0 B10R1.13 C=C(C)C1=CC=C(I)C=C1 AC1339 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 AC7918 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.13 CC(=O)C1=CN=C(O)N=C1 F13147 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.13 CC(=O)C1=NC=C(Br)C=N1 38376 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.13 CC(=O)C1=NC=C(C)C=N1 79366 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.13 CC(=O)C1=NC=C(C)N=C1 56571 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.13 CC(=O)C1=NC=C(N)C=C1 D94999 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.13 CC(=O)C1=NC=C(O)C=C1 53717 [0,0,0,0,0,0|2,0,0]=2 8 B10R1.13 CC(=O)C1=NC=C(O)N=C1 C71512 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.13 CC(=O)C1=NN=C(Cl)C=C1 P10979 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.13 CC(C)C1=CC=C(O)C=C1 D72532 [0,0,0,0,0,0|2,0,1]=3 11 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 20068 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 Y14023 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.13 CC1=CC=C([C@H](C)O)C=C1 W19044 [0,0,0,0,0,0|2,0,1]=3 14 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 97006 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 A11173 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 T73083 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.13 CC1=CCC(C(=O)O)=CC1 A12608 [0,0,0,0,0,0|1,0,2]=3 18 B10R1.13 CC1=CN=C(C(=O)O)N=C1 RB3298 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.13 CC1=CN=C([C@H](C)O)C=C1 AB7629 [0,0,0,0,0,0|3,0,1]=4 20 B10R1.13 CN(N)C1=CC=C(Br)C=C1 E10129 [0,0,0,0,0,0|4,0,0]=4 21 B10R1.13 C[C@H](Cl)C1=CC=C(F)C=C1 AC6174 [0,0,0,0,0,0|3,0,1]=4 22 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 C16655 [0,0,0,0,0,0|3,0,1]=4 23 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 Y10310 [0,0,0,0,0,0|3,0,1]=4 24 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 Y10311 [0,0,0,0,0,0|3,0,1]=4 25 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 20069 [0,0,0,0,0,0|3,0,1]=4 26 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 20071 [0,0,0,0,0,0|3,0,1]=4 27 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 O11060 [0,0,0,0,0,0|3,0,1]=4 28 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 Y11752 [0,0,0,0,0,0|3,0,1]=4 29 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 Y11753 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 Y10879 [0,0,0,0,0,0|2,0,1]=3 31 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 Y14795 [0,0,0,0,0,0|2,0,1]=3 32 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 SC1272 [0,0,0,0,0,0|2,0,1]=3 33 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 SC1278 [0,0,0,0,0,0|2,0,1]=3 34 B10R1.13 C[C@H](O)C1=CC=C(O)C=C1 25877 [0,0,0,0,0,0|1,0,1]=2 35 B10R1.13 C[C@H](O)C1=CN=C(Br)C=C1 AT11876 [0,0,0,0,0,0|3,0,1]=4 36 B10R1.13 C[C@H](O)C1=NC=C(Br)C=C1 Y13723 [0,0,0,0,0,0|3,0,1]=4 37 B10R1.13 C[C@H](O)C1=NC=C(O)C=N1 W17842 [0,0,0,0,0,0|3,0,1]=4 38 B10R1.13 FC(F)C1=CC=C(I)C=C1 C71790 [0,0,0,0,0,0|3,0,1]=4 39 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 W16706 [0,0,0,0,0,0|3,0,0]=3 40 B10R1.13 N=C(N)C1=CC=C(N)C=C1 56135 [0,0,0,0,0,0|3,0,0]=3 41 B10R1.13 N=C(N)C1=NC=C(Cl)C=C1 37719 [0,0,0,0,0,0|4,0,0]=4 42 B10R1.13 N=C(N)C1=NC=C(F)C=C1 38084 [0,0,0,0,0,0|4,0,0]=4 43 B10R1.13 NC(=O)C1=CN=C(O)C=C1 C74893 [0,0,0,0,0,0|2,0,0]=2 44 B10R1.13 NC(=O)C1=CN=C(O)N=C1 F13438 [0,0,0,0,0,0|3,0,0]=3 45 B10R1.13 NC(=O)C1=NC=C(N)C=C1 25630 [0,0,0,0,0,0|3,0,0]=3 46 B10R1.13 NC(=O)C1=NC=C(N)C=N1 30495 [0,0,0,0,0,0|4,0,0]=4 47 B10R1.13 NC(=O)C1=NC=C(N)N=C1 W17933 [0,0,0,0,0,0|4,0,0]=4 48 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 A11465 [0,0,0,0,0,0|1,0,1]=2 49 B10R1.13 NC1=CN=C(C(=O)O)N=C1 P10377 [0,0,0,0,0,0|3,0,0]=3 50 B10R1.13 NC1=CN=C([N+](=O)[O-])C=C1 26771 [0,0,0,0,0,0|3,0,1]=4 51 B10R1.13 O=C(O)C1=CN=C(Br)N=C1 F11671 [0,0,0,0,0,0|3,0,0]=3 52 B10R1.13 O=C(O)C1=CN=C(F)C=N1 70428 [0,0,0,0,0,0|3,0,0]=3 53 B10R1.13 O=C(O)C1=NC=C(F)C=N1 38641 [0,0,0,0,0,0|3,0,0]=3 54 B10R1.13 O=C(O)C1=NC=C(I)C=C1 O11456 [0,0,0,0,0,0|2,0,0]=2 55 B10R1.13 O=C(O)C1=NN=C(Br)C=C1 P10335 [0,0,0,0,0,0|3,0,0]=3 56 B10R1.13 O=C(O)C1=NN=C(O)C=C1 C73877 [0,0,0,0,0,0|2,0,0]=2 57 B10R1.13 O=C1N=CC(C(=O)O)=CN1 P13001 [0,0,0,0,0,0|2,0,1]=3 58 B10R1.13 O=[N+]([O-])C1=CN=C(I)C=C1 T72219 [0,0,0,0,0,0|3,0,1]=4 59 B10R1.13 OB(O)C1=NC=C(Br)C=C1 57235 [0,0,0,0,0,0|3,0,1]=4 60 B10R1.13 OB(O)C1=NC=C(F)C=C1 F16224 [0,0,0,0,0,0|3,0,1]=4 61 B10R1.13 OC1=CN=C(C(F)F)C=C1 D92853 [0,0,0,0,0,0|3,0,1]=4 62 B9R1.1 C#CC1=CC=C(I)C=C1 F21257 [1,0,0,0,0,0|2,0,1]=4 63 B9R1.1 C#CC1=CN=C(O)C=C1 O11429 [1,0,0,0,0,0|2,0,1]=4 64 B9R1.1 C=CC1=CN=C(Cl)C=C1 F13416 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.1 C=CC1=NC=C(Cl)C=C1 P17531 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.1 CC1=CN=C(C=O)C=N1 36020 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.1 CCC1=CN=C(O)C=C1 25325 [1,0,0,0,0,0|2,0,1]=4 68 B9R1.1 CNC1=CC=C(O)C=C1 D77985 [1,0,0,0,0,0|2,0,0]=3 69 B9R1.1 C[N+]1=CC=C(C=O)C=C1 D95156 [1,0,0,0,0,0|2,0,0]=3 70 B9R1.1 ClCC1=CC=C(I)C=C1 AB8901 [1,0,0,0,0,0|2,0,1]=4 71 B9R1.1 FCC1=CC=C(Br)C=C1 W10394 [1,0,0,0,0,0|2,0,1]=4 72 B9R1.1 N#CC1=CC=C(S)C=C1 F31167 [1,0,0,0,0,0|1,1,1]=4 73 B9R1.1 N#CC1=NC=C(O)C=C1 24955 [1,0,0,0,0,0|2,0,1]=4 74 B9R1.1 NC1=CN=C(C=O)C=C1 D77164 [1,0,0,0,0,0|2,0,0]=3 75 B9R1.1 NC1=CN=C(C=O)C=N1 F31178 [1,0,0,0,0,0|3,0,0]=4 76 B9R1.1 NCC1=CC=C(O)C=C1 AC1832 [1,0,0,0,0,0|1,0,1]=3 77 B9R1.1 NCC1=NC=C(O)C=C1 24338 [1,0,0,0,0,0|2,0,1]=4 78 B9R1.1 O=CC1=CN=C(O)N=C1 86751 [1,0,0,0,0,0|2,0,0]=3 79 B9R1.1 O=CC1=NC=C(Cl)C=N1 P10946 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.1 O=CC1=NN=C(Br)C=C1 P20764 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.1 O=CC1=NN=C(Cl)C=C1 25514 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.1 O=CC1=NN=C(O)C=C1 C77199 [1,0,0,0,0,0|2,0,0]=3 83 B9R1.1 OCC1=CC=C(S)C=C1 Y11017 [1,0,0,0,0,0|0,1,1]=3 84 B9R1.6 C=C(C)C1=NC=CC=C1 W17791 [1,0,0,0,0,0|3,0,0]=4 85 B9R1.6 CC(=O)C1=NN=CC=C1 37064 [1,0,0,0,0,0|3,0,0]=4 86 B9R1.6 C[C@H](N)C1=CC=CC=C1 D77753 [1,0,0,0,0,0|2,0,1]=4 87 B9R1.6 C[C@H](O)C1=NC=CC=C1 A11519 [1,0,0,0,0,0|2,0,1]=4 88 B9R1.6 C[C@H](O)C1=NC=CC=C1 C16040 [1,0,0,0,0,0|2,0,1]=4 89 B9R1.6 C[S@](=O)C1=NC=CC=C1 C74099 [1,0,0,0,0,0|3,0,0]=4 90 B9R1.6 N=C(N)C1=NC=CC=C1 71518 [1,0,0,0,0,0|3,0,0]=4 91 B9R1.6 NC(=O)C1=CN=CN=C1 F13864 [1,0,0,0,0,0|3,0,0]=4 92 B9R1.6 NC(=O)C1=CN=NC=C1 F14288 [1,0,0,0,0,0|3,0,0]=4 93 B9R1.6 NC(=O)C1=NC=NC=C1 C74468 [1,0,0,0,0,0|3,0,0]=4 94 B9R1.6 NC(=O)C1=NN=CC=C1 F30255 [1,0,0,0,0,0|3,0,0]=4 95 B9R1.6 O=C(Cl)C1=NN=CC=C1 D93513 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.6 O=C([O-])C1=NC=CC=N1 65419 [1,0,0,0,0,0|2,0,1]=4 97 B9R1.6 O=[S@]([O-])C1=NC=CC=C1 AT11818 [1,0,0,0,0,0|2,0,1]=4 98 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 A50667 [0,1,0,0,0,0|2,0,0]=3 99 B11R1.3 C#CC1=NC=C(C(=O)O)C=C1 P18107 [0,1,0,0,0,0|2,0,0]=3 100 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 AC1342 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 CL9316 [0,1,0,0,0,0|1,0,0]=2 102 B11R1.3 CC(=O)C1=NC=C(C#N)C=C1 W17133 [0,1,0,0,0,0|3,0,0]=4 103 B11R1.3 CCC1=CN=C(C(=O)O)C=C1 S10908 [0,1,0,0,0,0|2,0,0]=3 104 B11R1.3 CCC1=NC=C(C(=O)O)C=C1 W10833 [0,1,0,0,0,0|2,0,0]=3 105 B11R1.3 CCC1=NC=C(C(=O)O)C=N1 69207 [0,1,0,0,0,0|3,0,0]=4 106 B11R1.3 CCC1=NC=C(C(=O)O)C=N1 C80031 [0,1,0,0,0,0|3,0,0]=4 107 B11R1.3 CNC1=NC=C(C(=O)O)C=N1 H10198 [0,1,0,0,0,0|3,0,0]=4 108 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 C72879 [0,1,0,0,0,0|1,0,1]=3 109 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 C72977 [0,1,0,0,0,0|1,0,1]=3 110 B11R1.3 COC1=CN=C(C(=N)N)C=C1 66227 [0,1,0,0,0,0|3,0,0]=4 111 B11R1.3 COC1=CN=C(C(=O)O)N=C1 72368 [0,1,0,0,0,0|2,0,0]=3 112 B11R1.3 COC1=CN=C(C(C)=O)C=N1 S10058 [0,1,0,0,0,0|3,0,0]=4 113 B11R1.3 COC1=CN=C(C(C)=O)N=C1 97279 [0,1,0,0,0,0|3,0,0]=4 114 B11R1.3 COC1=NC=C(C(C)=O)C=N1 C71224 [0,1,0,0,0,0|3,0,0]=4 115 B11R1.3 COC1=NN=C(C(=O)O)C=C1 P10767 [0,1,0,0,0,0|2,0,0]=3 116 B11R1.3 C[C@H](N)C1=CC=C(CO)C=C1 33613 [0,1,0,0,0,0|2,0,1]=4 117 B11R1.3 C[C@H](N)C1=CC=C(CO)C=C1 33618 [0,1,0,0,0,0|2,0,1]=4 118 B11R1.3 C[C@H](N)C1=CC=C(CO)C=C1 33808 [0,1,0,0,0,0|2,0,1]=4 119 B11R1.3 C[C@H](O)C1=CC=C(C#N)C=C1 C13986 [0,1,0,0,0,0|2,0,1]=4 120 B11R1.3 C[S@](=O)C1=CC=C(C#N)C=C1 W16291 [0,1,0,0,0,0|3,0,0]=4 121 B11R1.3 C[S@](=O)C1=CC=C(CN)C=C1 AR2414 [0,1,0,0,0,0|3,0,0]=4 122 B11R1.3 N#CC1=CN=C(C(=O)O)C=N1 O11418 [0,1,0,0,0,0|3,0,0]=4 123 B11R1.3 N#CC1=CN=C(C(=O)O)N=C1 55103 [0,1,0,0,0,0|3,0,0]=4 124 B11R1.3 N#CC1=NC=C(C(=O)O)C=N1 38471 [0,1,0,0,0,0|3,0,0]=4 125 B11R1.3 N=C(N)C1=CC=C(C=O)C=C1 F58592 [0,1,0,0,0,0|2,0,1]=4 126 B11R1.3 NC(=O)C1=CC=C(CO)C=C1 D82598 [0,1,0,0,0,0|1,0,0]=2 127 B11R1.3 NC(=O)C1=NC=C(CO)N=C1 A10669 [0,1,0,0,0,0|3,0,0]=4 128 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 W15750 [0,1,0,0,0,0|2,0,0]=3 129 B11R1.3 NCC1=CN=C(C(=O)O)C=C1 N14194 [0,1,0,0,0,0|2,0,0]=3 130 B11R1.3 NCC1=NC=C(C(=O)O)C=C1 51960 [0,1,0,0,0,0|2,0,0]=3 131 B11R1.3 NNC1=CC=C(C(N)=O)C=C1 11076 [0,1,0,0,0,0|2,0,0]=3 132 B11R1.3 NNC1=CC=C([N+](=O)[O-])C=C1 73838 [0,1,0,0,0,0|2,0,1]=4 133 B11R1.3 NOC1=CC=C([N+](=O)[O-])C=C1 O12033 [0,1,0,0,0,0|1,0,1]=3 134 B11R1.3 O=C(O)C1=CN=C(CO)C=C1 P18087 [0,1,0,0,0,0|1,0,0]=2 135 B11R1.3 O=C(O)C1=NC=C(CO)C=C1 