0 B10R1.61 C=C(C)C1=C(Br)C=CC=C1 W17018 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.61 CC(=O)C1=C(Br)C=CC=N1 80328 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.61 CC(=O)C1=C(Br)C=NC=N1 26989 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.61 CC(=O)C1=C(C)N=CC=C1 C73307 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.61 CC(=O)C1=C(C)N=CN=C1 O10297 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.61 CC(=O)C1=C(Cl)C=CC=N1 27067 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 Y14823 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.61 CC(=O)C1=C(Cl)C=NC=C1 N12959 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.61 CC(=O)C1=C(N)N=CN=C1 D80245 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.61 CC(=O)C1=C(O)C=NC=C1 27646 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.61 CC(=O)C1=C(O)N=CC=C1 93481 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.61 CC(=O)C1=CC=CN=C1F F31395 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.61 CC(=O)C1=CNC=CC1=O C74936 [0,0,0,0,0,0|2,0,1]=3 13 B10R1.61 CC(=O)C1=NC=CC=C1N 80156 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.61 CC(=O)C1=NC=CC=C1O 80210 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.61 CC(C)C1=C(O)C=CC=N1 72523 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.61 CC(C)C1=C(S)C=CC=C1 29274 [0,0,0,0,0,0|2,1,1]=4 17 B10R1.61 CC1=C(C(=N)N)C=CC=C1 28690 [0,0,0,0,0,0|3,0,0]=3 18 B10R1.61 CC1=C(C(=O)O)C=CN=N1 P11312 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.61 CC1=C(C(=O)O)C=NC=C1 83402 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.61 CC1=C(C(N)=O)C=CN=C1 C74299 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.61 CC1=C(C(N)=O)C=NC=C1 A10183 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 52748 [0,0,0,0,0,0|3,0,1]=4 23 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 52749 [0,0,0,0,0,0|3,0,1]=4 24 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 N10464 [0,0,0,0,0,0|3,0,1]=4 25 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 Y10511 [0,0,0,0,0,0|3,0,1]=4 26 B10R1.61 CC1=C([N+](=O)[O-])C=NC=C1 C76767 [0,0,0,0,0,0|3,0,1]=4 27 B10R1.61 CC1=CC=CN=C1B(O)O C16742 [0,0,0,0,0,0|3,0,1]=4 28 B10R1.61 CC1=CC=CN=C1C(=N)N I11838 [0,0,0,0,0,0|4,0,0]=4 29 B10R1.61 CC1=CC=CN=C1[C@H](C)O 21080 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.61 CC1=CC=NN=C1C(=O)O P10780 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.61 CC1=CN=CN=C1C(=O)O F52630 [0,0,0,0,0,0|3,0,0]=3 32 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 21516 [0,0,0,0,0,0|3,0,1]=4 33 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 21517 [0,0,0,0,0,0|3,0,1]=4 34 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 Y10364 [0,0,0,0,0,0|3,0,1]=4 35 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 20095 [0,0,0,0,0,0|3,0,1]=4 36 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 SC1344 [0,0,0,0,0,0|3,0,1]=4 37 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 SC1353 [0,0,0,0,0,0|3,0,1]=4 38 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 52754 [0,0,0,0,0,0|3,0,1]=4 39 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 52755 [0,0,0,0,0,0|3,0,1]=4 40 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 I10701 [0,0,0,0,0,0|3,0,1]=4 41 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 Y10447 [0,0,0,0,0,0|3,0,1]=4 42 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 Y11656 [0,0,0,0,0,0|3,0,1]=4 43 B10R1.61 C[C@H](N)C1=C(N)C=CC=C1 C78195 [0,0,0,0,0,0|3,0,1]=4 44 B10R1.61 C[C@H](O)C1=C(Br)C=CC=C1 SC1257 [0,0,0,0,0,0|2,0,1]=3 45 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 SC1230 [0,0,0,0,0,0|2,0,1]=3 46 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 SC1233 [0,0,0,0,0,0|2,0,1]=3 47 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=N1 P19330 [0,0,0,0,0,0|3,0,1]=4 48 B10R1.61 C[C@H](O)C1=C(F)C=CC=N1 F13157 [0,0,0,0,0,0|3,0,1]=4 49 B10R1.61 C[C@H](O)C1=C(O)C=CC=C1 W16007 [0,0,0,0,0,0|1,0,1]=2 50 B10R1.61 C[C@H](O)C1=CC=CN=C1F F15555 [0,0,0,0,0,0|3,0,1]=4 51 B10R1.61 N=C(N)C1=C(Cl)C=CC=C1 71514 [0,0,0,0,0,0|3,0,0]=3 52 B10R1.61 N=C(N)C1=C(F)C=CC=N1 90259 [0,0,0,0,0,0|4,0,0]=4 53 B10R1.61 NC(=O)C1=C(O)C=NC=C1 CL0151 [0,0,0,0,0,0|2,0,0]=2 54 B10R1.61 NC(=O)C1=C(O)N=CN=C1 Y11131 [0,0,0,0,0,0|3,0,0]=3 55 B10R1.61 NC(=O)C1=CC=NNC1=O AC1803 [0,0,0,0,0,0|3,0,1]=4 56 B10R1.61 NC(=O)C1=NC=CN=C1Br Y10494 [0,0,0,0,0,0|4,0,0]=4 57 B10R1.61 NC(=O)C1=NC=CN=C1N 81968 [0,0,0,0,0,0|4,0,0]=4 58 B10R1.61 NC1=C(B(O)O)C=CC=N1 RB2059 [0,0,0,0,0,0|3,0,1]=4 59 B10R1.61 NC1=C(C(F)F)C=CC=C1 72620 [0,0,0,0,0,0|3,0,1]=4 60 B10R1.61 NC1=CN=CN=C1C(=O)O 20214 [0,0,0,0,0,0|3,0,0]=3 61 B10R1.61 O=C(O)C1=C(Br)C=NC=N1 84369 [0,0,0,0,0,0|3,0,0]=3 62 B10R1.61 O=C(O)C1=C(Cl)C=NC=N1 P10759 [0,0,0,0,0,0|3,0,0]=3 63 B10R1.61 O=C(O)C1=C(F)C=CN=C1 W18401 [0,0,0,0,0,0|2,0,0]=2 64 B10R1.61 O=C(O)C1=CC=NN=C1Cl P11658 [0,0,0,0,0,0|3,0,0]=3 65 B10R1.61 O=C(O)C1=NC=CN=C1Br 84139 [0,0,0,0,0,0|3,0,0]=3 66 B10R1.61 O=C(O)C1=NC=CN=C1I 26634 [0,0,0,0,0,0|3,0,0]=3 67 B10R1.61 O=C1NC=CC=C1B(O)O CS1662 [0,0,0,0,0,0|2,0,2]=4 68 B10R1.61 O=[N+]([O-])C1=C(F)C=CN=C1 I10226 [0,0,0,0,0,0|3,0,1]=4 69 B10R1.61 O=[N+]([O-])C1=C(F)C=NC=C1 84153 [0,0,0,0,0,0|3,0,1]=4 70 B10R1.61 O=[N+]([O-])C1=C(I)C=NC=C1 29629 [0,0,0,0,0,0|3,0,1]=4 71 B10R1.61 O=[N+]([O-])C1=C(O)C=NC=C1 27136 [0,0,0,0,0,0|2,0,1]=3 72 B10R1.61 O=[N+]([O-])C1=C(O)N=CN=C1 O11483 [0,0,0,0,0,0|3,0,1]=4 73 B10R1.61 OB(O)C1=C(Cl)C=CN=C1 FD10058 [0,0,0,0,0,0|3,0,1]=4 74 B9R1.6 C=C(C)C1=NC=CC=C1 W17791 [1,0,0,0,0,0|3,0,0]=4 75 B9R1.6 CC(=O)C1=NN=CC=C1 37064 [1,0,0,0,0,0|3,0,0]=4 76 B9R1.6 C[C@H](N)C1=CC=CC=C1 D77753 [1,0,0,0,0,0|2,0,1]=4 77 B9R1.6 C[C@H](O)C1=NC=CC=C1 A11519 [1,0,0,0,0,0|2,0,1]=4 78 B9R1.6 C[C@H](O)C1=NC=CC=C1 C16040 [1,0,0,0,0,0|2,0,1]=4 79 B9R1.6 C[S@](=O)C1=NC=CC=C1 C74099 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.6 N=C(N)C1=NC=CC=C1 71518 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.6 NC(=O)C1=CN=CN=C1 F13864 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.6 NC(=O)C1=CN=NC=C1 F14288 [1,0,0,0,0,0|3,0,0]=4 83 B9R1.6 NC(=O)C1=NC=NC=C1 C74468 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.6 NC(=O)C1=NN=CC=C1 F30255 [1,0,0,0,0,0|3,0,0]=4 85 B9R1.6 O=C(Cl)C1=NN=CC=C1 D93513 [1,0,0,0,0,0|3,0,0]=4 86 B9R1.6 O=C([O-])C1=NC=CC=N1 65419 [1,0,0,0,0,0|2,0,1]=4 87 B9R1.6 O=[S@]([O-])C1=NC=CC=C1 AT11818 [1,0,0,0,0,0|2,0,1]=4 88 B9R1.15 C#CC1=CC=CN=C1O CS1686 [1,0,0,0,0,0|2,0,1]=4 89 B9R1.15 C=CC1=C(N)C=CC=C1 25265 [1,0,0,0,0,0|2,0,0]=3 90 B9R1.15 C=CC1=CC=CN=C1Br 83953 [1,0,0,0,0,0|3,0,0]=4 91 B9R1.15 C=CC1=CC=CN=C1C P11579 [1,0,0,0,0,0|3,0,0]=4 92 B9R1.15 CC1=C(C=O)C=CN=C1 AB10090 [1,0,0,0,0,0|2,0,0]=3 93 B9R1.15 CC1=C(CO)C=NC=C1 38669 [1,0,0,0,0,0|2,0,1]=4 94 B9R1.15 CC1=NC=CN=C1C=O 30985 [1,0,0,0,0,0|3,0,0]=4 95 B9R1.15 CCC1=C(F)C=CC=C1 F20938 [1,0,0,0,0,0|2,0,1]=4 96 B9R1.15 CCC1=C(O)C=CC=N1 71246 [1,0,0,0,0,0|2,0,1]=4 97 B9R1.15 COC1=C(O)C=NC=C1 79066 [1,0,0,0,0,0|3,0,0]=4 98 B9R1.15 NC1=C(C=O)C=NC=N1 66183 [1,0,0,0,0,0|3,0,0]=4 99 B9R1.15 NC1=C(CO)C=CN=C1 F13531 [1,0,0,0,0,0|2,0,1]=4 100 B9R1.15 NC1=C(CO)C=NC=C1 28348 [1,0,0,0,0,0|2,0,1]=4 101 B9R1.15 NC1=CC=CN=C1C=O 80155 [1,0,0,0,0,0|2,0,0]=3 102 B9R1.15 NC1=CC=CN=C1CO H10562 [1,0,0,0,0,0|2,0,1]=4 103 B9R1.15 NC1=NC=CN=C1C=O 27460 [1,0,0,0,0,0|3,0,0]=4 104 B9R1.15 NCC1=C(I)C=CC=C1 C75019 [1,0,0,0,0,0|2,0,1]=4 105 B9R1.15 NCC1=CC=CN=C1O 55767 [1,0,0,0,0,0|2,0,1]=4 106 B9R1.15 NNC1=C(I)C=CC=C1 C75827 [1,0,0,0,0,0|3,0,0]=4 107 B9R1.15 O=C1NC=CC=C1CO P16012 [1,0,0,0,0,0|1,0,2]=4 108 B9R1.15 O=CC1=C(Br)C=CN=C1 P16584 [1,0,0,0,0,0|2,0,0]=3 109 B9R1.15 O=CC1=C(Cl)C=CC=C1 D77644 [1,0,0,0,0,0|1,0,0]=2 110 B9R1.15 O=CC1=C(O)C=CN=C1 P10968 [1,0,0,0,0,0|1,0,0]=2 111 B9R1.15 O=CC1=C(O)C=NC=C1 25615 [1,0,0,0,0,0|1,0,0]=2 112 B9R1.15 O=CC1=NC=CN=C1Br P14054 [1,0,0,0,0,0|3,0,0]=4 113 B9R1.15 O=CC1=NC=CN=C1Cl P10456 [1,0,0,0,0,0|3,0,0]=4 114 B9R1.15 OCC1=C(Br)C=CN=C1 71972 [1,0,0,0,0,0|2,0,1]=4 115 B9R1.15 OCC1=C(F)C=CN=C1 P15839 [1,0,0,0,0,0|2,0,1]=4 116 B9R1.15 OCC1=C(O)C=NC=C1 D84251 [1,0,0,0,0,0|1,0,1]=3 117 B11R1.53 C#CC1=C(B(O)O)C=CC=C1 S10014 [0,1,0,0,0,0|2,0,1]=4 118 B11R1.53 C#CC1=C(C(=O)O)C=CC=C1 77937 [0,1,0,0,0,0|1,0,0]=2 119 B11R1.53 C#CC1=C(C(C)=O)C=CC=C1 79244 [0,1,0,0,0,0|2,0,0]=3 120 B11R1.53 CCC1=C(C(=O)O)C=CC=N1 O10770 [0,1,0,0,0,0|2,0,0]=3 121 B11R1.53 CCC1=C(C(=O)O)C=CN=C1 O11001 [0,1,0,0,0,0|2,0,0]=3 122 B11R1.53 CCC1=C(C(=O)O)C=NC=C1 C75477 [0,1,0,0,0,0|2,0,0]=3 123 B11R1.53 CCC1=C(C(C)=O)C=CC=C1 A10857 [0,1,0,0,0,0|2,0,0]=3 124 B11R1.53 CN(C)C1=C(CO)C=CC=C1 W18685 [0,1,0,0,0,0|3,0,0]=4 125 B11R1.53 CNC1=C(C(C)=O)C=CC=C1 C73575 [0,1,0,0,0,0|2,0,0]=3 126 B11R1.53 COC1=C(B(O)O)C=NC=C1 63100 [0,1,0,0,0,0|2,0,1]=4 127 B11R1.53 COC1=C(C(=N)N)C=CC=C1 71596 [0,1,0,0,0,0|2,0,0]=3 128 B11R1.53 COC1=C(C(C)=O)C=CC=N1 32755 [0,1,0,0,0,0|2,0,0]=3 129 B11R1.53 COC1=C(C(C)=O)C=CN=C1 C76667 [0,1,0,0,0,0|2,0,0]=3 130 B11R1.53 COC1=C(C(C)=O)C=NC=C1 CS1683 [0,1,0,0,0,0|2,0,0]=3 131 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 52750 [0,1,0,0,0,0|2,0,1]=4 132 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 F16921 [0,1,0,0,0,0|2,0,1]=4 133 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 N10418 [0,1,0,0,0,0|2,0,1]=4 134 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 Y10162 [0,1,0,0,0,0|2,0,1]=4 135 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 Y10512 [0,1,0,0,0,0|2,0,1]=4 136 B11R1.53 COC1=NC=CC=C1[C@H](C)O CS1968 [0,1,0,0,0,0|2,0,1]=4 137 B11R1.53 COC1=NC=CN=C1C(=O)O 26255 [0,1,0,0,0,0|2,0,0]=3 138 B11R1.53 CSC1=C([N+](=O)[O-])C=CC=C1 C74572 [0,1,0,0,0,0|1,1,1]=4 139 B11R1.53 N#CC1=C(C(=O)O)C=CC=N1 O10763 [0,1,0,0,0,0|2,0,0]=3 140 B11R1.53 N#CC1=C(C(=O)O)C=CN=C1 85333 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.53 N#CC1=C(C(=O)O)C=NC=C1 38303 [0,1,0,0,0,0|2,0,0]=3 142 B11R1.53 N#CC1=CC=CN=C1C(=O)O 38302 [0,1,0,0,0,0|2,0,0]=3 143 B11R1.53 NC(=O)C1=C(CBr)C=CC=C1 26663 [0,1,0,0,0,0|2,0,0]=3 144 B11R1.53 NCC1=C(B(O)O)C=CC=C1 N11807 [0,1,0,0,0,0|2,0,1]=4 145 B11R1.53 O=[N+]([O-])C1=C(CO)N=CC=C1 AC1084 [0,1,0,0,0,0|2,0,1]=4 146 B11R1.87 CC1=C(S(=O)(=O)O)C=CC=C1 C73659 [0,1,0,0,0,0|2,0,0]=3 147 B11R1.87 CC1=CC=CN=C1S(=O)(=O)O C73655 [0,1,0,0,0,0|3,0,0]=4 148 B11R1.87 CS(=O)(=O)C1=C(N)C=CC=C1 AC1456 [0,1,0,0,0,0|2,0,1]=4 149 B11R1.87 OC1=C([B-](F)(F)F)C=CC=C1 65321 [0,1,0,0,0,0|3,0,0]=4 150 B11R1.156 CC(=O)C1=C(Br)C=NC=C1F 88880 [0,1,0,0,0,0|3,0,0]=4 151 B11R1.156 CC(=O)C1=C(Cl)C=CN=C1Br 55290 [0,1,0,0,0,0|3,0,0]=4 152 B11R1.156 CC(=O)C1=C(Cl)C=CN=C1Cl 72214 [0,1,0,0,0,0|3,0,0]=4 153 B11R1.156 CC(=O)C1=C(Cl)C=NC=C1Cl FD10663 [0,1,0,0,0,0|3,0,0]=4 154 B11R1.156 CC(=O)C1=C(F)C=CC=C1C CL9504 [0,1,0,0,0,0|2,0,0]=3 155 B11R1.156 CC(=O)C1=C(F)C=CC=C1N C76841 [0,1,0,0,0,0|2,0,0]=3 156 B11R1.156 CC(=O)C1=C(N)C=CN=C1Cl D83525 [0,1,0,0,0,0|3,0,0]=4 157 B11R1.156 CC(=O)C1=C(O)C=CC=C1C CL9444 [0,1,0,0,0,0|1,0,0]=2 158 B11R1.156 CC1=C(C(=O)O)C(Br)=NC=C1 H10306 [0,1,0,0,0,0|2,0,0]=3 159 B11R1.156 CC1=C(C(=O)O)C(Cl)=NC=C1 57354 [0,1,0,0,0,0|2,0,0]=3 160 B11R1.156 CC1=C(C(N)=O)C(Cl)=NC=C1 81867 [0,1,0,0,0,0|3,0,0]=4 161 B11R1.156 