0 B11R1.166 CC(=O)C1=C(Cl)C=C(C)C=C1 AT15339 [0,0,0,0,0,0|2,0,1]=3 1 B11R1.166 CC(=O)C1=C(O)C=C(I)C=C1 62926 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.166 CC(C)C1=C(Br)C=C(Cl)C=C1 F21471 [0,0,0,0,0,0|2,0,0]=2 3 B11R1.166 CC(C)C1=C(F)C=C(Br)C=C1 F52298 [0,0,0,0,0,0|2,0,0]=2 4 B11R1.166 CC1=CC(Br)=C(C(C)C)C=C1 AT26576 [0,0,0,0,0,0|1,0,0]=1 5 B11R1.166 CC1=CC(Br)=CN=C1[C@H](C)N N14911 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.166 CC1=CC(Br)=CN=C1[C@H](C)N N14912 [0,0,0,0,0,0|4,0,0]=4 7 B11R1.166 CC1=CC(Br)=CN=C1[C@H](C)N N14913 [0,0,0,0,0,0|4,0,0]=4 8 B11R1.166 CC1=CC(C)=C([C@H](C)N)C=C1 N12239 [0,0,0,0,0,0|2,0,0]=2 9 B11R1.166 CC1=CC(Cl)=C([C@H](C)N)C=C1 D81539 [0,0,0,0,0,0|2,0,0]=2 10 B11R1.166 CC1=CC(Cl)=C([C@H](C)N)C=C1 D81617 [0,0,0,0,0,0|2,0,0]=2 11 B11R1.166 CC1=CC(F)=C([C@H](C)O)C=C1 AT15336 [0,0,0,0,0,0|2,0,0]=2 12 B11R1.166 CC1=CC=C(C(C)C)C(N)=N1 AT11138 [0,0,0,0,0,0|2,0,0]=2 13 B11R1.166 CC1=CN=C([N+](=O)[O-])C(O)=C1 C14891 [0,0,0,0,0,0|4,0,0]=4 14 B11R1.166 C[C@H](Br)C1=C(F)C=C(F)C=C1 C77556 [0,0,0,0,0,0|3,0,0]=3 15 B11R1.166 C[C@H](Cl)C1=NC=C(Cl)C=C1F P14811 [0,0,0,0,0,0|4,0,0]=4 16 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Cl)C=N1 N14923 [0,0,0,0,0,0|4,0,0]=4 17 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Cl)C=N1 N14924 [0,0,0,0,0,0|4,0,0]=4 18 B11R1.166 C[C@H](N)C1=C(Cl)C=C(F)C=C1 N12749 [0,0,0,0,0,0|3,0,0]=3 19 B11R1.166 C[C@H](N)C1=C(Cl)C=C(F)C=C1 N13113 [0,0,0,0,0,0|3,0,0]=3 20 B11R1.166 C[C@H](N)C1=C(F)C=C(F)C=C1 F16902 [0,0,0,0,0,0|3,0,0]=3 21 B11R1.166 C[C@H](N)C1=NC=C(Br)C=C1F N14393 [0,0,0,0,0,0|4,0,0]=4 22 B11R1.166 C[C@H](N)C1=NC=C(Br)C=C1F N14394 [0,0,0,0,0,0|4,0,0]=4 23 B11R1.166 C[C@H](N)C1=NC=C(Br)C=C1F N14395 [0,0,0,0,0,0|4,0,0]=4 24 B11R1.166 C[C@H](N)C1=NC=C(Cl)C=C1F 79549 [0,0,0,0,0,0|4,0,0]=4 25 B11R1.166 C[C@H](O)C1=C(F)C=C(F)C=C1 AT11374 [0,0,0,0,0,0|3,0,0]=3 26 B11R1.166 C[C@H](O)C1=C(F)C=C(F)C=C1 AT11378 [0,0,0,0,0,0|3,0,0]=3 27 B11R1.166 C[C@H](O)C1=CC=C(Cl)N=C1Cl D75887 [0,0,0,0,0,0|4,0,0]=4 28 B11R1.166 C[C@H](O)C1=NC=C(Br)C=C1F S10055 [0,0,0,0,0,0|4,0,0]=4 29 B11R1.166 FC(F)C1=C(Br)C=C(I)C=C1 E70168 [0,0,0,0,0,0|4,0,0]=4 30 B11R1.166 OB(O)C1=C(O)C=C(Br)C=C1 D71659 [0,0,0,0,0,0|4,0,0]=4 31 B11R1.166 OC1=C(C(F)F)C=CC(F)=C1 79331 [0,0,0,0,0,0|3,0,0]=3 32 B10R1.13 CC(C)C1=NC=C(N)C=N1 81917 [1,0,0,0,0,0|3,0,0]=4 33 B10R1.13 CC(C)C1=NN=C(Br)C=C1 C14147 [1,0,0,0,0,0|3,0,0]=4 34 B10R1.13 CC1=CC=C([S@@](=O)Cl)C=C1 C14066 [1,0,0,0,0,0|3,0,0]=4 35 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 Y10705 [1,0,0,0,0,0|2,0,0]=3 36 B10R1.13 CC1=CN=C([C@H](C)N)C=N1 56573 [1,0,0,0,0,0|3,0,0]=4 37 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 56564 [1,0,0,0,0,0|2,0,0]=3 38 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 56569 [1,0,0,0,0,0|2,0,0]=3 39 B10R1.13 CC1=NC=C([C@H](C)N)C=N1 AT10886 [1,0,0,0,0,0|3,0,0]=4 40 B10R1.13 CC1=NC=C([C@H](C)N)C=N1 AT10887 [1,0,0,0,0,0|3,0,0]=4 41 B10R1.13 CC1=NC=C([C@H](C)N)C=N1 C90363 [1,0,0,0,0,0|3,0,0]=4 42 B10R1.13 CC1=NC=C([C@H](C)O)C=N1 AT10878 [1,0,0,0,0,0|3,0,0]=4 43 B10R1.13 CN(C)C1=CC=C(S)C=C1 T70960 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.13 CN(C)C1=NC=C(N)C=C1 D74940 [1,0,0,0,0,0|3,0,0]=4 45 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 F16941 [1,0,0,0,0,0|2,0,0]=3 46 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 N12656 [1,0,0,0,0,0|2,0,0]=3 47 B10R1.13 C[C@H](N)C1=CN=C(Br)C=C1 N11221 [1,0,0,0,0,0|3,0,0]=4 48 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 D81683 [1,0,0,0,0,0|3,0,0]=4 49 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 Y10703 [1,0,0,0,0,0|3,0,0]=4 50 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 90531 [1,0,0,0,0,0|3,0,0]=4 51 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 N16973 [1,0,0,0,0,0|3,0,0]=4 52 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 90529 [1,0,0,0,0,0|3,0,0]=4 53 B10R1.13 C[C@H](O)C1=CN=C(F)C=C1 AT10687 [1,0,0,0,0,0|3,0,0]=4 54 B10R1.13 C[C@H](O)C1=NC=C(F)C=C1 AT10690 [1,0,0,0,0,0|3,0,0]=4 55 B10R1.13 NC1=CC=C(C(F)F)C=C1 84195 [1,0,0,0,0,0|3,0,0]=4 56 B10R1.25 BrCC1=C(Br)C=C(Br)C=C1 C90776 [1,0,0,0,0,0|3,0,0]=4 57 B10R1.25 CC1=C(CBr)C=CC(N)=C1 98280 [1,0,0,0,0,0|3,0,0]=4 58 B10R1.25 CC1=C(CO)C=CC(Cl)=C1 T70197 [1,0,0,0,0,0|3,0,0]=4 59 B10R1.25 CC1=C(CO)C=CC(F)=C1 CK2474 [1,0,0,0,0,0|3,0,0]=4 60 B10R1.25 CC1=C(CO)C=CC(O)=C1 N13176 [1,0,0,0,0,0|3,0,0]=4 61 B10R1.25 CC1=CC(C)=NC=C1CN W16199 [1,0,0,0,0,0|3,0,0]=4 62 B10R1.25 CC1=CC(F)=C(CN)C=C1 A12837 [1,0,0,0,0,0|2,0,0]=3 63 B10R1.25 CC1=CC(F)=C(CO)C=C1 98275 [1,0,0,0,0,0|2,0,0]=3 64 B10R1.25 CC1=CC(F)=C(NN)C=C1 A12578 [1,0,0,0,0,0|3,0,0]=4 65 B10R1.25 CC1=CC(N)=C(C=O)C=C1 F15845 [1,0,0,0,0,0|2,0,1]=4 66 B10R1.25 CC1=CC(N)=C(CO)C=C1 O10038 [1,0,0,0,0,0|2,0,0]=3 67 B10R1.25 CC1=CC(O)=C(CO)C=C1 N12596 [1,0,0,0,0,0|1,0,0]=2 68 B10R1.25 CC1=CN=C(CBr)C(C)=C1 O10504 [1,0,0,0,0,0|3,0,0]=4 69 B10R1.25 CC1=CN=C(CN)C(C)=C1 D73748 [1,0,0,0,0,0|3,0,0]=4 70 B10R1.25 CC1=NC=C(CO)C(O)=N1 C76221 [1,0,0,0,0,0|3,0,0]=4 71 B10R1.25 CCC1=C(Br)C=C(Br)C=N1 F14393 [1,0,0,0,0,0|3,0,0]=4 72 B10R1.25 CCC1=C(N)C=C(F)C=C1 F20990 [1,0,0,0,0,0|2,0,0]=3 73 B10R1.25 CCN1C=CC(N)=CC1=O P12616 [1,0,0,0,0,0|2,0,1]=4 74 B10R1.25 CNC1=C(F)C=C(Br)C=C1 AT23114 [1,0,0,0,0,0|3,0,0]=4 75 B10R1.25 CNC1=C(F)C=C(Cl)C=C1 C11094 [1,0,0,0,0,0|3,0,0]=4 76 B10R1.25 CNC1=NC=C(C)C=C1N D75084 [1,0,0,0,0,0|3,0,0]=4 77 B10R1.25 COC1=C(I)C=C(C)N=C1 96426 [1,0,0,0,0,0|3,0,0]=4 78 B10R1.25 COC1=C(I)C=C(I)C=C1 AT18541 [1,0,0,0,0,0|3,0,0]=4 79 B10R1.25 COC1=C(O)N=C(C)N=C1 F30536 [1,0,0,0,0,0|3,0,0]=4 80 B10R1.25 COC1=NC=C(C)C=C1N D74381 [1,0,0,0,0,0|3,0,0]=4 81 B10R1.25 CSC1=C(Br)C=C(Br)C=C1 C13885 [1,0,0,0,0,0|3,0,0]=4 82 B10R1.25 CSC1=C(F)C=C(O)C=C1 94985 [1,0,0,0,0,0|3,0,0]=4 83 B10R1.25 