C75020 [0,1,0,0,0,0|1,0,0]=2 136 B11R1.3 OCC1=NC=C(B(O)O)C=C1 FD10242 [0,1,0,0,0,0|2,0,1]=4 137 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 20480 [0,1,0,0,0,0|2,0,0]=3 138 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 55666 [0,1,0,0,0,0|2,0,0]=3 139 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 63204 [0,1,0,0,0,0|2,0,0]=3 140 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 87616 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 91259 [0,1,0,0,0,0|2,0,0]=3 142 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 C73216 [0,1,0,0,0,0|2,0,0]=3 143 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS3396 [0,1,0,0,0,0|2,0,0]=3 144 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS3405 [0,1,0,0,0,0|2,0,0]=3 145 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 D83842 [0,1,0,0,0,0|2,0,0]=3 146 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 F51928 [0,1,0,0,0,0|2,0,0]=3 147 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 H11175 [0,1,0,0,0,0|2,0,0]=3 148 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 P18527 [0,1,0,0,0,0|2,0,0]=3 149 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 S11121 [0,1,0,0,0,0|2,0,0]=3 150 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W10985 [0,1,0,0,0,0|2,0,0]=3 151 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W13813 [0,1,0,0,0,0|2,0,0]=3 152 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W13814 [0,1,0,0,0,0|2,0,0]=3 153 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W13829 [0,1,0,0,0,0|2,0,0]=3 154 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 38109 [0,1,0,0,0,0|2,0,1]=4 155 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 D70941 [0,1,0,0,0,0|2,0,1]=4 156 B11R1.19 CP(C)(=O)C1=CC=C(N)C=C1 C75280 [0,1,0,0,0,0|3,0,0]=4 157 B11R1.19 CS(=O)(=O)C1=CC=C(I)C=C1 AC6545 [0,1,0,0,0,0|2,0,1]=4 158 B11R1.19 CS(=O)(=O)C1=NC=C(O)C=C1 F51251 [0,1,0,0,0,0|2,0,1]=4 159 B11R1.19 C[S@](=N)(=O)C1=CC=C(Br)C=C1 W10955 [0,1,0,0,0,0|3,0,0]=4 160 B11R1.19 NC1=CC=C(S(=O)(=O)F)C=C1 D72000 [0,1,0,0,0,0|2,0,1]=4 161 B11R1.19 NC1=CC=C(S(N)(=O)=O)C=C1 I12019 [0,1,0,0,0,0|2,0,1]=4 162 B11R1.19 O=P(O)(O)C1=CC=C(O)C=C1 T72323 [0,1,0,0,0,0|1,0,0]=2 163 B11R1.19 O=S(=O)(Cl)C1=CC=C(O)C=C1 F21306 [0,1,0,0,0,0|1,0,1]=3 164 B11R1.19 O=S(=O)(O)C1=CC=C(S)C=C1 FD13126 [0,1,0,0,0,0|1,1,0]=3 165 B11R1.19 OC1=CC=C([B-](F)(F)F)C=C1 65325 [0,1,0,0,0,0|3,0,0]=4 166 B11R1.21 CC(=O)C1=CC(=O)N(C)C=C1 90625 [0,1,0,0,0,0|3,0,0]=4 167 B11R1.21 CC(=O)C1=CC(Br)=C(I)C=C1 C77271 [0,1,0,0,0,0|2,0,0]=3 168 B11R1.21 CC(=O)C1=CC(C)=C(Br)C=N1 F53231 [0,1,0,0,0,0|3,0,0]=4 169 B11R1.21 CC(=O)C1=CC(Cl)=C(N)C=C1 20733 [0,1,0,0,0,0|2,0,0]=3 170 B11R1.21 CC(=O)C1=CC(Cl)=C(O)C=C1 C15500 [0,1,0,0,0,0|1,0,0]=2 171 B11R1.21 CC(=O)C1=CC(I)=C(N)C=C1 21187 [0,1,0,0,0,0|2,0,0]=3 172 B11R1.21 CC(=O)C1=CC(N)=C(C)C=C1 C73283 [0,1,0,0,0,0|2,0,0]=3 173 B11R1.21 CC(=O)C1=CC(N)=C(F)C=C1 FD17092 [0,1,0,0,0,0|2,0,0]=3 174 B11R1.21 CC(=O)C1=CC(N)=C(N)C=C1 D70632 [0,1,0,0,0,0|2,0,0]=3 175 B11R1.21 CC(=O)C1=CC(N)=C(O)C=C1 T71038 [0,1,0,0,0,0|1,0,0]=2 176 B11R1.21 CC(=O)C1=CC(O)=C(Br)C=C1 AB10068 [0,1,0,0,0,0|2,0,0]=3 177 B11R1.21 CC(=O)C1=CN(C)C(=O)C=C1 90627 [0,1,0,0,0,0|2,0,1]=4 178 B11R1.21 CC(=O)C1=CN=C(C)C(C)=C1 D93974 [0,1,0,0,0,0|3,0,0]=4 179 B11R1.21 CC(=O)C1=CN=C(Cl)C(C)=C1 C72016 [0,1,0,0,0,0|3,0,0]=4 180 B11R1.21 CC(=O)C1=CN=C(N)C(C)=C1 D80389 [0,1,0,0,0,0|3,0,0]=4 181 B11R1.21 CC1=C(Br)C=C(C(=O)O)N=C1 C71660 [0,1,0,0,0,0|2,0,0]=3 182 B11R1.21 CC1=C(Br)C=CC(B(O)O)=C1 C74119 [0,1,0,0,0,0|2,0,1]=4 183 B11R1.21 CC1=C(C)N=C(C(=O)O)C=C1 C76662 [0,1,0,0,0,0|2,0,0]=3 184 B11R1.21 CC1=C(Cl)C=C(C(=O)O)N=C1 O11218 [0,1,0,0,0,0|2,0,0]=3 185 B11R1.21 CC1=C(Cl)C=CC([C@H](C)O)=C1 W19076 [0,1,0,0,0,0|2,0,1]=4 186 B11R1.21 CC1=C(F)C=C(C(=O)O)C=N1 C10557 [0,1,0,0,0,0|2,0,0]=3 187 B11R1.21 CC1=C(F)C=CC(C(N)=O)=C1 A51175 [0,1,0,0,0,0|2,0,0]=3 188 B11R1.21 CC1=C(O)C=C(B(O)O)C=C1 F16733 [0,1,0,0,0,0|2,0,1]=4 189 B11R1.21 CC1=C(O)C=CC(B(O)O)=C1 W17226 [0,1,0,0,0,0|1,0,1]=3 190 B11R1.21 CC1=C(O)C=CC(C(C)C)=C1 F14410 [0,1,0,0,0,0|2,0,1]=4 191 B11R1.21 CC1=C(O)C=CC([N+](=O)[O-])=N1 AC1635 [0,1,0,0,0,0|2,0,1]=4 192 B11R1.21 CC1=C(O)N=C(C(=O)O)C=C1 90209 [0,1,0,0,0,0|2,0,0]=3 193 B11R1.21 CC1=C(S)C=CC([N+](=O)[O-])=C1 N16881 [0,1,0,0,0,0|1,1,1]=4 194 B11R1.21 CC1=CC(C(=O)O)=CN=C1C D86774 [0,1,0,0,0,0|2,0,0]=3 195 B11R1.21 CC1=CC(C(=O)O)=CNC1=O RB1153 [0,1,0,0,0,0|1,0,1]=3 196 B11R1.21 CC1=CC(C(N)=O)=CN=C1C D93908 [0,1,0,0,0,0|3,0,0]=4 197 B11R1.21 CC1=CC=C(C(=O)O)N=C1Br 87755 [0,1,0,0,0,0|2,0,0]=3 198 B11R1.21 CC1=NC(C(=O)O)=CN=C1Cl 57161 [0,1,0,0,0,0|3,0,0]=4 199 B11R1.21 CC1=NC=C(C(=O)O)C=C1N 38876 [0,1,0,0,0,0|2,0,0]=3 200 B11R1.21 CN1C=C(C(N)=O)C=CC1=O C76234 [0,1,0,0,0,0|2,0,1]=4 201 B11R1.21 CN1C=CC(C(N)=O)=CC1=O P10284 [0,1,0,0,0,0|3,0,0]=4 202 B11R1.21 N=C(N)C1=CC(Br)=C(F)C=C1 BL001616 [0,1,0,0,0,0|3,0,0]=4 203 B11R1.21 N=C(N)C1=CC(Cl)=C(Cl)C=C1 A12573 [0,1,0,0,0,0|3,0,0]=4 204 B11R1.21 N=C(N)C1=CC(F)=C(F)C=C1 F21414 [0,1,0,0,0,0|3,0,0]=4 205 B11R1.21 N=C(N)C1=CC(N)=C(N)C=C1 25512 [0,1,0,0,0,0|3,0,0]=4 206 B11R1.21 N=C(N)C1=CC(N)=C(N)C=C1 P20972 [0,1,0,0,0,0|3,0,0]=4 207 B11R1.21 NC(=O)C1=CC(F)=C(F)C=C1 D73480 [0,1,0,0,0,0|2,0,0]=3 208 B11R1.21 NC(=O)C1=CC(O)=C(Br)C=C1 AC7242 [0,1,0,0,0,0|2,0,0]=3 209 B11R1.21 NC(=O)C1=CC(O)=C(N)C=C1 Y11587 [0,1,0,0,0,0|2,0,0]=3 210 B11R1.21 NC(=O)C1=CC=C(F)C(Br)=N1 D79819 [0,1,0,0,0,0|3,0,0]=4 211 B11R1.21 NC(=O)C1=CN=C(Br)C(Cl)=C1 W18383 [0,1,0,0,0,0|3,0,0]=4 212 B11R1.21 NC1=C(Br)C=NC(C(=O)O)=C1 P12943 [0,1,0,0,0,0|2,0,0]=3 213 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=N1 D83582 [0,1,0,0,0,0|2,0,0]=3 214 B11R1.21 NC1=C(F)C=C(B(O)O)C=C1 D86713 [0,1,0,0,0,0|2,0,1]=4 215 B11R1.21 NC1=C(I)C=CC(C(=O)O)=C1 S10893 [0,1,0,0,0,0|1,0,0]=2 216 B11R1.21 NC1=C(S)C=C([N+](=O)[O-])C=C1 S11317 [0,1,0,0,0,0|2,0,1]=4 217 B11R1.21 NC1=CC(C(=O)O)=CN=C1N C74383 [0,1,0,0,0,0|2,0,0]=3 218 B11R1.21 NC1=NC=C(C(=O)O)N=C1Br 37237 [0,1,0,0,0,0|3,0,0]=4 219 B11R1.21 O=C(O)C1=CC(=O)C(O)=CN1 F31188 [0,1,0,0,0,0|1,0,0]=2 220 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=N1 A51162 [0,1,0,0,0,0|2,0,0]=3 221 B11R1.21 O=C(O)C1=CC(Cl)=C(O)C=N1 P19208 [0,1,0,0,0,0|1,0,0]=2 222 B11R1.21 O=C(O)C1=CC(I)=C(I)C=C1 D84788 [0,1,0,0,0,0|1,0,0]=2 223 B11R1.21 O=C(O)C1=CC(I)=C(O)C=C1 CK2246 [0,1,0,0,0,0|0,0,0]=1 224 B11R1.21 O=C(O)C1=CC=C(Br)C(Br)=N1 22742 [0,1,0,0,0,0|2,0,0]=3 225 B11R1.21 O=C(O)C1=CC=C(Cl)C(Br)=N1 22761 [0,1,0,0,0,0|2,0,0]=3 226 B11R1.21 O=C(O)C1=CN=C(Br)C(F)=C1 31381 [0,1,0,0,0,0|2,0,0]=3 227 B11R1.21 O=C(O)C1=CN=C(Cl)C(Cl)=N1 N13206 [0,1,0,0,0,0|3,0,0]=4 228 B11R1.21 O=C(O)C1=CN=C(Cl)C(F)=C1 24357 [0,1,0,0,0,0|2,0,0]=3 229 B11R1.21 O=C(O)C1=CN=C(F)C(F)=C1 P10667 [0,1,0,0,0,0|2,0,0]=3 230 B11R1.21 O=C(O)C1=CNC(=O)C(O)=C1 AC2078 [0,1,0,0,0,0|1,0,1]=3 231 B11R1.21 O=[N+]([O-])C1=CC(F)=C(O)N=C1 22716 [0,1,0,0,0,0|2,0,1]=4 232 B11R1.21 O=[N+]([O-])C1=CC(I)=C(Br)C=C1 W18337 [0,1,0,0,0,0|2,0,1]=4 233 B11R1.21 OB(O)C1=CC(Br)=C(F)C=C1 C11245 [0,1,0,0,0,0|2,0,1]=4 234 B11R1.22 C#CC(=O)C1=CC=C(F)C=C1 W16135 [0,1,0,0,0,0|2,0,0]=3 235 B11R1.22 C#C[C@@H](O)C1=CC=C(F)C=C1 W16136 [0,1,0,0,0,0|2,0,1]=4 236 B11R1.22 C=CC(=O)C1=CC=C(F)C=C1 AB9399 [0,1,0,0,0,0|2,0,0]=3 237 B11R1.22 CC1=CC=C(C(=O)CCl)C=C1 D93745 [0,1,0,0,0,0|2,0,0]=3 238 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 D81498 [0,1,0,0,0,0|2,0,1]=4 239 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 N10531 [0,1,0,0,0,0|2,0,1]=4 240 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 N11058 [0,1,0,0,0,0|2,0,1]=4 241 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 N11096 [0,1,0,0,0,0|2,0,1]=4 242 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 Y10547 [0,1,0,0,0,0|2,0,1]=4 243 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 Y13360 [0,1,0,0,0,0|2,0,1]=4 244 B11R1.22 CCC(=O)C1=CN=C(Cl)C=C1 F13171 [0,1,0,0,0,0|3,0,0]=4 245 B11R1.22 CCC(=O)C1=NC=C(Br)C=C1 N14256 [0,1,0,0,0,0|3,0,0]=4 246 B11R1.22 CCC(=O)C1=NC=C(Cl)C=C1 D81575 [0,1,0,0,0,0|3,0,0]=4 247 B11R1.22 CC[C@H](N)C1=CC=C(O)C=C1 N12238 [0,1,0,0,0,0|2,0,1]=4 248 B11R1.22 CC[C@H](O)C1=CC=C(Br)C=C1 AB6446 [0,1,0,0,0,0|2,0,1]=4 249 B11R1.22 CNC(=O)C1=CC=C(Cl)C=C1 D83483 [0,1,0,0,0,0|2,0,0]=3 250 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 29238 [0,1,0,0,0,0|2,0,0]=3 251 B11R1.22 COC(=O)C1=CC=C(S)C=C1 W12575 [0,1,0,0,0,0|0,1,0]=2 252 B11R1.22 COC(=O)C1=CNC(=O)N=C1 C75373 [0,1,0,0,0,0|2,0,1]=4 253 B11R1.22 COC(=O)C1=CNC(=O)N=C1 F12628 [0,1,0,0,0,0|2,0,1]=4 254 B11R1.22 COC(=O)C1=NC=C(C)C=N1 37740 [0,1,0,0,0,0|3,0,0]=4 255 B11R1.22 COC(=O)C1=NC=C(Cl)C=N1 72490 [0,1,0,0,0,0|3,0,0]=4 256 B11R1.22 COC(=O)C1=NC=C(F)C=N1 28016 [0,1,0,0,0,0|3,0,0]=4 257 B11R1.22 COC(=O)C1=NC=C(N)C=N1 P13628 [0,1,0,0,0,0|3,0,0]=4 258 B11R1.22 COC(=O)C1=NC=C(O)C=N1 P14075 [0,1,0,0,0,0|2,0,0]=3 259 B11R1.22 COC(=O)C1=NN=C(Br)C=C1 72416 [0,1,0,0,0,0|3,0,0]=4 260 B11R1.22 COC(=O)C1=NN=C(C)C=C1 29806 [0,1,0,0,0,0|3,0,0]=4 261 B11R1.22 COC(=O)C1=NN=C(N)C=C1 30525 [0,1,0,0,0,0|3,0,0]=4 262 B11R1.22 N#CC(=O)C1=CC=C(Br)C=C1 AB1242 [0,1,0,0,0,0|2,0,0]=3 263 B11R1.22 N#C[C@@H](O)C1=CC=C(Br)C=C1 W15228 [0,1,0,0,0,0|2,0,1]=4 264 B11R1.22 NC[C@H](O)C1=CC=C(Cl)C=C1 C78214 [0,1,0,0,0,0|2,0,1]=4 265 B11R1.22 NNC(=O)C1=NC=C(F)C=C1 26252 [0,1,0,0,0,0|3,0,0]=4 266 B11R1.22 NNC(=S)C1=CC=C(Cl)C=C1 