0 B9R1.6 C=C(C)C1=NC=CC=C1 W17791 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.6 CC(=O)C1=NN=CC=C1 37064 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.6 C[C@H](Cl)C1=NC=CC=C1 F13294 [0,0,0,0,0,0|2,0,1]=3 3 B9R1.6 C[C@H](N)C1=CC=CC=C1 D77753 [0,0,0,0,0,0|1,0,1]=2 4 B9R1.6 C[C@H](N)C1=CC=CN=C1 20316 [0,0,0,0,0,0|2,0,1]=3 5 B9R1.6 C[C@H](N)C1=CC=CN=C1 74003 [0,0,0,0,0,0|2,0,1]=3 6 B9R1.6 C[C@H](N)C1=CC=CN=C1 74005 [0,0,0,0,0,0|2,0,1]=3 7 B9R1.6 C[C@H](N)C1=CC=CN=C1 F31031 [0,0,0,0,0,0|2,0,1]=3 8 B9R1.6 C[C@H](N)C1=CC=CN=C1 F31032 [0,0,0,0,0,0|2,0,1]=3 9 B9R1.6 C[C@H](N)C1=CC=NC=C1 F31033 [0,0,0,0,0,0|2,0,1]=3 10 B9R1.6 C[C@H](N)C1=CC=NC=C1 N10538 [0,0,0,0,0,0|2,0,1]=3 11 B9R1.6 C[C@H](N)C1=CN=CN=C1 37059 [0,0,0,0,0,0|3,0,1]=4 12 B9R1.6 C[C@H](N)C1=CN=CN=C1 AT25773 [0,0,0,0,0,0|3,0,1]=4 13 B9R1.6 C[C@H](N)C1=CN=NC=C1 37052 [0,0,0,0,0,0|3,0,1]=4 14 B9R1.6 C[C@H](N)C1=NC=CC=N1 C90214 [0,0,0,0,0,0|3,0,1]=4 15 B9R1.6 C[C@H](N)C1=NC=CC=N1 C90215 [0,0,0,0,0,0|3,0,1]=4 16 B9R1.6 C[C@H](N)C1=NC=CC=N1 C90324 [0,0,0,0,0,0|3,0,1]=4 17 B9R1.6 C[C@H](N)C1=NC=CC=N1 S11170 [0,0,0,0,0,0|3,0,1]=4 18 B9R1.6 C[C@H](N)C1=NC=CN=C1 24931 [0,0,0,0,0,0|3,0,1]=4 19 B9R1.6 C[C@H](O)C1=NC=CC=C1 A11519 [0,0,0,0,0,0|1,0,2]=3 20 B9R1.6 C[C@H](O)C1=NC=CC=C1 C16040 [0,0,0,0,0,0|1,0,2]=3 21 B9R1.6 C[C@H](O)C1=NC=CC=N1 72303 [0,0,0,0,0,0|2,0,2]=4 22 B9R1.6 C[C@H](O)C1=NC=CC=N1 P19373 [0,0,0,0,0,0|2,0,2]=4 23 B9R1.6 C[C@H](O)C1=NC=CC=N1 P20178 [0,0,0,0,0,0|2,0,2]=4 24 B9R1.6 C[C@H](O)C1=NC=CN=C1 D82306 [0,0,0,0,0,0|2,0,2]=4 25 B9R1.6 C[S@](=O)C1=NC=CC=C1 C74099 [0,0,0,0,0,0|2,0,0]=2 26 B9R1.6 N=C(N)C1=NC=CC=C1 71518 [0,0,0,0,0,0|3,0,0]=3 27 B9R1.6 N=C(N)C1=NC=CC=N1 D74674 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.6 NC(=O)C1=CN=CN=C1 F13864 [0,0,0,0,0,0|3,0,0]=3 29 B9R1.6 NC(=O)C1=CN=NC=C1 F14288 [0,0,0,0,0,0|3,0,0]=3 30 B9R1.6 NC(=O)C1=NC=NC=C1 C74468 [0,0,0,0,0,0|3,0,0]=3 31 B9R1.6 NC(=O)C1=NN=CC=C1 F30255 [0,0,0,0,0,0|3,0,0]=3 32 B9R1.6 O=C(Cl)C1=NN=CC=C1 D93513 [0,0,0,0,0,0|3,0,0]=3 33 B9R1.6 O=C([O-])C1=NC=CC=N1 65419 [0,0,0,0,0,0|3,0,0]=3 34 B9R1.6 O=C([O-])C1=NN=CC=N1 67095 [0,0,0,0,0,0|4,0,0]=4 35 B9R1.6 O=[S@]([O-])C1=NC=CC=C1 AT11818 [0,0,0,0,0,0|3,0,0]=3 36 B8R1.2 CCC1=NC=NC=C1 F17281 [1,0,0,0,0,0|2,0,1]=4 37 B8R1.2 CNC1=CN=CN=C1 Y10181 [1,0,0,0,0,0|3,0,0]=4 38 B8R1.2 CNC1=CN=NC=C1 A10648 [1,0,0,0,0,0|3,0,0]=4 39 B8R1.2 CNC1=NC=NC=C1 W10133 [1,0,0,0,0,0|3,0,0]=4 40 B8R1.2 COC1=NC=NC=C1 T72699 [1,0,0,0,0,0|3,0,0]=4 41 B8R1.2 N#CC1=NC=CC=C1 D77869 [1,0,0,0,0,0|2,0,1]=4 42 B8R1.2 NCC1=CC=CC=C1 RB3068 [1,0,0,0,0,0|1,0,1]=3 43 B8R1.2 NCC1=CC=NC=C1 35876 [1,0,0,0,0,0|2,0,1]=4 44 B8R1.2 NNC1=CC=CN=C1 S12141 [1,0,0,0,0,0|3,0,0]=4 45 B8R1.2 O=CC1=NC=NC=C1 26359 [1,0,0,0,0,0|2,0,0]=3 46 B8R1.2 SCC1=CC=NC=C1 F18336 [1,0,0,0,0,0|1,1,1]=4 47 B8R1.2 SCC1=CN=CC=C1 F18343 [1,0,0,0,0,0|1,1,1]=4 48 B8R1.2 SCC1=NC=CC=C1 Y10072 [1,0,0,0,0,0|1,1,1]=4 49 B8R1.2 [C-]#[N+]C1=CC=CC=C1 AB1473 [1,0,0,0,0,0|1,0,1]=3 50 B10R1.13 C=C(C)C1=CC=C(I)C=C1 AC1339 [0,1,0,0,0,0|1,0,0]=2 51 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 AC7918 [0,1,0,0,0,0|0,0,0]=1 52 B10R1.13 CC(=O)C1=CN=C(O)N=C1 F13147 [0,1,0,0,0,0|2,0,0]=3 53 B10R1.13 CC(=O)C1=NC=C(Br)C=N1 38376 [0,1,0,0,0,0|2,0,0]=3 54 B10R1.13 CC(=O)C1=NC=C(C)C=N1 79366 [0,1,0,0,0,0|2,0,0]=3 55 B10R1.13 CC(=O)C1=NC=C(C)N=C1 56571 [0,1,0,0,0,0|2,0,0]=3 56 B10R1.13 CC(=O)C1=NC=C(N)C=C1 D94999 [0,1,0,0,0,0|1,0,0]=2 57 B10R1.13 CC(=O)C1=NC=C(O)C=C1 53717 [0,1,0,0,0,0|1,0,0]=2 58 B10R1.13 CC(=O)C1=NC=C(O)N=C1 C71512 [0,1,0,0,0,0|2,0,0]=3 59 B10R1.13 CC(=O)C1=NN=C(Cl)C=C1 P10979 [0,1,0,0,0,0|2,0,0]=3 60 B10R1.13 CC(C)C1=CC=C(O)C=C1 D72532 [0,1,0,0,0,0|1,0,1]=3 61 B10R1.13 CC(C)C1=NC=C(Br)C=C1 C71514 [0,1,0,0,0,0|2,0,1]=4 62 B10R1.13 CC(C)C1=NC=C(N)C=C1 D81293 [0,1,0,0,0,0|2,0,1]=4 63 B10R1.13 CC(C)C1=NC=C(N)C=C1 RB1132 [0,1,0,0,0,0|2,0,1]=4 64 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 20068 [0,1,0,0,0,0|1,0,1]=3 65 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 Y14023 [0,1,0,0,0,0|1,0,1]=3 66 B10R1.13 CC1=CC=C([C@H](C)O)C=C1 W19044 [0,1,0,0,0,0|0,0,2]=3 67 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 97006 [0,1,0,0,0,0|2,0,0]=3 68 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 A11173 [0,1,0,0,0,0|2,0,0]=3 69 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 T73083 [0,1,0,0,0,0|1,0,0]=2 70 B10R1.13 CC1=CCC(C(=O)O)=CC1 A12608 [0,1,0,0,0,0|1,0,2]=4 71 B10R1.13 CC1=CN=C(C(=O)O)N=C1 RB3298 [0,1,0,0,0,0|3,0,0]=4 72 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 Y10810 [0,1,0,0,0,0|2,0,1]=4 73 B10R1.13 CC1=CN=C([C@H](C)O)C=C1 AB7629 [0,1,0,0,0,0|1,0,2]=4 74 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 F16847 [0,1,0,0,0,0|2,0,1]=4 75 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 Y11095 [0,1,0,0,0,0|2,0,1]=4 76 B10R1.13 CN(C)C1=CN=C(Cl)C=C1 C15764 [0,1,0,0,0,0|3,0,0]=4 77 B10R1.13 CN(C)C1=CN=C(N)C=C1 N10123 [0,1,0,0,0,0|3,0,0]=4 78 B10R1.13 CN(N)C1=CC=C(Br)C=C1 E10129 [0,1,0,0,0,0|2,0,0]=3 79 B10R1.13 C[C@H](Cl)C1=CC=C(F)C=C1 AC6174 [0,1,0,0,0,0|1,0,1]=3 80 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 C16655 [0,1,0,0,0,0|1,0,1]=3 81 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 Y10310 [0,1,0,0,0,0|1,0,1]=3 82 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 Y10311 [0,1,0,0,0,0|1,0,1]=3 83 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 20069 [0,1,0,0,0,0|1,0,1]=3 84 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 20071 [0,1,0,0,0,0|1,0,1]=3 85 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 O11060 [0,1,0,0,0,0|1,0,1]=3 86 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 Y11752 [0,1,0,0,0,0|1,0,1]=3 87 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 Y11753 [0,1,0,0,0,0|1,0,1]=3 88 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 Y10879 [0,1,0,0,0,0|1,0,1]=3 89 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 Y14795 [0,1,0,0,0,0|1,0,1]=3 90 B10R1.13 C[C@H](N)C1=CN=C(Br)C=C1 81501 [0,1,0,0,0,0|2,0,1]=4 91 B10R1.13 C[C@H](N)C1=CN=C(Cl)C=C1 N11108 [0,1,0,0,0,0|2,0,1]=4 92 B10R1.13 C[C@H](N)C1=CN=C(Cl)C=C1 N11223 [0,1,0,0,0,0|2,0,1]=4 93 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 66671 [0,1,0,0,0,0|2,0,1]=4 94 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 74099 [0,1,0,0,0,0|2,0,1]=4 95 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 74101 [0,1,0,0,0,0|2,0,1]=4 96 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 81462 [0,1,0,0,0,0|2,0,1]=4 97 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 D82399 [0,1,0,0,0,0|2,0,1]=4 98 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 N11298 [0,1,0,0,0,0|2,0,1]=4 99 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 Y11564 [0,1,0,0,0,0|2,0,1]=4 100 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 N13196 [0,1,0,0,0,0|2,0,1]=4 101 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 Y12226 [0,1,0,0,0,0|2,0,1]=4 102 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 90530 [0,1,0,0,0,0|2,0,1]=4 103 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 F17006 [0,1,0,0,0,0|2,0,1]=4 104 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 N11135 [0,1,0,0,0,0|2,0,1]=4 105 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 Y10461 [0,1,0,0,0,0|2,0,1]=4 106 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 Y11597 [0,1,0,0,0,0|2,0,1]=4 107 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 Y13385 [0,1,0,0,0,0|2,0,1]=4 108 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 SC1272 [0,1,0,0,0,0|0,0,2]=3 109 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 SC1278 [0,1,0,0,0,0|0,0,2]=3 110 B10R1.13 C[C@H](O)C1=CC=C(O)C=C1 25877 [0,1,0,0,0,0|0,0,2]=3 111 B10R1.13 C[C@H](O)C1=CN=C(Br)C=C1 AT11876 [0,1,0,0,0,0|1,0,2]=4 112 B10R1.13 C[C@H](O)C1=NC=C(Br)C=C1 Y13723 [0,1,0,0,0,0|1,0,2]=4 113 B10R1.13 C[S@](=O)C1=NC=C(Br)C=N1 O11358 [0,1,0,0,0,0|3,0,0]=4 114 B10R1.13 FC(F)C1=CC=C(I)C=C1 C71790 [0,1,0,0,0,0|2,0,1]=4 115 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 W16706 [0,1,0,0,0,0|2,0,0]=3 116 B10R1.13 N=C(N)C1=CC=C(N)C=C1 56135 [0,1,0,0,0,0|2,0,0]=3 117 B10R1.13 N=C(N)C1=NC=C(Cl)C=C1 37719 [0,1,0,0,0,0|3,0,0]=4 118 B10R1.13 N=C(N)C1=NC=C(F)C=C1 38084 [0,1,0,0,0,0|3,0,0]=4 119 B10R1.13 NC(=O)C1=CN=C(O)C=C1 C74893 [0,1,0,0,0,0|2,0,0]=3 120 B10R1.13 NC(=O)C1=CN=C(O)N=C1 F13438 [0,1,0,0,0,0|3,0,0]=4 121 B10R1.13 NC(=O)C1=NC=C(N)C=C1 25630 [0,1,0,0,0,0|2,0,0]=3 122 B10R1.13 NC(=O)C1=NC=C(N)C=N1 30495 [0,1,0,0,0,0|3,0,0]=4 123 B10R1.13 NC(=O)C1=NC=C(N)N=C1 W17933 [0,1,0,0,0,0|3,0,0]=4 124 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 A11465 [0,1,0,0,0,0|1,0,0]=2 125 B10R1.13 NC1=CN=C(C(=O)O)N=C1 P10377 [0,1,0,0,0,0|3,0,0]=4 126 B10R1.13 NC1=CN=C([N+](=O)[O-])C=C1 26771 [0,1,0,0,0,0|3,0,0]=4 127 B10R1.13 O=C(O)C1=CN=C(Br)N=C1 F11671 [0,1,0,0,0,0|3,0,0]=4 128 B10R1.13 O=C(O)C1=CN=C(F)C=N1 70428 [0,1,0,0,0,0|3,0,0]=4 129 B10R1.13 O=C(O)C1=NC=C(F)C=N1 38641 [0,1,0,0,0,0|3,0,0]=4 130 B10R1.13 O=C(O)C1=NC=C(I)C=C1 O11456 [0,1,0,0,0,0|2,0,0]=3 131 B10R1.13 O=C(O)C1=NN=C(Br)C=C1 P10335 [0,1,0,0,0,0|3,0,0]=4 132 B10R1.13 O=C(O)C1=NN=C(O)C=C1 C73877 [0,1,0,0,0,0|3,0,0]=4 133 B10R1.13 O=C1N=CC(C(=O)O)=CN1 P13001 [0,1,0,0,0,0|3,0,0]=4 134 B10R1.13 O=[N+]([O-])C1=CN=C(I)C=C1 T72219 [0,1,0,0,0,0|3,0,0]=4 135 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 31291 [0,1,0,0,0,0|0,0,3]=4 136 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 32646 [0,1,0,0,0,0|0,0,3]=4 137 B10R1.15 C=C(CBr)C1=CC=CC=C1 35089 [0,1,0,0,0,0|1,0,0]=2 138 B10R1.15 C=C(CC)C1=CC=CC=C1 C73845 [0,1,0,0,0,0|1,0,0]=2 139 B10R1.15 C=CC(=O)C1=CC=CC=C1 77875 [0,1,0,0,0,0|0,0,1]=2 140 B10R1.15 C=C[C@H](N)C1=CC=CC=C1 Y11941 [0,1,0,0,0,0|1,0,2]=4 141 B10R1.15 C=C[C@H](N)C1=CC=CC=C1 Y11942 [0,1,0,0,0,0|1,0,2]=4 142 B10R1.15 C=C[C@H](N)C1=CC=CC=C1 Y12425 [0,1,0,0,0,0|1,0,2]=4 143 B10R1.15 CCC(=O)C1=NC=CN=C1 P11366 [0,1,0,0,0,0|2,0,0]=3 144 B10R1.15 CCN(C)C1=CC=CC=C1 S10715 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.15 CC[C@H](Br)C1=CC=CC=C1 A11640 [0,1,0,0,0,0|1,0,1]=3 146 B10R1.15 CC[C@H](N)C1=CC=CN=C1 31586 [0,1,0,0,0,0|2,0,1]=4 147 B10R1.15 CC[C@H](N)C1=CC=CN=C1 74009 [0,1,0,0,0,0|2,0,1]=4 148 B10R1.15 CC[C@H](N)C1=CC=NC=C1 31287 [0,1,0,0,0,0|2,0,1]=4 149 B10R1.15 CC[C@H](N)C1=CC=NC=C1 74015 [0,1,0,0,0,0|2,0,1]=4 150 B10R1.15 CC[C@H](N)C1=CC=NC=C1 74017 [0,1,0,0,0,0|2,0,1]=4 151 B10R1.15 CC[C@H](N)C1=CC=NC=C1 D81379 [0,1,0,0,0,0|2,0,1]=4 152 B10R1.15 CC[C@H](N)C1=NC=CC=C1 F16910 [0,1,0,0,0,0|2,0,1]=4 153 B10R1.15 CC[C@H](N)C1=NC=CC=C1 I11245 [0,1,0,0,0,0|2,0,1]=4 154 B10R1.15 CC[C@H](N)C1=NC=CC=C1 N10610 [0,1,0,0,0,0|2,0,1]=4 155 B10R1.15 CC[C@H](N)C1=NC=CC=C1 Y11176 [0,1,0,0,0,0|2,0,1]=4 156 B10R1.15 CC[C@H](N)C1=NC=CC=C1 Y11466 [0,1,0,0,0,0|2,0,1]=4 157 B10R1.15 CC[C@H](N)C1=NC=CC=C1 Y12115 [0,1,0,0,0,0|2,0,1]=4 158 B10R1.15 CC[C@H](O)C1=CC=CC=C1 T71858 [0,1,0,0,0,0|0,0,2]=3 159 B10R1.15 CC[C@H](O)C1=CC=CC=C1 T72707 [0,1,0,0,0,0|0,0,2]=3 160 B10R1.15 CN(C=O)C1=NC=CC=C1 A12745 [0,1,0,0,0,0|2,0,0]=3 161 B10R1.15 COC(=O)C1=CN=NC=C1 23653 [0,1,0,0,0,0|2,0,0]=3 162 B10R1.15 F[C@@H](CBr)C1=CC=CC=C1 32835 [0,1,0,0,0,0|1,0,1]=3 163 B10R1.15 N=C(NN)C1=CC=CC=C1 D97377 [0,1,0,0,0,0|2,0,0]=3 164 B10R1.15 N=C(NN)C1=NC=CC=C1 I10248 [0,1,0,0,0,0|3,0,0]=4 165 B10R1.15 NC[C@H](N)C1=CC=CC=C1 N12631 [0,1,0,0,0,0|1,0,1]=3 166 B10R1.15 NC[C@H](O)C1=NC=CC=C1 C77057 [0,1,0,0,0,0|1,0,2]=4 167 B10R1.15 NNC(=O)C1=CN=CN=C1 F18165 [0,1,0,0,0,0|3,0,0]=4 168 B10R1.15 NNC(=S)C1=CC=CC=C1 W10972 [0,1,0,0,0,0|1,1,0]=3 169 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 32217 [0,1,0,0,0,0|2,0,1]=4 170 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y11463 [0,1,0,0,0,0|2,0,1]=4 171 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y12121 [0,1,0,0,0,0|2,0,1]=4 172 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y13389 [0,1,0,0,0,0|2,0,1]=4 173 B10R1.15 N[C@@H](CO)C1=CN=CC=C1 F13354 [0,1,0,0,0,0|2,0,1]=4 174 B10R1.15 N[C@@H](CO)C1=CN=CC=C1 Y12482 [0,1,0,0,0,0|2,0,1]=4 175 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 D85222 [0,1,0,0,0,0|2,0,1]=4 176 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y13398 [0,1,0,0,0,0|2,0,1]=4 177 B10R1.15 O=C(CBr)C1=CN=CC=C1 D82267 [0,1,0,0,0,0|1,0,0]=2 178 B10R1.15 O=C(CBr)C1=NC=CC=N1 P17109 [0,1,0,0,0,0|2,0,0]=3 179 B10R1.15 O=C(CBr)C1=NC=CN=C1 FD7249 [0,1,0,0,0,0|2,0,0]=3 180 B10R1.15 O=C(CO)C1=NC=CC=C1 AC7454 [0,1,0,0,0,0|1,0,0]=2 181 B10R1.15 O=C(NO)C1=CN=CC=C1 F17466 [0,1,0,0,0,0|2,0,0]=3 182 B10R1.15 O=C[C@H](Br)C1=CC=CC=C1 F13390 [0,1,0,0,0,0|1,0,1]=3 183 B10R1.15 O[C@@H](CF)C1=CC=CC=C1 C91661 [0,1,0,0,0,0|0,0,2]=3 184 B10R1.15 O\N=C(/Cl)C1=NC=CC=C1 O12024 [0,1,0,0,0,0|2,0,1]=4 185 B10R1.28 CC(C)(N)C1=CC=CN=C1 27050 [0,1,0,0,0,0|2,0,1]=4 186 