FC1=CC(F)=C(CS)C=C1 AT13686 [1,0,0,0,0,0|3,0,0]=4 84 B10R1.25 NC1=C(CO)C=CC(F)=C1 AC5155 [1,0,0,0,0,0|3,0,0]=4 85 B10R1.25 NC1=CC(F)=C(CO)C=C1 AT26531 [1,0,0,0,0,0|3,0,0]=4 86 B10R1.25 NC1=CC(O)=C(CO)C=C1 D76340 [1,0,0,0,0,0|2,0,0]=3 87 B10R1.25 NCC1=C(Br)C=C(F)C=C1 Y11648 [1,0,0,0,0,0|3,0,0]=4 88 B10R1.25 NCC1=C(Cl)C=C(O)C=C1 F52064 [1,0,0,0,0,0|3,0,0]=4 89 B10R1.25 NCC1=C(F)C=C(N)C=C1 C90567 [1,0,0,0,0,0|3,0,0]=4 90 B10R1.25 NCC1=C(F)C=C(O)C=C1 N14307 [1,0,0,0,0,0|3,0,0]=4 91 B10R1.25 NCC1=C(N)C=C(Cl)C=C1 AC6575 [1,0,0,0,0,0|3,0,0]=4 92 B10R1.25 NCC1=C(O)C=C(Br)C=C1 AT19138 [1,0,0,0,0,0|2,0,0]=3 93 B10R1.25 NCC1=C(O)C=C(O)C=C1 I11211 [1,0,0,0,0,0|2,0,0]=3 94 B10R1.25 OCC1=C(I)C=C(Cl)C=C1 C90809 [1,0,0,0,0,0|3,0,0]=4 95 B10R1.25 OCC1=C(O)C=C(F)C=C1 A51208 [1,0,0,0,0,0|2,0,0]=3 96 B10R1.61 C=C(C)C1=C(I)C=CC=C1 E72643 [1,0,0,0,0,0|1,0,2]=4 97 B10R1.61 CC(=O)C1=C(S)C=CC=C1 93483 [1,0,0,0,0,0|1,1,1]=4 98 B10R1.61 CC(C)C1=CN=CN=C1Cl H10240 [1,0,0,0,0,0|3,0,0]=4 99 B10R1.61 CC(C)C1=NC=CN=C1Cl AT24532 [1,0,0,0,0,0|3,0,0]=4 100 B10R1.61 CC(C)C1=NC=CN=C1N 60031 [1,0,0,0,0,0|3,0,0]=4 101 B10R1.61 CC(C)C1=NC=CN=C1N W15952 [1,0,0,0,0,0|3,0,0]=4 102 B10R1.61 CC1=C(C(C)C)C=CC=C1 T71005 [1,0,0,0,0,0|1,0,0]=2 103 B10R1.61 C[C@H](Br)C1=C(Cl)C=CC=C1 C77623 [1,0,0,0,0,0|2,0,0]=3 104 B10R1.61 C[C@H](Cl)C1=C(Cl)C=CC=C1 A11172 [1,0,0,0,0,0|2,0,0]=3 105 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 70081 [1,0,0,0,0,0|3,0,0]=4 106 B10R1.61 C[C@H](N)C1=C(Cl)C=NC=C1 N14402 [1,0,0,0,0,0|3,0,0]=4 107 B10R1.61 C[C@H](N)C1=C(O)C=CC=N1 N14916 [1,0,0,0,0,0|2,0,0]=3 108 B10R1.61 C[C@H](N)C1=CC=CN=C1N P19332 [1,0,0,0,0,0|3,0,0]=4 109 B10R1.61 C[C@H](O)C1=C(N)N=CC=C1 C10363 [1,0,0,0,0,0|3,0,0]=4 110 B10R1.61 O=C([O-])C1=C(O)C=CC=C1 FD10574 [1,0,0,0,0,0|2,0,1]=4 111 B12R1.57 CC1=CC(CO)=C(B(O)O)C=C1 D71435 [0,1,0,0,0,0|3,0,0]=4 112 B12R1.57 COC1=C(C(C)=O)C=CC(O)=C1 W17789 [0,1,0,0,0,0|2,0,1]=4 113 B12R1.57 COC1=C(C(F)F)C=CC(Br)=C1 AC3396 [0,1,0,0,0,0|3,0,0]=4 114 B12R1.57 COC1=C([C@H](C)N)C=CC(F)=C1 N13112 [0,1,0,0,0,0|2,0,0]=3 115 B12R1.126 CC(C)(C)C1=C(O)C=C(O)C=C1 E10076 [0,1,0,0,0,0|1,0,0]=2 116 B12R1.126 CC(C)(O)C1=C(F)C=C(Br)C=C1 F52342 [0,1,0,0,0,0|2,0,0]=3 117 B12R1.126 CC1=CC(N)=C(C(F)(F)F)C=C1 C71268 [0,1,0,0,0,0|3,0,0]=4 118 B12R1.232 CC(=O)C1=CC(Cl)=C(F)C=C1O P18161 [0,1,0,0,0,0|2,0,1]=4 119 B12R1.232 CC(=O)C1=CC(Cl)=C(O)C=C1O AT18320 [0,1,0,0,0,0|2,0,1]=4 120 B12R1.232 CC(=O)C1=CC(F)=C(O)C=C1O AT18317 [0,1,0,0,0,0|2,0,1]=4 121 B12R1.232 CC1=C(F)C=C([N+](=O)[O-])C(O)=C1 55943 [0,1,0,0,0,0|3,0,0]=4 122 B12R1.232 C[C@H](N)C1=CC(Cl)=C(F)C=C1F 94484 [0,1,0,0,0,0|3,0,0]=4 123 B12R1.232 C[C@H](N)C1=CC(Cl)=C(F)C=C1F 94485 [0,1,0,0,0,0|3,0,0]=4 124 B12R1.452 CCC1=CC(O)=C([N+](=O)[O-])C=C1 F13833 [0,1,0,0,0,0|3,0,0]=4 125 B12R1.452 CN(C)C1=C(Cl)C=C(C=O)C=C1 AT16362 [0,1,0,0,0,0|2,0,1]=4 126 B12R1.452 COC1=CC(Br)=C(C(C)C)C=C1 E71918 [0,1,0,0,0,0|1,0,0]=2 127 B12R1.452 COC1=CC(F)=C(C(C)C)C=C1 P10295 [0,1,0,0,0,0|1,0,0]=2 128 B12R1.452 C[C@H](N)C1=C(F)C=C(CO)C=C1 N14658 [0,1,0,0,0,0|2,0,0]=3 129 B12R1.1000 CC(=O)C1=C(Br)C=C(Br)C=C1O 93704 [0,1,0,0,0,0|2,0,1]=4 130 B12R1.1000 CC1=CC(Br)=CC(C)=C1N(C)C 76906 [0,1,0,0,0,0|3,0,0]=4 131 B12R1.1000 CC1=CC(C)=C([C@H](C)N)C(C)=C1 E71773 [0,1,0,0,0,0|2,0,0]=3 132 B12R1.1000 CC1=CC(O)=C(C(=O)O)C(C)=C1 95585 [0,1,0,0,0,0|2,0,1]=4 133 B12R1.1000 C[C@H](N)C1=C(F)C=C(F)C=C1F N13233 [0,1,0,0,0,0|3,0,0]=4 134 B12R1.1703 C=C[C@H](N)C1=C(F)C=C(C)C=C1 N15339 [0,1,0,0,0,0|2,0,1]=4 135 B12R1.1703 C=C[C@H](N)C1=C(F)C=C(C)C=C1 N15340 [0,1,0,0,0,0|2,0,1]=4 136 B12R1.1703 C=C[C@H](N)C1=C(F)C=C(C)C=C1 N15341 [0,1,0,0,0,0|2,0,1]=4 137 B12R1.1703 CC1=CC(C)=C([C@@H](N)CN)C=C1 N13753 [0,1,0,0,0,0|2,0,0]=3 138 B12R1.1703 CC1=CC(C)=C([C@@H](N)CN)C=C1 N13754 [0,1,0,0,0,0|2,0,0]=3 139 B12R1.1703 CC1=CC(C)=C([C@@H](N)CN)C=C1 N13755 [0,1,0,0,0,0|2,0,0]=3 140 B12R1.1703 CC1=CC(C)=C([C@@H](N)CN)C=C1 N13768 [0,1,0,0,0,0|2,0,0]=3 141 B12R1.1703 CC1=CC(C)=C([C@@H](N)CN)C=C1 N13769 [0,1,0,0,0,0|2,0,0]=3 142 B12R1.1703 CC1=CC(C)=C([C@@H](O)CN)C=C1 C77862 [0,1,0,0,0,0|2,0,0]=3 143 B12R1.1703 CC1=CC(Cl)=C([C@@H](N)CN)C=C1 N13631 [0,1,0,0,0,0|2,0,0]=3 144 B12R1.1703 CC1=CC(Cl)=C([C@@H](N)CN)C=C1 N13632 [0,1,0,0,0,0|2,0,0]=3 145 B12R1.1703 CC1=CC(Cl)=C([C@@H](N)CN)C=C1 N13633 [0,1,0,0,0,0|2,0,0]=3 146 B12R1.1703 CC1=CC(F)=C([C@@H](N)CN)C=C1 N13557 [0,1,0,0,0,0|2,0,0]=3 147 B12R1.1703 CC1=CC(F)=C([C@@H](N)CN)C=C1 N13558 [0,1,0,0,0,0|2,0,0]=3 148 B12R1.1703 CC1=CC(F)=C([C@@H](N)CN)C=C1 N13559 [0,1,0,0,0,0|2,0,0]=3 149 B12R1.1703 CCC(=O)C1=C(C)C=C(C)C=C1 N12084 [0,1,0,0,0,0|2,0,1]=4 150 B12R1.1703 CCC(=O)C1=C(Cl)C=C(C)C=C1 N14082 [0,1,0,0,0,0|2,0,1]=4 151 B12R1.1703 CCC(=O)C1=C(F)C=C(C)C=C1 N14029 [0,1,0,0,0,0|2,0,1]=4 152 B12R1.1703 CCC(=O)C1=C(O)C=C(Cl)C=C1 98266 [0,1,0,0,0,0|2,0,1]=4 153 B12R1.1703 CC[C@H](N)C1=C(C)C=C(C)C=C1 N12160 [0,1,0,0,0,0|2,0,0]=3 154 B12R1.1703 CC[C@H](N)C1=C(F)C=C(F)C=C1 N10945 [0,1,0,0,0,0|3,0,0]=4 155 B12R1.1703 CC[C@H](N)C1=C(F)C=C(F)C=C1 N11162 [0,1,0,0,0,0|3,0,0]=4 156 B12R1.1703 CC[C@H](O)C1=C(C)C=C(C)C=C1 N14425 [0,1,0,0,0,0|2,0,0]=3 157 B12R1.1703 CC[C@H](O)C1=C(Cl)C=C(Cl)C=C1 N14422 [0,1,0,0,0,0|3,0,0]=4 158 B12R1.1703 CC[C@H](O)C1=C(F)C=C(Br)C=C1 97337 [0,1,0,0,0,0|3,0,0]=4 159 B12R1.1703 CC[C@H](O)C1=C(F)C=C(F)C=C1 N12683 [0,1,0,0,0,0|3,0,0]=4 160 B12R1.1703 CN[C@@H](C)C1=C(F)C=C(F)C=C1 N14215 [0,1,0,0,0,0|2,0,0]=3 161 B12R1.1703 CN[C@@H](C)C1=C(F)C=C(F)C=C1 N14216 [0,1,0,0,0,0|2,0,0]=3 162 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Br)C=C1 N13628 [0,1,0,0,0,0|3,0,0]=4 163 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Br)C=C1 N13629 [0,1,0,0,0,0|3,0,0]=4 164 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Br)C=C1 N13630 [0,1,0,0,0,0|3,0,0]=4 165 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Cl)C=C1 