=C1)OCO2 CK1017 [0,0,0,1,0,0|1,0,1]=3 72 B13R2.449 NCCC1=CC2=C(C=C1)OCO2 28956 [0,0,0,1,0,0|1,0,1]=3 73 B13R2.449 O=C=NC1=CC2=C(C=C1)OCO2 75660 [0,0,0,1,0,0|2,0,1]=4 74 B13R2.449 OCCC1=CC2=C(C=C1)OCO2 D97583 [0,0,0,1,0,0|1,0,1]=3 75 B13R2.599 COC1=C(Br)C=C2C=NNC2=C1 25189 [0,0,0,1,0,0|3,0,0]=4 76 B13R2.599 COC1=C(Br)C=C2N=CNC2=C1 25697 [0,0,0,1,0,0|3,0,0]=4 77 B10R1.10 CC1=CC=CC(CC#N)=C1 CK2045 [2,0,0,0,0,0|1,0,1]=4 78 B10R1.10 CC1=CC=CC(CCBr)=C1 F20015 [2,0,0,0,0,0|1,0,1]=4 79 B10R1.10 CC1=CC=CC(CCN)=C1 66804 [2,0,0,0,0,0|1,0,1]=4 80 B10R1.10 CC1=CC=CC(CCN)=C1 79173 [2,0,0,0,0,0|1,0,1]=4 81 B10R1.10 CC1=CC=CC(CCO)=C1 CK1130 [2,0,0,0,0,0|1,0,1]=4 82 B10R1.10 CC1=CC=CC(CNN)=C1 W16033 [2,0,0,0,0,0|2,0,0]=4 83 B10R1.10 CNCC1=CC=CC(O)=C1 30625 [2,0,0,0,0,0|1,0,1]=4 84 B10R1.10 N#CCC1=CC=CC(O)=C1 C74311 [2,0,0,0,0,0|1,0,1]=4 85 B10R1.10 NCCC1=CC=CC(O)=C1 51439 [2,0,0,0,0,0|1,0,1]=4 86 B10R1.10 NCCC1=CC=CC(O)=C1 51440 [2,0,0,0,0,0|1,0,1]=4 87 B10R1.10 NNCC1=CC=CC(O)=C1 62430 [2,0,0,0,0,0|2,0,0]=4 88 B10R1.10 OC1=CC=CC(CCBr)=C1 D84479 [2,0,0,0,0,0|1,0,1]=4 89 B10R1.10 OCCC1=CC=CC(O)=C1 52366 [2,0,0,0,0,0|1,0,1]=4 90 B10R1.172 C#CC1=CC=CC(OC)=C1 75816 [2,0,0,0,0,0|0,0,2]=4 91 B10R1.172 C=CC1=CC=CC(C=C)=C1 H10228 [2,0,0,0,0,0|1,0,1]=4 92 B10R1.172 CCC1=CC=CC(C=O)=C1 CL8323 [2,0,0,0,0,0|2,0,0]=4 93 B10R1.172 CNC1=CC(CN)=CC=C1 A10197 [2,0,0,0,0,0|2,0,0]=4 94 B10R1.172 COC1=CC(C#N)=CC=C1 78001 [2,0,0,0,0,0|1,0,1]=4 95 B10R1.172 COC1=CC(C=O)=CN=C1 23185 [2,0,0,0,0,0|2,0,0]=4 96 B10R1.172 COC1=CC(C=O)=NC=C1 CL0253 [2,0,0,0,0,0|2,0,0]=4 97 B10R1.172 COC1=CC(CCl)=NC=C1 C10583 [2,0,0,0,0,0|2,0,0]=4 98 B10R1.172 COC1=CC(CN)=CC=C1 CK2410 [2,0,0,0,0,0|1,0,0]=3 99 B10R1.172 COC1=CC(CN)=NC=C1 26278 [2,0,0,0,0,0|2,0,0]=4 100 B10R1.172 COC1=CC(CN)=NC=C1 C72364 [2,0,0,0,0,0|2,0,0]=4 101 B10R1.172 COC1=CC(CO)=CC=C1 78002 [2,0,0,0,0,0|1,0,0]=3 102 B10R1.172 COC1=CC(CO)=NC=C1 CL0286 [2,0,0,0,0,0|2,0,0]=4 103 B10R1.172 COC1=CC(NN)=CC=C1 I10071 [2,0,0,0,0,0|2,0,0]=4 104 B10R1.172 COC1=CC=CC(C=O)=C1 D70836 [2,0,0,0,0,0|1,0,0]=3 105 B10R1.172 COC1=CC=CC(C=O)=N1 23723 [2,0,0,0,0,0|2,0,0]=4 106 B10R1.172 COC1=CC=CC(CBr)=C1 CK2012 [2,0,0,0,0,0|1,0,0]=3 107 B10R1.172 COC1=CC=CC(CBr)=N1 C10189 [2,0,0,0,0,0|2,0,0]=4 108 B10R1.172 COC1=CC=CC(CCl)=C1 78003 [2,0,0,0,0,0|1,0,0]=3 109 B10R1.172 COC1=CC=CC(OC)=C1 22009 [2,0,0,0,0,0|1,0,1]=4 110 B10R1.172 COC1=CC=CC(SC)=C1 D91547 [2,0,0,0,0,0|1,0,1]=4 111 B10R1.172 COC1=CN=CC(CO)=C1 P11040 [2,0,0,0,0,0|2,0,0]=4 112 B10R1.172 COC1=NC(CN)=CC=C1 F30404 [2,0,0,0,0,0|2,0,0]=4 113 B10R1.172 COC1=NC(CO)=CC=C1 26710 [2,0,0,0,0,0|2,0,0]=4 114 B10R1.172 COC1=NC=CC(C=O)=C1 23786 [2,0,0,0,0,0|2,0,0]=4 115 B10R1.172 COC1=NC=CC(CN)=C1 37570 [2,0,0,0,0,0|2,0,0]=4 116 B10R1.172 COC1=NC=CC(CO)=C1 25644 [2,0,0,0,0,0|2,0,0]=4 117 B10R1.1 CC1=CC=C(CC=O)C=C1 W16820 [2,0,0,0,0,0|2,0,0]=4 118 B10R1.1 CCCC1=CC=C(O)C=C1 F16572 [2,0,0,0,0,0|0,0,2]=4 119 B10R1.1 N#CCC1=CC=C(O)C=C1 74178 [2,0,0,0,0,0|1,0,1]=4 120 B10R1.1 NCCC1=CC=C(O)C=C1 AC1814 [2,0,0,0,0,0|1,0,1]=4 121 B10R1.1 NCCC1=CC=C(O)C=C1 S12325 [2,0,0,0,0,0|1,0,1]=4 122 B10R1.1 O=CCC1=CC=C(Br)C=C1 68586 [2,0,0,0,0,0|2,0,0]=4 123 B10R1.1 O=CCC1=CC=C(F)C=C1 H10605 [2,0,0,0,0,0|2,0,0]=4 124 B10R1.1 OC1=CC=C(CCBr)C=C1 C10633 [2,0,0,0,0,0|1,0,1]=4 125 B10R1.1 OCCC1=CC=C(O)C=C1 36252 [2,0,0,0,0,0|1,0,1]=4 126 B10R1.176 C=CC1=CC(F)=C(F)C=C1 29872 [2,0,0,0,0,0|2,0,0]=4 127 B10R1.176 CC1=C(Br)C=CC(C=O)=C1 CL9119 [2,0,0,0,0,0|2,0,0]=4 128 B10R1.176 CC1=C(Br)C=CC(CBr)=C1 CL9332 [2,0,0,0,0,0|2,0,0]=4 129 B10R1.176 CC1=C(Br)C=CC(CO)=C1 30350 [2,0,0,0,0,0|2,0,0]=4 130 B10R1.176 CC1=C(C)C=C(C=O)C=C1 22052 [2,0,0,0,0,0|2,0,0]=4 131 B10R1.176 CC1=C(C)C=C(CBr)C=C1 25654 [2,0,0,0,0,0|2,0,0]=4 132 B10R1.176 CC1=C(C)C=C(CCl)C=C1 A10185 [2,0,0,0,0,0|2,0,0]=4 133 B10R1.176 CC1=C(C)C=C(CN)C=C1 28445 [2,0,0,0,0,0|2,0,0]=4 134 B10R1.176 CC1=C(C)C=C(CN)C=C1 71989 [2,0,0,0,0,0|2,0,0]=4 135 B10R1.176 CC1=C(C)C=C(CO)C=C1 29714 [2,0,0,0,0,0|2,0,0]=4 136 B10R1.176 CC1=C(Cl)C=CC(C=O)=C1 87012 [2,0,0,0,0,0|2,0,0]=4 137 B10R1.176 CC1=C(F)C=CC(C=O)=C1 67938 [2,0,0,0,0,0|2,0,0]=4 138 B10R1.176 CC1=C(F)C=CC(CN)=C1 CK2413 [2,0,0,0,0,0|2,0,0]=4 139 B10R1.176 CC1=C(F)C=CC(CO)=C1 D95680 [2,0,0,0,0,0|2,0,0]=4 140 B10R1.176 CC1=C(O)C=CC(C=O)=C1 CL8360 [2,0,0,0,0,0|1,0,0]=3 141 B10R1.176 CCC1=CC(Br)=C(O)C=C1 36862 [2,0,0,0,0,0|1,0,1]=4 142 B10R1.176 CCC1=CC(O)=C(N)C=C1 24711 [2,0,0,0,0,0|1,0,1]=4 143 B10R1.176 COC1=CC(C)=C(O)C=C1 CL9016 [2,0,0,0,0,0|1,0,1]=4 144 B10R1.176 N#CC1=CC(O)=C(O)C=C1 C10494 [2,0,0,0,0,0|1,0,1]=4 145 B10R1.176 O=CC1=CC(Br)=C(O)C=C1 CK2092 [2,0,0,0,0,0|2,0,0]=4 146 B10R1.176 O=CC1=CC(Cl)=C(O)C=C1 23388 [2,0,0,0,0,0|2,0,0]=4 147 B10R1.176 O=CC1=CC(F)=C(O)C=C1 CL8326 [2,0,0,0,0,0|2,0,0]=4 148 B10R1.176 O=CC1=CC(I)=C(O)C=C1 CK2087 [2,0,0,0,0,0|2,0,0]=4 149 B10R1.176 O=CC1=CC(O)=C(Cl)C=C1 CL8920 [2,0,0,0,0,0|2,0,0]=4 150 B10R1.176 O=CC1=CC(O)=C(F)C=C1 CL8356 [2,0,0,0,0,0|2,0,0]=4 151 B10R1.176 O=CC1=CC(O)=C(O)C=C1 95721 [2,0,0,0,0,0|1,0,0]=3 152 B10R1.176 OCC1=CC(Br)=C(O)C=C1 23755 [2,0,0,0,0,0|2,0,0]=4 153 B10R1.176 OCC1=CC(O)=C(Br)C=C1 RB3138 [2,0,0,0,0,0|2,0,0]=4 154 B10R1.176 OCC1=CC(O)=C(I)C=C1 30183 [2,0,0,0,0,0|2,0,0]=4 155 B10R1.176 OCC1=CC(O)=C(O)C=C1 T70871 [2,0,0,0,0,0|1,0,0]=3 156 B10R1.30 CC1=CC(C=O)=C(O)C=C1 CL8984 [2,0,0,0,0,0|2,0,0]=4 157 B10R1.30 CCC1=C(O)C=CC(Br)=C1 D94596 [2,0,0,0,0,0|2,0,0]=4 158 B10R1.30 CCC1=C(O)C=CC(C)=N1 34316 [2,0,0,0,0,0|2,0,0]=4 159 B10R1.30 CCC1=C(O)C=CC(C)=N1 CK1206 [2,0,0,0,0,0|2,0,0]=4 160 B10R1.30 CCC1=C(O)C=CC(F)=C1 W10550 [2,0,0,0,0,0|2,0,0]=4 161 B10R1.30 CCC1=C(O)C=CC(O)=C1 C74215 [2,0,0,0,0,0|2,0,0]=4 162 B10R1.30 COC1=C(Br)C=CC(Br)=C1 CL8582 [2,0,0,0,0,0|2,0,0]=4 163 B10R1.30 COC1=C(Br)C=CC(C)=C1 CL9188 [2,0,0,0,0,0|1,0,0]=3 164 B10R1.30 COC1=C(Br)C=CC(C)=N1 29086 [2,0,0,0,0,0|2,0,0]=4 165 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 CL8587 [2,0,0,0,0,0|2,0,0]=4 166 B10R1.30 COC1=C(Br)C=CC(F)=C1 TD1093 [2,0,0,0,0,0|2,0,0]=4 167 B10R1.30 COC1=C(Br)C=CC(I)=C1 34443 [2,0,0,0,0,0|2,0,0]=4 168 B10R1.30 COC1=C(Br)C=CC(N)=C1 50581 [2,0,0,0,0,0|2,0,0]=4 169 B10R1.30 COC1=C(Br)C=CC(O)=C1 