0 B10R1.13 C=C(Br)C1=CC=C(C)C=C1 CS-1224828 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.13 C=C(C)C1=CC=C(Br)C=C1 CS-0208559 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.13 C=C(C)C1=CC=C(I)C=C1 CS-0465842 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.13 C=C(C)C1=CN=C(Cl)C=C1 CS-0968611 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.13 C=C(Cl)C1=CC=C(Br)C=C1 CS-0236348 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.13 CC(=O)C1=CC=C(S)C=C1 CS-0244211 [0,0,0,0,0,0|1,1,0]=2 6 B10R1.13 CC(=O)C1=NN=C(C)C=C1 CS-0056546 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.13 CC(C)C1=CC=C(Cl)C=C1 CS-0211648 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.13 CC(C)C1=NC=C(O)C=C1 CS-0335671 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.13 CC(N)C1=CC=C(I)C=C1 CS-1044402 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.13 CC(O)C1=CC=C(I)C=C1 CS-0343358 [0,0,0,0,0,0|2,0,1]=3 11 B10R1.13 CC(O)C1=CC=C(S)C=C1 CS-0239751 [0,0,0,0,0,0|1,1,1]=3 12 B10R1.13 CC1=CC=C(C(=O)[O-])C=C1 CS-0731785 [0,0,0,0,0,0|1,0,1]=2 13 B10R1.13 CC1=CC=C(C(C)N)C=C1 CS-0211410 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 CS-0362628 [0,0,0,0,0,0|2,0,1]=3 15 B10R1.13 CC1=CC=C([IH2](F)F)C=C1 CS-0179659 [0,0,0,0,0,0|4,0,0]=4 16 B10R1.13 CC1=CN=C(B([O-])O)C=C1 CS-0176827 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.13 CC1=CN=C(C(C)O)C=C1 CS-0103313 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.13 CN(C)C1=CC=C(F)C=C1 CS-0452170 [0,0,0,0,0,0|4,0,0]=4 19 B10R1.13 CN(C)C1=CC=C(O)C=N1 CS-0516480 [0,0,0,0,0,0|4,0,0]=4 20 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 CS-0321007 [0,0,0,0,0,0|2,0,1]=3 21 B10R1.13 C[C@@H](O)C1=CC=C(O)C=C1 CS-0242105 [0,0,0,0,0,0|1,0,1]=2 22 B10R1.13 C[C@@H](O)C1=NC=C(O)C=N1 CS-0059960 [0,0,0,0,0,0|3,0,1]=4 23 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 CS-0197088 [0,0,0,0,0,0|3,0,1]=4 24 B10R1.13 C[C@H](O)C1=CC=C(Br)C=N1 CS-0169410 [0,0,0,0,0,0|3,0,1]=4 25 B10R1.13 C[C@H](O)C1=CC=C(I)C=C1 CS-0259153 [0,0,0,0,0,0|2,0,1]=3 26 B10R1.13 C[C@H](O)C1=CC=C(N)C=C1 CS-0147823 [0,0,0,0,0,0|2,0,1]=3 27 B10R1.13 C[C@H](O)C1=CC=C(O)C=C1 CS-0242103 [0,0,0,0,0,0|1,0,1]=2 28 B10R1.13 C[S+](C)C1=CC=C(O)C=C1 CS-0511825 [0,0,0,0,0,0|3,0,0]=3 29 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 CS-0060230 [0,0,0,0,0,0|3,0,0]=3 30 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 CS-0206859 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.13 N=C(N)C1=NC=C(F)C=C1 CS-0183196 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.13 NC(=O)C1=CC=C(F)N=C1 CS-0239553 [0,0,0,0,0,0|3,0,0]=3 33 B10R1.13 NC(=O)C1=CNC(=O)N=C1 CS-0045607 [0,0,0,0,0,0|3,0,1]=4 34 B10R1.13 NC(=O)C1=NN=C(N)C=C1 CS-0050340 [0,0,0,0,0,0|4,0,0]=4 35 B10R1.13 NC1=CC=C(B(O)O)C=C1 CS-0174693 [0,0,0,0,0,0|2,0,1]=3 36 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 CS-0778678 [0,0,0,0,0,0|1,0,1]=2 37 B10R1.13 NC1=NC=C(C(=O)O)N=N1 CS-0883583 [0,0,0,0,0,0|4,0,0]=4 38 B10R1.13 O=C(O)C1=CN=C(F)N=C1 CS-0885059 [0,0,0,0,0,0|3,0,0]=3 39 B10R1.13 O=C(O)C1=NC=C(F)N=C1 CS-0104512 [0,0,0,0,0,0|3,0,0]=3 40 B9R1.1 C#CC1=CC=C(O)C=C1 CS-0266218 [1,0,0,0,0,0|1,0,1]=3 41 B9R1.1 C=CC1=CN=C(Br)C=C1 CS-0267198 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.1 C=CC1=CN=C(O)C=C1 CS-0339254 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.1 C=CC1=NC=C(Br)C=C1 CS-0199043 [1,0,0,0,0,0|3,0,0]=4 44 B9R1.1 CC1=CN=C(C=O)N=C1 CS-0050426 [1,0,0,0,0,0|3,0,0]=4 45 B9R1.1 CC1=NN=C(C=O)C=C1 CS-0108567 [1,0,0,0,0,0|3,0,0]=4 46 B9R1.1 CCC1=CC=C(S)C=C1 CS-0296669 [1,0,0,0,0,0|1,1,1]=4 47 B9R1.1 CNC1=CC=C(Cl)C=C1 CS-0465118 [1,0,0,0,0,0|3,0,0]=4 48 B9R1.1 CNC1=CC=C(O)C=C1 CS-0166765 [1,0,0,0,0,0|2,0,0]=3 49 B9R1.1 CNC1=CC=C(O)C=C1 CS-0323491 [1,0,0,0,0,0|2,0,0]=3 50 B9R1.1 CSC1=CC=C(O)C=N1 CS-0459146 [1,0,0,0,0,0|3,0,0]=4 51 B9R1.1 NC1=CC=C(CO)C=C1 CS-0735554 [1,0,0,0,0,0|1,0,1]=3 52 B9R1.1 NC1=CC=C(CO)N=C1 CS-0112973 [1,0,0,0,0,0|2,0,1]=4 53 B9R1.1 NC1=CN=C(C=O)C=C1 CS-0112970 [1,0,0,0,0,0|2,0,0]=3 54 B9R1.1 NC1=CN=C(C=O)C=N1 CS-0160727 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.1 NCC1=CC=C(F)C=C1 CS-0214160 [1,0,0,0,0,0|2,0,1]=4 56 B9R1.1 NCC1=CC=C(O)C=C1 CS-0070437 [1,0,0,0,0,0|1,0,1]=3 57 B9R1.1 NCC1=CC=C(O)C=C1 CS-0268378 [1,0,0,0,0,0|1,0,1]=3 58 B9R1.1 NNC1=CC=C(Cl)C=C1 CS-0962234 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.1 O=CC1=CC=C(Br)N=N1 CS-0309971 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.1 O=CC1=CN=C(Br)N=C1 CS-0471250 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.1 O=CC1=CNC(=S)N=C1 CS-0514540 [1,0,0,0,0,0|2,1,0]=4 62 B9R1.1 O=CC1=NC=C(Cl)C=N1 CS-0054733 [1,0,0,0,0,0|3,0,0]=4 63 B9R1.1 OCC1=CC=C(O)C=C1 CS-0229718 [1,0,0,0,0,0|0,0,1]=2 64 B9R1.1 OCC1=NN=C(O)C=C1 CS-0238040 [1,0,0,0,0,0|2,0,1]=4 65 B9R1.6 FC(F)C1=CC=CC=C1 CS-0313522 [1,0,0,0,0,0|2,0,1]=4 66 B9R1.6 N=C(N)C1=CC=CN=C1 CS-0998730 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.6 NC(=O)C1=CN=NC=C1 CS-0212821 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.6 NC(=O)C1=NC=NC=C1 CS-0155568 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.6 NS(=O)C1=CC=CC=C1 CS-1022807 [1,0,0,0,0,0|2,0,0]=3 70 B9R1.6 O=C([O-])C1=NC=CC=N1 CS-0071863 [1,0,0,0,0,0|2,0,1]=4 71 B9R1.6 O=S(Cl)C1=CC=CC=C1 CS-0965673 [1,0,0,0,0,0|2,0,0]=3 72 B9R1.6 OB(O)C1=CC=NC=C1 CS-0175166 [1,0,0,0,0,0|2,0,1]=4 73 B11R1.3 C#CC1=CC=C(C(=O)O)C=N1 CS-0332154 [0,1,0,0,0,0|2,0,0]=3 74 B11R1.3 C=CC1=CC=C(C(C)=O)C=C1 CS-0722909 [0,1,0,0,0,0|2,0,0]=3 75 B11R1.3 CC(N)C1=CC=C(CO)C=C1 CS-D0432 [0,1,0,0,0,0|2,0,1]=4 76 B11R1.3 CCC1=CC=C([C@@H](C)O)C=C1 CS-0238477 [0,1,0,0,0,0|2,0,1]=4 77 B11R1.3 CCC1=CN=C(C(=O)O)C=N1 CS-0433837 [0,1,0,0,0,0|3,0,0]=4 78 B11R1.3 CNC1=CC=C(C(=N)N)C=C1 CS-0222712 [0,1,0,0,0,0|3,0,0]=4 79 B11R1.3 CNC1=CN=C(C(=O)O)C=N1 CS-0483809 [0,1,0,0,0,0|3,0,0]=4 80 B11R1.3 COC1=CN=C(C(C)=O)N=C1 CS-0458471 [0,1,0,0,0,0|3,0,0]=4 81 B11R1.3 COC1=NC=C(B(O)O)C=C1 CS-0176148 [0,1,0,0,0,0|2,0,1]=4 82 B11R1.3 CS(=O)C1=CC=C(C#N)C=C1 CS-0079978 [0,1,0,0,0,0|3,0,0]=4 83 B11R1.3 CS(=O)C1=CC=C(CN)C=C1 CS-0172669 [0,1,0,0,0,0|3,0,0]=4 84 B11R1.3 CSC1=CC=C(C(N)=S)C=C1 CS-0303873 [0,1,0,0,0,0|1,2,0]=4 85 B11R1.3 CSC1=CC=C([C@@H](C)O)C=C1 CS-0671945 [0,1,0,0,0,0|1,1,1]=4 86 B11R1.3 CSC1=CC=C([C@H](C)O)C=C1 CS-0217849 [0,1,0,0,0,0|1,1,1]=4 87 B11R1.3 C[C@H](N)C1=CC=C(CO)C=C1 CS-D0431 [0,1,0,0,0,0|2,0,1]=4 88 B11R1.3 N#CC1=CN=C(C(=O)O)N=C1 CS-0227558 [0,1,0,0,0,0|3,0,0]=4 89 B11R1.3 N#[N+]C1=CC=C([N+](=O)[O-])C=C1 CS-0452650 [0,1,0,0,0,0|2,0,1]=4 90 B11R1.3 N=C(N)C1=CC=C(C=O)C=C1 CS-0170925 [0,1,0,0,0,0|2,0,1]=4 91 B11R1.3 NC(=O)C1=CN=C(CO)C=N1 CS-0327409 [0,1,0,0,0,0|3,0,0]=4 92 B11R1.3 NC(=O)C1=NC=C(CO)C=C1 CS-0539285 [0,1,0,0,0,0|2,0,0]=3 93 B11R1.3 NCC1=CC=C(C(=O)O)C=N1 CS-0068191 [0,1,0,0,0,0|2,0,0]=3 94 B11R1.3 NCC1=NC=C(C(=O)O)C=C1 CS-0674147 [0,1,0,0,0,0|2,0,0]=3 95 B11R1.3 NNC1=CC=C(C(N)=O)C=C1 CS-0209694 [0,1,0,0,0,0|2,0,0]=3 96 B11R1.3 O=C(O)C1=CC=C(CF)C=C1 CS-0482902 [0,1,0,0,0,0|1,0,0]=2 97 B11R1.3 OCC1=CC=C(B(O)O)C=N1 CS-0088413 [0,1,0,0,0,0|2,0,1]=4 98 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-0029958 [0,1,0,0,0,0|2,0,0]=3 99 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-0040186 [0,1,0,0,0,0|2,0,0]=3 100 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-0054576 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-0139721 [0,1,0,0,0,0|2,0,0]=3 102 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-0185464 [0,1,0,0,0,0|2,0,0]=3 103 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-0254212 [0,1,0,0,0,0|2,0,0]=3 104 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-0340728 [0,1,0,0,0,0|2,0,0]=3 105 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-0442435 [0,1,0,0,0,0|2,0,0]=3 106 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-0505974 [0,1,0,0,0,0|2,0,0]=3 107 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-1056852 [0,1,0,0,0,0|2,0,0]=3 108 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-1056978 [0,1,0,0,0,0|2,0,0]=3 109 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-W018401 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 CS-0008009 [0,1,0,0,0,0|2,0,1]=4 111 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 CS-0085381 [0,1,0,0,0,0|2,0,1]=4 112 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 CS-0505219 [0,1,0,0,0,0|2,0,1]=4 113 B11R1.19 CS(=O)(=O)C1=CC=C(N)C=C1 CS-0207250 [0,1,0,0,0,0|2,0,1]=4 114 B11R1.19 C[Si](C)(C)C1=CC=C(O)C=C1 CS-0107197 [0,1,0,0,0,0|2,1,0]=4 115 B11R1.19 NC1=CC=C(P(=O)(O)O)C=C1 CS-0453341 [0,1,0,0,0,0|2,0,0]=3 116 B11R1.19 NC1=CC=C(S(=O)(=O)O)C=C1 CS-0204417 [0,1,0,0,0,0|2,0,0]=3 117 B11R1.19 NC1=CC=C(S(=O)(=O)[O-])C=C1 CS-0777351 [0,1,0,0,0,0|2,0,1]=4 118 B11R1.19 NS(=O)(=O)C1=CC=C(Cl)C=C1 CS-0039236 [0,1,0,0,0,0|2,0,1]=4 119 B11R1.19 O=P(O)(O)C1=CC=C(I)C=C1 CS-0246691 [0,1,0,0,0,0|2,0,0]=3 120 B11R1.19 O=P(O)(O)C1=CC=C(O)C=C1 CS-0318055 [0,1,0,0,0,0|1,0,0]=2 121 B11R1.19 O=S(=O)(F)C1=CC=C(I)C=C1 CS-0133613 [0,1,0,0,0,0|2,0,1]=4 122 B11R1.19 O=S(=O)(O)C1=CN=C(Cl)C=C1 CS-0217117 [0,1,0,0,0,0|3,0,0]=4 123 B11R1.19 OC1=CC=C([B+3]([F-])([F-])[F-])C=C1 CS-0034971 [0,1,0,0,0,0|3,0,0]=4 124 B11R1.21 CC(=O)C1=CC(C)=C(C)N=C1 CS-0456971 [0,1,0,0,0,0|3,0,0]=4 125 B11R1.21 CC(=O)C1=CC(I)=C(Br)C=C1 CS-0461683 [0,1,0,0,0,0|2,0,0]=3 126 B11R1.21 CC(=O)C1=CC(N)=C(C)C=C1 CS-0718212 [0,1,0,0,0,0|2,0,0]=3 127 B11R1.21 CC(=O)C1=CC(O)=C(Br)C=C1 CS-0060843 [0,1,0,0,0,0|2,0,0]=3 128 B11R1.21 CC(=O)C1=CC(O)=C(Cl)C=C1 CS-0192340 [0,1,0,0,0,0|2,0,0]=3 129 B11R1.21 CC(=O)C1=CC(O)=C(N)C=C1 CS-0214952 [0,1,0,0,0,0|2,0,0]=3 130 B11R1.21 CC(=O)C1=CC=C(I)C(C)=C1 CS-0757765 [0,1,0,0,0,0|2,0,0]=3 131 B11R1.21 CC(=O)C1=CC=C(I)C(Cl)=C1 CS-0513484 [0,1,0,0,0,0|2,0,0]=3 132 B11R1.21 CC(O)C1=CC(Br)=C(F)C=C1 CS-0195480 [0,1,0,0,0,0|2,0,1]=4 133 B11R1.21 CC(O)C1=CC(Cl)=C(F)C=C1 CS-0250854 [0,1,0,0,0,0|2,0,1]=4 134 B11R1.21 CC(O)C1=CC=C(Br)C(F)=C1 CS-0222579 [0,1,0,0,0,0|2,0,1]=4 135 B11R1.21 CC1=C(Br)N=C(C(=O)O)C=C1 CS-W006311 [0,1,0,0,0,0|2,0,0]=3 136 B11R1.21 CC1=C(Br)N=C(C(N)=O)C=C1 CS-0781423 [0,1,0,0,0,0|3,0,0]=4 137 B11R1.21 CC1=C(F)C=C(C(N)=S)C=C1 CS-0448319 [0,1,0,0,0,0|2,1,0]=4 138 B11R1.21 CC1=C(F)N=C(C(=O)O)C=C1 CS-0308379 [0,1,0,0,0,0|2,0,0]=3 139 B11R1.21 CC1=C(I)C=CC(C(N)=O)=C1 CS-0731395 [0,1,0,0,0,0|2,0,0]=3 140 B11R1.21 CC1=CC(C(=O)O)=CN=C1Br CS-0195777 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.21 CC1=CC(C(=O)O)=NC=C1Cl CS-0191962 [0,1,0,0,0,0|2,0,0]=3 142 B11R1.21 CC1=CC(C(C)O)=CC=C1Cl CS-0316728 [0,1,0,0,0,0|2,0,1]=4 143 B11R1.21 CC1=CC(C(N)=O)=CC=C1N CS-0061267 [0,1,0,0,0,0|2,0,0]=3 144 B11R1.21 CC1=CC(C(N)=O)=NC=C1Br CS-0194440 [0,1,0,0,0,0|3,0,0]=4 145 B11R1.21 CC1=CC=C(C(=N)N)C=C1C CS-0076035 [0,1,0,0,0,0|3,0,0]=4 146 B11R1.21 CC1=CC=C(C(C)O)C=C1C CS-0451317 [0,1,0,0,0,0|2,0,1]=4 147 B11R1.21 CC1=CC=C(C(N)=O)C=C1C CS-0206484 [0,1,0,0,0,0|2,0,0]=3 148 B11R1.21 CC1=CC=C(C(N)=O)C=C1N CS-0204893 [0,1,0,0,0,0|2,0,0]=3 149 B11R1.21 CC1=CC=C(C(N)=S)C=C1Br CS-0973820 [0,1,0,0,0,0|2,1,0]=4 150 B11R1.21 CC1=CC=C(C(N)=S)C=C1C CS-0281453 [0,1,0,0,0,0|2,1,0]=4 151 B11R1.21 CC1=CC=C([C@@H](C)O)C=C1C CS-0252190 [0,1,0,0,0,0|2,0,1]=4 152 B11R1.21 CC1=CC=C([C@@H](C)O)C=C1F CS-0266830 [0,1,0,0,0,0|2,0,1]=4 153 B11R1.21 CC1=CC=C([C@H](C)O)C=C1C CS-0251277 [0,1,0,0,0,0|2,0,1]=4 154 B11R1.21 CC1=CC=C([C@H](C)O)C=C1F CS-0266653 [0,1,0,0,0,0|2,0,1]=4 155 B11R1.21 CC1=CN=C(C(N)=O)C=C1Cl CS-0777691 [0,1,0,0,0,0|3,0,0]=4 156 B11R1.21 CC1=NC(C(=O)O)=CC=C1O CS-0534071 [0,1,0,0,0,0|1,0,0]=2 157 B11R1.21 CC1=NC(C(=O)O)=NC=C1Br CS-0567761 [0,1,0,0,0,0|3,0,0]=4 158 B11R1.21 CC1=NC(C(N)=O)=CC=C1Br CS-0195132 [0,1,0,0,0,0|3,0,0]=4 159 B11R1.21 CC1=NC=C(C(=O)O)C=C1N CS-0050680 [0,1,0,0,0,0|2,0,0]=3 160 B11R1.21 C[C@@H](O)C1=CC=C(Cl)C(Br)=C1 CS-0513048 [0,1,0,0,0,0|2,0,1]=4 161 B11R1.21 C[C@H](O)C1=CC(Br)=C(Cl)C=C1 CS-1019156 [0,1,0,0,0,0|2,0,1]=4 162 B11R1.21 C[C@H](O)C1=CC=C(Cl)C(Cl)=C1 CS-0250980 [0,1,0,0,0,0|2,0,1]=4 163 B11R1.21 C[C@H](O)C1=CC=C(F)C(Cl)=C1 CS-0266671 [0,1,0,0,0,0|2,0,1]=4 164 B11R1.21 N=C(N)C1=CC(Br)=C(F)C=C1 CS-0319059 [0,1,0,0,0,0|3,0,0]=4 165 B11R1.21 N=C(N)C1=CC(F)=C(Br)C=C1 CS-0215793 [0,1,0,0,0,0|3,0,0]=4 166 B11R1.21 NC(=O)C1=CC(Cl)=C(Cl)N=C1 CS-0466357 [0,1,0,0,0,0|3,0,0]=4 167 B11R1.21 NC(=O)C1=CC(I)=C(Br)C=C1 CS-0577321 [0,1,0,0,0,0|2,0,0]=3 168 B11R1.21 NC(=O)C1=CC(O)=C(Cl)C=C1 CS-0679362 [0,1,0,0,0,0|2,0,0]=3 169 B11R1.21 NC(=O)C1=CC(O)=C(F)C=C1 CS-0692697 [0,1,0,0,0,0|2,0,0]=3 170 B11R1.21 NC(=O)C1=CC=C(Cl)C(I)=C1 CS-0608113 [0,1,0,0,0,0|2,0,0]=3 171 B11R1.21 NC(=O)C1=CC=C(N)C(F)=C1 CS-0209444 [0,1,0,0,0,0|2,0,0]=3 172 B11R1.21 NC(=O)C1=CC=C(O)C(N)=C1 CS-0292846 [0,1,0,0,0,0|1,0,0]=2 173 B11R1.21 NC(=O)C1=CC=C(O)C(O)=C1 CS-0205433 [0,1,0,0,0,0|1,0,0]=2 174 B11R1.21 NC(=O)C1=NC(Br)=C(F)C=C1 CS-0315159 [0,1,0,0,0,0|3,0,0]=4 175 B11R1.21 NC(=S)C1=CC(F)=C(F)C=C1 CS-0308918 [0,1,0,0,0,0|2,1,0]=4 176 B11R1.21 NC(=S)C1=CC=C(Cl)C(Cl)=C1 CS-0205102 [0,1,0,0,0,0|2,1,0]=4 177 B11R1.21 NC(=S)C1=CC=C(O)C(F)=C1 CS-0235677 [0,1,0,0,0,0|1,1,0]=3 178 B11R1.21 NC1=C(Cl)C=CC(B(O)O)=C1 CS-0174302 [0,1,0,0,0,0|2,0,1]=4 179 B11R1.21 NC1=C(F)C=C(B(O)O)C=C1 CS-0174690 [0,1,0,0,0,0|2,0,1]=4 180 B11R1.21 NC1=C(N)C=C([N+](=O)[O-])C=C1 CS-0589887 [0,1,0,0,0,0|2,0,1]=4 181 B11R1.21 NC1=C(O)C=C(C(=O)O)C=N1 CS-0075501 [0,1,0,0,0,0|2,0,0]=3 182 B11R1.21 NC1=C(O)N=CC(C(=O)O)=C1 CS-0508044 [0,1,0,0,0,0|1,0,0]=2 183 B11R1.21 NC1=CC(B(O)O)=CC=C1Br CS-0178348 [0,1,0,0,0,0|2,0,1]=4 184 B11R1.21 NC1=CN=C(C(=O)O)C=C1Cl CS-0533188 [0,1,0,0,0,0|2,0,0]=3 185 B11R1.21 O=C(O)C1=CC(=O)C(O)=CN1 CS-0162522 [0,1,0,0,0,0|1,0,0]=2 186 B11R1.21 O=C(O)C1=CC(=O)C(O)=CN1 CS-0719550 [0,1,0,0,0,0|1,0,0]=2 187 B11R1.21 O=C(O)C1=CC(Cl)=C(O)C=C1 CS-0776531 [0,1,0,0,0,0|0,0,0]=1 188 B11R1.21 O=C(O)C1=CC(O)=C(Br)N=C1 CS-0239887 [0,1,0,0,0,0|2,0,0]=3 189 B11R1.21 O=C(O)C1=CC(S)=C(F)C=C1 CS-0263146 [0,1,0,0,0,0|1,0,0]=2 190 B11R1.21 O=C(O)C1=CC=C(Cl)C(=O)N1 CS-0127898 [0,1,0,0,0,0|2,0,0]=3 191 B11R1.21 O=C(O)C1=CC=C(F)C(F)=C1 CS-0511311 [0,1,0,0,0,0|1,0,0]=2 192 B11R1.21 O=C(O)C1=CN(O)C(=O)C=C1 CS-0233625 [0,1,0,0,0,0|1,0,1]=3 193 B11R1.21 O=C(O)C1=CNC(=O)C(I)=C1 CS-0373009 [0,1,0,0,0,0|1,0,1]=3 194 B11R1.21 O=C(O)C1=CNC(=O)C(O)=C1 CS-0071101 [0,1,0,0,0,0|1,0,1]=3 195 B11R1.21 O=C(O)C1=NC(Br)=C(Cl)C=C1 CS-0097336 [0,1,0,0,0,0|2,0,0]=3 196 B11R1.21 O=C(O)C1=NC(O)=C(O)C=C1 CS-0454495 [0,1,0,0,0,0|1,0,0]=2 197 B11R1.21 O=C(O)C1=NC=C(O)C(Cl)=C1 CS-0504964 [0,1,0,0,0,0|1,0,0]=2 198 B11R1.21 OB(O)C1=CC(O)=C(Br)C=C1 CS-0189493 [0,1,0,0,0,0|2,0,1]=4 199 B11R1.22 C#CC(=O)C1=CC=C(C)C=C1 CS-0245576 [0,1,0,0,0,0|2,0,0]=3 200 B11R1.22 C#CC(=O)C1=CC=C(Cl)C=C1 CS-0433409 [0,1,0,0,0,0|2,0,0]=3 201 B11R1.22 C#CC(=O)C1=CC=C(F)C=C1 CS-0215648 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.22 C#CC(O)C1=CC=C(F)C=C1 CS-0047272 [0,1,0,0,0,0|2,0,1]=4 203 B11R1.22 C=C(CBr)C1=CC=C(F)C=C1 CS-0507866 [0,1,0,0,0,0|3,0,0]=4 204 B11R1.22 C=CC(=O)C1=CC=C(Br)C=C1 CS-0210415 [0,1,0,0,0,0|2,0,0]=3 205 B11R1.22 C=CC(=O)C1=CC=C(F)C=C1 CS-0216100 [0,1,0,0,0,0|2,0,0]=3 206 B11R1.22 C=CC(O)C1=CC=C(Cl)C=C1 CS-0225788 [0,1,0,0,0,0|2,0,1]=4 207 B11R1.22 C=CC(O)C1=CC=C(F)C=C1 CS-0267097 [0,1,0,0,0,0|2,0,1]=4 208 B11R1.22 CC(C#N)C1=CC=C(O)C=C1 CS-0519194 [0,1,0,0,0,0|2,0,1]=4 209 B11R1.22 CC(CO)C1=CC=C(Br)C=C1 CS-0237050 [0,1,0,0,0,0|2,0,1]=4 210 B11R1.22 CC1=CC=C(C(=O)CCl)C=C1 CS-0213065 [0,1,0,0,0,0|2,0,0]=3 211 B11R1.22 CC1=CC=C(C(O)CN)C=C1 CS-0172125 [0,1,0,0,0,0|2,0,1]=4 212 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 CS-0162198 [0,1,0,0,0,0|2,0,1]=4 213 B11R1.22 CC1=CC=C([C@H](O)CCl)C=C1 CS-0963712 [0,1,0,0,0,0|2,0,1]=4 214 B11R1.22 CCC(=O)C1=CC=C(C)C=N1 CS-0757108 [0,1,0,0,0,0|3,0,0]=4 215 B11R1.22 CCC(=O)C1=NC=C(Cl)C=C1 CS-0161899 [0,1,0,0,0,0|3,0,0]=4 216 B11R1.22 CCC(C)C1=CC=C(O)C=C1 CS-0204829 [0,1,0,0,0,0|2,0,1]=4 217 B11R1.22 CC[C@@H](O)C1=CC=C(F)C=C1 CS-0232691 [0,1,0,0,0,0|2,0,1]=4 218 B11R1.22 CNC(=O)C1=CC=C(S)C=C1 CS-0868692 [0,1,0,0,0,0|1,1,0]=3 219 B11R1.22 CNC(=O)C1=NC=C(N)C=C1 CS-0567753 [0,1,0,0,0,0|3,0,0]=4 220 B11R1.22 COC(=O)C1=CN=C(Br)N=C1 CS-0136286 [0,1,0,0,0,0|3,0,0]=4 221 B11R1.22 COC(=O)C1=NC=C(N)C=C1 CS-W001375 [0,1,0,0,0,0|2,0,0]=3 222 B11R1.22 COC(C)C1=CC=C(Br)C=C1 CS-0207670 [0,1,0,0,0,0|2,0,1]=4 223 B11R1.22 COC(C)C1=CC=C(O)C=C1 CS-0541082 [0,1,0,0,0,0|1,0,1]=3 224 B11R1.22 N#CC(=O)C1=CC=C(Cl)C=C1 CS-0208499 [0,1,0,0,0,0|2,0,0]=3 225 B11R1.22 N=C([SH]=O)C1=CC=C(N)C=C1 CS-0231121 [0,1,0,0,0,0|2,0,0]=3 226 B11R1.22 NNC(=O)C1=CNC(=O)C=C1 CS-W000820 [0,1,0,0,0,0|2,0,1]=4 227 B11R1.22 NOC(=O)C1=CC=C(Cl)C=C1 CS-0210654 [0,1,0,0,0,0|1,0,0]=2 228 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 CS-0089913 [0,1,0,0,0,0|2,0,1]=4 229 B11R1.22 N[C@H](CO)C1=CC=C(O)C=C1 CS-0197420 [0,1,0,0,0,0|1,0,1]=3 230 B11R1.22 N\C(=N/O)C1=CC=C(Br)C=C1 CS-0369374 [0,1,0,0,0,0|2,0,0]=3 231 B11R1.22 N\C(=N/O)C1=CC=C(Cl)C=C1 CS-0173159 [0,1,0,0,0,0|2,0,0]=3 232 B11R1.22 O=C(CBr)C1=NC=C(F)C=C1 CS-0684403 [0,1,0,0,0,0|3,0,0]=4 233 B11R1.22 O=C(CCl)C1=NC=C(Br)C=C1 CS-0300063 [0,1,0,0,0,0|3,0,0]=4 234 B11R1.22 O=C(CCl)C1=NC=C(F)C=C1 CS-0441130 [0,1,0,0,0,0|3,0,0]=4 235 B11R1.22 O=C(CO)C1=CC=C(Br)C=C1 CS-0141559 [0,1,0,0,0,0|1,0,0]=2 236 B11R1.22 O=C(CO)C1=CC=C(F)C=C1 CS-0213503 [0,1,0,0,0,0|1,0,0]=2 