N13577 [0,1,0,0,0,0|3,0,0]=4 166 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Cl)C=C1 N13578 [0,1,0,0,0,0|3,0,0]=4 167 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Cl)C=C1 N13579 [0,1,0,0,0,0|3,0,0]=4 168 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Cl)C=C1 N13580 [0,1,0,0,0,0|3,0,0]=4 169 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(F)C=C1 N13581 [0,1,0,0,0,0|3,0,0]=4 170 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(F)C=C1 N13582 [0,1,0,0,0,0|3,0,0]=4 171 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(F)C=C1 N13583 [0,1,0,0,0,0|3,0,0]=4 172 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(F)C=C1 N13585 [0,1,0,0,0,0|3,0,0]=4 173 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(F)C=C1 N13586 [0,1,0,0,0,0|3,0,0]=4 174 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Br)C=C1 N13552 [0,1,0,0,0,0|3,0,0]=4 175 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Br)C=C1 N13553 [0,1,0,0,0,0|3,0,0]=4 176 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Br)C=C1 N13554 [0,1,0,0,0,0|3,0,0]=4 177 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Br)C=C1 N13555 [0,1,0,0,0,0|3,0,0]=4 178 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Br)C=C1 N13556 [0,1,0,0,0,0|3,0,0]=4 179 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Cl)C=C1 N13549 [0,1,0,0,0,0|3,0,0]=4 180 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Cl)C=C1 N13550 [0,1,0,0,0,0|3,0,0]=4 181 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Cl)C=C1 N13551 [0,1,0,0,0,0|3,0,0]=4 182 B12R1.1703 NC[C@H](N)C1=C(F)C=C(F)C=C1 N13546 [0,1,0,0,0,0|3,0,0]=4 183 B12R1.1703 NC[C@H](N)C1=C(F)C=C(F)C=C1 N13547 [0,1,0,0,0,0|3,0,0]=4 184 B12R1.1703 NC[C@H](N)C1=C(F)C=C(F)C=C1 N13548 [0,1,0,0,0,0|3,0,0]=4 185 B12R1.1703 NC[C@H](O)C1=C(Cl)C=C(Cl)C=C1 C78542 [0,1,0,0,0,0|3,0,0]=4 186 B12R1.1703 NC[C@H](O)C1=C(F)C=C(F)C=C1 C78271 [0,1,0,0,0,0|3,0,0]=4 187 B12R1.1703 N[C@@H](CO)C1=C(Br)C=C(F)C=C1 AT10628 [0,1,0,0,0,0|3,0,0]=4 188 B12R1.1703 N[C@@H](CO)C1=C(Br)C=C(F)C=C1 AT10637 [0,1,0,0,0,0|3,0,0]=4 189 B12R1.1703 O=C(CCl)C1=C(O)C=C(F)C=C1 AC4164 [0,1,0,0,0,0|2,0,1]=4 190 B12R1.1703 O[C@@H](CBr)C1=C(Cl)C=C(Cl)C=C1 11639 [0,1,0,0,0,0|3,0,0]=4 191 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CC2 N10840 [0,0,0,1,0,0|2,0,0]=3 192 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CO2 N11326 [0,0,0,1,0,0|1,0,0]=2 193 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CO2 N16521 [0,0,0,1,0,0|1,0,0]=2 194 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CO2 N16523 [0,0,0,1,0,0|1,0,0]=2 195 B12R2.612 CC1=COC2=C1C=CC(Br)=C2 V10221 [0,0,0,1,0,0|1,0,2]=4 196 B12R2.612 ClC1=CC2=C(C=C1)[C@@H](Br)CC2 AT21847 [0,0,0,1,0,0|3,0,0]=4 197 B12R2.612 Cl[C@H]1CCC2=C1C=CC(Br)=C2 O11349 [0,0,0,1,0,0|3,0,0]=4 198 B12R2.612 NC1=CC2=C(C=C1)[C@@H](N)CO2 N14630 [0,0,0,1,0,0|2,0,0]=3 199 B12R2.612 NC1=CC2=C(C=C1)[C@@H](N)CO2 N14631 [0,0,0,1,0,0|2,0,0]=3 200 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 69968 [0,0,0,1,0,0|3,0,0]=4 201 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 F16940 [0,0,0,1,0,0|3,0,0]=4 202 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 Y11252 [0,0,0,1,0,0|3,0,0]=4 203 B12R2.612 N[C@H]1COC2=C1C=CC(Br)=C2 N11256 [0,0,0,1,0,0|2,0,0]=3 204 B12R2.612 O[C@H]1COC2=C1C=CC(Cl)=C2 AT21520 [0,0,0,1,0,0|2,0,0]=3 205 B12R2.1317 CC1=CC(C)=C(C2CC2)C=C1 AC9569 [0,0,0,1,0,0|1,0,0]=2 206 B12R2.1317 FC1=CC(F)=C(C2CC2)C=C1 AC9452 [0,0,0,1,0,0|2,0,0]=3 207 B12R2.1317 NC1=C(C2CC2)C=CC(Cl)=C1 AC9037 [0,0,0,1,0,0|2,0,0]=3 208 B10R1.194 CC1=C(N)N(C(C)C)N=C1 AT11115 [0,0,0,0,1,0|3,0,0]=4 209 B12R1.233 CC(C)OC1=C(Br)C=C(Cl)C=C1 C91609 [0,0,0,0,0,1|2,0,0]=3 210 B12R1.233 CC(C)OC1=NC=C(Br)C=C1Cl W12587 [0,0,0,0,0,1|3,0,0]=4 211 B12R1.233 CC(C)OC1=NC=C(Cl)C=C1F W12585 [0,0,0,0,0,1|3,0,0]=4 212 B12R1.233 CC1=CC(Br)=C(OC(F)F)C=C1 AT15191 [0,0,0,0,0,1|3,0,0]=4 213 B12R1.233 CC1=CC(N)=C(OC(F)F)C=C1 AT12965 [0,0,0,0,0,1|3,0,0]=4 214 B12R1.233 CN(C)CC1=C(F)C=C(Br)C=C1 N11554 [0,0,0,0,0,1|3,0,0]=4 215 B12R1.233 C[C@H](N)CC1=C(Cl)C=C(Cl)C=C1 N11064 [0,0,0,0,0,1|3,0,0]=4 216 B12R1.233 C[C@H](N)CC1=C(Cl)C=C(F)C=C1 N11062 [0,0,0,0,0,1|3,0,0]=4 217 B9R1.1 CC1=NC=C(CBr)C=C1 F52459 [2,0,0,0,0,0|2,0,0]=4 218 B9R1.1 CC1=NC=C(CCl)C=C1 D87733 [2,0,0,0,0,0|2,0,0]=4 219 B9R1.1 CCN1C=CC(=S)C=C1 W16146 [2,0,0,0,0,0|2,0,0]=4 220 B9R1.1 CNC1=CC=C(N)C=C1 C78356 [2,0,0,0,0,0|2,0,0]=4 221 B9R1.1 C[Se]C1=CC=C(Br)C=C1 97865 [2,0,0,0,0,0|2,0,0]=4 222 B9R1.1 NCC1=CC=C(F)C=C1 N12249 [2,0,0,0,0,0|2,0,0]=4 223 B9R1.1 NCC1=CC=C(S)C=C1 AT20992 [2,0,0,0,0,0|2,0,0]=4 224 B9R1.1 [2H]CC1=CC=C(F)C=C1 D98910 [2,0,0,0,0,0|2,0,0]=4 225 B9R1.6 C[C@H](Cl)C1=NC=CC=C1 F13293 [2,0,0,0,0,0|2,0,0]=4 226 B9R1.6 C[C@H](N)C1=CC=CN=C1 S11132 [2,0,0,0,0,0|2,0,0]=4 227 B9R1.6 C[C@H](N)C1=CC=NC=C1 F31048 [2,0,0,0,0,0|2,0,0]=4 228 B9R1.6 C[C@H](N)C1=NC=CC=C1 90514 [2,0,0,0,0,0|2,0,0]=4 229 B9R1.15 CCC1=C(Br)C=CN=C1 H11182 [2,0,0,0,0,0|2,0,0]=4 230 B9R1.15 CCC1=CC=CN=C1C 75814 [2,0,0,0,0,0|2,0,0]=4 231 B9R1.15 CCC1=CN=CN=C1O C15413 [2,0,0,0,0,0|2,0,0]=4 232 B9R1.15 NCC1=C(I)C=CC=C1 AT26620 [2,0,0,0,0,0|2,0,0]=4 233 B9R1.15 NCC1=C(O)C=CC=N1 C73700 [2,0,0,0,0,0|2,0,0]=4 234 B9R1.15 NCC1=C(O)C=CN=C1 AT18117 [2,0,0,0,0,0|2,0,0]=4 235 B9R1.15 [2H]CC1=C(F)C=CC=C1 D99779 [2,0,0,0,0,0|2,0,0]=4 236 B9R1.69 CC1=C(S)C=C(Br)C=C1 AT20875 [2,0,0,0,0,0|1,1,0]=4 237 B9R1.69 CC1=C(S)C=C(N)C=C1 AT20843 [2,0,0,0,0,0|1,1,0]=4 238 B9R1.69 CC1=CC(N)=C(S)C=C1 AT19644 [2,0,0,0,0,0|2,0,0]=4 239 B9R1.69 CC1=CC(S)=C(Cl)C=C1 AT20814 [2,0,0,0,0,0|1,1,0]=4 240 B9R1.69 CC1=CC(S)=C(N)C=C1 AT19639 [2,0,0,0,0,0|1,1,0]=4 241 B9R1.69 CC1=CC(S)=C(N)C=C1 AT19640 [2,0,0,0,0,0|1,1,0]=4 242 B9R1.69 CC1=CC=C(N)C(O)=N1 68793 [2,0,0,0,0,0|2,0,0]=4 243 B9R1.69 NC1=CC(O)=C(Br)C=C1 