CC1=CC=CC(Cl)=C1C(=O)Cl 30562 [0,1,0,0,0,0|2,0,0]=3 162 B11R1.156 CC1=CC=CC(F)=C1B(O)O C76971 [0,1,0,0,0,0|2,0,1]=4 163 B11R1.156 CC1=CC=NC(N)=C1C(=O)O H10318 [0,1,0,0,0,0|2,0,0]=3 164 B11R1.156 CC1=CN=CC(C)=C1C(N)=O AT11860 [0,1,0,0,0,0|3,0,0]=4 165 B11R1.156 CC1=CN=CC(F)=C1C(=O)O AT23873 [0,1,0,0,0,0|2,0,0]=3 166 B11R1.156 CC1=CN=CC(F)=C1C(=O)O C14362 [0,1,0,0,0,0|2,0,0]=3 167 B11R1.156 NC(=O)C1=C(Br)C=NC=C1F 26678 [0,1,0,0,0,0|3,0,0]=4 168 B11R1.156 NC(=O)C1=C(I)C=CC=C1Cl 35383 [0,1,0,0,0,0|2,0,0]=3 169 B11R1.156 NC1=C(C(=O)O)C(Br)=NC=C1 O11151 [0,1,0,0,0,0|2,0,0]=3 170 B11R1.156 NC1=C(C(=O)O)C(Cl)=NC=C1 86987 [0,1,0,0,0,0|2,0,0]=3 171 B11R1.156 NC1=CC=CC(I)=C1C(=O)O FD13014 [0,1,0,0,0,0|1,0,0]=2 172 B11R1.156 NC1=NC=CC(Cl)=C1C(=O)O 36262 [0,1,0,0,0,0|2,0,0]=3 173 B11R1.156 O=C(Cl)C1=C(Br)C=CC=C1F CK1090 [0,1,0,0,0,0|2,0,0]=3 174 B11R1.156 O=C(O)C1=C(Br)C=CC=C1O C15718 [0,1,0,0,0,0|0,0,0]=1 175 B11R1.156 O=C(O)C1=C(Br)C=CN=C1Br D83260 [0,1,0,0,0,0|2,0,0]=3 176 B11R1.156 O=C(O)C1=C(Br)C=CN=C1Cl 55292 [0,1,0,0,0,0|2,0,0]=3 177 B11R1.156 O=C(O)C1=C(Br)C=CN=C1F 79053 [0,1,0,0,0,0|2,0,0]=3 178 B11R1.156 O=C(O)C1=C(Cl)C=NC=C1F 90326 [0,1,0,0,0,0|2,0,0]=3 179 B11R1.156 O=C(O)C1=C(I)C=CC=C1Br 81858 [0,1,0,0,0,0|1,0,0]=2 180 B11R1.156 O=C(O)C1=C(O)C=CN=C1Br D94451 [0,1,0,0,0,0|1,0,0]=2 181 B11R1.156 O=[N+]([O-])C1=C(Br)C=CC=C1Cl N12302 [0,1,0,0,0,0|2,0,1]=4 182 B11R1.156 O=[N+]([O-])C1=C(O)C=CN=C1Cl 80267 [0,1,0,0,0,0|2,0,1]=4 183 B11R1.156 OB(O)C1=C(Cl)C=CC=C1O H11802 [0,1,0,0,0,0|1,0,1]=3 184 B11R1.159 CC(=O)C1=C(N)C(C)=CC=C1 W18414 [0,1,0,0,0,0|2,0,0]=3 185 B11R1.159 CC(=O)C1=C(N)C(Cl)=NC=C1 F53540 [0,1,0,0,0,0|3,0,0]=4 186 B11R1.159 CC(=O)C1=C(N)C(O)=CC=C1 24067 [0,1,0,0,0,0|2,0,0]=3 187 B11R1.159 CC(=O)C1=C(O)C(O)=CC=C1 O10249 [0,1,0,0,0,0|1,0,0]=2 188 B11R1.159 CC(=O)C1=CC=CC(Br)=C1C CL9266 [0,1,0,0,0,0|2,0,0]=3 189 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1N 51210 [0,1,0,0,0,0|2,0,0]=3 190 B11R1.159 CC(=O)C1=CC=CC(F)=C1Br C73097 [0,1,0,0,0,0|2,0,0]=3 191 B11R1.159 CC(=O)C1=CC=CC(N)=C1F C72091 [0,1,0,0,0,0|2,0,0]=3 192 B11R1.159 CC1=C(Br)C=CN=C1C(=O)O Y10130 [0,1,0,0,0,0|2,0,0]=3 193 B11R1.159 CC1=C(Br)C=NC=C1C(=O)O 82203 [0,1,0,0,0,0|2,0,0]=3 194 B11R1.159 CC1=C(C(=O)O)N=CN=C1Cl 70443 [0,1,0,0,0,0|3,0,0]=4 195 B11R1.159 CC1=C(C)C(C(=O)O)=NC=N1 72793 [0,1,0,0,0,0|3,0,0]=4 196 B11R1.159 CC1=C(N)C(C(=O)O)=NC=C1 D83392 [0,1,0,0,0,0|2,0,0]=3 197 B11R1.159 CC1=NC=CC(C(=O)O)=C1N C90386 [0,1,0,0,0,0|2,0,0]=3 198 B11R1.159 CN1C(=O)C=CC=C1C(=O)O 26241 [0,1,0,0,0,0|2,0,0]=3 199 B11R1.159 C[C@H](O)C1=CC=CC(Br)=C1F 33965 [0,1,0,0,0,0|2,0,1]=4 200 B11R1.159 N=C(N)C1=CC=CC(Cl)=C1Cl 71884 [0,1,0,0,0,0|3,0,0]=4 201 B11R1.159 NC(=O)C1=C(Cl)C(Cl)=CC=N1 58503 [0,1,0,0,0,0|3,0,0]=4 202 B11R1.159 NC(=O)C1=C(N)C(Cl)=NC=C1 C74761 [0,1,0,0,0,0|3,0,0]=4 203 B11R1.159 NC(=O)C1=CC=CC(Br)=C1F 36237 [0,1,0,0,0,0|2,0,0]=3 204 B11R1.159 NC(=O)C1=CC=CC(Br)=C1N 26259 [0,1,0,0,0,0|2,0,0]=3 205 B11R1.159 NC(=O)C1=CC=CC(F)=C1F A12174 [0,1,0,0,0,0|2,0,0]=3 206 B11R1.159 NC(=O)C1=CC=CC(F)=C1N 35380 [0,1,0,0,0,0|2,0,0]=3 207 B11R1.159 NC(=O)C1=CC=CC(N)=C1F C72490 [0,1,0,0,0,0|2,0,0]=3 208 B11R1.159 NC(=O)C1=CN=CC(Cl)=C1Cl F20288 [0,1,0,0,0,0|3,0,0]=4 209 B11R1.159 NC1=C(C(=O)O)C=CN=C1Cl 36261 [0,1,0,0,0,0|2,0,0]=3 210 B11R1.159 NC1=C(F)C(C(=O)O)=CC=N1 D83637 [0,1,0,0,0,0|2,0,0]=3 211 B11R1.159 NC1=CC=CC([N+](=O)[O-])=C1Br CL9353 [0,1,0,0,0,0|2,0,1]=4 212 B11R1.159 NC1=CC=CC([N+](=O)[O-])=C1Cl 27932 [0,1,0,0,0,0|2,0,1]=4 213 B11R1.159 NC1=CC=CC([N+](=O)[O-])=C1O 36140 [0,1,0,0,0,0|1,0,1]=3 214 B11R1.159 O=C(O)C1=C(Br)C(Br)=NC=C1 W17140 [0,1,0,0,0,0|2,0,0]=3 215 B11R1.159 O=C(O)C1=C(Cl)C(Br)=NC=C1 30916 [0,1,0,0,0,0|2,0,0]=3 216 B11R1.159 O=C(O)C1=CC=CC(=O)N1O 36408 [0,1,0,0,0,0|1,0,0]=2 217 B11R1.159 O=C(O)C1=CC=CC(=S)N1O W11623 [0,1,0,0,0,0|1,0,0]=2 218 B11R1.159 O=C(O)C1=CC=CC(O)=C1Cl CL9330 [0,1,0,0,0,0|1,0,0]=2 219 B11R1.159 O=C(O)C1=CC=NC(Cl)=C1Br C13624 [0,1,0,0,0,0|2,0,0]=3 220 B11R1.159 O=C(O)C1=CN=CC(Br)=C1I H10040 [0,1,0,0,0,0|2,0,0]=3 221 B11R1.159 O=C(O)C1=CN=CC(Br)=C1O Y10035 [0,1,0,0,0,0|1,0,0]=2 222 B11R1.159 O=C(O)C1=CNC=C(Br)C1=O O11379 [0,1,0,0,0,0|1,0,1]=3 223 B11R1.159 O=C(O)C1=NC=CC(Cl)=C1F S10232 [0,1,0,0,0,0|2,0,0]=3 224 B11R1.159 O=[N+]([O-])C1=C(O)C(Cl)=NC=C1 80190 [0,1,0,0,0,0|2,0,1]=4 225 B11R1.159 O=[N+]([O-])C1=CC=CC(Cl)=C1I 69691 [0,1,0,0,0,0|2,0,1]=4 226 B11R1.159 O=[N+]([O-])C1=CC=CC(O)=C1F 80824 [0,1,0,0,0,0|2,0,1]=4 227 B11R1.159 O=[N+]([O-])C1=CN=CC(Cl)=C1O I10190 [0,1,0,0,0,0|2,0,1]=4 228 B11R1.159 O=[N+]([O-])C1=NC=CC(Br)=C1O D96885 [0,1,0,0,0,0|2,0,1]=4 229 B11R1.159 OB(O)C1=CC=CC(Br)=C1Cl N12989 [0,1,0,0,0,0|2,0,1]=4 230 B11R1.159 OB(O)C1=CC=CC(Cl)=C1O D71389 [0,1,0,0,0,0|1,0,1]=3 231 B11R1.159 OB(O)C1=CC=CC(F)=C1Br A51222 [0,1,0,0,0,0|2,0,1]=4 232 B11R1.166 CC(=O)C1=C(Br)C=C(C)C=C1 77817 [0,1,0,0,0,0|2,0,0]=3 233 B11R1.166 CC(=O)C1=C(Br)C=C(N)C=C1 34088 [0,1,0,0,0,0|2,0,0]=3 234 B11R1.166 CC(=O)C1=C(Br)C=C(O)C=C1 52517 [0,1,0,0,0,0|2,0,0]=3 235 B11R1.166 CC(=O)C1=C(C)C=C(C)N=C1 79163 [0,1,0,0,0,0|3,0,0]=4 236 B11R1.166 CC(=O)C1=C(Cl)C=C(F)C=N1 BL010219 [0,1,0,0,0,0|3,0,0]=4 237 B11R1.166 CC(=O)C1=C(Cl)C=C(N)C=C1 I12065 [0,1,0,0,0,0|2,0,0]=3 238 B11R1.166 CC(=O)C1=C(F)C=C(F)C=N1 50881 [0,1,0,0,0,0|3,0,0]=4 239 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 W18192 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.166 CC(=O)C1=CC=C(F)N=C1F O10255 [0,1,0,0,0,0|3,0,0]=4 241 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1Cl 86422 [0,1,0,0,0,0|3,0,0]=4 242 B11R1.166 CC(=O)C1=NC=C(Br)C=C1C C14359 [0,1,0,0,0,0|3,0,0]=4 243 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1C D79870 [0,1,0,0,0,0|3,0,0]=4 244 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1F BL010223 [0,1,0,0,0,0|3,0,0]=4 245 B11R1.166 CC(C)C1=C(O)C=C(N)C=C1 F51191 [0,1,0,0,0,0|2,0,1]=4 246 B11R1.166 CC1=C(B(O)O)C=CC(Br)=C1 A12288 [0,1,0,0,0,0|2,0,1]=4 247 B11R1.166 CC1=C(C(=O)O)C=CC(I)=C1 31871 [0,1,0,0,0,0|1,0,0]=2 248 B11R1.166 CC1=C(C(=O)O)C=NC(Cl)=N1 CS1395 [0,1,0,0,0,0|3,0,0]=4 249 B11R1.166 CC1=C(C(=O)O)C=NC(N)=C1 W11094 [0,1,0,0,0,0|2,0,0]=3 250 B11R1.166 CC1=C([N+](=O)[O-])C=CC(I)=C1 D71992 [0,1,0,0,0,0|2,0,1]=4 251 B11R1.166 CC1=C([N+](=O)[O-])C=CC(S)=C1 N16874 [0,1,0,0,0,0|2,0,1]=4 252 B11R1.166 CC1=CC(F)=C(C(=O)O)N=C1 P12274 [0,1,0,0,0,0|2,0,0]=3 253 B11R1.166 CC1=CN=C(C(=O)O)C(C)=N1 27738 [0,1,0,0,0,0|3,0,0]=4 254 B11R1.166 CC1=NC(C)=C(C(=O)O)C=N1 Y10097 [0,1,0,0,0,0|3,0,0]=4 255 B11R1.166 CC1=NC(N)=C(C(=O)O)C=N1 F52074 [0,1,0,0,0,0|3,0,0]=4 256 B11R1.166 CC1=NC(N)=C(C(N)=O)C=C1 D83361 [0,1,0,0,0,0|3,0,0]=4 257 B11R1.166 CC1=NC=C(C(=O)O)C(Cl)=N1 C16751 [0,1,0,0,0,0|3,0,0]=4 258 B11R1.166 NC(=O)C1=C(Br)C=C(Br)C=C1 35389 [0,1,0,0,0,0|2,0,0]=3 259 B11R1.166 NC(=O)C1=C(Br)C=C(I)C=C1 C72078 [0,1,0,0,0,0|2,0,0]=3 260 B11R1.166 NC(=O)C1=C(Cl)C=C(Cl)C=N1 RB3269 [0,1,0,0,0,0|3,0,0]=4 261 B11R1.166 NC(=O)C1=C(N)C=C(F)C=C1 25114 [0,1,0,0,0,0|2,0,0]=3 262 B11R1.166 NC(=O)C1=C(N)C=C(O)C=C1 C76630 [0,1,0,0,0,0|2,0,0]=3 263 B11R1.166 NC(=O)C1=C(O)C=C(Cl)C=C1 72118 [0,1,0,0,0,0|1,0,0]=2 264 B11R1.166 NC(=O)C1=C(O)C=C(N)C=C1 O11153 [0,1,0,0,0,0|1,0,0]=2 265 B11R1.166 NC(=O)C1=C(O)N=C(O)C=C1 95017 [0,1,0,0,0,0|2,0,0]=3 266 B11R1.166 NC(=O)C1=CC=C(N)N=C1F F20207 [0,1,0,0,0,0|3,0,0]=4 267 B11R1.166 NC(=O)C1=NC=C(Br)C=C1F D79818 [0,1,0,0,0,0|3,0,0]=4 268 B11R1.166 NC(=O)C1=NC=C(Cl)C=C1F D79885 [0,1,0,0,0,0|3,0,0]=4 269 B11R1.166 NC1=C(C(=O)O)C=NC(Cl)=N1 N10067 [0,1,0,0,0,0|3,0,0]=4 270 B11R1.166 NC1=C(C(=O)O)N=CC(Cl)=N1 77983 [0,1,0,0,0,0|3,0,0]=4 271 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=N1 I11984 [0,1,0,0,0,0|2,0,0]=3 272 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O 38415 [0,1,0,0,0,0|2,0,0]=3 273 B11R1.166 NC1=CC(F)=NC=C1C(=O)O 37635 [0,1,0,0,0,0|2,0,0]=3 274 B11R1.166 NC1=CC(N)=C(C(=O)O)C=C1 D95034 [0,1,0,0,0,0|1,0,0]=2 275 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)N=C1 F11789 [0,1,0,0,0,0|2,0,0]=3 276 B11R1.166 O=C(O)C1=C(Br)C=C(O)C=C1 C13381 [0,1,0,0,0,0|1,0,0]=2 277 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=N1 BL010109 [0,1,0,0,0,0|2,0,0]=3 278 B11R1.166 O=C(O)C1=C(Cl)N=C(Br)C=C1 F10539 [0,1,0,0,0,0|2,0,0]=3 279 B11R1.166 O=C(O)C1=C(F)C=C(O)C=N1 D79760 [0,1,0,0,0,0|2,0,0]=3 280 B11R1.166 O=C(O)C1=C(F)N=C(Cl)C=C1 RB3340 [0,1,0,0,0,0|2,0,0]=3 281 B11R1.166 O=C(O)C1=CC=C(F)N=C1Br F30561 [0,1,0,0,0,0|2,0,0]=3 282 B11R1.166 O=C(O)C1=CC=C(F)N=C1Cl W16949 [0,1,0,0,0,0|2,0,0]=3 283 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Br F11779 [0,1,0,0,0,0|2,0,0]=3 284 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Cl F11857 [0,1,0,0,0,0|2,0,0]=3 285 B11R1.166 O=C(O)C1=CN=C(F)C=C1F S10764 [0,1,0,0,0,0|2,0,0]=3 286 B11R1.166 O=C(O)C1=NC=C(Br)C=C1O 54575 [0,1,0,0,0,0|1,0,0]=2 287 B11R1.166 O=C(O)C1=NC=C(Cl)NC1=O W17937 [0,1,0,0,0,0|2,0,1]=4 288 B11R1.166 O=C1C=C(O)C(C(=O)O)=NN1 W19694 [0,1,0,0,0,0|2,0,0]=3 289 B11R1.166 O=[N+]([O-])C1=C(Cl)C=C(Br)C=C1 Y12426 [0,1,0,0,0,0|2,0,1]=4 290 B11R1.166 O=[N+]([O-])C1=C(I)C=C(O)C=C1 23870 [0,1,0,0,0,0|2,0,1]=4 291 B11R1.166 O=[N+]([O-])C1=CN=C(Cl)C=C1O 24225 [0,1,0,0,0,0|2,0,1]=4 292 B11R1.166 O=[N+]([O-])C1=NC=C(F)C=C1O D70628 [0,1,0,0,0,0|2,0,1]=4 293 B11R1.166 OB(O)C1=C(F)C=C(Br)C=C1 I12620 [0,1,0,0,0,0|2,0,1]=4 294 B11R1.166 OB(O)C1=C(F)C=C(O)C=C1 I12051 [0,1,0,0,0,0|2,0,1]=4 295 B11R1.167 CC(=O)C1=C(Br)C=CC(C)=C1 24153 [0,1,0,0,0,0|2,0,0]=3 296 B11R1.167 CC(=O)C1=C(Br)C=CC(F)=N1 33205 [0,1,0,0,0,0|3,0,0]=4 297 B11R1.167 CC(=O)C1=C(Br)C=CC(O)=C1 72605 [0,1,0,0,0,0|2,0,0]=3 298 B11R1.167 CC(=O)C1=C(Br)C=NC(Cl)=C1 79385 [0,1,0,0,0,0|3,0,0]=4 299 B11R1.167 CC(=O)C1=C(C)C=CC(O)=C1 N14343 [0,1,0,0,0,0|2,0,0]=3 300 B11R1.167 CC(=O)C1=C(Cl)C=CC(N)=C1 AC8788 [0,1,0,0,0,0|2,0,0]=3 301 B11R1.167 CC(=O)C1=C(Cl)C=CC(O)=C1 98261 [0,1,0,0,0,0|2,0,0]=3 302 B11R1.167 CC(=O)C1=C(F)C=CC(N)=C1 52903 [0,1,0,0,0,0|2,0,0]=3 303 B11R1.167 CC(=O)C1=CC(Br)=CN=C1C C72029 [0,1,0,0,0,0|3,0,0]=4 304 B11R1.167 CC(=O)C1=CC(C)=CN=C1Cl D82211 [0,1,0,0,0,0|3,0,0]=4 305 B11R1.167 CC(C)C1=C(O)C=CC(O)=C1 S10162 [0,1,0,0,0,0|2,0,1]=4 306 B11R1.167 CC1=C(C(=O)O)C=C(N)C=N1 D94837 [0,1,0,0,0,0|2,0,0]=3 307 B11R1.167 CC1=C(C(=O)O)N=C(Br)C=C1 P16139 [0,1,0,0,0,0|2,0,0]=3 308 B11R1.167 CC1=CC(B(O)O)=C(O)C=C1 F16104 [0,1,0,0,0,0|1,0,1]=3 309 B11R1.167 CC1=CC(C(=O)O)=C(C)C=N1 P18651 [0,1,0,0,0,0|2,0,0]=3 310 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=N1 C71246 [0,1,0,0,0,0|2,0,0]=3 311 B11R1.167 CC1=CC(C(=O)O)=C(F)C=N1 W16972 [0,1,0,0,0,0|2,0,0]=3 312 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 37636 [0,1,0,0,0,0|2,0,0]=3 313 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 C76925 [0,1,0,0,0,0|2,0,0]=3 314 B11R1.167 CC1=CC(C(=O)O)=C(N)N=C1 C75497 [0,1,0,0,0,0|2,0,0]=3 315 B11R1.167 CC1=CC=C(C)C(C(=O)O)=N1 O10927 [0,1,0,0,0,0|2,0,0]=3 316 B11R1.167 CC1=CC=C(N)C(C(=O)O)=N1 68795 [0,1,0,0,0,0|2,0,0]=3 317 B11R1.167 CC1=CC=C(O)C(C(=O)O)=N1 C72632 [0,1,0,0,0,0|1,0,0]=2 318 B11R1.167 CC1=CN=C(C)C(C(=O)O)=N1 36485 [0,1,0,0,0,0|3,0,0]=4 319 B11R1.167 CC1=CN=C(Cl)C(C(=O)O)=C1 26345 [0,1,0,0,0,0|2,0,0]=3 320 B11R1.167 CC1=CN=C(F)C(C(=O)O)=C1 C71175 [0,1,0,0,0,0|2,0,0]=3 321 B11R1.167 CC1=NC(C(=O)O)=C(Br)C=C1 Y10194 [0,1,0,0,0,0|2,0,0]=3 322 B11R1.167 CC1=NC(C(=O)O)=C(Br)C=N1 66252 [0,1,0,0,0,0|3,0,0]=4 323 B11R1.167 CC1=NC(C(=O)O)=C(Cl)C=C1 P18650 [0,1,0,0,0,0|2,0,0]=3 324 B11R1.167 CC1=NC=C(Cl)C=C1C(=O)O I11983 [0,1,0,0,0,0|2,0,0]=3 325 B11R1.167 CC1=NNC(=O)C(C(=O)O)=C1 94812 [0,1,0,0,0,0|2,0,1]=4 326 B11R1.167 CN1C=CC(=O)C=C1C(=O)O W19341 [0,1,0,0,0,0|2,0,0]=3 327 B11R1.167 C[C@H](N)C1=C(O)C=CC(F)=C1 Y11757 [0,1,0,0,0,0|2,0,1]=4 328 B11R1.167 C[C@H](N)C1=C(O)C=CC(F)=C1 Y11758 [0,1,0,0,0,0|2,0,1]=4 329 B11R1.167 C[C@H](N)C1=C(O)C=CC(F)=C1 Y12285 [0,1,0,0,0,0|2,0,1]=4 330 B11R1.167 C[C@H](O)C1=C(I)C=CC(F)=C1 C91309 [0,1,0,0,0,0|2,0,1]=4 331 B11R1.167 N=C(N)C1=C(F)C=CC(Br)=C1 D83462 [0,1,0,0,0,0|3,0,0]=4 332 B11R1.167 N=C(N)C1=C(F)C=CC(Cl)=C1 C90520 [0,1,0,0,0,0|3,0,0]=4 333 B11R1.167 NC(=O)C1=C(N)C=CC(Br)=N1 F30972 [0,1,0,0,0,0|3,0,0]=4 334 B11R1.167 NC(=O)C1=C(O)N=CC(Cl)=N1 83017 [0,1,0,0,0,0|3,0,0]=4 335 B11R1.167 NC(=O)C1=CC(Br)=NC=C1F C73428 [0,1,0,0,0,0|3,0,0]=4 336 B11R1.167 NC(=O)C1=CC(Cl)=NC=C1N D79795 [0,1,0,0,0,0|3,0,0]=4 337 B11R1.167 NC(=O)C1=CC(F)=CNC1=O D83259 [0,1,0,0,0,0|2,0,1]=4 338 B11R1.167 NC1=C(C(=O)O)N=C(Br)C=C1 F31145 [0,1,0,0,0,0|2,0,0]=3 339 B11R1.167 NC1=C(C(=O)O)N=C(Cl)N=C1 W17978 [0,1,0,0,0,0|3,0,0]=4 340 B11R1.167 NC1=C(C(=O)O)N=C(I)C=N1 75748 [0,1,0,0,0,0|3,0,0]=4 341 B11R1.167 NC1=CC(C(=O)O)=C(N)C=C1 F52721 [0,1,0,0,0,0|1,0,0]=2 342 B11R1.167 NC1=CN=C(Cl)C(C(=O)O)=C1 37564 [0,1,0,0,0,0|2,0,0]=3 343 B11R1.167 NC1=CN=C(F)C=C1C(=O)O 71434 [0,1,0,0,0,0|2,0,0]=3 344 B11R1.167 NC1=NC(C(=O)O)=C(Br)C=C1 F31274 [0,1,0,0,0,0|2,0,0]=3 345 B11R1.167 NC1=NC(C(=O)O)=C(Br)C=N1 C77121 [0,1,0,0,0,0|3,0,0]=4 346 B11R1.167 NC1=NC(C(=O)O)=C(Cl)C=N1 C15823 [0,1,0,0,0,0|3,0,0]=4 347 B11R1.167 NC1=NC(C(=O)O)=C(Cl)C=N1 FD13030 [0,1,0,0,0,0|3,0,0]=4 348 B11R1.167 NC1=NC=C(F)C=C1C(=O)O P15966 [0,1,0,0,0,0|2,0,0]=3 349 B11R1.167 O=C(Cl)C1=C(O)C=CC(Cl)=C1 W16064 [0,1,0,0,0,0|1,0,0]=2 350 B11R1.167 O=C(O)C1=C(Br)C=CC(F)=N1 80162 [0,1,0,0,0,0|2,0,0]=3 351 B11R1.167 O=C(O)C1=C(Br)C=NC(F)=C1 F31180 [0,1,0,0,0,0|2,0,0]=3 352 B11R1.167 O=C(O)C1=C(Cl)C=CC(O)=N1 O10988 [0,1,0,0,0,0|2,0,0]=3 353 B11R1.167 O=C(O)C1=C(F)C=CC(Br)=N1 85645 [0,1,0,0,0,0|2,0,0]=3 354 B11R1.167 O=C(O)C1=C(I)C=CC(O)=C1 69861 [0,1,0,0,0,0|1,0,0]=2 355 B11R1.167 O=C(O)C1=C(O)C=CC(Br)=N1 26690 [0,1,0,0,0,0|1,0,0]=2 356 B11R1.167 O=C(O)C1=C(O)N=CC(Br)=N1 C10999 [0,1,0,0,0,0|2,0,0]=3 357 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Cl 22950 [0,1,0,0,0,0|2,0,0]=3 358 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1O A10724 [0,1,0,0,0,0|1,0,0]=2 359 B11R1.167 O=C(O)C1=CC(F)=CN=C1Br 24198 [0,1,0,0,0,0|2,0,0]=3 360 B11R1.167 O=C(O)C1=CC(F)=CN=C1F AT10057 [0,1,0,0,0,0|2,0,0]=3 361 B11R1.167 O=C(O)C1=CC(F)=CN=C1O A12916 [0,1,0,0,0,0|1,0,0]=2 362 B11R1.167 O=C(O)C1=CC(O)=CN=C1Cl F13413 [0,1,0,0,0,0|2,0,0]=3 363 B11R1.167 O=C(O)C1=NC(Cl)=CN=C1Br 36554 [0,1,0,0,0,0|3,0,0]=4 364 B11R1.167 O=C(O)C1=NC(Cl)=CN=C1Cl N13216 [0,1,0,0,0,0|3,0,0]=4 365 B11R1.167 O=C1C=C(C(=O)O)C(Br)=CN1 54617 [0,1,0,0,0,0|2,0,0]=3 366 B11R1.167 OB(O)C1=C(Cl)C=CC(Br)=C1 F11380 [0,1,0,0,0,0|2,0,1]=4 367 B11R1.167 OB(O)C1=C(Cl)C=CC(O)=C1 C16692 [0,1,0,0,0,0|2,0,1]=4 368 B11R1.167 OB(O)C1=C(F)C=CC(O)=C1 N12235 [0,1,0,0,0,0|2,0,1]=4 369 B11R1.222 CC1=C(C(=O)C#N)C=CC=C1 AB1507 [0,1,0,0,0,0|2,0,0]=3 370 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 D80972 [0,1,0,0,0,0|2,0,1]=4 371 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 D81235 [0,1,0,0,0,0|2,0,1]=4 372 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 N11177 [0,1,0,0,0,0|2,0,1]=4 373 B11R1.222 CC1=C([C@@H](O)CN)C=CC=C1 AR2909 [0,1,0,0,0,0|2,0,1]=4 374 B11R1.222 CC1=CC=CN=C1\C(N)=N\O W10706 [0,1,0,0,0,0|3,0,0]=4 375 B11R1.222 CCC(=O)C1=C(Br)C=CC=N1 D81028 [0,1,0,0,0,0|3,0,0]=4 376 B11R1.222 CC[C@H](N)C1=C(O)C=CC=C1 Y14154 [0,1,0,0,0,0|2,0,1]=4 377 B11R1.222 CC[C@H](N)C1=C(O)C=CC=C1 Y14523 [0,1,0,0,0,0|2,0,1]=4 378 B11R1.222 CNC(=O)C1=CNC=CC1=O F11755 [0,1,0,0,0,0|2,0,1]=4 379 B11R1.222 COC(=O)C1=C(Br)C=CN=C1 I11422 [0,1,0,0,0,0|2,0,0]=3 380 B11R1.222 COC(=O)C1=C(Br)C=NC=N1 67174 [0,1,0,0,0,0|3,0,0]=4 381 B11R1.222 COC(=O)C1=C(Cl)C=CN=C1 26180 [0,1,0,0,0,0|2,0,0]=3 382 B11R1.222 COC(=O)C1=C(N)N=CN=C1 26406 [0,1,0,0,0,0|3,0,0]=4 383 B11R1.222 COC(=O)C1=C(N)N=NC=C1 32233 [0,1,0,0,0,0|3,0,0]=4 384 B11R1.222 COC(=O)C1=C(O)C=CN=C1 F30285 [0,1,0,0,0,0|1,0,0]=2 385 B11R1.222 COC(=O)C1=CC=NN=C1Cl AT22445 [0,1,0,0,0,0|3,0,0]=4 386 B11R1.222 COC(=O)C1=CC=NNC1=O P11740 [0,1,0,0,0,0|2,0,1]=4 387 B11R1.222 COC(=O)C1=NC=CN=C1F P16242 [0,1,0,0,0,0|3,0,0]=4 388 B11R1.222 COC(=O)C1=NC=CN=C1I 30615 [0,1,0,0,0,0|3,0,0]=4 389 B11R1.222 COC(=O)C1=NC=NC=C1N P21150 [0,1,0,0,0,0|3,0,0]=4 390 B11R1.222 C\C(=N\O)C1=C(O)C=CC=C1 W19004 [0,1,0,0,0,0|1,0,0]=2 391 B11R1.222 NC[C@H](O)C1=C(Cl)C=CC=C1 AC1512 [0,1,0,0,0,0|2,0,1]=4 392 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 D81268 [0,1,0,0,0,0|2,0,1]=4 393 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 D81404 [0,1,0,0,0,0|2,0,1]=4 394 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 Y12047 [0,1,0,0,0,0|2,0,1]=4 395 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 Y12048 [0,1,0,0,0,0|2,0,1]=4 396 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 N11089 [0,1,0,0,0,0|2,0,1]=4 397 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 N11090 [0,1,0,0,0,0|2,0,1]=4 398 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 Y10773 [0,1,0,0,0,0|2,0,1]=4 399 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 Y13361 [0,1,0,0,0,0|2,0,1]=4 400 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 D83963 [0,1,0,0,0,0|2,0,1]=4 401 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 I11002 [0,1,0,0,0,0|2,0,1]=4 402 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 I11143 [0,1,0,0,0,0|2,0,1]=4 403 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 Y10336 [0,1,0,0,0,0|2,0,1]=4 404 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 Y12049 [0,1,0,0,0,0|2,0,1]=4 405 B11R1.222 N\C(=N\O)C1=C(Cl)C=CC=C1 W10711 [0,1,0,0,0,0|2,0,0]=3 406 B11R1.222 O=C(CBr)C1=C(Cl)N=CC=C1 F10492 [0,1,0,0,0,0|3,0,0]=4 407 B11R1.222 O=C(CF)C1=C(F)C=CC=C1 75535 [0,1,0,0,0,0|2,0,0]=3 408 B11R1.222 O=C(CO)C1=C(Cl)C=CC=C1 AC1212 [0,1,0,0,0,0|1,0,0]=2 409 B11R2.1 BrC1=COC2=C1C=CC=N2 D82844 [0,0,0,1,0,0|3,0,0]=4 410 B11R2.1 BrC1=NSC2=C1C=CC=C2 D84733 [0,0,0,1,0,0|2,1,0]=4 411 B11R2.1 C=C1CCC2=C1C=CC=C2 AC3155 [0,0,0,1,0,0|3,0,0]=4 412 B11R2.1 CC1=CCC2=C1C=CC=C2 C76459 [0,0,0,1,0,0|3,0,0]=4 413 B11R2.1 ClC1=COC2=C1C=CC=C2 F14423 [0,0,0,1,0,0|2,0,0]=3 414 B11R2.1 ClC1=NOC2=CC=CN=C21 C73392 [0,0,0,1,0,0|3,0,0]=4 415 B11R2.1 FC1=NNC2=C1C=CC=C2 F30837 [0,0,0,1,0,0|3,0,0]=4 416 B11R2.1 NC1=CNC2=C1C=CC=C2 51896 [0,0,0,1,0,0|3,0,0]=4 417 B11R2.1 NC1=CSC2=C1C=CC=C2 25380 [0,0,0,1,0,0|2,1,0]=4 418 B11R2.1 NC1=NCC2=C1C=CC=C2 32182 [0,0,0,1,0,0|3,0,0]=4 419 B11R2.1 NC1=NOC2=C1C=CN=C2 C71454 [0,0,0,1,0,0|3,0,0]=4 420 B11R2.1 NC1=NOC2=C1C=NC=C2 A50063 [0,0,0,1,0,0|3,0,0]=4 421 B11R2.1 O=C1C=CC2=C1C=CC=C2 O10409 [0,0,0,1,0,0|2,0,0]=3 422 B11R2.1 O=C1CCC2=C1C=CN=C2 67473 [0,0,0,1,0,0|3,0,0]=4 423 B11R2.1 O=C1CCC2=C1C=NC=C2 P10633 [0,0,0,1,0,0|3,0,0]=4 424 B11R2.1 O=C1COC2=C1C=CN=C2 65977 [0,0,0,1,0,0|2,0,0]=3 425 B11R2.1 O=C1COC2=C1C=CN=C2 W17205 [0,0,0,1,0,0|2,0,0]=3 426 B11R2.1 O=C1CSC2=C1C=CC=C2 26760 [0,0,0,1,0,0|1,1,0]=3 427 B11R2.1 O=C1NCC2=C1C=CC=N2 84460 [0,0,0,1,0,0|3,0,0]=4 428 B11R2.1 O=C1NCC2=C1C=CN=C2 F19961 [0,0,0,1,0,0|3,0,0]=4 429 B11R2.1 O=C1NCC2=C1C=NC=C2 37545 [0,0,0,1,0,0|3,0,0]=4 430 B11R2.1 O=C1NCC2=CC=CN=C12 87908 [0,0,0,1,0,0|3,0,0]=4 431 B11R2.1 O=C1NNC2=C1C=CC=N2 36117 [0,0,0,1,0,0|3,0,0]=4 432 B11R2.1 O=C1NNC2=C1C=CN=C2 F50508 [0,0,0,1,0,0|3,0,0]=4 433 B11R2.1 O=C1NNC2=CC=CN=C12 36532 [0,0,0,1,0,0|3,0,0]=4 434 B11R2.1 OC1=NNC2=C1C=CC=C2 C71048 [0,0,0,1,0,0|2,0,0]=3 435 B11R2.1 OC1=NOC2=NC=CC=C12 A51240 [0,0,0,1,0,0|2,0,0]=3 436 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 D70931 [0,0,0,1,0,0|2,0,1]=4 437 B11R2.1 O[C@H]1COC2=NC=CC=C21 D97315 [0,0,0,1,0,0|2,0,1]=4 438 B9R1.41 CC(=O)C1=CNC=C1C W17613 [0,0,0,0,1,0|3,0,0]=4 439 B9R1.41 CC1=C(C(=O)O)C=CN1 W10234 [0,0,0,0,1,0|2,0,0]=3 440 B9R1.41 NC(=O)C1=CC=CN1N P15055 [0,0,0,0,1,0|3,0,0]=4 441 B9R1.41 O=C(O)C1=C(Br)C=CN1 C10492 [0,0,0,0,1,0|2,0,0]=3 442 B9R1.41 O=C(O)C1=C(Br)C=CO1 71103 [0,0,0,0,1,0|2,0,0]=3 443 B9R1.41 O=C(O)C1=C(Br)N=CS1 88253 [0,0,0,0,1,0|3,0,0]=4 444 B9R1.41 O=C(O)C1=C(Br)NC=N1 D86912 [0,0,0,0,1,0|3,0,0]=4 445 B9R1.41 O=C(O)C1=C(Cl)C=NN1 W10253 [0,0,0,0,1,0|3,0,0]=4 446 B9R1.41 O=C(O)C1=C(Cl)C=NS1 S11450 [0,0,0,0,1,0|3,0,0]=4 447 B9R1.41 O=C(O)C1=C(Cl)OC=C1 W18500 [0,0,0,0,1,0|2,0,0]=3 448 B9R1.41 O=C(O)C1=C(Cl)SC=C1 27789 [0,0,0,0,1,0|2,0,0]=3 449 B9R1.41 O=C(O)C1=C(F)C=CN1 91531 [0,0,0,0,1,0|2,0,0]=3 450 B9R1.41 O=C(O)C1=C(I)SC=C1 A11648 [0,0,0,0,1,0|2,0,0]=3 451 B9R1.41 O=C(O)C1=C(O)C=CS1 Y10188 [0,0,0,0,1,0|1,0,0]=2 452 B9R1.41 O=C(O)C1=NNC=C1Cl 24966 [0,0,0,0,1,0|3,0,0]=4 453 B9R1.41 O=C(O)C1=NNC=C1F C91234 [0,0,0,0,1,0|3,0,0]=4 454 B11R1.86 CC(=O)NC1=C(I)C=CC=C1 AR2168 [0,0,0,0,0,1|2,0,0]=3 455 B11R1.86 CC(C)OC1=C(O)C=CC=C1 D71146 [0,0,0,0,0,1|2,0,1]=4 456 B11R1.86 C[C@H](O)CC1=C(Cl)C=CC=C1 D84375 [0,0,0,0,0,1|2,0,1]=4 457 B11R1.86 FC1=C(C=C(Br)Br)C=CC=C1 D79986 [0,0,0,0,0,1|3,0,0]=4 458 B11R1.86 NC(=O)NC1=C(Cl)C=CC=C1 W18608 [0,0,0,0,0,1|2,0,0]=3 459 B11R1.86 O=C(O)CC1=C(Br)C=CC=N1 73446 [0,0,0,0,0,1|2,0,0]=3 460 B11R1.86 O=C(O)CC1=C(F)C=CC=N1 S10090 [0,0,0,0,0,1|2,0,0]=3 461 B11R1.86 O=C(O)CC1=CC=CN=C1Br D85902 [0,0,0,0,0,1|2,0,0]=3 462 B11R1.86 O=C(O)CC1=NC=CN=C1Cl P11662 [0,0,0,0,0,1|3,0,0]=4 463 B11R1.86 O=C(O)CN1C=CC=CC1=O 71529 [0,0,0,0,0,1|1,0,1]=3 464 B11R1.86 O=C(O)CN1C=CC=NC1=O W12296 [0,0,0,0,0,1|2,0,1]=4 465 B11R1.86 O=C([O-])CC1=C(Cl)C=CC=N1 27510 [0,0,0,0,0,1|2,0,1]=4 466 B11R1.86 O=C([O-])CC1=C(F)C=CC=N1 98377 [0,0,0,0,0,1|2,0,1]=4 467 B8R1.2 NCC1=CC=CC=C1 RB3068 [2,0,0,0,0,0|1,0,1]=4 468 B8R1.2 O=CC1=NC=NC=C1 26359 [2,0,0,0,0,0|2,0,0]=4 469 B8R1.2 [C-]#[N+]C1=CC=CC=C1 AB1473 [2,0,0,0,0,0|2,0,0]=4 470 B8R1.5 O=C1NC=NC=C1O 25860 [2,0,0,0,0,0|2,0,0]=4 471 B8R1.5 O=C1NC=NC=C1O C73082 [2,0,0,0,0,0|2,0,0]=4 472 B8R1.5 OC1=C(I)C=CC=N1 CS1389 [2,0,0,0,0,0|2,0,0]=4 473 B8R1.5 OC1=C(I)C=CN=C1 25190 [2,0,0,0,0,0|2,0,0]=4 474 B8R1.5 OC1=C(O)C=NC=C1 C14003 [2,0,0,0,0,0|1,0,0]=3 475 B8R1.5 OC1=NC=CN=C1O C74124 [2,0,0,0,0,0|2,0,0]=4 476 B10R1.13 C=C(C)C1=CC=C(I)C=C1 AC1339 [1,1,0,0,0,0|2,0,0]=4 477 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 AC7918 [1,1,0,0,0,0|1,0,0]=3 478 B10R1.13 CC(=O)C1=NC=C(N)C=C1 D94999 [1,1,0,0,0,0|2,0,0]=4 479 B10R1.13 CC(=O)C1=NC=C(O)C=C1 53717 [1,1,0,0,0,0|2,0,0]=4 480 B10R1.13 CC1=CC=C([C@H](C)O)C=C1 W19044 [1,1,0,0,0,0|1,0,1]=4 481 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 97006 [1,1,0,0,0,0|2,0,0]=4 482 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 A11173 [1,1,0,0,0,0|2,0,0]=4 483 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 T73083 [1,1,0,0,0,0|2,0,0]=4 484 B10R1.13 CC1=CCC(C(=O)O)=CC1 A12608 [1,1,0,0,0,0|0,0,2]=4 485 B10R1.13 CC1=CN=C(C(=O)O)N=C1 RB3298 [1,1,0,0,0,0|2,0,0]=4 486 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 SC1272 [1,1,0,0,0,0|1,0,1]=4 487 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 SC1278 [1,1,0,0,0,0|1,0,1]=4 488 B10R1.13 C[C@H](O)C1=CC=C(O)C=C1 25877 [1,1,0,0,0,0|1,0,1]=4 489 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 W16706 [1,1,0,0,0,0|2,0,0]=4 490 B10R1.13 N=C(N)C1=CC=C(N)C=C1 56135 [1,1,0,0,0,0|2,0,0]=4 491 B10R1.13 NC(=O)C1=CN=C(O)C=C1 C74893 [1,1,0,0,0,0|2,0,0]=4 492 B10R1.13 NC(=O)C1=NC=C(N)C=C1 25630 [1,1,0,0,0,0|2,0,0]=4 493 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 A11465 [1,1,0,0,0,0|0,0,1]=3 494 B10R1.13 NC1=CN=C(C(=O)O)N=C1 P10377 [1,1,0,0,0,0|2,0,0]=4 495 B10R1.13 O=C(O)C1=CN=C(Br)N=C1 F11671 [1,1,0,0,0,0|2,0,0]=4 496 B10R1.13 O=C(O)C1=CN=C(F)C=N1 70428 [1,1,0,0,0,0|2,0,0]=4 497 B10R1.13 O=C(O)C1=NC=C(F)C=N1 38641 [1,1,0,0,0,0|2,0,0]=4 498 B10R1.13 O=C(O)C1=NC=C(I)C=C1 O11456 [1,1,0,0,0,0|1,0,0]=3 499 B10R1.13 O=C(O)C1=NN=C(Br)C=C1 P10335 [1,1,0,0,0,0|2,0,0]=4 500 B10R1.13 O=C(O)C1=NN=C(O)C=C1 C73877 [1,1,0,0,0,0|2,0,0]=4 501 B10R1.13 O=C1N=CC(C(=O)O)=CN1 P13001 [1,1,0,0,0,0|2,0,0]=4 502 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 31291 [1,1,0,0,0,0|1,0,1]=4 503 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 32646 [1,1,0,0,0,0|1,0,1]=4 504 B10R1.15 C=C(CBr)C1=CC=CC=C1 35089 [1,1,0,0,0,0|2,0,0]=4 505 B10R1.15 C=C(CC)C1=CC=CC=C1 C73845 [1,1,0,0,0,0|2,0,0]=4 506 B10R1.15 C=CC(=O)C1=CC=CC=C1 77875 [1,1,0,0,0,0|1,0,0]=3 507 B10R1.15 CC[C@H](O)C1=CC=CC=C1 T71858 [1,1,0,0,0,0|1,0,1]=4 508 B10R1.15 CC[C@H](O)C1=CC=CC=C1 T72707 [1,1,0,0,0,0|1,0,1]=4 509 B10R1.15 COC(=O)C1=CN=NC=C1 23653 [1,1,0,0,0,0|2,0,0]=4 510 B10R1.15 N=C(NN)C1=CC=CC=C1 D97377 [1,1,0,0,0,0|2,0,0]=4 511 B10R1.15 NNC(=S)C1=CC=CC=C1 W10972 [1,1,0,0,0,0|1,1,0]=4 512 B10R1.15 O=C(CBr)C1=CN=CC=C1 D82267 [1,1,0,0,0,0|2,0,0]=4 513 B10R1.15 O=C(CO)C1=NC=CC=C1 AC7454 [1,1,0,0,0,0|1,0,0]=3 514 B10R1.15 O=C(NO)C1=CN=CC=C1 F17466 [1,1,0,0,0,0|1,0,0]=3 515 B10R1.15 O=C[C@H](Br)C1=CC=CC=C1 F13390 [1,1,0,0,0,0|1,0,1]=4 516 B10R1.15 O[C@@H](CF)C1=CC=CC=C1 C91661 [1,1,0,0,0,0|1,0,1]=4 517 B10R1.15 O\N=C(/Cl)C1=NC=CC=C1 O12024 [1,1,0,0,0,0|2,0,0]=4 518 B10R1.28 C[S@](=N)(=O)C1=CC=CC=C1 W16234 [1,1,0,0,0,0|2,0,0]=4 519 B10R1.28 O=S(=O)(O)C1=CC=NC=C1 12268 [1,1,0,0,0,0|2,0,0]=4 520 B10R1.113 C=C(C)C1=CC(C)=CC=C1 AC1343 [1,1,0,0,0,0|2,0,0]=4 521 B10R1.113 C=C(C)C1=CC=CC(Cl)=C1 AC1313 [1,1,0,0,0,0|2,0,0]=4 522 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 A10170 [1,1,0,0,0,0|2,0,0]=4 523 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 W17608 [1,1,0,0,0,0|2,0,0]=4 524 B10R1.113 CC(=O)C1=CC(C)=NC=C1 27585 [1,1,0,0,0,0|2,0,0]=4 525 B10R1.113 CC(=O)C1=CC(Cl)=CN=C1 78890 [1,1,0,0,0,0|2,0,0]=4 526 B10R1.113 CC(=O)C1=CC(F)=CN=C1 N13069 [1,1,0,0,0,0|2,0,0]=4 527 B10R1.113 CC(=O)C1=CC(F)=NC=C1 52239 [1,1,0,0,0,0|2,0,0]=4 528 B10R1.113 CC(=O)C1=CC(N)=NC=C1 82952 [1,1,0,0,0,0|2,0,0]=4 529 B10R1.113 CC(=O)C1=CC=CC(Cl)=C1 D77821 [1,1,0,0,0,0|1,0,0]=3 530 B10R1.113 CC(=O)C1=CC=CC(F)=N1 F30144 [1,1,0,0,0,0|2,0,0]=4 531 B10R1.113 CC(=O)C1=C[N+]([O-])=CC=C1 31268 [1,1,0,0,0,0|2,0,0]=4 532 B10R1.113 CC(=O)C1=NC=CC(Br)=C1 RB1136 [1,1,0,0,0,0|2,0,0]=4 533 B10R1.113 CC(=O)C1=NC=CC(N)=C1 C72011 [1,1,0,0,0,0|2,0,0]=4 534 B10R1.113 CC1=CC(C(=O)O)=NN=C1 P15424 [1,1,0,0,0,0|2,0,0]=4 535 B10R1.113 CC1=CC=CC(C(N)=O)=N1 AB10051 [1,1,0,0,0,0|2,0,0]=4 536 B10R1.113 CC1=CC=CC([C@H](C)O)=C1 W11160 [1,1,0,0,0,0|1,0,1]=4 537 B10R1.113 CC1=CC=CC([C@H](C)O)=C1 W11161 [1,1,0,0,0,0|1,0,1]=4 538 B10R1.113 CC1=CC=NC(C(=O)O)=N1 26974 [1,1,0,0,0,0|2,0,0]=4 539 B10R1.113 CC1=NC=CC(C(N)=O)=C1 F11696 [1,1,0,0,0,0|2,0,0]=4 540 B10R1.113 C[C@H](O)C1=CC=CC(Br)=C1 SC1266 [1,1,0,0,0,0|1,0,1]=4 541 B10R1.113 C[C@H](O)C1=CC=CC(Cl)=C1 SC1260 [1,1,0,0,0,0|1,0,1]=4 542 B10R1.113 C[C@H](O)C1=CC=CC(Cl)=C1 SC1269 [1,1,0,0,0,0|1,0,1]=4 543 B10R1.113 C[C@H](O)C1=CC=CC(F)=C1 SC1248 [1,1,0,0,0,0|1,0,1]=4 544 B10R1.113 C[N+]1=CC=CC(C(=O)[O-])=C1 41976 [1,1,0,0,0,0|1,0,1]=4 545 B10R1.113 NC(=O)C1=CC(O)=CC=C1 C75901 [1,1,0,0,0,0|1,0,0]=3 546 B10R1.113 NC(=O)C1=CC=CC(Cl)=N1 78773 [1,1,0,0,0,0|2,0,0]=4 547 B10R1.113 NC(=O)C1=CN=CC(O)=C1 W18378 [1,1,0,0,0,0|2,0,0]=4 548 B10R1.113 NC(=O)C1=NC(O)=CC=C1 C77024 [1,1,0,0,0,0|2,0,0]=4 549 B10R1.113 NC(=O)C1=NC=CC(N)=C1 S11442 [1,1,0,0,0,0|2,0,0]=4 550 B10R1.113 NC1=CC(C(=O)O)=CN=N1 P17402 [1,1,0,0,0,0|2,0,0]=4 551 B10R1.113 NC1=CC(C(=O)O)=NC=N1 26498 [1,1,0,0,0,0|2,0,0]=4 552 B10R1.113 NC1=CN=CC(C(=O)O)=N1 26349 [1,1,0,0,0,0|2,0,0]=4 553 B10R1.113 O=C(Cl)C1=CC(Cl)=NC=C1 78664 [1,1,0,0,0,0|2,0,0]=4 554 B10R1.113 O=C(Cl)C1=CC=CC(Cl)=N1 C76563 [1,1,0,0,0,0|2,0,0]=4 555 B10R1.113 O=C(O)C1=CC(S)=NC=C1 77943 [1,1,0,0,0,0|1,0,0]=3 556 B10R1.113 O=C(O)C1=CC=NC(Br)=N1 W17831 [1,1,0,0,0,0|2,0,0]=4 557 B10R1.113 O=C(O)C1=NC=CC(Cl)=N1 F19652 [1,1,0,0,0,0|2,0,0]=4 558 B10R1.113 O=C(O)C1=NC=CC(F)=C1 CL0347 [1,1,0,0,0,0|1,0,0]=3 559 B10R1.113 O=C1C=CNC(C(=O)O)=C1 N13374 [1,1,0,0,0,0|1,0,0]=3 560 B10R1.2 CC1=C(I)C=CC=C1CO CL9687 [1,1,0,0,0,0|1,0,1]=4 561 B10R1.2 CC1=CC=CC(C#N)=C1O F20100 [1,1,0,0,0,0|1,0,1]=4 562 B10R1.2 CC1=CC=CC(CN)=C1O Y10488 [1,1,0,0,0,0|1,0,1]=4 563 B10R1.2 CC1=CC=CC(CO)=C1Br 74396 [1,1,0,0,0,0|1,0,1]=4 564 B10R1.2 CC1=CC=CC(CO)=C1O F20046 [1,1,0,0,0,0|0,0,1]=3 565 B10R1.2 CC1=CC=NC(C=O)=C1Cl S10197 [1,1,0,0,0,0|2,0,0]=4 566 B10R1.2 CCC1=CC=CC(O)=C1O C77203 [1,1,0,0,0,0|1,0,1]=4 567 B10R1.2 COC1=C(O)C(N)=CC=C1 O10656 [1,1,0,0,0,0|2,0,0]=4 568 B10R1.2 COC1=CC=CC(Cl)=C1O O10746 [1,1,0,0,0,0|2,0,0]=4 569 B10R1.2 COC1=CC=CC(I)=C1O 84030 [1,1,0,0,0,0|2,0,0]=4 570 B10R1.2 N#CC1=CC=CC(F)=C1O 75820 [1,1,0,0,0,0|1,0,1]=4 571 B10R1.2 NC1=C(Br)C=CC=C1C=O 36406 [1,1,0,0,0,0|1,0,0]=3 572 B10R1.2 NC1=C(Br)C=NC=C1C=O C72169 [1,1,0,0,0,0|2,0,0]=4 573 B10R1.2 NC1=C(C=O)C=CC=C1O D94436 [1,1,0,0,0,0|1,0,0]=3 574 B10R1.2 NC1=C(Cl)C=NC=C1C=O 98150 [1,1,0,0,0,0|2,0,0]=4 575 B10R1.2 NC1=C(F)C=CC=C1CO W11419 [1,1,0,0,0,0|1,0,1]=4 576 B10R1.2 NCC1=CC=CC(O)=C1O S10740 [1,1,0,0,0,0|1,0,1]=4 577 B10R1.2 O=CC1=C(F)C(Br)=NC=C1 BL009674 [1,1,0,0,0,0|2,0,0]=4 578 B10R1.2 O=CC1=CC=CC(F)=C1I 34605 [1,1,0,0,0,0|1,0,0]=3 579 B10R1.2 O=CC1=CC=NC(F)=C1Cl 91702 [1,1,0,0,0,0|2,0,0]=4 580 B10R1.2 O=CC1=CN=CC(Br)=C1Cl 66142 [1,1,0,0,0,0|2,0,0]=4 581 B10R1.2 O=CC1=CN=CC(Br)=C1O D82530 [1,1,0,0,0,0|1,0,0]=3 582 B10R1.2 O=CC1=NC=CC(Cl)=C1Br P19340 [1,1,0,0,0,0|2,0,0]=4 583 B10R1.2 OCC1=CC=CC(F)=C1Br 35519 [1,1,0,0,0,0|1,0,1]=4 584 B10R1.2 OCC1=CC=CC(F)=C1Cl CL8694 [1,1,0,0,0,0|1,0,1]=4 585 B10R1.2 OCC1=CC=CC(F)=C1I 79245 [1,1,0,0,0,0|1,0,1]=4 586 B10R1.2 OCC1=CC=CC(I)=C1Br CL8691 [1,1,0,0,0,0|1,0,1]=4 587 B10R1.4 CCNC1=C(O)C=CC=C1 I11473 [1,1,0,0,0,0|1,0,1]=4 588 B10R1.4 COCC1=C(O)C=CC=C1 AC1453 [1,1,0,0,0,0|0,0,1]=3 589 B10R1.4 N#CCC1=C(O)C=CC=C1 32266 [1,1,0,0,0,0|1,0,1]=4 590 B10R1.4 NCCC1=C(O)C=CC=C1 83456 [1,1,0,0,0,0|1,0,1]=4 591 B10R1.4 O=CCC1=C(Br)C=CC=C1 W16824 [1,1,0,0,0,0|1,0,0]=3 592 B10R1.4 O=CCC1=C(F)C=CC=C1 W16825 [1,1,0,0,0,0|1,0,0]=3 593 B10R1.20 C=CC1=C(CO)C=CC=C1 C74805 [1,1,0,0,0,0|1,0,0]=3 594 B10R1.20 CNC1=C(C=O)C=CC=C1 O10528 [1,1,0,0,0,0|1,0,0]=3 595 B10R1.20 CNC1=C(C=O)C=CC=N1 FD10569 [1,1,0,0,0,0|2,0,0]=4 596 B10R1.20 COC1=C(C=O)C=CN=C1 P17577 [1,1,0,0,0,0|1,0,0]=3 597 B10R1.20 COC1=C(CO)N=CC=C1 F17518 [1,1,0,0,0,0|1,0,1]=4 598 B10R1.20 COC1=CC=CN=C1C=O P10318 [1,1,0,0,0,0|1,0,0]=3 599 B10R1.20 CSC1=C(C=O)C=CC=C1 T72851 [1,1,0,0,0,0|0,1,0]=3 600 B10R1.20 N#CC1=C(C=O)C=CN=C1 D82534 [1,1,0,0,0,0|2,0,0]=4 601 B10R1.20 OCC1=C(CBr)C=CC=C1 O10024 [1,1,0,0,0,0|1,0,1]=4 602 B10R1.20 OCC1=C(CF)C=CC=C1 W10520 [1,1,0,0,0,0|1,0,1]=4 603 B10R1.20 OCC1=C(CO)C=NC=C1 30227 [1,1,0,0,0,0|1,0,1]=4 604 B10R1.20 OCC1=C(CO)C=NC=C1 39456 [1,1,0,0,0,0|1,0,1]=4 605 B10R1.20 OCC1=CC=CN=C1CO 75308 [1,1,0,0,0,0|1,0,1]=4 606 B10R1.20 OCC1=CC=CN=C1CO S11918 [1,1,0,0,0,0|1,0,1]=4 607 B10R1.25 C=CC1=C(Br)C=C(F)C=C1 S10822 [1,1,0,0,0,0|2,0,0]=4 608 B10R1.25 CC1=C(C=O)C=CC(Br)=N1 C16730 [1,1,0,0,0,0|2,0,0]=4 609 B10R1.25 CC1=C(C=O)C=CC(F)=N1 C76919 [1,1,0,0,0,0|2,0,0]=4 610 B10R1.25 CC1=C(CO)C=CC(N)=C1 F19834 [1,1,0,0,0,0|1,0,1]=4 611 B10R1.25 CC1=CC(Br)=NC=C1C=O C77172 [1,1,0,0,0,0|2,0,0]=4 612 B10R1.25 CC1=CC(C)=C(C=O)C=N1 C14259 [1,1,0,0,0,0|2,0,0]=4 613 B10R1.25 CC1=CC=C(C=O)C(Br)=N1 D82345 [1,1,0,0,0,0|2,0,0]=4 614 B10R1.25 N#CC1=C(O)C=C(N)C=C1 S10894 [1,1,0,0,0,0|1,0,1]=4 615 B10R1.25 N#CC1=C(O)C=C(O)C=C1 C76016 [1,1,0,0,0,0|1,0,1]=4 616 B10R1.25 NC1=C(C=O)C=CC(F)=C1 34566 [1,1,0,0,0,0|1,0,0]=3 617 B10R1.25 NC1=CC(Br)=C(C=O)C=C1 C16178 [1,1,0,0,0,0|1,0,0]=3 618 B10R1.25 NC1=CC(Br)=CN=C1C=O P13238 [1,1,0,0,0,0|2,0,0]=4 619 B10R1.25 NC1=CC(Cl)=NC=C1C=O 22929 [1,1,0,0,0,0|2,0,0]=4 620 B10R1.25 NC1=CC(F)=C(C=O)C=C1 AC6806 [1,1,0,0,0,0|1,0,0]=3 621 B10R1.25 NC1=CC(F)=CN=C1C=O D83274 [1,1,0,0,0,0|2,0,0]=4 622 B10R1.25 NC1=CC(N)=C(C=O)C=C1 C10737 [1,1,0,0,0,0|1,0,0]=3 623 B10R1.25 NCC1=C(O)C=C(Br)C=C1 N13143 [1,1,0,0,0,0|1,0,1]=4 624 B10R1.25 O=CC1=C(Br)C=C(Br)C=N1 W15435 [1,1,0,0,0,0|2,0,0]=4 625 B10R1.25 O=CC1=C(Br)C=C(Cl)C=N1 BL010229 [1,1,0,0,0,0|2,0,0]=4 626 B10R1.25 O=CC1=C(Br)C=C(F)C=N1 58153 [1,1,0,0,0,0|2,0,0]=4 627 B10R1.25 O=CC1=C(Br)C=C(I)C=C1 67919 [1,1,0,0,0,0|1,0,0]=3 628 B10R1.25 O=CC1=C(Cl)C=C(Cl)C=N1 80307 [1,1,0,0,0,0|2,0,0]=4 629 B10R1.25 O=CC1=C(Cl)N=C(Br)C=C1 26730 [1,1,0,0,0,0|2,0,0]=4 630 B10R1.25 O=CC1=C(F)C=C(F)C=N1 F11044 [1,1,0,0,0,0|2,0,0]=4 631 B10R1.25 O=CC1=C(F)N=C(Br)C=C1 74727 [1,1,0,0,0,0|2,0,0]=4 632 B10R1.25 O=CC1=C(I)C=C(F)C=C1 CL9496 [1,1,0,0,0,0|1,0,0]=3 633 B10R1.25 O=CC1=C(O)N=C(Br)C=C1 D80553 [1,1,0,0,0,0|1,0,0]=3 634 B10R1.25 O=CC1=CC=C(Cl)N=C1Br C71249 [1,1,0,0,0,0|2,0,0]=4 635 B10R1.25 O=CC1=CC=C(F)N=C1Cl F12185 [1,1,0,0,0,0|2,0,0]=4 636 B10R1.25 O=CC1=CN=C(Br)C=C1Cl CL0319 [1,1,0,0,0,0|2,0,0]=4 637 B10R1.25 OCC1=C(Br)C=C(O)C=C1 98273 [1,1,0,0,0,0|1,0,1]=4 638 B10R1.25 OCC1=C(Cl)C=C(O)C=C1 CL9122 [1,1,0,0,0,0|1,0,1]=4 639 B10R1.25 OCC1=C(I)C=C(Cl)C=C1 95677 [1,1,0,0,0,0|1,0,1]=4 640 B10R1.25 OCC1=C(O)C=C(Br)C=C1 35526 [1,1,0,0,0,0|0,0,1]=3 641 B10R1.30 CC1=C(C=O)C=C(Cl)C=C1 CK2094 [1,1,0,0,0,0|1,0,0]=3 642 B10R1.30 CC1=C(C=O)C=C(I)C=C1 F20710 [1,1,0,0,0,0|1,0,0]=3 643 B10R1.30 CC1=C(CO)C=C(Cl)C=C1 70915 [1,1,0,0,0,0|1,0,1]=4 644 B10R1.30 CC1=C(CO)C=C(I)C=C1 F20542 [1,1,0,0,0,0|1,0,1]=4 645 B10R1.30 CC1=CC(C#N)=C(O)C=C1 90838 [1,1,0,0,0,0|1,0,1]=4 646 B10R1.30 CC1=CC(C=O)=C(I)C=C1 H10219 [1,1,0,0,0,0|1,0,0]=3 647 B10R1.30 CC1=CC(CO)=C(Br)C=C1 78891 [1,1,0,0,0,0|1,0,1]=4 648 B10R1.30 CC1=CC(CO)=C(O)C=C1 A11080 [1,1,0,0,0,0|0,0,1]=3 649 B10R1.30 CC1=CC=C(O)C(C=O)=N1 W11337 [1,1,0,0,0,0|1,0,0]=3 650 B10R1.30 CC1=CN=C(Cl)C(C=O)=C1 81874 [1,1,0,0,0,0|2,0,0]=4 651 B10R1.30 CC1=CNC(=O)C(C=O)=C1 O11471 [1,1,0,0,0,0|1,0,1]=4 652 B10R1.30 CC1=NC(C=O)=C(F)C=C1 P17355 [1,1,0,0,0,0|2,0,0]=4 653 B10R1.30 CC1=NC=C(Cl)C=C1C=O CL0290 [1,1,0,0,0,0|2,0,0]=4 654 B10R1.30 N#CC1=C(O)C=CC(O)=C1 C75243 [1,1,0,0,0,0|1,0,1]=4 655 B10R1.30 NC1=C(C=O)C=C(F)C=C1 88468 [1,1,0,0,0,0|1,0,0]=3 656 B10R1.30 NC1=CC(CO)=C(Cl)C=C1 35510 [1,1,0,0,0,0|1,0,1]=4 657 B10R1.30 NC1=CN=C(Br)C=C1C=O P19339 [1,1,0,0,0,0|2,0,0]=4 658 B10R1.30 NCC1=C(O)C=CC(Br)=C1 O10496 [1,1,0,0,0,0|1,0,1]=4 