54580 [2,0,0,0,0,0|2,0,0]=4 170 B10R1.30 COC1=C(C)C=CC(Br)=C1 CL9320 [2,0,0,0,0,0|2,0,0]=4 171 B10R1.30 COC1=C(C)C=CC(C)=C1 F14860 [2,0,0,0,0,0|1,0,0]=3 172 B10R1.30 COC1=C(C)C=CC(Cl)=C1 76267 [2,0,0,0,0,0|2,0,0]=4 173 B10R1.30 COC1=C(C)C=CC(I)=C1 D80581 [2,0,0,0,0,0|2,0,0]=4 174 B10R1.30 COC1=C(C)C=CC(N)=C1 CL8431 [2,0,0,0,0,0|2,0,0]=4 175 B10R1.30 COC1=C(Cl)C=CC(Br)=C1 CL8610 [2,0,0,0,0,0|2,0,0]=4 176 B10R1.30 COC1=C(Cl)C=CC(C)=C1 W10409 [2,0,0,0,0,0|1,0,0]=3 177 B10R1.30 COC1=C(Cl)C=CC(Cl)=C1 CK1198 [2,0,0,0,0,0|2,0,0]=4 178 B10R1.30 COC1=C(Cl)C=CC(F)=C1 34457 [2,0,0,0,0,0|2,0,0]=4 179 B10R1.30 COC1=C(Cl)C=CC(I)=C1 34464 [2,0,0,0,0,0|2,0,0]=4 180 B10R1.30 COC1=C(Cl)C=CC(N)=C1 67832 [2,0,0,0,0,0|2,0,0]=4 181 B10R1.30 COC1=C(Cl)C=CC(O)=C1 I11411 [2,0,0,0,0,0|2,0,0]=4 182 B10R1.30 COC1=C(F)C=CC(Br)=C1 67961 [2,0,0,0,0,0|2,0,0]=4 183 B10R1.30 COC1=C(F)C=CC(C)=N1 22427 [2,0,0,0,0,0|2,0,0]=4 184 B10R1.30 COC1=C(F)C=CC(F)=C1 34493 [2,0,0,0,0,0|2,0,0]=4 185 B10R1.30 COC1=C(F)C=CC(I)=C1 C16363 [2,0,0,0,0,0|2,0,0]=4 186 B10R1.30 COC1=C(F)C=CC(N)=C1 CL8443 [2,0,0,0,0,0|2,0,0]=4 187 B10R1.30 COC1=C(F)C=CC(O)=C1 CL8504 [2,0,0,0,0,0|2,0,0]=4 188 B10R1.30 COC1=C(I)C=CC(Br)=C1 34450 [2,0,0,0,0,0|2,0,0]=4 189 B10R1.30 COC1=C(I)C=CC(Cl)=C1 34467 [2,0,0,0,0,0|2,0,0]=4 190 B10R1.30 COC1=C(I)C=CC(F)=C1 F21015 [2,0,0,0,0,0|2,0,0]=4 191 B10R1.30 COC1=C(N)C=CC(Br)=C1 55886 [2,0,0,0,0,0|2,0,0]=4 192 B10R1.30 COC1=C(N)C=CC(C)=C1 84034 [2,0,0,0,0,0|1,0,0]=3 193 B10R1.30 COC1=C(N)C=CC(Cl)=C1 76059 [2,0,0,0,0,0|2,0,0]=4 194 B10R1.30 COC1=C(N)C=CC(F)=C1 76104 [2,0,0,0,0,0|2,0,0]=4 195 B10R1.30 COC1=C(N)C=CC(F)=C1 84273 [2,0,0,0,0,0|2,0,0]=4 196 B10R1.30 COC1=C(N)C=CC(I)=C1 34420 [2,0,0,0,0,0|2,0,0]=4 197 B10R1.30 COC1=C(N)C=CC(N)=C1 28702 [2,0,0,0,0,0|2,0,0]=4 198 B10R1.30 COC1=C(N)C=CC(O)=C1 30712 [2,0,0,0,0,0|2,0,0]=4 199 B10R1.30 COC1=C(O)C=CC(Br)=C1 CL8499 [2,0,0,0,0,0|1,0,0]=3 200 B10R1.30 COC1=C(O)C=CC(C)=C1 D70655 [2,0,0,0,0,0|0,0,0]=2 201 B10R1.30 COC1=C(O)C=CC(Cl)=C1 F20981 [2,0,0,0,0,0|1,0,0]=3 202 