C91066 [2,0,0,0,0,0|2,0,0]=4 244 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 D87575 [1,1,0,0,0,0|1,0,1]=4 245 B11R1.3 CC(C)C1=CC=C(CS)C=C1 AT13687 [1,1,0,0,0,0|0,0,0]=2 246 B11R1.3 CC(C)C1=NC=C(CN)C=N1 81408 [1,1,0,0,0,0|2,0,0]=4 247 B11R1.3 CCC1=CC=C([C@H](C)N)C=C1 N12206 [1,1,0,0,0,0|1,0,0]=3 248 B11R1.3 COC1=CN=C([C@H](C)N)C=C1 90819 [1,1,0,0,0,0|2,0,0]=4 249 B11R1.3 COC1=CN=C([C@H](C)N)C=C1 90820 [1,1,0,0,0,0|2,0,0]=4 250 B11R1.3 COC1=NC=C([C@H](C)N)C=C1 90831 [1,1,0,0,0,0|2,0,0]=4 251 B11R1.3 COC1=NC=C([C@H](C)N)C=C1 N11219 [1,1,0,0,0,0|2,0,0]=4 252 B11R1.3 CSC1=CC=C([C@H](C)N)C=C1 D76956 [1,1,0,0,0,0|1,0,0]=3 253 B11R1.3 CSC1=CC=C([C@H](C)N)C=C1 N10959 [1,1,0,0,0,0|1,0,0]=3 254 B11R1.3 CSC1=CC=C([C@H](C)O)C=C1 AT20981 [1,1,0,0,0,0|1,0,0]=3 255 B11R1.3 CSC1=CC=C([C@H](C)O)C=C1 AT20982 [1,1,0,0,0,0|1,0,0]=3 256 B11R1.3 C[C@H](N)C1=CC=C(C#N)C=C1 F16855 [1,1,0,0,0,0|1,0,1]=4 257 B11R1.3 C[C@H](N)C1=CC=C(CCl)C=C1 96061 [1,1,0,0,0,0|1,0,0]=3 258 B11R1.3 C[C@H](O)C1=CC=C(C#N)C=C1 C13987 [1,1,0,0,0,0|1,0,1]=4 259 B11R1.3 OCC1=CC=C(C(F)F)C=C1 AT10625 [1,1,0,0,0,0|2,0,0]=4 260 B11R1.19 CC(C)(C)C1=CN=C(O)C=C1 F13765 [1,1,0,0,0,0|2,0,0]=4 261 B11R1.19 CC(C)(F)C1=NC=C(Br)C=C1 AC2038 [1,1,0,0,0,0|2,0,0]=4 262 B11R1.19 CC(C)(N)C1=CC=C(Cl)C=C1 98110 [1,1,0,0,0,0|1,0,0]=3 263 B11R1.19 CC(C)(N)C1=CC=C(F)C=C1 N10815 [1,1,0,0,0,0|1,0,0]=3 264 B11R1.19 CC(C)(N)C1=CN=C(Cl)C=C1 91211 [1,1,0,0,0,0|2,0,0]=4 265 B11R1.19 CC(C)(O)C1=CN=C(Br)C=C1 AB10226 [1,1,0,0,0,0|2,0,0]=4 266 B11R1.19 CC(C)(O)C1=CN=C(Cl)C=C1 AT10277 [1,1,0,0,0,0|2,0,0]=4 267 B11R1.19 CC(C)(O)C1=CN=C(F)C=C1 88188 [1,1,0,0,0,0|2,0,0]=4 268 B11R1.19 CC1=CC=C(C(C)(C)N)C=C1 F13271 [1,1,0,0,0,0|0,0,0]=2 269 B11R1.19 CP(C)(=O)C1=CC=C(F)C=C1 AT21937 [1,1,0,0,0,0|2,0,0]=4 270 B11R1.19 CP(C)(=O)C1=CC=C(N)C=C1 D77062 [1,1,0,0,0,0|2,0,0]=4 271 B11R1.19 C[Si](C)(C)C1=CC=C(N)C=C1 D71910 [1,1,0,0,0,0|1,1,0]=4 272 B11R1.19 C[Si](C)(C)C1=CC=C(O)C=C1 D76703 [1,1,0,0,0,0|1,1,0]=4 273 B11R1.21 CC(C)C1=CC(Br)=C(I)C=C1 H11162 [1,1,0,0,0,0|1,0,0]=3 274 B11R1.21 CC1=C(C)C=C([C@H](C)O)C=C1 44393 [1,1,0,0,0,0|1,0,0]=3 275 B11R1.21 CC1=C(N)C=C([C@H](C)N)C=C1 Y11249 [1,1,0,0,0,0|1,0,0]=3 276 B11R1.21 CC1=C(O)C=C([C@H](C)N)C=C1 N14772 [1,1,0,0,0,0|1,0,0]=3 277 B11R1.21 CC1=C(O)C=CC([C@H](C)N)=C1 N14776 [1,1,0,0,0,0|2,0,0]=4 278 B11R1.21 CN(C)C1=CC(N)=C(N)C=C1 F53085 [1,1,0,0,0,0|2,0,0]=4 279 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Cl)C=C1 Y11087 [1,1,0,0,0,0|2,0,0]=4 280 B11R1.21 C[C@H](N)C1=CC(F)=C(F)C=C1 Y11614 [1,1,0,0,0,0|2,0,0]=4 281 B11R1.21 C[C@H](N)C1=CC(O)=C(F)C=C1 N14349 [1,1,0,0,0,0|2,0,0]=4 282 B11R1.21 C[C@H](N)C1=CC(O)=C(F)C=C1 N14734 [1,1,0,0,0,0|2,0,0]=4 283 B11R1.21 C[C@H](O)C1=CC(F)=C(F)C=C1 AT11379 [1,1,0,0,0,0|2,0,0]=4 284 B11R1.21 C[C@H](O)C1=CC(F)=C(F)C=C1 AT11380 [1,1,0,0,0,0|2,0,0]=4 285 B11R1.22 C#C[C@@H](O)C1=CC=C(C)C=C1 AC6704 [1,1,0,0,0,0|1,0,1]=4 286 B11R1.22 C=C[C@H](N)C1=CC=C(C)C=C1 N15265 [1,1,0,0,0,0|1,0,1]=4 287 B11R1.22 C=C[C@H](N)C1=CC=C(C)C=C1 N15266 [1,1,0,0,0,0|1,0,1]=4 288 B11R1.22 C=C[C@H](N)C1=CC=C(C)C=C1 N15267 [1,1,0,0,0,0|1,0,1]=4 289 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 C75563 [1,1,0,0,0,0|1,0,1]=4 290 B11R1.22 CC1=CC=C(C(=O)CO)C=C1 AC6089 [1,1,0,0,0,0|1,0,1]=4 291 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13432 [1,1,0,0,0,0|1,0,0]=3 292 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13433 [1,1,0,0,0,0|1,0,0]=3 293 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13434 [1,1,0,0,0,0|1,0,0]=3 294 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13455 [1,1,0,0,0,0|1,0,0]=3 295 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13456 [1,1,0,0,0,0|1,0,0]=3 296 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13457 [1,1,0,0,0,0|1,0,0]=3 297 B11R1.22 CC1=CC=C([C@@H](O)CN)C=C1 C78285 [1,1,0,0,0,0|1,0,0]=3 298 B11R1.22 CC1=NC=C([C@@H](N)CO)C=C1 N11154 [1,1,0,0,0,0|2,0,0]=4 299 B11R1.22 CC1=NC=C([C@@H](N)CO)C=C1 N11155 [1,1,0,0,0,0|2,0,0]=4 300 B11R1.22 CC[C@H](C)C1=CC=C(Br)C=C1 O10385 [1,1,0,0,0,0|1,0,0]=3 301 B11R1.22 CC[C@H](N)C1=CC=C(C)C=C1 N12295 [1,1,0,0,0,0|1,0,0]=3 302 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y11091 [1,1,0,0,0,0|1,0,0]=3 303 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y11092 [1,1,0,0,0,0|1,0,0]=3 304 B11R1.22 CO[C@@H](C)C1=CC=C(Br)C=C1 N11516 [1,1,0,0,0,0|1,0,0]=3 305 B11R1.22 CO[S@@](=O)C1=CC=C(C)C=C1 D92807 [1,1,0,0,0,0|2,0,0]=4 306 B11R1.22 C[C@@H](CN)C1=CC=C(Cl)C=C1 F20636 [1,1,0,0,0,0|1,0,0]=3 307 B11R1.22 C[C@@H](CN)C1=CC=C(O)C=C1 70995 [1,1,0,0,0,0|1,0,0]=3 308 B11R1.22 C[C@H](C#N)C1=CC=C(F)C=C1 AT19993 [1,1,0,0,0,0|1,0,1]=4 309 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13423 [1,1,0,0,0,0|2,0,0]=4 310 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13424 [1,1,0,0,0,0|2,0,0]=4 311 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13425 [1,1,0,0,0,0|2,0,0]=4 312 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13446 [1,1,0,0,0,0|2,0,0]=4 313 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13447 [1,1,0,0,0,0|2,0,0]=4 314 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13448 [1,1,0,0,0,0|2,0,0]=4 315 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N12560 [1,1,0,0,0,0|2,0,0]=4 316 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13414 [1,1,0,0,0,0|2,0,0]=4 317 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13415 [1,1,0,0,0,0|2,0,0]=4 318 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13416 [1,1,0,0,0,0|2,0,0]=4 319 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13438 [1,1,0,0,0,0|2,0,0]=4 320 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13439 [1,1,0,0,0,0|2,0,0]=4 321 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13400 [1,1,0,0,0,0|2,0,0]=4 322 