0 B12R1.4 C(=O)C1=CC=C(OC(C)=O)C=C1 SBB008231 [0,0,0,0,0,0|3,0,0]=3 1 B12R1.4 C=CC1=CC=C(CN(C)C)C=C1 SBB116892 [0,0,0,0,0,0|3,0,1]=4 2 B12R1.4 CC(=O)NC1=CC=C(C=O)C=C1 SBB058823 [0,0,0,0,0,0|3,0,0]=3 3 B12R1.4 CCC1=CC=C(NC(N)=S)C=C1 SBB017709 [0,0,0,0,0,0|3,1,0]=4 4 B12R1.4 CN(C)CC1=CC=C(C=O)C=C1 SBB108985 [0,0,0,0,0,0|4,0,0]=4 5 B12R1.4 COC1=CC=C(CC(=O)O)C=C1 SBB058345 [0,0,0,0,0,0|1,0,0]=1 6 B12R1.4 COC1=CC=C(CC(C)=O)C=C1 SBB058529 [0,0,0,0,0,0|0,0,0]=0 7 B12R1.4 COC1=CC=C(CC(N)=O)C=C1 SBB057982 [0,0,0,0,0,0|1,0,0]=1 8 B12R1.4 COC1=CC=C(CC(N)=S)C=C1 SBB089824 [0,0,0,0,0,0|1,1,0]=2 9 B12R1.4 COC1=CC=C(NC(C)=O)C=C1 SBB056791 [0,0,0,0,0,0|1,0,0]=1 10 B12R1.4 COC1=CC=C(NC(N)=O)C=C1 SBB062093 [0,0,0,0,0,0|2,0,0]=2 11 B12R1.4 COC1=CC=C(NC(N)=S)C=C1 SBB058957 [0,0,0,0,0,0|2,1,0]=3 12 B12R1.4 CSC1=CC=C(CC(=O)O)C=C1 SBB068771 [0,0,0,0,0,0|1,1,0]=2 13 B12R1.4 CSC1=CC=C(NC(C)=O)C=C1 SBB115654 [0,0,0,0,0,0|1,1,0]=2 14 B12R1.4 N(C(C)=O)C1=CC=C(C#N)C=C1 SBB059552 [0,0,0,0,0,0|3,0,0]=3 15 B12R1.4 NNC1=CC=C(CC(=O)O)C=C1 SBB049852 [0,0,0,0,0,0|3,0,0]=3 16 B12R1.4 O=C(O)CC1=CC=C(CBr)C=C1 SBB063870 [0,0,0,0,0,0|3,0,0]=3 17 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 SBB058424 [1,0,0,0,0,0|1,0,0]=2 18 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 SBB086853 [1,0,0,0,0,0|1,0,0]=2 19 B11R1.20 CC(=O)NC1=CC=C(Br)C=C1 SBB054161 [1,0,0,0,0,0|2,0,0]=3 20 B11R1.20 CC(=O)NC1=CC=C(Br)C=N1 SBB095054 [1,0,0,0,0,0|3,0,0]=4 21 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 SBB059339 [1,0,0,0,0,0|1,0,0]=2 22 B11R1.20 CC(=O)NC1=CC=C(C)C=N1 SBB086721 [1,0,0,0,0,0|2,0,0]=3 23 B11R1.20 CC(=O)NC1=CC=C(Cl)C=C1 SBB058218 [1,0,0,0,0,0|2,0,0]=3 24 B11R1.20 CC(=O)NC1=CC=C(Cl)C=N1 SBB113300 [1,0,0,0,0,0|3,0,0]=4 25 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 SBB086906 [1,0,0,0,0,0|2,0,0]=3 26 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 SBB028292 [1,0,0,0,0,0|2,0,0]=3 27 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 SBB090514 [1,0,0,0,0,0|2,0,0]=3 28 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 SBB043758 [1,0,0,0,0,0|1,0,0]=2 29 B11R1.20 CC(=O)NC1=NC=C(I)C=C1 SBB102484 [1,0,0,0,0,0|3,0,0]=4 30 B11R1.20 CC(=O)NC1=NC=C(N)C=C1 SBB028302 [1,0,0,0,0,0|3,0,0]=4 31 B11R1.20 CC(=O)OC1=CC=C(C)C=C1 SBB060032 [1,0,0,0,0,0|1,0,0]=2 32 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 SBB086983 [1,0,0,0,0,0|2,0,0]=3 33 B11R1.20 CC(N)CC1=CC=C(Cl)C=C1 SBB000454 [1,0,0,0,0,0|2,0,1]=4 34 B11R1.20 CC(N)CC1=CC=C(F)C=C1 SBB052387 [1,0,0,0,0,0|2,0,1]=4 35 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 SBB063734 [1,0,0,0,0,0|1,0,0]=2 36 B11R1.20 CC1=CC=C(CC(N)=S)C=C1 SBB087944 [1,0,0,0,0,0|1,1,0]=3 37 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 SBB028290 [1,0,0,0,0,0|2,0,0]=3 38 B11R1.20 CC1=CC=C(NC(N)=S)C=C1 SBB061970 [1,0,0,0,0,0|2,1,0]=4 39 B11R1.20 CN(C)CC1=CC=C(Br)C=C1 SBB109890 [1,0,0,0,0,0|3,0,0]=4 40 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 SBB028300 [1,0,0,0,0,0|1,0,0]=2 41 B11R1.20 NC(=O)NC1=CC=C(F)C=C1 SBB062099 [1,0,0,0,0,0|3,0,0]=4 42 B11R1.20 NC(=S)CC1=CC=C(Br)C=C1 SBB055187 [1,0,0,0,0,0|2,1,0]=4 43 B11R1.20 NC(=S)CC1=CC=C(Cl)C=C1 SBB055366 [1,0,0,0,0,0|2,1,0]=4 44 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 SBB028301 [1,0,0,0,0,0|2,0,0]=3 45 B11R1.20 O=C(Cl)CC1=CC=C(Cl)C=C1 SBB005859 [1,0,0,0,0,0|2,0,0]=3 46 B11R1.20 O=C(Cl)CC1=CC=C(F)C=C1 SBB067909 [1,0,0,0,0,0|2,0,0]=3 47 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 SBB042842 [1,0,0,0,0,0|2,0,0]=3 48 B11R1.20 O=C(O)CC1=CC=C(Br)C=N1 SBB062888 [1,0,0,0,0,0|3,0,0]=4 49 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 SBB008374 [1,0,0,0,0,0|2,0,0]=3 50 B11R1.20 O=C(O)CC1=CC=C(Cl)N=C1 SBB027117 [1,0,0,0,0,0|3,0,0]=4 51 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 SBB052671 [1,0,0,0,0,0|2,0,0]=3 52 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 SBB052672 [1,0,0,0,0,0|2,0,0]=3 53 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 SBB059600 [1,0,0,0,0,0|1,0,0]=2 54 B11R1.20 O=C1C=CN(CC(=O)O)C=C1 SBB017930 [1,0,0,0,0,0|2,0,1]=4 55 B11R1.20 SC1=CC=C(NC(C)=O)C=C1 SBB003881 [1,0,0,0,0,0|1,1,0]=3 56 B11R1.83 CCC1=CC=C(CC#N)C=C1 SBB065173 [1,0,0,0,0,0|2,0,1]=4 57 B11R1.83 CCC1=CC=C(N=C=O)C=C1 SBB046954 [1,0,0,0,0,0|2,0,1]=4 58 B11R1.83 CCCC1=CC=C(C#N)C=C1 SBB059145 [1,0,0,0,0,0|2,0,1]=4 59 B11R1.83 CCCC1=CC=C(C=O)C=C1 SBB059136 [1,0,0,0,0,0|2,0,1]=4 60 B11R1.83 CCCC1=CC=C(CN)C=C1 SBB059679 [1,0,0,0,0,0|2,0,1]=4 61 B11R1.83 CCCC1=CC=C(OC)C=C1 SBB007737 [1,0,0,0,0,0|0,0,1]=2 62 B11R1.83 CCNC1=CC=C(CC)C=C1 SBB072094 [1,0,0,0,0,0|2,0,1]=4 63 B11R1.83 CNCC1=CC=C(OC)C=C1 SBB086791 [1,0,0,0,0,0|1,0,0]=2 64 B11R1.83 COC1=CC=C(CC#N)C=C1 SBB055070 [1,0,0,0,0,0|1,0,1]=3 65 B11R1.83 COC1=CC=C(CC=O)C=C1 SBB052209 [1,0,0,0,0,0|0,0,0]=1 66 B11R1.83 COC1=CC=C(CCN)C=C1 SBB058795 [1,0,0,0,0,0|1,0,1]=3 67 B11R1.83 COC1=CC=C(CON)C=C1 SBB091016 [1,0,0,0,0,0|2,0,0]=3 68 B11R1.83 COC1=CC=C(N=C=O)C=C1 SBB048851 [1,0,0,0,0,0|1,0,1]=3 69 B11R1.83 COC1=CC=C(N=C=S)C=C1 SBB006547 [1,0,0,0,0,0|1,1,1]=4 70 B11R1.83 