B10R1.30 COC1=C(O)C=CC(F)=C1 F20936 [2,0,0,0,0,0|1,0,0]=3 203 B10R1.30 COC1=C(O)C=CC(I)=C1 76134 [2,0,0,0,0,0|1,0,0]=3 204 B10R1.30 COC1=C(O)C=CC(N)=C1 52065 [2,0,0,0,0,0|1,0,0]=3 205 B10R1.30 COC1=C(O)C=CC(O)=C1 75568 [2,0,0,0,0,0|1,0,0]=3 206 B10R1.30 COC1=CC(=O)C=CC1=O D91432 [2,0,0,0,0,0|1,0,1]=4 207 B10R1.30 COC1=NC(C)=CC=C1N 22424 [2,0,0,0,0,0|2,0,0]=4 208 B12R1.41 COC1=CC(CC#N)=CC(F)=C1 CL8908 [1,1,0,0,0,0|1,0,1]=4 209 B12R1.270 COC1=CC(CC#N)=C(F)C=C1 CL8763 [1,1,0,0,0,0|1,0,1]=4 210 B12R1.280 C=CCC1=CC=CC(C=O)=C1O O10931 [1,1,0,0,0,0|2,0,0]=4 211 B12R1.382 C=CCOC1=CC=CC(C=O)=C1 79770 [1,1,0,0,0,0|2,0,0]=4 212 B12R1.382 CNCCC1=CC=CC(OC)=C1 C15606 [1,1,0,0,0,0|0,0,2]=4 213 B12R1.382 COC1=CC(CCCO)=CC=C1 C78421 [1,1,0,0,0,0|0,0,2]=4 214 B12R1.382 COC1=CC=CC(OCC#N)=C1 31739 [1,1,0,0,0,0|1,0,1]=4 215 B12R1.435 COC1=CC([C@@H](N)CO)=CC=C1 N11091 [1,1,0,0,0,0|1,0,1]=4 216 B12R1.435 COC1=CC=CC(C(=O)C=O)=C1 75868 [1,1,0,0,0,0|1,0,1]=4 217 B12R1.438 COC1=CC=CC(CC(=O)Cl)=C1 D97427 [1,1,0,0,0,0|1,0,0]=3 218 B12R1.438 COC1=CC=CC(CC(=O)O)=C1 CK2074 [1,1,0,0,0,0|1,0,0]=3 219 B12R1.438 COC1=CC=CC(CC(C)=O)=C1 34187 [1,1,0,0,0,0|0,0,1]=3 220 B12R1.438 COC1=CC=CC(NC(C)=O)=C1 64241 [1,1,0,0,0,0|1,0,1]=4 221 B12R1.438 COC1=CC=CC(NC(N)=S)=C1 W17013 [1,1,0,0,0,0|2,0,0]=4 222 B12R1.19 CC(=O)NC1=CC(O)=C(O)C=C1 S10202 [1,1,0,0,0,0|1,0,1]=4 223 B12R1.19 CC1=C(Br)C=CC(CC(=O)O)=C1 CL8787 [1,1,0,0,0,0|2,0,0]=4 224 B12R1.19 CC1=C(C)C=C(CC(=O)O)C=C1 67768 [1,1,0,0,0,0|2,0,0]=4 225 B12R1.19 CC1=C(F)C=CC(CC(=O)O)=C1 CL9442 [1,1,0,0,0,0|2,0,0]=4 226 B12R1.19 CC1=C(N)C=CC(CC(=O)O)=C1 Y10010 [1,1,0,0,0,0|2,0,0]=4 227 B12R1.19 CC1=C(O)C=CC(CC(=O)O)=C1 CL9284 [1,1,0,0,0,0|1,0,0]=3 228 B12R1.19 O=C(O)CC1=CC(Br)=C(O)C=C1 CK2069 [1,1,0,0,0,0|2,0,0]=4 229 B12R1.19 O=C(O)CC1=CC(Cl)=C(O)C=C1 C13676 [1,1,0,0,0,0|2,0,0]=4 230 B12R1.19 O=C(O)CC1=CC(F)=C(O)C=C1 CL8962 [1,1,0,0,0,0|2,0,0]=4 231 B12R1.19 O=C(O)CC1=CC(O)=C(O)C=C1 33468 [1,1,0,0,0,0|1,0,0]=3 232 B12R1.288 COC1=C(C)C=C(CC#N)C=C1 CL9295 [1,1,0,0,0,0|1,0,1]=4 233 