0 B12R1.5 C#CC(=O)C1=CC=C(OC)C=C1 SBB074327 [0,0,0,0,0,0|1,0,1]=2 1 B12R1.5 C#CC1=CC=C(C(=O)OC)C=C1 SBB068914 [0,0,0,0,0,0|1,0,1]=2 2 B12R1.5 C(=O)C1=CC=C(C(=O)OC)C=C1 SBB008362 [0,0,0,0,0,0|2,0,0]=2 3 B12R1.5 CCC(=O)C1=CC=C(C#N)C=C1 SBB074336 [0,0,0,0,0,0|3,0,0]=3 4 B12R1.5 CCC(=O)C1=CC=C(OC)C=C1 SBB087799 [0,0,0,0,0,0|1,0,0]=1 5 B12R1.5 CCC(N)C1=CC=C(OC)C=C1 SBB009830 [0,0,0,0,0,0|2,0,1]=3 6 B12R1.5 CCC1=CC=C(C(=O)CCl)C=C1 SBB072734 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.5 CNC(=O)C1=CC=C(OC)C=C1 SBB087913 [0,0,0,0,0,0|1,0,0]=1 8 B12R1.5 CNC(C)C1=CC=C(OC)C=C1 SBB085415 [0,0,0,0,0,0|2,0,1]=3 9 B12R1.5 CNC1=CC=C(C(=O)OC)C=C1 SBB048194 [0,0,0,0,0,0|1,0,0]=1 10 B12R1.5 COC(=O)C1=CC=C(C#N)C=C1 SBB057292 [0,0,0,0,0,0|2,0,0]=2 11 B12R1.5 COC(=O)C1=CC=C(CBr)C=C1 SBB054899 [0,0,0,0,0,0|2,0,0]=2 12 B12R1.5 COC(=O)C1=CC=C(CCl)C=C1 SBB059299 [0,0,0,0,0,0|2,0,0]=2 13 B12R1.5 COC(=O)C1=CC=C(CN)C=C1 SBB026559 [0,0,0,0,0,0|2,0,0]=2 14 B12R1.5 COC(=O)C1=CC=C(CN)C=C1 SBB052372 [0,0,0,0,0,0|2,0,0]=2 15 B12R1.5 COC(=O)C1=CC=C(CO)C=C1 SBB059298 [0,0,0,0,0,0|2,0,0]=2 16 B12R1.5 COC(=O)C1=CC=C(NN)C=C1 SBB072386 [0,0,0,0,0,0|2,0,0]=2 17 B12R1.5 COC(=O)C1=CC=C(OC)C=C1 SBB058204 [0,0,0,0,0,0|0,0,0]=0 18 B12R1.5 COC(=O)C1=CN=C(CO)C=C1 SBB053825 [0,0,0,0,0,0|3,0,0]=3 19 B12R1.5 COC(=O)C1=CN=C(OC)C=C1 SBB058538 [0,0,0,0,0,0|1,0,0]=1 20 B12R1.5 COC(=O)C1=CN=C(SC)N=C1 SBB053952 [0,0,0,0,0,0|2,1,0]=3 21 B12R1.5 COC1=CC=C(C(=O)CBr)C=C1 SBB007777 [0,0,0,0,0,0|2,0,0]=2 22 B12R1.5 COC1=CC=C(C(=O)CCl)C=C1 SBB027247 [0,0,0,0,0,0|2,0,0]=2 23 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 SBB003530 [0,0,0,0,0,0|2,0,0]=2 24 B12R1.5 COC1=CC=C(C(=O)NN)C=C1 SBB040977 [0,0,0,0,0,0|2,0,0]=2 25 B12R1.5 COC1=CC=C(\C(C)=N/O)C=C1 SBB087911 [0,0,0,0,0,0|3,0,0]=3 26 B12R1.5 COC1=CC=C(\C(Cl)=N\O)C=C1 SBB090329 [0,0,0,0,0,0|3,0,0]=3 27 B12R1.5 COC1=CC=C(\C(N)=N\O)C=C1 SBB087986 [0,0,0,0,0,0|3,0,0]=3 28 B12R1.5 N#CC1=CC=C(C(=O)NN)C=C1 SBB047983 [0,0,0,0,0,0|4,0,0]=4 29 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 SBB055505 [1,0,0,0,0,0|1,0,0]=2 30 B11R1.3 CC(=O)C1=CC=C(C#N)C=C1 SBB063042 [1,0,0,0,0,0|2,0,0]=3 31 B11R1.3 CCC1=CC=C(B(O)O)C=C1 SBB048066 [1,0,0,0,0,0|2,0,1]=4 32 B11R1.3 CCC1=CC=C(C(=N)N)C=C1 SBB073190 [1,0,0,0,0,0|3,0,0]=4 33 B11R1.3 CCC1=CC=C(C(=O)Cl)C=C1 SBB006540 [1,0,0,0,0,0|2,0,0]=3 34 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 SBB037877 [1,0,0,0,0,0|1,0,0]=2 35 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 SBB040909 [1,0,0,0,0,0|1,0,0]=2 36 B11R1.3 CCC1=CC=C(C(C)N)C=C1 SBB016483 [1,0,0,0,0,0|2,0,1]=4 37 B11R1.3 CCC1=CC=C(C(N)=O)C=C1 SBB116864 [1,0,0,0,0,0|2,0,0]=3 38 B11R1.3 CCC1=CC=C(C(N)=S)C=C1 SBB016505 [1,0,0,0,0,0|2,1,0]=4 39 B11R1.3 CCC1=CC=C([N+](=O)[O-])C=C1 SBB060635 [1,0,0,0,0,0|2,0,1]=4 40 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 SBB058256 [1,0,0,0,0,0|1,0,0]=2 41 B11R1.3 COC1=CC=C(B(O)O)C=C1 SBB004055 [1,0,0,0,0,0|1,0,1]=3 42 B11R1.3 COC1=CC=C(B(O)O)C=N1 SBB052568 [1,0,0,0,0,0|2,0,1]=4 43 B11R1.3 COC1=CC=C(C(=N)N)C=C1 SBB048505 [1,0,0,0,0,0|2,0,0]=3 44 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 SBB040620 [1,0,0,0,0,0|1,0,0]=2 45 B11R1.3 COC1=CC=C(C(=O)O)C=C1 SBB037872 [1,0,0,0,0,0|0,0,0]=1 46 B11R1.3 COC1=CC=C(C(=O)O)N=N1 SBB053240 [1,0,0,0,0,0|2,0,0]=3 47 B11R1.3 COC1=CC=C(C(C)=O)C=C1 SBB040242 [1,0,0,0,0,0|0,0,0]=1 48 B11R1.3 COC1=CC=C(C(C)N)C=C1 SBB007015 [1,0,0,0,0,0|1,0,1]=3 49 B11R1.3 COC1=CC=C(C(N)=S)C=C1 SBB016507 [1,0,0,0,0,0|1,1,0]=3 50 B11R1.3 COC1=CC=C([N+](=O)[O-])C=C1 SBB058741 [1,0,0,0,0,0|1,0,1]=3 51 B11R1.3 COC1=NC=C(C(=O)O)C=C1 SBB012818 [1,0,0,0,0,0|1,0,0]=2 52 B11R1.3 CSC1=CC=C(B(O)O)C=C1 SBB052536 [1,0,0,0,0,0|1,1,1]=4 53 B11R1.3 CSC1=CC=C(C(=N)N)C=C1 SBB077444 [1,0,0,0,0,0|2,1,0]=4 54 B11R1.3 CSC1=CC=C(C(=O)O)C=C1 SBB063176 [1,0,0,0,0,0|0,1,0]=2 55 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 SBB088031 [1,0,0,0,0,0|0,1,0]=2 56 B11R1.3 CSC1=CC=C([N+](=O)[O-])C=C1 SBB068783 [1,0,0,0,0,0|1,1,1]=4 57 B11R1.3 N#CC1=CC=C(C(=O)Cl)C=C1 SBB059843 [1,0,0,0,0,0|3,0,0]=4 58 B11R1.3 N#CC1=CC=C(C(=O)O)C=C1 SBB008570 [1,0,0,0,0,0|2,0,0]=3 59 B11R1.3 N#CC1=CC=C(C(N)=O)C=C1 SBB065159 [1,0,0,0,0,0|3,0,0]=4 60 B11R1.3 N#CC1=NC=C(C(=O)O)C=C1 SBB064074 [1,0,0,0,0,0|3,0,0]=4 61 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 SBB006704 [1,0,0,0,0,0|2,0,0]=3 62 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 SBB046616 [1,0,0,0,0,0|3,0,0]=4 63 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 SBB017160 [1,0,0,0,0,0|2,0,0]=3 64 B11R1.3 NNC1=CC=C(C(=O)O)C=N1 SBB052917 [1,0,0,0,0,0|3,0,0]=4 65 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 SBB042644 [1,0,0,0,0,0|2,0,0]=3 66 B11R1.3 O=C(O)C1=CC=C(CCl)C=C1 SBB040672 [1,0,0,0,0,0|2,0,0]=3 67 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 SBB052730 [1,0,0,0,0,0|2,0,0]=3 68 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 SBB040263 [1,0,0,0,0,0|2,0,0]=3 69 B11R1.3 OC(=O)C1=CC=C(C=C)C=C1 SBB006579 [1,0,0,0,0,0|1,0,1]=3 70 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 SBB038706 [1,0,0,0,0,0|2,0,0]=3 71 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 SBB028287 [1,0,0,0,0,0|2,0,0]=3 72 B11R1.22 CC1=CC=C(\C(N)=N\O)C=C1 