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13401 [1,1,0,0,0,0|2,0,0]=4 323 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13402 [1,1,0,0,0,0|2,0,0]=4 324 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13406 [1,1,0,0,0,0|2,0,0]=4 325 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13407 [1,1,0,0,0,0|2,0,0]=4 326 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13408 [1,1,0,0,0,0|2,0,0]=4 327 B11R1.22 NC[C@H](O)C1=CC=C(Br)C=C1 58433 [1,1,0,0,0,0|2,0,0]=4 328 B11R1.22 NC[C@H](O)C1=CC=C(F)C=C1 C78230 [1,1,0,0,0,0|2,0,0]=4 329 B11R1.22 N[C@@H](CF)C1=CC=C(Br)C=C1 N14615 [1,1,0,0,0,0|2,0,0]=4 330 B11R1.22 N[C@@H](CF)C1=CC=C(F)C=C1 N14614 [1,1,0,0,0,0|2,0,0]=4 331 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 N11131 [1,1,0,0,0,0|2,0,0]=4 332 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 F16864 [1,1,0,0,0,0|2,0,0]=4 333 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 F16884 [1,1,0,0,0,0|2,0,0]=4 334 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 N10530 [1,1,0,0,0,0|2,0,0]=4 335 B11R1.22 OC[C@H](O)C1=CC=C(Cl)C=C1 FD1217 [1,1,0,0,0,0|2,0,0]=4 336 B11R1.22 O[C@@H](CCl)C1=CC=C(Br)C=C1 58431 [1,1,0,0,0,0|2,0,0]=4 337 B11R1.37 COC1=CC=C(C)N=C1OC D75013 [1,1,0,0,0,0|2,0,0]=4 338 B11R1.37 COC1=NC(C)=CC=C1CO W17835 [1,1,0,0,0,0|2,0,0]=4 339 B11R1.37 OCC1=C(CO)C=C(Cl)C=C1 Y11494 [1,1,0,0,0,0|2,0,0]=4 340 B11R1.37 OCC1=C(CO)C=C(F)C=C1 AB10273 [1,1,0,0,0,0|2,0,0]=4 341 B11R1.81 CCCC1=C(O)C=C(C)C=C1 A10895 [1,1,0,0,0,0|0,0,0]=2 342 B11R1.81 CCNC1=C(N)C=C(Br)C=C1 89427 [1,1,0,0,0,0|2,0,0]=4 343 B11R1.81 CCOC1=C(Br)C=C(C)C=N1 93939 [1,1,0,0,0,0|2,0,0]=4 344 B11R1.81 CCOC1=C(Br)C=C(N)C=C1 N12647 [1,1,0,0,0,0|2,0,0]=4 345 B11R1.81 CCOC1=C(C)C=C(N)C=C1 N12561 [1,1,0,0,0,0|2,0,0]=4 346 B11R1.81 CNCC1=C(Cl)C=C(F)C=C1 76695 [1,1,0,0,0,0|2,0,0]=4 347 B11R1.81 CNCC1=C(F)C=C(F)C=C1 36787 [1,1,0,0,0,0|2,0,0]=4 348 B11R1.81 COCC1=C(Cl)C=C(Br)C=C1 N11614 [1,1,0,0,0,0|2,0,0]=4 349 B11R1.81 NCCC1=C(Br)C=C(Br)C=C1 P18612 [1,1,0,0,0,0|2,0,0]=4 350 B11R1.81 NCCC1=C(Br)C=C(Cl)C=C1 AC3186 [1,1,0,0,0,0|2,0,0]=4 351 B11R1.81 NCCC1=C(Br)C=C(F)C=C1 AC7044 [1,1,0,0,0,0|2,0,0]=4 352 B11R1.81 NCCC1=C(F)C=C(Br)C=C1 50240 [1,1,0,0,0,0|2,0,0]=4 353 B11R1.81 NCCC1=C(F)C=C(O)C=C1 F51014 [1,1,0,0,0,0|2,0,0]=4 354 B11R1.81 OCCC1=C(Br)C=C(Cl)C=C1 D85895 [1,1,0,0,0,0|2,0,0]=4 355 B11R1.81 OCCC1=C(F)C=C(F)C=C1 A50720 [1,1,0,0,0,0|2,0,0]=4 356 B11R1.277 CC1=C(Br)C=C(C=O)C(O)=C1 W17313 [1,1,0,0,0,0|1,0,1]=4 357 B11R1.277 CC1=CC(F)=C(CCl)C=C1F 57258 [1,1,0,0,0,0|2,0,0]=4 358 B11R1.277 CC1=CC(F)=C(CO)C=C1F 57256 [1,1,0,0,0,0|2,0,0]=4 359 B11R1.277 CCC1=CC(N)=C(C)C=C1C C14445 [1,1,0,0,0,0|1,0,0]=3 360 B11R1.277 COC1=CC(F)=C(F)C=C1O F14425 [1,1,0,0,0,0|2,0,0]=4 361 B11R1.277 COC1=CC(I)=C(C)C=C1Cl F14415 [1,1,0,0,0,0|2,0,0]=4 362 B11R1.278 CC1=C(C)C(N)=C(CO)C=C1 AC4860 [1,1,0,0,0,0|2,0,0]=4 363 B11R1.278 CC1=CC=C(CO)C(F)=C1I 55477 [1,1,0,0,0,0|2,0,0]=4 364 B11R1.279 CCC1=C(O)C=C(OC)C=C1 75531 [1,1,0,0,0,0|0,0,0]=2 365 B11R1.279 CCC1=CC(Br)=C(OC)C=C1 AT26698 [1,1,0,0,0,0|2,0,0]=4 366 B11R1.279 COC1=C(Br)C=C(CN)C=C1 AC5724 [1,1,0,0,0,0|2,0,0]=4 367 B11R1.279 COC1=C(C)C=C(CCl)C=C1 F14712 [1,1,0,0,0,0|2,0,0]=4 368 B11R1.279 COC1=CC(O)=C(CO)C=C1 AC7760 [1,1,0,0,0,0|1,0,0]=3 369 B11R1.279 CSC1=C(C)C=C(CN)C=C1 AT20988 [1,1,0,0,0,0|2,0,0]=4 370 B11R1.464 CC1=CC(O)=C(CN)C(C)=C1 D87611 [1,1,0,0,0,0|1,0,0]=3 371 B11R1.464 COC1=C(O)C=C(Br)C=C1C AT22245 [1,1,0,0,0,0|2,0,0]=4 372 B11R1.53 CC(C)C1=C(CCl)C=CC=C1 E72192 [1,1,0,0,0,0|1,0,0]=3 373 B11R1.53 COC1=C([C@H](C)N)C=NC=C1 Y12493 [1,1,0,0,0,0|2,0,0]=4 374 B11R1.53 COC1=C([C@H](C)N)N=CC=C1 90521 [1,1,0,0,0,0|2,0,0]=4 375 B11R1.53 C[C@H](N)C1=C(C#N)C=CC=C1 Y12983 [1,1,0,0,0,0|2,0,0]=4 376 B11R1.53 C[C@H](N)C1=C(CO)C=CC=C1 Y13010 [1,1,0,0,0,0|1,0,0]=3 377 B11R1.53 C[C@H](O)C1=C(C#N)C=CC=C1 C73535 [1,1,0,0,0,0|2,0,0]=4 378 B11R1.53 OCC1=C(C(F)F)C=CC=C1 AT10623 [1,1,0,0,0,0|2,0,0]=4 379 B11R1.87 CC(C)(C)C1=C(O)C=CC=N1 W16228 [1,1,0,0,0,0|1,0,0]=3 380 B11R1.87 CC(C)(N)C1=C(F)C=CC=C1 C78437 [1,1,0,0,0,0|1,0,0]=3 381 B11R1.87 CC(C)(N)C1=C(F)C=NC=C1 D81239 [1,1,0,0,0,0|2,0,0]=4 382 B11R1.87 CC(C)(O)C1=C(Br)C=CC=N1 N10027 [1,1,0,0,0,0|2,0,0]=4 383 B11R1.87 CC(C)(O)C1=C(Cl)C=NC=C1 N12769 [1,1,0,0,0,0|2,0,0]=4 384 B11R1.87 CC(C)(O)C1=CC=CN=C1F VT1237 [1,1,0,0,0,0|2,0,0]=4 385 B11R1.87 CC(F)(F)C1=C(N)C=CC=C1 AT20037 [1,1,0,0,0,0|2,0,0]=4 386 B11R1.156 CC1=CC=CC(C)=C1[C@H](C)N AT12995 [1,1,0,0,0,0|2,0,0]=4 387 B11R1.156 C[C@H](N)C1=C(Br)C=CC=C1F C91102 [1,1,0,0,0,0|2,0,0]=4 388 B11R1.156 C[C@H](O)C1=C(F)C=CC=C1F AT11387 [1,1,0,0,0,0|2,0,0]=4 389 B11R1.156 C[C@H](O)C1=C(F)C=CC=C1F AT11388 [1,1,0,0,0,0|2,0,0]=4 390 B11R1.159 CC(C)C1=CC=CC(Br)=C1O C91212 [1,1,0,0,0,0|0,0,0]=2 391 B11R1.159 CC(C)C1=CC=CC(N)=C1N D85847 [1,1,0,0,0,0|1,0,0]=3 392 B11R1.159 CC(C)N1C=CC=C(N)C1=O AT19244 [1,1,0,0,0,0|1,0,1]=4 393 B11R1.159 CC1=CC=CC([C@H](C)N)=C1C N12727 [1,1,0,0,0,0|2,0,0]=4 394 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1Cl Y11085 [1,1,0,0,0,0|2,0,0]=4 395 B11R1.167 CC(C)C1=C(Br)C=CC(O)=C1 57997 [1,1,0,0,0,0|1,0,0]=3 396 B11R1.167 CC(C)C1=C(N)C=CC(Br)=C1 N12218 [1,1,0,0,0,0|1,0,0]=3 397 B11R1.167 CC(C)C1=C(O)C=CC(N)=C1 F31161 [1,1,0,0,0,0|0,0,0]=2 398 B11R1.167 CC(C)C1=CC(O)=NN=C1O P20475 [1,1,0,0,0,0|2,0,0]=4 399 B11R1.167 CC1=CC(C(C)C)=C(O)C=C1 30812 [1,1,0,0,0,0|0,0,0]=2 400 B11R1.167 CC1=CC([C@H](C)N)=C(C)C=C1 N12153 [1,1,0,0,0,0|2,0,0]=4 401 B11R1.167 C[C@H](N)C1=C(Br)C=CC(F)=C1 C91100 [1,1,0,0,0,0|2,0,0]=4 402 B11R1.167 C[C@H](N)C1=C(Br)C=CC(F)=C1 C91101 [1,1,0,0,0,0|2,0,0]=4 403 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(Cl)=C1 N13035 [1,1,0,0,0,0|2,0,0]=4 404 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(Cl)=C1 N13127 [1,1,0,0,0,0|2,0,0]=4 405 B11R1.167 C[C@H](N)C1=C(F)C=CC(Br)=C1 