W10978 [0,1,0,0,0,0|2,1,0]=4 267 B11R1.22 NNC(=S)C1=CC=C(F)C=C1 W10976 [0,1,0,0,0,0|2,1,0]=4 268 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 D83092 [0,1,0,0,0,0|2,0,1]=4 269 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 I11041 [0,1,0,0,0,0|2,0,1]=4 270 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 I11043 [0,1,0,0,0,0|2,0,1]=4 271 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 I11713 [0,1,0,0,0,0|2,0,1]=4 272 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 Y11114 [0,1,0,0,0,0|2,0,1]=4 273 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 N10527 [0,1,0,0,0,0|2,0,1]=4 274 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 N10528 [0,1,0,0,0,0|2,0,1]=4 275 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 Y10651 [0,1,0,0,0,0|2,0,1]=4 276 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 Y10776 [0,1,0,0,0,0|2,0,1]=4 277 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 F16942 [0,1,0,0,0,0|2,0,1]=4 278 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 I11004 [0,1,0,0,0,0|2,0,1]=4 279 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 I11005 [0,1,0,0,0,0|2,0,1]=4 280 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 I11499 [0,1,0,0,0,0|2,0,1]=4 281 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 Y10343 [0,1,0,0,0,0|2,0,1]=4 282 B11R1.22 N[C@@H](CO)C1=CC=C(I)C=C1 N10665 [0,1,0,0,0,0|2,0,1]=4 283 B11R1.22 N[C@@H](CO)C1=CC=C(I)C=C1 Y12067 [0,1,0,0,0,0|2,0,1]=4 284 B11R1.22 N[C@@H](CO)C1=CC=C(I)C=C1 Y12960 [0,1,0,0,0,0|2,0,1]=4 285 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 Y10690 [0,1,0,0,0,0|1,0,1]=3 286 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 Y10915 [0,1,0,0,0,0|1,0,1]=3 287 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 Y11472 [0,1,0,0,0,0|1,0,1]=3 288 B11R1.22 N\C(=N/O)C1=CC=C(Cl)C=C1 A12574 [0,1,0,0,0,0|2,0,0]=3 289 B11R1.22 N\C(=N/O)C1=CC=C(O)C=C1 60210 [0,1,0,0,0,0|1,0,0]=2 290 B11R1.22 O=C(CBr)C1=CN=C(Br)C=C1 D94486 [0,1,0,0,0,0|3,0,0]=4 291 B11R1.22 O=C(CBr)C1=NC=C(Cl)C=C1 80107 [0,1,0,0,0,0|3,0,0]=4 292 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 77934 [0,1,0,0,0,0|1,0,0]=2 293 B11R1.22 O=C(CCl)C1=CN=C(Cl)C=C1 83967 [0,1,0,0,0,0|3,0,0]=4 294 B11R1.22 O=C(CCl)C1=NC=C(F)C=C1 AC1560 [0,1,0,0,0,0|3,0,0]=4 295 B11R1.22 O=C(CO)C1=CC=C(I)C=C1 27936 [0,1,0,0,0,0|1,0,0]=2 296 B11R1.22 OC[C@H](O)C1=CC=C(Br)C=C1 11739 [0,1,0,0,0,0|1,0,2]=4 297 B11R1.22 O\N=C(/Cl)C1=CC=C(Br)C=C1 65916 [0,1,0,0,0,0|2,0,0]=3 298 B11R1.22 O\N=C(/Cl)C1=CC=C(Cl)C=C1 A12381 [0,1,0,0,0,0|2,0,0]=3 299 B11R1.166 CC(=O)C1=C(Br)C=C(C)C=C1 77817 [0,1,0,0,0,0|2,0,0]=3 300 B11R1.166 CC(=O)C1=C(Br)C=C(N)C=C1 34088 [0,1,0,0,0,0|2,0,0]=3 301 B11R1.166 CC(=O)C1=C(Br)C=C(O)C=C1 52517 [0,1,0,0,0,0|1,0,0]=2 302 B11R1.166 CC(=O)C1=C(C)C=C(C)N=C1 79163 [0,1,0,0,0,0|3,0,0]=4 303 B11R1.166 CC(=O)C1=C(Cl)C=C(F)C=N1 BL010219 [0,1,0,0,0,0|3,0,0]=4 304 B11R1.166 CC(=O)C1=C(Cl)C=C(N)C=C1 I12065 [0,1,0,0,0,0|2,0,0]=3 305 B11R1.166 CC(=O)C1=C(F)C=C(F)C=N1 50881 [0,1,0,0,0,0|3,0,0]=4 306 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 W18192 [0,1,0,0,0,0|2,0,0]=3 307 B11R1.166 CC(=O)C1=CC=C(F)N=C1F O10255 [0,1,0,0,0,0|3,0,0]=4 308 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1Cl 86422 [0,1,0,0,0,0|3,0,0]=4 309 B11R1.166 CC(=O)C1=NC=C(Br)C=C1C C14359 [0,1,0,0,0,0|3,0,0]=4 310 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1C D79870 [0,1,0,0,0,0|3,0,0]=4 311 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1F BL010223 [0,1,0,0,0,0|3,0,0]=4 312 B11R1.166 CC1=C(B(O)O)C=CC(Br)=C1 A12288 [0,1,0,0,0,0|2,0,1]=4 313 B11R1.166 CC1=C(C(=O)O)C=CC(I)=C1 31871 [0,1,0,0,0,0|1,0,0]=2 314 B11R1.166 CC1=C(C(=O)O)C=NC(Cl)=N1 CS1395 [0,1,0,0,0,0|3,0,0]=4 315 B11R1.166 CC1=C(C(=O)O)C=NC(N)=C1 W11094 [0,1,0,0,0,0|2,0,0]=3 316 B11R1.166 CC1=C([N+](=O)[O-])C=CC(I)=C1 D71992 [0,1,0,0,0,0|2,0,1]=4 317 B11R1.166 CC1=C([N+](=O)[O-])C=CC(S)=C1 N16874 [0,1,0,0,0,0|1,1,1]=4 318 B11R1.166 CC1=CC(F)=C(C(=O)O)N=C1 P12274 [0,1,0,0,0,0|2,0,0]=3 319 B11R1.166 CC1=CN=C(C(=O)O)C(C)=N1 27738 [0,1,0,0,0,0|3,0,0]=4 320 B11R1.166 CC1=NC(C)=C(C(=O)O)C=N1 Y10097 [0,1,0,0,0,0|3,0,0]=4 321 B11R1.166 CC1=NC(N)=C(C(=O)O)C=N1 F52074 [0,1,0,0,0,0|3,0,0]=4 322 B11R1.166 CC1=NC(N)=C(C(N)=O)C=C1 D83361 [0,1,0,0,0,0|3,0,0]=4 323 B11R1.166 CC1=NC=C(C(=O)O)C(Cl)=N1 C16751 [0,1,0,0,0,0|3,0,0]=4 324 B11R1.166 NC(=O)C1=C(Br)C=C(Br)C=C1 35389 [0,1,0,0,0,0|2,0,0]=3 325 B11R1.166 NC(=O)C1=C(Br)C=C(I)C=C1 C72078 [0,1,0,0,0,0|2,0,0]=3 326 B11R1.166 NC(=O)C1=C(Cl)C=C(Cl)C=N1 RB3269 [0,1,0,0,0,0|3,0,0]=4 327 B11R1.166 NC(=O)C1=C(N)C=C(F)C=C1 25114 [0,1,0,0,0,0|2,0,0]=3 328 B11R1.166 NC(=O)C1=C(N)C=C(O)C=C1 C76630 [0,1,0,0,0,0|1,0,0]=2 329 B11R1.166 NC(=O)C1=C(O)C=C(Cl)C=C1 72118 [0,1,0,0,0,0|2,0,0]=3 330 B11R1.166 NC(=O)C1=C(O)C=C(N)C=C1 O11153 [0,1,0,0,0,0|2,0,0]=3 331 B11R1.166 NC(=O)C1=C(O)N=C(O)C=C1 95017 [0,1,0,0,0,0|2,0,0]=3 332 B11R1.166 NC(=O)C1=CC=C(N)N=C1F F20207 [0,1,0,0,0,0|3,0,0]=4 333 B11R1.166 NC(=O)C1=NC=C(Br)C=C1F D79818 [0,1,0,0,0,0|3,0,0]=4 334 B11R1.166 NC(=O)C1=NC=C(Cl)C=C1F D79885 [0,1,0,0,0,0|3,0,0]=4 335 B11R1.166 NC1=C(C(=O)O)C=NC(Cl)=N1 N10067 [0,1,0,0,0,0|3,0,0]=4 336 B11R1.166 NC1=C(C(=O)O)N=CC(Cl)=N1 77983 [0,1,0,0,0,0|3,0,0]=4 337 B11R1.166 NC1=C([N+](=O)[O-])C=NC(O)=C1 26751 [0,1,0,0,0,0|2,0,1]=4 338 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=N1 I11984 [0,1,0,0,0,0|2,0,0]=3 339 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O 38415 [0,1,0,0,0,0|2,0,0]=3 340 B11R1.166 NC1=CC(F)=NC=C1C(=O)O 37635 [0,1,0,0,0,0|2,0,0]=3 341 B11R1.166 NC1=CC(N)=C(C(=O)O)C=C1 D95034 [0,1,0,0,0,0|1,0,0]=2 342 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)N=C1 F11789 [0,1,0,0,0,0|2,0,0]=3 343 B11R1.166 O=C(O)C1=C(Br)C=C(O)C=C1 C13381 [0,1,0,0,0,0|0,0,0]=1 344 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=N1 BL010109 [0,1,0,0,0,0|2,0,0]=3 345 B11R1.166 O=C(O)C1=C(Cl)N=C(Br)C=C1 F10539 [0,1,0,0,0,0|2,0,0]=3 346 B11R1.166 O=C(O)C1=C(F)C=C(O)C=N1 D79760 [0,1,0,0,0,0|1,0,0]=2 347 B11R1.166 O=C(O)C1=C(F)N=C(Cl)C=C1 RB3340 [0,1,0,0,0,0|2,0,0]=3 348 B11R1.166 O=C(O)C1=CC=C(F)N=C1Br F30561 [0,1,0,0,0,0|2,0,0]=3 349 B11R1.166 O=C(O)C1=CC=C(F)N=C1Cl W16949 [0,1,0,0,0,0|2,0,0]=3 350 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Br F11779 [0,1,0,0,0,0|2,0,0]=3 351 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Cl F11857 [0,1,0,0,0,0|2,0,0]=3 352 B11R1.166 O=C(O)C1=CN=C(F)C=C1F S10764 [0,1,0,0,0,0|2,0,0]=3 353 B11R1.166 O=C(O)C1=NC=C(Br)C=C1O 54575 [0,1,0,0,0,0|2,0,0]=3 354 B11R1.166 O=C(O)C1=NC=C(Cl)NC1=O W17937 [0,1,0,0,0,0|3,0,0]=4 355 B11R1.166 O=C1C=C(O)C(C(=O)O)=NN1 W19694 [0,1,0,0,0,0|2,0,1]=4 356 B11R1.166 O=[N+]([O-])C1=C(Cl)C=C(Br)C=C1 Y12426 [0,1,0,0,0,0|2,0,1]=4 357 B11R1.166 O=[N+]([O-])C1=C(I)C=C(O)C=C1 23870 [0,1,0,0,0,0|1,0,1]=3 358 B11R1.166 OB(O)C1=C(F)C=C(Br)C=C1 I12620 [0,1,0,0,0,0|2,0,1]=4 359 B11R1.166 OB(O)C1=C(F)C=C(O)C=C1 I12051 [0,1,0,0,0,0|1,0,1]=3 360 B9R1.35 CC(=O)C1=CNC(C)=C1 C75858 [0,0,0,0,1,0|3,0,0]=4 361 B9R1.35 CC(=O)C1=CSC(Br)=C1 25953 [0,0,0,0,1,0|3,0,0]=4 362 B9R1.35 CC(=O)C1=CSC(Cl)=C1 37629 [0,0,0,0,1,0|3,0,0]=4 363 B9R1.35 CC1=CC(C(=O)O)=CS1 BL001054 [0,0,0,0,1,0|2,0,0]=3 364 B9R1.35 CC1=CC(C(=O)O)=NS1 AT21128 [0,0,0,0,1,0|3,0,0]=4 365 B9R1.35 CC1=CNC(C(=O)O)=N1 C16255 [0,0,0,0,1,0|3,0,0]=4 366 B9R1.35 CC1=CNC(C(=O)O)=N1 Y11423 [0,0,0,0,1,0|3,0,0]=4 367 B9R1.35 CC1=NC=C(C(=O)O)O1 F13461 [0,0,0,0,1,0|3,0,0]=4 368 B9R1.35 CN1C=CC(C(=O)O)=C1 26121 [0,0,0,0,1,0|2,0,0]=3 369 B9R1.35 NC(=O)C1=CC(Br)=CN1 C73743 [0,0,0,0,1,0|3,0,0]=4 370 B9R1.35 NC(=O)C1=CC(Br)=CO1 C77306 [0,0,0,0,1,0|3,0,0]=4 371 B9R1.35 NC(=O)C1=CC=C(Br)N1 38755 [0,0,0,0,1,0|3,0,0]=4 372 B9R1.35 NC(=O)C1=CC=C(N)S1 C90315 [0,0,0,0,1,0|3,0,0]=4 373 B9R1.35 NC1=CNC(C(=O)O)=C1 F14489 [0,0,0,0,1,0|2,0,0]=3 374 B9R1.35 NC1=CNC(C(=O)O)=N1 D94530 [0,0,0,0,1,0|3,0,0]=4 375 B9R1.35 NC1=NC(C(=O)O)=CN1 F14481 [0,0,0,0,1,0|3,0,0]=4 376 B9R1.35 NC1=NC(C(=O)O)=CO1 38367 [0,0,0,0,1,0|3,0,0]=4 377 B9R1.35 O=C(O)C1=CC(Br)=CO1 25418 [0,0,0,0,1,0|2,0,0]=3 378 B9R1.35 O=C(O)C1=CC(Br)=NN1 D80317 [0,0,0,0,1,0|3,0,0]=4 379 B9R1.35 O=C(O)C1=CC(Br)=NO1 69280 [0,0,0,0,1,0|3,0,0]=4 380 B9R1.35 O=C(O)C1=CC(Cl)=CS1 24303 [0,0,0,0,1,0|2,0,0]=3 381 B9R1.35 O=C(O)C1=CC(F)=CS1 C10503 [0,0,0,0,1,0|2,0,0]=3 382 B9R1.35 O=C(O)C1=CC(I)=CN1 86089 [0,0,0,0,1,0|2,0,0]=3 383 B9R1.35 O=C(O)C1=CC=C(F)S1 83084 [0,0,0,0,1,0|2,0,0]=3 384 B9R1.35 O=C(O)C1=CC=C(I)S1 C75812 [0,0,0,0,1,0|2,0,0]=3 385 B9R1.35 O=C(O)C1=CNC(Cl)=C1 72647 [0,0,0,0,1,0|2,0,0]=3 386 B9R1.35 O=C(O)C1=COC(Cl)=N1 Y10043 [0,0,0,0,1,0|3,0,0]=4 387 B9R1.35 O=C(O)C1=COC(I)=N1 D95450 [0,0,0,0,1,0|3,0,0]=4 388 B9R1.35 O=C(O)C1=CSC(Cl)=C1 24618 [0,0,0,0,1,0|2,0,0]=3 389 B9R1.35 O=C(O)C1=NC=C(Br)S1 FD9045 [0,0,0,0,1,0|3,0,0]=4 390 B9R1.35 O=C(O)C1=NC=C(Cl)S1 P10902 [0,0,0,0,1,0|3,0,0]=4 391 B9R1.35 O=C(O)C1=NNC(Cl)=C1 20415 [0,0,0,0,1,0|3,0,0]=4 392 B9R1.35 O=C(O)C1=NNC(O)=C1 C77021 [0,0,0,0,1,0|2,0,0]=3 393 B9R1.35 O=C(O)C1=NOC(Cl)=C1 D80865 [0,0,0,0,1,0|3,0,0]=4 394 B11R1.20 CC(=O)NC1=CN=C(C)C=C1 N16920 [0,0,0,0,0,1|3,0,0]=4 395 B11R1.20 CC(=O)NC1=CN=C(O)C=C1 C75099 [0,0,0,0,0,1|2,0,0]=3 396 B11R1.20 CC(=O)NC1=NC=C(O)C=C1 C73008 [0,0,0,0,0,1|2,0,0]=3 397 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 56191 [0,0,0,0,0,1|2,0,0]=3 398 B11R1.20 