SBB022612 [1,0,0,0,0,0|3,0,0]=4 73 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 SBB058414 [1,0,0,0,0,0|2,0,0]=3 74 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 SBB056753 [1,0,0,0,0,0|1,0,0]=2 75 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 SBB035779 [1,0,0,0,0,0|2,0,0]=3 76 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 SBB058461 [1,0,0,0,0,0|2,0,0]=3 77 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 SBB040250 [1,0,0,0,0,0|1,0,0]=2 78 B11R1.22 CCC(N)C1=CC=C(C)C=C1 SBB017924 [1,0,0,0,0,0|2,0,1]=4 79 B11R1.22 CCC(N)C1=CC=C(O)C=C1 SBB080407 [1,0,0,0,0,0|2,0,1]=4 80 B11R1.22 CNC(=O)C1=CC=C(Br)C=C1 SBB051043 [1,0,0,0,0,0|2,0,0]=3 81 B11R1.22 CNC(=O)C1=CC=C(C)C=C1 SBB008263 [1,0,0,0,0,0|1,0,0]=2 82 B11R1.22 CNC(=O)C1=CC=C(Cl)C=C1 SBB003861 [1,0,0,0,0,0|2,0,0]=3 83 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 SBB000104 [1,0,0,0,0,0|2,0,0]=3 84 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 SBB063144 [1,0,0,0,0,0|1,0,0]=2 85 B11R1.22 COC(=O)C1=CC=C(Br)N=C1 SBB053855 [1,0,0,0,0,0|2,0,0]=3 86 B11R1.22 COC(=O)C1=CC=C(C)C=C1 SBB064103 [1,0,0,0,0,0|0,0,0]=1 87 B11R1.22 COC(=O)C1=CC=C(C)N=C1 SBB053798 [1,0,0,0,0,0|1,0,0]=2 88 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 SBB063826 [1,0,0,0,0,0|1,0,0]=2 89 B11R1.22 COC(=O)C1=CC=C(Cl)N=C1 SBB005815 [1,0,0,0,0,0|2,0,0]=3 90 B11R1.22 COC(=O)C1=CC=C(Cl)N=N1 SBB053957 [1,0,0,0,0,0|3,0,0]=4 91 B11R1.22 COC(=O)C1=CC=C(F)C=C1 SBB053694 [1,0,0,0,0,0|1,0,0]=2 92 B11R1.22 COC(=O)C1=CC=C(I)C=C1 SBB063273 [1,0,0,0,0,0|1,0,0]=2 93 B11R1.22 COC(=O)C1=CC=C(N)N=C1 SBB015053 [1,0,0,0,0,0|2,0,0]=3 94 B11R1.22 COC(=O)C1=CC=C(O)C=C1 SBB040908 [1,0,0,0,0,0|0,0,0]=1 95 B11R1.22 COC(=O)C1=CC=[N+](C)C=C1 SBB086856 [1,0,0,0,0,0|1,0,0]=2 96 B11R1.22 COC(=O)C1=CC=[N+]([O-])C=C1 SBB059050 [1,0,0,0,0,0|1,0,1]=3 97 B11R1.22 COC(=O)C1=CN=C(F)C=C1 SBB065264 [1,0,0,0,0,0|2,0,0]=3 98 B11R1.22 COC(=O)C1=COC(=O)C=C1 SBB000117 [1,0,0,0,0,0|1,0,1]=3 99 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 SBB053856 [1,0,0,0,0,0|2,0,0]=3 100 B11R1.22 COC(=O)C1=NC=C(C)N=C1 SBB053940 [1,0,0,0,0,0|2,0,0]=3 101 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 SBB053941 [1,0,0,0,0,0|3,0,0]=4 102 B11R1.22 COC(=O)C1=NC=C(O)N=C1 SBB014253 [1,0,0,0,0,0|2,0,0]=3 103 B11R1.22 COC(=O)C1=NNC(=O)C=C1 SBB042722 [1,0,0,0,0,0|2,0,1]=4 104 B11R1.22 NC1=CC=C(C(=O)OC)C=C1 SBB004063 [1,0,0,0,0,0|1,0,0]=2 105 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 SBB100801 [1,0,0,0,0,0|3,0,0]=4 106 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 SBB017900 [1,0,0,0,0,0|3,0,0]=4 107 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 SBB093579 [1,0,0,0,0,0|3,0,0]=4 108 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 SBB028150 [1,0,0,0,0,0|3,0,0]=4 109 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 SBB003853 [1,0,0,0,0,0|3,0,0]=4 110 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 SBB002375 [1,0,0,0,0,0|3,0,0]=4 111 B11R1.22 NNC(=O)C1=CC=C(N)C=C1 SBB007555 [1,0,0,0,0,0|3,0,0]=4 112 B11R1.22 NNC(=O)C1=CC=C(O)C=C1 SBB043780 [1,0,0,0,0,0|2,0,0]=3 113 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 SBB038654 [1,0,0,0,0,0|3,0,0]=4 114 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 SBB006561 [1,0,0,0,0,0|3,0,0]=4 115 B11R1.22 O=CC(=O)C1=CC=C(F)C=C1 SBB088374 [1,0,0,0,0,0|3,0,0]=4 116 B11R1.83 CCCC1=CC=C(OC)C=C1 SBB007737 [1,0,0,0,0,0|1,0,1]=3 117 B11R1.83 CCNC1=CC=C(CC)C=C1 SBB072094 [1,0,0,0,0,0|3,0,0]=4 118 B11R1.83 CNCC1=CC=C(OC)C=C1 SBB086791 [1,0,0,0,0,0|1,0,1]=3 119 B11R1.83 COC1=CC=C(CC#N)C=C1 SBB055070 [1,0,0,0,0,0|2,0,1]=4 120 B11R1.83 COC1=CC=C(CC=O)C=C1 SBB052209 [1,0,0,0,0,0|2,0,1]=4 121 B11R1.83 COC1=CC=C(CCN)C=C1 SBB058795 [1,0,0,0,0,0|2,0,1]=4 122 B11R1.83 COC1=CC=C(CON)C=C1 SBB091016 [1,0,0,0,0,0|1,0,1]=3 123 B11R1.83 COC1=CC=C(N=C=O)C=C1 SBB048851 [1,0,0,0,0,0|3,0,0]=4 124 B11R1.83 COC1=CC=C(N=C=S)C=C1 SBB006547 [1,0,0,0,0,0|3,0,0]=4 125 B11R1.83 COC1=CC=C(\C=N/O)C=C1 SBB086769 [1,0,0,0,0,0|2,0,0]=3 126 B13R1.39 COC1=CC=C(C(C#N)C=O)C=C1 SBB083134 [0,1,0,0,0,0|2,0,1]=4 127 B13R1.95 CCC(=O)C1=C(O)C=C(OC)C=C1 SBB027179 [0,1,0,0,0,0|1,0,0]=2 128 B13R1.95 COC(=O)C1=CC=C(OC)C=C1O SBB064005 [0,1,0,0,0,0|0,0,0]=1 129 B13R1.139 CCOC1=CC=C(C(=O)NN)C=C1 SBB040996 [0,1,0,0,0,0|2,0,0]=3 130 B13R1.139 CCOC1=CC=C(C(=O)OC)C=C1 SBB041033 [0,1,0,0,0,0|0,0,0]=1 131 B13R1.139 CCOC1=CC=C(C(N)CC)C=C1 SBB080412 [0,1,0,0,0,0|2,0,1]=4 132 B13R1.139 CNCC1=CC=C(C(=O)OC)C=C1 SBB073195 [0,1,0,0,0,0|1,0,0]=2 133 B13R1.139 COC(=O)C1=CC=C(N=C=S)C=C1 SBB018019 [0,1,0,0,0,0|1,0,1]=3 134 B13R1.187 CNS(=O)(=O)C1=CC=C(OC)C=C1 SBB092790 [0,1,0,0,0,0|2,0,0]=3 135 B13R1.452 CCCC(=O)C1=CC=C(CC)C=C1 SBB056543 [0,1,0,0,0,0|2,0,0]=3 136 B13R1.452 CCCC(=O)C1=CC=C(OC)C=C1 SBB048006 [0,1,0,0,0,0|1,0,0]=2 137 B13R1.452 CCOC(=O)C1=CC=C(CBr)C=C1 SBB063062 [0,1,0,0,0,0|2,0,0]=3 138 B13R1.452 CCOC(=O)C1=CC=C(OC)C=C1 SBB071416 [0,1,0,0,0,0|0,0,0]=1 139 B13R1.452 CCOC(=O)C1=CN=C(SC)N=C1 SBB065718 [0,1,0,0,0,0|2,1,0]=4 140 B13R1.452 CNCC(O)C1=CC=C(OC)C=C1 SBB027278 [0,1,0,0,0,0|1,0,2]=4 141 B13R1.452 COC1=CC=C(C(=O)CC#N)C=C1 SBB064537 [0,1,0,0,0,0|1,0,1]=3 142 B13R1.452 COC1=CC=C(C(=O)CCCl)C=C1 SBB055437 [0,1,0,0,0,0|1,0,0]=2 143 B13R1.537 CCC(=O)C1=CC=C(C(C)C)C=C1 SBB028616 [0,1,0,0,0,0|2,0,0]=3 144 B13R1.537 CN(C)C1=CC=C(C(=O)CBr)C=C1 SBB099538 [0,1,0,0,0,0|3,0,0]=4 145 B13R1.537 CN(C)C1=CC=C(C(=O)NN)C=C1 SBB017612 [0,1,0,0,0,0|3,0,0]=4 146 B13R1.537 CNC(=O)C1=CC=C(B(O)O)C=C1 SBB071064 [0,1,0,0,0,0|3,0,0]=4 147 B13R1.537 COC(=O)C1=CC=C(B(O)O)C=C1 SBB048077 [0,1,0,0,0,0|2,0,0]=3 148 B13R1.537 COC(=O)C1=CC=C(C(=O)O)C=C1 SBB052833 [0,1,0,0,0,0|2,0,0]=3 149 B13R1.537 COC(=O)C1=CC=C(C(C)=O)C=C1 SBB064206 [0,1,0,0,0,0|1,0,0]=2 150 B13R1.537 COC(=O)C1=CC=C(C(N)=O)C=C1 SBB072629 [0,1,0,0,0,0|2,0,0]=3 151 B13R1.537 COC(=O)C1=CC=C([N+](=O)[O-])C=C1 SBB063145 [0,1,0,0,0,0|2,0,0]=3 152 B13R1.537 COC(=O)C1=CN=C(C(=O)O)C=C1 SBB053022 [0,1,0,0,0,0|3,0,0]=4 153 B13R1.537 COC(=O)C1=NC=C(C(=O)O)C=C1 SBB053822 [0,1,0,0,0,0|3,0,0]=4 154 B13R1.3088 CCC(=O)C1=CC(Cl)=C(OC)C=C1 SBB019454 [0,1,0,0,0,0|1,0,0]=2 155 B13R1.3088 CNC(=O)C1=CC=C(OC)C(Br)=C1 SBB080409 [0,1,0,0,0,0|1,0,0]=2 156 B13R1.3088 COC(=O)C1=CC(I)=C(OC)C=C1 SBB053703 [0,1,0,0,0,0|0,0,0]=1 157 B13R1.3088 COC(=O)C1=CC(N)=C(OC)C=C1 SBB053702 [0,1,0,0,0,0|0,0,0]=1 158 B13R1.3088 COC(=O)C1=CC=C(OC)C(Br)=C1 SBB067797 [0,1,0,0,0,0|0,0,0]=1 159 B13R1.3088 COC(=O)C1=CC=C(OC)C(O)=C1 SBB064951 [0,1,0,0,0,0|0,0,0]=1 160 B13R1.3088 COC1=CC=C(C(=O)NN)C=C1Br SBB079930 [0,1,0,0,0,0|2,0,0]=3 161 B13R1.3088 COC1=CC=C(C(=O)NN)C=C1I SBB079921 [0,1,0,0,0,0|2,0,0]=3 162 B13R2.2130 COC1=CC2=C(C=C1)C(=O)CC2 SBB066990 [0,0,0,1,0,0|1,0,0]=2 163 B13R2.2130 COC1=CC=C2C(=O)COC2=C1 SBB038186 [0,0,0,1,0,0|2,0,0]=3 164 B13R2.2130 N#CC1=CC=C2C(=O)CCC2=C1 SBB068238 [0,0,0,1,0,0|3,0,0]=4 165 B11R1.44 CCC1=CC(C(=O)OC)=CS1 SBB024663 [0,0,0,0,1,0|2,0,0]=3 166 B11R1.44 CCN1C=CC(C(=O)OC)=N1 SBB025124 [0,0,0,0,1,0|3,0,0]=4 167 B11R1.44 COC(=O)C1=CC(C=O)=CS1 SBB051469 [0,0,0,0,1,0|3,0,0]=4 168 B11R1.44 COC(=O)C1=CC=C(CBr)S1 SBB019100 [0,0,0,0,1,0|3,0,0]=4 169 B11R1.44 COC(=O)C1=CC=C(CCl)O1 SBB003794 [0,0,0,0,1,0|3,0,0]=4 170 B11R1.44 COC(=O)C1=CC=C(CCl)S1 SBB000291 [0,0,0,0,1,0|3,0,0]=4 171 B13R1.5 C(=O)C1=CC=C(OC(=O)CC)C=C1 SBB008232 [0,0,0,0,0,1|3,0,0]=4 172 B13R1.5 CCC1=CC=C(NC(=O)CCl)C=C1 SBB000368 [0,0,0,0,0,1|3,0,0]=4 173 B13R1.5 CNC(=S)NC1=CC=C(OC)C=C1 SBB000355 [0,0,0,0,0,1|1,1,0]=3 174 B13R1.5 COC(=O)NC1=CC=C(OC)C=C1 SBB089787 [0,0,0,0,0,1|0,0,0]=1 175 B13R1.5 COC1=CC=C(CC(=O)NN)C=C1 SBB059654 [0,0,0,0,0,1|2,0,0]=3 176 B13R1.5 COC1=CC=C(NC(=O)CBr)C=C1 SBB080043 [0,0,0,0,0,1|2,0,0]=3 177 B13R1.5 COC1=CC=C(NC(=O)CCl)C=C1 SBB017384 [0,0,0,0,0,1|2,0,0]=3 178 B13R1.5 COC1=CC=C(NC(=S)NN)C=C1 SBB038434 [0,0,0,0,0,1|2,1,0]=4 179 B10R1.3 C#CC1=CC=C(C=O)C=C1 SBB064928 [2,0,0,0,0,0|1,0,1]=4 180 B10R1.3 C#CC1=CC=C(OC)C=C1 SBB063612 [2,0,0,0,0,0|0,0,2]=4 181 B10R1.3 C(=O)C1=CC=C(C#N)C=C1 SBB008634 [2,0,0,0,0,0|2,0,0]=4 182 B10R1.3 C(=O)C1=CC=C(C=O)C=C1 SBB012343 [2,0,0,0,0,0|2,0,0]=4 183 B10R1.3 CCC1=CC=C(C=O)C=C1 SBB040197 [2,0,0,0,0,0|1,0,0]=3 184 B10R1.3 CCC1=CC=C(CC)C=C1 SBB061169 [2,0,0,0,0,0|1,0,1]=4 185 B10R1.3 CCC1=CC=C(OC)C=C1 SBB060457 [2,0,0,0,0,0|0,0,1]=3 186 B10R1.3 CNC1=CC=C(OC)C=C1 SBB072645 [2,0,0,0,0,0|1,0,0]=3 187 B10R1.3 COC1=CC=C(C#N)C=C1 SBB059484 [2,0,0,0,0,0|1,0,1]=4 188 B10R1.3 COC1=CC=C(C=O)C=C1 SBB040224 [2,0,0,0,0,0|0,0,0]=2 189 B10R1.3 COC1=CC=C(C=O)C=N1 SBB052248 [2,0,0,0,0,0|1,0,0]=3 190 B10R1.3 COC1=CC=C(CBr)C=C1 SBB054916 [2,0,0,0,0,0|1,0,1]=4 191 B10R1.3 COC1=CC=C(CCl)C=C1 SBB040608 [2,0,0,0,0,0|1,0,1]=4 192 B10R1.3 COC1=CC=C(CN)C=C1 SBB040460 [2,0,0,0,0,0|1,0,1]=4 193 B10R1.3 COC1=CC=C(CO)C=C1 SBB063123 [2,0,0,0,0,0|0,0,1]=3 194 B10R1.3 COC1=CC=C(NN)C=C1 SBB012784 [2,0,0,0,0,0|2,0,0]=4 195 B10R1.3 COC1=CC=C(NN)C=C1 SBB063180 [2,0,0,0,0,0|2,0,0]=4 196 B10R1.3 COC1=CC=C(OC)C=C1 SBB060067 [2,0,0,0,0,0|0,0,0]=2 197 B10R1.3 COC1=NC=C(C=O)C=N1 SBB018979 [2,0,0,0,0,0|2,0,0]=4 198 B10R1.3 CSC1=CC=C(C=O)C=C1 SBB040212 [2,0,0,0,0,0|0,1,0]=3 199 B10R1.3 CSC1=CC=C(CO)C=C1 SBB064786 [2,0,0,0,0,0|0,1,1]=4 200 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 SBB040244 [2,0,0,0,0,0|1,0,0]=3 201 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 SBB055637 [2,0,0,0,0,0|2,0,0]=4 202 B10R1.13 CC(=O)C1=CC=C(C)C=C1 SBB058845 [2,0,0,0,0,0|0,0,0]=2 203 B10R1.13 CC(=O)C1=CC=C(C)N=C1 SBB055610 [2,0,0,0,0,0|1,0,0]=3 204 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 SBB040243 [2,0,0,0,0,0|1,0,0]=3 205 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 SBB055593 [2,0,0,0,0,0|2,0,0]=4 206 B10R1.13 CC(=O)C1=CC=C(F)C=C1 SBB040257 [2,0,0,0,0,0|1,0,0]=3 207 B10R1.13 CC(=O)C1=CC=C(I)C=C1 SBB058956 [2,0,0,0,0,0|1,0,0]=3 208 B10R1.13 CC(=O)C1=CC=C(N)C=C1 SBB040278 [2,0,0,0,0,0|1,0,0]=3 209 B10R1.13 CC(=O)C1=CC=C(O)C=C1 SBB040251 [2,0,0,0,0,0|0,0,0]=2 210 B10R1.13 CC(N)C1=CC=C(O)C=C1 SBB008453 [2,0,0,0,0,0|1,0,1]=4 211 B10R1.13 CC(N)C1=CC=C(O)C=C1 SBB080372 [2,0,0,0,0,0|1,0,1]=4 212 B10R1.13 CC1=CC=C(B(O)O)C=C1 SBB048068 [2,0,0,0,0,0|1,0,1]=4 213 B10R1.13 CC1=CC=C(C(=N)N)C=C1 SBB088463 [2,0,0,0,0,0|2,0,0]=4 214 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 SBB058746 [2,0,0,0,0,0|1,0,0]=3 215 B10R1.13 CC1=CC=C(C(=O)O)C=C1 SBB040516 [2,0,0,0,0,0|0,0,0]=2 216 B10R1.13 CC1=CC=C(C(=O)O)C=N1 SBB006666 [2,0,0,0,0,0|1,0,0]=3 217 B10R1.13 