B10R1.28 CC(C)(N)C1=CC=NC=C1 F17065 [0,1,0,0,0,0|2,0,1]=4 187 B10R1.28 CC(C)(N)C1=NC=CC=C1 F20062 [0,1,0,0,0,0|2,0,1]=4 188 B10R1.28 CC(C)(O)C1=CN=CC=C1 50806 [0,1,0,0,0,0|1,0,2]=4 189 B10R1.28 CC(C)(O)C1=NC=CC=C1 W17538 [0,1,0,0,0,0|1,0,2]=4 190 B10R1.28 CS(=O)(=O)C1=CC=NC=C1 C15067 [0,1,0,0,0,0|2,0,0]=3 191 B10R1.28 CS(=O)(=O)C1=NC=CC=N1 O10532 [0,1,0,0,0,0|3,0,0]=4 192 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 D77743 [0,1,0,0,0,0|2,0,0]=3 193 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 D77813 [0,1,0,0,0,0|2,0,0]=3 194 B10R1.28 C[S@](=N)(=O)C1=CC=CC=C1 W16234 [0,1,0,0,0,0|1,0,0]=2 195 B10R1.28 C[Sn](C)(C)C1=NC=CC=C1 T71744 [0,1,0,0,0,0|3,0,0]=4 196 B10R1.28 O=S(=O)(Cl)C1=NC=CC=C1 F14522 [0,1,0,0,0,0|3,0,0]=4 197 B10R1.28 O=S(=O)(O)C1=CC=NC=C1 12268 [0,1,0,0,0,0|3,0,0]=4 198 B10R1.61 C=C(C)C1=C(Br)C=CC=C1 W17018 [0,1,0,0,0,0|1,0,0]=2 199 B10R1.61 CC(=O)C1=C(Br)C=CC=N1 80328 [0,1,0,0,0,0|1,0,0]=2 200 B10R1.61 CC(=O)C1=C(Br)C=NC=N1 26989 [0,1,0,0,0,0|2,0,0]=3 201 B10R1.61 CC(=O)C1=C(C)N=CC=C1 C73307 [0,1,0,0,0,0|1,0,0]=2 202 B10R1.61 CC(=O)C1=C(C)N=CN=C1 O10297 [0,1,0,0,0,0|2,0,0]=3 203 B10R1.61 CC(=O)C1=C(Cl)C=CC=N1 27067 [0,1,0,0,0,0|1,0,0]=2 204 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 Y14823 [0,1,0,0,0,0|1,0,0]=2 205 B10R1.61 CC(=O)C1=C(Cl)C=NC=C1 N12959 [0,1,0,0,0,0|1,0,0]=2 206 B10R1.61 CC(=O)C1=C(N)N=CN=C1 D80245 [0,1,0,0,0,0|2,0,0]=3 207 B10R1.61 CC(=O)C1=C(O)C=NC=C1 27646 [0,1,0,0,0,0|1,0,0]=2 208 B10R1.61 CC(=O)C1=C(O)N=CC=C1 93481 [0,1,0,0,0,0|1,0,0]=2 209 B10R1.61 CC(=O)C1=CC=CN=C1F F31395 [0,1,0,0,0,0|1,0,0]=2 210 B10R1.61 CC(=O)C1=CNC=CC1=O C74936 [0,1,0,0,0,0|1,0,0]=2 211 B10R1.61 CC(=O)C1=NC=CC=C1N 80156 [0,1,0,0,0,0|1,0,0]=2 212 B10R1.61 CC(=O)C1=NC=CC=C1O 80210 [0,1,0,0,0,0|1,0,0]=2 213 B10R1.61 CC(C)C1=C(N)C=CN=C1 C77054 [0,1,0,0,0,0|2,0,1]=4 214 B10R1.61 CC(C)C1=C(O)C=CC=N1 72523 [0,1,0,0,0,0|2,0,1]=4 215 B10R1.61 CC(C)C1=C(S)C=CC=C1 29274 [0,1,0,0,0,0|1,0,1]=3 216 B10R1.61 CC(C)C1=CC=CN=C1Br C72641 [0,1,0,0,0,0|2,0,1]=4 217 B10R1.61 CC(C)C1=CC=CN=C1N 60027 [0,1,0,0,0,0|2,0,1]=4 218 B10R1.61 CC(C)C1=NC=CC=C1N C72482 [0,1,0,0,0,0|2,0,1]=4 219 B10R1.61 CC1=C(C(=N)N)C=CC=C1 28690 [0,1,0,0,0,0|2,0,0]=3 220 B10R1.61 CC1=C(C(=O)O)C=CN=N1 P11312 [0,1,0,0,0,0|3,0,0]=4 221 B10R1.61 CC1=C(C(=O)O)C=NC=C1 83402 [0,1,0,0,0,0|2,0,0]=3 222 B10R1.61 CC1=C(C(N)=O)C=CN=C1 C74299 [0,1,0,0,0,0|2,0,0]=3 223 B10R1.61 CC1=C(C(N)=O)C=NC=C1 A10183 [0,1,0,0,0,0|2,0,0]=3 224 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 52748 [0,1,0,0,0,0|1,0,1]=3 225 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 52749 [0,1,0,0,0,0|1,0,1]=3 226 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 N10464 [0,1,0,0,0,0|1,0,1]=3 227 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 Y10511 [0,1,0,0,0,0|1,0,1]=3 228 B10R1.61 CC1=C([N+](=O)[O-])C=NC=C1 C76767 [0,1,0,0,0,0|3,0,0]=4 229 B10R1.61 CC1=CC=CN=C1C(=N)N I11838 [0,1,0,0,0,0|3,0,0]=4 230 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y11090 [0,1,0,0,0,0|2,0,1]=4 231 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y12107 [0,1,0,0,0,0|2,0,1]=4 232 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y12108 [0,1,0,0,0,0|2,0,1]=4 233 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y13392 [0,1,0,0,0,0|2,0,1]=4 234 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y13393 [0,1,0,0,0,0|2,0,1]=4 235 B10R1.61 CC1=CC=CN=C1[C@H](C)O 21080 [0,1,0,0,0,0|1,0,2]=4 236 B10R1.61 CC1=CC=NN=C1C(=O)O P10780 [0,1,0,0,0,0|3,0,0]=4 237 B10R1.61 CC1=CN=CN=C1C(=O)O F52630 [0,1,0,0,0,0|3,0,0]=4 238 B10R1.61 CC1=NC=CC=C1[C@H](C)N Y12491 [0,1,0,0,0,0|2,0,1]=4 239 B10R1.61 CN(C)C1=C(Br)C=CC=N1 N11615 [0,1,0,0,0,0|3,0,0]=4 240 B10R1.61 CN(C)C1=C(Br)C=NC=C1 F19675 [0,1,0,0,0,0|3,0,0]=4 241 B10R1.61 C[C@H](Cl)C1=C(F)C=NC=C1 W10402 [0,1,0,0,0,0|2,0,1]=4 242 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 21516 [0,1,0,0,0,0|1,0,1]=3 243 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 21517 [0,1,0,0,0,0|1,0,1]=3 244 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 Y10364 [0,1,0,0,0,0|1,0,1]=3 245 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 70080 [0,1,0,0,0,0|2,0,1]=4 246 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 90519 [0,1,0,0,0,0|2,0,1]=4 247 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 D81561 [0,1,0,0,0,0|2,0,1]=4 248 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 20095 [0,1,0,0,0,0|1,0,1]=3 249 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 SC1344 [0,1,0,0,0,0|1,0,1]=3 250 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 SC1353 [0,1,0,0,0,0|1,0,1]=3 251 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=N1 90516 [0,1,0,0,0,0|2,0,1]=4 252 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 52754 [0,1,0,0,0,0|1,0,1]=3 253 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 52755 [0,1,0,0,0,0|1,0,1]=3 254 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 I10701 [0,1,0,0,0,0|1,0,1]=3 255 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 Y10447 [0,1,0,0,0,0|1,0,1]=3 256 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 Y11656 [0,1,0,0,0,0|1,0,1]=3 257 B10R1.61 C[C@H](N)C1=C(F)C=CC=N1 N13070 [0,1,0,0,0,0|2,0,1]=4 258 B10R1.61 C[C@H](N)C1=C(F)C=CC=N1 N13095 [0,1,0,0,0,0|2,0,1]=4 259 B10R1.61 C[C@H](N)C1=C(N)C=CC=C1 C78195 [0,1,0,0,0,0|1,0,1]=3 260 B10R1.61 C[C@H](O)C1=C(Br)C=CC=C1 SC1257 [0,1,0,0,0,0|0,0,2]=3 261 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 SC1230 [0,1,0,0,0,0|0,0,2]=3 262 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 SC1233 [0,1,0,0,0,0|0,0,2]=3 263 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=N1 P19330 [0,1,0,0,0,0|1,0,2]=4 264 B10R1.61 C[C@H](O)C1=C(F)C=CC=N1 F13157 [0,1,0,0,0,0|1,0,2]=4 265 B10R1.61 C[C@H](O)C1=C(O)C=CC=C1 W16007 [0,1,0,0,0,0|0,0,2]=3 266 B10R1.61 C[C@H](O)C1=CC=CN=C1F F15555 [0,1,0,0,0,0|1,0,2]=4 267 B10R1.61 N=C(N)C1=C(Cl)C=CC=C1 71514 [0,1,0,0,0,0|2,0,0]=3 268 B10R1.61 N=C(N)C1=C(F)C=CC=N1 90259 [0,1,0,0,0,0|3,0,0]=4 269 B10R1.61 NC(=O)C1=C(O)C=NC=C1 CL0151 [0,1,0,0,0,0|2,0,0]=3 270 B10R1.61 NC(=O)C1=C(O)N=CN=C1 Y11131 [0,1,0,0,0,0|3,0,0]=4 271 B10R1.61 NC(=O)C1=CC=NNC1=O AC1803 [0,1,0,0,0,0|3,0,0]=4 272 B10R1.61 NC(=O)C1=NC=CN=C1Br Y10494 [0,1,0,0,0,0|3,0,0]=4 273 B10R1.61 NC(=O)C1=NC=CN=C1N 81968 [0,1,0,0,0,0|3,0,0]=4 274 B10R1.61 NC1=C(C(F)F)C=CC=C1 72620 [0,1,0,0,0,0|2,0,1]=4 275 B10R1.61 NC1=CN=CN=C1C(=O)O 20214 [0,1,0,0,0,0|3,0,0]=4 276 B10R1.61 O=C(O)C1=C(Br)C=NC=N1 84369 [0,1,0,0,0,0|3,0,0]=4 277 B10R1.61 O=C(O)C1=C(Cl)C=NC=N1 P10759 [0,1,0,0,0,0|3,0,0]=4 278 B10R1.61 O=C(O)C1=C(F)C=CN=C1 W18401 [0,1,0,0,0,0|2,0,0]=3 279 B10R1.61 O=C(O)C1=CC=NN=C1Cl P11658 [0,1,0,0,0,0|3,0,0]=4 280 B10R1.61 O=C(O)C1=NC=CN=C1Br 84139 [0,1,0,0,0,0|3,0,0]=4 281 B10R1.61 O=C(O)C1=NC=CN=C1I 26634 [0,1,0,0,0,0|3,0,0]=4 282 B10R1.61 O=[N+]([O-])C1=C(F)C=CN=C1 I10226 [0,1,0,0,0,0|3,0,0]=4 283 B10R1.61 O=[N+]([O-])C1=C(F)C=NC=C1 84153 [0,1,0,0,0,0|3,0,0]=4 284 B10R1.61 O=[N+]([O-])C1=C(I)C=NC=C1 29629 [0,1,0,0,0,0|3,0,0]=4 285 B10R1.61 O=[N+]([O-])C1=C(O)C=NC=C1 27136 [0,1,0,0,0,0|3,0,0]=4 286 B10R1.113 C=C(C)C1=CC(Br)=CN=C1 27507 [0,1,0,0,0,0|2,0,0]=3 287 B10R1.113 C=C(C)C1=CC(C)=CC=C1 AC1343 [0,1,0,0,0,0|1,0,0]=2 288 B10R1.113 C=C(C)C1=CC=CC(Cl)=C1 AC1313 [0,1,0,0,0,0|1,0,0]=2 289 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 A10170 [0,1,0,0,0,0|1,0,0]=2 290 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 W17608 [0,1,0,0,0,0|1,0,0]=2 291 B10R1.113 CC(=O)C1=CC(C)=NC=C1 27585 [0,1,0,0,0,0|1,0,0]=2 292 B10R1.113 CC(=O)C1=CC(Cl)=CN=C1 78890 [0,1,0,0,0,0|1,0,0]=2 293 B10R1.113 CC(=O)C1=CC(F)=CN=C1 N13069 [0,1,0,0,0,0|1,0,0]=2 294 B10R1.113 CC(=O)C1=CC(F)=NC=C1 52239 [0,1,0,0,0,0|1,0,0]=2 295 B10R1.113 CC(=O)C1=CC(N)=NC=C1 82952 [0,1,0,0,0,0|1,0,0]=2 296 B10R1.113 CC(=O)C1=CC=CC(Cl)=C1 D77821 [0,1,0,0,0,0|0,0,0]=1 297 B10R1.113 CC(=O)C1=CC=CC(F)=N1 F30144 [0,1,0,0,0,0|1,0,0]=2 298 B10R1.113 CC(=O)C1=CN=CC(Cl)=N1 Y14516 [0,1,0,0,0,0|2,0,0]=3 299 B10R1.113 CC(=O)C1=C[N+]([O-])=CC=C1 31268 [0,1,0,0,0,0|1,0,0]=2 300 B10R1.113 CC(=O)C1=NC(C)=NC=C1 D70257 [0,1,0,0,0,0|2,0,0]=3 301 B10R1.113 CC(=O)C1=NC(N)=NC=C1 75052 [0,1,0,0,0,0|2,0,0]=3 302 B10R1.113 CC(=O)C1=NC=CC(Br)=C1 RB1136 [0,1,0,0,0,0|1,0,0]=2 303 B10R1.113 CC(=O)C1=NC=CC(N)=C1 C72011 [0,1,0,0,0,0|1,0,0]=2 304 B10R1.113 CC(C)C1=CC(Br)=CN=C1 C71734 [0,1,0,0,0,0|2,0,1]=4 305 B10R1.113 CC(C)C1=CC=CC(=O)N1 D96359 [0,1,0,0,0,0|2,0,1]=4 306 B10R1.113 CC(C)C1=CC=CC(Br)=N1 35873 [0,1,0,0,0,0|2,0,1]=4 307 B10R1.113 CC(C)C1=CC=CC(Cl)=N1 O10744 [0,1,0,0,0,0|2,0,1]=4 308 B10R1.113 CC(C)C1=CN=CC(N)=C1 C72026 [0,1,0,0,0,0|2,0,1]=4 309 B10R1.113 CC(C)C1=NC=CC(Br)=C1 F52115 [0,1,0,0,0,0|2,0,1]=4 310 B10R1.113 CC(C)C1=NC=CC(Cl)=C1 C77363 [0,1,0,0,0,0|2,0,1]=4 311 B10R1.113 CC(C)C1=NC=CC(N)=C1 F52587 [0,1,0,0,0,0|2,0,1]=4 312 B10R1.113 CC1=CC(C(=N)N)=NC=C1 W12205 [0,1,0,0,0,0|3,0,0]=4 313 B10R1.113 CC1=CC(C(=O)O)=NN=C1 P15424 [0,1,0,0,0,0|3,0,0]=4 314 B10R1.113 CC1=CC([C@H](C)O)=NC=C1 AB7628 [0,1,0,0,0,0|1,0,2]=4 315 B10R1.113 CC1=CC=CC(C(=N)N)=N1 W12204 [0,1,0,0,0,0|3,0,0]=4 316 B10R1.113 CC1=CC=CC(C(N)=O)=N1 AB10051 [0,1,0,0,0,0|2,0,0]=3 317 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 79174 [0,1,0,0,0,0|1,0,1]=3 318 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 I11812 [0,1,0,0,0,0|1,0,1]=3 319 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 Y10001 [0,1,0,0,0,0|1,0,1]=3 320 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 Y10156 [0,1,0,0,0,0|1,0,1]=3 321 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 Y11645 [0,1,0,0,0,0|1,0,1]=3 322 B10R1.113 CC1=CC=CC([C@H](C)O)=C1 W11160 [0,1,0,0,0,0|0,0,2]=3 323 B10R1.113 CC1=CC=CC([C@H](C)O)=C1 W11161 [0,1,0,0,0,0|0,0,2]=3 324 B10R1.113 CC1=CC=CC([C@H](C)O)=N1 AB7630 [0,1,0,0,0,0|1,0,2]=4 325 B10R1.113 CC1=CC=CC([N+](=O)[O-])=N1 W17269 [0,1,0,0,0,0|3,0,0]=4 326 B10R1.113 CC1=CC=NC(C(=O)O)=N1 26974 [0,1,0,0,0,0|3,0,0]=4 327 B10R1.113 CC1=NC=CC(C(N)=O)=C1 F11696 [0,1,0,0,0,0|2,0,0]=3 328 B10R1.113 CC1=NC=CC([C@H](C)N)=C1 Y11263 [0,1,0,0,0,0|2,0,1]=4 329 B10R1.113 CC1=NC=CC([C@H](C)N)=C1 Y11474 [0,1,0,0,0,0|2,0,1]=4 330 B10R1.113 CN(C)C1=CC(Cl)=NC=C1 S11986 [0,1,0,0,0,0|3,0,0]=4 331 B10R1.113 CN(C)C1=CC(F)=NC=C1 Y10856 [0,1,0,0,0,0|3,0,0]=4 332 B10R1.113 CN(C)C1=CC(N)=NC=C1 D95136 [0,1,0,0,0,0|3,0,0]=4 333 B10R1.113 CN(C)C1=CC=CC(Br)=N1 92343 [0,1,0,0,0,0|3,0,0]=4 334 B10R1.113 CN(C)C1=NC=CC(Br)=C1 26905 [0,1,0,0,0,0|3,0,0]=4 335 B10R1.113 C[C@H](N)C1=CC(Br)=CN=C1 D81619 [0,1,0,0,0,0|2,0,1]=4 336 B10R1.113 C[C@H](N)C1=CC(Br)=CN=C1 N10536 [0,1,0,0,0,0|2,0,1]=4 337 B10R1.113 C[C@H](N)C1=CC(Br)=CN=C1 Y11879 [0,1,0,0,0,0|2,0,1]=4 338 B10R1.113 C[C@H](N)C1=CC(Br)=CN=C1 Y13386 [0,1,0,0,0,0|2,0,1]=4 339 B10R1.113 C[C@H](N)C1=CC(Br)=NC=C1 Y10857 [0,1,0,0,0,0|2,0,1]=4 340 B10R1.113 C[C@H](N)C1=CC(Br)=NC=C1 Y11465 [0,1,0,0,0,0|2,0,1]=4 341 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 N10750 [0,1,0,0,0,0|2,0,1]=4 342 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 N10751 [0,1,0,0,0,0|2,0,1]=4 343 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 Y11065 [0,1,0,0,0,0|2,0,1]=4 344 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 Y13387 [0,1,0,0,0,0|2,0,1]=4 345 B10R1.113 C[C@H](N)C1=CC(Cl)=NC=C1 74119 [0,1,0,0,0,0|2,0,1]=4 346 B10R1.113 C[C@H](N)C1=CC(Cl)=NC=C1 N11225 [0,1,0,0,0,0|2,0,1]=4 347 B10R1.113 C[C@H](N)C1=CC(Cl)=NC=C1 Y12112 [0,1,0,0,0,0|2,0,1]=4 348 B10R1.113 C[C@H](N)C1=CC(Cl)=NC=C1 Y13390 [0,1,0,0,0,0|2,0,1]=4 349 B10R1.113 C[C@H](N)C1=CC(Cl)=NC=C1 Y13391 [0,1,0,0,0,0|2,0,1]=4 350 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 90830 [0,1,0,0,0,0|2,0,1]=4 351 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 Y10994 [0,1,0,0,0,0|2,0,1]=4 352 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 Y11212 [0,1,0,0,0,0|2,0,1]=4 353 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 20368 [0,1,0,0,0,0|1,0,1]=3 354 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 Y10443 [0,1,0,0,0,0|1,0,1]=3 355 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 90542 [0,1,0,0,0,0|2,0,1]=4 356 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 D81642 [0,1,0,0,0,0|2,0,1]=4 357 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 D81648 [0,1,0,0,0,0|2,0,1]=4 358 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 N11222 [0,1,0,0,0,0|2,0,1]=4 359 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 Y12109 [0,1,0,0,0,0|2,0,1]=4 360 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 Y12110 [0,1,0,0,0,0|2,0,1]=4 361 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 Y13396 [0,1,0,0,0,0|2,0,1]=4 362 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=C1 80051 [0,1,0,0,0,0|1,0,1]=3 363 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=C1 