B12R1.288 COC1=C(O)C=C(CCN)C=C1 51443 [1,1,0,0,0,0|1,0,1]=4 234 B12R1.367 NC[C@H](O)C1=CC(O)=C(O)C=C1 D88347 [1,1,0,0,0,0|1,0,1]=4 235 B12R1.385 CCCCC1=CC(O)=C(O)C=C1 D84238 [1,1,0,0,0,0|0,0,2]=4 236 B12R1.56 COC1=C(Br)C=CC(C(=O)O)=C1 63219 [1,1,0,0,0,0|2,0,0]=4 237 B12R1.56 COC1=C(C)C=CC(C(=O)O)=C1 28843 [1,1,0,0,0,0|2,0,0]=4 238 B12R1.56 COC1=C(Cl)C=CC(C(=O)O)=C1 CL8115 [1,1,0,0,0,0|2,0,0]=4 239 B12R1.56 COC1=C(F)C=CC(C(=O)O)=C1 CL8120 [1,1,0,0,0,0|2,0,0]=4 240 B12R1.56 COC1=C(F)C=CC(C(C)=O)=C1 CK2585 [1,1,0,0,0,0|1,0,1]=4 241 B12R1.56 COC1=C(N)C=CC(C(=O)O)=C1 TD1301 [1,1,0,0,0,0|2,0,0]=4 242 B12R1.56 COC1=C(O)C=CC(C(=O)O)=C1 CK2172 [1,1,0,0,0,0|1,0,0]=3 243 B12R1.56 COC1=C(O)C=CC(C(=O)[O-])=C1 D90828 [1,1,0,0,0,0|1,0,0]=3 244 B12R1.56 COC1=C(O)C=CC(C(C)=O)=C1 D70564 [1,1,0,0,0,0|0,0,1]=3 245 B12R1.56 COC1=C(O)C=CC([C@H](C)O)=C1 F17123 [1,1,0,0,0,0|0,0,1]=3 246 B12R1.56 COC1=C(O)C=CC([N+](=O)[O-])=C1 75564 [1,1,0,0,0,0|2,0,0]=4 247 B12R1.78 C#CC1=CC(OC)=C(OC)C=C1 98435 [1,1,0,0,0,0|0,0,2]=4 248 B12R1.78 C=CC1=CC(OC)=C(OC)C=C1 S10723 [1,1,0,0,0,0|0,0,0]=2 249 B12R1.78 COC1=C(OC)C=C(C#N)C=C1 CK1047 [1,1,0,0,0,0|1,0,1]=4 250 B12R1.78 COC1=C(OC)C=C(C=O)C=C1 44586 [1,1,0,0,0,0|1,0,0]=3 251 B12R1.78 COC1=C(OC)C=C(CCl)C=C1 88205 [1,1,0,0,0,0|1,0,0]=3 252 B12R1.78 COC1=C(OC)C=C(CN)C=C1 CK2400 [1,1,0,0,0,0|1,0,0]=3 253 B12R1.78 COC1=C(OC)C=C(CO)C=C1 35568 [1,1,0,0,0,0|1,0,0]=3 254 B12R1.78 COC1=CC(OC)=C(CO)C=C1 CK2454 [1,1,0,0,0,0|1,0,1]=4 255 B12R1.78 COC1=CC(OC)=C(OC)C=C1 F11207 [1,1,0,0,0,0|1,0,1]=4 256 B12R1.300 COC1=C(O)C(O)=CC(C=O)=C1 D72699 [1,1,0,0,0,0|1,0,0]=3 257 B12R1.300 COC1=CC(C#N)=CC(Br)=C1O 76872 [1,1,0,0,0,0|1,0,1]=4 258 B12R1.300 COC1=CC(C=O)=CC(Br)=C1O A10204 [1,1,0,0,0,0|1,0,0]=3 259 B12R1.300 COC1=CC(C=O)=CC(Cl)=C1O W18340 [1,1,0,0,0,0|1,0,0]=3 260 B12R1.300 COC1=CC(C=O)=CC(F)=C1F CL8295 [1,1,0,0,0,0|2,0,0]=4 261 B12R1.300 COC1=CC(C=O)=CC(F)=C1O CL8325 [1,1,0,0,0,0|1,0,0]=3 262 B12R1.300 COC1=CC(C=O)=CC(I)=C1O A10201 [1,1,0,0,0,0|1,0,0]=3 263 B12R1.449 COC1=C(Br)C=C(F)C(C=O)=C1 