C[C@H](N)CC1=CC=C(O)C=C1 84990 [0,0,0,0,0,1|2,0,1]=4 399 B11R1.20 C[C@H](O)CC1=CC=C(F)C=C1 C75202 [0,0,0,0,0,1|2,0,1]=4 400 B11R1.20 N=C(N)NC1=CC=C(Cl)C=C1 24230 [0,0,0,0,0,1|3,0,0]=4 401 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 69913 [0,0,0,0,0,1|2,0,0]=3 402 B11R1.20 NC(=O)CC1=CN=C(Cl)C=C1 84999 [0,0,0,0,0,1|3,0,0]=4 403 B11R1.20 NC(=O)CC1=NC=C(Br)C=C1 F19774 [0,0,0,0,0,1|3,0,0]=4 404 B11R1.20 NC1=NC=C(CC(=O)O)C=C1 F18175 [0,0,0,0,0,1|2,0,0]=3 405 B11R1.20 O=C(O)CC1=CC=C(S)C=C1 52120 [0,0,0,0,0,1|0,1,0]=2 406 B11R1.20 O=C(O)CC1=NC=C(Cl)C=C1 89138 [0,0,0,0,0,1|2,0,0]=3 407 B11R1.20 O=C(O)CC1=NC=C(Cl)C=N1 P10959 [0,0,0,0,0,1|3,0,0]=4 408 B11R1.20 O=C(O)CC1=NC=C(F)C=C1 89139 [0,0,0,0,0,1|2,0,0]=3 409 B11R1.20 O=C(O)CC1=NC=C(F)C=N1 27383 [0,0,0,0,0,1|3,0,0]=4 410 B11R1.20 O=C(O)CC1=NC=C(I)C=C1 P12089 [0,0,0,0,0,1|2,0,0]=3 411 B11R1.20 O=C(O)CC1=NC=C(O)C=C1 W18187 [0,0,0,0,0,1|1,0,0]=2 412 B8R1.2 NCC1=CC=CC=C1 RB3068 [2,0,0,0,0,0|1,0,1]=4 413 B8R1.2 O=CC1=NC=NC=C1 26359 [2,0,0,0,0,0|2,0,0]=4 414 B8R1.2 [C-]#[N+]C1=CC=CC=C1 AB1473 [2,0,0,0,0,0|2,0,0]=4 415 B8R1.3 NC1=CC=C(O)C=C1 C75965 [2,0,0,0,0,0|1,0,0]=3 416 B8R1.3 NC1=NC=C(O)C=C1 BL008086 [2,0,0,0,0,0|2,0,0]=4 417 B8R1.3 SC1=CC=C(I)C=C1 F20637 [2,0,0,0,0,0|1,1,0]=4 418 B10R1.1 C=CCC1=CC=C(O)C=C1 AC1877 [1,1,0,0,0,0|1,0,0]=3 419 B10R1.1 CNCC1=CC=C(O)C=C1 31972 [1,1,0,0,0,0|1,0,1]=4 420 B10R1.1 COCC1=CC=C(O)C=C1 63646 [1,1,0,0,0,0|0,0,1]=3 421 B10R1.1 NOCC1=CC=C(Cl)C=C1 78769 [1,1,0,0,0,0|1,0,1]=4 422 B10R1.1 O=CCC1=CC=C(Cl)C=C1 74968 [1,1,0,0,0,0|1,0,0]=3 423 B10R1.1 ON=CC1=NC=C(Br)C=C1 D81492 [1,1,0,0,0,0|2,0,0]=4 424 B10R1.3 C#CC1=CN=C(C=O)C=C1 51748 [1,1,0,0,0,0|2,0,0]=4 425 B10R1.3 C=CC1=CC=C(CO)C=C1 F14590 [1,1,0,0,0,0|1,0,0]=3 426 B10R1.3 CNC1=CC=C(C=O)C=C1 D93507 [1,1,0,0,0,0|1,0,0]=3 427 B10R1.3 CNC1=CC=C(CO)C=C1 20987 [1,1,0,0,0,0|1,0,1]=4 428 B10R1.3 CNC1=NC=C(C=O)C=C1 P10732 [1,1,0,0,0,0|2,0,0]=4 429 B10R1.3 COC1=CN=C(C=O)C=N1 P10975 [1,1,0,0,0,0|2,0,0]=4 430 B10R1.3 N#CC1=CN=C(C=O)C=C1 26613 [1,1,0,0,0,0|2,0,0]=4 431 B10R1.3 O=CC1=CC=C(CCl)C=C1 CL9238 [1,1,0,0,0,0|1,0,0]=3 432 B10R1.3 O=CC1=CN=C(C=O)C=C1 D80964 [1,1,0,0,0,0|1,0,1]=4 433 B10R1.25 C=CC1=C(Br)C=C(F)C=C1 S10822 [1,1,0,0,0,0|2,0,0]=4 434 B10R1.25 CC1=C(C=O)C=CC(Br)=N1 C16730 [1,1,0,0,0,0|2,0,0]=4 435 B10R1.25 CC1=C(C=O)C=CC(F)=N1 C76919 [1,1,0,0,0,0|2,0,0]=4 436 B10R1.25 CC1=C(CO)C=CC(N)=C1 F19834 [1,1,0,0,0,0|1,0,1]=4 437 B10R1.25 CC1=CC(Br)=NC=C1C=O C77172 [1,1,0,0,0,0|2,0,0]=4 438 B10R1.25 CC1=CC(C)=C(C=O)C=N1 C14259 [1,1,0,0,0,0|2,0,0]=4 439 B10R1.25 CC1=CC=C(C=O)C(Br)=N1 D82345 [1,1,0,0,0,0|2,0,0]=4 440 B10R1.25 CCC1=C(Br)C=C(O)C=C1 Y11628 [1,1,0,0,0,0|1,0,1]=4 441 B10R1.25 CCC1=C(F)C=C(O)C=C1 C11362 [1,1,0,0,0,0|1,0,1]=4 442 B10R1.25 CNC1=C(C)C=C(O)C=C1 C16321 [1,1,0,0,0,0|2,0,0]=4 443 B10R1.25 COC1=C(C)C=C(O)C=C1 95659 [1,1,0,0,0,0|2,0,0]=4 444 B10R1.25 N#CC1=C(Br)C=C(O)C=C1 AC6875 [1,1,0,0,0,0|1,0,1]=4 445 B10R1.25 N#CC1=C(O)C=C(O)C=C1 C76016 [1,1,0,0,0,0|1,0,1]=4 446 B10R1.25 NC1=C(C=O)C=CC(F)=C1 34566 [1,1,0,0,0,0|1,0,0]=3 447 B10R1.25 NC1=CC(Br)=C(C=O)C=C1 C16178 [1,1,0,0,0,0|1,0,0]=3 448 B10R1.25 NC1=CC(Br)=CN=C1C=O P13238 [1,1,0,0,0,0|2,0,0]=4 449 B10R1.25 NC1=CC(Cl)=NC=C1C=O 22929 [1,1,0,0,0,0|2,0,0]=4 450 B10R1.25 NC1=CC(F)=C(C=O)C=C1 AC6806 [1,1,0,0,0,0|1,0,0]=3 451 B10R1.25 NC1=CC(F)=CN=C1C=O D83274 [1,1,0,0,0,0|2,0,0]=4 452 B10R1.25 NC1=CC(N)=C(C=O)C=C1 C10737 [1,1,0,0,0,0|1,0,0]=3 453 B10R1.25 NCC1=C(F)C=C(O)C=C1 N14725 [1,1,0,0,0,0|1,0,1]=4 454 B10R1.25 O=CC1=C(Br)C=C(Br)C=N1 W15435 [1,1,0,0,0,0|2,0,0]=4 455 B10R1.25 O=CC1=C(Br)C=C(Cl)C=N1 BL010229 [1,1,0,0,0,0|2,0,0]=4 456 B10R1.25 O=CC1=C(Br)C=C(F)C=N1 58153 [1,1,0,0,0,0|2,0,0]=4 457 B10R1.25 O=CC1=C(Br)C=C(I)C=C1 67919 [1,1,0,0,0,0|1,0,0]=3 458 B10R1.25 O=CC1=C(Cl)C=C(Cl)C=N1 80307 [1,1,0,0,0,0|2,0,0]=4 459 B10R1.25 O=CC1=C(Cl)N=C(Br)C=C1 26730 [1,1,0,0,0,0|2,0,0]=4 460 B10R1.25 O=CC1=C(F)C=C(F)C=N1 F11044 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.25 O=CC1=C(F)N=C(Br)C=C1 74727 [1,1,0,0,0,0|2,0,0]=4 462 B10R1.25 O=CC1=C(I)C=C(F)C=C1 CL9496 [1,1,0,0,0,0|1,0,0]=3 463 B10R1.25 O=CC1=C(O)N=C(Br)C=C1 D80553 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.25 O=CC1=CC=C(Cl)N=C1Br C71249 [1,1,0,0,0,0|2,0,0]=4 465 B10R1.25 O=CC1=CC=C(F)N=C1Cl F12185 [1,1,0,0,0,0|2,0,0]=4 466 B10R1.25 O=CC1=CN=C(Br)C=C1Cl CL0319 [1,1,0,0,0,0|2,0,0]=4 467 B10R1.25 OCC1=C(Br)C=C(O)C=C1 98273 [1,1,0,0,0,0|0,0,1]=3 468 B10R1.25 OCC1=C(Cl)C=C(O)C=C1 CL9122 [1,1,0,0,0,0|0,0,1]=3 469 B10R1.25 OCC1=C(I)C=C(Cl)C=C1 95677 [1,1,0,0,0,0|1,0,1]=4 470 B10R1.25 OCC1=C(O)C=C(Br)C=C1 35526 [1,1,0,0,0,0|1,0,1]=4 471 B10R1.176 C=CC1=CC(Cl)=C(Cl)C=C1 C15264 [1,1,0,0,0,0|2,0,0]=4 472 B10R1.176 C=CC1=CC(F)=C(Cl)C=C1 S10073 [1,1,0,0,0,0|2,0,0]=4 473 B10R1.176 C=CC1=CC(I)=C(O)C=C1 D94289 [1,1,0,0,0,0|1,0,0]=3 474 B10R1.176 CC1=C(Br)C=C(C=O)N=C1 CS1689 [1,1,0,0,0,0|2,0,0]=4 475 B10R1.176 CC1=C(F)C=CC(C=O)=N1 P10585 [1,1,0,0,0,0|2,0,0]=4 476 B10R1.176 CC1=C(O)C=C(C=O)C=C1 W16814 [1,1,0,0,0,0|1,0,0]=3 477 B10R1.176 CC1=C(O)C=CC(C#N)=C1 O11240 [1,1,0,0,0,0|1,0,1]=4 478 B10R1.176 CC1=C(O)C=CC(CN)=C1 N14331 [1,1,0,0,0,0|1,0,1]=4 479 B10R1.176 CC1=C(O)C=CC(CO)=C1 C73536 [1,1,0,0,0,0|0,0,1]=3 480 B10R1.176 CC1=CC(C=O)=CN=C1Br 78107 [1,1,0,0,0,0|2,0,0]=4 481 B10R1.176 CN1C=C(C=O)C=CC1=O H11166 [1,1,0,0,0,0|1,0,1]=4 482 B10R1.176 COC1=CC(O)=C(O)C=C1 F18177 [1,1,0,0,0,0|2,0,0]=4 483 B10R1.176 NC1=C(F)C=C(CO)C=C1 74966 [1,1,0,0,0,0|1,0,1]=4 484 B10R1.176 NC1=C(O)C=CC(CO)=C1 Y13579 [1,1,0,0,0,0|0,0,1]=3 485 B10R1.176 NCC1=CC(O)=C(O)C=C1 S11863 [1,1,0,0,0,0|1,0,1]=4 486 B10R1.176 O=CC1=CC(Cl)=C(O)N=C1 A12705 [1,1,0,0,0,0|1,0,0]=3 487 B10R1.176 O=CC1=CC(F)=C(I)C=C1 23742 [1,1,0,0,0,0|1,0,0]=3 488 B10R1.176 O=CC1=CC(I)=C(F)C=C1 34606 [1,1,0,0,0,0|1,0,0]=3 489 B10R1.176 O=CC1=CC(O)=C(Br)C=C1 34572 [1,1,0,0,0,0|1,0,0]=3 490 B10R1.176 O=CC1=CC(O)=C(I)C=C1 62940 [1,1,0,0,0,0|1,0,0]=3 491 B10R1.176 O=CC1=CC=C(Cl)C(Br)=N1 C14399 [1,1,0,0,0,0|2,0,0]=4 492 B10R1.176 O=CC1=CN=C(Br)C(F)=C1 O11553 [1,1,0,0,0,0|2,0,0]=4 493 B10R1.176 O=CC1=CN=C(Cl)C(Cl)=C1 97698 [1,1,0,0,0,0|2,0,0]=4 494 B10R1.176 O=CC1=CN=C(Cl)C(F)=C1 C16801 [1,1,0,0,0,0|2,0,0]=4 495 B10R1.176 O=CC1=NC(Cl)=C(Br)C=C1 32221 [1,1,0,0,0,0|2,0,0]=4 496 B10R1.176 OCC1=CC(O)=C(F)C=C1 C77207 [1,1,0,0,0,0|1,0,1]=4 497 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 31291 [1,1,0,0,0,0|1,0,1]=4 498 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 32646 [1,1,0,0,0,0|1,0,1]=4 499 B10R1.15 C=C(CBr)C1=CC=CC=C1 35089 [1,1,0,0,0,0|2,0,0]=4 500 B10R1.15 C=C(CC)C1=CC=CC=C1 C73845 [1,1,0,0,0,0|2,0,0]=4 501 B10R1.15 C=CC(=O)C1=CC=CC=C1 77875 [1,1,0,0,0,0|1,0,0]=3 502 B10R1.15 CC[C@H](O)C1=CC=CC=C1 T71858 [1,1,0,0,0,0|1,0,1]=4 503 B10R1.15 CC[C@H](O)C1=CC=CC=C1 T72707 [1,1,0,0,0,0|1,0,1]=4 504 B10R1.15 COC(=O)C1=CN=NC=C1 23653 [1,1,0,0,0,0|2,0,0]=4 505 B10R1.15 N=C(NN)C1=CC=CC=C1 D97377 [1,1,0,0,0,0|2,0,0]=4 506 B10R1.15 NNC(=S)C1=CC=CC=C1 W10972 [1,1,0,0,0,0|1,1,0]=4 507 B10R1.15 O=C(CBr)C1=CN=CC=C1 D82267 [1,1,0,0,0,0|2,0,0]=4 508 B10R1.15 O=C(CO)C1=NC=CC=C1 AC7454 [1,1,0,0,0,0|1,0,0]=3 509 B10R1.15 O=C(NO)C1=CN=CC=C1 F17466 [1,1,0,0,0,0|1,0,0]=3 510 B10R1.15 O=C[C@H](Br)C1=CC=CC=C1 F13390 [1,1,0,0,0,0|1,0,1]=4 511 B10R1.15 O[C@@H](CF)C1=CC=CC=C1 C91661 [1,1,0,0,0,0|1,0,1]=4 512 B10R1.15 O\N=C(/Cl)C1=NC=CC=C1 O12024 [1,1,0,0,0,0|2,0,0]=4 513 B10R1.28 C[S@](=N)(=O)C1=CC=CC=C1 W16234 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.28 O=S(=O)(O)C1=CC=NC=C1 12268 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.61 C=C(C)C1=C(Br)C=CC=C1 W17018 [1,1,0,0,0,0|2,0,0]=4 516 B10R1.61 CC(=O)C1=C(Br)C=CC=N1 80328 [1,1,0,0,0,0|2,0,0]=4 517 B10R1.61 CC(=O)C1=C(C)N=CC=C1 C73307 [1,1,0,0,0,0|2,0,0]=4 518 B10R1.61 CC(=O)C1=C(Cl)C=CC=N1 27067 [1,1,0,0,0,0|2,0,0]=4 519 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 Y14823 [1,1,0,0,0,0|2,0,0]=4 520 B10R1.61 CC(=O)C1=C(Cl)C=NC=C1 N12959 [1,1,0,0,0,0|2,0,0]=4 521 B10R1.61 CC(=O)C1=C(O)C=NC=C1 27646 [1,1,0,0,0,0|2,0,0]=4 522 B10R1.61 CC(=O)C1=C(O)N=CC=C1 93481 [1,1,0,0,0,0|2,0,0]=4 523 B10R1.61 CC(=O)C1=CC=CN=C1F F31395 [1,1,0,0,0,0|2,0,0]=4 524 B10R1.61 CC(=O)C1=CNC=CC1=O C74936 [1,1,0,0,0,0|2,0,0]=4 525 B10R1.61 CC(=O)C1=NC=CC=C1N 80156 [1,1,0,0,0,0|2,0,0]=4 526 B10R1.61 CC(=O)C1=NC=CC=C1O 80210 [1,1,0,0,0,0|2,0,0]=4 527 B10R1.61 CC1=C(C(=N)N)C=CC=C1 28690 [1,1,0,0,0,0|2,0,0]=4 528 B10R1.61 CC1=C(C(=O)O)C=CN=N1 P11312 [1,1,0,0,0,0|2,0,0]=4 529 B10R1.61 CC1=C(C(=O)O)C=NC=C1 83402 [1,1,0,0,0,0|1,0,0]=3 530 B10R1.61 CC1=C(C(N)=O)C=CN=C1 C74299 [1,1,0,0,0,0|2,0,0]=4 531 B10R1.61 CC1=C(C(N)=O)C=NC=C1 A10183 [1,1,0,0,0,0|2,0,0]=4 532 B10R1.61 CC1=CC=NN=C1C(=O)O P10780 [1,1,0,0,0,0|2,0,0]=4 533 B10R1.61 CC1=CN=CN=C1C(=O)O F52630 [1,1,0,0,0,0|2,0,0]=4 534 B10R1.61 C[C@H](O)C1=C(Br)C=CC=C1 SC1257 [1,1,0,0,0,0|1,0,1]=4 535 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 SC1230 [1,1,0,0,0,0|1,0,1]=4 536 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 SC1233 [1,1,0,0,0,0|1,0,1]=4 537 B10R1.61 C[C@H](O)C1=C(O)C=CC=C1 W16007 [1,1,0,0,0,0|1,0,1]=4 538 B10R1.61 N=C(N)C1=C(Cl)C=CC=C1 71514 [1,1,0,0,0,0|2,0,0]=4 539 B10R1.61 NC(=O)C1=C(O)C=NC=C1 CL0151 [1,1,0,0,0,0|2,0,0]=4 540 B10R1.61 NC1=CN=CN=C1C(=O)O 20214 [1,1,0,0,0,0|2,0,0]=4 541 B10R1.61 O=C(O)C1=C(Br)C=NC=N1 84369 [1,1,0,0,0,0|2,0,0]=4 542 