COC1=CC=C(\C=N/O)C=C1 SBB086769 [1,0,0,0,0,0|1,0,2]=4 71 B11R1.83 CSC1=CC=C(N=C=O)C=C1 SBB048889 [1,0,0,0,0,0|1,1,1]=4 72 B13R1.5 C(=O)C1=CC=C(OC(=O)CC)C=C1 SBB008232 [0,1,0,0,0,0|3,0,0]=4 73 B13R1.5 CCC1=CC=C(NC(=O)CCl)C=C1 SBB000368 [0,1,0,0,0,0|2,0,0]=3 74 B13R1.5 CNC(=S)NC1=CC=C(OC)C=C1 SBB000355 [0,1,0,0,0,0|1,1,0]=3 75 B13R1.5 COC(=O)NC1=CC=C(OC)C=C1 SBB089787 [0,1,0,0,0,0|1,0,0]=2 76 B13R1.5 COC1=CC=C(CC(=O)NN)C=C1 SBB059654 [0,1,0,0,0,0|1,0,0]=2 77 B13R1.5 COC1=CC=C(NC(=O)CBr)C=C1 SBB080043 [0,1,0,0,0,0|1,0,0]=2 78 B13R1.5 COC1=CC=C(NC(=O)CCl)C=C1 SBB017384 [0,1,0,0,0,0|1,0,0]=2 79 B13R1.5 COC1=CC=C(NC(=S)NN)C=C1 SBB038434 [0,1,0,0,0,0|2,1,0]=4 80 B13R1.5 COC1=CC=C(OC(C)CN)C=C1 SBB027279 [0,1,0,0,0,0|2,0,1]=4 81 B13R1.5 N#CC1=CC=C(NC(=O)CCl)C=C1 SBB072143 [0,1,0,0,0,0|3,0,0]=4 82 B13R1.35 CC(=O)NC1=CC(C)=C(C#N)C=C1 SBB058979 [0,1,0,0,0,0|3,0,0]=4 83 B13R1.35 COC1=C(C)C=C(CC(=O)O)C=C1 SBB010652 [0,1,0,0,0,0|1,0,0]=2 84 B13R1.35 COC1=C(Cl)C=C(CC(=O)O)C=C1 SBB018546 [0,1,0,0,0,0|1,0,0]=2 85 B13R1.35 COC1=C(N)C=C(NC(C)=O)C=C1 SBB000217 [0,1,0,0,0,0|1,0,0]=2 86 B13R1.35 COC1=CC=C(CC(=O)O)C=C1Br SBB017829 [0,1,0,0,0,0|1,0,0]=2 87 B13R1.35 COC1=CC=C(CC(=O)O)C=C1F SBB017988 [0,1,0,0,0,0|1,0,0]=2 88 B13R1.35 COC1=CC=C(CC(=O)O)C=C1O SBB017714 [0,1,0,0,0,0|1,0,0]=2 89 B13R1.36 COC1=CC=C([C@@H](O)C(=O)O)C=C1 SBB063581 [0,1,0,0,0,0|1,0,0]=2 90 B13R1.142 CC(=O)NC1=CC=C(CC#N)C=C1 SBB017691 [0,1,0,0,0,0|2,0,1]=4 91 B13R1.142 CC(=O)NC1=CC=C(\C=N\O)C=C1 SBB019874 [0,1,0,0,0,0|3,0,0]=4 92 B13R1.142 CCOC1=CC=C(CC(=O)O)C=C1 SBB077880 [0,1,0,0,0,0|1,0,0]=2 93 B13R1.142 CCOC1=CC=C(NC(N)=O)C=C1 SBB089673 [0,1,0,0,0,0|2,0,0]=3 94 B13R1.142 CCOC1=CC=C(NC(N)=S)C=C1 SBB038543 [0,1,0,0,0,0|2,1,0]=4 95 B13R1.585 CC(=O)C1=CC=C(CC(C)C)C=C1 SBB007668 [0,1,0,0,0,0|2,0,1]=4 96 B13R1.585 CC(=O)NC1=CC=C(B(O)O)C=C1 SBB000202 [0,1,0,0,0,0|3,0,0]=4 97 B13R1.585 CC(=O)NC1=CC=C(C(=O)Cl)C=C1 SBB067901 [0,1,0,0,0,0|3,0,0]=4 98 B13R1.585 CC(=O)NC1=CC=C(C(C)=O)C=C1 SBB063980 [0,1,0,0,0,0|2,0,0]=3 99 B13R1.585 CC(=O)NC1=CC=C([N+](=O)[O-])C=C1 SBB058050 [0,1,0,0,0,0|3,0,0]=4 100 B13R1.585 CC(=O)OC1=CC=C(C(=O)O)C=C1 SBB085158 [0,1,0,0,0,0|3,0,0]=4 101 B13R1.585 CC(=O)OC1=CC=C(C(C)=O)C=C1 SBB005780 [0,1,0,0,0,0|2,0,0]=3 102 B13R1.585 CC(=O)OC1=CC=C([N+](=O)[O-])C=C1 SBB064125 [0,1,0,0,0,0|3,0,0]=4 103 B13R1.585 CC(C)C1=CC=C(CC(=O)O)C=C1 SBB079293 [0,1,0,0,0,0|2,0,0]=3 104 B13R1.585 CC(N)CC1=CC=C(N(C)C)C=C1 SBB005697 [0,1,0,0,0,0|2,0,1]=4 105 B13R1.585 CN(C)C1=CC=C(CC(=O)O)C=C1 SBB052676 [0,1,0,0,0,0|2,0,0]=3 106 B13R1.585 O=C(O)CC1=CC=C(C(=O)O)C=C1 SBB059723 [0,1,0,0,0,0|3,0,0]=4 107 B13R1.585 O=C(O)CC1=CC=C([N+](=O)[O-])C=C1 SBB056678 [0,1,0,0,0,0|3,0,0]=4 108 B13R1.585 OC(=O)C1=CC=C(NC(C)=O)C=C1 SBB037858 [0,1,0,0,0,0|3,0,0]=4 109 B13R1.653 COC1=CC=C(CC(=O)O)C(Br)=C1 SBB065954 [0,1,0,0,0,0|1,0,0]=2 110 B13R1.653 COC1=CC=C(CC(=O)O)C(F)=C1 SBB064503 [0,1,0,0,0,0|1,0,0]=2 111 B13R1.653 COC1=CC=C(NC(C)=O)C(N)=C1 SBB055485 [0,1,0,0,0,0|1,0,0]=2 112 B13R2.2121 COC1=CC2=C(C=C1)NC(=O)N2 SBB059283 [0,0,0,1,0,0|2,0,0]=3 113 B13R2.2121 COC1=CC2=C(C=C1)NC(C)=C2 SBB048388 [0,0,0,1,0,0|2,0,0]=3 114 B13R2.2121 COC1=CC2=C(C=C1)NC(S)=N2 SBB000219 [0,0,0,1,0,0|2,1,0]=4 115 B13R2.2121 COC1=CC2=C(C=C1)SC(C)=N2 SBB059122 [0,0,0,1,0,0|2,0,0]=3 116 B13R2.2121 COC1=CC2=C(C=C1)[Se]C(C)=N2 SBB057619 [0,0,0,1,0,0|2,0,0]=3 117 B13R2.2121 COC1=CC=C2NC(C)=NC2=C1 SBB056010 [0,0,0,1,0,0|2,0,0]=3 118 B13R2.2121 COC1=CC=C2NC(N)=NC2=C1 SBB051993 [0,0,0,1,0,0|3,0,0]=4 119 B13R2.2121 COC1=CC=C2OC(S)=NC2=C1 SBB046565 [0,0,0,1,0,0|2,1,0]=4 120 B13R2.2121 COC1=CC=C2SC(N)=NC2=C1 SBB051982 [0,0,0,1,0,0|3,0,0]=4 121 B13R2.2121 NC1=NC2=C(C=C(OC)C=C2)S1 SBB003746 [0,0,0,1,0,0|2,1,0]=4 122 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 SBB055505 [0,0,0,0,1,0|1,0,0]=2 123 B11R1.3 CC(=O)C1=CC=C(C#N)C=C1 SBB063042 [0,0,0,0,1,0|2,0,0]=3 124 B11R1.3 CCC1=CC=C(C(=N)N)C=C1 SBB073190 [0,0,0,0,1,0|3,0,0]=4 125 B11R1.3 CCC1=CC=C(C(=O)Cl)C=C1 SBB006540 [0,0,0,0,1,0|2,0,0]=3 126 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 SBB037877 [0,0,0,0,1,0|2,0,0]=3 127 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 SBB040909 [0,0,0,0,1,0|1,0,0]=2 128 B11R1.3 CCC1=CC=C(C(C)N)C=C1 SBB016483 [0,0,0,0,1,0|2,0,1]=4 129 B11R1.3 CCC1=CC=C(C(N)=O)C=C1 SBB116864 [0,0,0,0,1,0|2,0,0]=3 130 B11R1.3 CCC1=CC=C(C(N)=S)C=C1 SBB016505 [0,0,0,0,1,0|2,1,0]=4 131 B11R1.3 CCC1=CC=C([N+](=O)[O-])C=C1 SBB060635 [0,0,0,0,1,0|3,0,0]=4 132 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 SBB058256 [0,0,0,0,1,0|2,0,0]=3 133 B11R1.3 COC1=CC=C(B(O)O)C=C1 SBB004055 [0,0,0,0,1,0|2,0,1]=4 134 B11R1.3 COC1=CC=C(C(=N)N)C=C1 SBB048505 [0,0,0,0,1,0|2,0,0]=3 135 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 SBB040620 [0,0,0,0,1,0|1,0,0]=2 136 B11R1.3 COC1=CC=C(C(=O)O)C=C1 SBB037872 [0,0,0,0,1,0|1,0,0]=2 137 B11R1.3 COC1=CC=C(C(=O)O)N=N1 SBB053240 [0,0,0,0,1,0|3,0,0]=4 138 B11R1.3 COC1=CC=C(C(C)=O)C=C1 SBB040242 [0,0,0,0,1,0|0,0,0]=1 139 B11R1.3 COC1=CC=C(C(C)N)C=C1 SBB007015 [0,0,0,0,1,0|1,0,1]=3 140 B11R1.3 COC1=CC=C(C(N)=S)C=C1 