237 B11R1.22 O=C(CO)C1=CC=C(I)C=C1 CS-B1075 [0,1,0,0,0,0|1,0,0]=2 238 B11R1.22 O=C(CO)C1=CC=C(O)C=C1 CS-0365258 [0,1,0,0,0,0|0,0,0]=1 239 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 CS-0088819 [0,1,0,0,0,0|0,0,1]=2 240 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 CS-0466617 [0,1,0,0,0,0|0,0,1]=2 241 B11R1.22 O[C@@H](CBr)C1=CC=C(Br)C=C1 CS-0039360 [0,1,0,0,0,0|2,0,1]=4 242 B11R1.22 O[C@@H](CBr)C1=CC=C(F)C=C1 CS-0931532 [0,1,0,0,0,0|2,0,1]=4 243 B11R1.22 O[C@@H](CCl)C1=CC=C(Br)C=C1 CS-0263509 [0,1,0,0,0,0|2,0,1]=4 244 B11R1.22 O[C@H](CCl)C1=CC=C(Br)C=C1 CS-0685740 [0,1,0,0,0,0|2,0,1]=4 245 B11R1.22 O\N=C(/Cl)C1=CC=C(F)C=C1 CS-0170969 [0,1,0,0,0,0|2,0,0]=3 246 B11R1.22 O\N=C(/Cl)C1=CC=C(F)C=C1 CS-0370814 [0,1,0,0,0,0|2,0,0]=3 247 B11R1.166 C=C(C)C1=C(F)C=C(F)C=C1 CS-0308893 [0,1,0,0,0,0|3,0,0]=4 248 B11R1.166 CC(=O)C1=C(Br)C=C(Cl)N=C1 CS-0852141 [0,1,0,0,0,0|3,0,0]=4 249 B11R1.166 CC(=O)C1=C(C)C=C(Br)N=C1 CS-0751085 [0,1,0,0,0,0|3,0,0]=4 250 B11R1.166 CC(=O)C1=C(N)C=C(C)N=C1 CS-0216868 [0,1,0,0,0,0|3,0,0]=4 251 B11R1.166 CC(=O)C1=C(O)C=C(I)C=C1 CS-0199995 [0,1,0,0,0,0|2,0,0]=3 252 B11R1.166 CC(=O)C1=CC=C(C)NC1=O CS-0112128 [0,1,0,0,0,0|3,0,0]=4 253 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1I CS-0934824 [0,1,0,0,0,0|2,0,0]=3 254 B11R1.166 CC(=O)C1=CC=C(Cl)N=C1N CS-0135357 [0,1,0,0,0,0|3,0,0]=4 255 B11R1.166 CC(=O)C1=CC=C(I)C=C1Br CS-0525437 [0,1,0,0,0,0|2,0,0]=3 256 B11R1.166 CC(=O)C1=CC=C(I)C=C1Cl CS-0873026 [0,1,0,0,0,0|2,0,0]=3 257 B11R1.166 CC(=O)C1=CC=C(N)C=C1Br CS-0130773 [0,1,0,0,0,0|2,0,0]=3 258 B11R1.166 CC(=O)C1=NC=C(Br)C=C1O CS-0751020 [0,1,0,0,0,0|3,0,0]=4 259 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1Br CS-0106160 [0,1,0,0,0,0|3,0,0]=4 260 B11R1.166 CC(O)C1=CC=C(Br)C=C1F CS-0191859 [0,1,0,0,0,0|2,0,1]=4 261 B11R1.166 CC1=C(C(N)=O)C=NC(Cl)=C1 CS-0626727 [0,1,0,0,0,0|3,0,0]=4 262 B11R1.166 CC1=C([C@@H](C)O)C=CC(F)=C1 CS-0649719 [0,1,0,0,0,0|2,0,1]=4 263 B11R1.166 CC1=C([C@H](C)O)C=CC(F)=C1 CS-1019146 [0,1,0,0,0,0|2,0,1]=4 264 B11R1.166 CC1=CC(Br)=CC=C1C(=N)N CS-0245364 [0,1,0,0,0,0|3,0,0]=4 265 B11R1.166 CC1=CC(Br)=CC=C1C(N)=S CS-0280522 [0,1,0,0,0,0|2,1,0]=4 266 B11R1.166 CC1=CC(Br)=CN=C1C(N)=O CS-0044374 [0,1,0,0,0,0|3,0,0]=4 267 B11R1.166 CC1=CC(Br)=NC=C1C(N)=O CS-0160531 [0,1,0,0,0,0|3,0,0]=4 268 B11R1.166 CC1=CC(C)=NC=C1C(=O)O CS-0321564 [0,1,0,0,0,0|2,0,0]=3 269 B11R1.166 CC1=CC(F)=CC=C1S(=O)[O-] CS-0351004 [0,1,0,0,0,0|2,0,1]=4 270 B11R1.166 CC1=CC(N)=C(C(N)=O)N=C1 CS-0312711 [0,1,0,0,0,0|3,0,0]=4 271 B11R1.166 CC1=CC(O)=C(B(O)O)C=C1 CS-0049769 [0,1,0,0,0,0|2,0,1]=4 272 B11R1.166 CC1=CC(O)=C(C(=O)O)N=C1 CS-0454811 [0,1,0,0,0,0|2,0,0]=3 273 B11R1.166 CC1=CC(O)=NC=C1C(=O)O CS-0231090 [0,1,0,0,0,0|1,0,0]=2 274 B11R1.166 CC1=CC=C(C(=O)O)C(F)=C1 CS-0539235 [0,1,0,0,0,0|1,0,0]=2 275 B11R1.166 CC1=CC=C(C(C)O)C(C)=C1 CS-0378157 [0,1,0,0,0,0|2,0,1]=4 276 B11R1.166 CC1=CC=C(C(N)=O)C(Br)=C1 CS-0191567 [0,1,0,0,0,0|2,0,0]=3 277 B11R1.166 CC1=NC(F)=C(C(=O)O)C=C1 CS-0442310 [0,1,0,0,0,0|2,0,0]=3 278 B11R1.166 CC1=NC(O)=CC=C1B(O)O CS-0174989 [0,1,0,0,0,0|2,0,1]=4 279 B11R1.166 CS(=O)C1=CC=C(N)C=C1F CS-0264002 [0,1,0,0,0,0|3,0,0]=4 280 B11R1.166 C[C@@H](O)C1=CC=C(Cl)C=C1F CS-0266844 [0,1,0,0,0,0|2,0,1]=4 281 B11R1.166 C[C@@H](O)C1=CC=C(F)C=C1Cl CS-0258446 [0,1,0,0,0,0|2,0,1]=4 282 B11R1.166 C[C@@H](O)C1=CC=C(F)C=C1F CS-0250977 [0,1,0,0,0,0|2,0,1]=4 283 B11R1.166 C[C@H](O)C1=C(F)C=C(Cl)C=C1 CS-0530046 [0,1,0,0,0,0|2,0,1]=4 284 B11R1.166 C[C@H](O)C1=CC=C(Br)C=C1F CS-0239535 [0,1,0,0,0,0|2,0,1]=4 285 B11R1.166 C[C@H](O)C1=CC=C(Cl)C=C1Cl CS-0263513 [0,1,0,0,0,0|2,0,1]=4 286 B11R1.166 N=C(N)C1=C(Cl)C=C(Cl)C=C1 CS-0340145 [0,1,0,0,0,0|3,0,0]=4 287 B11R1.166 N=C(N)C1=CC=C(F)C=C1F CS-0142396 [0,1,0,0,0,0|3,0,0]=4 288 B11R1.166 N=C1C=CC(C(=O)O)=C(F)N1 CS-0269383 [0,1,0,0,0,0|2,0,0]=3 289 B11R1.166 N=C1N=C(Cl)C(C(=O)O)=CN1 CS-0238684 [0,1,0,0,0,0|3,0,0]=4 290 B11R1.166 NC(=O)C1=C(Cl)C=C(Cl)C=C1 CS-0316313 [0,1,0,0,0,0|2,0,0]=3 291 B11R1.166 NC(=O)C1=C(F)N=C(N)C=C1 CS-0448667 [0,1,0,0,0,0|3,0,0]=4 292 B11R1.166 NC(=O)C1=C(N)C=C(F)C=C1 CS-0150064 [0,1,0,0,0,0|2,0,0]=3 293 B11R1.166 NC(=O)C1=C(O)N=C(O)C=C1 CS-0451563 [0,1,0,0,0,0|2,0,0]=3 294 B11R1.166 NC(=O)C1=CC=C(I)C=C1F CS-0338152 [0,1,0,0,0,0|2,0,0]=3 295 B11R1.166 NC(=O)C1=NC=C(Br)C=C1Cl CS-0470981 [0,1,0,0,0,0|3,0,0]=4 296 B11R1.166 NC(=S)C1=C(Cl)C=C(Cl)C=C1 CS-0205968 [0,1,0,0,0,0|2,1,0]=4 297 B11R1.166 NC(=S)C1=C(Cl)C=C(N)C=C1 CS-0709889 [0,1,0,0,0,0|2,1,0]=4 298 B11R1.166 NC1=C(C(=O)O)C=NC(F)=C1 CS-0051042 [0,1,0,0,0,0|2,0,0]=3 299 B11R1.166 NC1=CC(Br)=CN=C1C(=O)O CS-0051547 [0,1,0,0,0,0|2,0,0]=3 300 B11R1.166 NC1=CC(F)=C(C(=O)O)N=C1 CS-0476413 [0,1,0,0,0,0|2,0,0]=3 301 B11R1.166 NC1=CC(N)=C(C(=O)O)C=C1 CS-0454219 [0,1,0,0,0,0|1,0,0]=2 302 B11R1.166 NC1=NC=C(C(=O)O)C(N)=N1 CS-0324106 [0,1,0,0,0,0|3,0,0]=4 303 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)N=N1 CS-0502479 [0,1,0,0,0,0|3,0,0]=4 304 B11R1.166 O=C(O)C1=C(O)N=C(O)C=C1 CS-0240209 [0,1,0,0,0,0|1,0,0]=2 305 B11R1.166 O=C(O)C1=CC=C(S)C=C1Cl CS-0265034 [0,1,0,0,0,0|0,1,0]=2 306 B11R1.166 O=C(O)C1=CC=C(S)C=C1F CS-0468558 [0,1,0,0,0,0|0,1,0]=2 307 B11R1.166 O=C(O)C1=NC=C(Br)C=C1O CS-0106543 [0,1,0,0,0,0|2,0,0]=3 308 B11R1.166 O=C(O)C1=NC=C(O)C=C1F CS-0432710 [0,1,0,0,0,0|1,0,0]=2 309 B11R1.166 O=C(O)C1=NN=C(Cl)C=C1Cl CS-0127897 [0,1,0,0,0,0|3,0,0]=4 310 B11R1.166 O=S([O-])C1=CC=C(F)C=C1Cl CS-0247474 [0,1,0,0,0,0|2,0,1]=4 311 B11R1.166 O=[N+]([O-])C1=C(Br)C=C(I)C=C1 CS-0466666 [0,1,0,0,0,0|2,0,1]=4 312 B11R1.166 O=[N+]([O-])C1=CC=C(S)C=C1Br CS-0520726 [0,1,0,0,0,0|1,1,1]=4 313 B9R0.7 C=C(CCC(=O)O)C(=O)O CS-0144510 [0,0,1,0,0,0|1,0,2]=4 314 B11R2.34 [C@H]1(C2=CC=C(F)C=C2)CO1 CS-W016506 [0,0,0,1,0,0|2,0,1]=4 315 B9R1.35 CC(=O)C1=CC=C(F)S1 CS-0241328 [0,0,0,0,1,0|3,0,0]=4 316 B9R1.35 CC(=O)C1=CSC(C)=C1 CS-0262638 [0,0,0,0,1,0|3,0,0]=4 317 B9R1.35 CC1=CC(C(=O)O)=NS1 CS-0188015 [0,0,0,0,1,0|3,0,0]=4 318 B9R1.35 CC1=CC=C(C(N)=O)O1 CS-0648744 [0,0,0,0,1,0|3,0,0]=4 319 B9R1.35 CC1=CN=C(C(=O)O)N1 CS-0503572 [0,0,0,0,1,0|3,0,0]=4 320 B9R1.35 CC1=CN=C(C(=O)O)N1 CS-0714683 [0,0,0,0,1,0|3,0,0]=4 321 B9R1.35 CC1=CN=C(C(=O)O)O1 CS-0183606 [0,0,0,0,1,0|3,0,0]=4 322 B9R1.35 CC1=COC(C(=O)O)=C1 CS-W007308 [0,0,0,0,1,0|2,0,0]=3 323 B9R1.35 CC1=CSC(C(N)=O)=C1 CS-0165852 [0,0,0,0,1,0|3,0,0]=4 324 B9R1.35 CC1=NC=C(C(=O)O)N1 CS-0714442 [0,0,0,0,1,0|3,0,0]=4 325 B9R1.35 CC1=NSC(C(=O)O)=C1 CS-0454781 [0,0,0,0,1,0|3,0,0]=4 326 B9R1.35 NC(=O)C1=CC(Br)=CO1 CS-0040115 [0,0,0,0,1,0|3,0,0]=4 327 B9R1.35 NC(=O)C1=CC=C(Br)N1 CS-0050646 [0,0,0,0,1,0|3,0,0]=4 328 B9R1.35 NC(=O)C1=CC=C(Br)O1 CS-0465986 [0,0,0,0,1,0|3,0,0]=4 329 B9R1.35 NC(=O)C1=CC=C(N)S1 CS-0567054 [0,0,0,0,1,0|3,0,0]=4 330 B9R1.35 NC(=O)C1=COC(Br)=C1 CS-0231274 [0,0,0,0,1,0|3,0,0]=4 331 B9R1.35 NC(=O)C1=CSC(I)=C1 CS-0237343 [0,0,0,0,1,0|3,0,0]=4 332 B9R1.35 NC1=CC=C(C(=O)O)N1 CS-0197463 [0,0,0,0,1,0|2,0,0]=3 333 B9R1.35 NC1=CNC(C(=O)O)=C1 CS-0356170 [0,0,0,0,1,0|2,0,0]=3 334 B9R1.35 NC1=CSC(C(=O)O)=C1 CS-0213395 [0,0,0,0,1,0|2,0,0]=3 335 B9R1.35 NC1=NC(C(=O)O)=CN1 CS-0130458 [0,0,0,0,1,0|3,0,0]=4 336 B9R1.35 O=C(O)C1=CC(Cl)=CO1 CS-0183132 [0,0,0,0,1,0|2,0,0]=3 337 B9R1.35 O=C(O)C1=CC(F)=CS1 CS-0040859 [0,0,0,0,1,0|2,0,0]=3 338 B9R1.35 O=C(O)C1=CC(I)=CN1 CS-0310067 [0,0,0,0,1,0|2,0,0]=3 339 B9R1.35 O=C(O)C1=CC=C(F)O1 CS-0465365 [0,0,0,0,1,0|2,0,0]=3 340 B9R1.35 O=C(O)C1=CN=C(Br)N1 CS-0458935 [0,0,0,0,1,0|3,0,0]=4 341 B9R1.35 O=C(O)C1=CNC(Cl)=C1 CS-0035544 [0,0,0,0,1,0|2,0,0]=3 342 B9R1.35 O=C(O)C1=COC(I)=C1 CS-0268588 [0,0,0,0,1,0|2,0,0]=3 343 B9R1.35 O=C(O)C1=CSC(I)=C1 CS-0259101 [0,0,0,0,1,0|2,0,0]=3 344 B9R1.35 O=C(O)C1=NC=C(Cl)S1 CS-0050549 [0,0,0,0,1,0|3,0,0]=4 345 B9R1.35 O=C(O)C1=NC=C(Cl)S1 CS-1057158 [0,0,0,0,1,0|3,0,0]=4 346 B9R1.35 O=C(O)C1=NC=C(I)N1 CS-0781488 [0,0,0,0,1,0|3,0,0]=4 347 B9R1.35 O=C(O)C1=NNC(O)=N1 CS-0267400 [0,0,0,0,1,0|3,0,0]=4 348 B9R1.35 O=C1NC=C(C(=O)O)O1 CS-0626781 [0,0,0,0,1,0|2,0,1]=4 349 B9R1.35 O=S(O)C1=CC=C(Br)S1 CS-0941529 [0,0,0,0,1,0|3,0,0]=4 350 B11R1.20 CC(=O)CC1=NC=C(C)C=C1 CS-0205756 [0,0,0,0,0,1|3,0,0]=4 351 B11R1.20 CC(=O)NC1=CC=C(Br)N=C1 CS-0084776 [0,0,0,0,0,1|3,0,0]=4 352 B11R1.20 CC(=O)NC1=CC=C(Cl)N=C1 CS-0083326 [0,0,0,0,0,1|3,0,0]=4 353 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 CS-W018075 [0,0,0,0,0,1|2,0,0]=3 354 B11R1.20 CC(=O)NC1=NC=C(Cl)C=C1 CS-0191704 [0,0,0,0,0,1|3,0,0]=4 355 B11R1.20 CC(=O)NC1=NC=C(N)C=C1 CS-0092458 [0,0,0,0,0,1|3,0,0]=4 356 B11R1.20 CC1=CC=C(CC(=N)N)C=C1 CS-0122276 [0,0,0,0,0,1|3,0,0]=4 357 B11R1.20 CC1=CC=C(NC(=N)N)C=C1 CS-0061307 [0,0,0,0,0,1|3,0,0]=4 358 B11R1.20 CC1=CC=C(NC(=N)N)C=C1 