Y10165 [0,1,0,0,0,0|1,0,1]=3 364 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=C1 Y11266 [0,1,0,0,0,0|1,0,1]=3 365 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=N1 N11224 [0,1,0,0,0,0|2,0,1]=4 366 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=N1 Y11269 [0,1,0,0,0,0|2,0,1]=4 367 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 35666 [0,1,0,0,0,0|1,0,1]=3 368 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 I10702 [0,1,0,0,0,0|1,0,1]=3 369 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 SC1338 [0,1,0,0,0,0|1,0,1]=3 370 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 Y10157 [0,1,0,0,0,0|1,0,1]=3 371 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 Y14762 [0,1,0,0,0,0|1,0,1]=3 372 B10R1.113 C[C@H](N)C1=CC=CC(F)=N1 90537 [0,1,0,0,0,0|2,0,1]=4 373 B10R1.113 C[C@H](N)C1=CC=CC(F)=N1 90538 [0,1,0,0,0,0|2,0,1]=4 374 B10R1.113 C[C@H](N)C1=CC=CC(F)=N1 Y11175 [0,1,0,0,0,0|2,0,1]=4 375 B10R1.113 C[C@H](N)C1=CC=CC(F)=N1 Y14741 [0,1,0,0,0,0|2,0,1]=4 376 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 70881 [0,1,0,0,0,0|1,0,1]=3 377 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 Y13415 [0,1,0,0,0,0|1,0,1]=3 378 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 N12887 [0,1,0,0,0,0|1,0,1]=3 379 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 N13189 [0,1,0,0,0,0|1,0,1]=3 380 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 Y10220 [0,1,0,0,0,0|1,0,1]=3 381 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 Y10873 [0,1,0,0,0,0|1,0,1]=3 382 B10R1.113 C[C@H](O)C1=CC=CC(Br)=C1 SC1266 [0,1,0,0,0,0|0,0,2]=3 383 B10R1.113 C[C@H](O)C1=CC=CC(Cl)=C1 SC1260 [0,1,0,0,0,0|0,0,2]=3 384 B10R1.113 C[C@H](O)C1=CC=CC(Cl)=C1 SC1269 [0,1,0,0,0,0|0,0,2]=3 385 B10R1.113 C[C@H](O)C1=CC=CC(F)=C1 SC1248 [0,1,0,0,0,0|0,0,2]=3 386 B10R1.113 C[C@H](O)C1=NC=CC(Br)=C1 AC1228 [0,1,0,0,0,0|1,0,2]=4 387 B10R1.113 C[N+]1=CC=CC(C(=O)[O-])=C1 41976 [0,1,0,0,0,0|2,0,0]=3 388 B10R1.113 FC(F)C1=CC=CC(I)=C1 72424 [0,1,0,0,0,0|2,0,1]=4 389 B10R1.113 NC(=O)C1=CC(O)=CC=C1 C75901 [0,1,0,0,0,0|1,0,0]=2 390 B10R1.113 NC(=O)C1=CC=CC(Cl)=N1 78773 [0,1,0,0,0,0|2,0,0]=3 391 B10R1.113 NC(=O)C1=CC=NC(Cl)=N1 24231 [0,1,0,0,0,0|3,0,0]=4 392 B10R1.113 NC(=O)C1=CN=CC(O)=C1 W18378 [0,1,0,0,0,0|2,0,0]=3 393 B10R1.113 NC(=O)C1=NC(N)=NC=C1 C73521 [0,1,0,0,0,0|3,0,0]=4 394 B10R1.113 NC(=O)C1=NC(O)=CC=C1 C77024 [0,1,0,0,0,0|2,0,0]=3 395 B10R1.113 NC(=O)C1=NC=CC(N)=C1 S11442 [0,1,0,0,0,0|2,0,0]=3 396 B10R1.113 NC(=O)C1=NC=NC(O)=C1 F17317 [0,1,0,0,0,0|3,0,0]=4 397 B10R1.113 NC(=S)C1=CN=CC(F)=C1 W11938 [0,1,0,0,0,0|2,1,0]=4 398 B10R1.113 NC1=CC(C(=O)O)=CN=N1 P17402 [0,1,0,0,0,0|3,0,0]=4 399 B10R1.113 NC1=CC(C(=O)O)=NC=N1 26498 [0,1,0,0,0,0|3,0,0]=4 400 B10R1.113 NC1=CC([N+](=O)[O-])=NC=C1 CS1209 [0,1,0,0,0,0|3,0,0]=4 401 B10R1.113 NC1=CN=CC(C(=O)O)=N1 26349 [0,1,0,0,0,0|3,0,0]=4 402 B10R1.113 NC1=NC=CC([N+](=O)[O-])=C1 24953 [0,1,0,0,0,0|3,0,0]=4 403 B10R1.113 O=C(Cl)C1=CC(Cl)=NC=C1 78664 [0,1,0,0,0,0|2,0,0]=3 404 B10R1.113 O=C(Cl)C1=CC(Cl)=NC=N1 F18835 [0,1,0,0,0,0|3,0,0]=4 405 B10R1.113 O=C(Cl)C1=CC=CC(Cl)=N1 C76563 [0,1,0,0,0,0|2,0,0]=3 406 B10R1.113 O=C(O)C1=CC(S)=NC=C1 77943 [0,1,0,0,0,0|2,0,0]=3 407 B10R1.113 O=C(O)C1=CC=NC(Br)=N1 W17831 [0,1,0,0,0,0|3,0,0]=4 408 B10R1.113 O=C(O)C1=NC=CC(Cl)=N1 F19652 [0,1,0,0,0,0|3,0,0]=4 409 B10R1.113 O=C(O)C1=NC=CC(F)=C1 CL0347 [0,1,0,0,0,0|2,0,0]=3 410 B10R1.113 O=C([O-])C1=NC(O)=CN=C1 P19772 [0,1,0,0,0,0|3,0,0]=4 411 B10R1.113 O=C1C=CNC(C(=O)O)=C1 N13374 [0,1,0,0,0,0|2,0,0]=3 412 B10R1.113 O=[N+]([O-])C1=CC(F)=NC=C1 78728 [0,1,0,0,0,0|3,0,0]=4 413 B10R1.113 O=[N+]([O-])C1=CC=CC(Cl)=N1 BL000528 [0,1,0,0,0,0|3,0,0]=4 414 B10R1.113 O=[N+]([O-])C1=CN=CC(O)=C1 26591 [0,1,0,0,0,0|3,0,0]=4 415 B10R1.113 O=[N+]([O-])C1=NC=CC(Br)=C1 C77097 [0,1,0,0,0,0|3,0,0]=4 416 B10R1.113 O=[N+]([O-])C1=NC=CC(F)=C1 C76921 [0,1,0,0,0,0|3,0,0]=4 417 B10R1.113 O=[N+]([O-])C1=NC=CC(O)=C1 H10537 [0,1,0,0,0,0|3,0,0]=4 418 B10R1.113 OC1=CC=CC(C(F)F)=C1 71582 [0,1,0,0,0,0|2,0,1]=4 419 B10R2.320 O=C1CC2=C1C=CC=C2 67963 [0,0,0,1,0,0|0,0,0]=1 420 B8R1.7 CC(=O)C1=CC=NO1 I11392 [0,0,0,0,1,0|2,0,0]=3 421 B8R1.7 CC(=O)C1=CC=NO1 Y10704 [0,0,0,0,1,0|2,0,0]=3 422 B8R1.7 CC(=O)C1=CC=NS1 62850 [0,0,0,0,1,0|2,0,0]=3 423 B8R1.7 CC(=O)C1=CN=CS1 66660 [0,0,0,0,1,0|2,0,0]=3 424 B8R1.7 CC(=O)C1=CN=NS1 66662 [0,0,0,0,1,0|3,0,0]=4 425 B8R1.7 CC(=O)C1=CNN=C1 50308 [0,0,0,0,1,0|2,0,0]=3 426 B8R1.7 CC(=O)C1=NC=CO1 33464 [0,0,0,0,1,0|2,0,0]=3 427 B8R1.7 CC(=O)C1=NOC=C1 33729 [0,0,0,0,1,0|2,0,0]=3 428 B8R1.7 CC(C)C1=CC=CO1 81450 [0,0,0,0,1,0|2,0,1]=4 429 B8R1.7 C[C@H](N)C1=CC=CO1 Y10899 [0,0,0,0,1,0|2,0,1]=4 430 B8R1.7 C[C@H](N)C1=CC=CO1 Y12106 [0,0,0,0,1,0|2,0,1]=4 431 B8R1.7 C[C@H](N)C1=CC=CS1 82880 [0,0,0,0,1,0|2,0,1]=4 432 B8R1.7 C[C@H](N)C1=CC=CS1 D81260 [0,0,0,0,1,0|2,0,1]=4 433 B8R1.7 C[C@H](N)C1=CC=CS1 N11134 [0,0,0,0,1,0|2,0,1]=4 434 B8R1.7 C[C@H](N)C1=CC=CS1 N12970 [0,0,0,0,1,0|2,0,1]=4 435 B8R1.7 C[C@H](N)C1=CC=CS1 Y10683 [0,0,0,0,1,0|2,0,1]=4 436 B8R1.7 C[C@H](N)C1=CSC=C1 27894 [0,0,0,0,1,0|2,0,1]=4 437 B8R1.7 C[C@H](N)C1=CSC=C1 Y14612 [0,0,0,0,1,0|2,0,1]=4 438 B8R1.7 C[C@H](O)C1=CSC=C1 79116 [0,0,0,0,1,0|1,0,2]=4 439 B8R1.7 N=C(N)C1=CC=CS1 C15965 [0,0,0,0,1,0|3,0,0]=4 440 B8R1.7 NC(=O)C1=CC=NO1 F30843 [0,0,0,0,1,0|3,0,0]=4 441 B8R1.7 NC(=O)C1=CN=CO1 78451 [0,0,0,0,1,0|3,0,0]=4 442 B8R1.7 NC(=O)C1=CN=CS1 D79735 [0,0,0,0,1,0|3,0,0]=4 443 B8R1.7 NC(=O)C1=COC=N1 35847 [0,0,0,0,1,0|3,0,0]=4 444 B8R1.7 NC(=O)C1=NC=CS1 A10602 [0,0,0,0,1,0|3,0,0]=4 445 B8R1.7 NC(=O)C1=NSC=C1 F14137 [0,0,0,0,1,0|3,0,0]=4 446 B8R1.7 O=C(Cl)N1C=CC=N1 72878 [0,0,0,0,1,0|3,0,0]=4 447 B8R1.7 O=C(O)C1=CSN=C1 83094 [0,0,0,0,1,0|3,0,0]=4 448 B8R1.7 O=C(O)C1=NSC=C1 83207 [0,0,0,0,1,0|3,0,0]=4 449 B8R1.7 O=[N+]([O-])C1=CC=CN1 26912 [0,0,0,0,1,0|3,0,0]=4 450 B8R1.7 O=[N+]([O-])C1=CNC=C1 29669 [0,0,0,0,1,0|3,0,0]=4 451 B10R1.18 BrC(Br)=CC1=CC=CC=C1 31017 [0,0,0,0,0,1|2,0,0]=3 452 B10R1.18 CC(=O)CC1=CN=CC=C1 28512 [0,0,0,0,0,1|1,0,0]=2 453 B10R1.18 CC(=O)NC1=CC=CC=C1 D72485 [0,0,0,0,0,1|0,0,0]=1 454 B10R1.18 C[C@H](N)CC1=NC=CC=C1 C80024 [0,0,0,0,0,1|2,0,1]=4 455 B10R1.18 FC(F)SC1=CC=CC=C1 I11988 [0,0,0,0,0,1|2,0,1]=4 456 B10R1.18 N=C(N)CC1=CC=CC=C1 F19863 [0,0,0,0,0,1|2,0,0]=3 457 B10R1.18 NC(=O)CC1=NC=CC=N1 26281 [0,0,0,0,0,1|3,0,0]=4 458 B10R1.18 NC(=O)NC1=NC=CN=C1 W17943 [0,0,0,0,0,1|3,0,0]=4 459 B10R1.18 NC(=S)CC1=CC=CC=C1 71029 [0,0,0,0,0,1|1,1,0]=3 460 B10R1.18 O=C(O)CC1=CN=CN=C1 24619 [0,0,0,0,0,1|3,0,0]=4 461 B10R1.18 O=C([O-])CC1=CN=NC=C1 P14654 [0,0,0,0,0,1|3,0,0]=4 462 B10R1.18 O=C([O-])CC1=NC=NC=C1 27827 [0,0,0,0,0,1|3,0,0]=4 463 B7R0.4 C\C=C/C=C/C(=O)O D86563 [1,0,1,0,0,0|1,0,1]=4 464 B7R1.3 ClC1=CN=CC=C1 P19758 [2,0,0,0,0,0|2,0,0]=4 465 B7R1.3 NC1=CC=CC=C1 T70935 [2,0,0,0,0,0|1,0,0]=3 466 B7R1.3 NC1=CC=CC=C1 T71037 [2,0,0,0,0,0|1,0,0]=3 467 B7R1.3 O=C1C=CNN=C1 D87946 [2,0,0,0,0,0|2,0,0]=4 468 B9R1.1 C#CC1=CC=C(I)C=C1 F21257 [1,1,0,0,0,0|0,0,2]=4 469 B9R1.1 C=CC1=CN=C(Cl)C=C1 F13416 [1,1,0,0,0,0|1,0,1]=4 470 B9R1.1 C=CC1=NC=C(Cl)C=C1 P17531 [1,1,0,0,0,0|1,0,1]=4 471 B9R1.1 CC1=CN=C(C=O)C=N1 36020 [1,1,0,0,0,0|2,0,0]=4 472 B9R1.1 CCC1=CN=C(Br)C=C1 CS1557 [1,1,0,0,0,0|1,0,1]=4 473 B9R1.1 CCC1=CN=C(Cl)C=C1 72594 [1,1,0,0,0,0|1,0,1]=4 474 B9R1.1 CCC1=CN=C(O)C=C1 25325 [1,1,0,0,0,0|1,0,1]=4 475 B9R1.1 CCC1=NC=C(Br)C=C1 26547 [1,1,0,0,0,0|1,0,1]=4 476 B9R1.1 CCC1=NC=C(Cl)C=C1 C71513 [1,1,0,0,0,0|1,0,1]=4 477 B9R1.1 CCC1=NC=C(N)C=C1 C72111 [1,1,0,0,0,0|1,0,1]=4 478 B9R1.1 CNC1=CC=C(O)C=C1 D77985 [1,1,0,0,0,0|1,0,0]=3 479 B9R1.1 CNC1=CN=C(Br)C=C1 D86940 [1,1,0,0,0,0|2,0,0]=4 480 B9R1.1 CNC1=CN=C(C)C=C1 D83365 [1,1,0,0,0,0|2,0,0]=4 481 B9R1.1 CNC1=NC=C(N)C=C1 C74450 [1,1,0,0,0,0|2,0,0]=4 482 B9R1.1 COC1=CN=C(F)C=C1 98092 [1,1,0,0,0,0|2,0,0]=4 483 B9R1.1 C[N+]1=CC=C(C=O)C=C1 D95156 [1,1,0,0,0,0|1,0,0]=3 484 B9R1.1 ClCC1=CC=C(I)C=C1 AB8901 [1,1,0,0,0,0|1,0,1]=4 485 B9R1.1 FCC1=CC=C(Br)C=C1 W10394 [1,1,0,0,0,0|1,0,1]=4 486 B9R1.1 N#CC1=CC=C(S)C=C1 F31167 [1,1,0,0,0,0|1,0,1]=4 487 B9R1.1 NC1=CN=C(C=O)C=C1 D77164 [1,1,0,0,0,0|1,0,0]=3 488 B9R1.1 NC1=CN=C(C=O)C=N1 F31178 [1,1,0,0,0,0|2,0,0]=4 489 B9R1.1 NCC1=CC=C(O)C=C1 AC1832 [1,1,0,0,0,0|1,0,1]=4 490 B9R1.1 O=CC1=CN=C(O)N=C1 86751 [1,1,0,0,0,0|2,0,0]=4 491 B9R1.1 O=CC1=NC=C(Cl)C=N1 P10946 [1,1,0,0,0,0|2,0,0]=4 492 B9R1.1 O=CC1=NN=C(Br)C=C1 P20764 [1,1,0,0,0,0|2,0,0]=4 493 B9R1.1 O=CC1=NN=C(Cl)C=C1 25514 [1,1,0,0,0,0|2,0,0]=4 494 B9R1.1 O=CC1=NN=C(O)C=C1 C77199 [1,1,0,0,0,0|2,0,0]=4 495 B9R1.1 OCC1=CC=C(S)C=C1 Y11017 [1,1,0,0,0,0|0,0,2]=4 496 B9R1.2 C=CC1=CC(Br)=CN=C1 50995 [1,1,0,0,0,0|1,0,1]=4 497 B9R1.2 C=CC1=CC(Br)=NC=C1 60113 [1,1,0,0,0,0|1,0,1]=4 498 B9R1.2 C=CC1=CC(C)=CC=C1 F16162 [1,1,0,0,0,0|0,0,1]=3 499 B9R1.2 C=CC1=CC(C)=CN=C1 79122 [1,1,0,0,0,0|1,0,1]=4 500 B9R1.2 C=CC1=CC=CC(Br)=N1 27481 [1,1,0,0,0,0|1,0,1]=4 501 B9R1.2 C=CC1=NC(C)=CC=C1 C71408 [1,1,0,0,0,0|1,0,1]=4 502 B9R1.2 C=CC1=NC=CC(Br)=C1 C75345 [1,1,0,0,0,0|1,0,1]=4 503 B9R1.2 C=CC1=NC=CC(Cl)=C1 C77362 [1,1,0,0,0,0|1,0,1]=4 504 B9R1.2 C=CC1=NC=CC(N)=C1 D82535 [1,1,0,0,0,0|1,0,1]=4 505 B9R1.2 CC1=CN=CC(C=O)=N1 72066 [1,1,0,0,0,0|2,0,0]=4 506 B9R1.2 CCC1=CC(Br)=CN=C1 25835 [1,1,0,0,0,0|1,0,1]=4 507 B9R1.2 CCC1=CC=CC(Br)=N1 O10692 [1,1,0,0,0,0|1,0,1]=4 508 B9R1.2 CCC1=NC=CC(Br)=C1 S10560 [1,1,0,0,0,0|1,0,1]=4 509 B9R1.2 CNC1=CC(Br)=NC=C1 CS1908 [1,1,0,0,0,0|2,0,0]=4 510 B9R1.2 CNC1=CC(N)=CC=C1 36494 [1,1,0,0,0,0|1,0,0]=3 511 B9R1.2 CNC1=NC=CC(Br)=C1 32749 [1,1,0,0,0,0|2,0,0]=4 512 B9R1.2 CNC1=NC=CC(N)=C1 27435 [1,1,0,0,0,0|2,0,0]=4 513 B9R1.2 COC1=CC(=O)NC=C1 25837 [1,1,0,0,0,0|2,0,0]=4 514 B9R1.2 CSC1=CC(F)=CC=C1 A12732 [1,1,0,0,0,0|1,0,0]=3 515 B9R1.2 CSC1=CC(O)=CC=C1 W12966 [1,1,0,0,0,0|1,0,0]=3 516 B9R1.2 CSC1=CC=CC(Cl)=N1 F14554 [1,1,0,0,0,0|2,0,0]=4 517 B9R1.2 CSC1=NC(N)=CC=C1 W18184 [1,1,0,0,0,0|2,0,0]=4 518 B9R1.2 N#[N+]C1=CC=CC(Br)=C1 98381 [1,1,0,0,0,0|2,0,0]=4 519 B9R1.2 NC1=CC=CC(C=O)=C1 CK2096 [1,1,0,0,0,0|0,0,0]=2 520 B9R1.2 NC1=CC=CC(C=O)=N1 D70565 [1,1,0,0,0,0|1,0,0]=3 521 B9R1.2 NC1=CC=CC(CF)=C1 32172 [1,1,0,0,0,0|1,0,1]=4 522 B9R1.2 O=CC1=CC(Br)=NC=N1 D70857 [1,1,0,0,0,0|2,0,0]=4 523 B9R1.2 O=CC1=CC=CC(=O)N1 N12900 [1,1,0,0,0,0|1,0,0]=3 524 B9R1.2 O=CC1=CC=NC(Cl)=N1 P10948 [1,1,0,0,0,0|2,0,0]=4 525 B9R1.2 O=CC1=CN=CC(Cl)=N1 70892 [1,1,0,0,0,0|2,0,0]=4 526 B9R1.2 O=CC1=C[N+]([O-])=CC=C1 O11007 [1,1,0,0,0,0|1,0,0]=3 527 B9R1.2 O=CC1=NC=CC(O)=C1 W18365 [1,1,0,0,0,0|1,0,0]=3 528 B9R1.2 O=CC1=NC=NC(O)=C1 82364 [1,1,0,0,0,0|2,0,0]=4 529 B9R1.8 BrC#CC1=CC=CC=C1 A51120 [1,1,0,0,0,0|0,0,2]=4 530 B9R1.8 BrCCC1=CC=NC=C1 C71689 [1,1,0,0,0,0|1,0,1]=4 531 B9R1.8 CCNC1=CC=CN=C1 C15578 [1,1,0,0,0,0|1,0,1]=4 532 B9R1.8 CNCC1=CC=NC=C1 AR1712 [1,1,0,0,0,0|1,0,1]=4 533 B9R1.8 ClCCC1=CC=NC=C1 O11064 [1,1,0,0,0,0|1,0,1]=4 534 B9R1.8 N\N=C\C1=CC=CC=C1 D81797 [1,1,0,0,0,0|1,0,0]=3 535 B9R1.8 O\N=C/C1=CC=CC=C1 N10040 [1,1,0,0,0,0|0,0,1]=3 536 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 C11398 [1,1,0,0,0,0|0,0,2]=4 537 B9R1.15 C=CC1=C(N)C=CC=C1 25265 [1,1,0,0,0,0|0,0,1]=3 538 B9R1.15 C=CC1=CC=CN=C1Br 83953 [1,1,0,0,0,0|1,0,1]=4 539 B9R1.15 C=CC1=CC=CN=C1C P11579 [1,1,0,0,0,0|1,0,1]=4 540 B9R1.15 CC1=C(C=O)C=CN=C1 AB10090 [1,1,0,0,0,0|1,0,0]=3 541 B9R1.15 CC1=NC=CN=C1C=O 30985 [1,1,0,0,0,0|2,0,0]=4 542 B9R1.15 CCC1=C(Br)C=CC=N1 P11641 [1,1,0,0,0,0|1,0,1]=4 543 B9R1.15 CCC1=C(Br)C=CN=C1 38064 [1,1,0,0,0,0|1,0,1]=4 544 B9R1.15 CCC1=C(F)C=CC=C1 F20938 [1,1,0,0,0,0|0,0,1]=3 545 B9R1.15 CCC1=C(O)C=CC=N1 71246 [1,1,0,0,0,0|1,0,1]=4 546 B9R1.15 CCC1=CC=CN=C1Br D80252 [1,1,0,0,0,0|1,0,1]=4 547 B9R1.15 CCC1=CC=CN=C1N 55791 [1,1,0,0,0,0|1,0,1]=4 548 B9R1.15 CNC1=C(C)C=CN=C1 C12398 [1,1,0,0,0,0|2,0,0]=4 549 B9R1.15 CNC1=C(I)C=NC=C1 D83398 [1,1,0,0,0,0|2,0,0]=4 550 B9R1.15 CNC1=C(N)C=CN=C1 F51691 [1,1,0,0,0,0|2,0,0]=4 551 B9R1.15 CNC1=C(N)C=NC=C1 C73540 [1,1,0,0,0,0|2,0,0]=4 552 B9R1.15 CNC1=CC=CN=C1N 94808 [1,1,0,0,0,0|2,0,0]=4 553 B9R1.15 CNC1=NC=CC=C1N 72351 [1,1,0,0,0,0|2,0,0]=4 554 B9R1.15 COC1=C(Br)C=CN=C1 26564 [1,1,0,0,0,0|2,0,0]=4 555 B9R1.15 COC1=C(I)C=CN=C1 D82954 [1,1,0,0,0,0|2,0,0]=4 556 B9R1.15 COC1=C(N)C=CN=C1 35474 [1,1,0,0,0,0|2,0,0]=4 557 B9R1.15 COC1=C(O)C=NC=C1 79066 [1,1,0,0,0,0|2,0,0]=4 558 B9R1.15 COC1=NC=CC=C1C C73664 [1,1,0,0,0,0|2,0,0]=4 559 B9R1.15 CSC1=C(F)N=CC=C1 F50785 [1,1,0,0,0,0|2,0,0]=4 560 B9R1.15 CSC1=C(N)C=CN=C1 W16024 [1,1,0,0,0,0|2,0,0]=4 561 B9R1.15 NC1=C(C=O)C=NC=N1 66183 [1,1,0,0,0,0|2,0,0]=4 562 B9R1.15 NC1=CC=CN=C1C=O 80155 [1,1,0,0,0,0|1,0,0]=3 563 B9R1.15 NC1=NC=CN=C1C=O 27460 [1,1,0,0,0,0|2,0,0]=4 564 B9R1.15 NCC1=C(I)C=CC=C1 C75019 [1,1,0,0,0,0|1,0,1]=4 565 B9R1.15 NNC1=C(I)C=CC=C1 C75827 [1,1,0,0,0,0|2,0,0]=4 566 B9R1.15 O=CC1=C(Br)C=CN=C1 P16584 [1,1,0,0,0,0|1,0,0]=3 567 B9R1.15 O=CC1=C(Cl)C=CC=C1 D77644 [1,1,0,0,0,0|0,0,0]=2 568 B9R1.15 