SBB016507 [0,0,0,0,1,0|1,1,0]=3 141 B11R1.3 COC1=CC=C([N+](=O)[O-])C=C1 SBB058741 [0,0,0,0,1,0|2,0,0]=3 142 B11R1.3 COC1=NC=C(C(=O)O)C=C1 SBB012818 [0,0,0,0,1,0|2,0,0]=3 143 B11R1.3 CSC1=CC=C(C(=N)N)C=C1 SBB077444 [0,0,0,0,1,0|2,1,0]=4 144 B11R1.3 CSC1=CC=C(C(=O)O)C=C1 SBB063176 [0,0,0,0,1,0|1,1,0]=3 145 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 SBB088031 [0,0,0,0,1,0|0,1,0]=2 146 B11R1.3 CSC1=CC=C([N+](=O)[O-])C=C1 SBB068783 [0,0,0,0,1,0|2,1,0]=4 147 B11R1.3 N#CC1=CC=C(C(=O)Cl)C=C1 SBB059843 [0,0,0,0,1,0|3,0,0]=4 148 B11R1.3 N#CC1=CC=C(C(=O)O)C=C1 SBB008570 [0,0,0,0,1,0|3,0,0]=4 149 B11R1.3 N#CC1=CC=C(C(N)=O)C=C1 SBB065159 [0,0,0,0,1,0|3,0,0]=4 150 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 SBB006704 [0,0,0,0,1,0|3,0,0]=4 151 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 SBB046616 [0,0,0,0,1,0|3,0,0]=4 152 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 SBB017160 [0,0,0,0,1,0|3,0,0]=4 153 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 SBB042644 [0,0,0,0,1,0|3,0,0]=4 154 B11R1.3 O=C(O)C1=CC=C(CCl)C=C1 SBB040672 [0,0,0,0,1,0|3,0,0]=4 155 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 SBB052730 [0,0,0,0,1,0|3,0,0]=4 156 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 SBB040263 [0,0,0,0,1,0|3,0,0]=4 157 B11R1.3 OC(=O)C1=CC=C(C=C)C=C1 SBB006579 [0,0,0,0,1,0|2,0,1]=4 158 B13R1.3 CCC1=CC=C(CCC(=O)O)C=C1 SBB017700 [0,0,0,0,0,1|2,0,0]=3 159 B13R1.3 CCC1=CC=C(OCC(=O)O)C=C1 SBB004547 [0,0,0,0,0,1|2,0,0]=3 160 B13R1.3 COC1=CC=C(CCC(C)=O)C=C1 SBB002546 [0,0,0,0,0,1|0,0,0]=1 161 B13R1.3 COC1=CC=C(CCC(C)N)C=C1 SBB010641 [0,0,0,0,0,1|1,0,1]=3 162 B13R1.3 COC1=CC=C(CNC(N)=S)C=C1 SBB017748 [0,0,0,0,0,1|1,1,0]=3 163 B13R1.3 COC1=CC=C(OCC(=O)O)C=C1 SBB004543 [0,0,0,0,0,1|1,0,0]=2 164 B13R1.3 COC1=CC=C(OCC(C)N)C=C1 SBB010677 [0,0,0,0,0,1|1,0,1]=3 165 B13R1.3 COC1=CC=C(OCC(N)=S)C=C1 SBB055418 [0,0,0,0,0,1|1,1,0]=3 166 B13R1.3 COC1=CC=C(\C=C\C(=O)O)C=C1 SBB005717 [0,0,0,0,0,1|1,0,1]=3 167 B13R1.3 COC1=CC=C(\C=C\C(C)=O)C=C1 SBB017375 [0,0,0,0,0,1|0,0,1]=2 168 B13R1.3 COC1=CC=C(\C=C\[N+](=O)[O-])C=C1 SBB042576 [0,0,0,0,0,1|2,0,1]=4 169 B13R1.3 CSC1=CC=C(\C=C\C(=O)O)C=C1 SBB002370 [0,0,0,0,0,1|1,1,1]=4 170 B13R1.3 N#CC1=CC=C(OCC(=O)O)C=C1 SBB019894 [0,0,0,0,0,1|3,0,0]=4 171 B13R1.3 NC(=O)COC1=CC=C(C=O)C=C1 SBB019522 [0,0,0,0,0,1|3,0,0]=4 172 B13R1.3 O=C(O)COC1=CC=C(CO)C=C1 SBB059335 [0,0,0,0,0,1|3,0,0]=4 173 B13R1.3 O=CC1=CC=C(OCC(=O)O)C=C1 SBB019893 [0,0,0,0,0,1|3,0,0]=4 174 B13R1.3 OC(=O)CCC1=CC=C(OC)C=C1 SBB003748 [0,0,0,0,0,1|1,0,0]=2 175 B10R1.1 CC1=CC=C(CC#N)C=C1 SBB063995 [2,0,0,0,0,0|1,0,1]=4 176 B10R1.1 CC1=CC=C(CC=O)C=C1 SBB052212 [2,0,0,0,0,0|0,0,0]=2 177 B10R1.1 CC1=CC=C(CON)C=C1 SBB021738 [2,0,0,0,0,0|2,0,0]=4 178 B10R1.1 CC1=CC=C(N=C=O)C=C1 SBB061737 [2,0,0,0,0,0|1,0,1]=4 179 B10R1.1 CC1=CC=C(NC=O)C=C1 SBB085897 [2,0,0,0,0,0|1,0,0]=3 180 B10R1.1 CCCC1=CC=C(N)C=C1 SBB008337 [2,0,0,0,0,0|1,0,1]=4 181 B10R1.1 CCCC1=CC=C(O)C=C1 SBB055506 [2,0,0,0,0,0|0,0,1]=3 182 B10R1.1 CCOC1=CC=C(C)C=C1 SBB060988 [2,0,0,0,0,0|1,0,1]=4 183 B10R1.1 CCOC1=CC=C(O)C=C1 SBB043810 [2,0,0,0,0,0|1,0,1]=4 184 B10R1.1 CNCC1=CC=C(C)C=C1 SBB079252 [2,0,0,0,0,0|1,0,0]=3 185 B10R1.1 CNCC1=CC=C(Cl)C=C1 SBB010371 [2,0,0,0,0,0|2,0,0]=4 186 B10R1.1 CNCC1=CC=C(F)C=C1 SBB005902 [2,0,0,0,0,0|2,0,0]=4 187 B10R1.1 CNCC1=CC=C(O)C=C1 SBB046545 [2,0,0,0,0,0|1,0,0]=3 188 B10R1.1 N#CCC1=CC=C(O)C=C1 SBB063205 [2,0,0,0,0,0|1,0,1]=4 189 B10R1.1 NCCC1=CC=C(O)C=C1 SBB003808 [2,0,0,0,0,0|1,0,1]=4 190 B10R1.1 O=CCC1=CC=C(Br)C=C1 SBB052205 [2,0,0,0,0,0|1,0,0]=3 191 B10R1.1 O=CCC1=CC=C(F)C=C1 SBB052206 [2,0,0,0,0,0|1,0,0]=3 192 B10R1.1 OCCC1=CC=C(O)C=C1 SBB086008 [2,0,0,0,0,0|0,0,2]=4 193 B10R1.18 CC(=O)CC1=CC=NC=C1 SBB055597 [2,0,0,0,0,0|1,0,0]=3 194 B10R1.18 CC(=O)NC1=CC=CC=C1 SBB040833 [2,0,0,0,0,0|1,0,0]=3 195 B10R1.18 CC(=O)NC1=CC=CC=N1 SBB085932 [2,0,0,0,0,0|2,0,0]=4 196 B10R1.18 CC(=O)NC1=CC=NC=C1 SBB085931 [2,0,0,0,0,0|2,0,0]=4 197 B10R1.18 CC(=O)OC1=CC=CC=C1 SBB058747 [2,0,0,0,0,0|1,0,0]=3 198 B10R1.18 CC(=S)NC1=CC=CC=C1 SBB086797 [2,0,0,0,0,0|1,1,0]=4 199 B10R1.18 CN(C)CC1=CC=CC=C1 SBB060233 [2,0,0,0,0,0|2,0,0]=4 200 B10R1.18 NC(=O)CC1=CC=CC=C1 SBB017634 [2,0,0,0,0,0|1,0,0]=3 201 B10R1.18 NC(=O)NC1=CC=CC=C1 SBB058197 [2,0,0,0,0,0|2,0,0]=4 202 B10R1.18 NC(=S)CC1=CC=CC=C1 SBB016517 [2,0,0,0,0,0|1,1,0]=4 203 B10R1.18 O=C(Cl)CC1=CC=CC=C1 SBB040622 [2,0,0,0,0,0|1,0,0]=3 204 B10R1.18 O=C(Cl)OC1=CC=CC=C1 SBB060851 [2,0,0,0,0,0|2,0,0]=4 205 B10R1.18 O=C(O)CC1=CC=CN=C1 SBB003812 [2,0,0,0,0,0|2,0,0]=4 206 B10R1.18 O=C(O)CC1=NC=CC=C1 SBB003810 [2,0,0,0,0,0|2,0,0]=4 207 B10R1.18 OC(=O)CC1=CC=NC=C1 SBB005759 [2,0,0,0,0,0|2,0,0]=4 208 B10R1.18 [NH2+](C(=O)Cl)C1=CC=CC=C1 SBB060746 [2,0,0,0,0,0|2,0,0]=4 209 B10R1.3 C#CC1=CC=C(C=O)C=C1 SBB064928 [2,0,0,0,0,0|1,0,1]=4 210 B10R1.3 C#CC1=CC=C(OC)C=C1 SBB063612 [2,0,0,0,0,0|0,0,2]=4 211 B10R1.3 C(=O)C1=CC=C(C#N)C=C1 SBB008634 [2,0,0,0,0,0|2,0,0]=4 212 B10R1.3 C(=O)C1=CC=C(C=O)C=C1 SBB012343 [2,0,0,0,0,0|2,0,0]=4 213 B10R1.3 CCC1=CC=C(C#N)C=C1 SBB059144 [2,0,0,0,0,0|2,0,0]=4 214 