CS-0341079 [0,0,0,0,0,1|3,0,0]=4 359 B11R1.20 CN(C)CC1=CC=C(O)C=C1 CS-0325442 [0,0,0,0,0,1|3,0,0]=4 360 B11R1.20 N=C(N)CC1=CC=C(Cl)C=C1 CS-0314700 [0,0,0,0,0,1|3,0,0]=4 361 B11R1.20 N=C(N)NC1=CC=C(Cl)C=C1 CS-0321240 [0,0,0,0,0,1|3,0,0]=4 362 B11R1.20 NC(=O)CC1=NC=C(Br)C=C1 CS-0158589 [0,0,0,0,0,1|3,0,0]=4 363 B11R1.20 NC(=O)NC1=CC=C(N)C=C1 CS-0215691 [0,0,0,0,0,1|2,0,0]=3 364 B11R1.20 O=C(O)CC1=CN=C(Cl)N=C1 CS-0101950 [0,0,0,0,0,1|3,0,0]=4 365 B11R1.20 O=C(O)CC1=NC=C(Cl)C=N1 CS-0053154 [0,0,0,0,0,1|3,0,0]=4 366 B11R1.20 O=C(O)CC1=NC=C(F)C=C1 CS-0185079 [0,0,0,0,0,1|2,0,0]=3 367 B8R1.2 FCC1=CC=CC=C1 CS-0304893 [2,0,0,0,0,0|1,0,1]=4 368 B8R1.2 N#[N+]C1=CC=CC=C1 CS-0260663 [2,0,0,0,0,0|2,0,0]=4 369 B8R1.3 NC1=CC=C(F)C=C1 CS-0214165 [2,0,0,0,0,0|2,0,0]=4 370 B8R1.3 O=C1N=CC(O)=CN1 CS-0665983 [2,0,0,0,0,0|2,0,0]=4 371 B8R1.3 SC1=CC=C(I)C=C1 CS-0465758 [2,0,0,0,0,0|1,1,0]=4 372 B10R1.1 Br\C=C\C1=CC=C(Br)C=C1 CS-0913556 [1,1,0,0,0,0|2,0,0]=4 373 B10R1.1 CC1=CC=C(CON)C=C1 CS-0317904 [1,1,0,0,0,0|1,0,1]=4 374 B10R1.1 CC1=CC=C(\C=N\O)C=C1 CS-0179148 [1,1,0,0,0,0|1,0,0]=3 375 B10R1.1 CCSC1=CC=C(O)C=C1 CS-0525907 [1,1,0,0,0,0|1,0,1]=4 376 B10R1.1 COCC1=CC=C(I)C=C1 CS-0253518 [1,1,0,0,0,0|1,0,1]=4 377 B10R1.1 COCC1=CC=C(S)C=C1 CS-0265206 [1,1,0,0,0,0|0,1,1]=4 378 B10R1.1 O=CNC1=CC=C(Cl)C=C1 CS-0172740 [1,1,0,0,0,0|1,0,0]=3 379 B10R1.1 O\N=C\C1=NC=C(Br)C=C1 CS-0160628 [1,1,0,0,0,0|2,0,0]=4 380 B10R1.3 C=CC1=CC=C(CN)C=C1 CS-0227142 [1,1,0,0,0,0|2,0,0]=4 381 B10R1.3 CNC1=CC=C(CO)C=C1 CS-0151031 [1,1,0,0,0,0|1,0,1]=4 382 B10R1.3 COC1=CC=C(NN)C=C1 CS-0099995 [1,1,0,0,0,0|2,0,0]=4 383 B10R1.3 COC1=NN=C(C=O)C=C1 CS-0136273 [1,1,0,0,0,0|2,0,0]=4 384 B10R1.3 N#CC1=CC=C(ON)C=C1 CS-0239877 [1,1,0,0,0,0|1,0,1]=4 385 B10R1.3 NCC1=CC=C(C=O)C=C1 CS-0215051 [1,1,0,0,0,0|1,0,0]=3 386 B10R1.3 O=CC1=CC=C(CF)C=C1 CS-0258438 [1,1,0,0,0,0|1,0,0]=3 387 B10R1.25 C(=O)C1=CC=C(N)N=C1Br CS-0502246 [1,1,0,0,0,0|2,0,0]=4 388 B10R1.25 C=CC1=C(F)C=C(Br)C=C1 CS-0454378 [1,1,0,0,0,0|2,0,0]=4 389 B10R1.25 C=CC1=C(F)C=C(F)C=C1 CS-0212167 [1,1,0,0,0,0|2,0,0]=4 390 B10R1.25 C=CC1=CC=C(Cl)C=C1F CS-0523824 [1,1,0,0,0,0|2,0,0]=4 391 B10R1.25 C=CC1=CC=C(F)C=C1Br CS-0203772 [1,1,0,0,0,0|2,0,0]=4 392 B10R1.25 CC1=CC(F)=CN=C1C=O CS-0211984 [1,1,0,0,0,0|2,0,0]=4 393 B10R1.25 CC1=CC(O)=NC=C1C=O CS-0236326 [1,1,0,0,0,0|1,0,0]=3 394 B10R1.25 CC1=NC(C)=C(C=O)C=C1 CS-W006807 [1,1,0,0,0,0|2,0,0]=4 395 B10R1.25 COC1=C(I)C=C(O)C=C1 CS-0873518 [1,1,0,0,0,0|2,0,0]=4 396 B10R1.25 CSC1=CC=C(O)C=C1Cl CS-0194892 [1,1,0,0,0,0|2,0,0]=4 397 B10R1.25 NC1=C(C=O)C=CC(Br)=N1 CS-0038663 [1,1,0,0,0,0|2,0,0]=4 398 B10R1.25 NC1=CC(F)=CN=C1C=O CS-0198904 [1,1,0,0,0,0|2,0,0]=4 399 B10R1.25 NC1=CC=C(CO)C(Br)=C1 CS-0379583 [1,1,0,0,0,0|1,0,1]=4 400 B10R1.25 NC1=CC=C(CO)C(O)=C1 CS-0103176 [1,1,0,0,0,0|1,0,1]=4 401 B10R1.25 NCC1=CC=C(O)C=C1O CS-0159762 [1,1,0,0,0,0|1,0,1]=4 402 B10R1.25 O=CC1=CC=C(Cl)C=C1Cl CS-0229177 [1,1,0,0,0,0|1,0,0]=3 403 B10R1.25 O=CC1=CC=C(Cl)C=C1I CS-0572427 [1,1,0,0,0,0|1,0,0]=3 404 B10R1.25 O=CC1=CC=C(F)N=C1Br CS-0492266 [1,1,0,0,0,0|2,0,0]=4 405 B10R1.25 OCC1=CC=C(I)C=C1F CS-0162339 [1,1,0,0,0,0|1,0,1]=4 406 B10R1.176 C#CC1=CC=C(O)C(F)=C1 CS-0611519 [1,1,0,0,0,0|1,0,1]=4 407 B10R1.176 C=CC1=CC=C(Br)C(Cl)=C1 CS-0515473 [1,1,0,0,0,0|2,0,0]=4 408 B10R1.176 CC1=CC(C=O)=CNC1=O CS-0075174 [1,1,0,0,0,0|1,0,1]=4 409 B10R1.176 CC1=NC(CO)=CC=C1O CS-0216006 [1,1,0,0,0,0|1,0,1]=4 410 B10R1.176 CCC1=CC(N)=C(O)C=C1 CS-0455750 [1,1,0,0,0,0|1,0,1]=4 411 B10R1.176 COC1=CC=C(O)C(I)=C1 CS-0608203 [1,1,0,0,0,0|2,0,0]=4 412 B10R1.176 CSC1=CC=C(O)C(C)=C1 CS-0216016 [1,1,0,0,0,0|2,0,0]=4 413 B10R1.176 NC1=CC(C=O)=CC=C1Br CS-0029751 [1,1,0,0,0,0|1,0,0]=3 414 B10R1.176 NC1=CC=C(C=O)C=C1Cl CS-0223593 [1,1,0,0,0,0|1,0,0]=3 415 B10R1.176 NC1=CC=C(CO)C=C1Br CS-0378760 [1,1,0,0,0,0|1,0,1]=4 416 B10R1.176 NCC1=CC(Br)=C(O)C=C1 CS-0668961 [1,1,0,0,0,0|1,0,1]=4 417 B10R1.176 O=CC1=CC(Br)=C(O)N=C1 CS-0462666 [1,1,0,0,0,0|1,0,0]=3 418 B10R1.176 O=CC1=CC(Cl)=C(Br)N=C1 CS-0350018 [1,1,0,0,0,0|2,0,0]=4 419 B10R1.176 O=CC1=CC(Cl)=C(F)N=C1 CS-0864064 [1,1,0,0,0,0|2,0,0]=4 420 B10R1.176 O=CC1=CC(F)=C(F)N=C1 CS-0212356 [1,1,0,0,0,0|2,0,0]=4 421 B10R1.176 O=CC1=CNC(=O)C(F)=C1 CS-1168237 [1,1,0,0,0,0|1,0,1]=4 422 B10R1.176 O=CC1=NC(F)=C(Br)C=C1 CS-0254842 [1,1,0,0,0,0|2,0,0]=4 423 B10R1.176 O=CC1=NC=C(Br)C(Cl)=C1 CS-0350236 [1,1,0,0,0,0|2,0,0]=4 424 B10R1.176 OCC1=CC=C(I)C(Br)=C1 CS-0378807 [1,1,0,0,0,0|1,0,1]=4 425 B10R1.176 OCC1=CC=C(O)C(F)=C1 CS-0261960 [1,1,0,0,0,0|0,0,1]=3 426 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 CS-0109601 [1,1,0,0,0,0|1,0,1]=4 427 B10R1.15 C#C[C@H](O)C1=CC=CC=C1 CS-0109874 [1,1,0,0,0,0|1,0,1]=4 428 B10R1.15 C=C(CO)C1=CC=CC=C1 CS-0511849 [1,1,0,0,0,0|1,0,0]=3 429 B10R1.15 COC(=N)C1=CC=NC=C1 CS-0663606 [1,1,0,0,0,0|2,0,0]=4 430 B10R1.15 CSC(=O)C1=CC=CC=C1 CS-0535653 [1,1,0,0,0,0|0,1,0]=3 431 B10R1.15 C\C(=N/O)C1=CC=CC=N1 CS-0170831 [1,1,0,0,0,0|2,0,0]=4 432 B10R1.15 C\C(=N\O)C1=NC=CC=C1 CS-0370594 [1,1,0,0,0,0|2,0,0]=4 433 B10R1.15 N\C(=N/O)C1=CC=CC=C1 CS-0698403 [1,1,0,0,0,0|1,0,0]=3 434 B10R1.15 O=C(CBr)C1=CN=CC=C1 CS-0156834 [1,1,0,0,0,0|2,0,0]=4 435 B10R1.15 O=C(CO)C1=CC=CN=C1 CS-0509038 [1,1,0,0,0,0|1,0,0]=3 436 B10R1.15 O=C(CO)C1=NC=CC=C1 CS-0458337 [1,1,0,0,0,0|1,0,0]=3 437 B10R1.15 O=C(NO)C1=CC=CC=C1 CS-0963291 [1,1,0,0,0,0|0,0,0]=2 438 B10R1.15 O=C(NO)C1=CC=NC=C1 CS-0290172 [1,1,0,0,0,0|1,0,0]=3 439 B10R1.15 O=C(NO)C1=CN=CC=C1 CS-0667579 [1,1,0,0,0,0|1,0,0]=3 440 B10R1.15 O[C@H](CF)C1=CC=CC=C1 CS-0374669 [1,1,0,0,0,0|1,0,1]=4 441 B10R1.28 CP(C)(=O)C1=CC=CC=C1 CS-0257681 [1,1,0,0,0,0|2,0,0]=4 442 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 CS-1056097 [1,1,0,0,0,0|1,0,0]=3 443 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 CS-0185432 [1,1,0,0,0,0|1,0,1]=4 444 B10R1.61 C=C(C)C1=C(Br)C=CC=C1 CS-0060836 [1,1,0,0,0,0|2,0,0]=4 445 B10R1.61 CC(=O)C1=C(F)C=NC=C1 CS-0962231 [1,1,0,0,0,0|2,0,0]=4 446 B10R1.61 CC(=O)C1=C(N)C=CC=N1 CS-0341854 [1,1,0,0,0,0|2,0,0]=4 447 B10R1.61 CC(=O)C1=CNC=CC1=N CS-0265442 [1,1,0,0,0,0|2,0,0]=4 448 B10R1.61 CC1=CN=CN=C1C(=O)O CS-W005526 [1,1,0,0,0,0|2,0,0]=4 449 B10R1.61 C[N+]1=CC=CC=C1C(=O)O CS-0571310 [1,1,0,0,0,0|1,0,0]=3 450 B10R1.61 C[N+]1=CC=CC=C1C(N)=O CS-0571219 [1,1,0,0,0,0|2,0,0]=4 451 B10R1.61 N=C(N)C1=C(Cl)C=CC=C1 CS-0313521 [1,1,0,0,0,0|2,0,0]=4 452 B10R1.61 N=C(N)C1=C(F)C=CC=C1 CS-0455135 [1,1,0,0,0,0|2,0,0]=4 453 B10R1.61 NC(=O)C1=CC=CC=C1S CS-0259303 [1,1,0,0,0,0|1,0,0]=3 454 B10R1.61 NC(=O)C1=CC=CN=C1O CS-0081575 [1,1,0,0,0,0|2,0,0]=4 455 B10R1.61 NC(=O)C1=CC=NC=C1N CS-0212699 [1,1,0,0,0,0|2,0,0]=4 456 B10R1.61 NC(=S)C1=CC=CC=C1N CS-0186549 [1,1,0,0,0,0|1,1,0]=4 457 B10R1.61 NC1=CN=CN=C1C(=O)O CS-0005453 [1,1,0,0,0,0|2,0,0]=4 458 B10R1.61 O=C(O)C1=C(Cl)N=NC=C1 CS-0056869 [1,1,0,0,0,0|2,0,0]=4 459 B10R1.61 O=C(O)C1=C(F)C=CN=C1 CS-0040491 [1,1,0,0,0,0|1,0,0]=3 460 B10R1.61 O=C(O)C1=C(F)C=NC=C1 CS-0690066 [1,1,0,0,0,0|1,0,0]=3 461 B10R1.61 O=C(O)C1=NC=CN=C1S CS-0240131 [1,1,0,0,0,0|2,0,0]=4 462 B10R1.61 O=S([O-])C1=CC=CC=C1Br CS-0259085 [1,1,0,0,0,0|1,0,1]=4 463 B10R1.113 C=C(C)C1=CC(F)=CC=C1 CS-0233810 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.113 CC(=O)C1=CC(Cl)=CN=C1 CS-0215732 [1,1,0,0,0,0|2,0,0]=4 465 B10R1.113 CC1=CC(C(N)=O)=CC=N1 CS-0309339 [1,1,0,0,0,0|2,0,0]=4 466 B10R1.113 CC1=CC(C(N)=O)=NC=C1 CS-0453415 [1,1,0,0,0,0|2,0,0]=4 467 B10R1.113 CC1=CC(S(=O)[O-])=CC=C1 CS-0308250 [1,1,0,0,0,0|1,0,1]=4 468 B10R1.113 CC1=CN=NC(C(=O)O)=C1 CS-0050429 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.113 C[C@@H](O)C1=CC(O)=CC=C1 CS-0258862 [1,1,0,0,0,0|1,0,1]=4 470 B10R1.113 C[C@H](O)C1=CC(O)=CC=C1 CS-0258860 [1,1,0,0,0,0|1,0,1]=4 471 B10R1.113 N=C(N)C1=CC(N)=CC=C1 CS-0206374 [1,1,0,0,0,0|2,0,0]=4 472 B10R1.113 N=C(N)C1=CC(N)=CC=C1 CS-0663274 [1,1,0,0,0,0|2,0,0]=4 473 B10R1.113 N=C(N)C1=CC(N)=CC=C1 CS-0776525 [1,1,0,0,0,0|2,0,0]=4 474 B10R1.113 N=C(N)C1=CC(O)=CC=C1 CS-0076851 [1,1,0,0,0,0|2,0,0]=4 475 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 CS-0439137 [1,1,0,0,0,0|2,0,0]=4 476 B10R1.113 NC(=O)C1=CC(I)=NC=C1 CS-0359269 [1,1,0,0,0,0|2,0,0]=4 477 B10R1.113 NC(=O)C1=CC(S)=CC=C1 CS-0492283 [1,1,0,0,0,0|1,0,0]=3 478 B10R1.113 NC(=S)C1=CC(Br)=CC=C1 CS-0464821 [1,1,0,0,0,0|1,1,0]=4 479 B10R1.113 NC1=NN=CC(C(=O)O)=C1 CS-0109667 [1,1,0,0,0,0|2,0,0]=4 480 B10R1.113 O=C(O)C1=CC(=S)NC=C1 CS-0099298 [1,1,0,0,0,0|1,0,0]=3 481 B10R1.113 O=C(O)C1=NC(F)=CN=C1 CS-0247769 [1,1,0,0,0,0|2,0,0]=4 482 B10R1.113 O=C(O)C1=NC(S)=CC=C1 CS-0220012 [1,1,0,0,0,0|1,0,0]=3 483 B10R1.113 O=C(O)C1=NC=CC(Cl)=N1 CS-0270834 [1,1,0,0,0,0|2,0,0]=4 484 B10R1.113 O=S(O)C1=NC(F)=CC=C1 