CC1=CC=C(C(C)C)C=C1 SBB060399 [2,0,0,0,0,0|1,0,1]=4 218 B10R1.13 CC1=CC=C(C(C)N)C=C1 SBB010017 [2,0,0,0,0,0|1,0,1]=4 219 B10R1.13 CC1=CC=C(C(C)O)C=C1 SBB061733 [2,0,0,0,0,0|0,0,2]=4 220 B10R1.13 CC1=CC=C(C(N)=O)C=C1 SBB007862 [2,0,0,0,0,0|1,0,0]=3 221 B10R1.13 CC1=CC=C(C(N)=S)C=C1 SBB016502 [2,0,0,0,0,0|1,1,0]=4 222 B10R1.13 CC1=CN=C(C(=O)O)C=C1 SBB052876 [2,0,0,0,0,0|1,0,0]=3 223 B10R1.13 CC1=NC=C(C(=O)O)C=N1 SBB053220 [2,0,0,0,0,0|2,0,0]=4 224 B10R1.13 CC1=NC=C(C(=O)O)N=C1 SBB006622 [2,0,0,0,0,0|2,0,0]=4 225 B10R1.13 CC1=NC=C(C(N)=O)C=C1 SBB028251 [2,0,0,0,0,0|2,0,0]=4 226 B10R1.13 NC(=O)C1=CC=C(F)C=C1 SBB086057 [2,0,0,0,0,0|2,0,0]=4 227 B10R1.13 NC(=O)C1=CC=C(N)C=C1 SBB028159 [2,0,0,0,0,0|2,0,0]=4 228 B10R1.13 NC(=O)C1=CC=C(O)C=C1 SBB058350 [2,0,0,0,0,0|1,0,0]=3 229 B10R1.13 NC(=S)C1=CC=C(O)C=C1 SBB066605 [2,0,0,0,0,0|1,1,0]=4 230 B10R1.13 NC1=CC=C(C(=O)O)C=C1 SBB058665 [2,0,0,0,0,0|1,0,0]=3 231 B10R1.13 NC1=CC=C(C(=O)O)C=N1 SBB004186 [2,0,0,0,0,0|2,0,0]=4 232 B10R1.13 NC1=CC=C(C(=O)O)N=C1 SBB028257 [2,0,0,0,0,0|2,0,0]=4 233 B10R1.13 NC1=CC=C(S(=O)O)C=C1 SBB072620 [2,0,0,0,0,0|2,0,0]=4 234 B10R1.13 O=C(Cl)C1=CC=C(Br)C=C1 SBB058718 [2,0,0,0,0,0|2,0,0]=4 235 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 SBB058751 [2,0,0,0,0,0|2,0,0]=4 236 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 SBB040628 [2,0,0,0,0,0|2,0,0]=4 237 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 SBB040519 [2,0,0,0,0,0|1,0,0]=3 238 B10R1.13 O=C(O)C1=CC=C(Br)C=N1 SBB028529 [2,0,0,0,0,0|2,0,0]=4 239 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 SBB040517 [2,0,0,0,0,0|1,0,0]=3 240 B10R1.13 O=C(O)C1=CC=C(Cl)C=N1 SBB062819 [2,0,0,0,0,0|2,0,0]=4 241 B10R1.13 O=C(O)C1=CC=C(Cl)N=C1 SBB004004 [2,0,0,0,0,0|2,0,0]=4 242 B10R1.13 O=C(O)C1=CC=C(F)C=C1 SBB008568 [2,0,0,0,0,0|1,0,0]=3 243 B10R1.13 O=C(O)C1=CC=C(F)N=C1 SBB065228 [2,0,0,0,0,0|2,0,0]=4 244 B10R1.13 O=C(O)C1=CC=C(I)C=C1 SBB063146 [2,0,0,0,0,0|1,0,0]=3 245 B10R1.13 O=C(O)C1=CC=C(O)N=C1 SBB004181 [2,0,0,0,0,0|1,0,0]=3 246 B10R1.13 O=C(O)C1=CC=[N+]([O-])C=C1 SBB052968 [2,0,0,0,0,0|1,0,1]=4 247 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 SBB028530 [2,0,0,0,0,0|2,0,0]=4 248 B10R1.13 O=C(O)C1=CN=C(S)C=C1 SBB004027 [2,0,0,0,0,0|1,1,0]=4 249 B10R1.13 O=C(O)C1=NC=C(F)C=C1 SBB065401 [2,0,0,0,0,0|2,0,0]=4 250 B10R1.13 O=C(O)C1=NC=C(O)C=C1 SBB052998 [2,0,0,0,0,0|1,0,0]=3 251 B10R1.13 O=C(O)C1=NC=C(O)N=C1 SBB047806 [2,0,0,0,0,0|2,0,0]=4 252 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 SBB040875 [2,0,0,0,0,0|1,0,1]=4 253 B10R1.13 OC(=O)C1=COC(=O)C=C1 SBB004170 [2,0,0,0,0,0|1,0,1]=4 254 B10R1.1 CC1=CC=C(CON)C=C1 SBB021738 [2,0,0,0,0,0|1,0,1]=4 255 B10R1.1 CCCC1=CC=C(O)C=C1 SBB055506 [2,0,0,0,0,0|1,0,1]=4 256 B10R1.1 CCOC1=CC=C(C)C=C1 SBB060988 [2,0,0,0,0,0|2,0,0]=4 257 B10R1.1 CCOC1=CC=C(O)C=C1 SBB043810 [2,0,0,0,0,0|2,0,0]=4 258 B10R1.1 CNCC1=CC=C(C)C=C1 SBB079252 [2,0,0,0,0,0|1,0,1]=4 259 B10R1.1 CNCC1=CC=C(O)C=C1 SBB046545 [2,0,0,0,0,0|1,0,1]=4 260 B10R1.1 O\N=C\C1=CC=C(O)C=C1 SBB080079 [2,0,0,0,0,0|2,0,0]=4 261 B10R1.15 C#CC(=O)C1=CC=CC=C1 SBB012771 [2,0,0,0,0,0|1,0,1]=4 262 B10R1.15 CCC(=O)C1=CC=CC=C1 SBB058853 [2,0,0,0,0,0|1,0,0]=3 263 B10R1.15 CCC(=O)C1=CC=NC=C1 SBB068976 [2,0,0,0,0,0|2,0,0]=4 264 B10R1.15 CNC(=O)C1=CC=CC=C1 SBB051421 [2,0,0,0,0,0|1,0,0]=3 265 B10R1.15 COC(=N)C1=CC=CC=C1 SBB055305 [2,0,0,0,0,0|1,0,0]=3 266 B10R1.15 COC(=O)C1=CC=CC=C1 SBB058212 [2,0,0,0,0,0|0,0,0]=2 267 B10R1.15 COC(=O)C1=CC=CC=N1 SBB008127 [2,0,0,0,0,0|1,0,0]=3 268 B10R1.15 COC(=O)C1=CC=NC=C1 SBB058848 [2,0,0,0,0,0|1,0,0]=3 269 B10R1.15 COC(=O)C1=CN=CC=C1 SBB040924 [2,0,0,0,0,0|1,0,0]=3 270 B10R1.15 COC(=O)C1=NC=CC=N1 SBB053945 [2,0,0,0,0,0|2,0,0]=4 271 B10R1.15 COC(=O)C1=NC=CN=C1 SBB053939 [2,0,0,0,0,0|2,0,0]=4 272 B10R1.15 COC(=O)C1=NC=NC=C1 SBB053949 [2,0,0,0,0,0|2,0,0]=4 273 B10R1.15 N#CC(=O)C1=CC=CC=C1 SBB058756 [2,0,0,0,0,0|2,0,0]=4 274 B10R1.15 NCC(=O)C1=CC=CC=C1 SBB063139 [2,0,0,0,0,0|2,0,0]=4 275 B10R1.15 NCC(=O)C1=CC=CC=C1 SBB066026 [2,0,0,0,0,0|2,0,0]=4 276 B10R1.15 NNC(=O)C1=CC=CC=C1 SBB040976 [2,0,0,0,0,0|2,0,0]=4 277 B10R1.15 O=C(CO)C1=CC=CC=C1 SBB085926 [2,0,0,0,0,0|2,0,0]=4 278 B10R1.15 O=C(NO)C1=CC=CC=C1 SBB058405 [2,0,0,0,0,0|2,0,0]=4 279 B10R1.15 O=CC(=O)C1=CC=CC=C1 SBB068905 [2,0,0,0,0,0|2,0,0]=4 280 B10R1.15 [NH3+]CC(=O)C1=CC=CC=C1 SBB061439 [2,0,0,0,0,0|2,0,0]=4 281 B12R1.6 COC1=CC=C(C(C)(C)C)C=C1 SBB061019 [1,1,0,0,0,0|1,0,1]=4 282 B12R1.6 COC1=CC=C(C(C)(C)O)C=C1 SBB054762 [1,1,0,0,0,0|0,0,2]=4 283 B12R1.6 COC1=CC=C(S(=O)(=O)Cl)C=C1 SBB040956 [1,1,0,0,0,0|1,0,1]=4 284 B12R1.48 CCC1=CC=C(C(=O)O)C=C1Br SBB067754 [1,1,0,0,0,0|1,0,0]=3 285 B12R1.48 COC1=C(Br)C=C(C(=O)O)C=C1 SBB009955 [1,1,0,0,0,0|0,0,0]=2 286 B12R1.48 COC1=C(C)C=C(B(O)O)C=C1 SBB005903 [1,1,0,0,0,0|1,0,1]=4 287 B12R1.48 COC1=C(Cl)C=C(C(=O)O)C=C1 SBB019257 [1,1,0,0,0,0|0,0,0]=2 288 B12R1.48 COC1=C(Cl)C=C(C(=O)O)C=N1 SBB052951 [1,1,0,0,0,0|1,0,0]=3 289 B12R1.48 COC1=C(F)C=C(B(O)O)C=C1 SBB088352 [1,1,0,0,0,0|1,0,1]=4 290 B12R1.48 COC1=C(F)C=C(C(=O)O)C=C1 SBB006649 [1,1,0,0,0,0|0,0,0]=2 291 B12R1.48 COC1=C(F)C=C(C(C)=O)C=C1 SBB064189 [1,1,0,0,0,0|0,0,0]=2 292 B12R1.48 COC1=C(N)C=C(C(=O)O)C=C1 SBB058403 [1,1,0,0,0,0|0,0,0]=2 