B10R1.3 CCC1=CC=C(C=O)C=C1 SBB040197 [2,0,0,0,0,0|1,0,0]=3 215 B10R1.3 CCC1=CC=C(CC)C=C1 SBB061169 [2,0,0,0,0,0|1,0,0]=3 216 B10R1.3 CCC1=CC=C(CN)C=C1 SBB017636 [2,0,0,0,0,0|2,0,0]=4 217 B10R1.3 CCC1=CC=C(NN)C=C1 SBB001777 [2,0,0,0,0,0|2,0,0]=4 218 B10R1.3 CCC1=CC=C(NN)C=C1 SBB064984 [2,0,0,0,0,0|2,0,0]=4 219 B10R1.3 CCC1=CC=C(OC)C=C1 SBB060457 [2,0,0,0,0,0|0,0,0]=2 220 B10R1.3 CNC1=CC=C(OC)C=C1 SBB072645 [2,0,0,0,0,0|1,0,0]=3 221 B10R1.3 COC1=CC=C(C#N)C=C1 SBB059484 [2,0,0,0,0,0|1,0,1]=4 222 B10R1.3 COC1=CC=C(C=O)C=C1 SBB040224 [2,0,0,0,0,0|0,0,0]=2 223 B10R1.3 COC1=CC=C(C=O)C=N1 SBB052248 [2,0,0,0,0,0|1,0,0]=3 224 B10R1.3 COC1=CC=C(CBr)C=C1 SBB054916 [2,0,0,0,0,0|1,0,0]=3 225 B10R1.3 COC1=CC=C(CCl)C=C1 SBB040608 [2,0,0,0,0,0|1,0,0]=3 226 B10R1.3 COC1=CC=C(CN)C=C1 SBB040460 [2,0,0,0,0,0|1,0,0]=3 227 B10R1.3 COC1=CC=C(CO)C=C1 SBB063123 [2,0,0,0,0,0|0,0,1]=3 228 B10R1.3 COC1=CC=C(NN)C=C1 SBB012784 [2,0,0,0,0,0|2,0,0]=4 229 B10R1.3 COC1=CC=C(NN)C=C1 SBB063180 [2,0,0,0,0,0|2,0,0]=4 230 B10R1.3 COC1=CC=C(OC)C=C1 SBB060067 [2,0,0,0,0,0|1,0,0]=3 231 B10R1.3 COC1=NC=C(C=O)C=N1 SBB018979 [2,0,0,0,0,0|2,0,0]=4 232 B10R1.3 CSC1=CC=C(C=O)C=C1 SBB040212 [2,0,0,0,0,0|0,1,0]=3 233 B10R1.3 CSC1=CC=C(CN)C=C1 SBB017654 [2,0,0,0,0,0|1,1,0]=4 234 B10R1.3 CSC1=CC=C(CO)C=C1 SBB064786 [2,0,0,0,0,0|0,1,1]=4 235 B12R1.19 CC(=O)CC1=CC=C(Cl)C(Cl)=C1 SBB005841 [1,1,0,0,0,0|1,0,0]=3 236 B12R1.19 CC(=O)NC1=CC(Cl)=C(C)C=C1 SBB090087 [1,1,0,0,0,0|1,0,0]=3 237 B12R1.19 CC(=O)NC1=CC(Cl)=C(Cl)C=C1 SBB093225 [1,1,0,0,0,0|2,0,0]=4 238 B12R1.19 CC(=O)NC1=CC(Cl)=C(F)C=C1 SBB090651 [1,1,0,0,0,0|2,0,0]=4 239 B12R1.19 CC(=O)NC1=CC(F)=C(Br)C=C1 SBB097859 [1,1,0,0,0,0|2,0,0]=4 240 B12R1.19 CC(=O)NC1=CC(F)=C(F)C=C1 SBB017328 [1,1,0,0,0,0|2,0,0]=4 241 B12R1.19 CC1=CC(CC(=O)O)=CC=C1F SBB088168 [1,1,0,0,0,0|2,0,0]=4 242 B12R1.19 CC1=CC=C(CC(=O)O)C=C1C SBB017956 [1,1,0,0,0,0|1,0,0]=3 243 B12R1.19 CC1=CC=C(CC(=O)O)C=C1F SBB088167 [1,1,0,0,0,0|1,0,0]=3 244 B12R1.19 NC1=C(O)C=CC(CC(=O)O)=C1 SBB052639 [1,1,0,0,0,0|1,0,0]=3 245 B12R1.19 O=C(O)CC1=CC(Cl)=C(Cl)C=C1 SBB003501 [1,1,0,0,0,0|2,0,0]=4 246 B12R1.19 O=C(O)CC1=CC=C(Cl)C(F)=C1 SBB064497 [1,1,0,0,0,0|2,0,0]=4 247 B12R1.19 O=C(O)CC1=CC=C(F)C(Br)=C1 SBB064034 [1,1,0,0,0,0|2,0,0]=4 248 B12R1.19 O=C(O)CC1=CC=C(F)C(Cl)=C1 SBB064032 [1,1,0,0,0,0|2,0,0]=4 249 B12R1.19 O=C(O)CC1=CC=C(F)C(F)=C1 SBB063735 [1,1,0,0,0,0|2,0,0]=4 250 B12R1.19 O=C(O)CC1=CC=C(O)C(F)=C1 SBB071465 [1,1,0,0,0,0|1,0,0]=3 251 B12R1.19 O=C(O)CC1=CC=C(O)C(O)=C1 SBB064931 [1,1,0,0,0,0|1,0,0]=3 252 B12R1.20 CC(=O)N(C)C1=CC=C(N)C=C1 SBB080453 [1,1,0,0,0,0|2,0,0]=4 253 B12R1.20 CC(=O)N(C)C1=CC=C(O)C=C1 SBB072886 [1,1,0,0,0,0|1,0,0]=3 254 B12R1.20 CC(C(=O)O)C1=CC=C(Cl)C=C1 SBB064110 [1,1,0,0,0,0|2,0,0]=4 255 B12R1.20 CC1=CC=C(C(C)C(=O)O)C=C1 SBB037860 [1,1,0,0,0,0|1,0,0]=3 256 B12R1.20 CC1=CC=C(C(O)C(=O)O)C=C1 SBB065020 [1,1,0,0,0,0|1,0,0]=3 257 B12R1.20 NC(C(=O)O)C1=CC=C(Br)C=C1 SBB097533 [1,1,0,0,0,0|2,0,0]=4 258 B12R1.20 NC(C(=O)O)C1=CC=C(F)C=C1 SBB028364 [1,1,0,0,0,0|2,0,0]=4 259 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Cl)C=C1 SBB062828 [1,1,0,0,0,0|2,0,0]=4 260 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(O)C=C1 SBB058359 [1,1,0,0,0,0|1,0,0]=3 261 B12R1.20 O=C(O)C(O)C1=CC=C(Br)C=C1 SBB057734 [1,1,0,0,0,0|2,0,0]=4 262 B12R1.20 O=C(O)C(O)C1=CC=C(Cl)C=C1 SBB008325 [1,1,0,0,0,0|2,0,0]=4 263 B12R1.20 O=C(O)C(O)C1=CC=C(F)C=C1 SBB063787 [1,1,0,0,0,0|2,0,0]=4 264 B12R1.20 O=C(O)C(O)C1=CC=C(O)C=C1 SBB065018 [1,1,0,0,0,0|1,0,0]=3 265 B12R1.20 OC(=O)C(C)C1=CC=C(O)C=C1 SBB003894 [1,1,0,0,0,0|1,0,0]=3 266 B12R1.20 [NH3+]C(C)C(O)C1=CC=C(O)C=C1 SBB056907 [1,1,0,0,0,0|1,0,1]=4 267 B12R1.49 CC1=CC=C(NC(=O)CBr)C=C1 SBB050418 [1,1,0,0,0,0|1,0,0]=3 268 B12R1.49 CC1=CC=C(NC(=O)CCl)C=C1 SBB004507 [1,1,0,0,0,0|1,0,0]=3 269 B12R1.49 CC1=CC=C(NC(=O)CN)C=C1 SBB004993 [1,1,0,0,0,0|1,0,0]=3 270 B12R1.49 CC1=CC=C(NC(=O)CS)C=C1 SBB083090 [1,1,0,0,0,0|1,0,0]=3 271 B12R1.49 CC1=CC=C(OC(=O)CCl)C=C1 SBB060341 [1,1,0,0,0,0|1,0,0]=3 272 B12R1.49 CCC(=O)NC1=CC=C(N)C=C1 SBB080274 [1,1,0,0,0,0|2,0,0]=4 273 B12R1.49 CCC(=O)NC1=CC=C(O)C=C1 SBB080008 [1,1,0,0,0,0|1,0,0]=3 274 B12R1.49 CNC(=O)CC1=CC=C(N)C=C1 SBB080431 [1,1,0,0,0,0|1,0,0]=3 275 B12R1.49 CNC(=S)NC1=CC=C(C)C=C1 SBB003745 [1,1,0,0,0,0|1,1,0]=4 276 B12R1.49 COC(=O)CC1=CC=C(F)C=C1 SBB017032 [1,1,0,0,0,0|1,0,0]=3 277 B12R1.49 COC(=O)CC1=CC=C(N)C=C1 SBB059052 [1,1,0,0,0,0|1,0,0]=3 278 B12R1.49 CSC(=S)NC1=CC=C(C)C=C1 SBB042895 [1,1,0,0,0,0|1,1,0]=4 279 B12R1.49 NNC(=O)CC1=CC=C(Cl)C=C1 SBB021009 [1,1,0,0,0,0|2,0,0]=4 280 B12R1.49 O=C(CBr)NC1=CC=C(F)C=C1 SBB051004 [1,1,0,0,0,0|2,0,0]=4 281 B12R1.49 O=C(CCl)NC1=CC=C(Br)C=C1 SBB000881 [1,1,0,0,0,0|2,0,0]=4 282 B12R1.49 O=C(CCl)NC1=CC=C(Cl)C=C1 SBB004510 [1,1,0,0,0,0|2,0,0]=4 283 B12R1.49 O=C(CCl)NC1=CC=C(F)C=C1 SBB002113 [1,1,0,0,0,0|2,0,0]=4 284 B12R1.49 O=C(CCl)NC1=CC=C(I)C=C1 SBB023446 [1,1,0,0,0,0|2,0,0]=4 285 B12R1.49 O=C(CCl)OC1=CC=C(Cl)C=C1 SBB056714 [1,1,0,0,0,0|2,0,0]=4 286 B12R1.106 CC(C)(N)CC1=CC=C(O)C=C1 SBB072113 [1,1,0,0,0,0|1,0,1]=4 287 B12R1.106 