O=CC1=C(O)C=CN=C1 P10968 [1,1,0,0,0,0|1,0,0]=3 569 B9R1.15 O=CC1=C(O)C=NC=C1 25615 [1,1,0,0,0,0|1,0,0]=3 570 B9R1.15 O=CC1=NC=CN=C1Br P14054 [1,1,0,0,0,0|2,0,0]=4 571 B9R1.15 O=CC1=NC=CN=C1Cl P10456 [1,1,0,0,0,0|2,0,0]=4 572 B9R1.11 CCC(=O)C1=CNC=N1 D93407 [0,1,0,0,1,0|2,0,0]=4 573 B9R1.11 CCC(=O)C1=COC=C1 N14291 [0,1,0,0,1,0|1,0,0]=3 574 B9R1.11 CCC(=O)C1=NC=CS1 F53520 [0,1,0,0,1,0|2,0,0]=4 575 B9R1.11 CNC(=O)C1=CN=CN1 P16942 [0,1,0,0,1,0|2,0,0]=4 576 B9R1.11 COC(=O)C1=CC=NS1 62854 [0,1,0,0,1,0|2,0,0]=4 577 B9R1.11 COC(=O)C1=COC=N1 22956 [0,1,0,0,1,0|2,0,0]=4 578 B9R1.11 COC(=O)C1=NC=CO1 C74629 [0,1,0,0,1,0|2,0,0]=4 579 B9R1.11 O=C(CBr)C1=CC=CO1 D79351 [0,1,0,0,1,0|1,0,0]=3 580 B9R1.11 O=C(CO)C1=CC=CO1 AC4738 [0,1,0,0,1,0|1,0,0]=3 581 B9R1.11 O=CC(=O)C1=CC=CO1 D94856 [0,1,0,0,1,0|1,0,1]=4 582 B9R1.35 CC(=O)C1=CN=C(Cl)S1 F13142 [0,1,0,0,1,0|2,0,0]=4 583 B9R1.35 CC(=O)C1=CNC(C)=C1 C75858 [0,1,0,0,1,0|1,0,0]=3 584 B9R1.35 CC(=O)C1=CSC(Br)=C1 25953 [0,1,0,0,1,0|1,0,0]=3 585 B9R1.35 CC(=O)C1=CSC(Br)=N1 51523 [0,1,0,0,1,0|2,0,0]=4 586 B9R1.35 CC(=O)C1=CSC(C)=N1 A12305 [0,1,0,0,1,0|2,0,0]=4 587 B9R1.35 CC(=O)C1=CSC(Cl)=C1 37629 [0,1,0,0,1,0|1,0,0]=3 588 B9R1.35 CC(=O)C1=CSC(N)=N1 35110 [0,1,0,0,1,0|2,0,0]=4 589 B9R1.35 CC(=O)C1=NC(Br)=CS1 C15281 [0,1,0,0,1,0|2,0,0]=4 590 B9R1.35 CC(=O)C1=NC(C)=CO1 36487 [0,1,0,0,1,0|2,0,0]=4 591 B9R1.35 CC(=O)C1=NC=C(Br)S1 P10802 [0,1,0,0,1,0|2,0,0]=4 592 B9R1.35 CC(=O)C1=NC=C(C)S1 78720 [0,1,0,0,1,0|2,0,0]=4 593 B9R1.35 CC(=O)C1=NC=C(Cl)S1 P10801 [0,1,0,0,1,0|2,0,0]=4 594 B9R1.35 CC(=O)C1=NN(C)C=C1 P10302 [0,1,0,0,1,0|2,0,0]=4 595 B9R1.35 CC(=O)C1=NNC(C)=C1 Y10230 [0,1,0,0,1,0|2,0,0]=4 596 B9R1.35 CC(=O)C1=NOC(C)=C1 72215 [0,1,0,0,1,0|2,0,0]=4 597 B9R1.35 CC(=O)C1=NOC(N)=C1 88477 [0,1,0,0,1,0|2,0,0]=4 598 B9R1.35 CC(=O)N1C=CC(=O)N1 C76740 [0,1,0,0,1,0|2,0,0]=4 599 B9R1.35 CC1=CC(C(=O)O)=CS1 BL001054 [0,1,0,0,1,0|2,0,0]=4 600 B9R1.35 CN1C=CC(C(=O)O)=C1 26121 [0,1,0,0,1,0|2,0,0]=4 601 B9R1.35 NC(=O)C1=CC(Br)=CN1 C73743 [0,1,0,0,1,0|2,0,0]=4 602 B9R1.35 NC(=O)C1=CC(Br)=CO1 C77306 [0,1,0,0,1,0|2,0,0]=4 603 B9R1.35 NC(=O)C1=CC=C(Br)N1 38755 [0,1,0,0,1,0|2,0,0]=4 604 B9R1.35 NC(=O)C1=CC=C(N)S1 C90315 [0,1,0,0,1,0|2,0,0]=4 605 B9R1.35 NC1=CNC(C(=O)O)=C1 F14489 [0,1,0,0,1,0|2,0,0]=4 606 B9R1.35 O=C(O)C1=CC(Br)=CO1 25418 [0,1,0,0,1,0|2,0,0]=4 607 B9R1.35 O=C(O)C1=CC(Cl)=CS1 24303 [0,1,0,0,1,0|2,0,0]=4 608 B9R1.35 O=C(O)C1=CC(F)=CS1 C10503 [0,1,0,0,1,0|2,0,0]=4 609 B9R1.35 O=C(O)C1=CC(I)=CN1 86089 [0,1,0,0,1,0|2,0,0]=4 610 B9R1.35 O=C(O)C1=CC=C(F)S1 83084 [0,1,0,0,1,0|2,0,0]=4 611 B9R1.35 O=C(O)C1=CC=C(I)S1 C75812 [0,1,0,0,1,0|2,0,0]=4 612 B9R1.35 O=C(O)C1=CNC(Cl)=C1 72647 [0,1,0,0,1,0|2,0,0]=4 613 B9R1.35 O=C(O)C1=CSC(Cl)=C1 24618 [0,1,0,0,1,0|2,0,0]=4 614 B9R1.41 CC(=O)C1=C(C)SC=N1 C72473 [0,1,0,0,1,0|2,0,0]=4 615 B9R1.41 CC(=O)C1=CN=CN1C W13364 [0,1,0,0,1,0|2,0,0]=4 616 B9R1.41 CC(=O)C1=CNC=C1C W17613 [0,1,0,0,1,0|1,0,0]=3 617 B9R1.41 CC(=O)C1=NC=CN1C 38319 [0,1,0,0,1,0|2,0,0]=4 618 B9R1.41 CC1=C(C(=O)O)C=CN1 W10234 [0,1,0,0,1,0|2,0,0]=4 619 B9R1.41 NC(=O)C1=CC=CN1N P15055 [0,1,0,0,1,0|2,0,0]=4 620 B9R1.41 O=C(O)C1=C(Br)C=CN1 C10492 [0,1,0,0,1,0|2,0,0]=4 621 B9R1.41 O=C(O)C1=C(Br)C=CO1 71103 [0,1,0,0,1,0|2,0,0]=4 622 B9R1.41 O=C(O)C1=C(Cl)OC=C1 W18500 [0,1,0,0,1,0|2,0,0]=4 623 B9R1.41 O=C(O)C1=C(Cl)SC=C1 27789 [0,1,0,0,1,0|2,0,0]=4 624 B9R1.41 O=C(O)C1=C(F)C=CN1 91531 [0,1,0,0,1,0|2,0,0]=4 625 B9R1.41 O=C(O)C1=C(I)SC=C1 A11648 [0,1,0,0,1,0|2,0,0]=4 626 B9R1.41 O=C(O)C1=C(O)C=CS1 Y10188 [0,1,0,0,1,0|2,0,0]=4 627 B11R1.20 CC(=O)NC1=CN=C(C)C=C1 N16920 [0,1,0,0,0,1|1,0,0]=3 628 B11R1.20 CC(=O)NC1=CN=C(O)C=C1 C75099 [0,1,0,0,0,1|1,0,0]=3 629 B11R1.20 CC(=O)NC1=NC=C(Br)C=N1 C12628 [0,1,0,0,0,1|2,0,0]=4 630 B11R1.20 CC(=O)NC1=NC=C(O)C=C1 C73008 [0,1,0,0,0,1|1,0,0]=3 631 B11R1.20 CC(=O)NC1=NN=C(Cl)C=C1 F52718 [0,1,0,0,0,1|2,0,0]=4 632 B11R1.20 CC(C)NC1=CC=C(F)C=C1 22289 [0,1,0,0,0,1|1,0,1]=4 633 B11R1.20 CC(C)SC1=CC=C(Br)C=C1 AT20955 [0,1,0,0,0,1|1,0,1]=4 634 B11R1.20 CC1=CC=C(C[C@H](C)N)C=C1 N10874 [0,1,0,0,0,1|1,0,1]=4 635 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 56191 [0,1,0,0,0,1|2,0,0]=4 636 B11R1.20 C[C@H](N)CC1=CC=C(Br)C=C1 84989 [0,1,0,0,0,1|1,0,1]=4 637 B11R1.20 C[C@H](N)CC1=CC=C(Br)C=C1 Y14838 [0,1,0,0,0,1|1,0,1]=4 638 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 N11301 [0,1,0,0,0,1|1,0,1]=4 639 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 N11302 [0,1,0,0,0,1|1,0,1]=4 640 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 Y11173 [0,1,0,0,0,1|1,0,1]=4 641 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 Y11623 [0,1,0,0,0,1|1,0,1]=4 642 B11R1.20 C[C@H](N)CC1=CC=C(O)C=C1 84990 [0,1,0,0,0,1|1,0,1]=4 643 B11R1.20 C[C@H](O)CC1=CC=C(F)C=C1 C75202 [0,1,0,0,0,1|0,0,2]=4 644 B11R1.20 N=C(N)NC1=CC=C(Cl)C=C1 24230 [0,1,0,0,0,1|2,0,0]=4 645 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 69913 [0,1,0,0,0,1|1,0,0]=3 646 B11R1.20 NC(=O)CC1=CN=C(Cl)C=C1 84999 [0,1,0,0,0,1|2,0,0]=4 647 B11R1.20 NC(=O)CC1=NC=C(Br)C=C1 F19774 [0,1,0,0,0,1|2,0,0]=4 648 B11R1.20 NC1=NC=C(CC(=O)O)C=C1 F18175 [0,1,0,0,0,1|2,0,0]=4 649 B11R1.20 O=C(O)CC1=CC=C(S)C=C1 52120 [0,1,0,0,0,1|1,0,0]=3 650 B11R1.20 O=C(O)CC1=NC=C(Cl)C=C1 89138 [0,1,0,0,0,1|2,0,0]=4 651 B11R1.20 O=C(O)CC1=NC=C(F)C=C1 89139 [0,1,0,0,0,1|2,0,0]=4 652 B11R1.20 O=C(O)CC1=NC=C(I)C=C1 P12089 [0,1,0,0,0,1|2,0,0]=4 653 B11R1.20 O=C(O)CC1=NC=C(O)C=C1 W18187 [0,1,0,0,0,1|2,0,0]=4 654 B11R1.36 CC(=O)[C@H](N)C1=CC=CC=C1 N13201 [0,1,0,0,0,1|0,0,0]=2 655 B11R1.36 CC(=O)[C@H](O)C1=CC=CC=C1 AC1336 [0,1,0,0,0,1|0,0,0]=2 656 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 74050 [0,1,0,0,0,1|1,0,1]=4 657 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 F16904 [0,1,0,0,0,1|1,0,1]=4 658 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 Y11074 [0,1,0,0,0,1|1,0,1]=4 659 B11R1.36 C[C@@H](C(=N)N)C1=CC=CC=C1 71885 [0,1,0,0,0,1|2,0,0]=4 660 B11R1.36 C[C@@H](C(=O)O)C1=CN=CC=C1 79624 [0,1,0,0,0,1|2,0,0]=4 661 B11R1.36 C[C@@H](C1=CC=CC=C1)N(C)C A12149 [0,1,0,0,0,1|2,0,0]=4 662 B11R1.36 C[C@@H](O)[C@H](N)C1=CC=CC=C1 N16817 [0,1,0,0,0,1|0,0,2]=4 663 B11R1.36 C[C@H](F)C(=O)C1=CC=CC=C1 C10603 [0,1,0,0,0,1|1,0,1]=4 664 B11R1.36 N[C@@H](C(=O)O)C1=CN=CC=C1 AC7675 [0,1,0,0,0,1|2,0,0]=4 665 B11R1.40 CNC(=O)CC1=CN=CC=C1 C71252 [0,1,0,0,0,1|1,0,0]=3 666 B11R1.40 CNC(=O)OC1=CC=CC=C1 C10489 [0,1,0,0,0,1|0,0,0]=2 667 B11R1.40 COC(=O)CC1=CN=CC=C1 31754 [0,1,0,0,0,1|1,0,0]=3 668 B11R1.40 COC(=O)CC1=NC=NC=C1 P11690 [0,1,0,0,0,1|2,0,0]=4 669 B11R1.40 C[C@@H](C#N)NC1=CC=CC=C1 81451 [0,1,0,0,0,1|1,0,1]=4 670 B11R1.40 C[C@@H](CN)OC1=CC=CC=C1 AR3791 [0,1,0,0,0,1|1,0,1]=4 671 B11R1.40 NCC(=O)CC1=CC=CC=C1 A10565 [0,1,0,0,0,1|0,0,0]=2 672 B11R1.40 NCC(=O)NC1=CC=CC=C1 AB22065 [0,1,0,0,0,1|0,0,0]=2 673 B11R1.40 NCC(=O)NC1=CC=CC=C1 AB22066 [0,1,0,0,0,1|0,0,0]=2 674 B11R1.40 NNC(=O)CC1=CC=NC=C1 25064 [0,1,0,0,0,1|2,0,0]=4 675 B11R1.40 NNC(=O)OC1=CC=CC=C1 Y11606 [0,1,0,0,0,1|1,0,0]=3 676 B11R1.40 N\C(CC1=CC=CC=C1)=N/O W18702 [0,1,0,0,0,1|1,0,1]=4 677 B11R1.40 O=C(CCl)CC1=CC=CC=C1 Y10931 [0,1,0,0,0,1|0,0,0]=2 678 B11R1.40 O=C(CO)NC1=CC=CC=C1 C77599 [0,1,0,0,0,1|0,0,0]=2 679 B11R1.40 OC[C@@H](Br)CC1=CC=CC=C1 D80460 [0,1,0,0,0,1|1,0,1]=4 680 B11R1.86 CC(=O)NC1=C(I)C=CC=C1 AR2168 [0,1,0,0,0,1|0,0,0]=2 681 B11R1.86 CC(C)OC1=C(O)C=CC=C1 D71146 [0,1,0,0,0,1|1,0,1]=4 682 B11R1.86 C[C@H](N)CC1=C(F)C=CC=C1 N10828 [0,1,0,0,0,1|1,0,1]=4 683 B11R1.86 C[C@H](O)CC1=C(Cl)C=CC=C1 D84375 [0,1,0,0,0,1|0,0,2]=4 684 B11R1.86 FC1=C(C=C(Br)Br)C=CC=C1 D79986 [0,1,0,0,0,1|2,0,0]=4 685 B11R1.86 NC(=O)NC1=C(Cl)C=CC=C1 W18608 [0,1,0,0,0,1|1,0,0]=3 686 B11R1.86 O=C(O)CC1=C(Br)C=CC=N1 73446 [0,1,0,0,0,1|2,0,0]=4 687 B11R1.86 O=C(O)CC1=C(F)C=CC=N1 S10090 [0,1,0,0,0,1|2,0,0]=4 688 B11R1.86 O=C(O)CC1=CC=CN=C1Br D85902 [0,1,0,0,0,1|2,0,0]=4 689 B11R1.86 O=C(O)CN1C=CC=CC1=O 71529 [0,1,0,0,0,1|2,0,0]=4 690 B11R1.86 O=C([O-])CC1=C(Cl)C=CC=N1 27510 [0,1,0,0,0,1|2,0,0]=4 691 B11R1.86 O=C([O-])CC1=C(F)C=CC=N1 98377 [0,1,0,0,0,1|2,0,0]=4 692 B11R1.157 CC(=O)NC1=CC(Cl)=NC=N1 79548 [0,1,0,0,0,1|2,0,0]=4 693 B11R1.157 CC(=O)NC1=NC=CC(Br)=C1 36520 [0,1,0,0,0,1|1,0,0]=3 694 B11R1.157 CC(=O)NC1=NC=CC(N)=C1 FD10602 [0,1,0,0,0,1|1,0,0]=3 695 B11R1.157 CC(=O)OC1=CC=CC(Cl)=C1 Y11318 [0,1,0,0,0,1|0,0,0]=2 696 B11R1.157 CC(=O)OC1=CC=CC(I)=C1 C75148 [0,1,0,0,0,1|0,0,0]=2 697 B11R1.157 CC(C)CC1=CC=CC(Br)=C1 C72557 [0,1,0,0,0,1|1,0,1]=4 698 B11R1.157 CC(C)OC1=CC(O)=CC=C1 C13518 [0,1,0,0,0,1|1,0,1]=4 699 B11R1.157 CC1=CC(CC(=O)O)=CN=C1 D80704 [0,1,0,0,0,1|2,0,0]=4 700 B11R1.157 CC1=CC(CC(=O)O)=CN=C1 P17359 [0,1,0,0,0,1|2,0,0]=4 701 B11R1.157 CC1=CC(CC(=O)O)=NC=C1 S10096 [0,1,0,0,0,1|2,0,0]=4 702 B11R1.157 CC1=CC=CC(CC(=O)O)=N1 26369 [0,1,0,0,0,1|2,0,0]=4 703 B11R1.157 CC1=CC=CC(CC(=O)[O-])=N1 36391 [0,1,0,0,0,1|2,0,0]=4 704 B11R1.157 CN(C)CC1=CC=CC(O)=C1 C75839 [0,1,0,0,0,1|2,0,0]=4 705 B11R1.157 C[C@H](N)CC1=CC=CC(Br)=C1 N10830 [0,1,0,0,0,1|1,0,1]=4 706 B11R1.157 C[C@H](N)CC1=CC=CC(Br)=C1 Y11543 [0,1,0,0,0,1|1,0,1]=4 707 B11R1.157 C[C@H](O)CC1=CC=CC(Cl)=C1 W16410 [0,1,0,0,0,1|0,0,2]=4 708 B11R1.157 N=C(N)NC1=CC=CC(Br)=C1 C16548 [0,1,0,0,0,1|2,0,0]=4 709 B11R1.157 NC(=O)CC1=CC(N)=CC=C1 C72191 [0,1,0,0,0,1|1,0,0]=3 710 B11R1.157 NC(=O)CC1=CC=CC(Cl)=C1 57489 [0,1,0,0,0,1|1,0,0]=3 711 B11R1.157 NC1=NC=CC(CC(=O)O)=C1 Y11285 [0,1,0,0,0,1|2,0,0]=4 712 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 39149 [0,1,0,0,0,1|2,0,0]=4 713 B11R1.157 O=C(O)CC1=CC=CC(Br)=N1 C71333 [0,1,0,0,0,1|2,0,0]=4 714 B11R1.157 O=C(O)CC1=CC=CC(Cl)=N1 F14480 [0,1,0,0,0,1|2,0,0]=4 715 B11R1.157 O=C(O)CC1=CC=CC(F)=N1 P10854 [0,1,0,0,0,1|2,0,0]=4 716 B11R1.157 O=C(O)CC1=NC=CC(Br)=C1 C71755 [0,1,0,0,0,1|2,0,0]=4 717 B11R1.509 C[S@](=N)(=O)CC1=CC=CC=C1 W18265 [0,1,0,0,0,1|1,0,0]=3 718 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 A50667 [0,2,0,0,0,0|0,0,0]=2 719 B11R1.3 C#CC1=NC=C(C(=O)O)C=C1 P18107 [0,2,0,0,0,0|2,0,0]=4 720 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 AC1342 [0,2,0,0,0,0|1,0,0]=3 721 B11R1.3 C=CC1=CC=C(N(C)C)C=C1 30617 [0,2,0,0,0,0|2,0,0]=4 722 B11R1.3 C=CC1=CC=C([C@H](C)N)C=C1 Y12652 [0,2,0,0,0,0|1,0,1]=4 723 B11R1.3 C=CC1=CC=C([C@H](C)N)C=C1 Y12653 [0,2,0,0,0,0|1,0,1]=4 724 B11R1.3 C=CC1=CC=C([C@H](C)N)C=C1 Y13029 [0,2,0,0,0,0|1,0,1]=4 725 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 CL9316 [0,2,0,0,0,0|0,0,0]=2 726 B11R1.3 CC(=O)C1=NC=C(C#N)C=C1 W17133 [0,2,0,0,0,0|1,0,0]=3 727 B11R1.3 CC(=O)C1=NC=C(C#N)N=C1 C77133 [0,2,0,0,0,0|2,0,0]=4 728 B11R1.3 CCC1=CC=C([C@H](C)N)C=C1 D81145 [0,2,0,0,0,0|1,0,1]=4 729 B11R1.3 CCC1=CC=C([C@H](C)N)C=C1 Y13670 [0,2,0,0,0,0|1,0,1]=4 730 B11R1.3 CCC1=CN=C(C(=O)O)C=C1 S10908 [0,2,0,0,0,0|2,0,0]=4 731 B11R1.3 CCC1=NC=C(C(=O)O)C=C1 W10833 [0,2,0,0,0,0|2,0,0]=4 732 B11R1.3 CCC1=NC=C(C(C)=O)C=N1 D81149 [0,2,0,0,0,0|2,0,0]=4 733 B11R1.3 CNC1=CC=C(C(C)C)C=C1 D95133 [0,2,0,0,0,0|1,0,1]=4 734 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 C72879 [0,2,0,0,0,0|0,0,2]=4 735 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 C72977 [0,2,0,0,0,0|0,0,2]=4 736 B11R1.3 COC1=CN=C(C(C)=O)C=N1 S10058 [0,2,0,0,0,0|2,0,0]=4 737 B11R1.3 COC1=CN=C(C(C)=O)N=C1 97279 [0,2,0,0,0,0|2,0,0]=4 738 B11R1.3 COC1=NC=C(C(C)=O)C=N1 C71224 [0,2,0,0,0,0|2,0,0]=4 739 B11R1.3 CSC1=CC=C([C@H](C)N)C=C1 AT20995 [0,2,0,0,0,0|1,0,1]=4 740 B11R1.3 CSC1=CC=C([C@H](C)N)C=C1 AT20996 [0,2,0,0,0,0|1,0,1]=4 741 B11R1.3 CSC1=CC=C([C@H](C)N)C=C1 D81124 [0,2,0,0,0,0|1,0,1]=4 742 B11R1.3 C[C@H](N)C1=CC=C(C#N)C=C1 50211 [0,2,0,0,0,0|1,0,1]=4 743 B11R1.3 C[C@H](N)C1=CC=C(C#N)C=C1 72478 [0,2,0,0,0,0|1,0,1]=4 744 B11R1.3 C[C@H](N)C1=CC=C(C#N)C=C1 F16907 [0,2,0,0,0,0|1,0,1]=4 745 B11R1.3 C[C@H](N)C1=CC=C(CO)C=C1 33613 [0,2,0,0,0,0|1,0,1]=4 746 B11R1.3 C[C@H](N)C1=CC=C(CO)C=C1 33618 [0,2,0,0,0,0|1,0,1]=4 747 B11R1.3 C[C@H](N)C1=CC=C(CO)C=C1 33808 [0,2,0,0,0,0|1,0,1]=4 748 B11R1.3 C[C@H](O)C1=CC=C(C#N)C=C1 C13986 [0,2,0,0,0,0|0,0,2]=4 749 B11R1.3 C[S@](=O)C1=CC=C(C#N)C=C1 W16291 [0,2,0,0,0,0|1,0,0]=3 750 B11R1.3 C[S@](=O)C1=CC=C(CN)C=C1 AR2414 [0,2,0,0,0,0|1,0,0]=3 751 B11R1.3 N=C(N)C1=CC=C(C=O)C=C1 F58592 [0,2,0,0,0,0|2,0,0]=4 752 B11R1.3 NC(=O)C1=CC=C(CO)C=C1 D82598 [0,2,0,0,0,0|1,0,0]=3 753 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 W15750 [0,2,0,0,0,0|1,0,0]=3 754 B11R1.3 NCC1=CN=C(C(=O)O)C=C1 N14194 [0,2,0,0,0,0|2,0,0]=4 755 B11R1.3 NCC1=NC=C(C(=O)O)C=C1 51960 [0,2,0,0,0,0|2,0,0]=4 756 B11R1.3 NNC1=CC=C(C(N)=O)C=C1 11076 [0,2,0,0,0,0|1,0,0]=3 757 B11R1.3 NNC1=CC=C([N+](=O)[O-])C=C1 73838 [0,2,0,0,0,0|2,0,0]=4 758 B11R1.3 NOC1=CC=C([N+](=O)[O-])C=C1 O12033 [0,2,0,0,0,0|2,0,0]=4 759 B11R1.3 O=C(O)C1=CN=C(CO)C=C1 P18087 [0,2,0,0,0,0|2,0,0]=4 760 B11R1.3 O=C(O)C1=NC=C(CO)C=C1 C75020 [0,2,0,0,0,0|2,0,0]=4 761 B11R1.19 CC(C)(F)C1=CC=C(Br)C=C1 F51874 [0,2,0,0,0,0|1,0,1]=4 