B10R1.61 O=C(O)C1=C(Cl)C=NC=N1 P10759 [1,1,0,0,0,0|2,0,0]=4 543 B10R1.61 O=C(O)C1=C(F)C=CN=C1 W18401 [1,1,0,0,0,0|1,0,0]=3 544 B10R1.61 O=C(O)C1=CC=NN=C1Cl P11658 [1,1,0,0,0,0|2,0,0]=4 545 B10R1.61 O=C(O)C1=NC=CN=C1Br 84139 [1,1,0,0,0,0|2,0,0]=4 546 B10R1.61 O=C(O)C1=NC=CN=C1I 26634 [1,1,0,0,0,0|2,0,0]=4 547 B10R1.113 C=C(C)C1=CC(C)=CC=C1 AC1343 [1,1,0,0,0,0|2,0,0]=4 548 B10R1.113 C=C(C)C1=CC=CC(Cl)=C1 AC1313 [1,1,0,0,0,0|2,0,0]=4 549 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 A10170 [1,1,0,0,0,0|2,0,0]=4 550 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 W17608 [1,1,0,0,0,0|2,0,0]=4 551 B10R1.113 CC(=O)C1=CC(C)=NC=C1 27585 [1,1,0,0,0,0|2,0,0]=4 552 B10R1.113 CC(=O)C1=CC(Cl)=CN=C1 78890 [1,1,0,0,0,0|2,0,0]=4 553 B10R1.113 CC(=O)C1=CC(F)=CN=C1 N13069 [1,1,0,0,0,0|2,0,0]=4 554 B10R1.113 CC(=O)C1=CC(F)=NC=C1 52239 [1,1,0,0,0,0|2,0,0]=4 555 B10R1.113 CC(=O)C1=CC(N)=NC=C1 82952 [1,1,0,0,0,0|2,0,0]=4 556 B10R1.113 CC(=O)C1=CC=CC(Cl)=C1 D77821 [1,1,0,0,0,0|1,0,0]=3 557 B10R1.113 CC(=O)C1=CC=CC(F)=N1 F30144 [1,1,0,0,0,0|2,0,0]=4 558 B10R1.113 CC(=O)C1=C[N+]([O-])=CC=C1 31268 [1,1,0,0,0,0|2,0,0]=4 559 B10R1.113 CC(=O)C1=NC=CC(Br)=C1 RB1136 [1,1,0,0,0,0|2,0,0]=4 560 B10R1.113 CC(=O)C1=NC=CC(N)=C1 C72011 [1,1,0,0,0,0|2,0,0]=4 561 B10R1.113 CC1=CC(C(=O)O)=NN=C1 P15424 [1,1,0,0,0,0|2,0,0]=4 562 B10R1.113 CC1=CC=CC(C(N)=O)=N1 AB10051 [1,1,0,0,0,0|2,0,0]=4 563 B10R1.113 CC1=CC=CC([C@H](C)O)=C1 W11160 [1,1,0,0,0,0|1,0,1]=4 564 B10R1.113 CC1=CC=CC([C@H](C)O)=C1 W11161 [1,1,0,0,0,0|1,0,1]=4 565 B10R1.113 CC1=CC=NC(C(=O)O)=N1 26974 [1,1,0,0,0,0|2,0,0]=4 566 B10R1.113 CC1=NC=CC(C(N)=O)=C1 F11696 [1,1,0,0,0,0|2,0,0]=4 567 B10R1.113 C[C@H](O)C1=CC=CC(Br)=C1 SC1266 [1,1,0,0,0,0|1,0,1]=4 568 B10R1.113 C[C@H](O)C1=CC=CC(Cl)=C1 SC1260 [1,1,0,0,0,0|1,0,1]=4 569 B10R1.113 C[C@H](O)C1=CC=CC(Cl)=C1 SC1269 [1,1,0,0,0,0|1,0,1]=4 570 B10R1.113 C[C@H](O)C1=CC=CC(F)=C1 SC1248 [1,1,0,0,0,0|1,0,1]=4 571 B10R1.113 C[N+]1=CC=CC(C(=O)[O-])=C1 41976 [1,1,0,0,0,0|1,0,1]=4 572 B10R1.113 NC(=O)C1=CC(O)=CC=C1 C75901 [1,1,0,0,0,0|1,0,0]=3 573 B10R1.113 NC(=O)C1=CC=CC(Cl)=N1 78773 [1,1,0,0,0,0|2,0,0]=4 574 B10R1.113 NC(=O)C1=CN=CC(O)=C1 W18378 [1,1,0,0,0,0|2,0,0]=4 575 B10R1.113 NC(=O)C1=NC(O)=CC=C1 C77024 [1,1,0,0,0,0|2,0,0]=4 576 B10R1.113 NC(=O)C1=NC=CC(N)=C1 S11442 [1,1,0,0,0,0|2,0,0]=4 577 B10R1.113 NC1=CC(C(=O)O)=CN=N1 P17402 [1,1,0,0,0,0|2,0,0]=4 578 B10R1.113 NC1=CC(C(=O)O)=NC=N1 26498 [1,1,0,0,0,0|2,0,0]=4 579 B10R1.113 NC1=CN=CC(C(=O)O)=N1 26349 [1,1,0,0,0,0|2,0,0]=4 580 B10R1.113 O=C(Cl)C1=CC(Cl)=NC=C1 78664 [1,1,0,0,0,0|2,0,0]=4 581 B10R1.113 O=C(Cl)C1=CC=CC(Cl)=N1 C76563 [1,1,0,0,0,0|2,0,0]=4 582 B10R1.113 O=C(O)C1=CC(S)=NC=C1 77943 [1,1,0,0,0,0|1,0,0]=3 583 B10R1.113 O=C(O)C1=CC=NC(Br)=N1 W17831 [1,1,0,0,0,0|2,0,0]=4 584 B10R1.113 O=C(O)C1=NC=CC(Cl)=N1 F19652 [1,1,0,0,0,0|2,0,0]=4 585 B10R1.113 O=C(O)C1=NC=CC(F)=C1 CL0347 [1,1,0,0,0,0|1,0,0]=3 586 B10R1.113 O=C1C=CNC(C(=O)O)=C1 N13374 [1,1,0,0,0,0|1,0,0]=3 587 B10R1.14 COC(=O)C1=CC(C)=CN1 F53538 [0,1,0,0,1,0|2,0,0]=4 588 B10R1.14 COC(=O)C1=CC(Cl)=CS1 P12968 [0,1,0,0,1,0|2,0,0]=4 589 B10R1.14 COC(=O)C1=CC(F)=CN1 68046 [0,1,0,0,1,0|2,0,0]=4 590 B10R1.14 COC(=O)C1=CC(F)=CS1 F21319 [0,1,0,0,1,0|2,0,0]=4 591 B10R1.14 COC(=O)C1=CC(I)=CN1 80242 [0,1,0,0,1,0|2,0,0]=4 592 B10R1.14 COC(=O)C1=CC(O)=NN1 F30450 [0,1,0,0,1,0|2,0,0]=4 593 B10R1.14 COC(=O)C1=CC=C(Cl)O1 76672 [0,1,0,0,1,0|2,0,0]=4 594 B10R1.14 COC(=O)C1=CC=C(Cl)S1 O11960 [0,1,0,0,1,0|2,0,0]=4 595 B10R1.14 COC(=O)C1=CC=C(I)S1 C76903 [0,1,0,0,1,0|2,0,0]=4 596 B10R1.14 COC(=O)C1=CC=C(N)N1 F14198 [0,1,0,0,1,0|2,0,0]=4 597 B10R1.14 COC(=O)C1=CN(C)C=C1 W18273 [0,1,0,0,1,0|2,0,0]=4 598 B10R1.14 COC(=O)C1=CNC(Br)=C1 30522 [0,1,0,0,1,0|2,0,0]=4 599 B10R1.14 COC(=O)C1=COC(C)=C1 C15656 [0,1,0,0,1,0|2,0,0]=4 600 B10R1.14 COC(=O)C1=CSC(N)=C1 W15215 [0,1,0,0,1,0|2,0,0]=4 601 B10R1.14 COC(=O)C1=NNC(O)=C1 64189 [0,1,0,0,1,0|2,0,0]=4 602 B10R1.31 COC1=CC=C(C(=O)O)S1 31392 [0,1,0,0,1,0|1,0,0]=3 603 B10R1.31 COC1=CN=C(C(=O)O)O1 C75184 [0,1,0,0,1,0|2,0,0]=4 604 B10R1.31 N#CC1=CC=C(C(=O)O)N1 C16499 [0,1,0,0,1,0|2,0,0]=4 605 B10R1.31 N#CC1=CC=C(C(=O)O)O1 N12973 [0,1,0,0,1,0|2,0,0]=4 606 B10R1.31 N#CC1=CC=C(C(=O)O)S1 89049 [0,1,0,0,1,0|2,0,0]=4 607 B10R1.31 N#CC1=COC(C(=O)O)=C1 C72484 [0,1,0,0,1,0|2,0,0]=4 608 B10R1.31 N#CC1=CSC(C(=O)O)=C1 76094 [0,1,0,0,1,0|2,0,0]=4 609 B10R1.31 O=C(O)C1=CC(CO)=NN1 C72595 [0,1,0,0,1,0|2,0,0]=4 610 B10R1.31 O=C(O)C1=CSC(CO)=N1 W17565 [0,1,0,0,1,0|2,0,0]=4 611 B10R1.31 O=CC1=CC(C(=O)O)=CO1 AT17491 [0,1,0,0,1,0|1,0,1]=4 612 B10R1.58 CC1=C(Br)C=C(C(=O)O)S1 36278 [0,1,0,0,1,0|2,0,0]=4 613 B10R1.58 CC1=C(C)NC(C(=O)O)=C1 F30544 [0,1,0,0,1,0|2,0,0]=4 614 B10R1.58 CC1=CC(C(=O)O)=CN1C 72960 [0,1,0,0,1,0|2,0,0]=4 615 B10R1.58 O=C(O)C1=CC(Br)=C(Cl)S1 C16067 [0,1,0,0,1,0|2,0,0]=4 616 B10R1.58 O=C(O)C1=CC(Cl)=C(Br)S1 C71923 [0,1,0,0,1,0|2,0,0]=4 617 B10R1.58 O=C(O)C1=CC(Cl)=C(Cl)N1 W17455 [0,1,0,0,1,0|2,0,0]=4 618 B10R1.59 CC1=C(C(=O)O)C=C(Br)S1 W11336 [0,1,0,0,1,0|2,0,0]=4 619 B10R1.59 CC1=CC(Br)=C(C(=O)O)S1 D95614 [0,1,0,0,1,0|2,0,0]=4 620 B10R1.59 CC1=CC(C(=O)O)=C(C)N1 F52431 [0,1,0,0,1,0|2,0,0]=4 621 B10R1.59 CC1=CC(C)=C(C(=O)O)N1 61000 [0,1,0,0,1,0|2,0,0]=4 622 B10R1.59 CN1C=C(Br)C=C1C(=O)O 26615 [0,1,0,0,1,0|2,0,0]=4 623 B10R1.59 CN1C=C(F)C=C1C(=O)O 73060 [0,1,0,0,1,0|2,0,0]=4 624 B10R1.59 CN1C=C(N)C=C1C(=O)O 84211 [0,1,0,0,1,0|2,0,0]=4 625 B10R1.59 O=C(O)C1=C(Br)C=C(Cl)S1 C10746 [0,1,0,0,1,0|2,0,0]=4 626 B10R1.59 O=C(O)C1=C(Cl)C=C(Br)S1 N12995 [0,1,0,0,1,0|2,0,0]=4 627 B10R1.59 O=C(O)C1=C(Cl)C=C(Cl)S1 F16141 [0,1,0,0,1,0|2,0,0]=4 628 B10R1.59 O=C(O)C1=C(Cl)SC(Br)=C1 C10404 [0,1,0,0,1,0|2,0,0]=4 629 B10R1.194 CC1=C(C)C(C(=O)O)=CS1 71336 [0,1,0,0,1,0|2,0,0]=4 630 B10R1.194 CC1=CC=C(C(=O)O)N1C D83409 [0,1,0,0,1,0|2,0,0]=4 631 B10R1.194 CC1=CSC(C(=O)O)=C1C C77023 [0,1,0,0,1,0|2,0,0]=4 632 B10R1.194 CN1C(Br)=CC=C1C(=O)O 26338 [0,1,0,0,1,0|2,0,0]=4 633 B10R1.194 CN1C(C(=O)O)=CN=C1O W11944 [0,1,0,0,1,0|2,0,0]=4 634 B12R1.4 CC(=O)NC1=CC=C(CN)C=C1 C77608 [0,1,0,0,0,1|2,0,0]=4 635 B12R1.4 CC(=O)NC1=CC=C(CN)C=C1 F19945 [0,1,0,0,0,1|2,0,0]=4 636 B12R1.4 CCC1=CC=C(NC(C)=O)C=C1 Y10852 [0,1,0,0,0,1|2,0,0]=4 637 B12R1.4 COC1=CC=C(OC(C)=O)C=C1 C11131 [0,1,0,0,0,1|1,0,0]=3 638 B12R1.4 NCC1=CC=C(CC(=O)O)C=C1 CK1029 [0,1,0,0,0,1|1,0,0]=3 639 B12R1.4 O=C(O)CC1=CC=C(CCl)C=C1 AC6356 [0,1,0,0,0,1|1,0,0]=3 640 B12R1.4 O=CC1=CC=C(CC(=O)O)C=C1 CX1079 [0,1,0,0,0,1|0,0,1]=3 641 B12R1.19 CC(=O)CC1=CC(O)=C(O)C=C1 W16241 [0,1,0,0,0,1|1,0,0]=3 642 B12R1.19 CC(=O)NC1=CC(Br)=C(Cl)C=C1 W18000 [0,1,0,0,0,1|2,0,0]=4 643 B12R1.19 CC(=O)NC1=CC(C)=C(O)C=C1 C73156 [0,1,0,0,0,1|1,0,0]=3 644 B12R1.19 CC(=O)NC1=CC(N)=C(O)C=C1 W13329 [0,1,0,0,0,1|1,0,0]=3 645 B12R1.19 CC1=C(Br)C=C(CC(=O)O)C=C1 97482 [0,1,0,0,0,1|1,0,0]=3 646 B12R1.19 NC(=O)NC1=CC(Cl)=C(Cl)C=C1 24890 [0,1,0,0,0,1|2,0,0]=4 647 B12R1.19 NC1=C(Br)C=C(CC(=O)O)C=C1 D78654 [0,1,0,0,0,1|1,0,0]=3 648 B12R1.19 NC1=C(F)C=C(CC(=O)O)C=C1 A11218 [0,1,0,0,0,1|1,0,0]=3 649 B12R1.19 NC1=C(N)C=C(CC(=O)O)C=C1 AB9013 [0,1,0,0,0,1|1,0,0]=3 650 B12R1.19 O=C(O)CC1=CC(Cl)=C(Br)C=C1 CL9560 [0,1,0,0,0,1|1,0,0]=3 651 B12R1.20 CC(=O)C(=O)C1=CC=C(Cl)C=C1 H10945 [0,1,0,0,0,1|2,0,0]=4 652 B12R1.20 CC(=O)N(C)C1=CC=C(C)C=C1 D93545 [0,1,0,0,0,1|2,0,0]=4 653 B12R1.20 CC1=CC=C([C@@H](N)C(=O)O)C=C1 D80223 [0,1,0,0,0,1|1,0,0]=3 654 B12R1.20 CC1=CC=C([C@@H](N)C(=O)O)C=C1 Y13382 [0,1,0,0,0,1|1,0,0]=3 655 B12R1.20 CC1=CC=C([C@@H](O)C(=O)O)C=C1 F20952 [0,1,0,0,0,1|1,0,0]=3 656 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(O)C=C1 AC1142 [0,1,0,0,0,1|0,0,0]=2 657 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(O)C=C1 AC3350 [0,1,0,0,0,1|0,0,0]=2 658 B12R1.20 C[C@@H](C(=O)O)C1=CN=C(Cl)C=C1 69943 [0,1,0,0,0,1|2,0,0]=4 659 B12R1.20 NC(=O)C(=O)C1=CC=C(Br)C=C1 A10635 [0,1,0,0,0,1|2,0,0]=4 660 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Br)C=C1 N12474 [0,1,0,0,0,1|1,0,0]=3 661 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Br)C=C1 Y10441 [0,1,0,0,0,1|1,0,0]=3 662 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Br)C=C1 Y11071 [0,1,0,0,0,1|1,0,0]=3 663 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(F)C=C1 61234 [0,1,0,0,0,1|1,0,0]=3 664 B12R1.20 O=C(O)C(=O)C1=CC=C(Br)C=C1 AB10481 [0,1,0,0,0,1|1,0,0]=3 665 B12R1.20 O=C(O)C(=O)C1=CC=C(Cl)C=C1 57454 [0,1,0,0,0,1|1,0,0]=3 666 B12R1.20 O=C(O)C(=O)C1=CC=C(F)C=C1 AB11475 [0,1,0,0,0,1|1,0,0]=3 667 B12R1.20 O=C(O)C(=O)C1=CC=C(O)C=C1 F16678 [0,1,0,0,0,1|0,0,0]=2 668 B12R1.20 O=C(O)[C@H](O)C1=CC=C(Cl)C=C1 25102 [0,1,0,0,0,1|1,0,0]=3 669 B12R1.20 O=C([O-])C(=O)C1=CC=C(O)C=C1 38640 [0,1,0,0,0,1|0,0,1]=3 670 B12R1.20 O=C([O-])[C@H](O)C1=CC=C(O)C=C1 C76190 [0,1,0,0,0,1|0,0,1]=3 671 B12R1.49 C=CC(=O)NC1=CC=C(N)C=C1 A10042 [0,1,0,0,0,1|2,0,0]=4 672 B12R1.49 CC1=CC=C(CC(=O)NN)C=C1 W18215 [0,1,0,0,0,1|2,0,0]=4 673 B12R1.49 CCC(=O)CC1=CC=C(Br)C=C1 79685 [0,1,0,0,0,1|2,0,0]=4 674 B12R1.49 CCC(=O)CC1=CC=C(C)C=C1 N12572 [0,1,0,0,0,1|2,0,0]=4 675 B12R1.49 CCC(=O)CC1=CC=C(F)C=C1 N14142 [0,1,0,0,0,1|2,0,0]=4 676 B12R1.49 CCC(=O)OC1=CC=C(O)C=C1 C11963 [0,1,0,0,0,1|1,0,0]=3 677 B12R1.49 COC(=O)CC1=CN=C(Br)C=C1 AB22708 [0,1,0,0,0,1|2,0,0]=4 678 B12R1.49 COC(=O)CC1=CN=C(C)C=C1 74980 [0,1,0,0,0,1|2,0,0]=4 679 B12R1.49 COC(=O)CC1=NC=C(Br)C=C1 P11352 [0,1,0,0,0,1|2,0,0]=4 680 B12R1.49 NCC(=O)NC1=CC=C(F)C=C1 F20087 [0,1,0,0,0,1|2,0,0]=4 681 B12R1.49 N\C(CC1=CC=C(O)C=C1)=N\O W10702 [0,1,0,0,0,1|1,0,0]=3 682 B12R1.49 O=C(CCl)NC1=CC=C(O)C=C1 69837 [0,1,0,0,0,1|1,0,0]=3 683 B12R1.106 O=P([O-])([O-])OC1=CC=C(O)C=C1 C73842 [0,1,0,0,0,1|1,0,1]=4 684 B12R1.233 CC(=O)CC1=C(Br)C=C(Cl)C=C1 C72216 [0,1,0,0,0,1|2,0,0]=4 685 B12R1.233 CC(=O)CC1=C(F)C=C(F)C=C1 N12745 [0,1,0,0,0,1|2,0,0]=4 686 B12R1.233 CC(=O)NC1=C(I)C=C(Br)C=C1 71393 [0,1,0,0,0,1|2,0,0]=4 687 B12R1.233 CC(=O)NC1=C(O)C=C(C)C=C1 D96026 [0,1,0,0,0,1|2,0,0]=4 688 B12R1.233 CC1=C(CC(=O)O)C=CC(N)=C1 72069 [0,1,0,0,0,1|1,0,0]=3 689 B12R1.233 NC1=C(CC(=O)O)C=CC(Br)=C1 98287 [0,1,0,0,0,1|1,0,0]=3 690 B12R1.233 NC1=CC(Br)=CN=C1CC(=O)O 27445 [0,1,0,0,0,1|2,0,0]=4 691 B12R1.233 O=C(O)CC1=C(F)C=C(O)C=C1 CL8759 [0,1,0,0,0,1|0,0,0]=2 692 B12R1.233 O=C(O)CC1=C(O)C=C(Br)C=C1 CL9173 [0,1,0,0,0,1|1,0,0]=3 693 B12R1.233 O=C(O)CC1=CC=C(Cl)N=C1Cl D83232 [0,1,0,0,0,1|2,0,0]=4 694 B12R1.5 C#CC1=NC=C(C(=O)OC)C=C1 F19828 [0,2,0,0,0,0|2,0,0]=4 695 B12R1.5 CCC1=CC=C(C(=O)CCl)C=C1 W16149 [0,2,0,0,0,0|2,0,0]=4 696 B12R1.5 CNC(=O)C1=CC=C(OC)C=C1 C74747 [0,2,0,0,0,0|1,0,0]=3 697 B12R1.5 COC(=O)C1=CC=C(NN)C=C1 AB9723 [0,2,0,0,0,0|1,0,0]=3 698 B12R1.5 COC(=O)C1=CN=C(C#N)C=C1 87748 [0,2,0,0,0,0|2,0,0]=4 699 B12R1.5 COC(=O)C1=CN=C(CBr)C=C1 57139 [0,2,0,0,0,0|2,0,0]=4 700 B12R1.5 COC(=O)C1=CN=C(CCl)C=C1 94419 [0,2,0,0,0,0|2,0,0]=4 701 B12R1.5 COC(=O)C1=CN=C(CN)C=C1 FD7395 [0,2,0,0,0,0|2,0,0]=4 702 B12R1.5 COC(=O)C1=NC=C(C=O)C=C1 68601 [0,2,0,0,0,0|1,0,1]=4 703 B12R1.5 COC(=O)C1=NC=C(CO)C=C1 90186 [0,2,0,0,0,0|1,0,0]=3 704 B12R1.5 COC(=O)C1=NC=C(OC)C=C1 P11291 [0,2,0,0,0,0|1,0,0]=3 705 B12R1.5 COC(=O)C1=NC=C(OC)C=N1 F52806 [0,2,0,0,0,0|2,0,0]=4 706 B12R1.5 COC(=O)C1=NC=C(OC)N=C1 RB3230 [0,2,0,0,0,0|2,0,0]=4 707 B12R1.5 COC1=CC=C(C(=O)C=O)C=C1 Y11290 [0,2,0,0,0,0|0,0,1]=3 708 B12R1.5 COC1=CC=C(C(=S)NN)C=C1 W10977 [0,2,0,0,0,0|1,1,0]=4 709 B12R1.5 COC1=CC=C([C@@H](N)CO)C=C1 N10529 [0,2,0,0,0,0|1,0,1]=4 710 B12R1.5 COC1=CC=C([C@@H](N)CO)C=C1 N11095 [0,2,0,0,0,0|1,0,1]=4 711 B12R1.5 COC1=CC=C([C@@H](N)CO)C=C1 Y10338 [0,2,0,0,0,0|1,0,1]=4 712 B12R1.5 COC1=CC=C([C@@H](N)CO)C=C1 Y10646 [0,2,0,0,0,0|1,0,1]=4 713 B12R1.5 COC1=NC=C(C(=N)NO)C=C1 79078 [0,2,0,0,0,0|2,0,0]=4 714 B12R1.5 N#CC1=CC=C(C(=O)CO)C=C1 AC6010 [0,2,0,0,0,0|1,0,0]=3 715 B12R1.6 COC1=CC=C(P(=O)(O)O)C=C1 T72088 [0,2,0,0,0,0|1,0,0]=3 716 B12R1.6 NS(=O)(=O)C1=CC=C(CO)C=C1 N16854 [0,2,0,0,0,0|1,0,1]=4 717 B12R1.6 O=CC1=CC=C(S(=O)(=O)O)C=C1 79124 [0,2,0,0,0,0|1,0,1]=4 718 B12R1.48 C#CC1=C(C)C=C(C(=O)O)C=C1 C72433 [0,2,0,0,0,0|1,0,0]=3 719 B12R1.48 CC(=O)C1=CC(C)=C(C#N)C=C1 34118 [0,2,0,0,0,0|2,0,0]=4 720 B12R1.48 CC1=C(CO)C=CC(B(O)O)=C1 H11429 [0,2,0,0,0,0|1,0,1]=4 721 B12R1.48 CCC1=C(Br)C=C(C(=O)O)C=C1 C77389 [0,2,0,0,0,0|1,0,0]=3 722 B12R1.48 CCC1=C(F)C=C(C(=O)O)C=C1 36886 [0,2,0,0,0,0|1,0,0]=3 723 B12R1.48 CCN1C=CC(C(=O)O)=CC1=O C71409 [0,2,0,0,0,0|2,0,0]=4 724 B12R1.48 CNC1=C(N)C=C(C(C)=O)C=C1 24155 [0,2,0,0,0,0|2,0,0]=4 725 B12R1.48 COC1=C(Br)C=C(C(=O)O)C=N1 C10744 [0,2,0,0,0,0|1,0,0]=3 726 B12R1.48 COC1=C(Cl)C=C(C(=O)O)N=C1 P11632 [0,2,0,0,0,0|1,0,0]=3 727 B12R1.48 COC1=C(O)C=C(B(O)O)C=C1 R10067 [0,2,0,0,0,0|1,0,1]=4 728 B12R1.48 COC1=COC(C(=O)O)=CC1=O A11938 [0,2,0,0,0,0|1,0,0]=3 729 B12R1.48 COC1=NC=C(C(=O)O)C=C1C 72479 [0,2,0,0,0,0|1,0,0]=3 730 B12R1.48 N#CC1=C(Br)C=C(C(=O)O)C=C1 AB6375 [0,2,0,0,0,0|1,0,0]=3 731 B12R1.48 N#CC1=C(Cl)C=C(C(=O)O)C=C1 95966 [0,2,0,0,0,0|1,0,0]=3 732 B12R1.48 N#CC1=C(N)C=C(C(=O)O)C=C1 CL9384 [0,2,0,0,0,0|1,0,0]=3 733 B12R1.48 N#CC1=CC=C(C(=O)O)N=C1Cl O11578 [0,2,0,0,0,0|2,0,0]=4 734 B12R1.48 O=C(O)C1=CC(F)=C(CBr)C=C1 C90464 [0,2,0,0,0,0|1,0,0]=3 735 B12R1.48 O=C(O)C1=CC(F)=C(CO)C=C1 W10220 [0,2,0,0,0,0|0,0,0]=2 736 B12R1.48 O=C(O)C1=CC(O)=C(CO)C=C1 D80533 [0,2,0,0,0,0|0,0,0]=2 737 B12R1.48 O=CC1=C(Br)C=C(C(=O)O)C=C1 AC1747 [0,2,0,0,0,0|0,0,1]=3 738 B12R1.48 O=CC1=C(Cl)C=C(C(=O)O)C=C1 CL9202 [0,2,0,0,0,0|0,0,1]=3 739 B12R1.48 O=[N+]([O-])C1=CC(I)=C(CO)C=C1 W18242 [0,2,0,0,0,0|1,0,1]=4 740 B12R1.113 C=CCC1=CC=C(C(=O)O)C=C1 D93345 [0,2,0,0,0,0|1,0,0]=3 741 B12R1.113 CC(=O)C1=CC=C(CCBr)C=C1 CL9094 [0,2,0,0,0,0|2,0,0]=4 742 B12R1.113 CCOC1=CC=C(C(N)=S)C=C1 76923 [0,2,0,0,0,0|1,1,0]=4 743 B12R1.113 CCOC1=CC=C([C@H](C)O)C=C1 A12294 [0,2,0,0,0,0|1,0,1]=4 744 B12R1.113 CCOC1=CN=C(C(=O)O)C=C1 C77361 [0,2,0,0,0,0|1,0,0]=3 745 B12R1.113 CCOC1=CN=C(C(=O)O)C=N1 36273 [0,2,0,0,0,0|2,0,0]=4 746 B12R1.113 O=C(O)C1=CC=C(C#CBr)C=C1 W15469 [0,2,0,0,0,0|1,0,0]=3 747 B12R1.113 O=C(O)C1=CC=C(CCO)C=C1 C75240 [0,2,0,0,0,0|0,0,0]=2 748 B12R1.113 O=C(O)C1=CN=C(OCF)C=N1 W11470 [0,2,0,0,0,0|2,0,0]=4 749 B12R1.113 O\N=C/C1=CC=C(B(O)O)C=C1 I12188 [0,2,0,0,0,0|1,0,1]=4 750 B12R1.256 CC(=O)C1=CC=C([C@H](C)N)C=C1 20153 [0,2,0,0,0,0|2,0,0]=4 751 B12R1.256 CC(C)C1=NC=C(C(=O)O)C=C1 O11601 [0,2,0,0,0,0|2,0,0]=4 752 B12R1.256 C[C@H](N)C1=CC=C(C(=O)O)C=C1 F31037 [0,2,0,0,0,0|1,0,0]=3 753 B12R1.256 C[C@H](N)C1=CC=C(C(=O)O)C=C1 Y10456 [0,2,0,0,0,0|1,0,0]=3 754 B12R1.256 C[C@H](N)C1=CC=C(C(=O)O)C=C1 Y10681 [0,2,0,0,0,0|1,0,0]=3 755 B12R1.256 C[C@H](O)C1=CC=C(B(O)O)C=C1 33993 [0,2,0,0,0,0|1,0,1]=4 756 B12R1.256 C[C@H](O)C1=CC=C(C(=O)O)C=C1 C77341 [0,2,0,0,0,0|0,0,0]=2 757 B12R1.256 C[C@H](O)C1=CC=C(C(N)=O)C=C1 C71562 [0,2,0,0,0,0|1,0,0]=3 758 B12R1.256 C[C@H](O)C1=CC=C([N+](=O)[O-])C=C1 A12664 [0,2,0,0,0,0|1,0,1]=4 759 B12R1.256 NC(=O)C1=NC=C(B(O)O)C=C1 FD10248 [0,2,0,0,0,0|2,0,0]=4 760 B12R1.256 O=C(O)C1=CC=C(C(F)F)C=C1 94898 [0,2,0,0,0,0|1,0,0]=3 761 B12R1.256 O=C(O)C1=CC=C([N+](=O)[O-])C=C1 C12929 [0,2,0,0,0,0|0,0,1]=3 762 B12R1.256 O=C(O)C1=CN=C(C(=O)O)N=C1 F30096 [0,2,0,0,0,0|2,0,0]=4 763 B12R1.256 O=C(O)C1=CN=C(C(F)F)C=C1 W11081 [0,2,0,0,0,0|2,0,0]=4 764 B12R1.256 O=C(O)C1=NC=C(B(O)O)C=C1 FD7237 [0,2,0,0,0,0|1,0,0]=3 765 B12R1.256 O=C(O)C1=NN=C(C(=O)O)C=C1 37156 [0,2,0,0,0,0|2,0,0]=4 766 B12R1.452 CC1=CC(C#N)=CN=C1C(=O)O 79221 [0,2,0,0,0,0|2,0,0]=4 767 B12R1.452 CCC1=CC(F)=C(C(N)=O)C=C1 D79253 [0,2,0,0,0,0|2,0,0]=4 768 B12R1.452 COC1=CC(C)=C(C(N)=O)C=C1 F15895 [0,2,0,0,0,0|1,0,0]=3 769 B12R1.452 COC1=CC(Cl)=C(C(=O)O)N=C1 O10984 [0,2,0,0,0,0|1,0,0]=3 770 B12R1.452 COC1=CC(Cl)=C(C(C)=O)C=C1 75061 [0,2,0,0,0,0|1,0,0]=3 771 B12R1.452 COC1=CC(Cl)=C([N+](=O)[O-])C=C1 S10425 [0,2,0,0,0,0|1,0,1]=4 772 B12R1.452 COC1=CC(F)=C(B(O)O)C=C1 67888 [0,2,0,0,0,0|1,0,1]=4 773 B12R1.452 COC1=CC(F)=C(C(=O)O)N=C1 80030 [0,2,0,0,0,0|1,0,0]=3 774 B12R1.452 COC1=CC(N)=C(C(=O)O)C=N1 P11630 [0,2,0,0,0,0|1,0,0]=3 775 B12R1.452 COC1=CC(N)=C(C(C)=O)C=C1 52087 [0,2,0,0,0,0|1,0,0]=3 776 B12R1.452 COC1=CC=C(C(=O)O)C(=O)N1 D80739 [0,2,0,0,0,0|1,0,0]=3 777 B12R1.452 COC1=CC=C(C(=O)O)C(Br)=N1 O10693 [0,2,0,0,0,0|1,0,0]=3 778 B12R1.452 COC1=CC=C(C(=O)O)C(Cl)=N1 89001 [0,2,0,0,0,0|1,0,0]=3 779 B12R1.452 COC1=CN=C(C(=O)O)C(N)=C1 N17024 [0,2,0,0,0,0|1,0,0]=3 780 B12R1.452 COC1=CN=C(C(=O)O)C(N)=N1 55145 [0,2,0,0,0,0|2,0,0]=4 781 B12R1.452 COC1=NC(C)=C(C(=O)O)C=C1 24363 [0,2,0,0,0,0|1,0,0]=3 782 B12R1.452 COC1=NC(N)=C(C(=O)O)C=C1 F31118 [0,2,0,0,0,0|1,0,0]=3 783 B12R1.452 CSC1=CC(C)=C(C(=O)O)C=C1 75574 [0,2,0,0,0,0|0,1,0]=3 784 B12R1.452 N#CC1=CC(F)=C(C(=O)O)N=C1 79772 [0,2,0,0,0,0|2,0,0]=4 785 B12R1.452 N#CC1=CC(I)=C(C(=O)O)C=C1 80126 [0,2,0,0,0,0|1,0,0]=3 786 B12R1.452 N#CC1=CC(N)=C(C(=O)O)C=C1 CL9383 [0,2,0,0,0,0|1,0,0]=3 787 B12R1.452 O=CC1=CC(Cl)=C(C(=O)O)C=C1 N10574 [0,2,0,0,0,0|0,0,1]=3 788 B12R1.452 O=CC1=CC(F)=C(C(=O)O)C=C1 D95103 [0,2,0,0,0,0|0,0,1]=3 789 B12R1.9 COS(=O)(=O)C1=CC=C(C)C=C1 D72514 [0,2,0,0,0,0|2,0,0]=4 790 B12R1.9 COS(=O)(=O)C1=CC=C(Cl)C=C1 D93386 [0,2,0,0,0,0|2,0,0]=4 791 B12R1.126 CC1=CC(O)=C(S(=O)(=O)O)C=C1 N11832 [0,2,0,0,0,0|2,0,0]=4 792 B12R1.56 CC1=NC=C(C(=O)O)C=C1C#N S10273 [0,2,0,0,0,0|2,0,0]=4 793 B12R1.56 CCC1=C(N)C=CC(C(=O)O)=C1 34928 [0,2,0,0,0,0|1,0,0]=3 794 B12R1.56 COC1=C(Br)C=CC(C(C)=O)=C1 W17726 [0,2,0,0,0,0|2,0,0]=4 795 B12R1.56 COC1=C(Br)C=NC(C(=O)O)=C1 54904 [0,2,0,0,0,0|2,0,0]=4 796 B12R1.56 COC1=C(C)C=CC(C(C)=O)=C1 CL9533 [0,2,0,0,0,0|2,0,0]=4 797 B12R1.56 COC1=C(Cl)C=CC(C(=O)O)=N1 36093 [0,2,0,0,0,0|2,0,0]=4 798 B12R1.56 COC1=C(I)C=CC(C(=O)O)=C1 AT15468 [0,2,0,0,0,0|1,0,0]=3 799 B12R1.56 COC1=C(O)C=CC(B(O)O)=C1 Y13466 [0,2,0,0,0,0|1,0,1]=4 800 B12R1.56 COC1=CC(C(=O)O)=CN=C1I W12409 [0,2,0,0,0,0|2,0,0]=4 801 B12R1.56 CSC1=C(Cl)C=CC(C(=O)O)=C1 AR3416 [0,2,0,0,0,0|1,0,0]=3 802 B12R1.56 N#CC1=C(N)C=CC(C(=O)O)=C1 CL9205 [0,2,0,0,0,0|1,0,0]=3 803 B12R1.56 N#CC1=C(O)C=CC(C(=O)O)=C1 59544 [0,2,0,0,0,0|0,0,0]=2 804 B12R1.56 N#CC1=CC(C(=O)O)=CN=C1Cl AC2146 [0,2,0,0,0,0|2,0,0]=4 805 B12R1.56 N#CC1=CC(C(=O)O)=CN=C1O AC4208 [0,2,0,0,0,0|1,0,0]=3 806 B12R1.232 CC(=O)C1=C(O)C=C(O)C(O)=C1 W17281 [0,2,0,0,0,0|1,0,0]=3 807 B12R1.232 CC(=O)C1=CC(Br)=C(C)C=C1N 56175 [0,2,0,0,0,0|2,0,0]=4 808 B12R1.232 CC(=O)C1=CC(Br)=C(F)C=C1O 58091 [0,2,0,0,0,0|2,0,0]=4 809 B12R1.232 CC(=O)C1=CC(Br)=C(O)C=C1O Y13503 [0,2,0,0,0,0|1,0,0]=3 810 B12R1.232 CC(=O)C1=CC(Cl)=C(Cl)C=C1C C11047 [0,2,0,0,0,0|2,0,0]=4 811 B12R1.232 CC(=O)C1=CC(Cl)=C(Cl)C=C1Cl W18042 [0,2,0,0,0,0|2,0,0]=4 812 B12R1.232 CC(=O)C1=CC(Cl)=C(F)C=C1N AC1207 [0,2,0,0,0,0|2,0,0]=4 813 B12R1.232 CC(=O)C1=CC(F)=C(Br)C=C1O W17159 [0,2,0,0,0,0|2,0,0]=4 814 B12R1.232 CC1=C(Br)C=C(C(=O)O)C(O)=C1 W19041 [0,2,0,0,0,0|1,0,0]=3 815 B12R1.232 CC1=C(C)N=C(Cl)C(C(=O)O)=C1 O10731 [0,2,0,0,0,0|2,0,0]=4 816 B12R1.232 CC1=C(F)C=C(C(=O)O)C(N)=C1 D78272 [0,2,0,0,0,0|1,0,0]=3 817 B12R1.232 CC1=CC(Br)=C(N)C=C1C(=O)O 72855 [0,2,0,0,0,0|1,0,0]=3 818 B12R1.232 CC1=CC(C(=O)O)=C(C)C=C1N N10396 [0,2,0,0,0,0|1,0,0]=3 819 B12R1.232 CC1=CC(C(=O)O)=C(C)C=C1O AC5772 [0,2,0,0,0,0|0,0,0]=2 820 B12R1.232 CC1=CC(C)=C(Br)C=C1C(=O)O N12774 [0,2,0,0,0,0|1,0,0]=3 821 B12R1.232 CC1=CC(Cl)=C(Cl)C=C1C(=O)O N13250 [0,2,0,0,0,0|1,0,0]=3 822 B12R1.232 CC1=CC(F)=C(Br)C=C1C(=O)O 79589 [0,2,0,0,0,0|1,0,0]=3 823 B12R1.232 CC1=CC(N)=C(C(=O)O)C=C1O 85911 [0,2,0,0,0,0|1,0,0]=3 824 B12R1.232 NC1=C(C(=O)O)C=C(Cl)C(Cl)=N1 P20935 [0,2,0,0,0,0|2,0,0]=4 825 B12R1.232 NC1=C(C(=O)O)C=C(O)C(O)=C1 AB8031 [0,2,0,0,0,0|0,0,0]=2 826 B12R1.232 NC1=C(Cl)C=C(Cl)C(C(=O)O)=C1 34912 [0,2,0,0,0,0|1,0,0]=3 827 B12R1.232 NC1=CC(Br)=C(Br)C=C1C(=O)O 34910 [0,2,0,0,0,0|1,0,0]=3 828 B12R1.232 NC1=CC(Br)=C(F)C=C1C(=O)O 54728 [0,2,0,0,0,0|1,0,0]=3 829 B12R1.232 NC1=CC(Br)=C(F)C=C1C(=O)O AC4169 [0,2,0,0,0,0|1,0,0]=3 830 B12R1.232 NC1=CC(Cl)=C(F)C=C1C(=O)O CL9060 [0,2,0,0,0,0|1,0,0]=3 831 B12R1.232 NC1=CC(F)=C(Cl)C=C1C(=O)O C74806 [0,2,0,0,0,0|1,0,0]=3 832 B12R1.232 NC1=CC([N+](=O)[O-])=C(F)C=C1O D70008 [0,2,0,0,0,0|1,0,1]=4 833 B12R1.232 O=C(O)C1=C(Cl)C=C(Cl)C(Cl)=N1 36047 [0,2,0,0,0,0|2,0,0]=4 834 B12R1.232 O=C(O)C1=C(Cl)C=C(F)C(Br)=N1 D70737 [0,2,0,0,0,0|2,0,0]=4 835 B12R1.232 O=C(O)C1=CC(Br)=C(Br)C=C1F AB10078 [0,2,0,0,0,0|1,0,0]=3 836 B12R1.232 O=C(O)C1=CC(Br)=C(F)C=C1Cl W17792 [0,2,0,0,0,0|1,0,0]=3 837 B12R1.232 O=C(O)C1=CC(Br)=C(F)C=C1F F14505 [0,2,0,0,0,0|1,0,0]=3 838 B12R1.232 O=C(O)C1=CC(Br)=C(O)C=C1F W15314 [0,2,0,0,0,0|0,0,0]=2 839 B12R1.232 O=C(O)C1=CC(Cl)=C(F)C=C1O 87142 [0,2,0,0,0,0|1,0,0]=3 840 B12R1.232 O=C(O)C1=CC(Cl)=C(O)C=C1O 81000 [0,2,0,0,0,0|0,0,0]=2 841 B12R1.232 O=C(O)C1=CC(F)=C(F)C=C1O C73895 [0,2,0,0,0,0|1,0,0]=3 842 B12R1.232 O=C(O)C1=CC(I)=C(F)C=C1Cl C10866 [0,2,0,0,0,0|1,0,0]=3 843 B12R1.367 CCC(=O)C1=CC(C)=C(F)C=C1 N14308 [0,2,0,0,0,0|2,0,0]=4 844 B12R1.367 CCC(=O)C1=CC(F)=C(C)C=C1 N14054 [0,2,0,0,0,0|2,0,0]=4 845 B12R1.367 CNC(=O)C1=CC(F)=C(N)C=C1 AB8036 [0,2,0,0,0,0|2,0,0]=4 846 B12R1.367 COC(=O)C1=CC(Br)=C(C)C=N1 D82594 [0,2,0,0,0,0|2,0,0]=4 847 B12R1.367 COC(=O)C1=CC(Br)=C(C)N=C1 89893 [0,2,0,0,0,0|2,0,0]=4 848 B12R1.367 COC(=O)C1=CC(Br)=C(F)N=C1 52415 [0,2,0,0,0,0|2,0,0]=4 849 B12R1.367 COC(=O)C1=CC(C)=C(Br)C=N1 27161 [0,2,0,0,0,0|2,0,0]=4 850 B12R1.367 COC(=O)C1=CC(Cl)=C(C)C=N1 36387 [0,2,0,0,0,0|2,0,0]=4 851 B12R1.367 COC(=O)C1=CC(Cl)=C(I)C=C1 71900 [0,2,0,0,0,0|1,0,0]=3 852 B12R1.367 COC(=O)C1=CC(I)=C(N)N=C1 D74443 [0,2,0,0,0,0|2,0,0]=4 853 B12R1.367 COC(=O)C1=CC(O)=C(Cl)C=C1 26246 [0,2,0,0,0,0|1,0,0]=3 854 B12R1.367 COC(=O)C1=CC=C(Br)C(Br)=N1 D94492 [0,2,0,0,0,0|2,0,0]=4 855 B12R1.367 COC(=O)C1=CC=C(C)C(Br)=N1 27120 [0,2,0,0,0,0|2,0,0]=4 856 B12R1.367 COC(=O)C1=CC=C(Cl)C(Br)=N1 D70929 [0,2,0,0,0,0|2,0,0]=4 857 B12R1.367 COC(=O)C1=CC=C(N)C(Br)=N1 F30314 [0,2,0,0,0,0|2,0,0]=4 858 B12R1.367 COC(=O)C1=CC=C(O)C(Br)=N1 A10575 [0,2,0,0,0,0|1,0,0]=3 859 B12R1.367 COC(=O)C1=CN=C(Br)C(C)=C1 C71741 [0,2,0,0,0,0|2,0,0]=4 860 B12R1.367 COC(=O)C1=CN=C(Br)C(Cl)=C1 AT10809 [0,2,0,0,0,0|2,0,0]=4 861 B12R1.367 COC(=O)C1=CN=C(C)C(C)=C1 W18451 [0,2,0,0,0,0|2,0,0]=4 862 B12R1.367 COC(=O)C1=CN=C(Cl)C(N)=C1 C74015 [0,2,0,0,0,0|2,0,0]=4 863 B12R1.367 COC(=O)C1=CN=C(I)C(O)=C1 P14147 [0,2,0,0,0,0|2,0,0]=4 864 B12R1.367 COC(=O)C1=CN=C(N)C(C)=C1 D71942 [0,2,0,0,0,0|2,0,0]=4 865 B12R1.367 COC(=O)C1=CN=C(N)C(O)=C1 C72053 [0,2,0,0,0,0|2,0,0]=4 866 B12R1.367 COC(=O)C1=CN=C(O)C(O)=C1 P13461 [0,2,0,0,0,0|1,0,0]=3 867 B12R1.367 COC(=O)C1=NC(C)=C(Br)C=C1 O11955 [0,2,0,0,0,0|2,0,0]=4 868 B12R1.367 COC(=O)C1=NC(C)=C(F)C=C1 P15512 [0,2,0,0,0,0|2,0,0]=4 869 B12R1.367 COC(=O)C1=NC(Cl)=C(Br)C=C1 27103 [0,2,0,0,0,0|2,0,0]=4 870 B12R1.367 COC(=O)C1=NC(N)=C(Cl)C=C1 D80838 [0,2,0,0,0,0|2,0,0]=4 871 B12R1.367 COC(=O)C1=NC(O)=C(O)C=C1 P10795 [0,2,0,0,0,0|1,0,0]=3 872 B12R1.367 COC(=O)C1=NC=C(C)C(N)=C1 F18534 [0,2,0,0,0,0|2,0,0]=4 873 B12R1.367 COC(=O)C1=NC=C(N)C(N)=C1 RB3263 [0,2,0,0,0,0|2,0,0]=4 874 B12R1.367 COC(=O)C1=NC=C(O)C(O)=C1 CS1665 [0,2,0,0,0,0|1,0,0]=3 875 B12R1.367 NCC(=O)C1=CC(F)=C(Br)C=C1 80144 [0,2,0,0,0,0|2,0,0]=4 876 B12R1.367 NCC(=O)C1=CC(O)=C(O)C=C1 A11075 [0,2,0,0,0,0|1,0,0]=3 877 B12R1.367 NC[C@H](O)C1=CC(O)=C(O)C=C1 A12589 [0,2,0,0,0,0|1,0,1]=4 878 B12R1.367 O=C(CBr)C1=CC(F)=C(Cl)C=C1 D87891 [0,2,0,0,0,0|2,0,0]=4 879 B12R1.367 O=C(CCl)C1=CC(F)=C(Br)C=C1 80196 [0,2,0,0,0,0|2,0,0]=4 880 B12R1.893 CC(=O)C1=C(F)C(F)=C(Br)C=C1 95672 [0,2,0,0,0,0|2,0,0]=4 881 B12R1.893 CC(=O)C1=CC=C(F)C(F)=C1Br 95669 [0,2,0,0,0,0|2,0,0]=4 882 B12R1.893 CC1=C(Br)C=CC(C(=O)O)=C1F F13685 [0,2,0,0,0,0|1,0,0]=3 883 B12R1.893 CC1=C(Br)C=CC(C(=O)O)=C1N AC8749 [0,2,0,0,0,0|1,0,0]=3 884 B12R1.893 CC1=C(C)C(C)=C(C(=O)O)C=C1 F11631 [0,2,0,0,0,0|1,0,0]=3 885 B12R1.893 CC1=C(C)C(I)=C(C(=O)O)C=C1 87931 [0,2,0,0,0,0|1,0,0]=3 886 B12R1.893 CC1=C(C)C(O)=C(C(=O)O)C=C1 D95028 [0,2,0,0,0,0|1,0,0]=3 887 B12R1.893 CC1=C(Cl)C=CC(C(=O)O)=C1F A10576 [0,2,0,0,0,0|1,0,0]=3 888 B12R1.893 CC1=C(Cl)C=CC(C(=O)O)=C1N F16600 [0,2,0,0,0,0|1,0,0]=3 889 B12R1.893 CC1=C(F)C=CC(C(=O)O)=C1F 24999 [0,2,0,0,0,0|1,0,0]=3 890 B12R1.893 CC1=C(N)C(C)=C(C(=O)O)C=C1 93860 [0,2,0,0,0,0|1,0,0]=3 891 B12R1.893 CC1=C(N)C=CC(C(=O)O)=C1C 34920 [0,2,0,0,0,0|1,0,0]=3 892 B12R1.893 CC1=C(O)C=CC([N+](=O)[O-])=C1F AC1774 [0,2,0,0,0,0|1,0,1]=4 893 B12R1.893 CC1=CC=C(C(=O)O)C(Cl)=C1Cl D86550 [0,2,0,0,0,0|1,0,0]=3 894 B12R1.893 CC1=CC=C(C(=O)O)C(F)=C1I 55471 [0,2,0,0,0,0|1,0,0]=3 895 B12R1.893 CC1=CC=C(C(=O)O)C(N)=C1Br 54754 [0,2,0,0,0,0|1,0,0]=3 896 B12R1.893 NC1=C(Br)C(Cl)=CC=C1C(=O)O Y13550 [0,2,0,0,0,0|1,0,0]=3 897 B12R1.893 NC1=C(C(=O)O)C=CC(Cl)=C1O D80855 [0,2,0,0,0,0|1,0,0]=3 898 B12R1.893 NC1=C(Cl)C(Cl)=CC=C1C(=O)O O10647 [0,2,0,0,0,0|1,0,0]=3 899 B12R1.893 NC1=CC=C(C(=O)O)C(Cl)=C1F A10783 [0,2,0,0,0,0|1,0,0]=3 900 B12R1.893 O=C(O)C1=C(Cl)C(Cl)=C(Br)C=C1 98179 [0,2,0,0,0,0|1,0,0]=3 901 B12R1.893 O=C(O)C1=C(F)C(F)=C(I)C=C1 C75339 [0,2,0,0,0,0|1,0,0]=3 902 B12R1.893 O=C(O)C1=C(O)C(F)=C(Br)C=C1 AT11230 [0,2,0,0,0,0|1,0,0]=3 903 B12R1.893 O=C(O)C1=C(O)C(O)=C(Br)C=C1 53229 [0,2,0,0,0,0|1,0,0]=3 904 B12R1.893 O=C(O)C1=CC=C(Cl)C(Br)=C1Cl 36583 [0,2,0,0,0,0|1,0,0]=3 905 B12R1.893 O=C(O)C1=CC=C(F)C(Br)=C1F C10544 [0,2,0,0,0,0|1,0,0]=3 906 B12R1.893 O=C(O)C1=CC=C(O)C(F)=C1F CK2226 [0,2,0,0,0,0|0,0,0]=2 907 B12R1.893 O=C(O)C1=CC=C(O)C(O)=C1Cl F19892 [0,2,0,0,0,0|0,0,0]=2 908 B12R1.893 O=C(O)C1=CN=C(Cl)C(F)=C1Cl P16057 [0,2,0,0,0,0|2,0,0]=4 909 B12R1.893 O=C(O)C1=CN=C(F)C(F)=C1Cl 26382 [0,2,0,0,0,0|2,0,0]=4 910 B12R1.893 O=[N+]([O-])C1=CC=C(O)C(Cl)=C1Cl F19867 [0,2,0,0,0,0|1,0,1]=4 911 B12R1.893 O=[N+]([O-])C1=CC=C(O)C(Cl)=C1F AC1562 [0,2,0,0,0,0|1,0,1]=4 912 B12R1.893 O=[N+]([O-])C1=CC=C(O)C(F)=C1Cl C13902 [0,2,0,0,0,0|1,0,1]=4 913 B12R1.1005 CC(=O)C1=CC(Br)=C(N)C(Br)=C1 20787 [0,2,0,0,0,0|2,0,0]=4 914 B12R1.1005 CC1=C(F)C=C(C(=O)O)C=C1N 34936 [0,2,0,0,0,0|1,0,0]=3 915 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1Br 34977 [0,2,0,0,0,0|1,0,0]=3 916 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1C D94858 [0,2,0,0,0,0|1,0,0]=3 917 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1N 34923 [0,2,0,0,0,0|1,0,0]=3 918 B12R1.1005 CC1=CC(C(N)=O)=CC(C)=C1Br 55755 [0,2,0,0,0,0|2,0,0]=4 919 B12R1.1005 CC1=CC(C(N)=O)=CC(C)=C1I C12877 [0,2,0,0,0,0|2,0,0]=4 920 B12R1.1005 NC1=C(F)C=C(C(=O)O)C=C1F 34916 [0,2,0,0,0,0|1,0,0]=3 921 B12R1.1005 O=C(O)C1=CC(Cl)=C(O)C(O)=C1 W17154 [0,2,0,0,0,0|0,0,0]=2 922 B12R1.1005 O=C(O)C1=CC(F)=C(Br)C(F)=C1 CL9597 [0,2,0,0,0,0|1,0,0]=3 923 B12R1.1005 O=C(O)C1=CC(F)=C(O)C(F)=C1 35062 [0,2,0,0,0,0|0,0,0]=2 924 B12R1.1005 OB(O)C1=CC(Cl)=C(O)C(Cl)=C1 36828 [0,2,0,0,0,0|1,0,1]=4 925 B12R1.1005 OB(O)C1=CC(Cl)=C(O)C(F)=C1 N11785 [0,2,0,0,0,0|1,0,1]=4 926 B12R1.1005 OB(O)C1=CC(F)=C(O)C(F)=C1 I10821 [0,2,0,0,0,0|1,0,1]=4 927 B12R1.16 CC1=CC=C(C(=O)CCCl)C=C1 D77805 [0,2,0,0,0,0|2,0,0]=4 928 B12R1.16 CCCC(=O)C1=CC=C(C)C=C1 N13972 [0,2,0,0,0,0|2,0,0]=4 929 B12R1.16 CCOC(=O)C1=CC=C(I)C=C1 D77688 [0,2,0,0,0,0|1,0,0]=3 930 B12R1.16 CCOC(=O)C1=CC=[N+]([O-])C=C1 AB21610 [0,2,0,0,0,0|1,0,1]=4 931 B12R1.16 CCOC(=O)C1=CN=C(F)C=C1 88966 [0,2,0,0,0,0|2,0,0]=4 932 B12R1.16 CCOC(=O)C1=NC=C(Cl)C=C1 C72155 [0,2,0,0,0,0|2,0,0]=4 933 B12R1.16 CCOC(=O)C1=NC=C(N)C=C1 D86980 [0,2,0,0,0,0|2,0,0]=4 934 B12R1.16 CNC[C@H](O)C1=CC=C(O)C=C1 42875 [0,2,0,0,0,0|1,0,1]=4 935 B12R1.1703 C=C(CO)C1=C(F)C=C(F)C=C1 D94514 [0,2,0,0,0,0|2,0,0]=4 936 B12R1.1703 CC1=C(C(=O)NN)C=CC(Cl)=C1 D97392 [0,2,0,0,0,0|2,0,0]=4 937 B12R1.1703 CC1=CC(C)=C(C(=O)CBr)C=C1 D87870 [0,2,0,0,0,0|2,0,0]=4 938 B12R1.1703 CCC(=O)C1=C(Cl)C=C(Cl)C=C1 T70851 [0,2,0,0,0,0|2,0,0]=4 939 B12R1.1703 CCC(=O)C1=C(F)C=C(Cl)C=C1 55949 [0,2,0,0,0,0|2,0,0]=4 940 B12R1.1703 CNC(=O)C1=C(Br)C=C(F)C=C1 75450 [0,2,0,0,0,0|2,0,0]=4 941 B12R1.1703 CNC(=O)C1=C(F)C=C(I)C=C1 35420 [0,2,0,0,0,0|2,0,0]=4 942 B12R1.1703 COC(=O)C1=C(Br)C=C(Cl)C=N1 BL008119 [0,2,0,0,0,0|2,0,0]=4 943 B12R1.1703 COC(=O)C1=C(Br)C=C(Cl)N=C1 F11974 [0,2,0,0,0,0|2,0,0]=4 944 B12R1.1703 COC(=O)C1=C(Br)C=C(F)C=N1 85649 [0,2,0,0,0,0|2,0,0]=4 945 B12R1.1703 COC(=O)C1=C(Br)C=C(O)C=C1 C90903 [0,2,0,0,0,0|0,0,0]=2 946 B12R1.1703 COC(=O)C1=C(C)C=C(C)N=C1 D82510 [0,2,0,0,0,0|2,0,0]=4 947 B12R1.1703 COC(=O)C1=C(C)C=C(I)C=C1 F19913 [0,2,0,0,0,0|1,0,0]=3 948 B12R1.1703 COC(=O)C1=C(C)N=C(Cl)C=C1 F16760 [0,2,0,0,0,0|2,0,0]=4 