659 B10R1.30 O=CC1=C(Br)C=NC(Cl)=C1 P11217 [1,1,0,0,0,0|2,0,0]=4 660 B10R1.30 O=CC1=C(Br)C=NC(O)=C1 F30966 [1,1,0,0,0,0|2,0,0]=4 661 B10R1.30 O=CC1=C(F)C=CC(Cl)=N1 C10107 [1,1,0,0,0,0|2,0,0]=4 662 B10R1.30 O=CC1=C(I)C=CC(F)=C1 34607 [1,1,0,0,0,0|1,0,0]=3 663 B10R1.30 O=CC1=CC(Br)=CNC1=O C71890 [1,1,0,0,0,0|1,0,1]=4 664 B10R1.30 O=CC1=CC(Cl)=CN=C1Br 79175 [1,1,0,0,0,0|2,0,0]=4 665 B10R1.30 O=CC1=CC(Cl)=NC=C1O 93891 [1,1,0,0,0,0|1,0,0]=3 666 B10R1.30 O=CC1=CC(F)=CN=C1Cl 85374 [1,1,0,0,0,0|2,0,0]=4 667 B10R1.30 OCC1=C(Cl)C=CC(O)=C1 C76883 [1,1,0,0,0,0|1,0,1]=4 668 B10R1.30 OCC1=CC(Br)=CN=C1O C71870 [1,1,0,0,0,0|1,0,1]=4 669 B10R1.245 C=CC1=C(Br)C=CN=C1O P17602 [1,1,0,0,0,0|2,0,0]=4 670 B10R1.245 C=CC1=C(Cl)C=CC=C1Cl CK2536 [1,1,0,0,0,0|2,0,0]=4 671 B10R1.245 C=CC1=C(F)C=CN=C1O P17601 [1,1,0,0,0,0|2,0,0]=4 672 B10R1.245 C=CC1=C(I)C=CN=C1O P17600 [1,1,0,0,0,0|2,0,0]=4 673 B10R1.245 CC1=CC=CC(F)=C1CO W16613 [1,1,0,0,0,0|1,0,1]=4 674 B10R1.245 CC1=CC=CC(O)=C1C=O 50507 [1,1,0,0,0,0|0,0,0]=2 675 B10R1.245 CC1=CC=CC(O)=C1CO C74535 [1,1,0,0,0,0|0,0,1]=3 676 B10R1.245 COC1=C(Cl)C=CC=C1O 95656 [1,1,0,0,0,0|2,0,0]=4 677 B10R1.245 NC1=CC=CC(Br)=C1C=O 90067 [1,1,0,0,0,0|1,0,0]=3 678 B10R1.245 NC1=CC=CC(Br)=C1CO 90066 [1,1,0,0,0,0|1,0,1]=4 679 B10R1.245 NC1=CC=CC(F)=C1C=O F15850 [1,1,0,0,0,0|1,0,0]=3 680 B10R1.245 NC1=CC=CC(I)=C1C=O D70934 [1,1,0,0,0,0|1,0,0]=3 681 B10R1.245 O=CC1=C(Br)C=CN=C1Br C10771 [1,1,0,0,0,0|2,0,0]=4 682 B10R1.245 O=CC1=C(Br)C=CN=C1Cl 55291 [1,1,0,0,0,0|2,0,0]=4 683 B10R1.245 O=CC1=C(Cl)C=CN=C1F C71910 [1,1,0,0,0,0|2,0,0]=4 684 B10R1.245 O=CC1=C(F)C=NC=C1F 75700 [1,1,0,0,0,0|2,0,0]=4 685 B10R1.245 O=CC1=C(I)C=CC=C1Cl C75422 [1,1,0,0,0,0|1,0,0]=3 686 B10R1.39 COC1=C(C(=O)O)SC=C1 W12768 [0,1,0,0,1,0|1,0,0]=3 687 B10R1.39 COC1=CSC=C1C(=O)O 24669 [0,1,0,0,1,0|1,0,0]=3 688 B10R1.39 COC1=NNC=C1C(=O)O P20920 [0,1,0,0,1,0|2,0,0]=4 689 B10R1.39 O=C(O)C1=C(CO)N=CN1 D79425 [0,1,0,0,1,0|2,0,0]=4 690 B10R1.39 O=CC1=C(C(=O)O)C=CS1 94721 [0,1,0,0,1,0|1,0,1]=4 691 B10R1.39 O=CC1=C(C(=O)O)OC=C1 AT17154 [0,1,0,0,1,0|1,0,1]=4 692 B10R1.59 CC1=C(C(=O)O)C=C(Br)S1 W11336 [0,1,0,0,1,0|2,0,0]=4 693 B10R1.59 CC1=CC(Br)=C(C(=O)O)S1 D95614 [0,1,0,0,1,0|2,0,0]=4 694 B10R1.59 CC1=CC(C(=O)O)=C(C)N1 F52431 [0,1,0,0,1,0|2,0,0]=4 695 B10R1.59 CC1=CC(C)=C(C(=O)O)N1 61000 [0,1,0,0,1,0|2,0,0]=4 696 B10R1.59 CN1C=C(Br)C=C1C(=O)O 26615 [0,1,0,0,1,0|2,0,0]=4 697 B10R1.59 CN1C=C(F)C=C1C(=O)O 73060 [0,1,0,0,1,0|2,0,0]=4 698 B10R1.59 CN1C=C(N)C=C1C(=O)O 84211 [0,1,0,0,1,0|2,0,0]=4 699 B10R1.59 O=C(O)C1=C(Br)C=C(Cl)S1 C10746 [0,1,0,0,1,0|2,0,0]=4 700 B10R1.59 O=C(O)C1=C(Cl)C=C(Br)S1 N12995 [0,1,0,0,1,0|2,0,0]=4 701 B10R1.59 O=C(O)C1=C(Cl)C=C(Cl)S1 F16141 [0,1,0,0,1,0|2,0,0]=4 702 B10R1.59 O=C(O)C1=C(Cl)SC(Br)=C1 C10404 [0,1,0,0,1,0|2,0,0]=4 703 B10R1.149 COC(=O)C1=C(C)C=CN1 38966 [0,1,0,0,1,0|2,0,0]=4 704 B10R1.149 COC(=O)C1=C(O)C=CN1 C10734 [0,1,0,0,1,0|1,0,0]=3 705 B10R1.149 COC(=O)C1=CC=CN1N O11841 [0,1,0,0,1,0|2,0,0]=4 706 B10R1.149 COC(=O)C1=CSC=C1Br 27641 [0,1,0,0,1,0|2,0,0]=4 707 B10R1.149 COC(=O)C1=CSC=C1N P17958 [0,1,0,0,1,0|2,0,0]=4 708 B10R1.192 CC1=C(C(=O)O)N(C)C=C1 W18312 [0,1,0,0,1,0|2,0,0]=4 709 B10R1.194 CC1=C(C)C(C(=O)O)=CS1 71336 [0,1,0,0,1,0|2,0,0]=4 710 B10R1.194 CC1=CC=C(C(=O)O)N1C D83409 [0,1,0,0,1,0|2,0,0]=4 711 B10R1.194 CC1=CSC(C(=O)O)=C1C C77023 [0,1,0,0,1,0|2,0,0]=4 712 B10R1.194 CN1C(Br)=CC=C1C(=O)O 26338 [0,1,0,0,1,0|2,0,0]=4 713 B12R1.75 C=CC1=C(OC(C)=O)C=CC=C1 20662 [0,1,0,0,0,1|2,0,0]=4 714 B12R1.75 CC(=O)NC1=C(C=O)C=CC=C1 T70224 [0,1,0,0,0,1|1,0,1]=4 715 B12R1.75 CC(=O)OC1=C(CBr)C=CC=C1 F18015 [0,1,0,0,0,1|2,0,0]=4 716 B12R1.75 CCC1=C(CC(=O)O)C=CC=C1 C15212 [0,1,0,0,0,1|1,0,0]=3 717 B12R1.75 COC1=C(CC(=O)O)C=CC=N1 71805 [0,1,0,0,0,1|1,0,0]=3 718 B12R1.75 COC1=CC=CN=C1CC(=O)[O-] 81711 [0,1,0,0,0,1|1,0,1]=4 719 B12R1.75 O=C(O)CC1=C(CBr)C=CC=C1 W10194 [0,1,0,0,0,1|1,0,0]=3 720 B12R1.75 O=CC1=C(CC(=O)O)C=CC=C1 C12630 [0,1,0,0,0,1|0,0,1]=3 721 B12R1.124 CC1=C([C@@H](N)C(=O)O)C=CC=C1 D83457 [0,1,0,0,0,1|1,0,0]=3 722 B12R1.124 CC1=C([C@@H](N)C(=O)O)C=CC=C1 Y11801 [0,1,0,0,0,1|1,0,0]=3 723 B12R1.124 C[C@@H](C(=O)O)N1C=CC=CC1=O W16391 [0,1,0,0,0,1|1,0,1]=4 724 B12R1.124 N[C@@H](C(=O)O)C1=C(Br)C=CC=C1 AT21607 [0,1,0,0,0,1|1,0,0]=3 725 B12R1.124 N[C@@H](C(=O)O)C1=C(Br)C=CC=C1 Y10528 [0,1,0,0,0,1|1,0,0]=3 726 B12R1.124 N[C@@H](C(=O)O)C1=C(Cl)C=CC=C1 Y11747 [0,1,0,0,0,1|1,0,0]=3 727 B12R1.124 N[C@@H](C(=O)O)C1=C(Cl)C=CC=C1 Y11901 [0,1,0,0,0,1|1,0,0]=3 728 B12R1.124 N[C@@H](C(=O)O)C1=C(F)C=CC=C1 Y13377 [0,1,0,0,0,1|1,0,0]=3 729 B12R1.124 N[C@@H](C(=O)O)C1=C(F)C=CC=C1 Y13378 [0,1,0,0,0,1|1,0,0]=3 730 B12R1.124 N[C@@H](C(=O)O)C1=C(O)C=CC=C1 Y10677 [0,1,0,0,0,1|0,0,0]=2 731 B12R1.124 O=C(O)C(=O)C1=C(Cl)C=CC=C1 AB11009 [0,1,0,0,0,1|1,0,0]=3 732 B12R1.124 O=C(O)C(=O)C1=C(F)C=CC=C1 AB7290 [0,1,0,0,0,1|1,0,0]=3 733 B12R1.124 O=C(O)[C@H](Br)C1=C(Br)C=CC=C1 P20733 [0,1,0,0,0,1|1,0,0]=3 734 B12R1.124 O=C(O)[C@H](F)C1=C(Cl)C=CC=C1 98561 [0,1,0,0,0,1|1,0,0]=3 735 B12R1.127 CC(=O)NC1=C(Br)C=CC(Br)=C1 28021 [0,1,0,0,0,1|2,0,0]=4 736 B12R1.127 CC(=O)NC1=C(O)C=CC(Cl)=C1 F19911 [0,1,0,0,0,1|1,0,0]=3 737 B12R1.127 CC1=CC(CC(=O)O)=C(F)C=C1 CK1027 [0,1,0,0,0,1|1,0,0]=3 738 B12R1.127 O=C(O)CC1=C(O)C=CC(Cl)=C1 AC5703 [0,1,0,0,0,1|0,0,0]=2 739 B12R1.224 CC(=O)CC1=CC=CC(F)=C1F Y12421 [0,1,0,0,0,1|2,0,0]=4 740 B12R1.224 CC(=O)NC1=C(Cl)C(C)=CC=C1 75491 [0,1,0,0,0,1|2,0,0]=4 741 B12R1.224 CC1=C(CC(=O)O)C=CC=C1N 78655 [0,1,0,0,0,1|1,0,0]=3 742 B12R1.224 CC1=C(I)C=CC=C1CC(=O)O CL9700 [0,1,0,0,0,1|1,0,0]=3 743 B12R1.224 O=C(O)CC1=CC=CC(Br)=C1Cl CL9124 [0,1,0,0,0,1|1,0,0]=3 744 B12R1.233 CC(=O)CC1=C(Br)C=C(Cl)C=C1 C72216 [0,1,0,0,0,1|2,0,0]=4 745 B12R1.233 CC(=O)CC1=C(F)C=C(F)C=C1 N12745 [0,1,0,0,0,1|2,0,0]=4 746 B12R1.233 CC(=O)NC1=C(I)C=C(Br)C=C1 71393 [0,1,0,0,0,1|2,0,0]=4 747 B12R1.233 CC(=O)NC1=C(O)C=C(C)C=C1 D96026 [0,1,0,0,0,1|1,0,0]=3 748 B12R1.233 CC1=C(CC(=O)O)C=CC(N)=C1 72069 [0,1,0,0,0,1|1,0,0]=3 749 B12R1.233 NC1=C(CC(=O)O)C=CC(Br)=C1 98287 [0,1,0,0,0,1|1,0,0]=3 750 B12R1.233 NC1=CC(Br)=CN=C1CC(=O)O 27445 [0,1,0,0,0,1|2,0,0]=4 751 B12R1.233 O=C(O)CC1=C(F)C=C(O)C=C1 CL8759 [0,1,0,0,0,1|1,0,0]=3 752 B12R1.233 O=C(O)CC1=C(O)C=C(Br)C=C1 CL9173 [0,1,0,0,0,1|0,0,0]=2 753 B12R1.233 O=C(O)CC1=CC=C(Cl)N=C1Cl D83232 [0,1,0,0,0,1|2,0,0]=4 754 B12R1.371 C=CC(=O)NC1=C(I)C=CC=C1 AR2315 [0,1,0,0,0,1|2,0,0]=4 755 B12R1.371 CC1=C(C\C(N)=N/O)C=CC=C1 W10713 [0,1,0,0,0,1|2,0,0]=4 756 B12R1.371 CCC(=O)CC1=C(F)C=CC=C1 N14134 [0,1,0,0,0,1|2,0,0]=4 757 B12R1.371 CCC(=O)NC1=C(N)C=CC=C1 D93364 [0,1,0,0,0,1|2,0,0]=4 758 B12R1.371 CNC(=O)CC1=C(Cl)C=CC=C1 W10824 [0,1,0,0,0,1|2,0,0]=4 759 B12R1.371 COC(=O)CC1=C(Br)C=NC=C1 D72052 [0,1,0,0,0,1|2,0,0]=4 760 B12R1.371 COC(=O)CC1=C(I)C=CC=C1 D93618 [0,1,0,0,0,1|1,0,0]=3 761 B12R1.371 COC(=O)CC1=C(N)C=CC=C1 26282 [0,1,0,0,0,1|1,0,0]=3 762 B12R1.371 COC(=O)CC1=C(N)C=CC=C1 35782 [0,1,0,0,0,1|1,0,0]=3 763 B12R1.371 COC(=O)NC1=C(C)C=CN=C1 12221 [0,1,0,0,0,1|2,0,0]=4 764 B12R1.371 NNC(=O)CC1=C(Br)C=CC=C1 AB10425 [0,1,0,0,0,1|2,0,0]=4 765 B12R1.371 N\C(CC1=C(Br)C=CC=C1)=N\O W10717 [0,1,0,0,0,1|2,0,0]=4 766 B12R1.1009 CC(=O)NC1=C(Cl)C=CC=C1Cl AB10318 [0,1,0,0,0,1|2,0,0]=4 767 B12R1.1009 NC(=O)CC1=C(Cl)C=CC=C1Cl A12848 [0,1,0,0,0,1|2,0,0]=4 768 B12R1.46 COC1=C(C(=O)O)C=C(C)C=N1 D71991 [0,2,0,0,0,0|1,0,0]=3 769 B12R1.46 COC1=C(C(=O)O)C=C(N)C=C1 A12433 [0,2,0,0,0,0|0,0,0]=2 770 B12R1.46 COC1=C(C(=O)O)C=C(O)C=C1 D95032 [0,2,0,0,0,0|0,0,0]=2 771 B12R1.46 COC1=C(C(=O)O)N=C(Br)C=C1 C72022 [0,2,0,0,0,0|1,0,0]=3 772 B12R1.46 COC1=CN=C(C)N=C1C(=O)O P11688 [0,2,0,0,0,0|2,0,0]=4 773 B12R1.46 NC1=CC(B(O)O)=C(CO)C=C1 C71548 [0,2,0,0,0,0|1,0,1]=4 774 B12R1.46 O=CC1=C(C(=O)O)C=C(Br)C=C1 94689 [0,2,0,0,0,0|0,0,1]=3 775 B12R1.46 O=[N+]([O-])C1=C(CO)C=CC(O)=C1 C76783 [0,2,0,0,0,0|1,0,1]=4 776 B12R1.46 OCC1=C(B(O)O)C=C(F)C=C1 N11788 [0,2,0,0,0,0|1,0,1]=4 777 B12R1.57 CCC1=C(C(=O)O)C=CC(Br)=C1 D95188 [0,2,0,0,0,0|1,0,0]=3 778 B12R1.57 CCC1=C(C(=O)O)C=CC(N)=C1 D70908 [0,2,0,0,0,0|1,0,0]=3 779 B12R1.57 COC1=C(C(=O)O)C=CC(Br)=N1 FD10660 [0,2,0,0,0,0|1,0,0]=3 780 B12R1.57 COC1=C(C(=O)O)C=CC(C)=N1 W17747 [0,2,0,0,0,0|1,0,0]=3 781 B12R1.57 COC1=C(C(=O)O)C=CC(Cl)=N1 C76053 [0,2,0,0,0,0|1,0,0]=3 782 B12R1.57 COC1=C(C(=O)O)C=CC(N)=N1 F52096 [0,2,0,0,0,0|1,0,0]=3 783 B12R1.57 COC1=CC(Br)=CN=C1C(=O)O 97690 [0,2,0,0,0,0|1,0,0]=3 784 B12R1.57 COC1=CC(Br)=CN=C1C(C)=O O10302 [0,2,0,0,0,0|2,0,0]=4 785 B12R1.57 COC1=CC(Cl)=CN=C1C(=O)O P15419 [0,2,0,0,0,0|1,0,0]=3 786 B12R1.57 N#CC1=C(C(=O)O)C=CC(F)=C1 22725 [0,2,0,0,0,0|1,0,0]=3 787 B12R1.57 NNC1=C(C(=O)O)C=CC(Br)=C1 Y14877 [0,2,0,0,0,0|1,0,0]=3 788 B12R1.57 O=C(O)C1=C(CO)C=C(Br)C=C1 C76109 [0,2,0,0,0,0|0,0,0]=2 789 B12R1.57 O=CC1=C(C(=O)O)C=CC(F)=C1 C71597 [0,2,0,0,0,0|0,0,1]=3 790 B12R1.57 O=CC1=CC(Cl)=NC=C1C(=O)O D85827 [0,2,0,0,0,0|1,0,1]=4 791 B12R1.57 O=[N+]([O-])C1=C(CO)C=C(O)C=C1 TD1016 [0,2,0,0,0,0|1,0,1]=4 792 B12R1.77 C=CC1=C(C(=O)OC)C=CC=C1 F53555 [0,2,0,0,0,0|1,0,0]=3 793 B12R1.77 C=CC1=C(C(=O)OC)C=CC=N1 70929 [0,2,0,0,0,0|2,0,0]=4 794 B12R1.77 COC(=O)C1=C(C#N)C=NC=C1 85332 [0,2,0,0,0,0|2,0,0]=4 795 B12R1.77 COC(=O)C1=C(CCl)C=CN=C1 63528 [0,2,0,0,0,0|2,0,0]=4 796 B12R1.77 COC(=O)C1=C(CN)N=CC=C1 O11853 [0,2,0,0,0,0|2,0,0]=4 797 B12R1.77 COC(=O)C1=C(NN)C=CC=C1 20930 [0,2,0,0,0,0|1,0,0]=3 798 B12R1.77 COC(=O)C1=CC=CN=C1CCl 84738 [0,2,0,0,0,0|2,0,0]=4 799 B12R1.77 COC(=O)C1=NC=CC=C1C#N AC6324 [0,2,0,0,0,0|2,0,0]=4 800 B12R1.77 COC(=O)C1=NC=CC=C1OC 27447 [0,2,0,0,0,0|1,0,0]=3 801 B12R1.77 COC1=C([C@@H](N)CO)C=CC=C1 A12272 [0,2,0,0,0,0|1,0,1]=4 802 B12R1.77 COC1=C([C@@H](N)CO)C=CC=C1 Y10337 [0,2,0,0,0,0|1,0,1]=4 803 B12R1.77 COC1=C([C@@H](N)CO)C=CC=C1 Y11070 [0,2,0,0,0,0|1,0,1]=4 804 B12R1.77 COC1=C([C@@H](N)CO)C=CC=C1 Y11299 [0,2,0,0,0,0|1,0,1]=4 805 B12R1.77 COC1=C([C@@H](O)CN)C=CC=C1 AR2903 [0,2,0,0,0,0|1,0,1]=4 806 B12R1.77 COC1=C(\C(N)=N\O)C=CC=C1 W10707 [0,2,0,0,0,0|1,0,0]=3 807 B12R1.77 N#CC1=C(C(=O)CBr)C=CC=C1 F13302 [0,2,0,0,0,0|2,0,0]=4 808 B12R1.87 CC1=CC=CC([N+](=O)[O-])=C1CO D84311 [0,2,0,0,0,0|1,0,1]=4 809 B12R1.87 CCC1=C(Br)C=CC=C1C(=O)O W18407 [0,2,0,0,0,0|1,0,0]=3 810 B12R1.87 CNC1=C(F)C=CC=C1C(=O)O N12920 [0,2,0,0,0,0|1,0,0]=3 811 B12R1.87 COC1=C(Br)C=CC=C1C(C)=O F13154 [0,2,0,0,0,0|1,0,0]=3 812 B12R1.87 COC1=C(Br)C=CC=C1C(N)=O C76534 [0,2,0,0,0,0|1,0,0]=3 813 B12R1.87 COC1=C(Br)C=CC=C1[C@H](C)O P14982 [0,2,0,0,0,0|1,0,1]=4 814 B12R1.87 COC1=C(Cl)C=CN=C1C(=O)O F11124 [0,2,0,0,0,0|1,0,0]=3 815 B12R1.87 COC1=C(F)C=CC=C1C(C)=O F13156 [0,2,0,0,0,0|1,0,0]=3 816 B12R1.87 NC1=CC=CC([N+](=O)[O-])=C1CO AC7482 [0,2,0,0,0,0|1,0,1]=4 817 B12R1.261 CC(=O)C1=C(B(O)O)C=CC=C1 50324 [0,2,0,0,0,0|1,0,0]=3 818 B12R1.261 CC(=O)C1=CC=CN=C1C(=O)O D95040 [0,2,0,0,0,0|1,0,1]=4 819 B12R1.261 CN(C)C1=C(C(=O)O)C=CC=N1 79702 [0,2,0,0,0,0|2,0,0]=4 820 B12R1.261 C[C@H](N)C1=C(C(=O)O)C=CC=C1 Y10100 [0,2,0,0,0,0|1,0,0]=3 821 B12R1.261 C[C@H](N)C1=C(C(=O)O)C=CC=C1 Y12102 [0,2,0,0,0,0|1,0,0]=3 822 B12R1.261 C[C@H](N)C1=C(C(=O)O)C=CC=C1 Y12103 [0,2,0,0,0,0|1,0,0]=3 823 B12R1.261 C[S@](=O)C1=C(B(O)O)C=CC=C1 A12888 [0,2,0,0,0,0|2,0,0]=4 824 B12R1.261 NC(=O)C1=C(B(O)O)C=CC=C1 I11215 [0,2,0,0,0,0|1,0,0]=3 825 B12R1.261 