AT24141 [1,1,0,0,0,0|2,0,0]=4 406 B11R1.167 C[C@H](N)C1=C(F)C=CC(Br)=C1 D85891 [1,1,0,0,0,0|2,0,0]=4 407 B11R1.167 C[C@H](N)C1=C(O)C=CC(F)=C1 D81270 [1,1,0,0,0,0|1,0,0]=3 408 B11R1.167 C[C@H](O)C1=C(F)C=CC(F)=C1 AT11385 [1,1,0,0,0,0|2,0,0]=4 409 B11R1.167 C[C@H](O)C1=C(F)C=CC(F)=C1 AT11386 [1,1,0,0,0,0|2,0,0]=4 410 B11R1.222 C#C[C@@H](O)C1=C(O)C=CC=C1 AC5065 [1,1,0,0,0,0|1,0,1]=4 411 B11R1.222 C=C[C@H](N)C1=C(O)C=CC=C1 N15292 [1,1,0,0,0,0|1,0,1]=4 412 B11R1.222 C=C[C@H](N)C1=C(O)C=CC=C1 N15293 [1,1,0,0,0,0|1,0,1]=4 413 B11R1.222 C=C[C@H](N)C1=C(O)C=CC=C1 N15294 [1,1,0,0,0,0|1,0,1]=4 414 B11R1.222 CC1=C([C@@H](N)CF)C=CC=C1 N14610 [1,1,0,0,0,0|2,0,0]=4 415 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13426 [1,1,0,0,0,0|2,0,0]=4 416 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13427 [1,1,0,0,0,0|2,0,0]=4 417 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13428 [1,1,0,0,0,0|2,0,0]=4 418 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13449 [1,1,0,0,0,0|2,0,0]=4 419 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13450 [1,1,0,0,0,0|2,0,0]=4 420 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13451 [1,1,0,0,0,0|2,0,0]=4 421 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 N15069 [1,1,0,0,0,0|2,0,0]=4 422 B11R1.222 CC[C@H](C)C1=C(N)C=CC=C1 35361 [1,1,0,0,0,0|1,0,0]=3 423 B11R1.222 CC[C@H](N)C1=C(Br)C=CC=C1 N13015 [1,1,0,0,0,0|2,0,0]=4 424 B11R1.222 CC[C@H](O)C1=C(Br)C=CC=C1 N12628 [1,1,0,0,0,0|2,0,0]=4 425 B11R1.222 CC[C@H](O)C1=C(C)C=CC=C1 N14414 [1,1,0,0,0,0|2,0,0]=4 426 B11R1.222 CC[C@H](O)C1=C(Cl)C=CC=C1 N14413 [1,1,0,0,0,0|2,0,0]=4 427 B11R1.222 CN[C@@H](C)C1=C(Br)C=CC=C1 N12718 [1,1,0,0,0,0|1,0,0]=3 428 B11R1.222 CN[C@@H](C)C1=C(C)C=CC=C1 N12531 [1,1,0,0,0,0|1,0,0]=3 429 B11R1.222 CN[C@@H](C)C1=C(O)C=CC=C1 N12719 [1,1,0,0,0,0|0,0,0]=2 430 B11R1.222 C\C(=N\O)C1=C(O)C=CC=C1 W12757 [1,1,0,0,0,0|1,0,1]=4 431 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13418 [1,1,0,0,0,0|2,0,0]=4 432 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13419 [1,1,0,0,0,0|2,0,0]=4 433 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13441 [1,1,0,0,0,0|2,0,0]=4 434 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13442 [1,1,0,0,0,0|2,0,0]=4 435 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13403 [1,1,0,0,0,0|2,0,0]=4 436 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13409 [1,1,0,0,0,0|2,0,0]=4 437 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13410 [1,1,0,0,0,0|2,0,0]=4 438 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13390 [1,1,0,0,0,0|2,0,0]=4 439 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13391 [1,1,0,0,0,0|2,0,0]=4 440 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13392 [1,1,0,0,0,0|2,0,0]=4 441 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13393 [1,1,0,0,0,0|2,0,0]=4 442 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13394 [1,1,0,0,0,0|2,0,0]=4 443 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13395 [1,1,0,0,0,0|2,0,0]=4 444 B11R1.222 NC[C@H](O)C1=C(Br)C=CC=C1 71742 [1,1,0,0,0,0|2,0,0]=4 445 B11R1.222 NC[C@H](O)C1=C(F)C=CC=C1 C78140 [1,1,0,0,0,0|2,0,0]=4 446 B11R1.222 NC[C@H](O)C1=C(I)C=CC=C1 O10641 [1,1,0,0,0,0|2,0,0]=4 447 B11R1.222 N[C@@H](CF)C1=C(F)C=CC=C1 N14609 [1,1,0,0,0,0|2,0,0]=4 448 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 C77783 [1,1,0,0,0,0|2,0,0]=4 449 B11R1.222 N[C@@H](CO)C1=C(O)C=CC=C1 N15244 [1,1,0,0,0,0|1,0,0]=3 450 B11R1.222 N[C@@H](CO)C1=C(O)C=CC=C1 N15255 [1,1,0,0,0,0|1,0,0]=3 451 B11R1.222 N[C@@H](CO)C1=C(O)C=CC=N1 N14918 [1,1,0,0,0,0|2,0,0]=4 452 B13R1.51 CC1=CC(CO)=C(OC(F)F)C=C1 93777 [0,1,0,0,0,1|2,0,0]=4 453 B13R1.163 CC(C)C(=O)C1=C(Cl)C=C(Cl)C=C1 N14079 [0,1,0,0,0,1|2,0,0]=4 454 B13R1.163 CC(C)C(=O)C1=C(F)C=C(Cl)C=C1 N12999 [0,1,0,0,0,1|2,0,0]=4 455 B13R1.163 CC(C)C(=O)C1=C(F)C=C(F)C=C1 N12697 [0,1,0,0,0,1|2,0,0]=4 456 B13R1.163 CC(C)C(=O)C1=C(F)C=C(O)C=C1 75540 [0,1,0,0,0,1|2,0,0]=4 457 B13R1.163 CC(C)[C@H](N)C1=C(F)C=C(F)C=C1 N12906 [0,1,0,0,0,1|2,0,0]=4 458 B13R1.163 CC(C)[C@H](O)C1=C(F)C=C(Br)C=C1 AC3834 [0,1,0,0,0,1|2,0,0]=4 459 B13R1.163 CC(O)C(N)C1=C(O)C=C(F)C=C1 N16335 [0,1,0,0,0,1|2,0,0]=4 460 B13R1.163 CC(O)[C@H](N)C1=C(O)C=C(F)C=C1 N16334 [0,1,0,0,0,1|2,0,0]=4 461 B13R1.163 CC1=C(C(=O)C(C)C)C=CC(O)=C1 91445 [0,1,0,0,0,1|2,0,0]=4 462 B13R1.163 CC1=CC(C)=C(C(=O)C(C)C)C=C1 N14103 [0,1,0,0,0,1|1,0,0]=3 463 B13R1.163 CC1=CC(C)=C(C(N)C(C)O)C=C1 N16003 [0,1,0,0,0,1|2,0,0]=4 464 B13R1.163 CC1=CC(C)=C([C@@H](N)C(C)O)C=C1 N16002 [0,1,0,0,0,1|2,0,0]=4 465 B13R1.163 CC1=CC(C)=C([C@@H](N)[C@@H](C)O)C=C1 N15999 [0,1,0,0,0,1|2,0,0]=4 466 B13R1.163 CC1=CC(C)=C([C@@H](N)[C@@H](C)O)C=C1 N16001 [0,1,0,0,0,1|2,0,0]=4 467 B13R1.163 CC1=CC(C)=C([C@@H](N)[C@H](C)O)C=C1 N16000 [0,1,0,0,0,1|2,0,0]=4 468 B13R1.163 CC1=CC(F)=C(C(N)C(C)O)C=C1 N16266 [0,1,0,0,0,1|2,0,0]=4 469 B13R1.163 CC1=CC(F)=C([C@@H](N)C(C)O)C=C1 N16267 [0,1,0,0,0,1|2,0,0]=4 470 B13R1.163 CC1=CC(F)=C([C@@H](N)[C@@H](C)O)C=C1 N16268 [0,1,0,0,0,1|2,0,0]=4 471 B13R1.163 CC1=CC(F)=C([C@@H](N)[C@@H](C)O)C=C1 N16270 [0,1,0,0,0,1|2,0,0]=4 472 B13R1.163 CC1=CC(F)=C([C@@H](N)[C@H](C)O)C=C1 N16269 [0,1,0,0,0,1|2,0,0]=4 473 B13R1.163 C[C@@H](O)[C@H](N)C1=C(O)C=C(F)C=C1 N16330 [0,1,0,0,0,1|2,0,0]=4 474 B13R1.163 C[C@@H](O)[C@H](N)C1=C(O)C=C(F)C=C1 N16332 [0,1,0,0,0,1|2,0,0]=4 475 B13R1.163 C[C@H](O)[C@H](N)C1=C(O)C=C(F)C=C1 N16333 [0,1,0,0,0,1|2,0,0]=4 476 B13R1.653 CC(C)OC1=C(Br)C=C(C=O)C=C1 57742 [0,1,0,0,0,1|1,0,1]=4 477 B13R1.653 CC(C)OC1=C(Cl)C=C(CO)C=C1 N12654 [0,1,0,0,0,1|1,0,0]=3 478 B13R1.99 COC1=CC(OC)=C([C@H](C)N)C=C1 N13101 [0,2,0,0,0,0|1,0,0]=3 479 B13R1.99 COC1=CC=C([C@H](C)O)C(OC)=N1 D75063 [0,2,0,0,0,0|2,0,0]=4 480 B13R1.165 CN(C)C1=C(C(=O)O)C=C(N)C=C1 34913 [0,2,0,0,0,0|2,0,0]=4 481 B13R1.96 CC(C)(C)C1=C(O)C=C(C#N)C=C1 