949 B12R1.1703 COC(=O)C1=C(C)N=C(F)C=C1 C71884 [0,2,0,0,0,0|2,0,0]=4 950 B12R1.1703 COC(=O)C1=C(C)N=C(N)C=C1 O11963 [0,2,0,0,0,0|2,0,0]=4 951 B12R1.1703 COC(=O)C1=C(C)NC(=O)C=C1 32384 [0,2,0,0,0,0|1,0,1]=4 952 B12R1.1703 COC(=O)C1=C(Cl)C=C(C)C=C1 C90285 [0,2,0,0,0,0|1,0,0]=3 953 B12R1.1703 COC(=O)C1=C(Cl)C=C(F)C=N1 BL010110 [0,2,0,0,0,0|2,0,0]=4 954 B12R1.1703 COC(=O)C1=C(Cl)C=C(N)C=N1 BL010141 [0,2,0,0,0,0|2,0,0]=4 955 B12R1.1703 COC(=O)C1=C(Cl)C=C(N)N=C1 C72055 [0,2,0,0,0,0|2,0,0]=4 956 B12R1.1703 COC(=O)C1=C(F)C=C(O)C=N1 P12276 [0,2,0,0,0,0|1,0,0]=3 957 B12R1.1703 COC(=O)C1=C(F)N=C(Cl)C=C1 O11966 [0,2,0,0,0,0|2,0,0]=4 958 B12R1.1703 COC(=O)C1=C(I)C=C(C)C=C1 C90901 [0,2,0,0,0,0|1,0,0]=3 959 B12R1.1703 COC(=O)C1=C(I)C=C(F)C=C1 W19258 [0,2,0,0,0,0|1,0,0]=3 960 B12R1.1703 COC(=O)C1=C(N)C=C(C)N=C1 P18775 [0,2,0,0,0,0|2,0,0]=4 961 B12R1.1703 COC(=O)C1=CC=C(C)N=C1Br 27048 [0,2,0,0,0,0|2,0,0]=4 962 B12R1.1703 COC(=O)C1=CC=C(Cl)N=C1Br Y11556 [0,2,0,0,0,0|2,0,0]=4 963 B12R1.1703 COC(=O)C1=CC=C(N)N=C1Cl AC8698 [0,2,0,0,0,0|2,0,0]=4 964 B12R1.1703 COC(=O)C1=CN=C(Br)C=C1Cl 28017 [0,2,0,0,0,0|2,0,0]=4 965 B12R1.1703 COC(=O)C1=CN=C(Cl)C=C1C 68238 [0,2,0,0,0,0|2,0,0]=4 966 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1F 24406 [0,2,0,0,0,0|2,0,0]=4 967 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1O 76668 [0,2,0,0,0,0|2,0,0]=4 968 B12R1.1703 COC(=O)C1=NC=C(Cl)C=C1N F14180 [0,2,0,0,0,0|2,0,0]=4 969 B12R1.1703 COC(=O)C1=NC=C(F)C=C1C S10377 [0,2,0,0,0,0|2,0,0]=4 970 B12R1.1703 COC(=O)C1=NC=C(F)C=C1N 85648 [0,2,0,0,0,0|2,0,0]=4 971 B12R1.1703 N[C@@H](CO)C1=C(Cl)C=C(O)C=C1 Y12208 [0,2,0,0,0,0|1,0,1]=4 972 B12R1.1703 N[C@@H](CO)C1=C(Cl)C=C(O)C=C1 Y12209 [0,2,0,0,0,0|1,0,1]=4 973 B12R1.1703 N\C(=N/O)C1=C(Cl)C=C(Cl)C=C1 75338 [0,2,0,0,0,0|2,0,0]=4 974 B12R1.1703 O=C(CBr)C1=C(Cl)C=C(F)C=C1 78988 [0,2,0,0,0,0|2,0,0]=4 975 B12R1.1703 O=C(CBr)C1=C(O)C=C(O)C=C1 T70646 [0,2,0,0,0,0|1,0,0]=3 976 B12R1.1703 O=C(CCl)C1=C(F)C=C(Cl)C=C1 W16973 [0,2,0,0,0,0|2,0,0]=4 977 B12R1.1703 O=C(CO)C1=C(Cl)C=C(Cl)C=C1 AC4055 [0,2,0,0,0,0|1,0,0]=3 978 B12R1.57 CCC1=C(C(=O)O)C=CC(Br)=C1 D95188 [0,2,0,0,0,0|1,0,0]=3 979 B12R1.57 CCC1=C(C(=O)O)C=CC(N)=C1 D70908 [0,2,0,0,0,0|1,0,0]=3 980 B12R1.57 COC1=C(C(=O)O)C=CC(Br)=N1 FD10660 [0,2,0,0,0,0|2,0,0]=4 981 B12R1.57 COC1=C(C(=O)O)C=CC(C)=N1 W17747 [0,2,0,0,0,0|2,0,0]=4 982 B12R1.57 COC1=C(C(=O)O)C=CC(Cl)=N1 C76053 [0,2,0,0,0,0|2,0,0]=4 983 B12R1.57 COC1=C(C(=O)O)C=CC(N)=N1 F52096 [0,2,0,0,0,0|2,0,0]=4 984 B12R1.57 COC1=CC(Br)=CN=C1C(=O)O 97690 [0,2,0,0,0,0|2,0,0]=4 985 B12R1.57 COC1=CC(Cl)=CN=C1C(=O)O P15419 [0,2,0,0,0,0|2,0,0]=4 986 B12R1.57 N#CC1=C(C(=O)O)C=CC(F)=C1 22725 [0,2,0,0,0,0|1,0,0]=3 987 B12R1.57 NNC1=C(C(=O)O)C=CC(Br)=C1 Y14877 [0,2,0,0,0,0|1,0,0]=3 988 B12R1.57 O=C(O)C1=C(CO)C=C(Br)C=C1 C76109 [0,2,0,0,0,0|1,0,0]=3 989 B12R1.57 O=CC1=C(C(=O)O)C=CC(F)=C1 C71597 [0,2,0,0,0,0|1,0,0]=3 990 B12R1.57 O=CC1=CC(Cl)=NC=C1C(=O)O D85827 [0,2,0,0,0,0|2,0,0]=4 991 B12R1.57 O=[N+]([O-])C1=C(CO)C=C(O)C=C1 TD1016 [0,2,0,0,0,0|1,0,1]=4 992 B12R1.1000 CC(=O)C1=C(F)C=C(Br)C=C1O 80620 [0,2,0,0,0,0|2,0,0]=4 993 B12R1.1000 CC(=O)C1=C(F)C=C(Cl)C=C1O C71371 [0,2,0,0,0,0|2,0,0]=4 994 B12R1.1000 CC(=O)C1=C(F)C=C(F)C=C1N C73141 [0,2,0,0,0,0|2,0,0]=4 995 B12R1.1000 CC1=CC(Br)=CC(Cl)=C1C(=O)O D86078 [0,2,0,0,0,0|1,0,0]=3 996 B12R1.1000 CC1=CC(Br)=CC(F)=C1C(N)=O 90653 [0,2,0,0,0,0|2,0,0]=4 997 B12R1.1000 CC1=CC(Cl)=CC(C)=C1C(=O)O N12990 [0,2,0,0,0,0|1,0,0]=3 998 B12R1.1000 CC1=CC(Cl)=CC(Cl)=C1C(=O)O D96191 [0,2,0,0,0,0|1,0,0]=3 999 B12R1.1000 CC1=CC(Cl)=CC(F)=C1C(=O)O 95590 [0,2,0,0,0,0|1,0,0]=3 1000 B12R1.1000 CC1=CC(Cl)=NC(C)=C1C(=O)O 84506 [0,2,0,0,0,0|2,0,0]=4 1001 B12R1.1000 CC1=CC(F)=C(C(=O)O)C(F)=C1 22738 [0,2,0,0,0,0|1,0,0]=3 1002 B12R1.1000 CC1=CC(O)=CC(O)=C1C(=O)O C75284 [0,2,0,0,0,0|0,0,0]=2 1003 B12R1.1000 NC1=C(C(=O)O)C(Cl)=NC(Cl)=C1 W16854 [0,2,0,0,0,0|2,0,0]=4 1004 B12R1.1000 NC1=CC(Br)=CC(Br)=C1C(=O)O 25210 [0,2,0,0,0,0|1,0,0]=3 1005 B12R1.1000 NC1=CC(F)=C(C(=O)O)C(F)=C1 F14513 [0,2,0,0,0,0|1,0,0]=3 1006 B12R1.1000 O=C(O)C1=C(Cl)C=C(O)C=C1Cl C15827 [0,2,0,0,0,0|0,0,0]=2 1007 B12R1.1000 O=C(O)C1=C(F)C=C(Br)C=C1O AT11231 [0,2,0,0,0,0|1,0,0]=3 1008 B12R1.1000 O=C(O)C1=C(F)C=C(F)C=C1O 86984 [0,2,0,0,0,0|1,0,0]=3 1009 B12R1.1000 O=[N+]([O-])C1=C(F)C=C(O)C=C1F 21065 [0,2,0,0,0,0|1,0,1]=4 1010 B12R1.1000 OB(O)C1=C(F)C=C(O)C=C1F Y10145 [0,2,0,0,0,0|1,0,1]=4 1011 B10R2.320 O=C1CC2=C1C=CC=C2 67963 [1,0,0,1,0,0|1,0,0]=3 1012 B12R2.606 CC1=CC2=C(C=C(O)C=C2)O1 F21500 [0,0,0,1,0,1|1,0,0]=3 1013 B12R2.606 CC1=CC2=C(C=C1)N=C(N)O2 52985 [0,0,0,1,0,1|2,0,0]=4 1014 B12R2.606 CC1=CC2=C(C=C1)N=C(S)O2 T72123 [0,0,0,1,0,1|1,1,0]=4 1015 B12R2.606 CC1=CC2=C(C=C1)NC(=O)S2 F15190 [0,0,0,1,0,1|1,1,0]=4 1016 B12R2.606 CC1=NC2=C(C=CC(O)=C2)N1 C75100 [0,0,0,1,0,1|2,0,0]=4 1017 B12R2.606 CC1=NC2=C(C=CC(O)=C2)O1 I10199 [0,0,0,1,0,1|2,0,0]=4 1018 B12R2.606 ClC1=NC2=C(C=C(Br)C=C2)O1 AC2127 [0,0,0,1,0,1|2,0,0]=4 1019 B12R2.606 NC1=CC2=C(C=C1)CC(=O)C2 88115 [0,0,0,1,0,1|2,0,0]=4 1020 B12R2.606 NC1=CC2=C(C=C1)OC(=O)C2 D82169 [0,0,0,1,0,1|2,0,0]=4 1021 B12R2.606 NC1=NC2=C(C=C(Br)C=C2)O1 29673 [0,0,0,1,0,1|2,0,0]=4 1022 B12R2.606 NC1=NC2=C(C=C(I)C=C2)O1 D94563 [0,0,0,1,0,1|2,0,0]=4 1023 B12R2.606 NC1=NC2=C(C=C(O)C=C2)S1 AB8010 [0,0,0,1,0,1|1,1,0]=4 1024 B12R2.606 NC1=NC2=C(C=CC(O)=C2)N1 C75402 [0,0,0,1,0,1|2,0,0]=4 1025 B12R2.606 NC1=NC2=C(C=CC(O)=C2)S1 P10163 [0,0,0,1,0,1|2,0,0]=4 1026 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)C1 26376 [0,0,0,1,0,1|2,0,0]=4 1027 B12R2.606 O=C1CC2=C(C=C(F)C=C2)C1 53683 [0,0,0,1,0,1|2,0,0]=4 1028 B12R2.606 O=C1CC2=C(C=C(I)C=C2)N1 F30698 [0,0,0,1,0,1|2,0,0]=4 1029 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)O1 D78722 [0,0,0,1,0,1|2,0,0]=4 1030 B12R2.606 O=C1NC2=C(C=C(F)C=C2)N1 24744 [0,0,0,1,0,1|2,0,0]=4 1031 B12R2.606 O=C1NC2=C(C=C(I)C=C2)N1 A12501 [0,0,0,1,0,1|2,0,0]=4 1032 B12R2.606 O=C1NC2=C(C=CC(Br)=C2)S1 27037 [0,0,0,1,0,1|2,0,0]=4 1033 B12R2.606 O=C1NC2=C(C=CC(O)=C2)O1 D83229 [0,0,0,1,0,1|1,0,0]=3 1034 B12R2.606 O=C1OC2=C(C=CC(O)=C2)S1 C75325 [0,0,0,1,0,1|0,0,0]=2 1035 B12R2.606 OC1=CC2=C(C=C1)N=C(S)N2 W18405 [0,0,0,1,0,1|1,1,0]=4 1036 B12R2.606 OC1=CC2=C(C=C1)SC(Cl)=N2 C72085 [0,0,0,1,0,1|2,0,0]=4 1037 B12R2.606 OC1=NC2=C(C=C(F)C=C2)S1 F15029 [0,0,0,1,0,1|1,1,0]=4 1038 B12R2.1384 O=C(O)C1=CC2=C(C=C1)CC2 67661 [0,1,0,1,0,0|1,0,0]=3 1039 B12R2.612 CC1=CC2=C(C=C1)C(=O)OC2 78098 [0,1,0,1,0,0|1,0,0]=3 1040 B12R2.612 CC1=CC2=C(C=C1)C(O)=NO2 O11611 [0,1,0,1,0,0|1,0,1]=4 1041 B12R2.612 ClC1=CC2=C(C=C1)C(Cl)=NO2 27523 [0,1,0,1,0,0|2,0,0]=4 1042 B12R2.612 ClC1=NOC2=C1C=CC(Br)=C2 83077 [0,1,0,1,0,0|2,0,0]=4 1043 B12R2.612 FC1=CC2=C(C=C1)C(Cl)=NO2 27521 [0,1,0,1,0,0|2,0,0]=4 1044 B12R2.612 NC1=CC2=C(C=C1)C(=O)NN2 20323 [0,1,0,1,0,0|2,0,0]=4 1045 B12R2.612 O=C1CCC2=C1C=CC(I)=C2 78363 [0,1,0,1,0,0|2,0,0]=4 1046 B12R2.612 O=C1COC2=C1C=CC(Br)=C2 67306 [0,1,0,1,0,0|1,0,0]=3 1047 B12R2.612 O=C1NCC2=C1C=CC(Cl)=C2 83087 [0,1,0,1,0,0|2,0,0]=4 1048 B12R2.612 O=C1NOC2=C1C=CC(F)=C2 26667 [0,1,0,1,0,0|1,0,0]=3 1049 B12R2.612 O=C1NSC2=C1C=CC(F)=C2 S10563 [0,1,0,1,0,0|1,1,0]=4 1050 B12R2.612 O=C1OCC2=CC(Cl)=NC=C12 P13253 [0,1,0,1,0,0|2,0,0]=4 1051 B12R2.612 OB1OCC2=C1C=CC(O)=C2 P15896 [0,1,0,1,0,0|1,0,1]=4 1052 B12R2.612 OC1=CC2=C(C=C1)C(Br)=NN2 F52085 [0,1,0,1,0,0|2,0,0]=4 1053 B12R2.612 OC1=NOC2=C1C=CC(Br)=C2 93322 [0,1,0,1,0,0|1,0,1]=4 1054 B8R1.1 CC1=CC(C=O)=CS1 P15425 [1,0,0,0,1,0|2,0,0]=4 1055 B8R1.1 CC1=CC=C(C=O)N1 29847 [1,0,0,0,1,0|2,0,0]=4 1056 B8R1.1 CC1=CNC(C=O)=C1 D84258 [1,0,0,0,1,0|2,0,0]=4 1057 B8R1.1 CN1C=CC(C=O)=C1 AT16322 [1,0,0,0,1,0|2,0,0]=4 1058 B8R1.1 O=CC1=CC(I)=CS1 Y10451 [1,0,0,0,1,0|2,0,0]=4 1059 B8R1.1 O=CC1=CC=C(Br)N1 O11353 [1,0,0,0,1,0|2,0,0]=4 1060 B8R1.1 O=CC1=CC=C(Cl)N1 D95169 [1,0,0,0,1,0|2,0,0]=4 1061 B8R1.1 O=CC1=CNC(Br)=C1 F13792 [1,0,0,0,1,0|2,0,0]=4 1062 B8R1.1 O=CC1=CSC(Br)=C1 P10686 [1,0,0,0,1,0|2,0,0]=4 1063 B8R1.1 O=CC1=CSC(Cl)=C1 37628 [1,0,0,0,1,0|2,0,0]=4 1064 B8R1.7 O=C(O)C1=CSN=C1 83094 [1,0,0,0,1,0|2,0,0]=4 1065 B8R1.7 O=C(O)C1=NSC=C1 83207 [1,0,0,0,1,0|2,0,0]=4 1066 B10R1.18 BrC(Br)=CC1=CC=CC=C1 31017 [1,0,0,0,0,1|2,0,0]=4 1067 B10R1.18 CC(=O)CC1=CN=CC=C1 28512 [1,0,0,0,0,1|2,0,0]=4 1068 B10R1.18 CC(=O)NC1=CC=CC=C1 D72485 [1,0,0,0,0,1|1,0,0]=3 1069 B10R1.18 N=C(N)CC1=CC=CC=C1 F19863 [1,0,0,0,0,1|2,0,0]=4 1070 B10R1.18 NC(=S)CC1=CC=CC=C1 71029 [1,0,0,0,0,1|1,1,0]=4 1071 B10R1.18 O=C(O)CC1=CN=CN=C1 24619 [1,0,0,0,0,1|2,0,0]=4 1072 B12R1.21 CC(=O)CCC1=CC=C(F)C=C1 D71139 [0,0,0,0,0,2|2,0,0]=4 1073 B12R1.21 CC(=O)NCC1=CC=C(F)C=C1 20599 [0,0,0,0,0,2|2,0,0]=4 1074 B12R1.21 CC(=O)\C=C\C1=CC=C(Br)C=C1 F12211 [0,0,0,0,0,2|2,0,0]=4 1075 B12R1.21 CC1=CN=C(CCC(=O)O)C=C1 72577 [0,0,0,0,0,2|2,0,0]=4 1076 B12R1.21 CC1=NC=C(CCC(=O)O)C=C1 72581 [0,0,0,0,0,2|2,0,0]=4 1077 B12R1.21 NC(=O)NCC1=CC=C(N)C=C1 46011 [0,0,0,0,0,2|2,0,0]=4 1078 B12R1.21 NC1=NC=C(CCC(=O)O)C=C1 75631 [0,0,0,0,0,2|2,0,0]=4 1079 B12R1.21 O=C(O)C#CC1=CC=C(Cl)C=C1 25118 [0,0,0,0,0,2|1,0,0]=3 1080 B12R1.21 O=C(O)C#CC1=CC=C(F)C=C1 89770 [0,0,0,0,0,2|1,0,0]=3 1081 B12R1.21 O=C(O)CCC1=CC=C(S)C=C1 T72748 [0,0,0,0,0,2|0,1,0]=3 1082 B12R1.21 O=C(O)CCC1=CN=C(Br)C=C1 F30869 [0,0,0,0,0,2|2,0,0]=4 1083 B12R1.21 O=C(O)\C=C\C1=CN=C(Br)C=C1 F16133 [0,0,0,0,0,2|2,0,0]=4 1084 B12R1.21 O=C(O)\C=C\C1=NC=C(F)C=C1 C77141 [0,0,0,0,0,2|2,0,0]=4