NC(=O)C1=C(C(=O)O)C=CC=N1 W10225 [0,2,0,0,0,0|1,0,1]=4 826 B12R1.261 NC(=O)C1=CC=CN=C1C(=O)O T70945 [0,2,0,0,0,0|1,0,1]=4 827 B12R1.261 O=C(O)C1=C(B(O)O)C=NC=C1 A11877 [0,2,0,0,0,0|1,0,0]=3 828 B12R1.283 CC(=O)C1=C(CC#N)C=CC=C1 W16908 [0,2,0,0,0,0|2,0,0]=4 829 B12R1.283 CCCC1=CC=CN=C1C(=O)O D93328 [0,2,0,0,0,0|2,0,0]=4 830 B12R1.283 CCOC1=C(C(=O)O)C=CN=C1 C76521 [0,2,0,0,0,0|1,0,0]=3 831 B12R1.283 NCCC1=C(C(=O)O)C=CC=C1 52097 [0,2,0,0,0,0|1,0,0]=3 832 B12R1.283 O\N=C\C1=C(B(O)O)C=CC=C1 I12186 [0,2,0,0,0,0|1,0,1]=4 833 B12R1.437 COC1=C(B(O)O)C(C)=CC=C1 C72960 [0,2,0,0,0,0|1,0,1]=4 834 B12R1.437 COC1=C(C(=O)O)C(F)=NC=C1 O10781 [0,2,0,0,0,0|1,0,0]=3 835 B12R1.437 COC1=C(C(=O)O)C(N)=CN=C1 52218 [0,2,0,0,0,0|1,0,0]=3 836 B12R1.437 COC1=C(C(C)=O)C(C)=CC=C1 C75893 [0,2,0,0,0,0|1,0,0]=3 837 B12R1.437 COC1=CC=CC(Br)=C1C(C)=O O10259 [0,2,0,0,0,0|1,0,0]=3 838 B12R1.437 COC1=CC=CC(Br)=C1C(N)=O C72080 [0,2,0,0,0,0|1,0,0]=3 839 B12R1.437 COC1=CC=CC(Cl)=C1C(C)=O 25880 [0,2,0,0,0,0|1,0,0]=3 840 B12R1.437 COC1=CC=CC(I)=C1C(=O)O 58592 [0,2,0,0,0,0|0,0,0]=2 841 B12R1.437 COC1=CC=CC(I)=C1[N+](=O)[O-] S11058 [0,2,0,0,0,0|1,0,1]=4 842 B12R1.437 COC1=CN=CC(Cl)=C1C(=O)O 64353 [0,2,0,0,0,0|1,0,0]=3 843 B12R1.437 COC1=NC=CC(Cl)=C1C(=O)O C13695 [0,2,0,0,0,0|1,0,0]=3 844 B12R1.437 COC1=NC=CC(F)=C1C(=O)O D93132 [0,2,0,0,0,0|1,0,0]=3 845 B12R1.437 N#CC1=CC=CC(Br)=C1C(=O)O CL9646 [0,2,0,0,0,0|1,0,0]=3 846 B12R1.437 N#CC1=CC=CC(F)=C1C(=O)O 38034 [0,2,0,0,0,0|1,0,0]=3 847 B12R1.437 N#CC1=CC=CC(O)=C1[N+](=O)[O-] D71944 [0,2,0,0,0,0|1,0,1]=4 848 B12R1.437 O=CC1=CC=CC(F)=C1C(=O)O D80402 [0,2,0,0,0,0|0,0,1]=3 849 B12R1.437 O=CC1=CC=CC(O)=C1[N+](=O)[O-] 57730 [0,2,0,0,0,0|1,0,1]=4 850 B12R1.126 CC1=CC(O)=C(S(=O)(=O)O)C=C1 N11832 [0,2,0,0,0,0|1,0,0]=3 851 B12R1.128 CC1=CC(P(=O)(O)O)=C(N)C=C1 D83786 [0,2,0,0,0,0|2,0,0]=4 852 B12R1.128 CS(=O)(=O)C1=C(O)C=CC(Br)=C1 C76900 [0,2,0,0,0,0|1,0,1]=4 853 B12R1.128 O=S(=O)(O)C1=C(O)C=CC(O)=C1 F20533 [0,2,0,0,0,0|1,0,0]=3 854 B12R1.195 COS(=O)(=O)C1=C(I)C=CC=C1 P17004 [0,2,0,0,0,0|2,0,0]=4 855 B12R1.1010 NC1=CC=CC(O)=C1S(=O)(=O)O N16855 [0,2,0,0,0,0|1,0,0]=3 856 B12R1.894 CC(=O)C1=C(Cl)C=CC(F)=C1F E70350 [0,2,0,0,0,0|2,0,0]=4 857 B12R1.894 CC1=C(Br)C=CC(F)=C1C(=O)O 74625 [0,2,0,0,0,0|1,0,0]=3 858 B12R1.894 CC1=C(Br)C=CC(N)=C1C(=O)O C71962 [0,2,0,0,0,0|1,0,0]=3 859 B12R1.894 CC1=C(Br)C=NC(N)=C1C(=O)O F20034 [0,2,0,0,0,0|2,0,0]=4 860 B12R1.894 CC1=C(C(=O)O)C(F)=C(Br)C=C1 D80937 [0,2,0,0,0,0|1,0,0]=3 861 B12R1.894 CC1=C(C(=O)O)C(N)=C(F)C=C1 72128 [0,2,0,0,0,0|1,0,0]=3 862 B12R1.894 CC1=C(F)C(C(=O)O)=C(I)C=C1 90582 [0,2,0,0,0,0|1,0,0]=3 863 B12R1.894 CC1=CC=C(C)C(C(=O)O)=C1N 78661 [0,2,0,0,0,0|1,0,0]=3 864 B12R1.894 CC1=CC=C(F)C(C(=O)O)=C1Br N12259 [0,2,0,0,0,0|1,0,0]=3 865 B12R1.894 CC1=CC=C(F)C(F)=C1C(=O)O 95584 [0,2,0,0,0,0|1,0,0]=3 866 B12R1.894 CC1=CC=C(O)C([N+](=O)[O-])=C1F C90833 [0,2,0,0,0,0|1,0,1]=4 867 B12R1.894 NC(=O)C1=C(I)C=CC(Br)=C1F W11910 [0,2,0,0,0,0|2,0,0]=4 868 B12R1.894 NC1=C(C(=O)O)C(Br)=C(I)C=C1 94239 [0,2,0,0,0,0|1,0,0]=3 869 B12R1.894 NC1=C(C(=O)O)C(F)=C(Br)C=C1 79998 [0,2,0,0,0,0|1,0,0]=3 870 B12R1.894 NC1=C(C(=O)O)C(F)=C(Cl)C=C1 C91478 [0,2,0,0,0,0|1,0,0]=3 871 B12R1.894 NC1=C(F)C=CC(Br)=C1C(=O)O F50736 [0,2,0,0,0,0|1,0,0]=3 872 B12R1.894 NC1=C(F)C=CC(Cl)=C1C(=O)O W16945 [0,2,0,0,0,0|1,0,0]=3 873 B12R1.894 NC1=C(F)C=CC(F)=C1C(=O)O F11053 [0,2,0,0,0,0|1,0,0]=3 874 B12R1.894 NC1=CC=C(Cl)C(Br)=C1C(=O)O C76067 [0,2,0,0,0,0|1,0,0]=3 875 B12R1.894 NC1=CC=C(Cl)C(Cl)=C1C(=O)O C90815 [0,2,0,0,0,0|1,0,0]=3 876 B12R1.894 NC1=CC=C(F)C(Br)=C1C(=O)O F53350 [0,2,0,0,0,0|1,0,0]=3 877 B12R1.894 O=C(O)C1=C(Br)C=CC(F)=C1F 89226 [0,2,0,0,0,0|1,0,0]=3 878 B12R1.894 O=C(O)C1=C(Cl)C=CC(Br)=C1Cl 39188 [0,2,0,0,0,0|1,0,0]=3 879 B12R1.894 O=C(O)C1=C(F)C(Cl)=NC=C1Cl 90319 [0,2,0,0,0,0|2,0,0]=4 880 B12R1.894 O=C(O)C1=C(F)C(F)=CC=C1O O10572 [0,2,0,0,0,0|0,0,0]=2 881 B12R1.894 O=C(O)C1=C(F)C=CC(O)=C1O P16935 [0,2,0,0,0,0|0,0,0]=2 882 B12R1.894 O=C(O)C1=C(O)C=CC(Br)=C1O C74385 [0,2,0,0,0,0|0,0,0]=2 883 B12R1.894 O=[N+]([O-])C1=C(F)C=CC(Br)=C1O 95660 [0,2,0,0,0,0|1,0,1]=4 884 B12R1.1000 CC(=O)C1=C(F)C=C(Br)C=C1O 80620 [0,2,0,0,0,0|1,0,0]=3 885 B12R1.1000 CC(=O)C1=C(F)C=C(Cl)C=C1O C71371 [0,2,0,0,0,0|1,0,0]=3 886 B12R1.1000 CC(=O)C1=C(F)C=C(F)C=C1N C73141 [0,2,0,0,0,0|2,0,0]=4 887 B12R1.1000 CC1=CC(Br)=CC(Cl)=C1C(=O)O D86078 [0,2,0,0,0,0|1,0,0]=3 888 B12R1.1000 CC1=CC(Br)=CC(F)=C1C(N)=O 90653 [0,2,0,0,0,0|2,0,0]=4 889 B12R1.1000 CC1=CC(Cl)=CC(C)=C1C(=O)O N12990 [0,2,0,0,0,0|1,0,0]=3 890 B12R1.1000 CC1=CC(Cl)=CC(Cl)=C1C(=O)O D96191 [0,2,0,0,0,0|1,0,0]=3 891 B12R1.1000 CC1=CC(Cl)=CC(F)=C1C(=O)O 95590 [0,2,0,0,0,0|1,0,0]=3 892 B12R1.1000 CC1=CC(Cl)=NC(C)=C1C(=O)O 84506 [0,2,0,0,0,0|2,0,0]=4 893 B12R1.1000 CC1=CC(F)=C(C(=O)O)C(F)=C1 22738 [0,2,0,0,0,0|1,0,0]=3 894 B12R1.1000 CC1=CC(O)=CC(O)=C1C(=O)O C75284 [0,2,0,0,0,0|0,0,0]=2 895 B12R1.1000 NC1=C(C(=O)O)C(Cl)=NC(Cl)=C1 W16854 [0,2,0,0,0,0|2,0,0]=4 896 B12R1.1000 NC1=CC(Br)=CC(Br)=C1C(=O)O 25210 [0,2,0,0,0,0|1,0,0]=3 897 B12R1.1000 NC1=CC(F)=C(C(=O)O)C(F)=C1 F14513 [0,2,0,0,0,0|1,0,0]=3 898 B12R1.1000 O=C(O)C1=C(Cl)C=C(O)C=C1Cl C15827 [0,2,0,0,0,0|1,0,0]=3 899 B12R1.1000 O=C(O)C1=C(F)C=C(Br)C=C1O AT11231 [0,2,0,0,0,0|0,0,0]=2 900 B12R1.1000 O=C(O)C1=C(F)C=C(F)C=C1O 86984 [0,2,0,0,0,0|0,0,0]=2 901 B12R1.1000 O=[N+]([O-])C1=C(Br)C=C(Cl)C=C1O 75769 [0,2,0,0,0,0|1,0,1]=4 902 B12R1.1000 O=[N+]([O-])C1=C(Cl)C=C(Br)C=C1O 97460 [0,2,0,0,0,0|1,0,1]=4 903 B12R1.1000 O=[N+]([O-])C1=C(F)C=C(Br)C=C1O AT21482 [0,2,0,0,0,0|1,0,1]=4 904 B12R1.3441 COC(=O)C1=C(Br)C=NC=C1Br AT11253 [0,2,0,0,0,0|2,0,0]=4 905 B12R1.3441 COC(=O)C1=C(C)C=NC=C1C AT11252 [0,2,0,0,0,0|2,0,0]=4 906 B12R1.3441 COC(=O)C1=C(Cl)C=CN=C1Br 55289 [0,2,0,0,0,0|2,0,0]=4 907 B12R1.3441 COC(=O)C1=C(Cl)C=CN=C1C P17403 [0,2,0,0,0,0|2,0,0]=4 908 B12R1.3441 COC(=O)C1=C(F)C=NC=C1C D79934 [0,2,0,0,0,0|2,0,0]=4 909 B12R1.3441 COC(=O)C1=C(I)C=CC=C1Br 82625 [0,2,0,0,0,0|1,0,0]=3 910 B12R1.3441 COC(=O)C1=C(I)C=CC=C1Cl D76547 [0,2,0,0,0,0|1,0,0]=3 911 B12R1.3441 COC(=O)C1=C(I)C=CC=C1F C11271 [0,2,0,0,0,0|1,0,0]=3 912 B12R1.3441 COC(=O)C1=C(N)C=CN=C1Cl 87438 [0,2,0,0,0,0|2,0,0]=4 913 B12R1.3441 COC(=O)C1=C(N)N=CC=C1C D81973 [0,2,0,0,0,0|2,0,0]=4 914 B12R1.3441 COC(=O)C1=C(O)C=CC=C1C C74722 [0,2,0,0,0,0|0,0,0]=2 915 B12R1.3441 COC(=O)C1=C(O)C=CC=C1N F30234 [0,2,0,0,0,0|0,0,0]=2 916 B12R1.3441 N\C(=N/O)C1=C(Cl)C=CC=C1F W15443 [0,2,0,0,0,0|2,0,0]=4 917 B12R1.3441 O=C(CCl)C1=C(Cl)C=CC=C1Cl Y13245 [0,2,0,0,0,0|2,0,0]=4 918 B12R1.3441 O=C(CO)C1=C(F)C=CC=C1F AC3385 [0,2,0,0,0,0|1,0,0]=3 919 B12R1.24 CCC(=O)C1=CC=CC(F)=C1C W10818 [0,2,0,0,0,0|2,0,0]=4 920 B12R1.24 COC(=O)C1=C(Cl)C(Cl)=CC=N1 W16398 [0,2,0,0,0,0|2,0,0]=4 921 B12R1.24 COC(=O)C1=C(F)C(Br)=NC=C1 AC2387 [0,2,0,0,0,0|2,0,0]=4 922 B12R1.24 COC(=O)C1=C(F)C(F)=NC=C1 22790 [0,2,0,0,0,0|2,0,0]=4 923 B12R1.24 COC(=O)C1=C(N)C(C)=NC=C1 P11890 [0,2,0,0,0,0|2,0,0]=4 924 B12R1.24 COC(=O)C1=C(N)C(O)=CC=C1 25739 [0,2,0,0,0,0|1,0,0]=3 925 B12R1.24 COC(=O)C1=CC=CC(F)=C1O 35125 [0,2,0,0,0,0|0,0,0]=2 926 B12R1.24 COC(=O)C1=CC=CC(I)=C1Cl C90780 [0,2,0,0,0,0|1,0,0]=3 927 B12R1.24 COC(=O)C1=CC=CC(I)=C1F CL9472 [0,2,0,0,0,0|1,0,0]=3 928 B12R1.24 COC(=O)C1=CC=CC(I)=C1N 87420 [0,2,0,0,0,0|1,0,0]=3 929 B12R1.24 COC(=O)C1=CC=CC(N)=C1Cl C71675 [0,2,0,0,0,0|1,0,0]=3 930 B12R1.24 COC(=O)C1=CC=CC(N)=C1F 84758 [0,2,0,0,0,0|1,0,0]=3 931 B12R1.24 COC(=O)C1=CC=CC(N)=C1I D93611 [0,2,0,0,0,0|1,0,0]=3 932 B12R1.24 COC(=O)C1=CC=CC(O)=C1Cl O11869 [0,2,0,0,0,0|1,0,0]=3 933 B12R1.24 COC(=O)C1=CC=CC(O)=C1F 31763 [0,2,0,0,0,0|1,0,0]=3 934 B12R1.24 COC(=O)C1=CC=CN(C)C1=O P10137 [0,2,0,0,0,0|1,0,1]=4 935 B12R1.24 COC(=O)C1=CN=CC(Br)=C1Cl O11951 [0,2,0,0,0,0|2,0,0]=4 936 B12R1.24 COC(=O)C1=CN=CC(Br)=C1O C71564 [0,2,0,0,0,0|1,0,0]=3 937 B12R1.24 COC(=O)C1=CN=CC(Cl)=C1Cl D79951 [0,2,0,0,0,0|2,0,0]=4 938 B12R1.24 COC(=O)C1=NC=CC(Br)=C1C W12069 [0,2,0,0,0,0|2,0,0]=4 939 B12R1.24 COC(=O)C1=NC=CC(Cl)=C1C 36343 [0,2,0,0,0,0|2,0,0]=4 940 B12R1.24 COC(=O)C1=NC=CC(Cl)=C1F C71146 [0,2,0,0,0,0|2,0,0]=4 941 B12R1.24 NNC(=O)C1=CC=CC(Cl)=C1Cl C75178 [0,2,0,0,0,0|2,0,0]=4 942 B12R1.440 COC1=C(Cl)C(C(=O)O)=CC=N1 RB3386 [0,2,0,0,0,0|2,0,0]=4 943 B12R1.440 COC1=C(O)C(C(=O)O)=NC=C1 F20157 [0,2,0,0,0,0|1,0,0]=3 944 B12R1.440 COC1=CC=CC(C(C)=O)=C1N 11655 [0,2,0,0,0,0|2,0,0]=4 945 B12R1.440 COC1=CC=CC(C(C)=O)=C1O P11508 [0,2,0,0,0,0|1,0,0]=3 946 B12R1.440 COC1=CC=CC(C(N)=O)=C1N F15887 [0,2,0,0,0,0|2,0,0]=4 947 B12R1.440 COC1=CC=NC(C(=O)O)=C1F D80860 [0,2,0,0,0,0|2,0,0]=4 948 B12R1.440 COC1=NC=CC(C(=O)O)=C1C O10815 [0,2,0,0,0,0|2,0,0]=4 949 B12R1.440 COC1=NC=CC(C(=O)O)=C1N 82990 [0,2,0,0,0,0|2,0,0]=4 950 B12R1.440 CSC1=C(O)C(C(=O)O)=CC=C1 W17087 [0,2,0,0,0,0|0,0,0]=2 951 B12R1.440 N#CC1=C(Cl)C(C(=O)O)=CC=C1 C13929 [0,2,0,0,0,0|1,0,0]=3 952 B12R1.440 N#CC1=C(F)C(C(=O)O)=CC=C1 22679 [0,2,0,0,0,0|1,0,0]=3 953 B12R1.440 N#CC1=CC=CC(C(=O)O)=C1O 77993 [0,2,0,0,0,0|0,0,0]=2 954 B12R1.440 N#CC1=CC=CC([N+](=O)[O-])=C1O I11278 [0,2,0,0,0,0|1,0,1]=4 955 B12R1.440 NC1=C(C(=O)O)C=CC=C1C=O 55044 [0,2,0,0,0,0|1,0,0]=3 956 B12R1.440 O=C(O)C1=C(F)C(CO)=CC=C1 35126 [0,2,0,0,0,0|1,0,0]=3 957 B12R1.440 O=CC1=CC=CC(C(=O)O)=C1Br D79952 [0,2,0,0,0,0|1,0,0]=3 958 B12R1.440 O=CC1=CC=CC(C(=O)O)=C1F C11207 [0,2,0,0,0,0|1,0,0]=3 959 B12R1.440 O=CC1=CC=CC(C(=O)O)=C1O C13277 [0,2,0,0,0,0|0,0,0]=2 960 B12R1.511 CC(=O)C1=CC(Br)=CC(Br)=C1N F15013 [0,2,0,0,0,0|2,0,0]=4 961 B12R1.511 CC1=C(Br)C=C(F)C=C1C(=O)O W17035 [0,2,0,0,0,0|1,0,0]=3 962 B12R1.511 CC1=C(C(=O)O)C=C(Cl)N=C1Cl FD10673 [0,2,0,0,0,0|2,0,0]=4 963 B12R1.511 CC1=C(Cl)C=C(Br)C=C1C(=O)O AT12535 [0,2,0,0,0,0|1,0,0]=3 964 B12R1.511 CC1=C(Cl)C=C(F)C=C1C(=O)O C13388 [0,2,0,0,0,0|1,0,0]=3 965 B12R1.511 CC1=C(F)C=C(Br)C=C1C(=O)O 55829 [0,2,0,0,0,0|1,0,0]=3 966 B12R1.511 CC1=C(O)C=C(Br)C=C1C(=O)O F31181 [0,2,0,0,0,0|1,0,0]=3 967 B12R1.511 CC1=CC(Br)=C(I)C(C(=O)O)=C1 W17365 [0,2,0,0,0,0|1,0,0]=3 968 B12R1.511 CC1=CC(Br)=CC(C(=O)O)=C1F 88535 [0,2,0,0,0,0|1,0,0]=3 969 B12R1.511 CC1=CC(Cl)=NC(C(=O)O)=C1N D93596 [0,2,0,0,0,0|2,0,0]=4 970 B12R1.511 CC1=CC(F)=C(F)C(C(=O)O)=C1 35069 [0,2,0,0,0,0|1,0,0]=3 971 B12R1.511 CC1=CC(F)=C(F)C(C(N)=O)=C1 98378 [0,2,0,0,0,0|2,0,0]=4 972 B12R1.511 CC1=CC(F)=CC(C(=O)O)=C1Br D83243 [0,2,0,0,0,0|1,0,0]=3 973 B12R1.511 CC1=CC(F)=CC(C(=O)O)=C1N D76769 [0,2,0,0,0,0|1,0,0]=3 974 B12R1.511 CC1=CC(F)=CC([N+](=O)[O-])=C1O I11228 [0,2,0,0,0,0|1,0,1]=4 975 B12R1.511 CC1=CC([N+](=O)[O-])=C(O)C(O)=C1 D80979 [0,2,0,0,0,0|1,0,1]=4 976 B12R1.511 NC(=O)C1=CC(F)=CC(I)=C1O D96926 [0,2,0,0,0,0|1,0,0]=3 977 B12R1.511 NC1=C(Br)C=C(Cl)N=C1C(=O)O D97611 [0,2,0,0,0,0|2,0,0]=4 978 B12R1.511 NC1=C(C(=O)O)C=C(Cl)N=C1Cl 52092 [0,2,0,0,0,0|2,0,0]=4 979 B12R1.511 NC1=C(C(=O)O)N=C(Cl)C=C1Cl O10935 [0,2,0,0,0,0|2,0,0]=4 980 B12R1.511 NC1=C(I)C=C(Cl)C=C1C(=O)O W17253 [0,2,0,0,0,0|1,0,0]=3 981 B12R1.511 NC1=CC(Br)=CC([N+](=O)[O-])=C1O 36395 [0,2,0,0,0,0|1,0,1]=4 982 B12R1.511 NC1=CC(C(=O)O)=C(O)C(N)=C1 22928 [0,2,0,0,0,0|0,0,0]=2 983 B12R1.511 O=C(O)C1=C(O)C(Cl)=NC(Cl)=C1 27323 [0,2,0,0,0,0|1,0,0]=3 984 B12R1.511 O=C(O)C1=CC(Br)=CC(F)=C1O AT11237 [0,2,0,0,0,0|0,0,0]=2 985 B12R1.511 O=C(O)C1=CC(F)=CC(Br)=C1F C14898 [0,2,0,0,0,0|1,0,0]=3 