58362 [0,2,0,0,0,0|0,0,1]=3 482 B13R1.96 COC1=CC(O)=C(C(F)(F)F)C=C1 F10540 [0,2,0,0,0,0|2,0,0]=4 483 B13R1.877 CC(C)(C)C1=CC(Br)=C(Cl)C=C1O 58367 [0,2,0,0,0,0|1,0,0]=3 484 B13R1.877 CC(C)(C)C1=CC(Br)=C(F)C=C1O 58369 [0,2,0,0,0,0|1,0,0]=3 485 B13R1.877 CC(C)(C)C1=CC(Br)=C(N)C=C1O C91651 [0,2,0,0,0,0|1,0,0]=3 486 B13R1.877 CC(C)(C)C1=CC(Cl)=C(Br)C=C1O 58365 [0,2,0,0,0,0|1,0,0]=3 487 B13R1.877 CC(C)(C)C1=CC(Cl)=C(F)C=C1O 58339 [0,2,0,0,0,0|1,0,0]=3 488 B13R1.877 CC(C)(C)C1=CC(Cl)=C(N)C=C1O C91649 [0,2,0,0,0,0|1,0,0]=3 489 B13R1.877 CC(C)(C)C1=CC(Cl)=C(O)C=C1N C93164 [0,2,0,0,0,0|2,0,0]=4 490 B13R1.877 CC1=C(Br)C=C(O)C(C(C)(C)C)=C1 58340 [0,2,0,0,0,0|1,0,0]=3 491 B13R1.651 CC1=C(N=O)C=C(C(C)C)C(O)=C1 33989 [0,2,0,0,0,0|0,0,0]=2 492 B13R1.651 CC1=CC(=O)C(C(C)C)=C\C1=N/O C15085 [0,2,0,0,0,0|0,0,1]=3 493 B13R1.652 COC1=C(I)C=C(C(C)C)C(F)=C1 66348 [0,2,0,0,0,0|1,0,0]=3 494 B13R1.1807 COC(=O)C1=CC(Cl)=C(C)C=C1O AT11635 [0,2,0,0,0,0|1,0,1]=4 495 B13R1.1807 COC(=O)C1=CC(I)=C(C)C=C1O AT20704 [0,2,0,0,0,0|1,0,1]=4 496 B13R1.95 COC1=CC(C)=C([C@@H](N)CN)C=C1 N13756 [0,2,0,0,0,0|2,0,0]=4 497 B13R1.95 COC1=CC(C)=C([C@@H](N)CN)C=C1 N13757 [0,2,0,0,0,0|2,0,0]=4 498 B13R1.95 COC1=CC(C)=C([C@@H](N)CN)C=C1 N13758 [0,2,0,0,0,0|2,0,0]=4 499 B13R1.95 COC1=CC(C)=C([C@@H](N)CN)C=C1 N13763 [0,2,0,0,0,0|2,0,0]=4 500 B13R1.95 COC1=CC(C)=C([C@@H](N)CN)C=C1 N13764 [0,2,0,0,0,0|2,0,0]=4 501 B13R1.95 COC1=CC(Cl)=C([C@@H](N)CN)C=C1 N13634 [0,2,0,0,0,0|2,0,0]=4 502 B13R1.95 COC1=CC(Cl)=C([C@@H](N)CN)C=C1 N13635 [0,2,0,0,0,0|2,0,0]=4 503 B13R1.95 COC1=CC(Cl)=C([C@@H](N)CN)C=C1 N13636 [0,2,0,0,0,0|2,0,0]=4 504 B13R1.95 COC1=CC(F)=C([C@@H](N)CN)C=C1 N13560 [0,2,0,0,0,0|2,0,0]=4 505 B13R1.95 COC1=CC(F)=C([C@@H](N)CN)C=C1 N13561 [0,2,0,0,0,0|2,0,0]=4 506 B13R1.95 COC1=CC(F)=C([C@@H](N)CN)C=C1 N13562 [0,2,0,0,0,0|2,0,0]=4 507 B13R1.120 CN(C)C1=C(Br)C=C(C(F)F)C=C1 N11503 [0,2,0,0,0,0|2,0,0]=4 508 B13R1.385 CN(C)C1=C(F)C=C(CCN)C=C1 78921 [0,2,0,0,0,0|2,0,0]=4 509 B13R1.428 COC1=CC(F)=C([C@H](C)O)C(F)=C1 90967 [0,2,0,0,0,0|2,0,0]=4 510 B13R1.4656 CC1=CC(C)=C([C@@H](N)CN)C(C)=C1 N13821 [0,2,0,0,0,0|2,0,0]=4 511 B13R1.4656 CC1=CC(C)=C([C@@H](N)CN)C(C)=C1 N13822 [0,2,0,0,0,0|2,0,0]=4 512 B13R1.4656 CC1=CC(C)=C([C@@H](N)CN)C(C)=C1 N13823 [0,2,0,0,0,0|2,0,0]=4 513 B13R1.4656 CC1=CC(C)=C([C@@H](N)CN)C(C)=C1 N13824 [0,2,0,0,0,0|2,0,0]=4 514 B13R1.4656 CC1=CC(C)=C([C@@H](N)CN)C(C)=C1 N13825 [0,2,0,0,0,0|2,0,0]=4 515 B13R1.961 CN[C@@H](CO)C1=C(Cl)C=C(Br)C=C1 Y12538 [0,2,0,0,0,0|2,0,0]=4 516 B13R1.961 CN[C@@H](CO)C1=C(Cl)C=C(Br)C=C1 Y13046 [0,2,0,0,0,0|2,0,0]=4 517 B13R1.961 CN[C@@H](CO)C1=C(Cl)C=C(C)C=C1 Y12539 [0,2,0,0,0,0|1,0,0]=3 518 B13R1.961 CN[C@@H](CO)C1=C(Cl)C=C(C)C=C1 Y13304 [0,2,0,0,0,0|1,0,0]=3 519 B13R1.961 CN[C@@H](CO)C1=C(Cl)C=C(O)C=C1 Y12200 [0,2,0,0,0,0|2,0,0]=4 520 B13R1.961 CN[C@@H](CO)C1=C(Cl)C=C(O)C=C1 Y13041 [0,2,0,0,0,0|2,0,0]=4 521 B13R1.961 CN[C@@H](CO)C1=C(Cl)C=C(O)C=C1 Y13309 [0,2,0,0,0,0|2,0,0]=4 522 B13R1.1511 CC1=CC(Cl)=C([C@@H](N)CC#N)C=C1 N15070 [0,2,0,0,0,0|2,0,0]=4 523 B13R1.1511 CC1=CC(Cl)=C([C@@H](N)CC#N)C=C1 N15071 [0,2,0,0,0,0|2,0,0]=4 524 B13R1.1511 CC1=CC(Cl)=C([C@@H](N)CC#N)C=C1 N15072 [0,2,0,0,0,0|2,0,0]=4 525 B13R1.1511 CC1=CC(F)=C([C@@H](N)CC#N)C=C1 N14963 [0,2,0,0,0,0|2,0,0]=4 526 B13R1.1511 CC1=CC(F)=C([C@@H](N)CC#N)C=C1 N14964 [0,2,0,0,0,0|2,0,0]=4 527 B13R1.1511 CC1=CC(F)=C([C@@H](N)CC#N)C=C1 N14965 [0,2,0,0,0,0|2,0,0]=4 528 B13R1.1511 CCC[C@H](N)C1=C(C)C=C(C)C=C1 N11167 [0,2,0,0,0,0|2,0,0]=4 529 B11R2.34 CC1=CC=C(C2CC2)C=C1 AC9737 [1,0,0,1,0,0|0,0,0]=2 530 B11R2.34 ClC1=CC=C(C2CC2)C=C1 AC9567 [1,0,0,1,0,0|1,0,0]=3 531 B11R2.36 CC1=CC2=C(C=C1)CNC2 71833 [1,0,0,1,0,0|2,0,0]=4 532 B11R2.36 CC1=CC2=C(C=C1)CNC2 W10108 [1,0,0,1,0,0|2,0,0]=4 533 B11R2.36 FC1=CC2=C(C=C1)CCC2 36515 [1,0,0,1,0,0|2,0,0]=4 534 B11R2.36 IC1=CC2=C(C=C1)CCC2 C12643 [1,0,0,1,0,0|2,0,0]=4 535 B11R2.1 C[C@H]1CNC2=C1C=CC=C2 W18948 [1,0,0,1,0,0|1,0,0]=3 536 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 41003 [1,0,0,1,0,0|2,0,0]=4 537 B11R2.1 N[C@H]1COC2=C1C=CC=C2 I11926 [1,0,0,1,0,0|1,0,0]=3 538 B11R2.1 O[C@H]1COC2=C1C=CC=C2 AT19563 [1,0,0,1,0,0|1,0,0]=3 539 B11R2.55 BrC1=C(C2CC2)C=CN=C1 AT12865 [1,0,0,1,0,0|2,0,0]=4 540 B11R2.55 CC1=C(C2CC2)C=CC=C1 AC9736 [1,0,0,1,0,0|1,0,0]=3 541 B11R2.55 CC1=CC=CN=C1C2CC2 AC9685 [1,0,0,1,0,0|2,0,0]=4 542 B11R2.55 CC1=NC=CC=C1C2CC2 F13571 [1,0,0,1,0,0|2,0,0]=4 543 B11R2.55 ClC1=C([C@@H]2CO2)C=CC=C1 AT10463 [1,0,0,1,0,0|2,0,0]=4 544 B11R2.55 ClC1=C([C@@H]2CO2)C=CC=C1 CK2535 [1,0,0,1,0,0|2,0,0]=4 545 B11R2.55 NC1=C(C2CC2)C=CC=C1 A10978 [1,0,0,1,0,0|1,0,0]=3 546 B11R2.55 NC1=C(C2CC2)C=CN=C1 AT16333 [1,0,0,1,0,0|2,0,0]=4 547 B11R2.55 OC1=C(C2CC2)C=CC=C1 91444 [1,0,0,1,0,0|0,0,0]=2 548 B13R2.3051 CC1(C)CC2=C(C=C(Br)C=C2)C1 F53402 [0,0,0,1,0,1|2,0,0]=4 549 B13R2.3051 CC1(C)CC2=C(C=C(Cl)C=C2)O1 96490 [0,0,0,1,0,1|1,0,0]=3 550 B13R2.3051 CC1(C)CC2=C(C=C(F)C=C2)O1 96488 [0,0,0,1,0,1|1,0,0]=3 551 B13R2.3683 CC1=CC2=C(C=C1)NC(=O)CO2 AC6060 [0,0,0,1,0,1|1,0,1]=4 552 B13R2.3683 C[C@H]1CCC2=C(C=CC(F)=C2)N1 51483 [0,0,0,1,0,1|2,0,0]=4 553 B13R2.3683 C[C@H]1CCC2=C(C=CC(F)=C2)N1 51485 [0,0,0,1,0,1|2,0,0]=4 554 B13R2.3683 C[C@H]1CNC2=C(C=CC(Cl)=C2)O1 77474 [0,0,0,1,0,1|2,0,0]=4 555 B13R2.5400 NC1=C(NC2CC2)C=CC(Br)=C1 AT16679 [0,0,0,1,0,1|2,0,0]=4 556 B13R2.5400 NC1=CC(F)=C(OC2CC2)C=C1 AT11985 [0,0,0,1,0,1|2,0,0]=4 557 B13R2.2082 COC1=C(C2CC2)C=CC(Cl)=C1 AC9035 [0,1,0,1,0,0|1,0,0]=3 558 B13R2.3108 CC1(C)CNC2=C1C=CC(F)=C2 85439 [0,1,0,1,0,0|2,0,0]=4 559 B13R2.3108 CC1(C)COC2=C1C=CC(N)=C2 F12398 [0,1,0,1,0,0|1,0,0]=3 560 B13R2.5179 CC1=CC2=C(C=C1)[C@@H](O)CCO2 N14459 [0,1,0,1,0,0|1,0,0]=3 561 B13R2.5179 C[C@@H]1NCCC2=C1C=CC(F)=C2 AT19619 [0,1,0,1,0,0|2,0,0]=4 562 B13R2.5179 C[C@@H]1NCCC2=C1C=CC(F)=C2 AT19620 [0,1,0,1,0,0|2,0,0]=4 563 B13R2.5179 N[C@H]1CCOC2=C1C=CC(Cl)=C2 N13012 [0,1,0,1,0,0|2,0,0]=4 564 B13R2.5179 N[C@H]1CCOC2=C1C=CC(F)=C2 I11337 [0,1,0,1,0,0|2,0,0]=4 565 B13R2.5179 N[C@H]1CCOC2=C1C=CC(F)=C2 N13088 [0,1,0,1,0,0|2,0,0]=4 566 B13R2.5179 N[C@H]1COCC2=C1C=CC(Cl)=C2 D79931 [0,1,0,1,0,0|2,0,0]=4 567 B13R2.5179 N[C@H]1COCC2=C1C=CC(Cl)=C2 D79932 [0,1,0,1,0,0|2,0,0]=4 568 B13R2.5179 O[C@H]1CCOC2=C1C=CC(F)=C2 N14454 [0,1,0,1,0,0|2,0,0]=4 569 B13R2.3125 CC1(C2=C(N)C=C(Br)C=C2)CC1 F53401 [0,1,0,1,0,0|2,0,0]=4 570 B13R2.3125 NC1(C2=C(Cl)C=C(Cl)C=C2)CC1 C78512 [0,1,0,1,0,0|2,0,0]=4 571 B13R2.3125 OC1(C2=C(F)C=C(Br)C=C2)CC1 F12141 [0,1,0,1,0,0|2,0,0]=4 572 B13R2.5391 CC1=C(Cl)C=C(C2CC2)C(O)=C1 58350 [0,1,0,1,0,0|0,0,0]=2 573 B13R2.5391 NC1=C(Cl)C=C(C2CC2)C(O)=C1 58356 [0,1,0,1,0,0|1,0,0]=3 574 B13R2.11634 CC1=C(Br)C=C2C(=C1)CC[C@@H]2N Y12694 [0,1,0,1,0,0|2,0,0]=4 575 B13R2.11634 CC1=C(Br)C=C2C(=C1)CC[C@@H]2N Y12695 [0,1,0,1,0,0|2,0,0]=4 576 B13R2.11634 CC1=C(Br)C=C2C(=C1)CC[C@@H]2N Y12807 [0,1,0,1,0,0|2,0,0]=4 577 B13R2.11634 N[C@H]1COC2=CC(Br)=C(F)C=C21 N16615 [0,1,0,1,0,0|2,0,0]=4 578 B13R2.11634 N[C@H]1COC2=CC(Br)=C(F)C=C21 N16616 [0,1,0,1,0,0|2,0,0]=4 579 B13R2.11634 N[C@H]1COC2=CC(Br)=C(F)C=C21 N16617 [0,1,0,1,0,0|2,0,0]=4 580 B13R2.11634 N[C@H]1COC2=CC(Cl)=C(F)C=C21 N16636 [0,1,0,1,0,0|2,0,0]=4 581 B13R2.11634 N[C@H]1COC2=CC(Cl)=C(F)C=C21 N16637 [0,1,0,1,0,0|2,0,0]=4 582 B13R2.11634 N[C@H]1COC2=CC(Cl)=C(F)C=C21 N16638 [0,1,0,1,0,0|2,0,0]=4 583 B13R2.11634 N[C@H]1COC2=CC(F)=C(Br)C=C21 N16612 [0,1,0,1,0,0|2,0,0]=4 584 B13R2.11634 N[C@H]1COC2=CC(F)=C(Br)C=C21 N16613 [0,1,0,1,0,0|2,0,0]=4 585 B13R2.11634 N[C@H]1COC2=CC(F)=C(Br)C=C21 N16614 [0,1,0,1,0,0|2,0,0]=4 586 B13R2.11634 N[C@H]1COC2=CC(F)=C(Cl)C=C21 N16639 [0,1,0,1,0,0|2,0,0]=4 587 B13R2.11634 N[C@H]1COC2=CC(F)=C(Cl)C=C21 N16640 [0,1,0,1,0,0|2,0,0]=4 588 B13R2.11634 N[C@H]1COC2=CC(F)=C(Cl)C=C21 N16641 [0,1,0,1,0,0|2,0,0]=4 589 B13R2.11634 N[C@H]1COC2=CC(F)=C(F)C=C21 N11350 [0,1,0,1,0,0|2,0,0]=4 590 B13R2.11634 N[C@H]1COC2=CC(F)=C(F)C=C21 N16642 [0,1,0,1,0,0|2,0,0]=4 591 B13R2.11634 N[C@H]1COC2=CC(F)=C(F)C=C21 N16643 [0,1,0,1,0,0|2,0,0]=4 592 B13R2.2130 CCC1=CC2=C(C=C1)[C@@H](N)CO2 N16573 [0,1,0,1,0,0|1,0,0]=3 593 B13R2.2130 CCC1=CC2=C(C=C1)[C@@H](N)CO2 N16574 [0,1,0,1,0,0|1,0,0]=3 594 B13R2.2130 CCC1=CC2=C(C=C1)[C@@H](N)CO2 N16575 [0,1,0,1,0,0|1,0,0]=3 595 B13R2.2130 COC1=CC2=C(C=C1)[C@@H](N)CC2 N10955 [0,1,0,1,0,0|2,0,0]=4 596 B13R2.2130 COC1=CC2=C(C=C1)[C@@H](N)CC2 N11042 [0,1,0,1,0,0|2,0,0]=4 597 B13R2.2130 COC1=CC2=C(C=C1)[C@@H](N)CO2 89000 [0,1,0,1,0,0|1,0,0]=3 598 B13R2.2130 COC1=CC2=C(C=C1)[C@@H](N)CO2 N10004 [0,1,0,1,0,0|1,0,0]=3 599 B13R2.2130 COC1=CC2=C(C=C1)[C@@H](N)CO2 N10960 [0,1,0,1,0,0|1,0,0]=3 600 B13R2.2130 COC1=CC2=C(C=C1)[C@@H](N)CO2 N10961 [0,1,0,1,0,0|1,0,0]=3 601 B13R2.2130 COC1=CC2=C(C=C1)[C@@H](O)CC2 N14435 [0,1,0,1,0,0|2,0,0]=4 602 B13R2.2130 CSC1=CC2=C(C=C1)[C@@H](N)CO2 N16543 [0,1,0,1,0,0|1,0,0]=3 603 B13R2.2130 CSC1=CC2=C(C=C1)[C@@H](N)CO2 N16545 [0,1,0,1,0,0|1,0,0]=3 604 B13R2.2130 CSC1=CC2=C(C=C1)[C@@H](N)CO2 N16546 [0,1,0,1,0,0|1,0,0]=3 605 B13R2.2170 COC1=CC(N)=C(C2CC2)C=C1 AC9666 [0,1,0,1,0,0|1,0,0]=3 606 B13R2.5180 CC1=CC=C2C(=C1C)OC[C@@H]2N N16658 [0,1,0,1,0,0|1,0,0]=3 607 B13R2.5180 CC1=CC=C2C(=C1C)OC[C@@H]2N N16659 [0,1,0,1,0,0|1,0,0]=3 608 B13R2.5180 CC1=CC=C2C(=C1C)OC[C@@H]2N N16660 [0,1,0,1,0,0|1,0,0]=3 609 B13R2.5180 N[C@H]1COC2=C1C=CC(Cl)=C2Cl N11200 [0,1,0,1,0,0|2,0,0]=4 610 B13R2.5180 N[C@H]1COC2=C1C=CC(Cl)=C2Cl N11244 [0,1,0,1,0,0|2,0,0]=4 611 B13R2.5180 N[C@H]1COC2=C1C=CC(Cl)=C2Cl N11254 [0,1,0,1,0,0|2,0,0]=4 612 B13R2.5180 N[C@H]1COC2=C1C=CC(Cl)=C2F N16627 [0,1,0,1,0,0|2,0,0]=4 613 B13R2.5180 N[C@H]1COC2=C1C=CC(Cl)=C2F N16628 [0,1,0,1,0,0|2,0,0]=4 614 B13R2.5180 N[C@H]1COC2=C1C=CC(Cl)=C2F N16629 [0,1,0,1,0,0|2,0,0]=4 615 B13R2.5180 N[C@H]1COC2=C1C=CC(F)=C2Br N16597 [0,1,0,1,0,0|2,0,0]=4 616 B13R2.5180 N[C@H]1COC2=C1C=CC(F)=C2Br N16598 [0,1,0,1,0,0|2,0,0]=4 617 B13R2.5180 N[C@H]1COC2=C1C=CC(F)=C2Br N16599 [0,1,0,1,0,0|2,0,0]=4 618 B13R2.5180 N[C@H]1COC2=C1C=CC(F)=C2F N11322 [0,1,0,1,0,0|2,0,0]=4 619 B13R2.5180 N[C@H]1COC2=C1C=CC(F)=C2F N11323 [0,1,0,1,0,0|2,0,0]=4 620 B13R2.5180 N[C@H]1COC2=C1C=CC(F)=C2F N16648 [0,1,0,1,0,0|2,0,0]=4 621 B9R1.35 CC1=CC(C(C)C)=NN1 89085 [1,0,0,0,1,0|2,0,0]=4 622 B9R1.35 CC1=CC=C([C@H](C)N)O1 N12562 [1,0,0,0,1,0|2,0,0]=4 623 B9R1.35 CC1=CC=C([C@H](C)N)O1 Y12182 [1,0,0,0,1,0|2,0,0]=4 624 B9R1.41 CC(C)N1N=CC=C1O P20906 [1,0,0,0,1,0|2,0,0]=4 625 B11R1.20 CC1=CC=C(C[C@H](C)N)C=C1 N14354 [1,0,0,0,0,1|1,0,0]=3 626 B11R1.20 C[C@H](N)CC1=CC=C(Br)C=C1 Y11268 [1,0,0,0,0,1|2,0,0]=4 627 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 N10873 [1,0,0,0,0,1|2,0,0]=4 628 B11R1.20 C[C@H](N)CC1=CC=C(O)C=C1 85180 [1,0,0,0,0,1|2,0,0]=4 629 B11R1.86 CC(C)CC1=NC=CN=C1O 43967 [1,0,0,0,0,1|2,0,0]=4 630 B11R1.86 CC(C)NC1=C(Br)C=CC=C1 C77931 [1,0,0,0,0,1|1,0,0]=3 631 B11R1.86 CC(C)NC1=C(Cl)C=CC=C1 C78464 [1,0,0,0,0,1|1,0,0]=3 632 B11R1.86 CC(C)NC1=C(F)C=CC=C1 C77765 [1,0,0,0,0,1|1,0,0]=3 633 B11R1.86 CC(C)NC1=C(S)C=CC=C1 AC8476 [1,0,0,0,0,1|0,1,0]=3 634 B11R1.86 CC(C)OC1=C(I)C=CC=N1 76901 [1,0,0,0,0,1|2,0,0]=4 635 B11R1.86 CC(C)OC1=C(N)C=CN=C1 AT18128 [1,0,0,0,0,1|2,0,0]=4 636 B11R1.86 CC1=C(C[C@H](C)N)C=CC=C1 N10867 [1,0,0,0,0,1|2,0,0]=4 637 B11R1.86 C[C@H](N)CC1=C(Br)C=CC=C1 N11144 [1,0,0,0,0,1|2,0,0]=4 638 B11R1.86 C[C@H](N)CC1=C(Cl)C=CC=C1 N11063 [1,0,0,0,0,1|2,0,0]=4 639 B11R1.74 CC1=CC(C)=CC([C@H](C)N)=C1 N12241 [0,0,0,0,1,1|2,0,0]=4 640 B11R1.74 CC1=CC(Cl)=NC(C(C)C)=N1 A12537 [0,0,0,0,1,1|2,0,0]=4 641 B13R1.164 CC(C)NCC1=C(Cl)C=C(Cl)C=C1 N14374 [0,0,0,0,0,2|2,0,0]=4 642 B13R1.164 CC(C)NCC1=C(Cl)C=C(Cl)C=C1 N14375 [0,0,0,0,0,2|2,0,0]=4 643 B13R1.164 CC(C)OCC1=C(Br)C=C(F)C=C1 N10219 [0,0,0,0,0,2|2,0,0]=4