762 B11R1.19 CC(C)(N)C1=CC=C(Br)C=C1 91218 [0,2,0,0,0,0|1,0,1]=4 763 B11R1.19 CC(C)(N)C1=CC=C(F)C=C1 W17967 [0,2,0,0,0,0|1,0,1]=4 764 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 20480 [0,2,0,0,0,0|2,0,0]=4 765 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 55666 [0,2,0,0,0,0|2,0,0]=4 766 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 63204 [0,2,0,0,0,0|2,0,0]=4 767 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 87616 [0,2,0,0,0,0|2,0,0]=4 768 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 91259 [0,2,0,0,0,0|2,0,0]=4 769 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 C73216 [0,2,0,0,0,0|2,0,0]=4 770 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS3396 [0,2,0,0,0,0|2,0,0]=4 771 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS3405 [0,2,0,0,0,0|2,0,0]=4 772 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 D83842 [0,2,0,0,0,0|2,0,0]=4 773 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 F51928 [0,2,0,0,0,0|2,0,0]=4 774 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 H11175 [0,2,0,0,0,0|2,0,0]=4 775 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 P18527 [0,2,0,0,0,0|2,0,0]=4 776 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 S11121 [0,2,0,0,0,0|2,0,0]=4 777 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W10985 [0,2,0,0,0,0|2,0,0]=4 778 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W13813 [0,2,0,0,0,0|2,0,0]=4 779 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W13814 [0,2,0,0,0,0|2,0,0]=4 780 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W13829 [0,2,0,0,0,0|2,0,0]=4 781 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 38109 [0,2,0,0,0,0|2,0,0]=4 782 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 D70941 [0,2,0,0,0,0|2,0,0]=4 783 B11R1.19 CP(C)(=O)C1=CC=C(N)C=C1 C75280 [0,2,0,0,0,0|1,0,0]=3 784 B11R1.19 CS(=O)(=O)C1=CC=C(I)C=C1 AC6545 [0,2,0,0,0,0|1,0,0]=3 785 B11R1.19 CS(=O)(=O)C1=CN=C(Cl)C=C1 91182 [0,2,0,0,0,0|2,0,0]=4 786 B11R1.19 CS(=O)(=O)C1=NC=C(Br)C=C1 P10314 [0,2,0,0,0,0|2,0,0]=4 787 B11R1.19 CS(=O)(=O)C1=NC=C(O)C=C1 F51251 [0,2,0,0,0,0|2,0,0]=4 788 B11R1.19 C[S@](=N)(=O)C1=CC=C(Br)C=C1 W10955 [0,2,0,0,0,0|1,0,0]=3 789 B11R1.19 NC1=CC=C(S(=O)(=O)F)C=C1 D72000 [0,2,0,0,0,0|2,0,0]=4 790 B11R1.19 NC1=CC=C(S(N)(=O)=O)C=C1 I12019 [0,2,0,0,0,0|2,0,0]=4 791 B11R1.19 O=P(O)(O)C1=CC=C(O)C=C1 T72323 [0,2,0,0,0,0|2,0,0]=4 792 B11R1.19 O=S(=O)(Cl)C1=CC=C(O)C=C1 F21306 [0,2,0,0,0,0|2,0,0]=4 793 B11R1.19 O=S(=O)(O)C1=CC=C(S)C=C1 FD13126 [0,2,0,0,0,0|2,0,0]=4 794 B11R1.21 CC(=O)C1=CC(=O)N(C)C=C1 90625 [0,2,0,0,0,0|1,0,0]=3 795 B11R1.21 CC(=O)C1=CC(Br)=C(I)C=C1 C77271 [0,2,0,0,0,0|0,0,0]=2 796 B11R1.21 CC(=O)C1=CC(C)=C(Br)C=N1 F53231 [0,2,0,0,0,0|1,0,0]=3 797 B11R1.21 CC(=O)C1=CC(Cl)=C(N)C=C1 20733 [0,2,0,0,0,0|0,0,0]=2 798 B11R1.21 CC(=O)C1=CC(Cl)=C(O)C=C1 C15500 [0,2,0,0,0,0|0,0,0]=2 799 B11R1.21 CC(=O)C1=CC(I)=C(N)C=C1 21187 [0,2,0,0,0,0|0,0,0]=2 800 B11R1.21 CC(=O)C1=CC(N)=C(C)C=C1 C73283 [0,2,0,0,0,0|0,0,0]=2 801 B11R1.21 CC(=O)C1=CC(N)=C(F)C=C1 FD17092 [0,2,0,0,0,0|0,0,0]=2 802 B11R1.21 CC(=O)C1=CC(N)=C(N)C=C1 D70632 [0,2,0,0,0,0|0,0,0]=2 803 B11R1.21 CC(=O)C1=CC(N)=C(O)C=C1 T71038 [0,2,0,0,0,0|0,0,0]=2 804 B11R1.21 CC(=O)C1=CC(O)=C(Br)C=C1 AB10068 [0,2,0,0,0,0|0,0,0]=2 805 B11R1.21 CC(=O)C1=CN(C)C(=O)C=C1 90627 [0,2,0,0,0,0|1,0,0]=3 806 B11R1.21 CC(=O)C1=CN=C(C)C(C)=C1 D93974 [0,2,0,0,0,0|1,0,0]=3 807 B11R1.21 CC(=O)C1=CN=C(Cl)C(C)=C1 C72016 [0,2,0,0,0,0|1,0,0]=3 808 B11R1.21 CC(=O)C1=CN=C(N)C(C)=C1 D80389 [0,2,0,0,0,0|1,0,0]=3 809 B11R1.21 CC(C)C1=CC(F)=C(Br)C=C1 D93757 [0,2,0,0,0,0|1,0,1]=4 810 B11R1.21 CC(C)C1=CC(I)=C(N)C=C1 F11367 [0,2,0,0,0,0|1,0,1]=4 811 B11R1.21 CC(C)C1=CC(N)=C(N)C=C1 D78649 [0,2,0,0,0,0|1,0,1]=4 812 B11R1.21 CC1=C(Br)C=C(C(=O)O)N=C1 C71660 [0,2,0,0,0,0|2,0,0]=4 813 B11R1.21 CC1=C(Br)C=CC([C@H](C)N)=C1 Y11738 [0,2,0,0,0,0|1,0,1]=4 814 B11R1.21 CC1=C(Br)C=CC([C@H](C)N)=C1 Y12483 [0,2,0,0,0,0|1,0,1]=4 815 B11R1.21 CC1=C(Br)C=CC([C@H](C)N)=C1 Y12484 [0,2,0,0,0,0|1,0,1]=4 816 B11R1.21 CC1=C(Br)C=CC([C@H](C)N)=C1 Y13421 [0,2,0,0,0,0|1,0,1]=4 817 B11R1.21 CC1=C(Br)C=CC([C@H](C)N)=C1 Y13422 [0,2,0,0,0,0|1,0,1]=4 818 B11R1.21 CC1=C(C)C=C([C@H](C)N)C=C1 Y10159 [0,2,0,0,0,0|1,0,1]=4 819 B11R1.21 CC1=C(C)C=C([C@H](C)N)C=C1 Y11763 [0,2,0,0,0,0|1,0,1]=4 820 B11R1.21 CC1=C(C)C=C([C@H](C)N)C=C1 Y13629 [0,2,0,0,0,0|1,0,1]=4 821 B11R1.21 CC1=C(C)C=C([C@H](C)N)C=C1 Y13905 [0,2,0,0,0,0|1,0,1]=4 822 B11R1.21 CC1=C(C)N=C(C(=O)O)C=C1 C76662 [0,2,0,0,0,0|2,0,0]=4 823 B11R1.21 CC1=C(Cl)C=C(C(=O)O)N=C1 O11218 [0,2,0,0,0,0|2,0,0]=4 824 B11R1.21 CC1=C(Cl)C=C([C@H](C)N)C=C1 F16970 [0,2,0,0,0,0|1,0,1]=4 825 B11R1.21 CC1=C(Cl)C=C([C@H](C)N)C=C1 Y11029 [0,2,0,0,0,0|1,0,1]=4 826 B11R1.21 CC1=C(Cl)C=C([C@H](C)N)C=C1 Y11059 [0,2,0,0,0,0|1,0,1]=4 827 B11R1.21 CC1=C(Cl)C=C([C@H](C)N)C=C1 Y11531 [0,2,0,0,0,0|1,0,1]=4 828 B11R1.21 CC1=C(Cl)C=CC([C@H](C)N)=C1 F16962 [0,2,0,0,0,0|1,0,1]=4 829 B11R1.21 CC1=C(Cl)C=CC([C@H](C)N)=C1 Y10261 [0,2,0,0,0,0|1,0,1]=4 830 B11R1.21 CC1=C(Cl)C=CC([C@H](C)N)=C1 Y10483 [0,2,0,0,0,0|1,0,1]=4 831 B11R1.21 CC1=C(Cl)C=CC([C@H](C)N)=C1 Y10896 [0,2,0,0,0,0|1,0,1]=4 832 B11R1.21 CC1=C(Cl)C=CC([C@H](C)O)=C1 W19076 [0,2,0,0,0,0|0,0,2]=4 833 B11R1.21 CC1=C(F)C=C(C(=O)O)C=N1 C10557 [0,2,0,0,0,0|2,0,0]=4 834 B11R1.21 CC1=C(F)C=C([C@H](C)N)C=C1 N10471 [0,2,0,0,0,0|1,0,1]=4 835 B11R1.21 CC1=C(F)C=C([C@H](C)N)C=C1 Y10777 [0,2,0,0,0,0|1,0,1]=4 836 B11R1.21 CC1=C(F)C=C([C@H](C)N)C=C1 Y14522 [0,2,0,0,0,0|1,0,1]=4 837 B11R1.21 CC1=C(F)C=C([C@H](C)N)C=C1 Y14600 [0,2,0,0,0,0|1,0,1]=4 838 B11R1.21 CC1=C(F)C=CC(C(N)=O)=C1 A51175 [0,2,0,0,0,0|1,0,0]=3 839 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 20091 [0,2,0,0,0,0|1,0,1]=4 840 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 20093 [0,2,0,0,0,0|1,0,1]=4 841 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 F16977 [0,2,0,0,0,0|1,0,1]=4 842 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 N14192 [0,2,0,0,0,0|1,0,1]=4 843 B11R1.21 CC1=C(N)C=C(C(C)C)C=C1 34381 [0,2,0,0,0,0|1,0,1]=4 844 B11R1.21 CC1=C(N)C=C([C@H](C)N)C=C1 Y11247 [0,2,0,0,0,0|1,0,1]=4 845 B11R1.21 CC1=C(N)C=C([C@H](C)N)C=C1 Y11248 [0,2,0,0,0,0|1,0,1]=4 846 B11R1.21 CC1=C(O)C=CC(C(C)C)=C1 F14410 [0,2,0,0,0,0|1,0,1]=4 847 B11R1.21 CC1=C(O)N=C(C(=O)O)C=C1 90209 [0,2,0,0,0,0|2,0,0]=4 848 B11R1.21 CC1=C(S)C=CC([N+](=O)[O-])=C1 N16881 [0,2,0,0,0,0|2,0,0]=4 849 B11R1.21 CC1=CC(C(=O)O)=CN=C1C D86774 [0,2,0,0,0,0|2,0,0]=4 850 B11R1.21 CC1=CC(C(=O)O)=CNC1=O RB1153 [0,2,0,0,0,0|2,0,0]=4 851 B11R1.21 CC1=CC(C(N)=O)=CN=C1C D93908 [0,2,0,0,0,0|2,0,0]=4 852 B11R1.21 CC1=CC=C(C(=O)O)N=C1Br 87755 [0,2,0,0,0,0|2,0,0]=4 853 B11R1.21 CC1=NC=C(C(=O)O)C=C1N 38876 [0,2,0,0,0,0|2,0,0]=4 854 B11R1.21 CN(C)C1=CC(N)=C(N)C=C1 F31304 [0,2,0,0,0,0|2,0,0]=4 855 B11R1.21 CN1C=C(C(N)=O)C=CC1=O C76234 [0,2,0,0,0,0|2,0,0]=4 856 B11R1.21 CN1C=CC(C(N)=O)=CC1=O P10284 [0,2,0,0,0,0|2,0,0]=4 857 B11R1.21 C[C@H](Br)C1=CC(F)=C(F)C=C1 C77557 [0,2,0,0,0,0|1,0,1]=4 858 B11R1.21 C[C@H](N)C1=CC(Br)=C(F)C=C1 N10463 [0,2,0,0,0,0|1,0,1]=4 859 B11R1.21 C[C@H](N)C1=CC(Br)=C(F)C=C1 Y10442 [0,2,0,0,0,0|1,0,1]=4 860 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Br)C=C1 N10743 [0,2,0,0,0,0|1,0,1]=4 861 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Br)C=C1 Y10815 [0,2,0,0,0,0|1,0,1]=4 862 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Cl)C=C1 I11039 [0,2,0,0,0,0|1,0,1]=4 863 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Cl)C=C1 N10849 [0,2,0,0,0,0|1,0,1]=4 864 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Cl)C=C1 Y10524 [0,2,0,0,0,0|1,0,1]=4 865 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Cl)C=C1 Y10673 [0,2,0,0,0,0|1,0,1]=4 866 B11R1.21 C[C@H](N)C1=CC(Cl)=C(F)C=C1 N10467 [0,2,0,0,0,0|1,0,1]=4 867 B11R1.21 C[C@H](N)C1=CC(Cl)=C(F)C=C1 N10948 [0,2,0,0,0,0|1,0,1]=4 868 B11R1.21 C[C@H](N)C1=CC(Cl)=C(F)C=C1 Y10300 [0,2,0,0,0,0|1,0,1]=4 869 B11R1.21 C[C@H](N)C1=CC(F)=C(Br)C=C1 Y11210 [0,2,0,0,0,0|1,0,1]=4 870 B11R1.21 C[C@H](N)C1=CC(F)=C(Br)C=C1 Y11211 [0,2,0,0,0,0|1,0,1]=4 871 B11R1.21 C[C@H](N)C1=CC(F)=C(Br)C=C1 Y12971 [0,2,0,0,0,0|1,0,1]=4 872 B11R1.21 C[C@H](N)C1=CC(F)=C(Cl)C=C1 20137 [0,2,0,0,0,0|1,0,1]=4 873 B11R1.21 C[C@H](N)C1=CC(F)=C(Cl)C=C1 F16865 [0,2,0,0,0,0|1,0,1]=4 874 B11R1.21 C[C@H](N)C1=CC(F)=C(Cl)C=C1 N10497 [0,2,0,0,0,0|1,0,1]=4 875 B11R1.21 C[C@H](N)C1=CC(F)=C(F)C=C1 73374 [0,2,0,0,0,0|1,0,1]=4 876 B11R1.21 C[C@H](N)C1=CC(F)=C(F)C=C1 Y10166 [0,2,0,0,0,0|1,0,1]=4 877 B11R1.21 C[C@H](N)C1=CC(F)=C(F)C=C1 Y10893 [0,2,0,0,0,0|1,0,1]=4 878 B11R1.21 N=C(N)C1=CC(Br)=C(F)C=C1 BL001616 [0,2,0,0,0,0|2,0,0]=4 879 B11R1.21 N=C(N)C1=CC(Cl)=C(Cl)C=C1 A12573 [0,2,0,0,0,0|2,0,0]=4 880 B11R1.21 N=C(N)C1=CC(F)=C(F)C=C1 F21414 [0,2,0,0,0,0|2,0,0]=4 881 B11R1.21 N=C(N)C1=CC(N)=C(N)C=C1 25512 [0,2,0,0,0,0|2,0,0]=4 882 B11R1.21 N=C(N)C1=CC(N)=C(N)C=C1 P20972 [0,2,0,0,0,0|2,0,0]=4 883 B11R1.21 NC(=O)C1=CC(F)=C(F)C=C1 D73480 [0,2,0,0,0,0|1,0,0]=3 884 B11R1.21 NC(=O)C1=CC(O)=C(Br)C=C1 AC7242 [0,2,0,0,0,0|1,0,0]=3 885 B11R1.21 NC(=O)C1=CC(O)=C(N)C=C1 Y11587 [0,2,0,0,0,0|1,0,0]=3 886 B11R1.21 NC(=O)C1=CC=C(F)C(Br)=N1 D79819 [0,2,0,0,0,0|2,0,0]=4 887 B11R1.21 NC(=O)C1=CN=C(Br)C(Cl)=C1 W18383 [0,2,0,0,0,0|2,0,0]=4 888 B11R1.21 NC1=C(Br)C=NC(C(=O)O)=C1 P12943 [0,2,0,0,0,0|2,0,0]=4 889 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=N1 D83582 [0,2,0,0,0,0|2,0,0]=4 890 B11R1.21 NC1=C(I)C=CC(C(=O)O)=C1 S10893 [0,2,0,0,0,0|1,0,0]=3 891 B11R1.21 NC1=C(S)C=C([N+](=O)[O-])C=C1 S11317 [0,2,0,0,0,0|2,0,0]=4 892 B11R1.21 NC1=CC(C(=O)O)=CN=C1N C74383 [0,2,0,0,0,0|2,0,0]=4 893 B11R1.21 O=C(O)C1=CC(=O)C(O)=CN1 F31188 [0,2,0,0,0,0|2,0,0]=4 894 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=N1 A51162 [0,2,0,0,0,0|2,0,0]=4 895 B11R1.21 O=C(O)C1=CC(Cl)=C(O)C=N1 P19208 [0,2,0,0,0,0|2,0,0]=4 896 B11R1.21 O=C(O)C1=CC(I)=C(I)C=C1 D84788 [0,2,0,0,0,0|1,0,0]=3 897 B11R1.21 O=C(O)C1=CC(I)=C(O)C=C1 CK2246 [0,2,0,0,0,0|1,0,0]=3 898 B11R1.21 O=C(O)C1=CC=C(Br)C(Br)=N1 22742 [0,2,0,0,0,0|2,0,0]=4 899 B11R1.21 O=C(O)C1=CC=C(Cl)C(Br)=N1 22761 [0,2,0,0,0,0|2,0,0]=4 900 B11R1.21 O=C(O)C1=CN=C(Br)C(F)=C1 31381 [0,2,0,0,0,0|2,0,0]=4 901 B11R1.21 O=C(O)C1=CN=C(Cl)C(F)=C1 24357 [0,2,0,0,0,0|2,0,0]=4 902 B11R1.21 O=C(O)C1=CN=C(F)C(F)=C1 P10667 [0,2,0,0,0,0|2,0,0]=4 903 B11R1.21 O=C(O)C1=CNC(=O)C(O)=C1 AC2078 [0,2,0,0,0,0|2,0,0]=4 904 B11R1.21 O=[N+]([O-])C1=CC(I)=C(Br)C=C1 W18337 [0,2,0,0,0,0|2,0,0]=4 905 B11R1.22 C#CC(=O)C1=CC=C(F)C=C1 W16135 [0,2,0,0,0,0|0,0,1]=3 906 B11R1.22 C=CC(=O)C1=CC=C(F)C=C1 AB9399 [0,2,0,0,0,0|0,0,1]=3 907 B11R1.22 CC1=CC=C(C(=O)CCl)C=C1 D93745 [0,2,0,0,0,0|0,0,0]=2 908 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 D81498 [0,2,0,0,0,0|1,0,1]=4 909 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 N10531 [0,2,0,0,0,0|1,0,1]=4 910 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 N11058 [0,2,0,0,0,0|1,0,1]=4 911 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 N11096 [0,2,0,0,0,0|1,0,1]=4 912 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 Y10547 [0,2,0,0,0,0|1,0,1]=4 913 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 Y13360 [0,2,0,0,0,0|1,0,1]=4 914 B11R1.22 CCC(=O)C1=CN=C(Cl)C=C1 F13171 [0,2,0,0,0,0|1,0,0]=3 915 B11R1.22 CCC(=O)C1=NC=C(Br)C=C1 N14256 [0,2,0,0,0,0|1,0,0]=3 916 B11R1.22 CCC(=O)C1=NC=C(Cl)C=C1 D81575 [0,2,0,0,0,0|1,0,0]=3 917 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 F16933 [0,2,0,0,0,0|1,0,1]=4 918 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 N10949 [0,2,0,0,0,0|1,0,1]=4 919 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 N10950 [0,2,0,0,0,0|1,0,1]=4 920 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 N12584 [0,2,0,0,0,0|1,0,1]=4 921 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 Y10817 [0,2,0,0,0,0|1,0,1]=4 922 B11R1.22 CC[C@H](N)C1=CC=C(C)C=C1 Y10160 [0,2,0,0,0,0|1,0,1]=4 923 B11R1.22 CC[C@H](N)C1=CC=C(C)C=C1 Y10161 [0,2,0,0,0,0|1,0,1]=4 924 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 D81275 [0,2,0,0,0,0|1,0,1]=4 925 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 S11131 [0,2,0,0,0,0|1,0,1]=4 926 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 Y11768 [0,2,0,0,0,0|1,0,1]=4 927 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y10163 [0,2,0,0,0,0|1,0,1]=4 928 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y10164 [0,2,0,0,0,0|1,0,1]=4 929 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y10653 [0,2,0,0,0,0|1,0,1]=4 930 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y11063 [0,2,0,0,0,0|1,0,1]=4 931 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y11174 [0,2,0,0,0,0|1,0,1]=4 932 B11R1.22 CC[C@H](N)C1=CC=C(I)C=C1 Y14552 [0,2,0,0,0,0|1,0,1]=4 933 B11R1.22 CC[C@H](N)C1=CC=C(I)C=C1 Y14553 [0,2,0,0,0,0|1,0,1]=4 934 B11R1.22 