986 B12R1.511 O=C(O)C1=CC(F)=CC(F)=C1O 93351 [0,2,0,0,0,0|0,0,0]=2 987 B12R1.511 O=C(O)C1=CC(I)=CC(Cl)=C1F 36888 [0,2,0,0,0,0|1,0,0]=3 988 B12R1.511 O=C(O)C1=CC(I)=CC(I)=C1O D88046 [0,2,0,0,0,0|0,0,0]=2 989 B12R1.511 O=[N+]([O-])C1=CC(Br)=CC(O)=C1O W13102 [0,2,0,0,0,0|1,0,1]=4 990 B12R1.511 OB(O)C1=CC(F)=CC(F)=C1O D71381 [0,2,0,0,0,0|1,0,1]=4 991 B12R1.893 CC(=O)C1=C(F)C(F)=C(Br)C=C1 95672 [0,2,0,0,0,0|2,0,0]=4 992 B12R1.893 CC(=O)C1=CC=C(F)C(F)=C1Br 95669 [0,2,0,0,0,0|2,0,0]=4 993 B12R1.893 CC1=C(Br)C=CC(C(=O)O)=C1F F13685 [0,2,0,0,0,0|1,0,0]=3 994 B12R1.893 CC1=C(Br)C=CC(C(=O)O)=C1N AC8749 [0,2,0,0,0,0|1,0,0]=3 995 B12R1.893 CC1=C(C)C(C)=C(C(=O)O)C=C1 F11631 [0,2,0,0,0,0|1,0,0]=3 996 B12R1.893 CC1=C(C)C(I)=C(C(=O)O)C=C1 87931 [0,2,0,0,0,0|1,0,0]=3 997 B12R1.893 CC1=C(C)C(O)=C(C(=O)O)C=C1 D95028 [0,2,0,0,0,0|0,0,0]=2 998 B12R1.893 CC1=C(Cl)C=CC(C(=O)O)=C1F A10576 [0,2,0,0,0,0|1,0,0]=3 999 B12R1.893 CC1=C(Cl)C=CC(C(=O)O)=C1N F16600 [0,2,0,0,0,0|1,0,0]=3 1000 B12R1.893 CC1=C(F)C=CC(C(=O)O)=C1F 24999 [0,2,0,0,0,0|1,0,0]=3 1001 B12R1.893 CC1=C(N)C(C)=C(C(=O)O)C=C1 93860 [0,2,0,0,0,0|1,0,0]=3 1002 B12R1.893 CC1=C(N)C=CC(C(=O)O)=C1C 34920 [0,2,0,0,0,0|1,0,0]=3 1003 B12R1.893 CC1=CC=C(C(=O)O)C(Cl)=C1Cl D86550 [0,2,0,0,0,0|1,0,0]=3 1004 B12R1.893 CC1=CC=C(C(=O)O)C(F)=C1I 55471 [0,2,0,0,0,0|1,0,0]=3 1005 B12R1.893 CC1=CC=C(C(=O)O)C(N)=C1Br 54754 [0,2,0,0,0,0|1,0,0]=3 1006 B12R1.893 NC1=C(Br)C(Cl)=CC=C1C(=O)O Y13550 [0,2,0,0,0,0|1,0,0]=3 1007 B12R1.893 NC1=C(C(=O)O)C=CC(Cl)=C1O D80855 [0,2,0,0,0,0|1,0,0]=3 1008 B12R1.893 NC1=C(Cl)C(Cl)=CC=C1C(=O)O O10647 [0,2,0,0,0,0|1,0,0]=3 1009 B12R1.893 NC1=CC=C(C(=O)O)C(Cl)=C1F A10783 [0,2,0,0,0,0|1,0,0]=3 1010 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 1011 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 1012 B12R1.893 O=C(O)C1=C(O)C(F)=C(Br)C=C1 AT11230 [0,2,0,0,0,0|0,0,0]=2 1013 B12R1.893 O=C(O)C1=C(O)C(O)=C(Br)C=C1 53229 [0,2,0,0,0,0|0,0,0]=2 1014 B12R1.893 O=C(O)C1=CC=C(Cl)C(Br)=C1Cl 36583 [0,2,0,0,0,0|1,0,0]=3 1015 B12R1.893 O=C(O)C1=CC=C(F)C(Br)=C1F C10544 [0,2,0,0,0,0|1,0,0]=3 1016 B12R1.893 O=C(O)C1=CC=C(O)C(F)=C1F CK2226 [0,2,0,0,0,0|1,0,0]=3 1017 B12R1.893 O=C(O)C1=CC=C(O)C(O)=C1Cl F19892 [0,2,0,0,0,0|1,0,0]=3 1018 B12R1.893 O=C(O)C1=CN=C(Cl)C(F)=C1Cl P16057 [0,2,0,0,0,0|2,0,0]=4 1019 B12R1.893 O=C(O)C1=CN=C(F)C(F)=C1Cl 26382 [0,2,0,0,0,0|2,0,0]=4 1020 B12R1.893 O=[N+]([O-])C1=CC=C(Cl)C(Cl)=C1O F19868 [0,2,0,0,0,0|1,0,1]=4 1021 B12R1.893 O=[N+]([O-])C1=CC=C(F)C(Br)=C1O S10817 [0,2,0,0,0,0|1,0,1]=4 1022 B12R1.232 CC(=O)C1=C(O)C=C(O)C(O)=C1 W17281 [0,2,0,0,0,0|1,0,0]=3 1023 B12R1.232 CC(=O)C1=CC(Br)=C(C)C=C1N 56175 [0,2,0,0,0,0|2,0,0]=4 1024 B12R1.232 CC(=O)C1=CC(Br)=C(F)C=C1O 58091 [0,2,0,0,0,0|1,0,0]=3 1025 B12R1.232 CC(=O)C1=CC(Br)=C(O)C=C1O Y13503 [0,2,0,0,0,0|1,0,0]=3 1026 B12R1.232 CC(=O)C1=CC(Cl)=C(Cl)C=C1C C11047 [0,2,0,0,0,0|2,0,0]=4 1027 B12R1.232 CC(=O)C1=CC(Cl)=C(Cl)C=C1Cl W18042 [0,2,0,0,0,0|2,0,0]=4 1028 B12R1.232 CC(=O)C1=CC(Cl)=C(F)C=C1N AC1207 [0,2,0,0,0,0|2,0,0]=4 1029 B12R1.232 CC(=O)C1=CC(F)=C(Br)C=C1O W17159 [0,2,0,0,0,0|1,0,0]=3 1030 B12R1.232 CC1=C(Br)C=C(C(=O)O)C(O)=C1 W19041 [0,2,0,0,0,0|0,0,0]=2 1031 B12R1.232 CC1=C(C)N=C(Cl)C(C(=O)O)=C1 O10731 [0,2,0,0,0,0|2,0,0]=4 1032 B12R1.232 CC1=C(F)C=C(C(=O)O)C(N)=C1 D78272 [0,2,0,0,0,0|1,0,0]=3 1033 B12R1.232 CC1=CC(Br)=C(N)C=C1C(=O)O 72855 [0,2,0,0,0,0|1,0,0]=3 1034 B12R1.232 CC1=CC(C(=O)O)=C(C)C=C1N N10396 [0,2,0,0,0,0|1,0,0]=3 1035 B12R1.232 CC1=CC(C(=O)O)=C(C)C=C1O AC5772 [0,2,0,0,0,0|1,0,0]=3 1036 B12R1.232 CC1=CC(C)=C(Br)C=C1C(=O)O N12774 [0,2,0,0,0,0|1,0,0]=3 1037 B12R1.232 CC1=CC(Cl)=C(Cl)C=C1C(=O)O N13250 [0,2,0,0,0,0|1,0,0]=3 1038 B12R1.232 CC1=CC(F)=C(Br)C=C1C(=O)O 79589 [0,2,0,0,0,0|1,0,0]=3 1039 B12R1.232 CC1=CC(N)=C(C(=O)O)C=C1O 85911 [0,2,0,0,0,0|1,0,0]=3 1040 B12R1.232 NC1=C(C(=O)O)C=C(Cl)C(Cl)=N1 P20935 [0,2,0,0,0,0|2,0,0]=4 1041 B12R1.232 NC1=C(C(=O)O)C=C(O)C(O)=C1 AB8031 [0,2,0,0,0,0|1,0,0]=3 1042 B12R1.232 NC1=C(Cl)C=C(Cl)C(C(=O)O)=C1 34912 [0,2,0,0,0,0|1,0,0]=3 1043 B12R1.232 NC1=CC(Br)=C(Br)C=C1C(=O)O 34910 [0,2,0,0,0,0|1,0,0]=3 1044 B12R1.232 NC1=CC(Br)=C(F)C=C1C(=O)O 54728 [0,2,0,0,0,0|1,0,0]=3 1045 B12R1.232 NC1=CC(Br)=C(F)C=C1C(=O)O AC4169 [0,2,0,0,0,0|1,0,0]=3 1046 B12R1.232 NC1=CC(Cl)=C(F)C=C1C(=O)O CL9060 [0,2,0,0,0,0|1,0,0]=3 1047 B12R1.232 NC1=CC(F)=C(Cl)C=C1C(=O)O C74806 [0,2,0,0,0,0|1,0,0]=3 1048 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 1049 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 1050 B12R1.232 O=C(O)C1=CC(Br)=C(Br)C=C1F AB10078 [0,2,0,0,0,0|1,0,0]=3 1051 B12R1.232 O=C(O)C1=CC(Br)=C(F)C=C1Cl W17792 [0,2,0,0,0,0|1,0,0]=3 1052 B12R1.232 O=C(O)C1=CC(Br)=C(F)C=C1F F14505 [0,2,0,0,0,0|1,0,0]=3 1053 B12R1.232 O=C(O)C1=CC(Br)=C(O)C=C1F W15314 [0,2,0,0,0,0|1,0,0]=3 1054 B12R1.232 O=C(O)C1=CC(Cl)=C(F)C=C1O 87142 [0,2,0,0,0,0|0,0,0]=2 1055 B12R1.232 O=C(O)C1=CC(Cl)=C(O)C=C1O 81000 [0,2,0,0,0,0|0,0,0]=2 1056 B12R1.232 O=C(O)C1=CC(F)=C(F)C=C1O C73895 [0,2,0,0,0,0|0,0,0]=2 1057 B12R1.232 O=C(O)C1=CC(I)=C(F)C=C1Cl C10866 [0,2,0,0,0,0|1,0,0]=3 1058 B12R1.452 CC1=CC(C#N)=CN=C1C(=O)O 79221 [0,2,0,0,0,0|2,0,0]=4 1059 B12R1.452 CCC1=CC(F)=C(C(N)=O)C=C1 D79253 [0,2,0,0,0,0|2,0,0]=4 1060 B12R1.452 COC1=CC(C)=C(C(N)=O)C=C1 F15895 [0,2,0,0,0,0|2,0,0]=4 1061 B12R1.452 COC1=CC(Cl)=C(C(=O)O)N=C1 O10984 [0,2,0,0,0,0|2,0,0]=4 1062 B12R1.452 COC1=CC(Cl)=C(C(C)=O)C=C1 75061 [0,2,0,0,0,0|2,0,0]=4 1063 B12R1.452 COC1=CC(F)=C(C(=O)O)N=C1 80030 [0,2,0,0,0,0|2,0,0]=4 1064 B12R1.452 COC1=CC(N)=C(C(=O)O)C=N1 P11630 [0,2,0,0,0,0|2,0,0]=4 1065 B12R1.452 COC1=CC(N)=C(C(C)=O)C=C1 52087 [0,2,0,0,0,0|2,0,0]=4 1066 B12R1.452 COC1=CC=C(C(=O)O)C(=O)N1 D80739 [0,2,0,0,0,0|1,0,1]=4 1067 B12R1.452 COC1=CC=C(C(=O)O)C(Br)=N1 O10693 [0,2,0,0,0,0|2,0,0]=4 1068 B12R1.452 COC1=CC=C(C(=O)O)C(Cl)=N1 89001 [0,2,0,0,0,0|2,0,0]=4 1069 B12R1.452 COC1=CN=C(C(=O)O)C(N)=C1 N17024 [0,2,0,0,0,0|2,0,0]=4 1070 B12R1.452 COC1=NC(C)=C(C(=O)O)C=C1 24363 [0,2,0,0,0,0|2,0,0]=4 1071 B12R1.452 COC1=NC(N)=C(C(=O)O)C=C1 F31118 [0,2,0,0,0,0|2,0,0]=4 1072 B12R1.452 CSC1=CC(C)=C(C(=O)O)C=C1 75574 [0,2,0,0,0,0|1,0,0]=3 1073 B12R1.452 N#CC1=CC(F)=C(C(=O)O)N=C1 79772 [0,2,0,0,0,0|2,0,0]=4 1074 B12R1.452 N#CC1=CC(I)=C(C(=O)O)C=C1 80126 [0,2,0,0,0,0|1,0,0]=3 1075 B12R1.452 N#CC1=CC(N)=C(C(=O)O)C=C1 CL9383 [0,2,0,0,0,0|1,0,0]=3 1076 B12R1.452 N#CC1=CC(O)=C([N+](=O)[O-])C=C1 W11095 [0,2,0,0,0,0|1,0,1]=4 1077 B12R1.452 O=CC1=CC(Cl)=C(C(=O)O)C=C1 N10574 [0,2,0,0,0,0|1,0,0]=3 1078 B12R1.452 O=CC1=CC(F)=C(C(=O)O)C=C1 D95103 [0,2,0,0,0,0|1,0,0]=3 1079 B12R1.1703 C=C(CO)C1=C(F)C=C(F)C=C1 D94514 [0,2,0,0,0,0|2,0,0]=4 1080 B12R1.1703 CC1=C(C(=O)NN)C=CC(Cl)=C1 D97392 [0,2,0,0,0,0|2,0,0]=4 1081 B12R1.1703 CC1=CC(C)=C(C(=O)CBr)C=C1 D87870 [0,2,0,0,0,0|2,0,0]=4 1082 B12R1.1703 CCC(=O)C1=C(Cl)C=C(Cl)C=C1 T70851 [0,2,0,0,0,0|2,0,0]=4 1083 B12R1.1703 CCC(=O)C1=C(F)C=C(Cl)C=C1 55949 [0,2,0,0,0,0|2,0,0]=4 1084 B12R1.1703 CNC(=O)C1=C(Br)C=C(F)C=C1 75450 [0,2,0,0,0,0|2,0,0]=4 1085 B12R1.1703 CNC(=O)C1=C(F)C=C(I)C=C1 35420 [0,2,0,0,0,0|2,0,0]=4 1086 B12R1.1703 COC(=O)C1=C(Br)C=C(Cl)C=N1 BL008119 [0,2,0,0,0,0|2,0,0]=4 1087 B12R1.1703 COC(=O)C1=C(Br)C=C(Cl)N=C1 F11974 [0,2,0,0,0,0|2,0,0]=4 1088 B12R1.1703 COC(=O)C1=C(Br)C=C(F)C=N1 85649 [0,2,0,0,0,0|2,0,0]=4 1089 B12R1.1703 COC(=O)C1=C(Br)C=C(O)C=C1 C90903 [0,2,0,0,0,0|1,0,0]=3 1090 B12R1.1703 COC(=O)C1=C(C)C=C(C)N=C1 D82510 [0,2,0,0,0,0|2,0,0]=4 1091 B12R1.1703 COC(=O)C1=C(C)C=C(I)C=C1 F19913 [0,2,0,0,0,0|1,0,0]=3 1092 B12R1.1703 COC(=O)C1=C(C)N=C(Cl)C=C1 F16760 [0,2,0,0,0,0|2,0,0]=4 1093 B12R1.1703 COC(=O)C1=C(C)N=C(F)C=C1 C71884 [0,2,0,0,0,0|2,0,0]=4 1094 B12R1.1703 COC(=O)C1=C(C)N=C(N)C=C1 O11963 [0,2,0,0,0,0|2,0,0]=4 1095 B12R1.1703 COC(=O)C1=C(C)NC(=O)C=C1 32384 [0,2,0,0,0,0|2,0,0]=4 1096 B12R1.1703 COC(=O)C1=C(Cl)C=C(C)C=C1 C90285 [0,2,0,0,0,0|1,0,0]=3 1097 B12R1.1703 COC(=O)C1=C(Cl)C=C(F)C=N1 BL010110 [0,2,0,0,0,0|2,0,0]=4 1098 B12R1.1703 COC(=O)C1=C(Cl)C=C(N)C=N1 BL010141 [0,2,0,0,0,0|2,0,0]=4 1099 B12R1.1703 COC(=O)C1=C(Cl)C=C(N)N=C1 C72055 [0,2,0,0,0,0|2,0,0]=4 1100 B12R1.1703 COC(=O)C1=C(F)C=C(O)C=N1 P12276 [0,2,0,0,0,0|2,0,0]=4 1101 B12R1.1703 COC(=O)C1=C(F)N=C(Cl)C=C1 O11966 [0,2,0,0,0,0|2,0,0]=4 1102 B12R1.1703 COC(=O)C1=C(I)C=C(C)C=C1 C90901 [0,2,0,0,0,0|1,0,0]=3 1103 B12R1.1703 COC(=O)C1=C(I)C=C(F)C=C1 W19258 [0,2,0,0,0,0|1,0,0]=3 1104 B12R1.1703 COC(=O)C1=C(N)C=C(C)N=C1 P18775 [0,2,0,0,0,0|2,0,0]=4 1105 B12R1.1703 COC(=O)C1=C(O)N=C(C)N=C1 W17872 [0,2,0,0,0,0|2,0,0]=4 1106 B12R1.1703 COC(=O)C1=CC=C(C)N=C1Br 27048 [0,2,0,0,0,0|2,0,0]=4 1107 B12R1.1703 COC(=O)C1=CC=C(Cl)N=C1Br Y11556 [0,2,0,0,0,0|2,0,0]=4 1108 B12R1.1703 COC(=O)C1=CC=C(N)N=C1Cl AC8698 [0,2,0,0,0,0|2,0,0]=4 1109 B12R1.1703 COC(=O)C1=CN=C(Br)C=C1Cl 28017 [0,2,0,0,0,0|2,0,0]=4 1110 B12R1.1703 COC(=O)C1=CN=C(Cl)C=C1C 68238 [0,2,0,0,0,0|2,0,0]=4 1111 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1F 24406 [0,2,0,0,0,0|2,0,0]=4 1112 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1O 76668 [0,2,0,0,0,0|1,0,0]=3 1113 B12R1.1703 COC(=O)C1=NC=C(Cl)C=C1N F14180 [0,2,0,0,0,0|2,0,0]=4 1114 B12R1.1703 COC(=O)C1=NC=C(F)C=C1C S10377 [0,2,0,0,0,0|2,0,0]=4 1115 B12R1.1703 COC(=O)C1=NC=C(F)C=C1N 85648 [0,2,0,0,0,0|2,0,0]=4 1116 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 1117 B12R1.1703 O=C(CBr)C1=C(Cl)C=C(F)C=C1 78988 [0,2,0,0,0,0|2,0,0]=4 1118 B12R1.1703 O=C(CBr)C1=C(O)C=C(O)C=C1 T70646 [0,2,0,0,0,0|1,0,0]=3 1119 B12R1.1703 O=C(CCl)C1=C(F)C=C(Cl)C=C1 W16973 [0,2,0,0,0,0|2,0,0]=4 1120 B12R1.1703 O=C(CO)C1=C(Cl)C=C(Cl)C=C1 AC4055 [0,2,0,0,0,0|1,0,0]=3 1121 B12R1.354 CC1=C(C(=O)NN)C=C(Br)C=C1 W11103 [0,2,0,0,0,0|2,0,0]=4 1122 B12R1.354 CCC(=O)C1=C(C)C=CC(Cl)=C1 W17965 [0,2,0,0,0,0|2,0,0]=4 1123 B12R1.354 CCC(=O)C1=C(F)C=CC(Br)=C1 F19670 [0,2,0,0,0,0|2,0,0]=4 1124 B12R1.354 CCC(=O)C1=C(N)C=CC(Br)=C1 C14451 [0,2,0,0,0,0|2,0,0]=4 1125 B12R1.354 CCC(=O)C1=C(O)C=CC(Cl)=C1 W10407 [0,2,0,0,0,0|1,0,0]=3 1126 B12R1.354 CNC(=O)C1=C(F)C=CC(N)=C1 AB3027 [0,2,0,0,0,0|2,0,0]=4 1127 B12R1.354 COC(=O)C1=C(Br)C=CC(C)=N1 N11759 [0,2,0,0,0,0|2,0,0]=4 1128 B12R1.354 COC(=O)C1=C(Br)C=CC(Cl)=N1 83150 [0,2,0,0,0,0|2,0,0]=4 1129 B12R1.354 COC(=O)C1=C(Br)C=CC(O)=C1 91199 [0,2,0,0,0,0|1,0,0]=3 1130 B12R1.354 COC(=O)C1=C(C)C=CC(Br)=N1 D80475 [0,2,0,0,0,0|2,0,0]=4 1131 B12R1.354 COC(=O)C1=C(C)C=CC(O)=C1 35162 [0,2,0,0,0,0|1,0,0]=3 1132 B12R1.354 COC(=O)C1=C(Cl)C=CC(=O)N1 C71788 [0,2,0,0,0,0|2,0,0]=4 1133 B12R1.354 COC(=O)C1=C(Cl)C=CC(Br)=N1 D70469 [0,2,0,0,0,0|2,0,0]=4 1134 B12R1.354 COC(=O)C1=C(Cl)C=CC(N)=N1 D74444 [0,2,0,0,0,0|2,0,0]=4 1135 B12R1.354 COC(=O)C1=C(F)C=CC(Br)=N1 C71779 [0,2,0,0,0,0|2,0,0]=4 1136 B12R1.354 COC(=O)C1=C(F)C=CC(C)=N1 D79814 [0,2,0,0,0,0|2,0,0]=4 1137 B12R1.354 COC(=O)C1=C(I)C=CC(Cl)=C1 F14202 [0,2,0,0,0,0|1,0,0]=3 1138 B12R1.354 COC(=O)C1=C(I)C=CC(F)=C1 TD1035 [0,2,0,0,0,0|1,0,0]=3 1139 B12R1.354 COC(=O)C1=C(I)C=CC(N)=C1 C90900 [0,2,0,0,0,0|1,0,0]=3 1140 B12R1.354 COC(=O)C1=C(N)C=CC(Br)=N1 Y10087 [0,2,0,0,0,0|2,0,0]=4 1141 B12R1.354 COC(=O)C1=C(N)C=CC(Cl)=N1 36328 [0,2,0,0,0,0|2,0,0]=4 1142 B12R1.354 COC(=O)C1=C(N)C=CC(N)=C1 C75313 [0,2,0,0,0,0|1,0,0]=3 1143 B12R1.354 