293 B12R1.48 COC1=C(N)C=C(C(C)=O)C=C1 SBB018620 [1,1,0,0,0,0|0,0,0]=2 294 B12R1.48 COC1=C(N)C=C(C(N)=O)C=C1 SBB058396 [1,1,0,0,0,0|1,0,0]=3 295 B12R1.48 COC1=C(N)C=C([N+](=O)[O-])C=C1 SBB058786 [1,1,0,0,0,0|1,0,1]=4 296 B12R1.48 COC1=C(O)C=C(C(=O)O)C=C1 SBB058347 [1,1,0,0,0,0|0,0,0]=2 297 B12R1.48 COC1=CC=C(C(=O)Cl)C=C1F SBB067908 [1,1,0,0,0,0|1,0,0]=3 298 B12R1.48 COC1=CC=C(C(=O)O)C=C1C SBB017677 [1,1,0,0,0,0|0,0,0]=2 299 B12R1.48 COC1=CC=C(C(=O)O)C=C1I SBB064700 [1,1,0,0,0,0|0,0,0]=2 300 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1Br SBB054167 [1,1,0,0,0,0|1,0,1]=4 301 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1Cl SBB064058 [1,1,0,0,0,0|1,0,1]=4 302 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1F SBB063398 [1,1,0,0,0,0|1,0,1]=4 303 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1I SBB064805 [1,1,0,0,0,0|1,0,1]=4 304 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1O SBB063219 [1,1,0,0,0,0|1,0,1]=4 305 B12R1.113 CC(=O)C1=CC=C(CCCl)C=C1 SBB089965 [1,1,0,0,0,0|1,0,0]=3 306 B12R1.113 CC(=O)C1=CC=C(N=C=O)C=C1 SBB046961 [1,1,0,0,0,0|1,0,1]=4 307 B12R1.113 CC(=O)C1=CC=C(N=C=S)C=C1 SBB032972 [1,1,0,0,0,0|1,0,1]=4 308 B12R1.113 CCCC1=CC=C(C(C)=O)C=C1 SBB007807 [1,1,0,0,0,0|1,0,0]=3 309 B12R1.113 CCOC1=CC=C(B(O)O)C=C1 SBB087954 [1,1,0,0,0,0|1,0,1]=4 310 B12R1.113 CCOC1=CC=C(C(=O)Cl)C=C1 SBB067896 [1,1,0,0,0,0|1,0,0]=3 311 B12R1.113 CCOC1=CC=C(C(=O)O)C=C1 SBB015394 [1,1,0,0,0,0|0,0,0]=2 312 B12R1.113 CCOC1=CC=C(C(=O)O)C=N1 SBB010479 [1,1,0,0,0,0|1,0,0]=3 313 B12R1.113 CCOC1=CC=C(C(C)=O)C=C1 SBB040279 [1,1,0,0,0,0|0,0,0]=2 314 B12R1.113 CCOC1=CC=C(C(C)N)C=C1 SBB007021 [1,1,0,0,0,0|1,0,1]=4 315 B12R1.113 CCOC1=CC=C([N+](=O)[O-])C=C1 SBB058653 [1,1,0,0,0,0|1,0,1]=4 316 B12R1.113 CCSC1=CC=C(C(=O)O)C=C1 SBB000236 [1,1,0,0,0,0|0,1,0]=3 317 B12R1.113 COCC1=CC=C(C(=O)O)C=C1 SBB010473 [1,1,0,0,0,0|0,0,0]=2 318 B12R1.113 N#CCC1=CC=C(C(=O)O)C=C1 SBB052656 [1,1,0,0,0,0|1,0,1]=4 319 B12R1.113 OC(=O)C1=CC=C(CCC)C=C1 SBB006558 [1,1,0,0,0,0|1,0,0]=3 320 B12R1.256 C=C(C)C1=CC=C(C(=C)C)C=C1 SBB061144 [1,1,0,0,0,0|2,0,0]=4 321 B12R1.256 CC(=O)C1=CC=C(B(O)O)C=C1 SBB000146 [1,1,0,0,0,0|2,0,0]=4 322 B12R1.256 CC(=O)C1=CC=C(C(=O)O)C=C1 SBB051425 [1,1,0,0,0,0|1,0,0]=3 323 B12R1.256 CC(=O)C1=CC=C(C(C)=O)C=C1 SBB008588 [1,1,0,0,0,0|1,0,0]=3 324 B12R1.256 CC(=O)C1=CC=C(C(C)C)C=C1 SBB063211 [1,1,0,0,0,0|1,0,0]=3 325 B12R1.256 CC(=O)C1=CC=C(N(C)C)C=C1 SBB007875 [1,1,0,0,0,0|1,0,0]=3 326 B12R1.256 CC(=O)C1=CC=C([N+](=O)[O-])C=C1 SBB040245 [1,1,0,0,0,0|2,0,0]=4 327 B12R1.256 CC(=O)C1=CC=C([N+](=O)[O-])C=C1 SBB060947 [1,1,0,0,0,0|2,0,0]=4 328 B12R1.256 CC(C)C1=CC=C(C(=O)O)C=C1 SBB063138 [1,1,0,0,0,0|1,0,0]=3 329 B12R1.256 CN(C)C1=CC=C(C(=O)Cl)C=C1 SBB053620 [1,1,0,0,0,0|2,0,0]=4 330 B12R1.256 CN(C)C1=CC=C(C(=O)O)C=C1 SBB040528 [1,1,0,0,0,0|1,0,0]=3 331 B12R1.256 NC(=O)C1=CC=C(C(=O)O)C=C1 SBB087883 [1,1,0,0,0,0|2,0,0]=4 332 B12R1.256 OB(O)C1=CC=C(C(=O)O)C=C1 SBB003899 [1,1,0,0,0,0|2,0,0]=4 333 B12R1.256 OC(=O)C1=CC=C([N+](=O)[O-])C=C1 SBB058196 [1,1,0,0,0,0|2,0,0]=4 334 B12R1.452 COC1=CC(F)=C(C(=O)Cl)C=C1 SBB090844 [1,1,0,0,0,0|1,0,0]=3 335 B12R1.452 COC1=CC(F)=C(C(C)=O)C=C1 SBB064080 [1,1,0,0,0,0|0,0,0]=2 336 B12R1.452 COC1=CC(F)=C(C(N)=O)C=C1 SBB088263 [1,1,0,0,0,0|1,0,0]=3 337 B12R1.452 COC1=CC=C(B(O)O)C(Cl)=C1 SBB071194 [1,1,0,0,0,0|1,0,1]=4 338 B12R1.452 COC1=CC=C(B(O)O)C(F)=C1 SBB052527 [1,1,0,0,0,0|1,0,1]=4 339 B12R1.452 COC1=CC=C(C(=O)O)C(C)=C1 SBB052683 [1,1,0,0,0,0|0,0,0]=2 340 B12R1.452 COC1=CC=C(C(=O)O)C(F)=C1 SBB052739 [1,1,0,0,0,0|0,0,0]=2 341 B12R1.452 COC1=CC=C(C(=O)O)C(N)=C1 SBB016770 [1,1,0,0,0,0|0,0,0]=2 342 B12R1.452 COC1=CC=C(C(=O)O)C(O)=C1 SBB063950 [1,1,0,0,0,0|0,0,0]=2 343 B12R1.452 COC1=CC=C(C(C)=O)C(O)=C1 SBB066134 [1,1,0,0,0,0|0,0,0]=2 344 B12R1.452 COC1=CC=C([N+](=O)[O-])C(C)=C1 SBB055094 [1,1,0,0,0,0|1,0,1]=4 345 B12R1.452 COC1=CC=C([N+](=O)[O-])C(N)=C1 SBB051714 [1,1,0,0,0,0|1,0,1]=4 346 B12R1.452 COC1=CC=C([N+](=O)[O-])C(O)=C1 SBB008609 [1,1,0,0,0,0|1,0,1]=4 347 B12R1.452 N#CC1=CC(F)=C(C(=O)O)C=C1 SBB028478 [1,1,0,0,0,0|2,0,0]=4 348 B12R1.9 CNS(=O)(=O)C1=CC=C(C)C=C1 SBB058120 [1,1,0,0,0,0|2,0,0]=4 349 B12R1.9 COS(=O)(=O)C1=CC=C(C)C=C1 SBB058206 [1,1,0,0,0,0|1,0,0]=3 350 B12R1.12 CC\C(=N/O)C1=CC=C(C)C=C1 SBB020243 [1,1,0,0,0,0|1,0,1]=4 351 B12R1.12 CC\C(=N\O)C1=CC=C(O)C=C1 SBB080217 [1,1,0,0,0,0|1,0,1]=4 352 B12R1.16 CC1=CC=C(C(=O)CC#N)C=C1 SBB005351 [1,1,0,0,0,0|1,0,1]=4 353 B12R1.16 CC1=CC=C(C(=O)CCCl)C=C1 SBB063951 [1,1,0,0,0,0|1,0,0]=3 354 B12R1.16 CCCC(=O)C1=CC=C(Br)C=C1 SBB065069 [1,1,0,0,0,0|2,0,0]=4 355 B12R1.16 CCCC(=O)C1=CC=C(C)C=C1 SBB017369 [1,1,0,0,0,0|1,0,0]=3 356 B12R1.16 CCCC(=O)C1=CC=C(F)C=C1 SBB088007 [1,1,0,0,0,0|2,0,0]=4 357 B12R1.16 CCCC(=O)C1=CC=C(N)C=C1 SBB017672 [1,1,0,0,0,0|2,0,0]=4 358 B12R1.16 CCCC(=O)C1=CC=C(O)C=C1 SBB001584 [1,1,0,0,0,0|1,0,0]=3 359 B12R1.16 CCNC(=O)C1=CC=C(N)C=C1 SBB017849 [1,1,0,0,0,0|2,0,0]=4 360 B12R1.16 CCOC(=N)C1=CC=C(O)C=C1 SBB057804 [1,1,0,0,0,0|1,0,0]=3 361 B12R1.16 CCOC(=O)C1=CC=C(Br)C=C1 SBB065108 [1,1,0,0,0,0|1,0,0]=3 362 B12R1.16 CCOC(=O)C1=CC=C(C)C=C1 SBB064875 [1,1,0,0,0,0|0,0,0]=2 363 B12R1.16 CCOC(=O)C1=CC=C(Cl)C=C1 SBB040855 [1,1,0,0,0,0|1,0,0]=3 364 B12R1.16 