CS-0961639 [1,1,0,0,0,0|2,0,0]=4 485 B10R1.14 COC(=O)C1=CC(O)=CS1 CS-0666427 [0,1,0,0,1,0|1,0,0]=3 486 B10R1.14 COC(=O)C1=CSC(N)=C1 CS-0308108 [0,1,0,0,1,0|2,0,0]=4 487 B10R1.14 O=C(NO)C1=CC=C(Br)S1 CS-0233715 [0,1,0,0,1,0|2,0,0]=4 488 B10R1.31 C#CC1=CSC(C(=O)O)=C1 CS-0610657 [0,1,0,0,1,0|2,0,0]=4 489 B10R1.31 CCC1=CSC(C(=O)O)=C1 CS-0672028 [0,1,0,0,1,0|2,0,0]=4 490 B10R1.31 COC1=CC(C(=O)O)=NN1 CS-0113056 [0,1,0,0,1,0|2,0,0]=4 491 B10R1.31 COC1=CN=C(C(=O)O)O1 CS-0044014 [0,1,0,0,1,0|2,0,0]=4 492 B10R1.31 COC1=NC(C(=O)O)=CO1 CS-0490808 [0,1,0,0,1,0|2,0,0]=4 493 B10R1.31 N#CC1=COC(C(=O)O)=C1 CS-W022171 [0,1,0,0,1,0|2,0,0]=4 494 B10R1.31 NCC1=CC(C(=O)O)=CO1 CS-0235030 [0,1,0,0,1,0|2,0,0]=4 495 B10R1.31 NCC1=CC(C(=O)O)=CO1 CS-0235143 [0,1,0,0,1,0|2,0,0]=4 496 B10R1.31 NCC1=CC=C(C(=O)O)S1 CS-0268563 [0,1,0,0,1,0|2,0,0]=4 497 B10R1.31 O=C(O)C1=CC(CO)=CO1 CS-0969536 [0,1,0,0,1,0|1,0,0]=3 498 B10R1.31 O=C(O)C1=CC=C(CO)S1 CS-0245093 [0,1,0,0,1,0|1,0,0]=3 499 B10R1.31 O=C(O)C1=COC(CO)=C1 CS-0309020 [0,1,0,0,1,0|1,0,0]=3 500 B10R1.31 O=C(O)C1=NOC(CO)=C1 CS-0074800 [0,1,0,0,1,0|2,0,0]=4 501 B10R1.58 CC1=C(Br)C=C(C(=O)O)O1 CS-0074768 [0,1,0,0,1,0|2,0,0]=4 502 B10R1.58 CC1=C(C)OC(C(=O)O)=C1 CS-0112756 [0,1,0,0,1,0|2,0,0]=4 503 B10R1.58 CC1=CC(C(=O)O)=CN1C CS-0216480 [0,1,0,0,1,0|2,0,0]=4 504 B10R1.58 O=C(O)C1=CC(Br)=C(Cl)N1 CS-0248800 [0,1,0,0,1,0|2,0,0]=4 505 B10R1.58 O=C(O)C1=CC(Br)=C(F)S1 CS-0658483 [0,1,0,0,1,0|2,0,0]=4 506 B10R1.58 O=C(O)C1=CC(F)=C(Cl)S1 CS-0959181 [0,1,0,0,1,0|2,0,0]=4 507 B10R1.59 CC1=C(C(=O)O)C=C(Br)S1 CS-0080177 [0,1,0,0,1,0|2,0,0]=4 508 B10R1.59 CC1=CC(C(=O)O)=C(N)S1 CS-0183586 [0,1,0,0,1,0|2,0,0]=4 509 B10R1.59 CC1=CC(C)=C(C(=O)O)O1 CS-0134544 [0,1,0,0,1,0|2,0,0]=4 510 B10R1.59 CN1C=C(Cl)C=C1C(=O)O CS-0241853 [0,1,0,0,1,0|2,0,0]=4 511 B10R1.59 CN1C=C(F)C=C1C(=O)O CS-0464429 [0,1,0,0,1,0|2,0,0]=4 512 B10R1.59 CN1C=C(N)C=C1C(=O)O CS-0527886 [0,1,0,0,1,0|2,0,0]=4 513 B10R1.59 O=C(O)C1=C(Br)SC(Cl)=C1 CS-0163560 [0,1,0,0,1,0|2,0,0]=4 514 B10R1.59 O=C(O)C1=C(Cl)C=C(Br)S1 CS-0197448 [0,1,0,0,1,0|2,0,0]=4 515 B10R1.59 O=C(O)C1=C(F)C=C(Br)S1 CS-0376858 [0,1,0,0,1,0|2,0,0]=4 516 B10R1.59 O=C(O)C1=C(I)C=C(Br)S1 CS-0236195 [0,1,0,0,1,0|2,0,0]=4 517 B10R1.194 O=C(O)C1=C(F)C(F)=CS1 CS-0857301 [0,1,0,0,1,0|2,0,0]=4 518 B10R1.194 O=C(O)C1=CSC(Br)=C1Br CS-0235613 [0,1,0,0,1,0|2,0,0]=4 519 B10R1.194 O=C(O)C1=CSC(Cl)=C1Cl CS-0165980 [0,1,0,0,1,0|2,0,0]=4 520 B12R1.4 C#CC1=CC=C(NC(C)=O)C=C1 CS-0094843 [0,1,0,0,0,1|2,0,0]=4 521 B12R1.4 CC(=O)OC1=CC=C(C#N)C=C1 CS-0444219 [0,1,0,0,0,1|2,0,0]=4 522 B12R1.4 NCC1=CC=C(CC(=O)O)C=C1 CS-0213353 [0,1,0,0,0,1|1,0,0]=3 523 B12R1.19 CC(=O)NC1=CC(Br)=C(C)C=C1 CS-0720333 [0,1,0,0,0,1|2,0,0]=4 524 B12R1.19 CC(=O)NC1=CC(I)=C(C)C=C1 CS-0335821 [0,1,0,0,0,1|2,0,0]=4 525 B12R1.19 CC(=O)NC1=CC(N)=C(Cl)C=C1 CS-W016975 [0,1,0,0,0,1|2,0,0]=4 526 B12R1.19 CC(=O)NC1=CC=C(C)C(Cl)=C1 CS-M1325 [0,1,0,0,0,1|2,0,0]=4 527 B12R1.19 CC(=O)NC1=CC=C(C)C(N)=C1 CS-0370446 [0,1,0,0,0,1|2,0,0]=4 528 B12R1.19 CC(=O)NC1=CC=C(N)C(Br)=C1 CS-0224959 [0,1,0,0,0,1|2,0,0]=4 529 B12R1.19 CC(=O)NC1=CC=C(N)C(C)=C1 CS-0117950 [0,1,0,0,0,1|2,0,0]=4 530 B12R1.19 CC(=O)OC1=CC(Br)=C(F)C=C1 CS-0661780 [0,1,0,0,0,1|2,0,0]=4 531 B12R1.19 CC(=O)OC1=CC(F)=C(C)C=C1 CS-0868555 [0,1,0,0,0,1|2,0,0]=4 532 B12R1.19 CC(=O)OC1=CC(N)=C(F)C=C1 CS-0449536 [0,1,0,0,0,1|2,0,0]=4 533 B12R1.19 CC1=CC(CC(=O)O)=CC=C1Cl CS-0489195 [0,1,0,0,0,1|1,0,0]=3 534 B12R1.19 CC1=CC=C(CC(=O)O)C=C1Br CS-0525974 [0,1,0,0,0,1|1,0,0]=3 535 B12R1.19 CC1=CC=C(CC(=O)O)C=C1Cl CS-0258583 [0,1,0,0,0,1|1,0,0]=3 536 B12R1.19 CC1=CC=C(CC(=O)O)C=C1N CS-0370471 [0,1,0,0,0,1|1,0,0]=3 537 B12R1.19 CN1C=C(CC(=O)O)C=CC1=O CS-0683750 [0,1,0,0,0,1|1,0,1]=4 538 B12R1.19 NC(=O)CC1=CC(Cl)=C(Cl)C=C1 CS-0149946 [0,1,0,0,0,1|2,0,0]=4 539 B12R1.19 NC1=C(Cl)C=C(CC(=O)O)C=C1 CS-0682977 [0,1,0,0,0,1|1,0,0]=3 540 B12R1.19 NC1=C(O)C=CC(CC(=O)O)=C1 CS-0235284 [0,1,0,0,0,1|0,0,0]=2 541 B12R1.19 NC1=CC=C(CC(=O)O)C=C1I CS-0730661 [0,1,0,0,0,1|1,0,0]=3 542 B12R1.19 O=C(O)CC1=CC=C(I)C(Br)=C1 CS-0242597 [0,1,0,0,0,1|1,0,0]=3 543 B12R1.20 C=C(C(=O)O)C1=CC=C(Cl)C=C1 CS-0238850 [0,1,0,0,0,1|1,0,0]=3 544 B12R1.20 CC(=O)C(=O)C1=CC=C(F)C=C1 CS-0577964 [0,1,0,0,0,1|2,0,0]=4 545 B12R1.20 CC(=O)C(Cl)C1=CC=C(F)C=C1 CS-0660067 [0,1,0,0,0,1|2,0,0]=4 546 B12R1.20 CC(=O)N(C)C1=CC=C(N)C=C1 CS-0647585 [0,1,0,0,0,1|2,0,0]=4 547 B12R1.20 CC(C(=O)O)C1=CC=C(I)C=C1 CS-0110449 [0,1,0,0,0,1|1,0,0]=3 548 B12R1.20 CC(C(N)=O)C1=CC=C(Br)C=C1 CS-0457960 [0,1,0,0,0,1|2,0,0]=4 549 B12R1.20 CC1=CC=C([C@@H](N)C(=O)O)C=C1 CS-0434801 [0,1,0,0,0,1|1,0,0]=3 550 B12R1.20 CC1=CC=C([C@H](N)C(=O)O)C=C1 CS-0375913 [0,1,0,0,0,1|1,0,0]=3 551 B12R1.20 CC1=CC=C([C@H](N)C(=O)O)C=C1 CS-0697587 [0,1,0,0,0,1|1,0,0]=3 552 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(O)C=C1 CS-0315782 [0,1,0,0,0,1|0,0,0]=2 553 B12R1.20 C[C@H](C(=O)O)C1=CC=C(Br)C=C1 CS-0621465 [0,1,0,0,0,1|1,0,0]=3 554 B12R1.20 C[C@H](C(=O)O)C1=CC=C(O)C=C1 CS-0435917 [0,1,0,0,0,1|0,0,0]=2 555 B12R1.20 NC(=O)C(=O)C1=CC=C(Br)C=C1 CS-0319563 [0,1,0,0,0,1|2,0,0]=4 556 B12R1.20 NC(=O)C(N)C1=CC=C(Br)C=C1 CS-0265902 [0,1,0,0,0,1|2,0,0]=4 557 B12R1.20 NC(=O)C(N)C1=CC=C(F)C=C1 CS-0139439 [0,1,0,0,0,1|2,0,0]=4 558 B12R1.20 NC(C(=O)O)C1=CC=C(F)C=C1 CS-0442575 [0,1,0,0,0,1|1,0,0]=3 559 B12R1.20 NC(C(=O)O)C1=CC=C(I)C=C1 CS-0214794 [0,1,0,0,0,1|1,0,0]=3 560 B12R1.20 O=C(O)C(=O)C1=CC=C(I)C=C1 CS-0523394 [0,1,0,0,0,1|1,0,0]=3 561 B12R1.20 O=C(O)C(Br)C1=CC=C(F)C=C1 CS-0204625 [0,1,0,0,0,1|1,0,0]=3 562 B12R1.20 O=C(O)C(Cl)C1=CC=C(Cl)C=C1 CS-0745177 [0,1,0,0,0,1|1,0,0]=3 563 B12R1.49 CC1=CC=C(CC(=O)NN)C=C1 CS-0313168 [0,1,0,0,0,1|2,0,0]=4 564 B12R1.49 CNC(=O)CC1=CC=C(I)C=C1 CS-0663618 [0,1,0,0,0,1|2,0,0]=4 565 B12R1.49 CNC(=O)NC1=CC=C(Br)C=C1 CS-0657601 [0,1,0,0,0,1|2,0,0]=4 566 B12R1.49 COC(=O)CC1=NC=C(N)C=C1 CS-0263470 [0,1,0,0,0,1|2,0,0]=4 567 B12R1.49 COC(=O)CC1=NC=C(O)C=N1 CS-0037240 [0,1,0,0,0,1|2,0,0]=4 568 B12R1.49 COC(=O)NC1=CC=C(Cl)C=C1 CS-0361655 [0,1,0,0,0,1|1,0,0]=3 569 B12R1.49 COC(=O)NC1=CC=C(F)C=C1 CS-1055701 [0,1,0,0,0,1|1,0,0]=3 570 B12R1.49 N=C(CC1=CC=C(O)C=C1)NO CS-0037137 [0,1,0,0,0,1|1,0,0]=3 571 B12R1.49 NCC(=O)NC1=CC=C(O)C=C1 CS-0252149 [0,1,0,0,0,1|1,0,0]=3 572 B12R1.49 NNC(=O)CC1=CC=C(F)C=C1 CS-0039978 [0,1,0,0,0,1|2,0,0]=4 573 B12R1.49 NNC(=O)CC1=CC=C(O)C=C1 CS-0116771 [0,1,0,0,0,1|1,0,0]=3 574 B12R1.49 N[C@H](CO)CC1=CC=C(O)C=C1 CS-0453130 [0,1,0,0,0,1|1,0,1]=4 575 B12R1.49 O=C(CBr)NC1=CC=C(F)C=C1 CS-0313643 [0,1,0,0,0,1|2,0,0]=4 576 B12R1.49 O=C(CCl)CC1=CC=C(F)C=C1 CS-0124993 [0,1,0,0,0,1|2,0,0]=4 577 B12R1.49 O=C(CCl)NC1=CC=C(O)C=C1 CS-0073174 [0,1,0,0,0,1|1,0,0]=3 578 B12R1.106 CS(=O)(=O)OC1=CC=C(O)C=C1 CS-0000189 [0,1,0,0,0,1|1,0,1]=4 579 B12R1.106 NC1=CC=C(CP(=O)(O)O)C=C1 CS-0373855 [0,1,0,0,0,1|2,0,0]=4 580 B12R1.233 CC(=O)NC1=C(C)C=C(C)C=C1 CS-0038858 [0,1,0,0,0,1|2,0,0]=4 581 B12R1.233 CC(=O)NC1=C(Cl)C=C(Cl)C=C1 CS-0326591 [0,1,0,0,0,1|2,0,0]=4 582 B12R1.233 CC(=O)NC1=C(F)C=C(I)C=C1 CS-0210995 [0,1,0,0,0,1|2,0,0]=4 583 B12R1.233 CC(=O)NC1=C(N)C=C(C)C=C1 CS-0217044 [0,1,0,0,0,1|2,0,0]=4 584 B12R1.233 CC(=O)NC1=CC=C(N)C=C1C CS-0207160 [0,1,0,0,0,1|2,0,0]=4 585 B12R1.233 CC(=O)OC1=CC=C(Br)C=C1F CS-0513259 [0,1,0,0,0,1|2,0,0]=4 586 B12R1.233 CC(=O)OC1=CC=C(F)C=C1F CS-0358973 [0,1,0,0,0,1|2,0,0]=4 587 B12R1.233 NC(=O)NC1=CC=C(Br)C=C1F CS-0208660 [0,1,0,0,0,1|2,0,0]=4 588 B12R1.233 NC(=O)NC1=CC=C(Cl)C=C1Cl CS-0315848 [0,1,0,0,0,1|2,0,0]=4 589 B12R1.233 NC(=O)NC1=CC=C(F)C=C1F CS-0357620 [0,1,0,0,0,1|2,0,0]=4 590 B12R1.233 NC1=C(CC(=O)O)C=CC(Br)=C1 CS-0723693 [0,1,0,0,0,1|1,0,0]=3 591 B12R1.233 NC1=CC(Cl)=CC=C1CC(=O)O CS-0448412 [0,1,0,0,0,1|1,0,0]=3 592 B12R1.233 NC1=CC=C(CC(=O)O)C(Cl)=C1 CS-0438326 [0,1,0,0,0,1|1,0,0]=3 593 B12R1.233 O=C(O)CC1=C(F)C=C(Cl)C=N1 CS-0211639 [0,1,0,0,0,1|2,0,0]=4 594 B12R1.5 C#CC(O)C1=CC=C(OC)C=C1 CS-0073777 [0,2,0,0,0,0|1,0,1]=4 595 B12R1.5 C=C(CBr)C1=CC=C(OC)C=C1 CS-0521157 [0,2,0,0,0,0|2,0,0]=4 596 B12R1.5 C=CC(=O)C1=CC=C(OC)C=C1 CS-0238731 [0,2,0,0,0,0|1,0,0]=3 597 B12R1.5 C=CC1=NC=C(C(=O)OC)C=C1 CS-0684617 [0,2,0,0,0,0|2,0,0]=4 598 B12R1.5 CCC(=O)C1=CC=C(CN)C=C1 CS-1029560 [0,2,0,0,0,0|2,0,0]=4 599 B12R1.5 CCC1=CC=C(C(=O)CO)C=C1 CS-0309267 [0,2,0,0,0,0|1,0,0]=3 600 B12R1.5 CCC1=CC=C(C(=O)NN)C=C1 CS-0195906 [0,2,0,0,0,0|2,0,0]=4 601 B12R1.5 CC[N+]1=CC=C(C(=O)OC)C=C1 CS-0329353 [0,2,0,0,0,0|2,0,0]=4 602 B12R1.5 CNC(=O)C1=CC=C(CN)C=C1 CS-0028261 [0,2,0,0,0,0|2,0,0]=4 603 B12R1.5 CNC(=O)C1=CC=C(CO)C=C1 CS-0568804 [0,2,0,0,0,0|1,0,0]=3 604 B12R1.5 COC(=N)C1=NC=C(OC)C=C1 CS-0522093 [0,2,0,0,0,0|2,0,0]=4 605 B12R1.5 COC(=O)C1=CN=C(CO)C=N1 CS-0443591 [0,2,0,0,0,0|2,0,0]=4 