COC(=O)C1=C(N)C=NC(C)=C1 92402 [0,2,0,0,0,0|2,0,0]=4 1144 B12R1.354 COC(=O)C1=C(N)N=CC(C)=C1 27205 [0,2,0,0,0,0|2,0,0]=4 1145 B12R1.354 COC(=O)C1=C(O)N=CC(F)=N1 N13384 [0,2,0,0,0,0|2,0,0]=4 1146 B12R1.354 COC(=O)C1=CC(Br)=CN=C1Br P11748 [0,2,0,0,0,0|2,0,0]=4 1147 B12R1.354 COC(=O)C1=CC(Br)=NC=C1Cl 33641 [0,2,0,0,0,0|2,0,0]=4 1148 B12R1.354 COC(=O)C1=CC(Br)=NC=C1O P12277 [0,2,0,0,0,0|1,0,0]=3 1149 B12R1.354 COC(=O)C1=CC(C)=CN=C1Br F31227 [0,2,0,0,0,0|2,0,0]=4 1150 B12R1.354 COC(=O)C1=CC(Cl)=CNC1=O AB10289 [0,2,0,0,0,0|1,0,1]=4 1151 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1N 36566 [0,2,0,0,0,0|2,0,0]=4 1152 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1O P12281 [0,2,0,0,0,0|1,0,0]=3 1153 B12R1.354 COC(=O)C1=CC(F)=CN=C1Br D79790 [0,2,0,0,0,0|2,0,0]=4 1154 B12R1.354 COC(=O)C1=CC(F)=CN=C1C D83689 [0,2,0,0,0,0|2,0,0]=4 1155 B12R1.354 COC(=O)C1=CC(F)=CN=C1F N13221 [0,2,0,0,0,0|2,0,0]=4 1156 B12R1.354 COC(=O)C1=CC(N)=CN=C1Cl AB9601 [0,2,0,0,0,0|2,0,0]=4 1157 B12R1.354 COC(=O)C1=CC(O)=CN=C1Cl P16237 [0,2,0,0,0,0|2,0,0]=4 1158 B12R1.354 COC(=O)C1=NC(C)=CC=C1O C75887 [0,2,0,0,0,0|1,0,0]=3 1159 B12R1.354 O=C(CCl)C1=C(O)C=CC(O)=C1 D93523 [0,2,0,0,0,0|1,0,0]=3 1160 B12R1.453 CC1=C(C(=O)O)C=C(C#N)C=C1 AB10107 [0,2,0,0,0,0|1,0,0]=3 1161 B12R1.453 CC1=C(C(=O)O)C=C(C=O)C=C1 CL9400 [0,2,0,0,0,0|1,0,0]=3 1162 B12R1.453 CCC1=CC(C(=O)O)=C(N)C=C1 C74274 [0,2,0,0,0,0|1,0,0]=3 1163 B12R1.453 COC1=CC(C(=O)O)=C(Cl)C=N1 27468 [0,2,0,0,0,0|2,0,0]=4 1164 B12R1.453 COC1=CC(C(=O)O)=C(N)C=N1 29049 [0,2,0,0,0,0|2,0,0]=4 1165 B12R1.453 COC1=CC=C(N)C(C(=O)O)=N1 D78274 [0,2,0,0,0,0|2,0,0]=4 1166 B12R1.453 COC1=CN=C(Cl)C(C(=O)O)=C1 38951 [0,2,0,0,0,0|2,0,0]=4 1167 B12R1.453 COC1=NC(C(=O)O)=C(Br)C=C1 C71659 [0,2,0,0,0,0|2,0,0]=4 1168 B12R1.453 N#CC1=CC(B(O)O)=C(O)C=C1 D95164 [0,2,0,0,0,0|1,0,1]=4 1169 B12R1.453 N#CC1=CC(C(=O)O)=C(Br)C=C1 CL9198 [0,2,0,0,0,0|1,0,0]=3 1170 B12R1.453 N#CC1=CC(C(=O)O)=C(Cl)C=C1 20919 [0,2,0,0,0,0|1,0,0]=3 1171 B12R1.453 N#CC1=CC(C(=O)O)=C(I)C=C1 72432 [0,2,0,0,0,0|1,0,0]=3 1172 B12R1.453 NC(=O)C1=C(O)C=CC(C=O)=C1 P16788 [0,2,0,0,0,0|1,0,0]=3 1173 B12R1.453 NCC1=CC(C(=O)O)=C(O)C=C1 50734 [0,2,0,0,0,0|0,0,0]=2 1174 B12R1.453 O=C(O)C1=C(F)C=CC(CO)=C1 C11410 [0,2,0,0,0,0|1,0,0]=3 1175 B12R1.453 O=C([O-])C1=C([O-])C=CC(CO)=C1 Y11412 [0,2,0,0,0,0|0,0,2]=4 1176 B12R1.453 O=CC1=CC(B(O)O)=C(O)C=C1 C15304 [0,2,0,0,0,0|1,0,1]=4 1177 B12R1.453 O=CC1=CC(C(=O)O)=C(Br)C=C1 D83958 [0,2,0,0,0,0|1,0,0]=3 1178 B12R1.308 CCOC(=O)C1=C(C)C=CN=C1 72062 [0,2,0,0,0,0|2,0,0]=4 1179 B12R1.308 CCOC(=O)C1=C(Cl)C=CC=N1 W18461 [0,2,0,0,0,0|2,0,0]=4 1180 B12R1.308 CCOC(=O)C1=C(N)C=CN=C1 A12134 [0,2,0,0,0,0|2,0,0]=4 1181 B12R1.308 CCOC(=O)C1=C(O)C=NC=C1 BL009831 [0,2,0,0,0,0|1,0,0]=3 1182 B12R1.308 CCOC(=O)C1=CC=CN=C1Br 24958 [0,2,0,0,0,0|2,0,0]=4 1183 B12R1.308 CCOC(=O)C1=NC=CC=C1C 30595 [0,2,0,0,0,0|2,0,0]=4 1184 B12R1.308 CONC(=O)C1=C(N)C=CC=C1 W13132 [0,2,0,0,0,0|1,0,0]=3 1185 B12R1.308 N#CCC(=O)C1=C(O)C=CC=C1 AC8189 [0,2,0,0,0,0|1,0,0]=3 1186 B12R1.308 O=C(CCCl)C1=C(F)C=CC=C1 AC7173 [0,2,0,0,0,0|2,0,0]=4 1187 B10R1.66 O=C(O)\C=C\C1=NC=CS1 AC7829 [0,0,1,1,0,0|1,1,0]=4 1188 B10R1.23 O=C(O)C(=O)C1=CC=CO1 D77791 [0,0,1,1,0,0|1,0,0]=3 1189 B10R1.31 O=CC1=CC(C(=O)O)=CO1 AT17491 [0,0,1,1,0,0|1,0,0]=3 1190 B10R2.320 O=C1CC2=C1C=CC=C2 67963 [1,0,0,1,0,0|1,0,0]=3 1191 B10R2.7 C1=CC2=C(C=CO2)N=C1 BL002594 [1,0,0,1,0,0|2,0,0]=4 1192 B10R2.7 C1=CC2=CON=C2C=C1 T70698 [1,0,0,1,0,0|1,0,0]=3 1193 B10R2.7 C1=CN=C2OC=CC2=C1 N13064 [1,0,0,1,0,0|2,0,0]=4 1194 B12R2.24 O=C1C=C2C=CC=CC2=NN1 O11709 [0,0,0,1,0,1|2,0,0]=4 1195 B12R2.24 O=C1CC2=C(C=CC=C2)CN1 C15389 [0,0,0,1,0,1|2,0,0]=4 1196 B12R2.24 O=C1COC2=C(C=CC=N2)N1 83760 [0,0,0,1,0,1|2,0,0]=4 1197 B12R2.24 O=C1COC2=C(C=CN=C2)N1 83761 [0,0,0,1,0,1|2,0,0]=4 1198 B12R2.24 O=C1COC2=C(C=NC=C2)N1 84022 [0,0,0,1,0,1|2,0,0]=4 1199 B12R2.24 O=C1NCC2=C(C=CC=C2)N1 C76098 [0,0,0,1,0,1|2,0,0]=4 1200 B12R2.202 CC1=CC=CC2=C1N=C(O)S2 F15065 [0,0,0,1,0,1|1,1,0]=4 1201 B12R2.202 CC1=CC=CC2=C1OC(=O)N2 F20152 [0,0,0,1,0,1|2,0,0]=4 1202 B12R2.202 CC1=NC2=C(Br)C=CC=C2O1 F13689 [0,0,0,1,0,1|2,0,0]=4 1203 B12R2.202 CC1=NC2=C(C=CC=C2O)S1 D84739 [0,0,0,1,0,1|1,1,0]=4 1204 B12R2.202 CC1=NC2=C(F)C=CC=C2O1 C73452 [0,0,0,1,0,1|2,0,0]=4 1205 B12R2.202 CC1=NC2=C(O)C=CC=C2N1 W10564 [0,0,0,1,0,1|2,0,0]=4 1206 B12R2.202 NC1=CC=CC2=C1CC(=O)N2 82071 [0,0,0,1,0,1|2,0,0]=4 1207 B12R2.202 NC1=CC=CC2=C1NC(=O)C2 D80850 [0,0,0,1,0,1|2,0,0]=4 1208 B12R2.202 NC1=CC=CC2=C1NC(O)=N2 W18048 [0,0,0,1,0,1|2,0,0]=4 1209 B12R2.202 NC1=CC=CC2=C1OC(=O)N2 70907 [0,0,0,1,0,1|2,0,0]=4 1210 B12R2.202 NC1=NC2=C(Br)C=CC=C2O1 C13690 [0,0,0,1,0,1|2,0,0]=4 1211 B12R2.202 NC1=NC2=C(C=CC=C2O)O1 C77367 [0,0,0,1,0,1|1,0,0]=3 1212 B12R2.202 NC1=NC2=CC=CC(O)=C2S1 P12369 [0,0,0,1,0,1|2,0,0]=4 1213 B12R2.202 O=C1CC2=CC=CC(Br)=C2C1 38087 [0,0,0,1,0,1|2,0,0]=4 1214 B12R2.202 O=C1CC2=CC=CC(Cl)=C2C1 27432 [0,0,0,1,0,1|2,0,0]=4 1215 B12R2.202 O=C1CC2=CC=CC(F)=C2C1 I11355 [0,0,0,1,0,1|2,0,0]=4 1216 B12R2.202 O=C1NC2=C(Cl)C=CC=C2S1 F15046 [0,0,0,1,0,1|1,1,0]=4 1217 B12R2.202 O=C1NC2=CC=CC(Br)=C2N1 C91054 [0,0,0,1,0,1|2,0,0]=4 1218 B12R2.202 O=C1NC2=CC=CC(Br)=C2O1 36174 [0,0,0,1,0,1|2,0,0]=4 1219 B12R2.202 O=C1NC2=CC=CC(Br)=C2S1 C71607 [0,0,0,1,0,1|2,0,0]=4 1220 B12R2.202 O=C1NC2=CC=CC(F)=C2N1 C74328 [0,0,0,1,0,1|2,0,0]=4 1221 B12R2.202 OC1=CC=CC2=C1N=C(Br)S2 O10699 [0,0,0,1,0,1|1,1,0]=4 1222 B12R2.202 OC1=CC=CC2=C1SC(Cl)=N2 P15336 [0,0,0,1,0,1|2,0,0]=4 1223 B12R2.1081 O=C1CC=CC2=C1C=CC=C2 F31381 [0,1,0,1,0,0|2,0,0]=4 1224 B12R2.1081 O=C1CCOC2=CC=CN=C12 50250 [0,1,0,1,0,0|2,0,0]=4 1225 B12R2.1081 O=C1CNNC2=C1C=CC=C2 H10992 [0,1,0,1,0,0|2,0,0]=4 1226 B12R2.1081 O=C1OC=CC2=C1C=CC=C2 N10038 [0,1,0,1,0,0|1,0,0]=3 1227 B12R2.1081 O[C@H]1CCOC2=C1C=CC=C2 A12066 [0,1,0,1,0,0|1,0,1]=4 1228 B12R2.1081 O[C@H]1COCC2=C1C=CC=C2 N13051 [0,1,0,1,0,0|1,0,1]=4 1229 B12R2.2028 CN1NC(=O)C2=C1C=CC=C2 C71035 [0,1,0,1,0,0|2,0,0]=4 1230 B12R2.2028 C[C@@H]1NC(=O)C2=C1C=CC=C2 72362 [0,1,0,1,0,0|2,0,0]=4 1231 B12R2.2028 N[C@H]1NC(=O)C2=C1C=CC=C2 Y10046 [0,1,0,1,0,0|2,0,0]=4 1232 B12R2.2048 COC1=C([C@@H]2CO2)C=CC=C1 P17977 [0,1,0,1,0,0|1,0,1]=4 1233 B12R2.203 CC1=CNC2=CC=CC(O)=C12 71522 [0,1,0,1,0,0|2,0,0]=4 1234 B12R2.203 CC1=NOC2=CC=CC(Br)=C21 D83934 [0,1,0,1,0,0|2,0,0]=4 1235 B12R2.203 NC1=C2C(=O)CCC2=CC=C1 79955 [0,1,0,1,0,0|2,0,0]=4 1236 B12R2.203 NC1=C2C(=O)NCC2=CC=C1 P10726 [0,1,0,1,0,0|2,0,0]=4 1237 B12R2.203 NC1=C2C(=O)OCC2=CC=C1 F16457 [0,1,0,1,0,0|1,0,0]=3 1238 B12R2.203 O=C1CCC2=CC=CC(Cl)=C12 58274 [0,1,0,1,0,0|2,0,0]=4 1239 B12R2.203 O=C1COC2=CC=CC(Br)=C12 F13692 [0,1,0,1,0,0|1,0,0]=3 1240 B12R2.203 O=C1COC2=CC=CC(F)=C12 C16679 [0,1,0,1,0,0|1,0,0]=3 1241 B12R2.203 O=C1NCC2=CC=CC(F)=C12 90046 [0,1,0,1,0,0|2,0,0]=4 1242 B12R2.203 O=C1OCC2=CC=CC(Br)=C12 Y12627 [0,1,0,1,0,0|1,0,0]=3 1243 B12R2.203 O=C1OCC2=CC=CC(F)=C12 N13153 [0,1,0,1,0,0|1,0,0]=3 1244 B12R2.203 O=C1OCC2=CC=CC(I)=C12 D83894 [0,1,0,1,0,0|1,0,0]=3 1245 B12R2.203 OC1=NOC2=CC=CC(F)=C21 66461 [0,1,0,1,0,0|1,0,0]=3 1246 B12R2.196 CC1=CC=CC2=C1CNC2=O 80956 [0,1,0,1,0,0|2,0,0]=4 1247 B12R2.196 CC1=NOC2=C(Br)C=CC=C12 AC8269 [0,1,0,1,0,0|2,0,0]=4 1248 B12R2.196 ClC1=NOC2=C(Br)C=CC=C12 D75918 [0,1,0,1,0,0|2,0,0]=4 1249 B12R2.196 O=C1COC2=C(Cl)C=CC=C12 AT10339 [0,1,0,1,0,0|1,0,0]=3 1250 B12R2.196 O=C1NCC2=C(Cl)C=CC=C12 F17918 [0,1,0,1,0,0|2,0,0]=4 1251 B12R2.196 O=C1NCC2=C(F)C=CC=C12 94869 [0,1,0,1,0,0|2,0,0]=4 1252 B12R2.196 O=C1NCC2=C1C=CC=C2O 52838 [0,1,0,1,0,0|2,0,0]=4 1253 B12R2.196 O=C1OCC2=C(F)C=CC=C12 89370 [0,1,0,1,0,0|1,0,0]=3 1254 B12R2.196 O=C1OCC2=C1C=CC=C2O 76130 [0,1,0,1,0,0|1,0,0]=3 1255 B12R2.196 O[C@H]1COC2=C(Br)C=CC=C21 Y10971 [0,1,0,1,0,0|1,0,1]=4 1256 B12R2.612 CC1=CC2=C(C=C1)C(=O)OC2 78098 [0,1,0,1,0,0|1,0,0]=3 1257 B12R2.612 CC1=CC2=C(C=C1)C(O)=NO2 O11611 [0,1,0,1,0,0|1,0,0]=3 1258 B12R2.612 ClC1=CC2=C(C=C1)C(Cl)=NO2 27523 [0,1,0,1,0,0|2,0,0]=4 1259 B12R2.612 ClC1=NOC2=C1C=CC(Br)=C2 83077 [0,1,0,1,0,0|2,0,0]=4 1260 B12R2.612 FC1=CC2=C(C=C1)C(Cl)=NO2 27521 [0,1,0,1,0,0|2,0,0]=4 1261 B12R2.612 NC1=CC2=C(C=C1)C(=O)NN2 20323 [0,1,0,1,0,0|2,0,0]=4 1262 B12R2.612 O=C1CCC2=C1C=CC(I)=C2 78363 [0,1,0,1,0,0|2,0,0]=4 1263 B12R2.612 O=C1COC2=C1C=CC(Br)=C2 67306 [0,1,0,1,0,0|1,0,0]=3 1264 B12R2.612 O=C1NCC2=C1C=CC(Cl)=C2 83087 [0,1,0,1,0,0|2,0,0]=4 1265 B12R2.612 O=C1NOC2=C1C=CC(F)=C2 26667 [0,1,0,1,0,0|1,0,0]=3 1266 B12R2.612 O=C1NSC2=C1C=CC(F)=C2 S10563 [0,1,0,1,0,0|1,1,0]=4 1267 B12R2.612 O=C1OCC2=CC(Cl)=NC=C12 P13253 [0,1,0,1,0,0|2,0,0]=4 1268 B12R2.612 OC1=NOC2=C1C=CC(Br)=C2 93322 [0,1,0,1,0,0|1,0,0]=3 1269 B12R2.612 O[C@H]1COC2=C1C=CC(Br)=C2 67308 [0,1,0,1,0,0|1,0,1]=4 1270 B12R2.132 CC1=C2C=C(Cl)C=CC2=NO1 C75084 [0,1,0,1,0,0|2,0,0]=4 1271 B12R2.132 CC1=CC2=C(C=C1)OCC2=O N12808 [0,1,0,1,0,0|1,0,0]=3 1272 B12R2.132 CC1=CC2=C(C=C1)ONC2=O C76060 [0,1,0,1,0,0|1,0,0]=3 1273 B12R2.132 CC1=NOC2=C1C=C(N)C=C2 27530 [0,1,0,1,0,0|2,0,0]=4 1274 B12R2.132 ClC1=CC2=C(C=C1)ON=C2Cl C73123 [0,1,0,1,0,0|2,0,0]=4 1275 B12R2.132 ClC1=NOC2=C1C=C(Br)C=C2 F19599 [0,1,0,1,0,0|2,0,0]=4 1276 B12R2.132 FC1=CC2=C(C=C1)ON=C2Cl O10983 [0,1,0,1,0,0|2,0,0]=4 1277 B12R2.132 NC1=CC2=C(C=C1)ONC2=O C76344 [0,1,0,1,0,0|1,0,0]=3 1278 B12R2.132 O=C1COC2=C1C=C(Br)C=C2 24739 [0,1,0,1,0,0|1,0,0]=3 1279 B12R2.132 O=C1COC2=C1C=C(O)C=C2 P16901 [0,1,0,1,0,0|1,0,0]=3 1280 B12R2.132 O=C1CSC2=C1C=C(Br)C=C2 F11126 [0,1,0,1,0,0|1,1,0]=4 1281 B12R2.132 O=C1NCC2=C1C=C(F)C=C2 84532 [0,1,0,1,0,0|2,0,0]=4 1282 B12R2.132 O=C1NCC2=C1C=C(I)C=C2 87915 [0,1,0,1,0,0|2,0,0]=4 1283 B12R2.132 O=C1NCC2=C1C=C(O)C=C2 82363 [0,1,0,1,0,0|2,0,0]=4 1284 B12R2.132 O=C1NOC2=C1C=C(Br)C=C2 27739 [0,1,0,1,0,0|1,0,0]=3 1285 B12R2.132 O=C1NSC2=C1C=C(Br)C=C2 F30839 [0,1,0,1,0,0|1,1,0]=4 1286 B12R2.132 O=C1OCC2=C1C=C(Cl)C=C2 76358 [0,1,0,1,0,0|1,0,0]=3 1287 B12R2.132 O=C1OCC2=C1C=C(F)C=C2 Y10487 [0,1,0,1,0,0|1,0,0]=3 1288 B12R2.132 O=C1OCC2=C1C=C(I)C=C2 82366 [0,1,0,1,0,0|1,0,0]=3 1289 B12R2.132 OC1=NNC2=C1C=C(Br)C=C2 67466 [0,1,0,1,0,0|2,0,0]=4 1290 B12R2.132 OC1=NNC2=C1C=C(I)C=C2 83259 [0,1,0,1,0,0|2,0,0]=4 1291 B12R2.1 BrCC1=NOC2=C1C=CC=C2 53608 [0,1,0,1,0,0|2,0,0]=4 1292 B12R2.1 N#CC1=COC2=C1C=CC=C2 N12998 [0,1,0,1,0,0|2,0,0]=4 1293 B12R2.1 O=CC1=COC2=C1C=CC=C2 29951 [0,1,0,1,0,0|1,0,0]=3 1294 B12R2.1 OCC1=NOC2=C1C=CC=C2 62838 [0,1,0,1,0,0|1,0,0]=3 1295 B12R2.18 CC1=C(Br)C2=C(C=CC=C2)O1 54481 [0,1,0,1,0,0|2,0,0]=4 1296 B8R1.7 O=C(O)C1=CSN=C1 83094 [1,0,0,0,1,0|2,0,0]=4 1297 B8R1.7 O=C(O)C1=NSC=C1 83207 [1,0,0,0,1,0|2,0,0]=4 1298 B8R1.11 CC1=CSC=C1C=O P16095 [1,0,0,0,1,0|2,0,0]=4 1299 B8R1.11 O=CC1=C(Br)C=CN1 P11326 [1,0,0,0,1,0|2,0,0]=4 1300 B8R1.11 O=CC1=C(Br)SC=C1 57105 [1,0,0,0,1,0|2,0,0]=4 1301 B8R1.11 O=CC1=C(Cl)SC=C1 A11316 [1,0,0,0,1,0|2,0,0]=4 1302 B8R1.11 O=CC1=C(I)SC=C1 C73596 [1,0,0,0,1,0|2,0,0]=4 1303 B12R1.125 CC(=O)NCC1=C(O)C=CC=C1 C76570 [0,0,0,0,0,2|1,0,0]=3 1304 B12R1.125 CC1=C(CCC(=O)O)C=CC=N1 72353 [0,0,0,0,0,2|2,0,0]=4 1305 B12R1.125 CC1=C(CCC(=O)O)C=CC=N1 97407 [0,0,0,0,0,2|2,0,0]=4 1306 B12R1.125 CC1=C(CCC(=O)O)C=NC=C1 72576 [0,0,0,0,0,2|2,0,0]=4 1307 B12R1.125 CC1=CC=CN=C1CCC(=O)O 72065 [0,0,0,0,0,2|2,0,0]=4 1308 B12R1.125 O=C(O)CNC1=C(Cl)C=CC=C1 E70332 [0,0,0,0,0,2|1,0,0]=3