CC1=CC=C(C[S+](=O)([O-])Cl)C=C1 SBB027263 [1,1,0,0,0,0|2,0,0]=4 288 B12R1.233 CC(=O)NC1=C(Br)C=C(F)C=C1 SBB097860 [1,1,0,0,0,0|2,0,0]=4 289 B12R1.233 CC(=O)NC1=C(Cl)C=C(Br)C=C1 SBB100472 [1,1,0,0,0,0|2,0,0]=4 290 B12R1.233 CC(=O)NC1=C(Cl)C=C(F)C=C1 SBB090652 [1,1,0,0,0,0|2,0,0]=4 291 B12R1.233 CC(=O)NC1=C(F)C=C(F)C=C1 SBB088485 [1,1,0,0,0,0|2,0,0]=4 292 B12R1.233 CC(=O)NC1=C(N)C=C(C)C=C1 SBB050334 [1,1,0,0,0,0|1,0,0]=3 293 B12R1.233 CC(=O)NC1=CC=C(Br)C=C1F SBB009911 [1,1,0,0,0,0|2,0,0]=4 294 B12R1.233 CC(=O)NC1=CC=C(Cl)C=C1C SBB090089 [1,1,0,0,0,0|2,0,0]=4 295 B12R1.233 CC(=O)NC1=CC=C(N)C=C1C SBB017958 [1,1,0,0,0,0|2,0,0]=4 296 B12R1.233 CC1=C(CC(=O)O)C=CC(F)=C1 SBB027289 [1,1,0,0,0,0|2,0,0]=4 297 B12R1.233 CC1=CC(=O)N(CC(=O)O)C=C1 SBB303320 [1,1,0,0,0,0|2,0,0]=4 298 B12R1.233 CC1=CC(F)=C(CC(=O)O)C=C1 SBB088156 [1,1,0,0,0,0|1,0,0]=3 299 B12R1.233 N(C(C)=O)C1=C(C)C=C(Br)C=C1 SBB005784 [1,1,0,0,0,0|2,0,0]=4 300 B12R1.233 N(C(C)=O)C1=C(F)C=C(Cl)C=C1 SBB003684 [1,1,0,0,0,0|2,0,0]=4 301 B12R1.233 NC(=O)CC1=C(Cl)C=C(F)C=C1 SBB090653 [1,1,0,0,0,0|2,0,0]=4 302 B12R1.233 O=C(O)CC1=C(Cl)C=C(Cl)C=C1 SBB003502 [1,1,0,0,0,0|2,0,0]=4 303 B12R1.233 O=C(O)CC1=C(F)C=C(F)C=C1 SBB037936 [1,1,0,0,0,0|2,0,0]=4 304 B12R1.233 O=C(O)CC1=CC=C(Br)C=C1F SBB052731 [1,1,0,0,0,0|2,0,0]=4 305 B12R1.233 O=C(O)CC1=CC=C(Cl)C=C1F SBB064352 [1,1,0,0,0,0|2,0,0]=4 306 B12R1.233 OC(=O)CC1=C(Cl)C=C(F)C=C1 SBB003675 [1,1,0,0,0,0|2,0,0]=4 307 B12R1.5 CCC(=O)C1=CC=C(OC)C=C1 SBB087799 [1,1,0,0,0,0|0,0,2]=4 308 B12R1.5 CCC(N)C1=CC=C(OC)C=C1 SBB009830 [1,1,0,0,0,0|0,0,1]=3 309 B12R1.5 CNC(=O)C1=CC=C(OC)C=C1 SBB087913 [1,1,0,0,0,0|1,0,1]=4 310 B12R1.5 CNC(C)C1=CC=C(OC)C=C1 SBB085415 [1,1,0,0,0,0|1,0,0]=3 311 B12R1.5 COC(=O)C1=CC=C(OC)C=C1 SBB058204 [1,1,0,0,0,0|1,0,1]=4 312 B12R1.71 COC1=CC=C(CCC#N)C=C1 SBB017671 [1,1,0,0,0,0|0,0,2]=4 313 B12R1.71 COC1=CC=C(CCCN)C=C1 SBB010459 [1,1,0,0,0,0|0,0,1]=3 314 B12R1.71 COC1=CC=C(OCC#N)C=C1 SBB055362 [1,1,0,0,0,0|1,0,1]=4 315 B12R1.71 COC1=CC=C(OCCBr)C=C1 SBB018220 [1,1,0,0,0,0|1,0,1]=4 316 B12R1.71 COC1=CC=C(OCCN)C=C1 SBB002492 [1,1,0,0,0,0|1,0,1]=4 317 B12R1.71 COC1=CC=C(OCCO)C=C1 SBB055468 [1,1,0,0,0,0|0,0,2]=4 318 B12R1.113 CCCC1=CC=C(C(C)=O)C=C1 SBB007807 [1,1,0,0,0,0|1,0,1]=4 319 B12R1.113 CCCC1=CC=C(C(C)N)C=C1 SBB020275 [1,1,0,0,0,0|1,0,1]=4 320 B12R1.114 COC1=CC(F)=C(CC#N)C=C1 SBB087895 [1,1,0,0,0,0|1,0,1]=4 321 B12R1.116 CCOC1=CC=C(CC#N)C=C1 SBB017666 [1,1,0,0,0,0|1,0,1]=4 322 B12R1.116 CCOC1=CC=C(N=C=O)C=C1 SBB048829 [1,1,0,0,0,0|1,0,1]=4 323 B12R1.116 CCOC1=CC=C(OCC)C=C1 SBB060362 [1,1,0,0,0,0|1,0,1]=4 324 B12R1.288 COC1=C(Br)C=C(CC#N)C=C1 SBB058927 [1,1,0,0,0,0|1,0,1]=4 325 B12R1.288 COC1=CC=C(CC#N)C=C1F SBB079121 [1,1,0,0,0,0|1,0,1]=4 326 B12R1.6 COC1=CC=C(C(C)(C)C)C=C1 SBB061019 [0,1,0,0,1,0|1,0,1]=4 327 B12R1.6 COC1=CC=C(C(C)(C)O)C=C1 SBB054762 [0,1,0,0,1,0|0,0,2]=4 328 B12R1.6 COC1=CC=C(S(=O)(=O)Cl)C=C1 SBB040956 [0,1,0,0,1,0|2,0,0]=4 329 B12R1.48 CCC1=CC=C(C(=O)O)C=C1Br SBB067754 [0,1,0,0,1,0|2,0,0]=4 330 B12R1.48 COC1=C(Br)C=C(C(=O)O)C=C1 SBB009955 [0,1,0,0,1,0|1,0,0]=3 331 B12R1.48 COC1=C(Cl)C=C(C(=O)O)C=C1 SBB019257 [0,1,0,0,1,0|1,0,0]=3 332 B12R1.48 COC1=C(Cl)C=C(C(=O)O)C=N1 SBB052951 [0,1,0,0,1,0|2,0,0]=4 333 B12R1.48 COC1=C(F)C=C(C(=O)O)C=C1 SBB006649 [0,1,0,0,1,0|1,0,0]=3 334 B12R1.48 COC1=C(F)C=C(C(C)=O)C=C1 SBB064189 [0,1,0,0,1,0|0,0,0]=2 335 B12R1.48 COC1=C(N)C=C(C(=O)O)C=C1 SBB058403 [0,1,0,0,1,0|1,0,0]=3 336 B12R1.48 COC1=C(N)C=C(C(C)=O)C=C1 SBB018620 [0,1,0,0,1,0|0,0,0]=2 337 B12R1.48 COC1=C(N)C=C(C(N)=O)C=C1 SBB058396 [0,1,0,0,1,0|1,0,0]=3 338 B12R1.48 COC1=C(N)C=C([N+](=O)[O-])C=C1 SBB058786 [0,1,0,0,1,0|2,0,0]=4 339 B12R1.48 COC1=C(O)C=C(C(=O)O)C=C1 SBB058347 [0,1,0,0,1,0|1,0,0]=3 340 B12R1.48 COC1=CC=C(C(=O)Cl)C=C1F SBB067908 [0,1,0,0,1,0|1,0,0]=3 341 B12R1.48 COC1=CC=C(C(=O)O)C=C1C SBB017677 [0,1,0,0,1,0|1,0,0]=3 342 B12R1.48 COC1=CC=C(C(=O)O)C=C1I SBB064700 [0,1,0,0,1,0|1,0,0]=3 343 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1Br SBB054167 [0,1,0,0,1,0|2,0,0]=4 344 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1Cl SBB064058 [0,1,0,0,1,0|2,0,0]=4 345 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1F SBB063398 [0,1,0,0,1,0|2,0,0]=4 346 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1I SBB064805 [0,1,0,0,1,0|2,0,0]=4 347 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1O SBB063219 [0,1,0,0,1,0|2,0,0]=4 348 B12R1.256 C=C(C)C1=CC=C(C(=C)C)C=C1 SBB061144 [0,1,0,0,1,0|2,0,0]=4 349 B12R1.256 CC(=O)C1=CC=C(B(O)O)C=C1 SBB000146 [0,1,0,0,1,0|2,0,0]=4 350 B12R1.256 CC(=O)C1=CC=C(C(=O)O)C=C1 SBB051425 [0,1,0,0,1,0|2,0,0]=4 351 B12R1.256 CC(=O)C1=CC=C(C(C)=O)C=C1 SBB008588 [0,1,0,0,1,0|1,0,0]=3 352 B12R1.256 CC(=O)C1=CC=C(C(C)C)C=C1 SBB063211 [0,1,0,0,1,0|1,0,0]=3 353 B12R1.256 CC(=O)C1=CC=C(N(C)C)C=C1 SBB007875 [0,1,0,0,1,0|1,0,0]=3 354 B12R1.256 CC(=O)C1=CC=C([N+](=O)[O-])C=C1 SBB040245 [0,1,0,0,1,0|2,0,0]=4 355 B12R1.256 CC(=O)C1=CC=C([N+](=O)[O-])C=C1 SBB060947 [0,1,0,0,1,0|2,0,0]=4 356 B12R1.256 CC(C)C1=CC=C(C(=O)O)C=C1 SBB063138 [0,1,0,0,1,0|2,0,0]=4 357 