88202 [1,1,0,0,0,0|2,0,0]=4 264 B12R1.449 COC1=C(Br)C=C(O)C(C=O)=C1 32650 [1,1,0,0,0,0|2,0,0]=4 265 B12R1.449 COC1=C(Cl)C=C(F)C(C=O)=C1 58141 [1,1,0,0,0,0|2,0,0]=4 266 B12R1.449 COC1=C(F)C=C(F)C(C=O)=C1 32283 [1,1,0,0,0,0|2,0,0]=4 267 B12R1.449 COC1=CC(C#N)=C(Br)C=C1O 77710 [1,1,0,0,0,0|1,0,1]=4 268 B12R1.449 COC1=CC(C=O)=C(Br)C=C1F 95029 [1,1,0,0,0,0|2,0,0]=4 269 B12R1.449 COC1=CC(C=O)=C(Br)C=C1O 29352 [1,1,0,0,0,0|1,0,0]=3 270 B12R1.453 CCC1=CC(C(C)=O)=C(O)C=C1 S10957 [1,1,0,0,0,0|1,0,1]=4 271 B12R1.654 COC1=C(Cl)C=CC(C=O)=C1F 36779 [1,1,0,0,0,0|2,0,0]=4 272 B14R1.41 COC1=C(O)C=CC([C@@H](O)C(=O)O)=C1 D90829 [0,2,0,0,0,0|1,0,0]=3 273 B14R1.3405 COC(=O)CC1=CC(OC)=C(F)C=C1 95690 [0,2,0,0,0,0|1,0,1]=4 274 B14R1.3651 COC1=C(OC)C=C(CC(=O)O)C=C1 22516 [0,2,0,0,0,0|1,0,0]=3 275 B14R1.3651 COC1=C(OC)C=C(CC(C)=O)C=C1 28452 [0,2,0,0,0,0|0,0,1]=3 276 B14R1.3651 COC1=C(OC)C=C(C[C@H](C)O)C=C1 D75342 [0,2,0,0,0,0|0,0,2]=4 277 B14R1.6787 CCOC1=C(OC)C=CC(CNC)=C1 D82808 [0,2,0,0,0,0|1,0,1]=4 278 B14R1.793 CNCCC1=CC(OC)=C(OC)C=C1 FD10469 [0,2,0,0,0,0|0,0,2]=4 279 B14R1.6788 CCOC1=C(OC)C=C(CNC)C=C1 D80792 [0,2,0,0,0,0|1,0,1]=4 280 B14R1.14946 COC1=CC(Br)=C(CC#N)C=C1OC 75445 [0,2,0,0,0,0|1,0,1]=4 281 B14R1.42 COC1=C(O)C=CC(CCC(=O)O)=C1 A50645 [0,2,0,0,0,0|0,0,1]=3 282 B14R1.42 COC1=C(O)C=CC(CCC(C)=O)=C1 78548 [0,2,0,0,0,0|0,0,1]=3 283 B14R1.42 COC1=C(O)C=CC(CC[N+](=O)[O-])=C1 50830 [0,2,0,0,0,0|1,0,1]=4 284 B14R1.42 COC1=C(O)C=CC(\C=C/[N+](=O)[O-])=C1 62434 [0,2,0,0,0,0|1,0,1]=4 285 B14R1.42 COC1=C(O)C=CC(\C=C\C(=O)O)=C1 41707 [0,2,0,0,0,0|0,0,1]=3 286 B14R1.42 COC1=C(O)C=CC(\C=C\C(=O)O)=C1 AC7905 [0,2,0,0,0,0|0,0,1]=3 287 B14R1.42 COC1=C(O)C=CC(\C=C\C(=O)[O-])=C1 41757 [0,2,0,0,0,0|0,0,1]=3 288 B14R1.42 COC1=C(O)C=CC(\C=C\C(C)=O)=C1 AC8555 [0,2,0,0,0,0|0,0,1]=3 289 B14R1.3236 C=CCC1=CC(OC)=C(O)C(OC)=C1 55761 [0,2,0,0,0,0|0,0,0]=2 290 B12R2.43 COC1=CC=CC([C@@H]2CO2)=C1 D93449 [1,0,0,1,0,0|1,0,1]=4 291 B12R2.44 COC1=CC2=C(C=C1)CNC2 64066 [1,0,0,1,0,0|1,0,1]=4 292 B12R2.44 COC1=CC2=C(C=C1)N=CS2 24867 [1,0,0,1,0,0|2,0,0]=4 293 B12R2.44 COC1=CC2=C(C=C1)NC=C2 29335 [1,0,0,1,0,0|1,0,1]=4 294 B12R2.44 COC1=CC2=C(C=C1)NC=N2 F17318 [1,0,0,1,0,0|2,0,0]=4 295 B12R2.44 COC1=CC2=C(C=C1)NCC2 23816 [1,0,0,1,0,0|1,0,1]=4 296 B12R2.44 COC1=CC2=C(C=C1)NCC2 29213 [1,0,0,1,0,0|1,0,1]=4 297 B12R2.44 COC1=CC2=C(C=C1)SC=N2 O11467 [1,0,0,1,0,0|2,0,0]=4 298 B12R2.44 COC1=CC2=C(C=CN2)C=C1 29336 [1,0,0,1,0,0|1,0,0]=3 299 B12R2.44 COC1=CC2=C(C=CO2)C=C1 F10222 [1,0,0,1,0,0|1,0,0]=3 300 B12R2.44 COC1=CC2=C(C=CS2)C=C1 82369 [1,0,0,1,0,0|1,0,0]=3 301 B12R2.44 COC1=CC2=NC=CN2C=C1 Y11018 [1,0,0,1,0,0|2,0,0]=4 302 B12R2.44 COC1=NC=C2C=CNC2=C1 25463 [1,0,0,1,0,0|2,0,0]=4 303 B12R2.315 COC1=C2C=CNC2=CC=C1 29334 [1,0,0,1,0,0|1,0,0]=3 304 B12R2.315 COC1=C2C=CNC2=NC=C1 82146 [1,0,0,1,0,0|2,0,0]=4 305 B12R2.315 COC1=C2C=NNC2=CC=C1 25909 [1,0,0,1,0,0|2,0,0]=4 306 B12R2.315 COC1=C2NC=CC2=CC=C1 63980 [1,0,0,1,0,0|1,0,1]=4 307 B12R2.315 COC1=C2NCCC2=CC=C1 D82696 [1,0,0,1,0,0|1,0,1]=4 308 B12R2.315 COC1=C2OC=CC2=CC=C1 33540 [1,0,0,1,0,0|1,0,1]=4 309 B12R2.100 CC1=C(Br)C=C2C=CNC2=C1 20053 [1,0,0,1,0,0|2,0,0]=4 310 B12R2.100 CC1=C(O)C=C2C=NNC2=C1 28427 [1,0,0,1,0,0|2,0,0]=4 311 B12R2.100 OC1=C(O)C=C2NC=CC2=C1 70422 [1,0,0,1,0,0|1,0,0]=3 312 B14R2.1008 CC(=O)OC1=CC2=C(C=C1)OCO2 D83607 [0,1,0,1,0,0|1,0,1]=4 313 B14R2.1008 NC(=O)CC1=CC2=C(C=C1)OCO2 D86622 [0,1,0,1,0,0|1,0,0]=3 314 B14R2.1008 O=C(Cl)OC1=CC2=C(C=C1)OCO2 D80374 [0,1,0,1,0,0|2,0,0]=4 315 B14R2.1008 O=C(O)CC1=CC2=C(C=C1)OCC2 F10315 [0,1,0,1,0,0|2,0,0]=4 316 B14R2.1008 O=C(O)CC1=CC2=C(C=C1)OCO2 53670 [0,1,0,1,0,0|1,0,0]=3 317 B14R2.82 COC1=C(OC)C=C2NC=CC2=C1 F15637 [0,1,0,1,0,0|1,0,0]=3 318 B14R2.82 COC1=C(OC)C=C2NC=NC2=C1 60530 [0,1,0,1,0,0|2,0,0]=4 319 B14R2.82 COC1=C(OC)C=C2NN=CC2=C1 I10216 [0,1,0,1,0,0|2,0,0]=4 320 B14R2.991 OCCNC1=CC2=C(C=C1)OCO2 26909 [0,1,0,1,0,0|1,0,1]=4 321 B14R2.1128 COC1=C(O)C=C2C=NCCC2=C1 F17334 [0,1,0,1,0,0|0,0,1]=3 322 B14R2.1128 COC1=CC2=CC=CN=C2C=C1F 27987 [0,1,0,1,0,0|1,0,1]=4 323 B14R2.1128 COC1=CC2=NC=CC=C2C=C1C AC2182 [0,1,0,1,0,0|1,0,1]=4