CC[C@H](N)C1=CC=C(O)C=C1 N12238 [0,2,0,0,0,0|1,0,1]=4 935 B11R1.22 CC[C@H](O)C1=CC=C(Br)C=C1 AB6446 [0,2,0,0,0,0|0,0,2]=4 936 B11R1.22 CNC(=O)C1=CC=C(Cl)C=C1 D83483 [0,2,0,0,0,0|0,0,0]=2 937 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 29238 [0,2,0,0,0,0|0,0,0]=2 938 B11R1.22 CN[C@@H](C)C1=CC=C(Br)C=C1 N10761 [0,2,0,0,0,0|1,0,1]=4 939 B11R1.22 CN[C@@H](C)C1=CC=C(Br)C=C1 Y10719 [0,2,0,0,0,0|1,0,1]=4 940 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 F16874 [0,2,0,0,0,0|1,0,1]=4 941 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 F16927 [0,2,0,0,0,0|1,0,1]=4 942 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y10862 [0,2,0,0,0,0|1,0,1]=4 943 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y10897 [0,2,0,0,0,0|1,0,1]=4 944 B11R1.22 CN[C@@H](C)C1=CC=C(F)C=C1 N13109 [0,2,0,0,0,0|1,0,1]=4 945 B11R1.22 COC(=O)C1=CC=C(S)C=C1 W12575 [0,2,0,0,0,0|0,0,0]=2 946 B11R1.22 COC(=O)C1=CNC(=O)N=C1 C75373 [0,2,0,0,0,0|2,0,0]=4 947 B11R1.22 COC(=O)C1=CNC(=O)N=C1 F12628 [0,2,0,0,0,0|2,0,0]=4 948 B11R1.22 COC(=O)C1=NC=C(C)C=N1 37740 [0,2,0,0,0,0|2,0,0]=4 949 B11R1.22 COC(=O)C1=NC=C(Cl)C=N1 72490 [0,2,0,0,0,0|2,0,0]=4 950 B11R1.22 COC(=O)C1=NC=C(F)C=N1 28016 [0,2,0,0,0,0|2,0,0]=4 951 B11R1.22 COC(=O)C1=NC=C(N)C=N1 P13628 [0,2,0,0,0,0|2,0,0]=4 952 B11R1.22 COC(=O)C1=NC=C(O)C=N1 P14075 [0,2,0,0,0,0|2,0,0]=4 953 B11R1.22 COC(=O)C1=NN=C(Br)C=C1 72416 [0,2,0,0,0,0|2,0,0]=4 954 B11R1.22 COC(=O)C1=NN=C(C)C=C1 29806 [0,2,0,0,0,0|2,0,0]=4 955 B11R1.22 COC(=O)C1=NN=C(N)C=C1 30525 [0,2,0,0,0,0|2,0,0]=4 956 B11R1.22 C[C@@H](CN)C1=CC=C(Br)C=C1 84993 [0,2,0,0,0,0|1,0,1]=4 957 B11R1.22 N#CC(=O)C1=CC=C(Br)C=C1 AB1242 [0,2,0,0,0,0|0,0,1]=3 958 B11R1.22 NC[C@H](O)C1=CC=C(Cl)C=C1 C78214 [0,2,0,0,0,0|0,0,2]=4 959 B11R1.22 NNC(=O)C1=NC=C(F)C=C1 26252 [0,2,0,0,0,0|2,0,0]=4 960 B11R1.22 NNC(=S)C1=CC=C(Cl)C=C1 W10978 [0,2,0,0,0,0|1,1,0]=4 961 B11R1.22 NNC(=S)C1=CC=C(F)C=C1 W10976 [0,2,0,0,0,0|1,1,0]=4 962 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 D83092 [0,2,0,0,0,0|1,0,1]=4 963 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 I11041 [0,2,0,0,0,0|1,0,1]=4 964 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 I11043 [0,2,0,0,0,0|1,0,1]=4 965 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 I11713 [0,2,0,0,0,0|1,0,1]=4 966 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 Y11114 [0,2,0,0,0,0|1,0,1]=4 967 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 N10527 [0,2,0,0,0,0|1,0,1]=4 968 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 N10528 [0,2,0,0,0,0|1,0,1]=4 969 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 Y10651 [0,2,0,0,0,0|1,0,1]=4 970 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 Y10776 [0,2,0,0,0,0|1,0,1]=4 971 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 F16942 [0,2,0,0,0,0|1,0,1]=4 972 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 I11004 [0,2,0,0,0,0|1,0,1]=4 973 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 I11005 [0,2,0,0,0,0|1,0,1]=4 974 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 I11499 [0,2,0,0,0,0|1,0,1]=4 975 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 Y10343 [0,2,0,0,0,0|1,0,1]=4 976 B11R1.22 N[C@@H](CO)C1=CC=C(I)C=C1 N10665 [0,2,0,0,0,0|1,0,1]=4 977 B11R1.22 N[C@@H](CO)C1=CC=C(I)C=C1 Y12067 [0,2,0,0,0,0|1,0,1]=4 978 B11R1.22 N[C@@H](CO)C1=CC=C(I)C=C1 Y12960 [0,2,0,0,0,0|1,0,1]=4 979 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 Y10690 [0,2,0,0,0,0|1,0,1]=4 980 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 Y10915 [0,2,0,0,0,0|1,0,1]=4 981 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 Y11472 [0,2,0,0,0,0|1,0,1]=4 982 B11R1.22 N\C(=N/O)C1=CC=C(Cl)C=C1 A12574 [0,2,0,0,0,0|1,0,1]=4 983 B11R1.22 N\C(=N/O)C1=CC=C(O)C=C1 60210 [0,2,0,0,0,0|1,0,1]=4 984 B11R1.22 O=C(CBr)C1=CN=C(Br)C=C1 D94486 [0,2,0,0,0,0|1,0,0]=3 985 B11R1.22 O=C(CBr)C1=NC=C(Cl)C=C1 80107 [0,2,0,0,0,0|1,0,0]=3 986 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 77934 [0,2,0,0,0,0|0,0,0]=2 987 B11R1.22 O=C(CCl)C1=CN=C(Cl)C=C1 83967 [0,2,0,0,0,0|1,0,0]=3 988 B11R1.22 O=C(CCl)C1=NC=C(F)C=C1 AC1560 [0,2,0,0,0,0|1,0,0]=3 989 B11R1.22 O=C(CO)C1=CC=C(I)C=C1 27936 [0,2,0,0,0,0|0,0,0]=2 990 B11R1.22 OC[C@H](O)C1=CC=C(Br)C=C1 11739 [0,2,0,0,0,0|0,0,2]=4 991 B11R1.22 O\N=C(/Cl)C1=CC=C(Br)C=C1 65916 [0,2,0,0,0,0|1,0,1]=4 992 B11R1.22 O\N=C(/Cl)C1=CC=C(Cl)C=C1 A12381 [0,2,0,0,0,0|1,0,1]=4 993 B11R1.166 CC(=O)C1=C(Br)C=C(C)C=C1 77817 [0,2,0,0,0,0|0,0,0]=2 994 B11R1.166 CC(=O)C1=C(Br)C=C(N)C=C1 34088 [0,2,0,0,0,0|0,0,0]=2 995 B11R1.166 CC(=O)C1=C(Br)C=C(O)C=C1 52517 [0,2,0,0,0,0|0,0,0]=2 996 B11R1.166 CC(=O)C1=C(C)C=C(C)N=C1 79163 [0,2,0,0,0,0|1,0,0]=3 997 B11R1.166 CC(=O)C1=C(Cl)C=C(F)C=N1 BL010219 [0,2,0,0,0,0|1,0,0]=3 998 B11R1.166 CC(=O)C1=C(Cl)C=C(N)C=C1 I12065 [0,2,0,0,0,0|0,0,0]=2 999 B11R1.166 CC(=O)C1=C(Cl)N=C(Cl)N=C1 85285 [0,2,0,0,0,0|2,0,0]=4 1000 B11R1.166 CC(=O)C1=C(F)C=C(F)C=N1 50881 [0,2,0,0,0,0|1,0,0]=3 1001 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 W18192 [0,2,0,0,0,0|0,0,0]=2 1002 B11R1.166 CC(=O)C1=CC=C(F)N=C1F O10255 [0,2,0,0,0,0|1,0,0]=3 1003 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1Cl 86422 [0,2,0,0,0,0|1,0,0]=3 1004 B11R1.166 CC(=O)C1=NC=C(Br)C=C1C C14359 [0,2,0,0,0,0|1,0,0]=3 1005 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1C D79870 [0,2,0,0,0,0|1,0,0]=3 1006 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1F BL010223 [0,2,0,0,0,0|1,0,0]=3 1007 B11R1.166 CC(C)C1=C(O)C=C(N)C=C1 F51191 [0,2,0,0,0,0|1,0,1]=4 1008 B11R1.166 CC1=C(C(=O)O)C=CC(I)=C1 31871 [0,2,0,0,0,0|1,0,0]=3 1009 B11R1.166 CC1=C(C(=O)O)C=NC(N)=C1 W11094 [0,2,0,0,0,0|2,0,0]=4 1010 B11R1.166 CC1=C(C(C)C)C=CC(N)=C1 A12536 [0,2,0,0,0,0|1,0,1]=4 1011 B11R1.166 CC1=C([C@H](C)N)C=CC(Cl)=C1 Y10861 [0,2,0,0,0,0|1,0,1]=4 1012 B11R1.166 CC1=C([C@H](C)N)C=CC(Cl)=C1 Y10895 [0,2,0,0,0,0|1,0,1]=4 1013 B11R1.166 CC1=C([C@H](C)N)C=CC(Cl)=C1 Y11476 [0,2,0,0,0,0|1,0,1]=4 1014 B11R1.166 CC1=C([C@H](C)N)C=CC(Cl)=C1 Y11477 [0,2,0,0,0,0|1,0,1]=4 1015 B11R1.166 CC1=C([C@H](C)N)C=CC(F)=C1 Y11919 [0,2,0,0,0,0|1,0,1]=4 1016 B11R1.166 CC1=C([C@H](C)N)C=CC(F)=C1 Y11920 [0,2,0,0,0,0|1,0,1]=4 1017 B11R1.166 CC1=C([C@H](C)N)C=CC(F)=C1 Y12621 [0,2,0,0,0,0|1,0,1]=4 1018 B11R1.166 CC1=C([N+](=O)[O-])C=CC(I)=C1 D71992 [0,2,0,0,0,0|2,0,0]=4 1019 B11R1.166 CC1=C([N+](=O)[O-])C=CC(S)=C1 N16874 [0,2,0,0,0,0|2,0,0]=4 1020 B11R1.166 CC1=CC(C)=C([C@H](C)N)C=C1 Y11487 [0,2,0,0,0,0|1,0,1]=4 1021 B11R1.166 CC1=CC(Cl)=C([C@H](C)N)C=C1 D81528 [0,2,0,0,0,0|1,0,1]=4 1022 B11R1.166 CC1=CC(F)=C(C(=O)O)N=C1 P12274 [0,2,0,0,0,0|2,0,0]=4 1023 B11R1.166 CC1=NC(N)=C(C(N)=O)C=C1 D83361 [0,2,0,0,0,0|2,0,0]=4 1024 B11R1.166 C[C@H](N)C1=C(Br)C=C(F)C=C1 20177 [0,2,0,0,0,0|1,0,1]=4 1025 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Cl)C=C1 D81223 [0,2,0,0,0,0|1,0,1]=4 1026 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Cl)C=C1 Y10218 [0,2,0,0,0,0|1,0,1]=4 1027 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Cl)C=C1 Y10360 [0,2,0,0,0,0|1,0,1]=4 1028 B11R1.166 C[C@H](N)C1=C(Cl)C=C(F)C=C1 D80666 [0,2,0,0,0,0|1,0,1]=4 1029 B11R1.166 C[C@H](N)C1=C(Cl)C=C(F)C=C1 D81664 [0,2,0,0,0,0|1,0,1]=4 1030 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 41021 [0,2,0,0,0,0|1,0,1]=4 1031 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 41031 [0,2,0,0,0,0|1,0,1]=4 1032 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 N10675 [0,2,0,0,0,0|1,0,1]=4 1033 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 N10686 [0,2,0,0,0,0|1,0,1]=4 1034 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 Y10648 [0,2,0,0,0,0|1,0,1]=4 1035 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 Y11061 [0,2,0,0,0,0|1,0,1]=4 1036 B11R1.166 C[C@H](N)C1=C(F)C=C(Cl)C=C1 N16827 [0,2,0,0,0,0|1,0,1]=4 1037 B11R1.166 C[C@H](N)C1=C(F)C=C(Cl)C=C1 N16937 [0,2,0,0,0,0|1,0,1]=4 1038 B11R1.166 C[C@H](N)C1=C(F)C=C(Cl)C=C1 N17056 [0,2,0,0,0,0|1,0,1]=4 1039 B11R1.166 C[C@H](N)C1=C(F)C=C(F)C=C1 N10465 [0,2,0,0,0,0|1,0,1]=4 1040 B11R1.166 NC(=O)C1=C(Br)C=C(Br)C=C1 35389 [0,2,0,0,0,0|1,0,0]=3 1041 B11R1.166 NC(=O)C1=C(Br)C=C(I)C=C1 C72078 [0,2,0,0,0,0|1,0,0]=3 1042 B11R1.166 NC(=O)C1=C(Cl)C=C(Cl)C=N1 RB3269 [0,2,0,0,0,0|2,0,0]=4 1043 B11R1.166 NC(=O)C1=C(N)C=C(F)C=C1 25114 [0,2,0,0,0,0|1,0,0]=3 1044 B11R1.166 NC(=O)C1=C(N)C=C(O)C=C1 C76630 [0,2,0,0,0,0|1,0,0]=3 1045 B11R1.166 NC(=O)C1=C(O)C=C(Cl)C=C1 72118 [0,2,0,0,0,0|1,0,0]=3 1046 B11R1.166 NC(=O)C1=C(O)C=C(N)C=C1 O11153 [0,2,0,0,0,0|1,0,0]=3 1047 B11R1.166 NC(=O)C1=C(O)N=C(O)C=C1 95017 [0,2,0,0,0,0|2,0,0]=4 1048 B11R1.166 NC(=O)C1=CC=C(N)N=C1F F20207 [0,2,0,0,0,0|2,0,0]=4 1049 B11R1.166 NC(=O)C1=NC=C(Br)C=C1F D79818 [0,2,0,0,0,0|2,0,0]=4 1050 B11R1.166 NC(=O)C1=NC=C(Cl)C=C1F D79885 [0,2,0,0,0,0|2,0,0]=4 1051 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=N1 I11984 [0,2,0,0,0,0|2,0,0]=4 1052 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O 38415 [0,2,0,0,0,0|2,0,0]=4 1053 B11R1.166 NC1=CC(F)=NC=C1C(=O)O 37635 [0,2,0,0,0,0|2,0,0]=4 1054 B11R1.166 NC1=CC(N)=C(C(=O)O)C=C1 D95034 [0,2,0,0,0,0|1,0,0]=3 1055 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)N=C1 F11789 [0,2,0,0,0,0|2,0,0]=4 1056 B11R1.166 O=C(O)C1=C(Br)C=C(O)C=C1 C13381 [0,2,0,0,0,0|1,0,0]=3 1057 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=N1 BL010109 [0,2,0,0,0,0|2,0,0]=4 1058 B11R1.166 O=C(O)C1=C(Cl)N=C(Br)C=C1 F10539 [0,2,0,0,0,0|2,0,0]=4 1059 B11R1.166 O=C(O)C1=C(F)C=C(O)C=N1 D79760 [0,2,0,0,0,0|2,0,0]=4 1060 B11R1.166 O=C(O)C1=C(F)N=C(Cl)C=C1 RB3340 [0,2,0,0,0,0|2,0,0]=4 1061 B11R1.166 O=C(O)C1=CC=C(F)N=C1Br F30561 [0,2,0,0,0,0|2,0,0]=4 1062 B11R1.166 O=C(O)C1=CC=C(F)N=C1Cl W16949 [0,2,0,0,0,0|2,0,0]=4 1063 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Br F11779 [0,2,0,0,0,0|2,0,0]=4 1064 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Cl F11857 [0,2,0,0,0,0|2,0,0]=4 1065 B11R1.166 O=C(O)C1=CN=C(F)C=C1F S10764 [0,2,0,0,0,0|2,0,0]=4 1066 B11R1.166 O=C(O)C1=NC=C(Br)C=C1O 54575 [0,2,0,0,0,0|2,0,0]=4 1067 B11R1.166 O=[N+]([O-])C1=C(Cl)C=C(Br)C=C1 Y12426 [0,2,0,0,0,0|2,0,0]=4 1068 B11R1.166 O=[N+]([O-])C1=C(I)C=C(O)C=C1 23870 [0,2,0,0,0,0|2,0,0]=4 1069 B11R1.7 C[C@](N)(CO)C1=CC=CC=C1 66215 [0,2,0,0,0,0|0,0,2]=4 1070 B11R1.7 NCC(F)(F)C1=CC=CC=C1 P11064 [0,2,0,0,0,0|1,0,1]=4 1071 B11R1.12 CN[C@@H](CO)C1=CC=CC=C1 Y10222 [0,2,0,0,0,0|0,0,2]=4 1072 B11R1.12 NC[C@@H](CO)C1=CC=CC=C1 70910 [0,2,0,0,0,0|0,0,2]=4 1073 B11R1.16 C=CC[C@H](N)C1=CC=CC=C1 I11297 [0,2,0,0,0,0|1,0,1]=4 1074 B11R1.16 C=CC[C@H](N)C1=CC=CC=C1 Y10366 [0,2,0,0,0,0|1,0,1]=4 1075 B11R1.16 C=CC[C@H](N)C1=CC=CC=C1 Y12585 [0,2,0,0,0,0|1,0,1]=4 1076 B11R1.16 C=CC[C@H](N)C1=CC=CC=C1 Y13293 [0,2,0,0,0,0|1,0,1]=4 1077 B11R1.16 CCCC(=O)C1=CN=CC=C1 N12405 [0,2,0,0,0,0|1,0,0]=3 1078 B11R1.16 CCCC(=O)C1=NC=CC=C1 55420 [0,2,0,0,0,0|1,0,0]=3 1079 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 Y10270 [0,2,0,0,0,0|1,0,1]=4 1080 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 Y11637 [0,2,0,0,0,0|1,0,1]=4 1081 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 Y11944 [0,2,0,0,0,0|1,0,1]=4 1082 B11R1.16 COC[C@H](N)C1=CC=CC=C1 N12553 [0,2,0,0,0,0|1,0,1]=4 1083 B11R1.16 CONC(=O)C1=CC=CC=C1 W17974 [0,2,0,0,0,0|0,0,0]=2 1084 B11R1.16 C[C@@H](CCN)C1=CC=CC=C1 AC6042 [0,2,0,0,0,0|1,0,1]=4 1085 B11R1.16 C[C@H](N=C=O)C1=CC=CC=C1 D87824 [0,2,0,0,0,0|0,0,1]=3 1086 B11R1.16 N#CC[C@H](O)C1=CC=CC=C1 AB1470 [0,2,0,0,0,0|0,0,2]=4 1087 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 65208 [0,2,0,0,0,0|1,0,1]=4 1088 B11R1.16 O=C(CCO)C1=CC=CC=C1 A11168 [0,2,0,0,0,0|0,0,0]=2 1089 B11R1.23 CC1=CC(C(=O)NN)=CN=C1 79461 [0,2,0,0,0,0|2,0,0]=4 1090 B11R1.23 CC1=CC=CC(C(=O)CBr)=C1 S10680 [0,2,0,0,0,0|0,0,0]=2 1091 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 N11093 [0,2,0,0,0,0|1,0,1]=4 1092 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 N11094 [0,2,0,0,0,0|1,0,1]=4 1093 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 N11207 [0,2,0,0,0,0|1,0,1]=4 1094 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 Y10647 [0,2,0,0,0,0|1,0,1]=4 1095 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 Y10654 [0,2,0,0,0,0|1,0,1]=4 1096 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 Y12450 [0,2,0,0,0,0|1,0,1]=4 1097 B11R1.23 CCC(=O)C1=CC(F)=CN=C1 D81551 [0,2,0,0,0,0|1,0,0]=3 1098 B11R1.23 CCC(=O)C1=CC=CC(Br)=N1 F50478 [0,2,0,0,0,0|1,0,0]=3 1099 B11R1.23 CCC(=O)C1=NC=CC(Cl)=C1 FD10573 [0,2,0,0,0,0|1,0,0]=3 1100 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 N11059 [0,2,0,0,0,0|1,0,1]=4 1101 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 N11060 [0,2,0,0,0,0|1,0,1]=4 1102 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 N13204 [0,2,0,0,0,0|1,0,1]=4 1103 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 N14300 [0,2,0,0,0,0|1,0,1]=4 