CCOC(=O)C1=CC=C(Cl)N=C1 SBB053795 [1,1,0,0,0,0|2,0,0]=4 365 B12R1.16 CCOC(=O)C1=CC=C(F)C=C1 SBB063137 [1,1,0,0,0,0|1,0,0]=3 366 B12R1.16 CCOC(=O)C1=CC=C(I)C=C1 SBB058455 [1,1,0,0,0,0|1,0,0]=3 367 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 SBB028356 [1,1,0,0,0,0|1,0,0]=3 368 B12R1.16 CCOC(=O)C1=CC=C(O)C=C1 SBB038536 [1,1,0,0,0,0|0,0,0]=2 369 B12R1.16 CNCC(=O)C1=CC=C(O)C=C1 SBB013970 [1,1,0,0,0,0|1,0,0]=3 370 B12R1.16 O=C(CCCl)C1=CC=C(Cl)C=C1 SBB063212 [1,1,0,0,0,0|2,0,0]=4 371 B12R1.16 O=C(CCCl)C1=CC=C(F)C=C1 SBB042481 [1,1,0,0,0,0|2,0,0]=4 372 B12R1.20 CC(C)C(=O)C1=CC=C(F)C=C1 SBB088008 [1,1,0,0,0,0|2,0,0]=4 373 B12R1.20 CC(Cl)C(=O)C1=CC=C(F)C=C1 SBB064057 [1,1,0,0,0,0|2,0,0]=4 374 B12R1.20 CN(C)C(=O)C1=CC=C(N)C=C1 SBB041090 [1,1,0,0,0,0|2,0,0]=4 375 B12R1.367 CC1=CC=C(C(=O)NN)C=C1Br SBB079936 [1,1,0,0,0,0|2,0,0]=4 376 B12R1.367 CC1=CC=C(C(=O)NN)C=C1C SBB021008 [1,1,0,0,0,0|2,0,0]=4 377 B12R1.367 CC1=CC=C(C(=O)NN)C=C1Cl SBB017721 [1,1,0,0,0,0|2,0,0]=4 378 B12R1.367 CCC(=O)C1=CC(Br)=C(F)C=C1 SBB097700 [1,1,0,0,0,0|2,0,0]=4 379 B12R1.367 CCC(=O)C1=CC(C)=C(O)C=C1 SBB057383 [1,1,0,0,0,0|1,0,0]=3 380 B12R1.367 CCC(=O)C1=CC(F)=C(F)C=C1 SBB055169 [1,1,0,0,0,0|2,0,0]=4 381 B12R1.367 CCC(=O)C1=CC=C(C)C(C)=C1 SBB028618 [1,1,0,0,0,0|1,0,0]=3 382 B12R1.367 CCC(=O)C1=CC=C(Cl)C(Cl)=C1 SBB058468 [1,1,0,0,0,0|2,0,0]=4 383 B12R1.367 CCC(=O)C1=CC=C(Cl)C(F)=C1 SBB090501 [1,1,0,0,0,0|2,0,0]=4 384 B12R1.367 CCC(=O)C1=CC=C(F)C(Cl)=C1 SBB090505 [1,1,0,0,0,0|2,0,0]=4 385 B12R1.367 CCC(=O)C1=CC=C(O)C(Cl)=C1 SBB090222 [1,1,0,0,0,0|1,0,0]=3 386 B12R1.367 COC(=O)C1=CC(Br)=C(Cl)N=C1 SBB053832 [1,1,0,0,0,0|2,0,0]=4 387 B12R1.367 COC(=O)C1=CC(Br)=C(N)C=C1 SBB012847 [1,1,0,0,0,0|1,0,0]=3 388 B12R1.367 COC(=O)C1=CC(Br)=C(N)N=C1 SBB053828 [1,1,0,0,0,0|2,0,0]=4 389 B12R1.367 COC(=O)C1=CC(Br)=C(O)N=C1 SBB053800 [1,1,0,0,0,0|1,0,0]=3 390 B12R1.367 COC(=O)C1=CC(C)=C(C)C=C1 SBB053730 [1,1,0,0,0,0|0,0,0]=2 391 B12R1.367 COC(=O)C1=CC(C)=C(N)C=C1 SBB053690 [1,1,0,0,0,0|1,0,0]=3 392 B12R1.367 COC(=O)C1=CC(Cl)=C(C)C=C1 SBB053740 [1,1,0,0,0,0|0,0,0]=2 393 B12R1.367 COC(=O)C1=CC(Cl)=C(Cl)C=C1 SBB093406 [1,1,0,0,0,0|1,0,0]=3 394 B12R1.367 COC(=O)C1=CC(N)=C(C)C=C1 SBB053756 [1,1,0,0,0,0|0,0,0]=2 395 B12R1.367 COC(=O)C1=CC(N)=C(N)C=C1 SBB053760 [1,1,0,0,0,0|1,0,0]=3 396 B12R1.367 COC(=O)C1=CC(N)=C(O)C=C1 SBB053757 [1,1,0,0,0,0|0,0,0]=2 397 B12R1.367 COC(=O)C1=CC(O)=C(C)C=C1 SBB053738 [1,1,0,0,0,0|0,0,0]=2 398 B12R1.367 COC(=O)C1=CC(O)=C(O)C=C1 SBB058373 [1,1,0,0,0,0|0,0,0]=2 399 B12R1.367 COC(=O)C1=CC=C(Br)C(C)=C1 SBB064631 [1,1,0,0,0,0|1,0,0]=3 400 B12R1.367 COC(=O)C1=CC=C(C)C(Br)=C1 SBB064768 [1,1,0,0,0,0|0,0,0]=2 401 B12R1.367 COC(=O)C1=CC=C(C)C(I)=C1 SBB068078 [1,1,0,0,0,0|0,0,0]=2 402 B12R1.367 COC(=O)C1=CC=C(Cl)C(C)=C1 SBB064720 [1,1,0,0,0,0|1,0,0]=3 403 B12R1.367 COC(=O)C1=CC=C(F)C(F)=C1 SBB068281 [1,1,0,0,0,0|1,0,0]=3 404 B12R1.367 COC(=O)C1=CC=C(F)C(N)=C1 SBB088266 [1,1,0,0,0,0|1,0,0]=3 405 B12R1.367 COC(=O)C1=CC=C(F)C(O)=C1 SBB067582 [1,1,0,0,0,0|1,0,0]=3 406 B12R1.367 COC(=O)C1=CC=C(I)C(C)=C1 SBB064772 [1,1,0,0,0,0|1,0,0]=3 407 B12R1.367 COC(=O)C1=CC=C(N)C(I)=C1 SBB064804 [1,1,0,0,0,0|1,0,0]=3 408 B12R1.367 COC(=O)C1=CC=C(N)C(O)=C1 SBB050374 [1,1,0,0,0,0|1,0,0]=3 409 B12R1.367 COC(=O)C1=CC=C(O)C(Br)=C1 SBB067796 [1,1,0,0,0,0|0,0,0]=2 410 B12R1.367 COC(=O)C1=CC=C(O)C(I)=C1 SBB068813 [1,1,0,0,0,0|0,0,0]=2 411 B12R1.367 COC(=O)C1=COC(=O)C(Br)=C1 SBB054033 [1,1,0,0,0,0|1,0,1]=4 412 B12R1.367 NC1=C(Cl)C=C(C(=O)OC)C=C1 SBB003712 [1,1,0,0,0,0|1,0,0]=3 413 B12R1.367 NNC(=O)C1=CC(O)=C(O)C=C1 SBB057990 [1,1,0,0,0,0|2,0,0]=4 414 B12R1.367 O=C(CCl)C1=CC(O)=C(O)C=C1 SBB063277 [1,1,0,0,0,0|2,0,0]=4 415 B12R1.1703 CC1=CC(Cl)=C(C(=O)NN)C=C1 SBB072898 [1,1,0,0,0,0|2,0,0]=4 416 B12R1.1703 CCC(=O)C1=C(F)C=C(F)C=C1 SBB064045 [1,1,0,0,0,0|2,0,0]=4 417 B12R1.1703 CCC(=O)C1=C(O)C=C(O)C=C1 SBB057457 [1,1,0,0,0,0|1,0,0]=3 418 B12R1.1703 CCC(=O)C1=CC=C(C)C=C1C SBB028615 [1,1,0,0,0,0|1,0,0]=3 419 B12R1.1703 CCC(=O)C1=CC=C(Cl)C=C1Cl SBB016918 [1,1,0,0,0,0|2,0,0]=4 420 B12R1.1703 CCC(=O)C1=CC=C(Cl)C=C1Cl SBB016920 [1,1,0,0,0,0|2,0,0]=4 421 B12R1.1703 COC(=O)C1=C(Cl)C=C(Cl)N=C1 SBB053826 [1,1,0,0,0,0|2,0,0]=4 422 B12R1.1703 COC(=O)C1=C(Cl)N=C(Cl)C=C1 SBB093570 [1,1,0,0,0,0|2,0,0]=4 423 B12R1.1703 COC(=O)C1=C(O)C=C(C)C=C1 SBB008512 [1,1,0,0,0,0|0,0,0]=2 424 B12R1.1703 COC(=O)C1=C(O)C=C(F)C=C1 SBB064671 [1,1,0,0,0,0|1,0,0]=3 425 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1N SBB053695 [1,1,0,0,0,0|1,0,0]=3 426 B12R1.1703 COC(=O)C1=CC=C(Cl)C=C1Cl SBB064667 [1,1,0,0,0,0|1,0,0]=3 427 B12R1.1703 COC(=O)C1=CC=C(Cl)C=C1N SBB003711 [1,1,0,0,0,0|1,0,0]=3 428 B12R1.1703 COC(=O)C1=CC=C(Cl)C=C1O SBB053784 [1,1,0,0,0,0|1,0,0]=3 429 B12R1.1703 COC(=O)C1=CC=C(F)C=C1Cl SBB053708 [1,1,0,0,0,0|1,0,0]=3 430 B12R1.1703 COC(=O)C1=CC=C(F)C=C1F SBB063010 [1,1,0,0,0,0|1,0,0]=3 431 B12R1.1703 COC(=O)C1=CC=C(N)C=C1C SBB053715 [1,1,0,0,0,0|1,0,0]=3 432 B12R1.1703 COC(=O)C1=CC=C(N)C=C1O SBB053791 [1,1,0,0,0,0|1,0,0]=3 433 B12R1.1703 COC(=O)C1=CC=C(O)C=C1O SBB040072 [1,1,0,0,0,0|0,0,0]=2 434 B12R1.1703 O=C(CCl)C1=CC=C(O)C=C1O SBB010752 [1,1,0,0,0,0|2,0,0]=4 435 B12R1.4 COC1=CC=C(CC(C)=O)C=C1 SBB058529 [1,1,0,0,0,0|1,0,1]=4 436 