606 B12R1.5 COC(=O)C1=CN=C(NN)C=C1 CS-0224350 [0,2,0,0,0,0|2,0,0]=4 607 B12R1.5 COC(=O)C1=CN=C(SC)C=C1 CS-0195619 [0,2,0,0,0,0|1,1,0]=4 608 B12R1.5 COC1=CC=C(C(=O)C#N)C=C1 CS-0107123 [0,2,0,0,0,0|1,0,0]=3 609 B12R1.5 COC1=CC=C(C(=O)C=O)C=C1 CS-0364608 [0,2,0,0,0,0|0,0,1]=3 610 B12R1.5 COC1=CC=C(C(=O)NN)C=N1 CS-0209797 [0,2,0,0,0,0|2,0,0]=4 611 B12R1.5 COC1=CC=C(C(O)C#N)C=C1 CS-0963466 [0,2,0,0,0,0|1,0,1]=4 612 B12R1.5 COC1=CC=C([C@H](N)CO)C=C1 CS-0302716 [0,2,0,0,0,0|1,0,1]=4 613 B12R1.5 COC1=NC=C(C(=N)NO)C=C1 CS-0452847 [0,2,0,0,0,0|2,0,0]=4 614 B12R1.5 N#CC1=CC=C(C(=O)NN)C=C1 CS-0536254 [0,2,0,0,0,0|2,0,0]=4 615 B12R1.6 COC1=CC=C(P(=O)(O)O)C=C1 CS-0315044 [0,2,0,0,0,0|1,0,0]=3 616 B12R1.48 C#CC1=CC=C(C(=O)O)C=C1F CS-0521132 [0,2,0,0,0,0|1,0,0]=3 617 B12R1.48 CC(=O)C1=CC(Br)=C(CO)C=C1 CS-0052676 [0,2,0,0,0,0|1,0,0]=3 618 B12R1.48 CC(=O)C1=CC=C(C#N)C(Br)=C1 CS-0654891 [0,2,0,0,0,0|2,0,0]=4 619 B12R1.48 CC(=O)C1=CC=C(C=O)C(C)=C1 CS-0866355 [0,2,0,0,0,0|1,0,1]=4 620 B12R1.48 CC1=CC(C(=O)O)=CC=C1CN CS-0880222 [0,2,0,0,0,0|1,0,0]=3 621 B12R1.48 CCC1=C(I)C=C(C(=O)O)C=C1 CS-0152555 [0,2,0,0,0,0|1,0,0]=3 622 B12R1.48 COC1=C(Br)C=C(B(O)O)C=C1 CS-0189604 [0,2,0,0,0,0|1,0,1]=4 623 B12R1.48 COC1=C(Br)C=C(C(N)=O)C=C1 CS-0302170 [0,2,0,0,0,0|1,0,0]=3 624 B12R1.48 COC1=C(C)C=C([C@@H](C)O)C=C1 CS-1019130 [0,2,0,0,0,0|1,0,1]=4 625 B12R1.48 COC1=C(N)C=C(B(O)O)C=C1 CS-0174303 [0,2,0,0,0,0|1,0,1]=4 626 B12R1.48 COC1=C(O)C=C(C(=O)O)C=N1 CS-0075310 [0,2,0,0,0,0|1,0,0]=3 627 B12R1.48 COC1=CC=C([C@H](C)O)C=C1C CS-0253094 [0,2,0,0,0,0|1,0,1]=4 628 B12R1.48 COC1=CN=C(C(=O)O)C=C1Cl CS-0054016 [0,2,0,0,0,0|1,0,0]=3 629 B12R1.48 CSC1=C(Cl)C=C(C(=O)O)C=C1 CS-0194893 [0,2,0,0,0,0|0,1,0]=3 630 B12R1.48 CSC1=CC=C(C(=O)O)C=C1C CS-0195958 [0,2,0,0,0,0|0,1,0]=3 631 B12R1.48 CSC1=CC=C(C(=O)O)C=C1F CS-0191441 [0,2,0,0,0,0|0,1,0]=3 632 B12R1.48 CSC1=CC=C(C(N)=O)C=C1F CS-0517716 [0,2,0,0,0,0|1,1,0]=4 633 B12R1.48 N#CC1=C(Br)C=C(C(=O)O)C=N1 CS-0232541 [0,2,0,0,0,0|2,0,0]=4 634 B12R1.48 N#CC1=CC=C(C(=O)O)C=C1O CS-0532095 [0,2,0,0,0,0|1,0,0]=3 635 B12R1.48 O=C(O)C1=CC(Cl)=C(CO)C=C1 CS-0779276 [0,2,0,0,0,0|0,0,0]=2 636 B12R1.48 O=C(O)C1=CC=C(CO)C(O)=C1 CS-0163404 [0,2,0,0,0,0|0,0,0]=2 637 B12R1.48 O=C(O)C1=CC=C(CS)C(F)=C1 CS-0264013 [0,2,0,0,0,0|0,1,0]=3 638 B12R1.113 CCCC1=CC=C(C(=O)O)C=N1 CS-0104504 [0,2,0,0,0,0|2,0,0]=4 639 B12R1.113 CCNC1=CC=C(C(N)=O)C=C1 CS-0235877 [0,2,0,0,0,0|2,0,0]=4 640 B12R1.113 CCOC1=CC=C([C@@H](C)O)C=C1 CS-0086775 [0,2,0,0,0,0|1,0,1]=4 641 B12R1.113 CCOC1=CC=C([C@H](C)O)C=C1 CS-0263516 [0,2,0,0,0,0|1,0,1]=4 642 B12R1.113 CCSC1=CC=C(C(C)=O)C=C1 CS-0531093 [0,2,0,0,0,0|1,1,0]=4 643 B12R1.113 CC\N=C1\C=CC(C(=O)O)=CN1 CS-0298170 [0,2,0,0,0,0|2,0,0]=4 644 B12R1.113 CNCC1=CC=C(C(=O)O)C=C1 CS-0301521 [0,2,0,0,0,0|1,0,0]=3 645 B12R1.113 CNCC1=CC=C(C(N)=O)C=C1 CS-0215887 [0,2,0,0,0,0|2,0,0]=4 646 B12R1.113 COCC1=NC=C(C(=O)O)C=N1 CS-0461947 [0,2,0,0,0,0|2,0,0]=4 647 B12R1.113 N#CCC1=CN=C(C(=O)O)C=C1 CS-0324754 [0,2,0,0,0,0|2,0,0]=4 648 B12R1.113 NC(=O)C1=CC=C(CCCl)C=C1 CS-0522037 [0,2,0,0,0,0|2,0,0]=4 649 B12R1.113 NOCC1=CC=C(C(=O)O)C=C1 CS-0217308 [0,2,0,0,0,0|0,0,0]=2 650 B12R1.113 O=COC1=CC=C([N+](=O)[O-])C=C1 CS-0112298 [0,2,0,0,0,0|1,0,1]=4 651 B12R1.113 O=[N+]([O-])C1=CC=C(\C=N\O)C=C1 CS-0887156 [0,2,0,0,0,0|1,0,1]=4 652 B12R1.113 O\N=C\C1=CC=C(B(O)O)C=C1 CS-0157615 [0,2,0,0,0,0|1,0,1]=4 653 B12R1.256 CC(=O)C1=CC=C(C(N)=O)C=C1 CS-0128005 [0,2,0,0,0,0|1,0,1]=4 654 B12R1.256 CC(C)C1=CC=C(C(N)=O)C=C1 CS-0273820 [0,2,0,0,0,0|2,0,0]=4 655 B12R1.256 CC(N)C1=CC=C(C(=O)O)C=C1 CS-0341767 [0,2,0,0,0,0|1,0,0]=3 656 B12R1.256 C[C@@H](N)C1=CC=C(C(N)=O)C=C1 CS-0000332 [0,2,0,0,0,0|2,0,0]=4 657 B12R1.256 NC(=S)C1=CC=C(B(O)O)C=C1 CS-0177442 [0,2,0,0,0,0|1,1,0]=4 658 B12R1.452 C#CC1=CN=C(C(=O)O)C(C)=C1 CS-0610014 [0,2,0,0,0,0|2,0,0]=4 659 B12R1.452 CC(=O)C1=CC=C(C#N)C=C1C CS-0215136 [0,2,0,0,0,0|2,0,0]=4 660 B12R1.452 CC1=CC(C#N)=CN=C1C(=O)O CS-0210862 [0,2,0,0,0,0|2,0,0]=4 661 B12R1.452 CC1=NC(CN)=CC=C1C(=O)O CS-0224951 [0,2,0,0,0,0|2,0,0]=4 662 B12R1.452 CCC1=CC=C(C(=O)O)C(Br)=C1 CS-0190112 [0,2,0,0,0,0|1,0,0]=3 663 B12R1.452 COC1=CC(Br)=C(C(N)=O)C=C1 CS-0365316 [0,2,0,0,0,0|1,0,0]=3 664 B12R1.452 COC1=CC(F)=C(C(C)O)C=C1 CS-0194325 [0,2,0,0,0,0|1,0,1]=4 665 B12R1.452 COC1=CC(F)=C(C(N)=O)C=C1 CS-0456638 [0,2,0,0,0,0|1,0,0]=3 666 B12R1.452 COC1=CC=C(C(C)=O)C(I)=C1 CS-0609081 [0,2,0,0,0,0|1,0,0]=3 667 B12R1.452 COC1=NC=C(C(=O)O)C(N)=C1 CS-0053916 [0,2,0,0,0,0|1,0,0]=3 668 B12R1.452 N#CC1=CC=C(C(=O)O)C(=O)N1 CS-0490169 [0,2,0,0,0,0|2,0,0]=4 669 B12R1.452 N#CC1=CC=C(C(=O)O)C(I)=C1 CS-0041244 [0,2,0,0,0,0|1,0,0]=3 670 B12R1.452 N#CC1=CN=C(C(=O)O)C(Cl)=C1 CS-0253857 [0,2,0,0,0,0|2,0,0]=4 671 B12R1.452 NCC1=CC=C(C(=O)O)C(Cl)=C1 CS-0432664 [0,2,0,0,0,0|1,0,0]=3 672 B12R1.452 O=C(O)C1=C(F)C=C(CBr)C=C1 CS-0665857 [0,2,0,0,0,0|1,0,0]=3 673 B12R1.452 O=CC1=CC=C(C(=O)O)C(Br)=C1 CS-0459381 [0,2,0,0,0,0|0,0,1]=3 674 B12R1.9 CCS(=O)(=O)C1=CC=C(O)C=C1 CS-0227161 [0,2,0,0,0,0|1,0,1]=4 675 B12R1.9 O=S(=O)(O[Na])C1=CC=C(Cl)C=C1 CS-0197254 [0,2,0,0,0,0|2,0,0]=4 676 B12R1.23 CC1=C(C)C=C(S(=O)(=O)O)C=C1 CS-0668582 [0,2,0,0,0,0|2,0,0]=4 677 B12R1.23 NC1=CC(S(=O)(=O)O)=CC=C1O CS-1154033 [0,2,0,0,0,0|1,0,0]=3 678 B12R1.126 CC1=CC=C(S(=O)(=O)O)C(C)=C1 CS-0698672 [0,2,0,0,0,0|2,0,0]=4 679 B12R1.126 CS(=O)(=O)C1=CC=C(O)C=C1F CS-0459145 [0,2,0,0,0,0|1,0,1]=4 680 B12R1.56 CCC1=CC(B(O)O)=CC=C1O CS-0515313 [0,2,0,0,0,0|1,0,1]=4 681 B12R1.56 CCC1=CC(C(=O)O)=CC=C1Br CS-0242505 [0,2,0,0,0,0|1,0,0]=3 682 B12R1.56 CCC1=CC(C(=O)O)=CC=C1Cl CS-0194531 [0,2,0,0,0,0|1,0,0]=3 683 B12R1.56 CCC1=CC(C(=O)O)=CC=C1O CS-0239592 [0,2,0,0,0,0|0,0,0]=2 684 B12R1.56 COC1=C(Br)N=CC(C(=O)O)=C1 CS-0194232 [0,2,0,0,0,0|2,0,0]=4 685 B12R1.56 COC1=C(C)N=CC(C(=O)O)=C1 CS-0567190 [0,2,0,0,0,0|2,0,0]=4 686 B12R1.56 COC1=C(N)C=CC(C(=O)O)=N1 CS-0370512 [0,2,0,0,0,0|2,0,0]=4 687 B12R1.56 COC1=C(N)C=CC(C(N)=O)=C1 CS-0215458 [0,2,0,0,0,0|2,0,0]=4 688 B12R1.56 COC1=CC(C(=O)O)=CN=C1I CS-0039651 [0,2,0,0,0,0|2,0,0]=4 689 B12R1.56 COC1=CC(C(C)=O)=CC=C1S CS-0230607 [0,2,0,0,0,0|1,1,0]=4 690 B12R1.56 CSC1=C(Cl)C=CC(C(=O)O)=C1 CS-0172670 [0,2,0,0,0,0|1,0,0]=3 691 B12R1.56 N#CC1=CC(C(=O)O)=CN=C1O CS-0515814 [0,2,0,0,0,0|1,0,0]=3 692 B12R1.56 NC1=CC=C(C(=O)O)C=C1C=O CS-0883552 [0,2,0,0,0,0|1,0,0]=3 693 B12R1.56 NCC1=CC(C(=O)O)=CC=C1O CS-0567152 [0,2,0,0,0,0|0,0,0]=2 694 B12R1.56 O=C(O)C1=CC(CO)=C(Cl)C=C1 CS-0442108 [0,2,0,0,0,0|1,0,0]=3 695 B12R1.56 O=C(O)C1=CC=C(F)C(CBr)=C1 CS-0459307 [0,2,0,0,0,0|1,0,0]=3 696 B12R1.56 O=CC1=C(Br)C=CC(C(=O)O)=C1 CS-0195951 [0,2,0,0,0,0|1,0,0]=3 697 B12R1.232 CC(=O)C1=C(F)C=C(C)C(Br)=C1 CS-0871876 [0,2,0,0,0,0|2,0,0]=4 698 B12R1.232 CC(=O)C1=C(F)C=C(Cl)C(F)=C1 CS-0317412 [0,2,0,0,0,0|2,0,0]=4 699 B12R1.232 CC(=O)C1=CC(Br)=C(C)C=C1N CS-0137049 [0,2,0,0,0,0|2,0,0]=4 700 B12R1.232 CC(=O)C1=CC(Br)=C(Cl)C=C1F CS-0779804 [0,2,0,0,0,0|2,0,0]=4 701 B12R1.232 CC(=O)C1=CC(Cl)=C(Br)C=C1F CS-0513133 [0,2,0,0,0,0|2,0,0]=4 702 B12R1.232 CC(=O)C1=CC(Cl)=C(Cl)C=C1N CS-0670269 [0,2,0,0,0,0|2,0,0]=4 703 B12R1.232 CC(=O)C1=CC(Cl)=C(F)C=C1Br CS-0871733 [0,2,0,0,0,0|2,0,0]=4 704 B12R1.232 CC(=O)C1=CC(Cl)=C(F)C=C1N CS-0462272 [0,2,0,0,0,0|2,0,0]=4 705 B12R1.232 CC(=O)C1=CC(F)=C(F)C=C1O CS-0132874 [0,2,0,0,0,0|2,0,0]=4 706 B12R1.232 CC1=C(Br)C=C(C(=O)O)C(Br)=C1 CS-0356328 [0,2,0,0,0,0|1,0,0]=3 707 B12R1.232 CC1=C(C(=O)O)C=C(I)C(Cl)=C1 CS-0750458 [0,2,0,0,0,0|1,0,0]=3 708 B12R1.232 CC1=C(Cl)C=C(F)C(C(N)=O)=C1 CS-0521990 [0,2,0,0,0,0|2,0,0]=4 709 B12R1.232 CC1=C(F)C=C(Cl)C(C(N)=O)=C1 CS-0521897 [0,2,0,0,0,0|2,0,0]=4 710 B12R1.232 CC1=C(F)C=C(F)C(C(N)=O)=C1 CS-0507090 [0,2,0,0,0,0|2,0,0]=4 711 B12R1.232 CC1=C(I)C=C(C(=O)O)C(Br)=C1 CS-0191317 [0,2,0,0,0,0|1,0,0]=3 712 B12R1.232 CC1=C(I)C=C(C(=O)O)C(F)=C1 CS-0190643 [0,2,0,0,0,0|1,0,0]=3 713 B12R1.232 CC1=C(I)C=C(C(=O)O)C(O)=C1 CS-0541709 [0,2,0,0,0,0|1,0,0]=3 714 B12R1.232 CC1=C(N)C=C(C(=O)O)C(F)=C1 CS-0370478 [0,2,0,0,0,0|1,0,0]=3 715 B12R1.232 CC1=C(O)C=C(O)C(C(=O)O)=C1 CS-0823275 [0,2,0,0,0,0|0,0,0]=2 716 B12R1.232 CC1=CC(=O)C(C(=O)O)=CN1C CS-0214866 [0,2,0,0,0,0|2,0,0]=4 717 B12R1.232 CC1=CC(Br)=C(C(=O)O)C=C1C CS-0532110 [0,2,0,0,0,0|1,0,0]=3 718 B12R1.232 CC1=CC(Br)=C(Cl)C=C1C(=O)O CS-0194712 [0,2,0,0,0,0|1,0,0]=3 719 B12R1.232 CC1=CC(Br)=C(F)C=C1C(N)=O CS-0716453 [0,2,0,0,0,0|2,0,0]=4 720 B12R1.232 CC1=CC(C(=O)O)=C(C)C=C1O CS-0450346 [0,2,0,0,0,0|0,0,0]=2 721 B12R1.232 CC1=CC(C(N)=O)=C(F)C=C1Br CS-0692094 [0,2,0,0,0,0|2,0,0]=4 722 B12R1.232 CC1=CC(F)=C(C(N)=O)C=C1Br CS-1033030 [0,2,0,0,0,0|2,0,0]=4 723 B12R1.232 CC1=CC(F)=C(C)C=C1C(=O)O CS-0190737 [0,2,0,0,0,0|1,0,0]=3 724 B12R1.232 CC1=CC(F)=C(Cl)C=C1C(=O)O