1104 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 Y12439 [0,2,0,0,0,0|1,0,1]=4 1105 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 Y13349 [0,2,0,0,0,0|1,0,1]=4 1106 B11R1.23 CC[C@H](N)C1=CC=CC(Br)=C1 N10470 [0,2,0,0,0,0|1,0,1]=4 1107 B11R1.23 CC[C@H](N)C1=CC=CC(Br)=C1 N10952 [0,2,0,0,0,0|1,0,1]=4 1108 B11R1.23 CC[C@H](N)C1=CC=CC(Br)=C1 N11195 [0,2,0,0,0,0|1,0,1]=4 1109 B11R1.23 CC[C@H](N)C1=CC=CC(Br)=C1 Y10721 [0,2,0,0,0,0|1,0,1]=4 1110 B11R1.23 CC[C@H](N)C1=CC=CC(Br)=C1 Y11058 [0,2,0,0,0,0|1,0,1]=4 1111 B11R1.23 CC[C@H](N)C1=CC=CC(Cl)=C1 Y10291 [0,2,0,0,0,0|1,0,1]=4 1112 B11R1.23 CC[C@H](N)C1=CC=CC(F)=C1 20089 [0,2,0,0,0,0|1,0,1]=4 1113 B11R1.23 CC[C@H](N)C1=CC=CC(F)=C1 N10472 [0,2,0,0,0,0|1,0,1]=4 1114 B11R1.23 CC[C@H](N)C1=CC=CC(F)=C1 N10473 [0,2,0,0,0,0|1,0,1]=4 1115 B11R1.23 CC[C@H](N)C1=CC=CC(F)=C1 Y10473 [0,2,0,0,0,0|1,0,1]=4 1116 B11R1.23 CC[C@H](N)C1=CC=CC(F)=C1 Y11089 [0,2,0,0,0,0|1,0,1]=4 1117 B11R1.23 CC[C@H](N)C1=CC=CC(O)=C1 Y14524 [0,2,0,0,0,0|1,0,1]=4 1118 B11R1.23 CNC(=O)C1=CC(Br)=CN=C1 A12089 [0,2,0,0,0,0|1,0,0]=3 1119 B11R1.23 CNC(=O)C1=NC=CC(Br)=C1 D80651 [0,2,0,0,0,0|1,0,0]=3 1120 B11R1.23 CN[C@@H](C)C1=CC(C)=CC=C1 Y11601 [0,2,0,0,0,0|1,0,1]=4 1121 B11R1.23 CN[C@@H](C)C1=CC(C)=CC=C1 Y12434 [0,2,0,0,0,0|1,0,1]=4 1122 B11R1.23 CN[C@@H](C)C1=CC=CC(Br)=C1 Y10927 [0,2,0,0,0,0|1,0,1]=4 1123 B11R1.23 CN[C@@H](C)C1=CC=CC(Cl)=C1 Y12192 [0,2,0,0,0,0|1,0,1]=4 1124 B11R1.23 CN[C@@H](C)C1=CC=CC(Cl)=C1 Y13371 [0,2,0,0,0,0|1,0,1]=4 1125 B11R1.23 CN[C@@H](C)C1=CC=CC(Cl)=C1 Y13372 [0,2,0,0,0,0|1,0,1]=4 1126 B11R1.23 CN[C@@H](C)C1=CC=CC(Cl)=C1 Y13373 [0,2,0,0,0,0|1,0,1]=4 1127 B11R1.23 CN[C@@H](C)C1=CC=CC(F)=C1 Y14837 [0,2,0,0,0,0|1,0,1]=4 1128 B11R1.23 CN[C@@H](C)C1=CC=CC(F)=C1 Y14849 [0,2,0,0,0,0|1,0,1]=4 1129 B11R1.23 COC(=O)C1=CC(=O)C=CN1 C77360 [0,2,0,0,0,0|1,0,0]=3 1130 B11R1.23 COC(=O)C1=CC(Br)=NC=N1 C71735 [0,2,0,0,0,0|2,0,0]=4 1131 B11R1.23 COC(=O)C1=CC(F)=NC=C1 C10485 [0,2,0,0,0,0|1,0,0]=3 1132 B11R1.23 COC(=O)C1=CN=CC(Br)=N1 25757 [0,2,0,0,0,0|2,0,0]=4 1133 B11R1.23 COC(=O)C1=NC(=O)NC=C1 C77281 [0,2,0,0,0,0|2,0,0]=4 1134 B11R1.23 COC(=O)C1=NC(C)=NC=C1 90607 [0,2,0,0,0,0|2,0,0]=4 1135 B11R1.23 COC(=O)C1=NC(N)=CC=N1 AT18258 [0,2,0,0,0,0|2,0,0]=4 1136 B11R1.23 COC(=O)C1=NC(N)=NC=C1 H10331 [0,2,0,0,0,0|2,0,0]=4 1137 B11R1.23 COC(=O)C1=NC=NC(C)=C1 P11578 [0,2,0,0,0,0|2,0,0]=4 1138 B11R1.23 COC(=O)C1=NC=NC(N)=C1 39272 [0,2,0,0,0,0|2,0,0]=4 1139 B11R1.23 COC(=O)C1=NN=CC(C)=C1 F30429 [0,2,0,0,0,0|2,0,0]=4 1140 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13444 [0,2,0,0,0,0|1,0,1]=4 1141 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 Y10361 [0,2,0,0,0,0|0,0,2]=4 1142 B11R1.23 NNC(=O)C1=CC=CC(=O)N1 C77301 [0,2,0,0,0,0|2,0,0]=4 1143 B11R1.23 NNC(=O)C1=NC(N)=CC=C1 F13874 [0,2,0,0,0,0|2,0,0]=4 1144 B11R1.23 NNC(=O)C1=NC=CC(Cl)=C1 F19685 [0,2,0,0,0,0|2,0,0]=4 1145 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 I11040 [0,2,0,0,0,0|1,0,1]=4 1146 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 I11042 [0,2,0,0,0,0|1,0,1]=4 1147 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 N11209 [0,2,0,0,0,0|1,0,1]=4 1148 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 Y10525 [0,2,0,0,0,0|1,0,1]=4 1149 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 F16952 [0,2,0,0,0,0|1,0,1]=4 1150 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 I11003 [0,2,0,0,0,0|1,0,1]=4 1151 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 Y10108 [0,2,0,0,0,0|1,0,1]=4 1152 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 Y10643 [0,2,0,0,0,0|1,0,1]=4 1153 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 F16917 [0,2,0,0,0,0|1,0,1]=4 1154 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 N11105 [0,2,0,0,0,0|1,0,1]=4 1155 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 Y10686 [0,2,0,0,0,0|1,0,1]=4 1156 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 Y10867 [0,2,0,0,0,0|1,0,1]=4 1157 B11R1.23 N[C@@H](CO)C1=CC=CC(O)=C1 Y10947 [0,2,0,0,0,0|1,0,1]=4 1158 B11R1.23 O=C(CBr)C1=CC(Cl)=NC=C1 80119 [0,2,0,0,0,0|1,0,0]=3 1159 B11R1.23 O=C(CCl)C1=NC=CC(Cl)=C1 78962 [0,2,0,0,0,0|1,0,0]=3 1160 B11R1.23 O=C(CO)C1=CC=CC(Cl)=C1 AC6589 [0,2,0,0,0,0|0,0,0]=2 1161 B11R1.23 O=CC(=O)C1=CC=CC(Cl)=C1 N16981 [0,2,0,0,0,0|0,0,1]=3 1162 B11R1.23 OC[C@H](Cl)C1=CC=CC(Cl)=C1 58254 [0,2,0,0,0,0|1,0,1]=4 1163 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 58256 [0,2,0,0,0,0|0,0,2]=4 1164 B11R1.222 CC1=C(C(=O)C#N)C=CC=C1 AB1507 [0,2,0,0,0,0|0,0,1]=3 1165 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 D80972 [0,2,0,0,0,0|1,0,1]=4 1166 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 D81235 [0,2,0,0,0,0|1,0,1]=4 1167 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 N11177 [0,2,0,0,0,0|1,0,1]=4 1168 B11R1.222 CC1=C([C@@H](O)CN)C=CC=C1 AR2909 [0,2,0,0,0,0|0,0,2]=4 1169 B11R1.222 CCC(=O)C1=C(Br)C=CC=N1 D81028 [0,2,0,0,0,0|1,0,0]=3 1170 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 20083 [0,2,0,0,0,0|1,0,1]=4 1171 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 F16885 [0,2,0,0,0,0|1,0,1]=4 1172 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 N10518 [0,2,0,0,0,0|1,0,1]=4 1173 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 N10519 [0,2,0,0,0,0|1,0,1]=4 1174 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 Y10722 [0,2,0,0,0,0|1,0,1]=4 1175 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y10294 [0,2,0,0,0,0|1,0,1]=4 1176 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y10295 [0,2,0,0,0,0|1,0,1]=4 1177 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y10316 [0,2,0,0,0,0|1,0,1]=4 1178 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y11207 [0,2,0,0,0,0|1,0,1]=4 1179 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y11964 [0,2,0,0,0,0|1,0,1]=4 1180 B11R1.222 CC[C@H](N)C1=C(F)C=CC=C1 S10041 [0,2,0,0,0,0|1,0,1]=4 1181 B11R1.222 CC[C@H](N)C1=C(F)C=CC=C1 Y10807 [0,2,0,0,0,0|1,0,1]=4 1182 B11R1.222 CC[C@H](N)C1=C(O)C=CC=C1 Y14154 [0,2,0,0,0,0|1,0,1]=4 1183 B11R1.222 CC[C@H](N)C1=C(O)C=CC=C1 Y14523 [0,2,0,0,0,0|1,0,1]=4 1184 B11R1.222 CNC(=O)C1=CNC=CC1=O F11755 [0,2,0,0,0,0|1,0,0]=3 1185 B11R1.222 CNC(=O)C1=NC=CN=C1N AB3038 [0,2,0,0,0,0|2,0,0]=4 1186 B11R1.222 CN[C@@H](C)C1=C(C)C=CC=C1 N13149 [0,2,0,0,0,0|1,0,1]=4 1187 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y11428 [0,2,0,0,0,0|1,0,1]=4 1188 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y11555 [0,2,0,0,0,0|1,0,1]=4 1189 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y12189 [0,2,0,0,0,0|1,0,1]=4 1190 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y13379 [0,2,0,0,0,0|1,0,1]=4 1191 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y14597 [0,2,0,0,0,0|1,0,1]=4 1192 B11R1.222 CN[C@@H](C)C1=C(F)C=CC=C1 H11712 [0,2,0,0,0,0|1,0,1]=4 1193 B11R1.222 CN[C@@H](C)C1=C(F)C=CC=C1 N12637 [0,2,0,0,0,0|1,0,1]=4 1194 B11R1.222 COC(=O)C1=C(Br)C=CN=C1 I11422 [0,2,0,0,0,0|1,0,0]=3 1195 B11R1.222 COC(=O)C1=C(Br)C=NC=N1 67174 [0,2,0,0,0,0|2,0,0]=4 1196 B11R1.222 COC(=O)C1=C(Cl)C=CN=C1 26180 [0,2,0,0,0,0|1,0,0]=3 1197 B11R1.222 COC(=O)C1=C(N)N=CN=C1 26406 [0,2,0,0,0,0|2,0,0]=4 1198 B11R1.222 COC(=O)C1=C(N)N=NC=C1 32233 [0,2,0,0,0,0|2,0,0]=4 1199 B11R1.222 COC(=O)C1=C(O)C=CN=C1 F30285 [0,2,0,0,0,0|1,0,0]=3 1200 B11R1.222 COC(=O)C1=CC=NN=C1Cl AT22445 [0,2,0,0,0,0|2,0,0]=4 1201 B11R1.222 COC(=O)C1=CC=NNC1=O P11740 [0,2,0,0,0,0|2,0,0]=4 1202 B11R1.222 COC(=O)C1=NC=CN=C1F P16242 [0,2,0,0,0,0|2,0,0]=4 1203 B11R1.222 COC(=O)C1=NC=CN=C1I 30615 [0,2,0,0,0,0|2,0,0]=4 1204 B11R1.222 COC(=O)C1=NC=NC=C1N P21150 [0,2,0,0,0,0|2,0,0]=4 1205 B11R1.222 C\C(=N\O)C1=C(O)C=CC=C1 W19004 [0,2,0,0,0,0|0,0,1]=3 1206 B11R1.222 NC[C@H](O)C1=C(Cl)C=CC=C1 AC1512 [0,2,0,0,0,0|0,0,2]=4 1207 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 D81268 [0,2,0,0,0,0|1,0,1]=4 1208 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 D81404 [0,2,0,0,0,0|1,0,1]=4 1209 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 Y12047 [0,2,0,0,0,0|1,0,1]=4 1210 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 Y12048 [0,2,0,0,0,0|1,0,1]=4 1211 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 N11089 [0,2,0,0,0,0|1,0,1]=4 1212 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 N11090 [0,2,0,0,0,0|1,0,1]=4 1213 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 Y10773 [0,2,0,0,0,0|1,0,1]=4 1214 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 Y13361 [0,2,0,0,0,0|1,0,1]=4 1215 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 D83963 [0,2,0,0,0,0|1,0,1]=4 1216 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 I11002 [0,2,0,0,0,0|1,0,1]=4 1217 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 I11143 [0,2,0,0,0,0|1,0,1]=4 1218 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 Y10336 [0,2,0,0,0,0|1,0,1]=4 1219 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 Y12049 [0,2,0,0,0,0|1,0,1]=4 1220 B11R1.222 N\C(=N\O)C1=C(Cl)C=CC=C1 W10711 [0,2,0,0,0,0|1,0,1]=4 1221 B11R1.222 O=C(CBr)C1=C(Cl)N=CC=C1 F10492 [0,2,0,0,0,0|1,0,0]=3 1222 B11R1.222 O=C(CF)C1=C(F)C=CC=C1 75535 [0,2,0,0,0,0|0,0,0]=2 1223 B11R1.222 O=C(CO)C1=C(Cl)C=CC=C1 AC1212 [0,2,0,0,0,0|0,0,0]=2 1224 B11R1.87 CC(C)(C)C1=C(Br)C=CC=C1 C76258 [0,2,0,0,0,0|1,0,1]=4 1225 B11R1.87 CC(C)(N)C1=C(Br)C=CC=C1 Y10933 [0,2,0,0,0,0|1,0,1]=4 1226 B11R1.87 CC1=C(S(=O)(=O)O)C=CC=C1 C73659 [0,2,0,0,0,0|2,0,0]=4 1227 B11R1.87 CS(=O)(=O)C1=C(Br)C=CC=N1 D80464 [0,2,0,0,0,0|2,0,0]=4 1228 B11R1.87 CS(=O)(=O)C1=C(N)C=CC=C1 AC1456 [0,2,0,0,0,0|1,0,0]=3 1229 B11R1.87 CS(=O)(=O)C1=C(N)N=CC=C1 W19350 [0,2,0,0,0,0|2,0,0]=4 1230 B11R1.87 CS(=O)(=O)C1=CC=CN=C1Cl 37543 [0,2,0,0,0,0|2,0,0]=4 1231 B11R1.87 CS(=O)(=O)C1=CC=CNC1=O F50909 [0,2,0,0,0,0|2,0,0]=4 1232 B11R1.87 C[Si](C)(C)C1=C(F)C=CC=C1 AC4958 [0,2,0,0,0,0|1,1,0]=4 1233 B11R1.155 CC(C)(N)C1=CC=CC(F)=C1 N10807 [0,2,0,0,0,0|1,0,1]=4 1234 B11R1.155 CC(C)(O)C1=CC=CC(O)=C1 AC1663 [0,2,0,0,0,0|0,0,2]=4 1235 B11R1.155 CC(F)(F)C1=CC=CC(Br)=C1 F30196 [0,2,0,0,0,0|1,0,1]=4 1236 B11R1.155 CS(=O)(=O)C1=CC(Br)=CN=C1 91183 [0,2,0,0,0,0|2,0,0]=4 1237 B11R1.155 CS(=O)(=O)C1=CC(Br)=NC=C1 C71640 [0,2,0,0,0,0|2,0,0]=4 1238 B11R1.155 CS(=O)(=O)C1=CC(O)=CC=C1 A12065 [0,2,0,0,0,0|1,0,0]=3 1239 B11R1.155 CS(=O)(=O)C1=CC=CC(Cl)=C1 AC1312 [0,2,0,0,0,0|1,0,0]=3 1240 B11R1.155 CS(=O)(=O)C1=CN=CC(N)=C1 W17114 [0,2,0,0,0,0|2,0,0]=4 1241 B11R1.155 NS(=O)(=O)C1=CC(O)=CC=C1 AB10153 [0,2,0,0,0,0|2,0,0]=4 1242 B11R1.155 NS(=O)(=O)C1=CC=CC(I)=C1 D85694 [0,2,0,0,0,0|2,0,0]=4 1243 B11R1.155 O=S(=O)(F)C1=CC=CC(Br)=C1 F53144 [0,2,0,0,0,0|2,0,0]=4 1244 B11R1.155 O=S(=O)(O)C1=CC=CC(Cl)=C1 A12252 [0,2,0,0,0,0|2,0,0]=4 1245 B11R1.155 O=S(=O)(O)C1=CC=CC(I)=C1 AR3554 [0,2,0,0,0,0|2,0,0]=4 1246 B11R1.53 C#CC1=C(C(=O)O)C=CC=C1 77937 [0,2,0,0,0,0|1,0,0]=3 1247 B11R1.53 C#CC1=C(C(C)=O)C=CC=C1 79244 [0,2,0,0,0,0|0,0,0]=2 1248 B11R1.53 C=C(C)C1=CC=CN=C1C#N D81130 [0,2,0,0,0,0|2,0,0]=4 1249 B11R1.53 CC(C)C1=C(CBr)C=CC=C1 39100 [0,2,0,0,0,0|1,0,1]=4 1250 B11R1.53 CCC1=C(C(=O)O)C=CC=N1 O10770 [0,2,0,0,0,0|2,0,0]=4 1251 B11R1.53 CCC1=C(C(=O)O)C=CN=C1 O11001 [0,2,0,0,0,0|2,0,0]=4 1252 B11R1.53 CCC1=C(C(=O)O)C=NC=C1 C75477 [0,2,0,0,0,0|2,0,0]=4 1253 B11R1.53 CCC1=C(C(C)=O)C=CC=C1 A10857 [0,2,0,0,0,0|0,0,0]=2 1254 B11R1.53 CCC1=C([C@H](C)N)C=CC=C1 Y11921 [0,2,0,0,0,0|1,0,1]=4 1255 B11R1.53 CCC1=C([C@H](C)N)C=CC=C1 Y11922 [0,2,0,0,0,0|1,0,1]=4 1256 B11R1.53 CCC1=C([C@H](C)N)C=CC=C1 Y12590 [0,2,0,0,0,0|1,0,1]=4 1257 B11R1.53 CCC1=C([C@H](C)N)C=CC=C1 Y12977 [0,2,0,0,0,0|1,0,1]=4 1258 B11R1.53 CN(C)C1=C(CN)C=CC=C1 C16014 [0,2,0,0,0,0|2,0,0]=4 1259 B11R1.53 CN(C)C1=C(CO)C=CC=C1 W18685 [0,2,0,0,0,0|2,0,0]=4 1260 B11R1.53 CNC1=C(C(C)=O)C=CC=C1 C73575 [0,2,0,0,0,0|0,0,0]=2 1261 B11R1.53 COC1=C(C(=N)N)C=CC=C1 71596 [0,2,0,0,0,0|2,0,0]=4 1262 B11R1.53 COC1=C(C(C)=O)C=CC=N1 32755 [0,2,0,0,0,0|1,0,0]=3 1263 B11R1.53 COC1=C(C(C)=O)C=CN=C1 C76667 [0,2,0,0,0,0|1,0,0]=3 1264 B11R1.53 COC1=C(C(C)=O)C=NC=C1 CS1683 [0,2,0,0,0,0|1,0,0]=3 1265 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 52750 [0,2,0,0,0,0|1,0,1]=4 1266 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 F16921 [0,2,0,0,0,0|1,0,1]=4 1267 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 N10418 [0,2,0,0,0,0|1,0,1]=4 1268 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 Y10162 [0,2,0,0,0,0|1,0,1]=4 1269 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 Y10512 [0,2,0,0,0,0|1,0,1]=4 1270 B11R1.53 CSC1=C([N+](=O)[O-])C=CC=C1 C74572 [0,2,0,0,0,0|2,0,0]=4 1271 B11R1.53 C[C@H](N)C1=C(C#N)C=CC=C1 Y12201 [0,2,0,0,0,0|1,0,1]=4 1272 B11R1.53 N#CC1=C(C(=O)O)C=CC=N1 O10763 [0,2,0,0,0,0|2,0,0]=4 1273 B11R1.53 N#CC1=C(C(=O)O)C=CN=C1 85333 [0,2,0,0,0,0|2,0,0]=4 1274 B11R1.53 N#CC1=C(C(=O)O)C=NC=C1 38303 [0,2,0,0,0,0|2,0,0]=4 1275 B11R1.53 N#CC1=CC=CN=C1C(=O)O 