B12R1.4 COC1=CC=C(NC(C)=O)C=C1 SBB056791 [1,1,0,0,0,0|2,0,0]=4 437 B12R1.71 COC1=CC=C(CCCN)C=C1 SBB010459 [1,1,0,0,0,0|1,0,1]=4 438 B12R1.71 COC1=CC=C(OCCBr)C=C1 SBB018220 [1,1,0,0,0,0|2,0,0]=4 439 B12R1.71 COC1=CC=C(OCCN)C=C1 SBB002492 [1,1,0,0,0,0|2,0,0]=4 440 B12R1.71 COC1=CC=C(OCCO)C=C1 SBB055468 [1,1,0,0,0,0|2,0,0]=4 441 B12R1.116 CCOC1=CC=C(OCC)C=C1 SBB060362 [1,1,0,0,0,0|2,0,0]=4 442 B12R1.608 CCC1=CC(C(=O)OC)=C(N)S1 SBB019618 [0,1,0,0,1,0|2,0,0]=4 443 B14R1.24 CCOC1=CC=C(NC(=O)CCl)C=C1 SBB000538 [0,1,0,0,0,1|2,0,0]=4 444 B14R1.24 COC(=O)CC1=CC=C(N=C=S)C=C1 SBB013662 [0,1,0,0,0,1|1,0,1]=4 445 B14R1.954 CCNC(=S)NC1=CC=C(OC)C=C1 SBB000500 [0,1,0,0,0,1|1,1,0]=4 446 B14R1.954 CCOC(=O)CC1=CC=C(NN)C=C1 SBB053734 [0,1,0,0,0,1|2,0,0]=4 447 B14R1.954 COC1=CC=C(NC(=O)CC#N)C=C1 SBB023435 [0,1,0,0,0,1|1,0,1]=4 448 B14R1.954 COC1=CC=C(NC(=O)CCCl)C=C1 SBB040631 [0,1,0,0,0,1|1,0,0]=3 449 B14R1.954 COC1=CC=C(NC(=O)CCN)C=C1 SBB018517 [0,1,0,0,0,1|1,0,0]=3 450 B14R1.2879 COC(=O)OC1=CC=C(C(=O)O)C=C1 SBB052661 [0,1,0,0,0,1|2,0,0]=4 451 B14R1.3276 COC1=C(Cl)C=C(NC(=O)CCl)C=C1 SBB037899 [0,1,0,0,0,1|2,0,0]=4 452 B14R1.6402 CC(C)C(=O)C1=CC=C(C(C)C)C=C1 SBB056542 [0,2,0,0,0,0|2,0,0]=4 453 B14R1.145 CCOC1=CC=C(\C(CC)=N\O)C=C1 SBB080348 [0,2,0,0,0,0|1,0,1]=4 454 B14R1.1128 COC(=O)C1=C(Cl)C=C([N+](=O)[O-])C=C1 SBB095154 [0,2,0,0,0,0|2,0,0]=4 455 B14R1.1128 COC(=O)C1=C(F)C=C(B(O)O)C=C1 SBB064182 [0,2,0,0,0,0|2,0,0]=4 456 B14R1.1128 COC(=O)C1=C(N)C=C([N+](=O)[O-])C=C1 SBB071567 [0,2,0,0,0,0|2,0,0]=4 457 B14R1.1128 COC(=O)C1=CC=C([N+](=O)[O-])C=C1Br SBB068812 [0,2,0,0,0,0|2,0,0]=4 458 B14R1.1128 COC(=O)C1=CC=C([N+](=O)[O-])C=C1C SBB053732 [0,2,0,0,0,0|2,0,0]=4 459 B14R1.2294 CCC(=O)C1=C(O)C=C(OC)C(Br)=C1 SBB027224 [0,2,0,0,0,0|1,0,0]=3 460 B14R1.2294 COC(=O)C1=CC(Br)=C(OC)C=C1O SBB067787 [0,2,0,0,0,0|0,0,0]=2 461 B14R1.2294 COC(=O)C1=CC(F)=C(OC)N=C1Cl SBB095839 [0,2,0,0,0,0|1,0,0]=3 462 B14R1.2294 COC1=CC(C)=C(C(=O)CBr)C=C1C SBB302426 [0,2,0,0,0,0|2,0,0]=4 463 B14R1.2334 COC1=CC(OC)=C(C(=O)CCl)C=C1 SBB011306 [0,2,0,0,0,0|2,0,0]=4 464 B14R1.2334 COC1=CC=C(C(=O)CBr)C(OC)=C1 SBB063557 [0,2,0,0,0,0|2,0,0]=4 465 B14R1.25 CCOC(=O)C1=CC=C(N=C=O)C=C1 SBB091273 [0,2,0,0,0,0|1,0,1]=4 466 B14R1.25 CCOC(=O)C1=CC=C(N=C=S)C=C1 SBB055493 [0,2,0,0,0,0|1,0,1]=4 467 B14R1.25 CCOC(=O)C1=CC=C(OCC)C=C1 SBB063746 [0,2,0,0,0,0|0,0,0]=2 468 B14R1.25 CCOC1=CC=C(C(=O)CC#N)C=C1 SBB019164 [0,2,0,0,0,0|1,0,1]=4 469 B14R1.65 C=CCOC1=CC=C(C(=O)NN)C=C1 SBB005103 [0,2,0,0,0,0|2,0,0]=4 470 B14R1.65 CCCOC1=CC=C(C(=O)CC)C=C1 SBB017368 [0,2,0,0,0,0|1,0,0]=3 471 B14R1.65 COC(=O)C1=CC=C(OCCCl)C=C1 SBB302363 [0,2,0,0,0,0|0,0,0]=2 472 B14R1.717 CC(C)OC1=CC=C(C(=O)NN)C=C1 SBB091763 [0,2,0,0,0,0|2,0,0]=4 473 B14R1.717 COC(=O)C1=CC=C(NC(C)=O)C=C1 SBB091569 [0,2,0,0,0,0|1,0,0]=3 474 B14R1.717 COC(=O)C1=CC=C(OC(F)F)C=C1 SBB021284 [0,2,0,0,0,0|0,0,0]=2 475 B14R1.717 COC(=O)C1=CN=C(NC(C)=O)C=C1 SBB091721 [0,2,0,0,0,0|2,0,0]=4 476 B14R1.717 NNC(=O)C1=CC=C(OC(F)F)C=C1 SBB020663 [0,2,0,0,0,0|2,0,0]=4 477 B14R1.718 COC(=O)C1=CC=C(C(=O)OC)C=C1 SBB060564 [0,2,0,0,0,0|0,0,0]=2 478 B14R1.3175 COC1=CC=C(S(=O)(=O)CCN)C=C1 SBB018632 [0,2,0,0,0,0|2,0,0]=4 479 B14R1.3287 CCS(=O)(=O)C1=CC=C(OC)C(N)=C1 SBB051108 [0,2,0,0,0,0|2,0,0]=4 480 B14R1.2 COC1=CC=C(C(=O)CC(C)=O)C=C1 SBB017372 [0,2,0,0,0,0|1,0,0]=3 481 B14R1.2 COC1=CC=C(C(=O)C[N+](=O)[O-])C=C1 SBB116039 [0,2,0,0,0,0|2,0,0]=4 482 B14R1.610 CCCC(=O)C1=CC=C(C(C)C)C=C1 SBB056544 [0,2,0,0,0,0|2,0,0]=4 483 B14R1.610 CCOC(=O)C1=CC=C(B(O)O)C=C1 SBB063240 [0,2,0,0,0,0|2,0,0]=4 484 B14R1.610 CCOC(=O)C1=CC=C(N(C)C)C=C1 SBB063817 [0,2,0,0,0,0|1,0,0]=3 485 B14R1.610 CCOC(=O)C1=CC=C([N+](=O)[O-])C=C1 SBB058453 [0,2,0,0,0,0|2,0,0]=4 486 B14R1.926 COC1=CC=C(C(=O)CCCCl)C=C1 SBB003419 [0,2,0,0,0,0|1,0,0]=3 487 B14R1.926 COC1=CC=C(C(=O)CSC#N)C=C1 SBB072343 [0,2,0,0,0,0|0,1,1]=4 488 B14R1.719 CCC(=O)C1=CC=C(C(C)(C)C)C=C1 SBB028617 [0,2,0,0,0,0|2,0,0]=4 489 B14R1.719 COC(=O)C1=CC=C(C(C)(C)C)C=C1 SBB000305 [0,2,0,0,0,0|1,0,0]=3 490 B14R1.719 COC(=O)C1=CC=C(C(F)(F)F)C=C1 SBB063996 [0,2,0,0,0,0|2,0,0]=4 491 B14R1.719 COC(=O)C1=CC=C(S(=O)(=O)Cl)C=C1 SBB081599 [0,2,0,0,0,0|1,1,0]=4 492 B14R1.747 COC(=O)C1=CC(F)=C(B(O)O)C=C1 SBB092227 [0,2,0,0,0,0|2,0,0]=4 493 B14R1.747 COC(=O)C1=CC(N)=C(C(=O)O)C=C1 SBB053749 [0,2,0,0,0,0|2,0,0]=4 494 B14R1.747 COC(=O)C1=CC=C([N+](=O)[O-])C(C)=C1 SBB053758 [0,2,0,0,0,0|2,0,0]=4 495 B14R1.747 COC(=O)C1=CC=C([N+](=O)[O-])C(O)=C1 SBB002401 [0,2,0,0,0,0|2,0,0]=4 496 B14R1.1864 COC(=O)C1=CC(C#N)=C(OC)C=C1 SBB091277 [0,2,0,0,0,0|0,0,0]=2 497 B14R1.1864 COC(=O)C1=CC=C(CBr)C(OC)=C1 SBB017624 [0,2,0,0,0,0|2,0,0]=4 498 B14R1.1864 COC(=O)C1=CC=C(OC)C(OC)=C1 SBB058227 [0,2,0,0,0,0|0,0,0]=2 499 B14R1.1864 COC1=C(OC)C=C(C(=O)NN)C=C1 SBB038550 [0,2,0,0,0,0|2,0,0]=4 500 B14R1.1864 COC1=CC=C(C(=O)CBr)C=C1OC SBB018310 [0,2,0,0,0,0|2,0,0]=4 501 B14R1.12512 COC(=O)C1=CC(Br)=C(OC)C(Cl)=C1 SBB116043 [0,2,0,0,0,0|0,0,0]=2 502 B14R1.12512 COC1=C(Cl)C=C(C(=O)NN)C=C1Cl SBB098360 [0,2,0,0,0,0|2,0,0]=4 503 B12R1.24 COC(=O)C1=C(O)C(C)=CC=C1 SBB007735 [0,0,1,1,0,0|2,0,0]=4 504 B12R1.24 COC(=O)C1=CC=CC(C)=C1Br SBB064769 [0,0,1,1,0,0|2,0,0]=4 505 B12R1.24 COC(=O)C1=CC=CC(C)=C1N SBB045998 [0,0,1,1,0,0|2,0,0]=4 