B12R1.256 CN(C)C1=CC=C(C(=O)Cl)C=C1 SBB053620 [0,1,0,0,1,0|2,0,0]=4 358 B12R1.256 CN(C)C1=CC=C(C(=O)O)C=C1 SBB040528 [0,1,0,0,1,0|2,0,0]=4 359 B12R1.452 COC1=CC(F)=C(C(=O)Cl)C=C1 SBB090844 [0,1,0,0,1,0|1,0,0]=3 360 B12R1.452 COC1=CC(F)=C(C(C)=O)C=C1 SBB064080 [0,1,0,0,1,0|0,0,0]=2 361 B12R1.452 COC1=CC(F)=C(C(N)=O)C=C1 SBB088263 [0,1,0,0,1,0|1,0,0]=3 362 B12R1.452 COC1=CC=C(C(=O)O)C(C)=C1 SBB052683 [0,1,0,0,1,0|1,0,0]=3 363 B12R1.452 COC1=CC=C(C(=O)O)C(F)=C1 SBB052739 [0,1,0,0,1,0|1,0,0]=3 364 B12R1.452 COC1=CC=C(C(=O)O)C(N)=C1 SBB016770 [0,1,0,0,1,0|1,0,0]=3 365 B12R1.452 COC1=CC=C(C(=O)O)C(O)=C1 SBB063950 [0,1,0,0,1,0|1,0,0]=3 366 B12R1.452 COC1=CC=C(C(C)=O)C(O)=C1 SBB066134 [0,1,0,0,1,0|0,0,0]=2 367 B12R1.452 COC1=CC=C([N+](=O)[O-])C(C)=C1 SBB055094 [0,1,0,0,1,0|2,0,0]=4 368 B12R1.452 COC1=CC=C([N+](=O)[O-])C(N)=C1 SBB051714 [0,1,0,0,1,0|2,0,0]=4 369 B12R1.452 COC1=CC=C([N+](=O)[O-])C(O)=C1 SBB008609 [0,1,0,0,1,0|2,0,0]=4 370 B14R1.2 CCC1=CC=C(C(N)CC(=O)O)C=C1 SBB091596 [0,1,0,0,0,1|2,0,0]=4 371 B14R1.2 COC1=CC=C(C(=O)CC(C)=O)C=C1 SBB017372 [0,1,0,0,0,1|0,0,0]=2 372 B14R1.2 COC1=CC=C(C(=O)C[N+](=O)[O-])C=C1 SBB116039 [0,1,0,0,0,1|2,0,0]=4 373 B14R1.2 COC1=CC=C(C(N)CC(=O)O)C=C1 SBB001784 [0,1,0,0,0,1|1,0,0]=3 374 B14R1.3 CCC1=CC=C(OC(C)C(=O)O)C=C1 SBB004559 [0,1,0,0,0,1|2,0,0]=4 375 B14R1.3 COC1=CC=C(C[C@H](N)C(=O)O)C=C1 SBB064007 [0,1,0,0,0,1|1,0,0]=3 376 B14R1.3 COC1=CC=C(OC(C)C(=O)O)C=C1 SBB004557 [0,1,0,0,0,1|1,0,0]=3 377 B14R1.5 CCC1=CC=C(OCC(=O)NN)C=C1 SBB005109 [0,1,0,0,0,1|2,0,0]=4 378 B14R1.5 COC(=O)COC1=CC=C(C=O)C=C1 SBB091714 [0,1,0,0,0,1|2,0,0]=4 379 B14R1.5 COC(=O)COC1=CC=C(OC)C=C1 SBB071632 [0,1,0,0,0,1|0,0,0]=2 380 B14R1.5 COC1=CC=C(CNC(=O)CCl)C=C1 SBB037904 [0,1,0,0,0,1|0,0,0]=2 381 B14R1.5 COC1=CC=C(COC(=O)NN)C=C1 SBB072897 [0,1,0,0,0,1|1,0,0]=3 382 B14R1.5 COC1=CC=C(NCC(=O)NN)C=C1 SBB019863 [0,1,0,0,0,1|1,0,0]=3 383 B14R1.5 COC1=CC=C(OCC(=O)NN)C=C1 SBB005115 [0,1,0,0,0,1|1,0,0]=3 384 B14R1.5 COC1=CC=C(OCC(O)CN)C=C1 SBB055361 [0,1,0,0,0,1|0,0,2]=4 385 B14R1.5 COC1=CC=C(OC\C(N)=N\O)C=C1 SBB055219 [0,1,0,0,0,1|1,0,1]=4 386 B14R1.103 CCC1=CC(Br)=C(OCC(N)=O)C=C1 SBB113391 [0,1,0,0,0,1|2,0,0]=4 387 B14R1.103 CCC1=CC=C(OCC(=O)O)C(Br)=C1 SBB043615 [0,1,0,0,0,1|2,0,0]=4 388 B14R1.103 COC1=CC=C(CCC(=O)O)C(C)=C1 SBB303070 [0,1,0,0,0,1|1,0,0]=3 389 B14R1.142 CCOC1=CC=C(CCC(=O)O)C=C1 SBB043645 [0,1,0,0,0,1|1,0,0]=3 390 B14R1.142 CCOC1=CC=C(\C=C\C(=O)Cl)C=C1 SBB050871 [0,1,0,0,0,1|1,0,1]=4 391 B14R1.142 CCOC1=CC=C(\C=C\C(=O)O)C=C1 SBB043517 [0,1,0,0,0,1|1,0,1]=4 392 B14R1.419 CC(=O)C1=CC=C(OCC(=O)O)C=C1 SBB063920 [0,1,0,0,0,1|2,0,0]=4 393 B14R1.419 CC(=O)C1=CC=C(OCC(N)=O)C=C1 SBB012924 [0,1,0,0,0,1|2,0,0]=4 394 B14R1.419 CC(=O)OCC1=CC=C([N+](=O)[O-])C=C1 SBB068843 [0,1,0,0,0,1|2,0,0]=4 395 B14R1.419 CC(=O)\C=C\C1=CC=C(N(C)C)C=C1 SBB017113 [0,1,0,0,0,1|1,0,1]=4 396 B14R1.419 CC(C)C1=CC=C(CCC(=O)O)C=C1 SBB017730 [0,1,0,0,0,1|2,0,0]=4 397 B14R1.419 CC(C)C1=CC=C(OCC(=O)Cl)C=C1 SBB050614 [0,1,0,0,0,1|2,0,0]=4 398 B14R1.419 CC(C)C1=CC=C(OCC(=O)O)C=C1 SBB004548 [0,1,0,0,0,1|2,0,0]=4 399 B14R1.419 CN(C)C1=CC=C(CCC(=O)O)C=C1 SBB085364 [0,1,0,0,0,1|2,0,0]=4 400 B14R1.3653 COC1=C(Br)C=C(\C=C\C(=O)O)C=C1 SBB015390 [0,1,0,0,0,1|1,0,1]=4 401 B14R1.3653 COC1=C(Cl)C=C(\C=C\C(=O)O)C=C1 SBB023926 [0,1,0,0,0,1|1,0,1]=4 402 B14R1.3653 COC1=C(O)C=C(\C=C\C(=O)O)C=C1 SBB042817 [0,1,0,0,0,1|1,0,1]=4 403 B14R1.3653 COC1=CC=C(CCC(=O)O)C=C1C SBB010912 [0,1,0,0,0,1|1,0,0]=3 404 B14R1.24 CCOC1=CC=C(NC(=O)CCl)C=C1 SBB000538 [0,2,0,0,0,0|1,0,0]=3 405 B14R1.24 COC(=O)CC1=CC=C(N=C=S)C=C1 SBB013662 [0,2,0,0,0,0|1,0,1]=4 406 B14R1.954 CCC1=CC=C(NC(=O)CC#N)C=C1 SBB016608 [0,2,0,0,0,0|2,0,0]=4 407 B14R1.954 CCNC(=S)NC1=CC=C(OC)C=C1 SBB000500 [0,2,0,0,0,0|1,1,0]=4 408 B14R1.954 CCOC(=O)CC1=CC=C(NN)C=C1 SBB053734 [0,2,0,0,0,0|2,0,0]=4 409 B14R1.954 COC1=CC=C(NC(=O)CC#N)C=C1 SBB023435 [0,2,0,0,0,0|1,0,0]=3 410 B14R1.954 COC1=CC=C(NC(=O)CCCl)C=C1 SBB040631 [0,2,0,0,0,0|1,0,0]=3 411 B14R1.954 COC1=CC=C(NC(=O)CCN)C=C1 SBB018517 [0,2,0,0,0,0|1,0,0]=3 412 B14R1.2879 CC(=O)C1=CC=C(NC(=O)CCl)C=C1 SBB003429 [0,2,0,0,0,0|2,0,0]=4 413 B14R1.2879 CC(C)C1=CC=C(NC(=O)CCl)C=C1 SBB040685 [0,2,0,0,0,0|2,0,0]=4 414 B14R1.2879 CN(C)C1=CC=C(NC(=O)CCl)C=C1 SBB040619 [0,2,0,0,0,0|2,0,0]=4 415 B14R1.3276 COC1=C(Cl)C=C(NC(=O)CCl)C=C1 SBB037899 [0,2,0,0,0,0|1,0,0]=3 416 B14R1.3651 COC1=C(C=O)C=C(CN(C)C)C=C1 SBB110892 [0,2,0,0,0,0|2,0,0]=4 417 B14R1.3651 COC1=C(OC)C=C(CC(C)O)C=C1 SBB072682 [0,2,0,0,0,0|0,0,2]=4 418 B14R1.3651 COC1=CC=C(CC(=O)O)C=C1OC SBB040533 [0,2,0,0,0,0|1,0,0]=3 419 B14R1.3651 COC1=CC=C(CC(C)=O)C=C1OC SBB051427 [0,2,0,0,0,0|0,0,0]=2 420 B14R1.3662 COC1=CC=C(CC(=O)O)C(F)=C1F SBB092891 [0,2,0,0,0,0|1,0,0]=3 421 B14R1.5801 CC(=O)NC1=CC(C)=C(C(C)=O)C=C1 SBB058980 [0,2,0,0,0,0|2,0,0]=4 422 B14R1.5801 CC(=O)OC1=CC=C(C(C)=O)C(O)=C1 SBB064191 [0,2,0,0,0,0|2,0,0]=4 423 B14R1.12535 COC1=C(F)C=C(CC(=O)O)C=C1Cl SBB095657 [0,2,0,0,0,0|1,0,0]=3 424 B14R1.12535 COC1=C(F)C=C(CC(=O)O)C=C1F SBB092890 [0,2,0,0,0,0|1,0,0]=3 425 B14R1.8 COC1=CC=C(C(CN)N(C)C)C=C1 SBB010170 [0,2,0,0,0,0|2,0,0]=4 426 B14R1.68 C=CCOC1=CC=C(NC(C)=O)C=C1 SBB091295 [0,2,0,0,0,0|1,0,0]=3 427 B14R1.68 CC(=O)NC1=CC=C(OCCBr)C=C1 SBB300053 [0,2,0,0,0,0|1,0,0]=3 428 B14R1.68 CC(=O)NC1=CC=C(OCCO)C=C1 SBB091874 [0,2,0,0,0,0|1,0,0]=3 429 B14R1.68 CCCCC1=CC=C(NC(C)=O)C=C1 SBB091321 [0,2,0,0,0,0|2,0,0]=4 430 B14R1.68 CCCOC1=CC=C(CC(=O)O)C=C1 SBB018026 [0,2,0,0,0,0|1,0,0]=3 431 B14R1.490 CCOC1=CC=C(NC(C)=O)C(N)=C1 SBB050338 [0,2,0,0,0,0|1,0,0]=3 432 B14R1.717 COC(=O)C1=CC=C(NC(C)=O)C=C1 SBB091569 [0,2,0,0,0,0|1,0,0]=3 433 B14R1.717 COC(=O)C1=CN=C(NC(C)=O)C=C1 SBB091721 [0,2,0,0,0,0|2,0,0]=4 434 B14R1.805 CC(=O)NC1=CC=C(NC(C)=O)C=C1 SBB006302 [0,2,0,0,0,0|2,0,0]=4 435 B14R1.805 CC(=O)OC1=CC=C(OC(C)=O)C=C1 SBB008048 [0,2,0,0,0,0|1,0,0]=3 436 B14R1.124 CC(=O)NC1=C(Br)C=C(C(C)=O)C=C1 SBB058022 [0,2,0,0,0,0|2,0,0]=4 437 B14R1.806 CC(=O)NC1=CC=C(C(C)(C)C)C=C1 SBB007960 [0,2,0,0,0,0|2,0,0]=4 438 B14R1.806 OC(=O)CC1=CC=C(S(C)(=O)=O)C=C1 SBB009970 [0,2,0,0,0,0|1,1,0]=4 439 B14R1.101 COC1=CC=C(CC(=O)O)C(OC)=C1 SBB042699 [0,2,0,0,0,0|1,0,0]=3 440 B14R1.560 COC1=CC(F)=C(CC(=O)O)C(F)=C1 SBB092884 [0,2,0,0,0,0|1,0,0]=3 441 B12R1.453 COC1=CC=C(O)C(C(C)=O)=C1 SBB063252 [0,0,1,1,0,0|1,0,1]=4 442 B12R2.606 CC1=CC2=C(C=C1)NC(=O)N2 SBB059280 [1,0,0,1,0,0|2,0,0]=4 443 B12R2.606 CC1=CC2=C(C=C1)NC(C)=N2 SBB045895 [1,0,0,1,0,0|2,0,0]=4 444 B12R2.606 CC1=CC2=C(C=C1)SC(C)=N2 SBB058748 [1,0,0,1,0,0|2,0,0]=4 445 B12R2.606 CC1=NC2=CC=C(O)C=C2O1 SBB072525 [1,0,0,1,0,0|1,0,1]=4 446 B12R2.606 NC1=CC=C2CC(=O)NC2=C1 SBB072398 [1,0,0,1,0,0|2,0,0]=4 447 B12R2.606 NC1=CC=C2NC(=O)CC2=C1 SBB010120 [1,0,0,1,0,0|2,0,0]=4 448 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)N1 SBB058442 [1,0,0,1,0,0|2,0,0]=4 449 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 SBB005897 [1,0,0,1,0,0|2,0,0]=4 450 B12R2.606 O=C1CC2=C(C=CC(Cl)=C2)N1 SBB003879 [1,0,0,1,0,0|2,0,0]=4 451 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 SBB018719 [1,0,0,1,0,0|2,0,0]=4 452 B12R2.606 O=C1CC2=CC(O)=CC=C2O1 SBB038172 [1,0,0,1,0,0|1,0,0]=3 453 B12R2.606 O=C1OC2=CC=C(O)C=C2S1 SBB012368 [1,0,0,1,0,0|2,0,0]=4 454 B12R2.606 OC1=CC2=C(C=C1)SC(=O)O2 SBB071406 [1,0,0,1,0,0|2,0,0]=4 455 B12R2.44 COC1=CC=C2C=CNC2=C1 SBB055970 [1,0,0,1,0,0|1,0,1]=4 456 B12R2.44 COC1=CC=C2NC=NC2=C1 SBB086586 [1,0,0,1,0,0|2,0,0]=4 457 B12R2.44 N1C=CC2=C1C=CC(OC)=C2 SBB004094 [1,0,0,1,0,0|1,0,1]=4 458 B14R2.134 COC1=CC=C2CCC(=O)CC2=C1 SBB056290 [0,0,0,1,0,1|0,0,0]=2 459 B14R2.2332 COC1=CC2=C(C=C1)N=C(C)C=C2 SBB059281 [0,1,0,1,0,0|2,0,0]=4 460 B14R2.2332 COC1=CC2=C(C=C1)NC(=O)CS2 SBB071471 [0,1,0,1,0,0|1,0,0]=3 461 B14R2.2332 COC1=CC=C2CC(=O)CCC2=C1 SBB056289 [0,1,0,1,0,0|0,0,0]=2 462 B14R2.3274 COC1=CC=C2NC(=O)C(=O)C2=C1 SBB067262 [0,1,0,1,0,0|1,0,1]=4 463 B14R2.3304 COC1=CC2=C(C=C1)NC(C=O)=C2 SBB300074 [0,1,0,1,0,0|1,0,1]=4 464 B14R2.3304 COC1=CC2=C(C=C1)OC(C=O)=C2 SBB303489 [0,1,0,1,0,0|1,0,1]=4 465 B14R2.3304 COC1=CC=C2NC(CCl)=NC2=C1 SBB005587 [0,1,0,1,0,0|2,0,0]=4 466 B14R2.3304 COC1=CC=C2NC(CCl)=NC2=C1 SBB018521 [0,1,0,1,0,0|2,0,0]=4 467 B14R2.3304 COC1=CC=C2OC(SC)=NC2=C1 SBB046568 [0,1,0,1,0,0|2,0,0]=4 468 B14R2.1008 CC(=O)NC1=CC=C2OCOC2=C1 SBB007866 [0,1,0,1,0,0|1,0,0]=3 469 B14R2.1008 O=C(Cl)CC1=CC2=C(C=C1)OCO2 SBB010977 [0,1,0,1,0,0|1,0,0]=3 470 B14R2.1008 O=C(O)CC1=CC2=C(C=C1)CCC2 SBB010596 [0,1,0,1,0,0|2,0,0]=4 471 B14R2.1008 O=C(O)CC1=CC2=C(C=C1)OC=N2 SBB053279 [0,1,0,1,0,0|1,0,1]=4 472 B14R2.1008 O=C(O)CC1=CC=C2OCCC2=C1 SBB063736 [0,1,0,1,0,0|1,0,0]=3 473 B14R2.1008 O=C(O)CC1=CC=C2OCOC2=C1 SBB000212 [0,1,0,1,0,0|1,0,0]=3 474 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 SBB040244 [1,0,0,0,1,0|1,0,0]=3 475 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 SBB055637 [1,0,0,0,1,0|2,0,0]=4 476 B10R1.13 CC(=O)C1=CC=C(C)C=C1 SBB058845 [1,0,0,0,1,0|0,0,0]=2 477 B10R1.13 CC(=O)C1=CC=C(C)N=C1 SBB055610 [1,0,0,0,1,0|1,0,0]=3 478 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 SBB040243 [1,0,0,0,1,0|1,0,0]=3 479 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 SBB055593 [1,0,0,0,1,0|2,0,0]=4 480 B10R1.13 CC(=O)C1=CC=C(F)C=C1 SBB040257 [1,0,0,0,1,0|1,0,0]=3 481 B10R1.13 CC(=O)C1=CC=C(I)C=C1 SBB058956 [1,0,0,0,1,0|1,0,0]=3 482 B10R1.13 CC(=O)C1=CC=C(N)C=C1 SBB040278 [1,0,0,0,1,0|1,0,0]=3 483 B10R1.13 CC(=O)C1=CC=C(O)C=C1 SBB040251 [1,0,0,0,1,0|0,0,0]=2 484 B10R1.13 CC(N)C1=CC=C(O)C=C1 SBB008453 [1,0,0,0,1,0|1,0,1]=4 485 B10R1.13 CC(N)C1=CC=C(O)C=C1 SBB080372 [1,0,0,0,1,0|1,0,1]=4 486 B10R1.13 CC1=CC=C(C(=N)N)C=C1 SBB088463 [1,0,0,0,1,0|2,0,0]=4 487 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 SBB058746 [1,0,0,0,1,0|1,0,0]=3 488 B10R1.13 CC1=CC=C(C(=O)O)C=C1 SBB040516 [1,0,0,0,1,0|1,0,0]=3 489 B10R1.13 CC1=CC=C(C(=O)O)C=N1 SBB006666 [1,0,0,0,1,0|2,0,0]=4 490 B10R1.13 CC1=CC=C(C(C)C)C=C1 SBB060399 [1,0,0,0,1,0|1,0,1]=4 491 B10R1.13 CC1=CC=C(C(C)N)C=C1 SBB010017 [1,0,0,0,1,0|1,0,1]=4 492 B10R1.13 CC1=CC=C(C(C)O)C=C1 SBB061733 [1,0,0,0,1,0|0,0,2]=4 493 B10R1.13 CC1=CC=C(C(N)=O)C=C1 SBB007862 [1,0,0,0,1,0|1,0,0]=3 494 B10R1.13 CC1=CC=C(C(N)=S)C=C1 SBB016502 [1,0,0,0,1,0|1,1,0]=4 