CS-0572579 [0,2,0,0,0,0|1,0,0]=3 725 B12R1.232 CC1=CC(N)=C(C(=O)O)C=C1I CS-0779879 [0,2,0,0,0,0|1,0,0]=3 726 B12R1.232 CC1=CC(N)=C(I)C=C1C(=O)O CS-0372654 [0,2,0,0,0,0|1,0,0]=3 727 B12R1.232 CC1=CC(O)=C(F)C=C1C(=O)O CS-0880327 [0,2,0,0,0,0|0,0,0]=2 728 B12R1.232 CC1=CC(O)=C(O)C=C1C(=O)O CS-0259888 [0,2,0,0,0,0|0,0,0]=2 729 B12R1.232 CC1=NC(Cl)=C(C(=O)O)C=C1F CS-0254128 [0,2,0,0,0,0|2,0,0]=4 730 B12R1.232 CC1=NC(N)=C(C(=O)O)C=C1Br CS-0564782 [0,2,0,0,0,0|2,0,0]=4 731 B12R1.232 NC(=O)C1=C(F)C=C(Cl)C(F)=C1 CS-0260240 [0,2,0,0,0,0|2,0,0]=4 732 B12R1.232 NC(=O)C1=CC(Br)=C(Cl)C=C1N CS-0542355 [0,2,0,0,0,0|2,0,0]=4 733 B12R1.232 NC(=O)C1=CC(Cl)=C(Br)C=C1N CS-0820029 [0,2,0,0,0,0|2,0,0]=4 734 B12R1.232 NC(=O)C1=CC(Cl)=C(Cl)C=C1Cl CS-0523767 [0,2,0,0,0,0|2,0,0]=4 735 B12R1.232 NC(=O)C1=CC(F)=C(Br)C=C1Cl CS-0686859 [0,2,0,0,0,0|2,0,0]=4 736 B12R1.232 NC(=O)C1=CC(F)=C(F)C=C1F CS-0313336 [0,2,0,0,0,0|2,0,0]=4 737 B12R1.232 NC1=C(Br)C=C(C(=O)O)C(Cl)=C1 CS-0539779 [0,2,0,0,0,0|1,0,0]=3 738 B12R1.232 NC1=C(Cl)C=C(Br)C(C(=O)O)=C1 CS-0372967 [0,2,0,0,0,0|1,0,0]=3 739 B12R1.232 NC1=CC(Br)=C(I)C=C1C(=O)O CS-0529053 [0,2,0,0,0,0|1,0,0]=3 740 B12R1.232 NC1=CC(C(=O)O)=C(F)C=C1O CS-0541676 [0,2,0,0,0,0|0,0,0]=2 741 B12R1.232 NC1=CC(O)=C(O)C=C1C(=O)O CS-0376423 [0,2,0,0,0,0|0,0,0]=2 742 B12R1.232 NC1=NC(Cl)=C(Cl)C=C1C(=O)O CS-0135748 [0,2,0,0,0,0|2,0,0]=4 743 B12R1.232 NC1=NC(O)=C(Cl)N=C1C(=O)O CS-0184782 [0,2,0,0,0,0|2,0,0]=4 744 B12R1.232 O=C(O)C1=C(Cl)C=C(F)C(F)=N1 CS-0875236 [0,2,0,0,0,0|2,0,0]=4 745 B12R1.232 O=C(O)C1=CC(Br)=C(Cl)C=C1Cl CS-0190588 [0,2,0,0,0,0|1,0,0]=3 746 B12R1.232 O=C(O)C1=CC(Br)=C(F)C=C1Cl CS-W004398 [0,2,0,0,0,0|1,0,0]=3 747 B12R1.232 O=C(O)C1=CC(Br)=C(O)C=C1Br CS-0442639 [0,2,0,0,0,0|0,0,0]=2 748 B12R1.232 O=C(O)C1=CC(Br)=C(O)C=C1O CS-W009491 [0,2,0,0,0,0|0,0,0]=2 749 B12R1.232 O=C(O)C1=CC(Cl)=C(O)C=C1O CS-0205243 [0,2,0,0,0,0|0,0,0]=2 750 B12R1.232 O=C(O)C1=CC(F)=C(Br)C=C1Br CS-0194687 [0,2,0,0,0,0|1,0,0]=3 751 B12R1.232 O=C(O)C1=CC(F)=C(Br)C=C1I CS-0521170 [0,2,0,0,0,0|1,0,0]=3 752 B12R1.232 O=C(O)C1=CC(I)=C(Br)C=C1F CS-0515282 [0,2,0,0,0,0|1,0,0]=3 753 B12R1.232 O=C(O)C1=CC(I)=C(Cl)C=C1Cl CS-0191188 [0,2,0,0,0,0|1,0,0]=3 754 B12R1.232 O=C([O-])C1=CC(F)=C(F)C=C1Cl CS-0699118 [0,2,0,0,0,0|1,0,1]=4 755 B12R1.232 O=[N+]([O-])C1=C(F)C=C(O)C(Br)=C1 CS-0098635 [0,2,0,0,0,0|1,0,1]=4 756 B12R1.232 OB(O)C1=CC(Cl)=C(O)C=C1F CS-0189415 [0,2,0,0,0,0|1,0,1]=4 757 B12R1.232 OB(O)C1=CC(F)=C(O)C=C1F CS-0112418 [0,2,0,0,0,0|1,0,1]=4 758 B12R1.367 CC1=CC(C(=O)CN)=CC=C1F CS-0127448 [0,2,0,0,0,0|2,0,0]=4 759 B12R1.367 CC1=CC(C(=O)NN)=CC=C1Br CS-0337161 [0,2,0,0,0,0|2,0,0]=4 760 B12R1.367 CC1=CC=C(C(=O)NO)C=C1O CS-0263016 [0,2,0,0,0,0|1,0,0]=3 761 B12R1.367 CCC(=O)C1=CC(F)=C(C)C=C1 CS-0363466 [0,2,0,0,0,0|2,0,0]=4 762 B12R1.367 CNC(=O)C1=CC(N)=C(Cl)C=C1 CS-0713562 [0,2,0,0,0,0|2,0,0]=4 763 B12R1.367 CNC(=O)C1=CC=C(N)C(Cl)=C1 CS-0222797 [0,2,0,0,0,0|2,0,0]=4 764 B12R1.367 COC(=O)C1=CC(=O)N(C)C=C1 CS-0049227 [0,2,0,0,0,0|2,0,0]=4 765 B12R1.367 COC(=O)C1=CC(Cl)=C(Br)C=N1 CS-0497031 [0,2,0,0,0,0|2,0,0]=4 766 B12R1.367 COC(=O)C1=CC(S)=C(N)C=C1 CS-0366553 [0,2,0,0,0,0|1,0,0]=3 767 B12R1.367 COC(=O)C1=CN=C(C)C(C)=C1 CS-0195607 [0,2,0,0,0,0|2,0,0]=4 768 B12R1.367 COC(=O)C1=CN=C(F)C(F)=C1 CS-0534106 [0,2,0,0,0,0|2,0,0]=4 769 B12R1.367 COC(=O)C1=NC(C)=C(O)C=C1 CS-0564004 [0,2,0,0,0,0|1,0,0]=3 770 B12R1.367 COC(=O)C1=NC(I)=C(O)C=C1 CS-0338260 [0,2,0,0,0,0|1,0,0]=3 771 B12R1.367 COC(=O)C1=NC=C(C)C(N)=C1 CS-0361857 [0,2,0,0,0,0|2,0,0]=4 772 B12R1.367 COC(=O)C1=NC=C(F)C(N)=C1 CS-0775986 [0,2,0,0,0,0|2,0,0]=4 773 B12R1.367 COC(=O)C1=NC=C(O)C(O)=C1 CS-0049064 [0,2,0,0,0,0|1,0,0]=3 774 B12R1.367 NCC(=O)C1=CC=C(F)C(F)=C1 CS-0108339 [0,2,0,0,0,0|2,0,0]=4 775 B12R1.367 NNC(=O)C1=CC(Br)=C(Cl)C=C1 CS-0359766 [0,2,0,0,0,0|2,0,0]=4 776 B12R1.367 NNC(=O)C1=CC(Cl)=C(F)C=C1 CS-0333584 [0,2,0,0,0,0|2,0,0]=4 777 B12R1.367 O=C(CBr)C1=CC=C(I)C(Cl)=C1 CS-0515545 [0,2,0,0,0,0|2,0,0]=4 778 B12R1.367 O=CC(=O)C1=CC(F)=C(F)C=C1 CS-0206176 [0,2,0,0,0,0|1,0,1]=4 779 B12R1.893 CC(=O)C1=C(Cl)C(Cl)=C(Cl)C=C1 CS-W010451 [0,2,0,0,0,0|2,0,0]=4 780 B12R1.893 CC(=O)C1=C(I)C(F)=C(Br)C=C1 CS-0872938 [0,2,0,0,0,0|2,0,0]=4 781 B12R1.893 CC(=O)C1=CC=C(Br)C(Cl)=C1F CS-0469597 [0,2,0,0,0,0|2,0,0]=4 782 B12R1.893 CC(=O)C1=CC=C(Br)C(F)=C1Cl CS-0469600 [0,2,0,0,0,0|2,0,0]=4 783 B12R1.893 CC(=O)C1=CC=C(F)C(C)=C1Cl CS-0448379 [0,2,0,0,0,0|2,0,0]=4 784 B12R1.893 CC(=O)C1=CC=C(I)C(F)=C1F CS-0191304 [0,2,0,0,0,0|2,0,0]=4 785 B12R1.893 CC1=C(Br)C(Cl)=C(C(=O)O)C=N1 CS-0231589 [0,2,0,0,0,0|2,0,0]=4 786 B12R1.893 CC1=C(C)C(C(=O)O)=CC=C1F CS-0510429 [0,2,0,0,0,0|1,0,0]=3 787 B12R1.893 CC1=C(C)C(C(=O)O)=CC=C1O CS-0236144 [0,2,0,0,0,0|0,0,0]=2 788 B12R1.893 CC1=C(Cl)C(Br)=C(C(=O)O)C=N1 CS-0288461 [0,2,0,0,0,0|2,0,0]=4 789 B12R1.893 CC1=C(Cl)C(Cl)=C(C(=O)O)C=C1 CS-0194026 [0,2,0,0,0,0|1,0,0]=3 790 B12R1.893 CC1=C(Cl)C(O)=C(C(=O)O)C=N1 CS-0222070 [0,2,0,0,0,0|2,0,0]=4 791 B12R1.893 CC1=C(F)C(C(=O)O)=CC=C1F CS-0018842 [0,2,0,0,0,0|1,0,0]=3 792 B12R1.893 CC1=C(F)C(C(=O)O)=CC=C1I CS-0191020 [0,2,0,0,0,0|1,0,0]=3 793 B12R1.893 CC1=C(F)C(F)=C(C(N)=O)C=C1 CS-0194153 [0,2,0,0,0,0|2,0,0]=4 794 B12R1.893 CC1=C(F)C(N)=C(C(=O)O)C=C1 CS-0723727 [0,2,0,0,0,0|1,0,0]=3 795 B12R1.893 CC1=C(O)C([N+](=O)[O-])=CC=C1O CS-0260380 [0,2,0,0,0,0|1,0,1]=4 796 B12R1.893 CC1=C(O)C=CC([N+](=O)[O-])=C1F CS-0480089 [0,2,0,0,0,0|1,0,1]=4 797 B12R1.893 CC1=CC=C(C(=O)O)C(=O)N1C CS-0713548 [0,2,0,0,0,0|2,0,0]=4 798 B12R1.893 CC1=CC=C(C(=O)O)C(C)=C1C CS-0130735 [0,2,0,0,0,0|1,0,0]=3 799 B12R1.893 CC1=CC=C(C(=O)O)C(C)=C1Cl CS-0194013 [0,2,0,0,0,0|1,0,0]=3 800 B12R1.893 CC1=CC=C(C(=O)O)C(F)=C1I CS-0046931 [0,2,0,0,0,0|1,0,0]=3 801 B12R1.893 NC(=O)C1=C(F)C(Cl)=C(F)C=C1 CS-0319231 [0,2,0,0,0,0|2,0,0]=4 802 B12R1.893 NC(=O)C1=C(F)C(F)=C(F)C=C1 CS-0315056 [0,2,0,0,0,0|2,0,0]=4 803 B12R1.893 NC1=C(Br)C(Cl)=C(C(=O)O)C=C1 CS-0657548 [0,2,0,0,0,0|1,0,0]=3 804 B12R1.893 NC1=C(Br)C(Cl)=CC=C1C(=O)O CS-0090494 [0,2,0,0,0,0|1,0,0]=3 805 B12R1.893 NC1=C(Br)C(F)=CC=C1C(=O)O CS-0512103 [0,2,0,0,0,0|1,0,0]=3 806 B12R1.893 NC1=C(F)C(Cl)=CC=C1C(=O)O CS-0127899 [0,2,0,0,0,0|1,0,0]=3 807 B12R1.893 NC1=C(N)C(C(=O)O)=CC=C1F CS-0883766 [0,2,0,0,0,0|1,0,0]=3 808 B12R1.893 NC1=C(O)C(Cl)=CC=C1C(=O)O CS-0161456 [0,2,0,0,0,0|1,0,0]=3 809 B12R1.893 O=C(O)C1=C(F)C(Cl)=C(Cl)C=C1 CS-0193468 [0,2,0,0,0,0|1,0,0]=3 810 B12R1.893 O=C(O)C1=C(F)C(I)=C(Br)C=C1 CS-0194384 [0,2,0,0,0,0|1,0,0]=3 811 B12R1.893 O=C(O)C1=CC=C(Br)C(Br)=C1F CS-0191133 [0,2,0,0,0,0|1,0,0]=3 812 B12R1.893 O=C(O)C1=CC=C(Br)C(O)=C1O CS-0119672 [0,2,0,0,0,0|1,0,0]=3 813 B12R1.893 O=C(O)C1=CC=C(Cl)C(Br)=C1F CS-0469534 [0,2,0,0,0,0|1,0,0]=3 814 B12R1.893 O=C(O)C1=NC=C(Cl)C(Cl)=C1Cl CS-0005495 [0,2,0,0,0,0|2,0,0]=4 815 B12R1.893 O=[N+]([O-])C1=C(Br)C(F)=C(O)C=C1 CS-0746878 [0,2,0,0,0,0|1,0,1]=4 816 B12R1.893 O=[N+]([O-])C1=CC=C(O)C(Br)=C1F CS-0505266 [0,2,0,0,0,0|1,0,1]=4 817 B12R1.1005 CC(=O)C1=CC(C)=C(O)C(Cl)=C1 CS-0322942 [0,2,0,0,0,0|1,0,0]=3 818 B12R1.1005 CC(=O)C1=CC(F)=C(Cl)C(F)=C1 CS-0318651 [0,2,0,0,0,0|2,0,0]=4 819 B12R1.1005 CC(=O)C1=CC(F)=C(F)C(Br)=C1 CS-0521884 [0,2,0,0,0,0|2,0,0]=4 820 B12R1.1005 CC(=O)C1=CC(F)=C(F)C(Cl)=C1 CS-0873255 [0,2,0,0,0,0|2,0,0]=4 821 B12R1.1005 CC(=O)C1=CC(F)=C(N)C(F)=C1 CS-0224409 [0,2,0,0,0,0|2,0,0]=4 822 B12R1.1005 CC1=C(Br)C=C(C(=O)O)C=C1N CS-0371019 [0,2,0,0,0,0|1,0,0]=3 823 B12R1.1005 CC1=C(C)C(Br)=CC(C(=O)O)=C1 CS-0834795 [0,2,0,0,0,0|1,0,0]=3 824 B12R1.1005 CC1=C(Cl)C=C(C(=O)O)C=C1Br CS-0222750 [0,2,0,0,0,0|1,0,0]=3 825 B12R1.1005 CC1=C(F)C=C(C(N)=O)C=C1N CS-0292813 [0,2,0,0,0,0|2,0,0]=4 826 B12R1.1005 CC1=C(I)C=C(C(=O)O)C=C1Br CS-0755507 [0,2,0,0,0,0|1,0,0]=3 827 B12R1.1005 CC1=CC(C(=O)O)=CC(Cl)=C1F CS-0756267 [0,2,0,0,0,0|1,0,0]=3 828 B12R1.1005 CC1=CC(C(=O)O)=CC(I)=C1O CS-0936206 [0,2,0,0,0,0|0,0,0]=2 829 B12R1.1005 CC1=CC(C(N)=O)=CC(C)=C1F CS-0330577 [0,2,0,0,0,0|2,0,0]=4 830 B12R1.1005 CC1=CC([N+](=O)[O-])=CC(Cl)=C1O CS-0315997 [0,2,0,0,0,0|1,0,1]=4 831 B12R1.1005 NC(=O)C1=CC(Cl)=C(O)C(Cl)=C1 CS-0323502 [0,2,0,0,0,0|1,0,0]=3 832 B12R1.1005 NC1=C(F)C=C(C(=O)O)C=C1Br CS-0035004 [0,2,0,0,0,0|1,0,0]=3 833 B12R1.1005 NC1=CC(C(=O)O)=CC(F)=C1Br CS-0235017 [0,2,0,0,0,0|1,0,0]=3 834 B12R1.1005 O=C(O)C1=CC(Br)=C(Cl)C(Cl)=C1 CS-0489622 [0,2,0,0,0,0|1,0,0]=3 835 B12R1.1005 O=C(O)C1=CC(Cl)=C(F)C(Br)=C1 CS-0255893 [0,2,0,0,0,0|1,0,0]=3 836 B12R1.1005 O=C(O)C1=CC(Cl)=C(I)C(Br)=C1 CS-0372957 [0,2,0,0,0,0|1,0,0]=3 837 B12R1.1005 O=C(O)C1=CC(O)=C(Cl)C(O)=C1 CS-0618112 [0,2,0,0,0,0|1,0,0]=3 838 B12R1.16 C=CCC(=O)C1=CC=C(F)C=C1 CS-0261968 [0,2,0,0,0,0|2,0,0]=4 839 B12R1.16 CCNC(=O)C1=CC=C(Br)C=C1 CS-0452304 [0,2,0,0,0,0|2,0,0]=4 840 B12R1.16 CCNC(=O)C1=CC=C(N)C=C1 CS-0122457 [0,2,0,0,0,0|2,0,0]=4 841 B12R1.16 CCOC(=N)C1=CC=C(Br)C=C1 CS-0122258 [0,2,0,0,0,0|2,0,0]=4 842 B12R1.16 CCOC(=N)C1=CC=C(O)C=C1 CS-0453665 [0,2,0,0,0,0|1,0,0]=3 843 B12R1.16 CCOC(=O)C1=CN=C(F)C=C1 CS-0452032 [0,2,0,0,0,0|2,0,0]=4 844 B12R1.16 CCOC(=O)C1=NC=C(F)C=C1 CS-0315150 [0,2,0,0,0,0|2,0,0]=4 845 B12R1.16 CCOC(=O)C1=NC=C(O)C=C1 CS-0311544 [0,2,0,0,0,0|1,0,0]=3 846 B12R1.16 CNCC(=O)C1=CC=C(O)C=C1 CS-0301430 [0,2,0,0,0,0|1,0,0]=3 847 B12R1.16 CNCC(=O)C1=CC=C(O)C=C1 CS-0914801 [0,2,0,0,0,0|1,0,0]=3 848 B12R1.16 COCC(=O)C1=CC=C(Br)C=C1 CS-0651794 [0,2,0,0,0,0|1,0,0]=3 849 B12R1.16 CONC(=O)C1=CC=C(O)C=C1 CS-0209810 [0,2,0,0,0,0|0,0,0]=2 850 B12R1.16 N#CCC(=O)C1=CC=C(O)C=C1 CS-0313434 [0,2,0,0,0,0|1,0,0]=3 851 B12R1.16 O=C(CCBr)C1=CC=C(Br)C=C1 CS-0268078 [0,2,0,0,0,0|2,0,0]=4 852 B12R1.16 O=C(CCBr)C1=CC=C(F)C=C1 CS-0231260 [0,2,0,0,0,0|2,0,0]=4 853 B12R1.16 O=C(CCCl)C1=CC=C(O)C=C1 CS-0466262 [0,2,0,0,0,0|1,0,0]=3 854 B12R1.1703 CC1=CC=C(C(=O)CBr)C(C)=C1 CS-0073020 [0,2,0,0,0,0|2,0,0]=4 855 B12R1.1703 CCC(=O)C1=C(C)C=C(Br)C=C1 CS-0670529 [0,2,0,0,0,0|2,0,0]=4 856 B12R1.1703 CCC(=O)C1=C(Cl)C=C(Cl)C=C1 CS-0152664 [0,2,0,0,0,0|2,0,0]=4 857 B12R1.1703 CCC(=O)C1=C(N)C=C(Br)C=C1 CS-0210207 [0,2,0,0,0,0|2,0,0]=4 858 B12R1.1703 CNC(=O)C1=C(C)C=C(O)C=C1 CS-0666315 [0,2,0,0,0,0|1,0,0]=3 859 B12R1.1703 CNC(=O)C1=C(F)C=C(C)C=C1 CS-0069893 [0,2,0,0,0,0|2,0,0]=4 860 B12R1.1703 CNC(=O)C1=CC=C(Cl)C=C1F CS-0209762 [0,2,0,0,0,0|2,0,0]=4 861 B12R1.1703 CNC(=O)C1=CC=C(N)C=C1N CS-0246789 [0,2,0,0,0,0|2,0,0]=4 862 B12R1.1703 CNC(=O)C1=CC=C(O)C=C1F CS-0526171 [0,2,0,0,0,0|1,0,0]=3 863 B12R1.1703 COC(=O)C1=C(Br)N=C(F)C=C1 CS-0442352 [0,2,0,0,0,0|2,0,0]=4 864 B12R1.1703 COC(=O)C1=C(N)C=C(N)N=C1 CS-0732303 [0,2,0,0,0,0|2,0,0]=4 865 B12R1.1703 COC(=O)C1=CC=C(Br)N=C1Br CS-0080810 [0,2,0,0,0,0|2,0,0]=4 866 B12R1.1703 COC(=O)C1=NC=C(Cl)C=C1N CS-0254901 [0,2,0,0,0,0|2,0,0]=4 867 B12R1.1703 COC(=O)C1=NC=C(N)C=C1C CS-0057768 [0,2,0,0,0,0|2,0,0]=4 868 B12R1.1703 COC(=O)C1=NC=C(N)C=C1F CS-0056634 [0,2,0,0,0,0|2,0,0]=4 869 B12R1.1703 C\C(=N/O)C1=CC=C(O)C=C1O CS-0331626 [0,2,0,0,0,0|1,0,0]=3 870 B12R1.1703 N=C(NO)C1=CC=C(Br)C=C1F CS-0045382 [0,2,0,0,0,0|2,0,0]=4 871 B12R1.1703 NNC(=O)C1=C(O)C=C(Cl)C=C1 CS-0250297 [0,2,0,0,0,0|2,0,0]=4 872 B12R1.1703 NNC(=O)C1=CC=C(F)C=C1Br CS-0458753 [0,2,0,0,0,0|2,0,0]=4 873 B12R1.1703 NNC(=O)C1=CN=C(O)C=C1O CS-0366526 [0,2,0,0,0,0|2,0,0]=4 874 B12R1.1703 N\C(=N/O)C1=CC=C(F)C=C1Cl CS-0261259 [0,2,0,0,0,0|2,0,0]=4 875 B12R1.1703 N\C(=N/O)C1=CC=C(O)C=C1Cl CS-0261368 [0,2,0,0,0,0|1,0,0]=3 876 B12R1.1703 O=C(CCl)C1=CC=C(Cl)C=C1F CS-0059807 [0,2,0,0,0,0|2,0,0]=4 877 B12R1.1703 O=C(CO)C1=CC=C(Cl)C=C1Cl CS-0328828 [0,2,0,0,0,0|1,0,0]=3 878 B12R1.57 CC(=O)C1=CC=C(C)C=C1C=O CS-0866345 [0,2,0,0,0,0|2,0,0]=4 879 B12R1.57 CC(=O)C1=CC=C(F)C=C1C=O CS-0866760 [0,2,0,0,0,0|2,0,0]=4 880 B12R1.57 CC1=CC=C(C(=O)O)C(C#N)=C1 CS-0374705 [0,2,0,0,0,0|1,0,0]=3 881 B12R1.57 CCC1=CC(F)=CC=C1C(=O)O CS-0236011 [0,2,0,0,0,0|1,0,0]=3 882 B12R1.57 CCC1=CC(N)=CC=C1C(=O)O CS-0160910 [0,2,0,0,0,0|1,0,0]=3 883 B12R1.57 CNC1=C(C(=O)O)C=CC(F)=C1 CS-0301375 [0,2,0,0,0,0|1,0,0]=3 884 B12R1.57 CNC1=CC(Br)=CC=C1C(N)=O CS-0622931 [0,2,0,0,0,0|2,0,0]=4 885 B12R1.57 COC1=CC(Br)=NC=C1C(=O)O CS-0367422 [0,2,0,0,0,0|2,0,0]=4 886 B12R1.57 COC1=CC(Cl)=CN=C1C(=O)O CS-0050528 [0,2,0,0,0,0|2,0,0]=4 887 B12R1.57 COC1=CC(N)=CC=C1C(N)=O CS-0107344 [0,2,0,0,0,0|2,0,0]=4 888 B12R1.57 COC1=CC(O)=CC=C1B(O)O CS-0045031 [0,2,0,0,0,0|1,0,1]=4 889 B12R1.57 CSC1=CC(N)=CC=C1C(=O)O CS-0225916 [0,2,0,0,0,0|1,0,0]=3 890 B12R1.57 NCC1=CC(F)=CC=C1C(=O)O CS-1099411 [0,2,0,0,0,0|1,0,0]=3 891 B12R1.57 NNC1=C(C(=O)O)C=CC(F)=C1 CS-0869853 [0,2,0,0,0,0|1,0,0]=3 892 B12R1.57 O=C(O)C1=CN=C(Cl)C=C1CO CS-0778410 [0,2,0,0,0,0|2,0,0]=4 893 B12R1.1000 CC(=O)C1=C(C)C=C(Br)C=C1F CS-0618886 [0,2,0,0,0,0|2,0,0]=4 894 B12R1.1000 CC(=O)C1=C(C)C=C(N)C=C1C CS-0247672 [0,2,0,0,0,0|2,0,0]=4 895 B12R1.1000 CC(=O)C1=C(C)C=C(O)C=C1C CS-0247397 [0,2,0,0,0,0|1,0,0]=3 896 B12R1.1000 CC(=O)C1=C(F)C=C(Cl)C=C1F CS-W015865 [0,2,0,0,0,0|2,0,0]=4 897 B12R1.1000 CC(=O)C1=C(O)C=C(Br)C=C1C CS-0654860 [0,2,0,0,0,0|2,0,0]=4 898 B12R1.1000 CC1=CC(Br)=C(C(=O)O)C(Br)=C1 CS-0196048 [0,2,0,0,0,0|1,0,0]=3 899 B12R1.1000 CC1=CC(C)=C(C(=O)O)C(F)=C1 CS-0446423 [0,2,0,0,0,0|1,0,0]=3 900 B12R1.1000 CC1=CC(C)=C(C(=O)[O-])C(C)=C1 CS-0621686 [0,2,0,0,0,0|1,0,1]=4 901 B12R1.1000 CC1=CC(C)=C(S(=O)O)C(C)=C1 CS-0205191 [0,2,0,0,0,0|2,0,0]=4 902 B12R1.1000 CC1=CC(F)=C(C(=O)O)C(Cl)=C1 CS-0197866 [0,2,0,0,0,0|1,0,0]=3 903 B12R1.1000 CC1=NC(Cl)=CC(C)=C1C(=O)O CS-0319678 [0,2,0,0,0,0|2,0,0]=4 904 B12R1.1000 NC(=O)C1=C(Br)C=C(Br)C=C1F CS-0195105 [0,2,0,0,0,0|2,0,0]=4 905 B12R1.1000 NC1=CC(F)=C(C(=O)O)C(F)=C1 CS-0217879 [0,2,0,0,0,0|1,0,0]=3 906 B12R1.1000 O=C(O)C1=C(Cl)C=C(F)C=C1Br CS-0515474 [0,2,0,0,0,0|1,0,0]=3 907 B12R2.606 CC1=CC=C2N=C(C)OC2=C1 CS-0511358 [0,0,0,1,0,1|2,0,0]=4 908 B12R2.606 CC1=NC2=C(C=CC(O)=C2)S1 CS-0071360 [0,0,0,1,0,1|2,0,0]=4 909 B12R2.606 ClC1=CC=C2N=C(Br)OC2=C1 CS-0338262 [0,0,0,1,0,1|2,0,0]=4 910 B12R2.606 NC1=CC2=C(C=C1)CC(=O)C2 CS-0696189 [0,0,0,1,0,1|2,0,0]=4 911 B12R2.606 NC1=CC=C2N=C(N)OC2=C1 CS-0513526 [0,0,0,1,0,1|2,0,0]=4 912 B12R2.606 NC1=NC2=C(C=C(O)C=C2)S1 CS-0661175 [0,0,0,1,0,1|1,1,0]=4 913 B12R2.606 O=C1CC2=C(C=C(F)C=C2)C1 CS-0616340 [0,0,0,1,0,1|2,0,0]=4 914 B12R2.606 O=C1CC2=CC(O)=CN=C2N1 CS-0050462 [0,0,0,1,0,1|2,0,0]=4 915 B12R2.606 O=C1NC2=CC(F)=CC=C2S1 CS-0112391 [0,0,0,1,0,1|2,0,0]=4 916 B12R2.606 O=C1NC2=CC(O)=CC=C2O1 CS-0616825 [0,0,0,1,0,1|1,0,0]=3 917 B12R2.606 O=C1NC2=CC=C(I)C=C2N1 CS-0608251 [0,0,0,1,0,1|2,0,0]=4 918 B12R2.606 O=C1OC2=C(C=C(Br)C=C2)O1 CS-0217684 [0,0,0,1,0,1|1,0,0]=3 919 B12R2.612 CC1=CC=C2C(=O)NSC2=C1 CS-0965115 [0,1,0,1,0,0|1,1,0]=4 920 B12R2.612 CC1=COC2=CC(Cl)=CC=C12 CS-0517312 [0,1,0,1,0,0|2,0,0]=4 921 B12R2.612 CC1=NOC2=C1C=CC(Cl)=C2 CS-0454667 [0,1,0,1,0,0|2,0,0]=4 922 B12R2.612 NC1=CC2=C(C=C1)C(=O)NC2 CS-D1571 [0,1,0,1,0,0|2,0,0]=4 923 B12R2.612 NC1=NNC2=C1C=CC(O)=C2 CS-0239933 [0,1,0,1,0,0|2,0,0]=4 924 B12R2.612 O=C1COC2=NC(Cl)=CC=C12 CS-0903756 [0,1,0,1,0,0|2,0,0]=4 925 B12R2.612 O=C1OCC2=CC(Br)=CN=C12 CS-0864624 [0,1,0,1,0,0|2,0,0]=4 926 B12R2.612 O=C1OCC2=NC(Cl)=CC=C12 CS-0892695 [0,1,0,1,0,0|2,0,0]=4 927 B12R2.612 O=C1ONC2=CC(Cl)=CC=C12 CS-0963668 [0,1,0,1,0,0|1,0,0]=3 928 B12R2.612 OC1=CC2=C(C=C1)C(O)CO2 CS-0221831 [0,1,0,1,0,0|0,0,2]=4 929 B8R1.1 O=CC1=CC=C(Cl)N1 CS-0448463 [1,0,0,0,1,0|2,0,0]=4 930 B8R1.1 O=CC1=CC=C(F)S1 CS-0054969 [1,0,0,0,1,0|2,0,0]=4 931 B8R1.7 CC(=O)C1=COC=C1 CS-0005260 [1,0,0,0,1,0|2,0,0]=4 932 B10R1.18 NC(=O)C[N+]1=CC=CC=C1 CS-0156736 [1,0,0,0,0,1|2,0,0]=4 933 B12R1.21 CC(=O)C#CC1=CC=C(Cl)C=C1 CS-0530793 [0,0,0,0,0,2|2,0,0]=4 934 B12R1.21 CC(=O)NCC1=CC=C(F)C=C1 CS-0326241 [0,0,0,0,0,2|2,0,0]=4 935 B12R1.21 CC(=O)NCC1=CC=C(O)C=C1 CS-0663147 [0,0,0,0,0,2|1,0,0]=3 936 B12R1.21 CC(=O)\C=C\C1=CC=C(F)C=C1 CS-0513230 [0,0,0,0,0,2|2,0,0]=4 937 B12R1.21 CC1=CC=C(CCC(=O)O)C=N1 CS-0037502 [0,0,0,0,0,2|2,0,0]=4 938 B12R1.21 CC1=CC=C(CCC(=O)O)N=C1 CS-0038739 [0,0,0,0,0,2|2,0,0]=4 939 B12R1.21 C[C@@H](O)CCC1=CC=C(O)C=C1 CS-0016082 [0,0,0,0,0,2|1,0,1]=4 940 B12R1.21 NC(=O)C#CC1=CC=C(Cl)C=C1 CS-0435675 [0,0,0,0,0,2|2,0,0]=4 941 B12R1.21 NC(=O)CCC1=CC=C(N)C=C1 CS-0096223 [0,0,0,0,0,2|2,0,0]=4 942 B12R1.21 NC(=O)CSC1=CC=C(Br)C=C1 CS-0358355 [0,0,0,0,0,2|2,0,0]=4 943 B12R1.21 NC(=O)NCC1=CC=C(F)C=C1 CS-0207460 [0,0,0,0,0,2|2,0,0]=4 944 B12R1.21 NC(=O)NCC1=CC=C(N)C=C1 CS-0172695 [0,0,0,0,0,2|2,0,0]=4 945 B12R1.21 NC(=O)\C=C\C1=CC=C(Br)C=C1 CS-0911831 [0,0,0,0,0,2|2,0,0]=4 946 B12R1.21 NC(=O)\C=C\C1=CC=C(O)C=C1 CS-0017859 [0,0,0,0,0,2|1,0,0]=3 947 B12R1.21 NC1=CC=C(OCC(=O)O)C=C1 CS-0873992 [0,0,0,0,0,2|1,0,0]=3 948 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=C1 CS-0016851 [0,0,0,0,0,2|1,0,0]=3 949 B12R1.21 O=C(O)CCC1=CC=C(Cl)N=C1 CS-0470799 [0,0,0,0,0,2|2,0,0]=4 950 B12R1.21 O=C(O)CCC1=CC=C(O)N=N1 CS-0071513 [0,0,0,0,0,2|2,0,0]=4 951 B12R1.21 O=C(O)CCC1=CC=C(S)C=C1 CS-W017100 [0,0,0,0,0,2|0,1,0]=3 952 B12R1.21 O=C(O)CCC1=CN=C(Br)C=C1 CS-0684670 [0,0,0,0,0,2|2,0,0]=4 953 B12R1.21 O=C(O)CNC1=CC=C(Cl)C=C1 CS-0170992 [0,0,0,0,0,2|1,0,0]=3 954 B12R1.21 O=C(O)CSC1=CC=C(O)C=C1 CS-0308042 [0,0,0,0,0,2|0,0,0]=2 955 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 CS-0062425 [0,0,0,0,0,2|1,0,0]=3 956 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 CS-0076947 [0,0,0,0,0,2|1,0,0]=3 957 B12R1.21 O=C(O)\C=C\C1=CC=C(F)C=C1 CS-0077011 [0,0,0,0,0,2|1,0,0]=3 958 B12R1.21 O=[N+]([O-])\C=C\C1=CC=C(O)C=C1 CS-0784846 [0,0,0,0,0,2|1,0,1]=4