506 B12R1.78 COC1=CC=C(C=O)C(OC)=C1 SBB040221 [0,0,1,1,0,0|2,0,0]=4 507 B12R1.78 COC1=CC=C(C=O)C(OC)=N1 SBB065549 [0,0,1,1,0,0|2,0,0]=4 508 B12R2.612 CC1=CC=C2C(=O)CCC2=C1 SBB056356 [1,0,0,1,0,0|1,0,0]=3 509 B12R2.612 NC1=CC=C2C(=O)OCC2=C1 SBB007358 [1,0,0,1,0,0|1,0,0]=3 510 B12R2.612 O=C1CCC2=C1C=CC(Cl)=C2 SBB069432 [1,0,0,1,0,0|2,0,0]=4 511 B12R2.612 O=C1CCC2=CC(Br)=CC=C12 SBB054671 [1,0,0,1,0,0|2,0,0]=4 512 B12R2.612 O=C1CCC2=CC(F)=CC=C12 SBB054670 [1,0,0,1,0,0|2,0,0]=4 513 B12R2.612 O=C1COC2=CC(O)=CC=C12 SBB038967 [1,0,0,1,0,0|2,0,0]=4 514 B12R2.612 O=C1OCC2=C1C=CC(Br)=C2 SBB063188 [1,0,0,1,0,0|1,0,0]=3 515 B12R2.44 COC1=CC2=NON=C2C=C1 SBB086688 [1,0,0,1,0,0|2,0,0]=4 516 B12R2.44 COC1=CC=C2C=CNC2=C1 SBB055970 [1,0,0,1,0,0|2,0,0]=4 517 B14R2.2332 COC1=CC2=C(C=C1)NC(=O)CS2 SBB071471 [0,0,0,1,0,1|2,0,0]=4 518 B14R2.2332 COC1=CC=C2CC(=O)CCC2=C1 SBB056289 [0,0,0,1,0,1|1,0,0]=3 519 B14R2.3274 COC1=CC=C2NC(=O)C(=O)C2=C1 SBB067262 [0,0,0,1,0,1|2,0,0]=4 520 B14R2.3304 COC1=CC=C2OC(SC)=NC2=C1 SBB046568 [0,0,0,1,0,1|1,1,0]=4 521 B14R2.329 COC1=CC=C(C(=O)C2CC2)C=C1 SBB055275 [0,1,0,1,0,0|1,0,0]=3 522 B14R2.152 COC1=CC2=C(C=C1)C(C=O)=CN2 SBB005312 [0,1,0,1,0,0|2,0,0]=4 523 B14R2.1801 COC1=CC=C2C(=O)CCCC2=C1 SBB007549 [0,1,0,1,0,0|1,0,0]=3 524 B14R2.1801 COC1=CC=C2C(=O)CCOC2=C1 SBB069435 [0,1,0,1,0,0|1,0,0]=3 525 B14R2.966 CCC(=O)C1=CC=C2OCOC2=C1 SBB067417 [0,1,0,1,0,0|1,0,0]=3 526 B14R2.966 COC(=O)C1=CC2=C(C=C1)C=NN2 SBB069255 [0,1,0,1,0,0|2,0,0]=4 527 B14R2.966 COC(=O)C1=CC2=C(C=C1)NC=C2 SBB048185 [0,1,0,1,0,0|1,0,1]=4 528 B14R2.966 COC(=O)C1=CC2=C(C=C1)NC=N2 SBB038171 [0,1,0,1,0,0|1,0,1]=4 529 B14R2.966 COC(=O)C1=CC2=NON=C2C=C1 SBB018876 [0,1,0,1,0,0|1,0,0]=3 530 B14R2.966 COC(=O)C1=CC2=NSN=C2C=C1 SBB053989 [0,1,0,1,0,0|1,1,0]=4 531 B14R2.966 COC(=O)C1=CC=C2C=CNC2=C1 SBB049640 [0,1,0,1,0,0|1,0,1]=4 532 B14R2.966 COC(=O)C1=CC=C2CNCC2=C1 SBB069313 [0,1,0,1,0,0|1,0,0]=3 533 B14R2.966 COC(=O)C1=CC=C2NN=NC2=C1 SBB054052 [0,1,0,1,0,0|2,0,0]=4 534 B14R2.966 COC(=O)C1=CC=C2OCOC2=C1 SBB089638 [0,1,0,1,0,0|0,0,0]=2 535 B14R2.966 NNC(=O)C1=CC=C2OCOC2=C1 SBB028390 [0,1,0,1,0,0|2,0,0]=4 536 B14R2.966 O=C(CBr)C1=CC2=C(C=C1)OCO2 SBB038721 [0,1,0,1,0,0|2,0,0]=4 537 B10R0.46 C=C(CC(=O)OC)C(=O)OC SBB087286 [0,0,1,0,1,0|1,0,1]=4 538 B10R1.31 CCC1=CC(C(=O)O)=CS1 SBB010374 [1,0,0,0,1,0|2,0,0]=4 539 B10R1.31 CCC1=CC=C(C(=O)O)O1 SBB085435 [1,0,0,0,1,0|2,0,0]=4 540 B10R1.31 CCC1=CC=C(C(=O)O)S1 SBB019480 [1,0,0,0,1,0|2,0,0]=4 541 B10R1.31 CCC1=CC=C(C(C)=O)S1 SBB021979 [1,0,0,0,1,0|2,0,0]=4 542 B10R1.31 COC1=CC=C(C(=O)O)S1 SBB023958 [1,0,0,0,1,0|1,0,0]=3 543 B10R1.31 CSC1=CC=C(C(=O)O)S1 SBB002900 [1,0,0,0,1,0|1,1,0]=4 544 B10R1.14 COC(=O)C1=CC(Br)=CN1 SBB053897 [1,0,0,0,1,0|2,0,0]=4 545 B10R1.14 COC(=O)C1=CC(C)=NO1 SBB026808 [1,0,0,0,1,0|2,0,0]=4 546 B10R1.14 COC(=O)C1=CC=C(Br)O1 SBB041085 [1,0,0,0,1,0|2,0,0]=4 547 B10R1.14 COC(=O)C1=CC=C(C)S1 SBB027056 [1,0,0,0,1,0|1,0,0]=3 548 B10R1.14 COC(=O)C1=CC=C(N)S1 SBB014204 [1,0,0,0,1,0|2,0,0]=4 549 B10R1.14 COC(=O)C1=CN(C)N=C1 SBB116497 [1,0,0,0,1,0|2,0,0]=4 550 B10R1.14 COC(=O)C1=COC(C)=N1 SBB086182 [1,0,0,0,1,0|2,0,0]=4 551 B10R1.14 COC(=O)C1=NC=C(C)S1 SBB087214 [1,0,0,0,1,0|2,0,0]=4 552 B10R1.14 COC(=O)C1=NN(C)C=C1 SBB021345 [1,0,0,0,1,0|2,0,0]=4 553 B10R1.14 COC(=O)C1=NNC(C)=C1 SBB022982 [1,0,0,0,1,0|2,0,0]=4 554 B10R1.14 COC(=O)C1=NOC(C)=C1 SBB053925 [1,0,0,0,1,0|2,0,0]=4 555 B12R1.49 CC1=CC=C(NC(=O)CBr)C=C1 SBB050418 [1,0,0,0,0,1|2,0,0]=4 556 B12R1.49 CC1=CC=C(NC(=O)CCl)C=C1 SBB004507 [1,0,0,0,0,1|2,0,0]=4 557 B12R1.49 CC1=CC=C(NC(=O)CN)C=C1 SBB004993 [1,0,0,0,0,1|2,0,0]=4 558 B12R1.49 CC1=CC=C(NC(=O)CS)C=C1 SBB083090 [1,0,0,0,0,1|2,0,0]=4 559 B12R1.49 CC1=CC=C(OC(=O)CCl)C=C1 SBB060341 [1,0,0,0,0,1|2,0,0]=4 560 B12R1.49 CCC(=O)NC1=CC=C(N)C=C1 SBB080274 [1,0,0,0,0,1|2,0,0]=4 561 B12R1.49 CCC(=O)NC1=CC=C(O)C=C1 SBB080008 [1,0,0,0,0,1|1,0,0]=3 562 B12R1.49 CNC(=O)CC1=CC=C(N)C=C1 SBB080431 [1,0,0,0,0,1|2,0,0]=4 563 B12R1.49 CNC(=S)NC1=CC=C(C)C=C1 SBB003745 [1,0,0,0,0,1|1,1,0]=4 564 B12R1.49 COC(=O)CC1=CC=C(F)C=C1 SBB017032 [1,0,0,0,0,1|1,0,0]=3 565 B12R1.49 COC(=O)CC1=CC=C(N)C=C1 SBB059052 [1,0,0,0,0,1|1,0,0]=3 566 B12R1.49 CSC(=S)NC1=CC=C(C)C=C1 SBB042895 [1,0,0,0,0,1|0,2,0]=4 567 B12R1.435 COC(=O)C1=CC(CO)=CC=C1 SBB059613 [0,0,0,0,1,1|2,0,0]=4 568 B12R1.435 COC(=O)C1=CC=CC(CBr)=C1 SBB005793 [0,0,0,0,1,1|2,0,0]=4 569 B12R1.435 COC(=O)C1=CC=CC(OC)=C1 SBB063351 [0,0,0,0,1,1|0,0,0]=2 570 B12R1.435 COC(=O)C1=CN=CC(C#N)=C1 SBB065584 [0,0,0,0,1,1|2,0,0]=4 571 B12R1.435 COC(=O)C1=NC=CC(OC)=C1 SBB053797 [0,0,0,0,1,1|0,0,0]=2 572 B12R1.435 COC1=CC(C(=O)C=O)=CC=C1 SBB087783 [0,0,0,0,1,1|2,0,0]=4 573 B12R1.435 COC1=CC(C(=O)CBr)=CC=C1 SBB065145 [0,0,0,0,1,1|2,0,0]=4 574 B12R1.435 COC1=CC=CC(C(=O)NN)=C1 SBB032275 [0,0,0,0,1,1|2,0,0]=4 575 B14R1.5 COC(=O)COC1=CC=C(C=O)C=C1 SBB091714 [0,0,0,0,0,2|2,0,0]=4 576 B14R1.5 COC(=O)COC1=CC=C(OC)C=C1 SBB071632 [0,0,0,0,0,2|0,0,0]=2 577 B14R1.5 COC1=CC=C(CNC(=O)CCl)C=C1 SBB037904 [0,0,0,0,0,2|2,0,0]=4 578 B14R1.5 COC1=CC=C(COC(=O)NN)C=C1 SBB072897 [0,0,0,0,0,2|2,0,0]=4 579 B14R1.5 COC1=CC=C(NCC(=O)NN)C=C1 SBB019863 [0,0,0,0,0,2|2,0,0]=4 580 B14R1.5 COC1=CC=C(OCC(=O)NN)C=C1 SBB005115 [0,0,0,0,0,2|2,0,0]=4