495 B10R1.13 CC1=CN=C(C(=O)O)C=C1 SBB052876 [1,0,0,0,1,0|2,0,0]=4 496 B10R1.13 CC1=NC=C(C(N)=O)C=C1 SBB028251 [1,0,0,0,1,0|2,0,0]=4 497 B10R1.13 NC(=O)C1=CC=C(F)C=C1 SBB086057 [1,0,0,0,1,0|2,0,0]=4 498 B10R1.13 NC(=O)C1=CC=C(N)C=C1 SBB028159 [1,0,0,0,1,0|2,0,0]=4 499 B10R1.13 NC(=O)C1=CC=C(O)C=C1 SBB058350 [1,0,0,0,1,0|1,0,0]=3 500 B10R1.13 NC(=S)C1=CC=C(O)C=C1 SBB066605 [1,0,0,0,1,0|1,1,0]=4 501 B10R1.13 NC1=CC=C(C(=O)O)C=C1 SBB058665 [1,0,0,0,1,0|2,0,0]=4 502 B10R1.13 O=C(Cl)C1=CC=C(Br)C=C1 SBB058718 [1,0,0,0,1,0|2,0,0]=4 503 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 SBB058751 [1,0,0,0,1,0|2,0,0]=4 504 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 SBB040628 [1,0,0,0,1,0|2,0,0]=4 505 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 SBB040519 [1,0,0,0,1,0|2,0,0]=4 506 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 SBB040517 [1,0,0,0,1,0|2,0,0]=4 507 B10R1.13 O=C(O)C1=CC=C(F)C=C1 SBB008568 [1,0,0,0,1,0|2,0,0]=4 508 B10R1.13 O=C(O)C1=CC=C(I)C=C1 SBB063146 [1,0,0,0,1,0|2,0,0]=4 509 B10R1.13 O=C(O)C1=CC=C(O)N=C1 SBB004181 [1,0,0,0,1,0|2,0,0]=4 510 B10R1.13 O=C(O)C1=NC=C(O)C=C1 SBB052998 [1,0,0,0,1,0|2,0,0]=4 511 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 SBB040875 [1,0,0,0,1,0|2,0,0]=4 512 B10R1.54 CC(=O)CN1C=C(C)C=N1 SBB026107 [1,0,0,0,1,0|2,0,0]=4 513 B10R1.54 CC(=O)CN1C=CC(C)=N1 SBB022223 [1,0,0,0,1,0|2,0,0]=4 514 B10R1.31 CCC1=CC=C(C(C)=O)S1 SBB021979 [0,0,0,0,2,0|2,0,0]=4 515 B10R1.31 COC1=CC=C(C(=O)O)S1 SBB023958 [0,0,0,0,2,0|2,0,0]=4 516 B12R1.21 C=C(C)COC1=CC=C(N)C=C1 SBB080146 [1,0,0,0,0,1|2,0,0]=4 517 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 SBB056768 [1,0,0,0,0,1|0,0,0]=2 518 B12R1.21 CC(=O)COC1=CC=C(Cl)C=C1 SBB072870 [1,0,0,0,0,1|1,0,0]=3 519 B12R1.21 CC(=O)CSC1=CC=C(C)C=C1 SBB089710 [1,0,0,0,0,1|0,0,0]=2 520 B12R1.21 CC(=O)CSC1=CC=C(Cl)C=C1 SBB057983 [1,0,0,0,0,1|1,0,0]=3 521 B12R1.21 CC(=O)CSC1=CC=C(F)C=C1 SBB090182 [1,0,0,0,0,1|1,0,0]=3 522 B12R1.21 CC(=O)NCC1=CC=C(F)C=C1 SBB055227 [1,0,0,0,0,1|1,0,0]=3 523 B12R1.21 CC(=O)OCC1=CC=C(C)C=C1 SBB116862 [1,0,0,0,0,1|0,0,0]=2 524 B12R1.21 CC(=O)\C=C\C1=CC=C(Br)C=C1 SBB017373 [1,0,0,0,0,1|1,0,1]=4 525 B12R1.21 CC(=O)\C=C\C1=CC=C(Cl)C=C1 SBB089732 [1,0,0,0,0,1|1,0,1]=4 526 B12R1.21 CC(=O)\C=C\C1=CC=C(F)C=C1 SBB087791 [1,0,0,0,0,1|1,0,1]=4 527 B12R1.21 CC1=CC=C(CCC(=O)O)C=C1 SBB016295 [1,0,0,0,0,1|1,0,0]=3 528 B12R1.21 CC1=CC=C(CNC(N)=S)C=C1 SBB017712 [1,0,0,0,0,1|1,1,0]=4 529 B12R1.21 CC1=CC=C(NCC(=O)O)C=C1 SBB046297 [1,0,0,0,0,1|1,0,0]=3 530 B12R1.21 CC1=CC=C(OCC(=O)O)C=C1 SBB004531 [1,0,0,0,0,1|1,0,0]=3 531 B12R1.21 CC1=CC=C(SCC(=O)O)C=C1 SBB038335 [1,0,0,0,0,1|1,0,0]=3 532 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 SBB015822 [1,0,0,0,0,1|1,0,1]=4 533 B12R1.21 CC1=CC=C(\C=C\C(N)=O)C=C1 SBB113392 [1,0,0,0,0,1|1,0,1]=4 534 B12R1.21 NC(=O)COC1=CC=C(F)C=C1 SBB088264 [1,0,0,0,0,1|2,0,0]=4 535 B12R1.21 NC(=O)COC1=CC=C(N)C=C1 SBB006760 [1,0,0,0,0,1|2,0,0]=4 536 B12R1.21 NC(=O)NCC1=CC=C(F)C=C1 SBB088171 [1,0,0,0,0,1|2,0,0]=4 537 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 SBB010089 [1,0,0,0,0,1|2,0,0]=4 538 B12R1.21 NC1=CC=C(OCC(=O)O)C=C1 SBB001635 [1,0,0,0,0,1|2,0,0]=4 539 B12R1.21 O=C(Cl)COC1=CC=C(Cl)C=C1 SBB009959 [1,0,0,0,0,1|2,0,0]=4 540 B12R1.21 O=C(Cl)COC1=CC=C(F)C=C1 SBB010782 [1,0,0,0,0,1|2,0,0]=4 541 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 SBB017617 [1,0,0,0,0,1|2,0,0]=4 542 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 SBB010179 [1,0,0,0,0,1|2,0,0]=4 543 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 SBB017621 [1,0,0,0,0,1|2,0,0]=4 544 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 SBB052832 [1,0,0,0,0,1|2,0,0]=4 545 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 SBB064098 [1,0,0,0,0,1|1,0,0]=3 546 B12R1.21 O=C(O)CNC1=CC=C(Cl)C=C1 SBB016740 [1,0,0,0,0,1|2,0,0]=4 547 B12R1.21 O=C(O)CNC1=CC=C(F)C=C1 SBB063172 [1,0,0,0,0,1|2,0,0]=4 548 B12R1.21 O=C(O)CNC1=CC=C(O)C=C1 SBB003884 [1,0,0,0,0,1|1,0,0]=3 549 B12R1.21 O=C(O)COC1=CC=C(Br)C=C1 SBB004535 [1,0,0,0,0,1|2,0,0]=4 550 B12R1.21 O=C(O)COC1=CC=C(Cl)C=C1 SBB004537 [1,0,0,0,0,1|2,0,0]=4 551 B12R1.21 O=C(O)COC1=CC=C(F)C=C1 SBB030014 [1,0,0,0,0,1|2,0,0]=4 552 B12R1.21 O=C(O)COC1=CC=C(I)C=C1 SBB063740 [1,0,0,0,0,1|2,0,0]=4 553 B12R1.21 O=C(O)CSC1=CC=C(F)C=C1 SBB052749 [1,0,0,0,0,1|2,0,0]=4 554 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 SBB007613 [1,0,0,0,0,1|1,0,1]=4 555 B12R1.21 OC(=O)CSC1=CC=C(Cl)C=C1 SBB003520 [1,0,0,0,0,1|2,0,0]=4 556 B12R1.438 COC1=CC(NC(C)=O)=CC=C1 SBB080674 [0,0,0,0,1,1|1,0,0]=3 557 B12R1.438 COC1=CC=CC(CC(=O)O)=C1 SBB042511 [0,0,0,0,1,1|1,0,0]=3 558 B12R1.438 COC1=CC=CC(CC(N)=S)=C1 SBB055060 [0,0,0,0,1,1|1,1,0]=4 559 B12R1.438 COC1=CC=CC(NC(N)=O)=C1 SBB087993 [0,0,0,0,1,1|2,0,0]=4 560 B12R1.438 CSC1=CC(NC(C)=O)=CC=C1 SBB115887 [0,0,0,0,1,1|1,1,0]=4 561 B14R1.4 COC1=CC=C(CCCC(=O)O)C=C1 SBB063261 [0,0,0,0,0,2|1,0,0]=3 562 B14R1.4 COC1=CC=C(OCCC(=O)O)C=C1 SBB091985 [0,0,0,0,0,2|1,0,0]=3 563 B14R1.4 COC1=CC=C(\C=N/NC(N)=O)C=C1 SBB112644 [0,0,0,0,0,2|1,0,1]=4