38302 [0,2,0,0,0,0|2,0,0]=4 1276 B11R1.53 NC(=O)C1=C(CBr)C=CC=C1 26663 [0,2,0,0,0,0|1,0,0]=3 1277 B11R1.156 CC(=O)C1=C(Br)C=NC=C1F 88880 [0,2,0,0,0,0|1,0,0]=3 1278 B11R1.156 CC(=O)C1=C(Cl)C=CN=C1Br 55290 [0,2,0,0,0,0|1,0,0]=3 1279 B11R1.156 CC(=O)C1=C(Cl)C=CN=C1Cl 72214 [0,2,0,0,0,0|1,0,0]=3 1280 B11R1.156 CC(=O)C1=C(Cl)C=NC=C1Cl FD10663 [0,2,0,0,0,0|1,0,0]=3 1281 B11R1.156 CC(=O)C1=C(F)C=CC=C1C CL9504 [0,2,0,0,0,0|0,0,0]=2 1282 B11R1.156 CC(=O)C1=C(F)C=CC=C1N C76841 [0,2,0,0,0,0|0,0,0]=2 1283 B11R1.156 CC(=O)C1=C(N)C=CN=C1Cl D83525 [0,2,0,0,0,0|1,0,0]=3 1284 B11R1.156 CC(=O)C1=C(O)C=CC=C1C CL9444 [0,2,0,0,0,0|0,0,0]=2 1285 B11R1.156 CC1=C(C(=O)O)C(Br)=NC=C1 H10306 [0,2,0,0,0,0|2,0,0]=4 1286 B11R1.156 CC1=C(C(=O)O)C(Cl)=NC=C1 57354 [0,2,0,0,0,0|2,0,0]=4 1287 B11R1.156 CC1=C(C(N)=O)C(Cl)=NC=C1 81867 [0,2,0,0,0,0|2,0,0]=4 1288 B11R1.156 CC1=CC=CC(C)=C1[C@H](C)N 20079 [0,2,0,0,0,0|1,0,1]=4 1289 B11R1.156 CC1=CC=CC(C)=C1[C@H](C)N 20081 [0,2,0,0,0,0|1,0,1]=4 1290 B11R1.156 CC1=CC=CC(C)=C1[C@H](C)N D80841 [0,2,0,0,0,0|1,0,1]=4 1291 B11R1.156 CC1=CC=CC(C)=C1[C@H](C)N F16983 [0,2,0,0,0,0|1,0,1]=4 1292 B11R1.156 CC1=CC=CC(C)=C1[C@H](C)N Y11055 [0,2,0,0,0,0|1,0,1]=4 1293 B11R1.156 CC1=CC=CC(Cl)=C1C(=O)Cl 30562 [0,2,0,0,0,0|1,0,0]=3 1294 B11R1.156 CC1=CC=NC(N)=C1C(=O)O H10318 [0,2,0,0,0,0|2,0,0]=4 1295 B11R1.156 CC1=CN=CC(C)=C1C(N)=O AT11860 [0,2,0,0,0,0|2,0,0]=4 1296 B11R1.156 CC1=CN=CC(F)=C1C(=O)O AT23873 [0,2,0,0,0,0|2,0,0]=4 1297 B11R1.156 CC1=CN=CC(F)=C1C(=O)O C14362 [0,2,0,0,0,0|2,0,0]=4 1298 B11R1.156 C[C@H](N)C1=C(Br)C=CC=C1Cl Y12650 [0,2,0,0,0,0|1,0,1]=4 1299 B11R1.156 C[C@H](N)C1=C(Br)C=CC=C1Cl Y12651 [0,2,0,0,0,0|1,0,1]=4 1300 B11R1.156 C[C@H](N)C1=C(Br)C=CC=C1Cl Y13244 [0,2,0,0,0,0|1,0,1]=4 1301 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1Cl 71000 [0,2,0,0,0,0|1,0,1]=4 1302 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1Cl 73349 [0,2,0,0,0,0|1,0,1]=4 1303 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1Cl 73350 [0,2,0,0,0,0|1,0,1]=4 1304 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1Cl Y10531 [0,2,0,0,0,0|1,0,1]=4 1305 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1Cl Y10765 [0,2,0,0,0,0|1,0,1]=4 1306 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1Cl Y10926 [0,2,0,0,0,0|1,0,1]=4 1307 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1F I10857 [0,2,0,0,0,0|1,0,1]=4 1308 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1F N10469 [0,2,0,0,0,0|1,0,1]=4 1309 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1F N10676 [0,2,0,0,0,0|1,0,1]=4 1310 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1F Y10302 [0,2,0,0,0,0|1,0,1]=4 1311 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1F Y10460 [0,2,0,0,0,0|1,0,1]=4 1312 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1F Y10644 [0,2,0,0,0,0|1,0,1]=4 1313 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1F 20101 [0,2,0,0,0,0|1,0,1]=4 1314 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1F N10466 [0,2,0,0,0,0|1,0,1]=4 1315 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1F Y11206 [0,2,0,0,0,0|1,0,1]=4 1316 B11R1.156 NC(=O)C1=C(Br)C=NC=C1F 26678 [0,2,0,0,0,0|2,0,0]=4 1317 B11R1.156 NC(=O)C1=C(I)C=CC=C1Cl 35383 [0,2,0,0,0,0|1,0,0]=3 1318 B11R1.156 NC1=C(C(=O)O)C(Br)=NC=C1 O11151 [0,2,0,0,0,0|2,0,0]=4 1319 B11R1.156 NC1=C(C(=O)O)C(Cl)=NC=C1 86987 [0,2,0,0,0,0|2,0,0]=4 1320 B11R1.156 NC1=CC=CC(I)=C1C(=O)O FD13014 [0,2,0,0,0,0|1,0,0]=3 1321 B11R1.156 NC1=NC=CC(Cl)=C1C(=O)O 36262 [0,2,0,0,0,0|2,0,0]=4 1322 B11R1.156 O=C(Cl)C1=C(Br)C=CC=C1F CK1090 [0,2,0,0,0,0|1,0,0]=3 1323 B11R1.156 O=C(O)C1=C(Br)C=CC=C1O C15718 [0,2,0,0,0,0|1,0,0]=3 1324 B11R1.156 O=C(O)C1=C(Br)C=CN=C1Br D83260 [0,2,0,0,0,0|2,0,0]=4 1325 B11R1.156 O=C(O)C1=C(Br)C=CN=C1Cl 55292 [0,2,0,0,0,0|2,0,0]=4 1326 B11R1.156 O=C(O)C1=C(Br)C=CN=C1F 79053 [0,2,0,0,0,0|2,0,0]=4 1327 B11R1.156 O=C(O)C1=C(Cl)C=NC=C1F 90326 [0,2,0,0,0,0|2,0,0]=4 1328 B11R1.156 O=C(O)C1=C(I)C=CC=C1Br 81858 [0,2,0,0,0,0|1,0,0]=3 1329 B11R1.156 O=C(O)C1=C(O)C=CN=C1Br D94451 [0,2,0,0,0,0|2,0,0]=4 1330 B11R1.156 O=[N+]([O-])C1=C(Br)C=CC=C1Cl N12302 [0,2,0,0,0,0|2,0,0]=4 1331 B11R1.159 CC(=O)C1=C(N)C(C)=CC=C1 W18414 [0,2,0,0,0,0|0,0,0]=2 1332 B11R1.159 CC(=O)C1=C(N)C(Cl)=NC=C1 F53540 [0,2,0,0,0,0|1,0,0]=3 1333 B11R1.159 CC(=O)C1=C(N)C(O)=CC=C1 24067 [0,2,0,0,0,0|0,0,0]=2 1334 B11R1.159 CC(=O)C1=C(O)C(O)=CC=C1 O10249 [0,2,0,0,0,0|0,0,0]=2 1335 B11R1.159 CC(=O)C1=CC=CC(Br)=C1C CL9266 [0,2,0,0,0,0|0,0,0]=2 1336 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1N 51210 [0,2,0,0,0,0|0,0,0]=2 1337 B11R1.159 CC(=O)C1=CC=CC(F)=C1Br C73097 [0,2,0,0,0,0|0,0,0]=2 1338 B11R1.159 CC(=O)C1=CC=CC(N)=C1F C72091 [0,2,0,0,0,0|0,0,0]=2 1339 B11R1.159 CC(C)C1=CC=CC(N)=C1F C72489 [0,2,0,0,0,0|1,0,1]=4 1340 B11R1.159 CC1=C(Br)C=CN=C1C(=O)O Y10130 [0,2,0,0,0,0|2,0,0]=4 1341 B11R1.159 CC1=C(Br)C=NC=C1C(=O)O 82203 [0,2,0,0,0,0|2,0,0]=4 1342 B11R1.159 CC1=C(N)C(C(=O)O)=NC=C1 D83392 [0,2,0,0,0,0|2,0,0]=4 1343 B11R1.159 CC1=CC=CC(C(C)C)=C1N 77942 [0,2,0,0,0,0|1,0,1]=4 1344 B11R1.159 CC1=CC=CC([C@H](C)N)=C1C Y11914 [0,2,0,0,0,0|1,0,1]=4 1345 B11R1.159 CC1=CC=CC([C@H](C)N)=C1C Y12440 [0,2,0,0,0,0|1,0,1]=4 1346 B11R1.159 CC1=CC=CC([C@H](C)N)=C1Cl Y12291 [0,2,0,0,0,0|1,0,1]=4 1347 B11R1.159 CC1=CC=CC([C@H](C)N)=C1Cl Y12292 [0,2,0,0,0,0|1,0,1]=4 1348 B11R1.159 CC1=CC=CC([C@H](C)N)=C1Cl Y13233 [0,2,0,0,0,0|1,0,1]=4 1349 B11R1.159 CC1=NC=CC(C(=O)O)=C1N C90386 [0,2,0,0,0,0|2,0,0]=4 1350 B11R1.159 CN1C(=O)C=CC=C1C(=O)O 26241 [0,2,0,0,0,0|2,0,0]=4 1351 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1Cl F16890 [0,2,0,0,0,0|1,0,1]=4 1352 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1F 20057 [0,2,0,0,0,0|1,0,1]=4 1353 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1F 72338 [0,2,0,0,0,0|1,0,1]=4 1354 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1F I11007 [0,2,0,0,0,0|1,0,1]=4 1355 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1F N13159 [0,2,0,0,0,0|1,0,1]=4 1356 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1F Y10319 [0,2,0,0,0,0|1,0,1]=4 1357 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1F Y11208 [0,2,0,0,0,0|1,0,1]=4 1358 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1Cl N10578 [0,2,0,0,0,0|1,0,1]=4 1359 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1Cl Y11025 [0,2,0,0,0,0|1,0,1]=4 1360 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1Cl Y11260 [0,2,0,0,0,0|1,0,1]=4 1361 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1Cl Y11261 [0,2,0,0,0,0|1,0,1]=4 1362 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1F 20103 [0,2,0,0,0,0|1,0,1]=4 1363 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1F 20105 [0,2,0,0,0,0|1,0,1]=4 1364 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1F S12185 [0,2,0,0,0,0|1,0,1]=4 1365 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1F Y11584 [0,2,0,0,0,0|1,0,1]=4 1366 B11R1.159 C[C@H](O)C1=CC=CC(Br)=C1F 33965 [0,2,0,0,0,0|0,0,2]=4 1367 B11R1.159 N=C(N)C1=CC=CC(Cl)=C1Cl 71884 [0,2,0,0,0,0|2,0,0]=4 1368 B11R1.159 NC(=O)C1=C(Cl)C(Cl)=CC=N1 58503 [0,2,0,0,0,0|2,0,0]=4 1369 B11R1.159 NC(=O)C1=C(N)C(Cl)=NC=C1 C74761 [0,2,0,0,0,0|2,0,0]=4 1370 B11R1.159 NC(=O)C1=CC=CC(Br)=C1F 36237 [0,2,0,0,0,0|1,0,0]=3 1371 B11R1.159 NC(=O)C1=CC=CC(Br)=C1N 26259 [0,2,0,0,0,0|1,0,0]=3 1372 B11R1.159 NC(=O)C1=CC=CC(F)=C1F A12174 [0,2,0,0,0,0|1,0,0]=3 1373 B11R1.159 NC(=O)C1=CC=CC(F)=C1N 35380 [0,2,0,0,0,0|1,0,0]=3 1374 B11R1.159 NC(=O)C1=CC=CC(N)=C1F C72490 [0,2,0,0,0,0|1,0,0]=3 1375 B11R1.159 NC(=O)C1=CN=CC(Cl)=C1Cl F20288 [0,2,0,0,0,0|2,0,0]=4 1376 B11R1.159 NC1=C(C(=O)O)C=CN=C1Cl 36261 [0,2,0,0,0,0|2,0,0]=4 1377 B11R1.159 NC1=C(F)C(C(=O)O)=CC=N1 D83637 [0,2,0,0,0,0|2,0,0]=4 1378 B11R1.159 NC1=CC=CC([N+](=O)[O-])=C1Br CL9353 [0,2,0,0,0,0|2,0,0]=4 1379 B11R1.159 NC1=CC=CC([N+](=O)[O-])=C1Cl 27932 [0,2,0,0,0,0|2,0,0]=4 1380 B11R1.159 NC1=CC=CC([N+](=O)[O-])=C1O 36140 [0,2,0,0,0,0|2,0,0]=4 1381 B11R1.159 O=C(O)C1=C(Br)C(Br)=NC=C1 W17140 [0,2,0,0,0,0|2,0,0]=4 1382 B11R1.159 O=C(O)C1=C(Cl)C(Br)=NC=C1 30916 [0,2,0,0,0,0|2,0,0]=4 1383 B11R1.159 O=C(O)C1=CC=CC(=O)N1O 36408 [0,2,0,0,0,0|2,0,0]=4 1384 B11R1.159 O=C(O)C1=CC=CC(=S)N1O W11623 [0,2,0,0,0,0|2,0,0]=4 1385 B11R1.159 O=C(O)C1=CC=CC(O)=C1Cl CL9330 [0,2,0,0,0,0|1,0,0]=3 1386 B11R1.159 O=C(O)C1=CC=NC(Cl)=C1Br C13624 [0,2,0,0,0,0|2,0,0]=4 1387 B11R1.159 O=C(O)C1=CN=CC(Br)=C1I H10040 [0,2,0,0,0,0|2,0,0]=4 1388 B11R1.159 O=C(O)C1=CN=CC(Br)=C1O Y10035 [0,2,0,0,0,0|2,0,0]=4 1389 B11R1.159 O=C(O)C1=CNC=C(Br)C1=O O11379 [0,2,0,0,0,0|2,0,0]=4 1390 B11R1.159 O=C(O)C1=NC=CC(Cl)=C1F S10232 [0,2,0,0,0,0|2,0,0]=4 1391 B11R1.159 O=[N+]([O-])C1=CC=CC(Cl)=C1I 69691 [0,2,0,0,0,0|2,0,0]=4 1392 B11R1.159 O=[N+]([O-])C1=CC=CC(O)=C1F 80824 [0,2,0,0,0,0|2,0,0]=4 1393 B11R1.167 CC(=O)C1=C(Br)C=CC(C)=C1 24153 [0,2,0,0,0,0|0,0,0]=2 1394 B11R1.167 CC(=O)C1=C(Br)C=CC(F)=N1 33205 [0,2,0,0,0,0|1,0,0]=3 1395 B11R1.167 CC(=O)C1=C(Br)C=CC(O)=C1 72605 [0,2,0,0,0,0|0,0,0]=2 1396 B11R1.167 CC(=O)C1=C(Br)C=NC(Cl)=C1 79385 [0,2,0,0,0,0|1,0,0]=3 1397 B11R1.167 CC(=O)C1=C(C)C=CC(O)=C1 N14343 [0,2,0,0,0,0|0,0,0]=2 1398 B11R1.167 CC(=O)C1=C(C)C=NC(Cl)=N1 27765 [0,2,0,0,0,0|2,0,0]=4 1399 B11R1.167 CC(=O)C1=C(Cl)C=CC(N)=C1 AC8788 [0,2,0,0,0,0|0,0,0]=2 1400 B11R1.167 CC(=O)C1=C(Cl)C=CC(O)=C1 98261 [0,2,0,0,0,0|0,0,0]=2 1401 B11R1.167 CC(=O)C1=C(F)C=CC(N)=C1 52903 [0,2,0,0,0,0|0,0,0]=2 1402 B11R1.167 CC(=O)C1=CC(Br)=CN=C1C C72029 [0,2,0,0,0,0|1,0,0]=3 1403 B11R1.167 CC(=O)C1=CC(C)=CN=C1Cl D82211 [0,2,0,0,0,0|1,0,0]=3 1404 B11R1.167 CC(=O)C1=NC(Br)=CN=C1Br 81571 [0,2,0,0,0,0|2,0,0]=4 1405 B11R1.167 CC(=O)C1=NC(C)=CN=C1C D82518 [0,2,0,0,0,0|2,0,0]=4 1406 B11R1.167 CC(C)C1=C(F)C=CC(I)=C1 C72486 [0,2,0,0,0,0|1,0,1]=4 1407 B11R1.167 CC(C)C1=C(O)C=CC(O)=C1 S10162 [0,2,0,0,0,0|1,0,1]=4 1408 B11R1.167 CC1=C(C(=O)O)C=C(N)C=N1 D94837 [0,2,0,0,0,0|2,0,0]=4 1409 B11R1.167 CC1=C(C(=O)O)N=C(Br)C=C1 P16139 [0,2,0,0,0,0|2,0,0]=4 1410 B11R1.167 CC1=C([C@H](C)N)C=C(F)C=C1 Y12032 [0,2,0,0,0,0|1,0,1]=4 1411 B11R1.167 CC1=C([C@H](C)N)C=C(F)C=C1 Y12589 [0,2,0,0,0,0|1,0,1]=4 1412 B11R1.167 CC1=C([C@H](C)N)C=C(F)C=C1 Y12591 [0,2,0,0,0,0|1,0,1]=4 1413 B11R1.167 CC1=CC(C(=O)O)=C(C)C=N1 P18651 [0,2,0,0,0,0|2,0,0]=4 1414 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=N1 C71246 [0,2,0,0,0,0|2,0,0]=4 1415 B11R1.167 CC1=CC(C(=O)O)=C(F)C=N1 W16972 [0,2,0,0,0,0|2,0,0]=4 1416 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 37636 [0,2,0,0,0,0|2,0,0]=4 1417 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 C76925 [0,2,0,0,0,0|2,0,0]=4 1418 B11R1.167 CC1=CC(C(=O)O)=C(N)N=C1 C75497 [0,2,0,0,0,0|2,0,0]=4 1419 B11R1.167 CC1=CC([C@H](C)N)=C(C)C=C1 N13078 [0,2,0,0,0,0|1,0,1]=4 1420 B11R1.167 CC1=CC=C(C)C(C(=O)O)=N1 O10927 [0,2,0,0,0,0|2,0,0]=4 1421 B11R1.167 CC1=CC=C(N)C(C(=O)O)=N1 68795 [0,2,0,0,0,0|2,0,0]=4 1422 B11R1.167 CC1=CC=C(O)C(C(=O)O)=N1 C72632 [0,2,0,0,0,0|2,0,0]=4 1423 B11R1.167 CC1=CN=C(Cl)C(C(=O)O)=C1 26345 [0,2,0,0,0,0|2,0,0]=4 1424 B11R1.167 CC1=CN=C(F)C(C(=O)O)=C1 C71175 [0,2,0,0,0,0|2,0,0]=4 1425 B11R1.167 CC1=NC(C(=O)O)=C(Br)C=C1 Y10194 [0,2,0,0,0,0|2,0,0]=4 1426 B11R1.167 CC1=NC(C(=O)O)=C(Cl)C=C1 P18650 [0,2,0,0,0,0|2,0,0]=4 1427 B11R1.167 CC1=NC=C(Cl)C=C1C(=O)O I11983 [0,2,0,0,0,0|2,0,0]=4 1428 B11R1.167 CN(C)C1=C(I)C=CC(O)=C1 C71961 [0,2,0,0,0,0|2,0,0]=4 1429 B11R1.167 CN1C=CC(=O)C=C1C(=O)O W19341 [0,2,0,0,0,0|2,0,0]=4 1430 B11R1.167 C[C@H](N)C1=C(Br)C=CC(F)=C1 90613 [0,2,0,0,0,0|1,0,1]=4 1431 B11R1.167 C[C@H](N)C1=C(Br)C=CC(F)=C1 Y11887 [0,2,0,0,0,0|1,0,1]=4 1432 B11R1.167 C[C@H](N)C1=C(Br)C=CC(F)=C1 Y11893 [0,2,0,0,0,0|1,0,1]=4 1433 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(Cl)=C1 71504 [0,2,0,0,0,0|1,0,1]=4 1434 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(Cl)=C1 Y11772 [0,2,0,0,0,0|1,0,1]=4 1435 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(Cl)=C1 Y11773 [0,2,0,0,0,0|1,0,1]=4 1436 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(F)=C1 Y12588 [0,2,0,0,0,0|1,0,1]=4 1437 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(F)=C1 Y13292 [0,2,0,0,0,0|1,0,1]=4 1438 B11R1.167 C[C@H](N)C1=C(F)C=CC(Cl)=C1 20059 [0,2,0,0,0,0|1,0,1]=4 1439 B11R1.167 C[C@H](N)C1=C(F)C=CC(Cl)=C1 N10677 [0,2,0,0,0,0|1,0,1]=4 1440 B11R1.167 C[C@H](N)C1=C(F)C=CC(Cl)=C1 N13034 [0,2,0,0,0,0|1,0,1]=4 1441 B11R1.167 C[C@H](N)C1=C(F)C=CC(Cl)=C1 Y10450 [0,2,0,0,0,0|1,0,1]=4 1442 B11R1.167 C[C@H](N)C1=C(F)C=CC(F)=C1 94482 [0,2,0,0,0,0|1,0,1]=4 1443 B11R1.167 C[C@H](N)C1=C(F)C=CC(F)=C1 94483 [0,2,0,0,0,0|1,0,1]=4 1444 B11R1.167 C[C@H](N)C1=C(F)C=CC(F)=C1 N12219 [0,2,0,0,0,0|1,0,1]=4 1445 B11R1.167 C[C@H](N)C1=C(F)C=CC(F)=C1 Y11205 [0,2,0,0,0,0|1,0,1]=4 1446 B11R1.167 C[C@H](N)C1=C(F)C=CC(F)=C1 Y11544 [0,2,0,0,0,0|1,0,1]=4 1447 B11R1.167 C[C@H](N)C1=C(O)C=CC(F)=C1 Y11757 [0,2,0,0,0,0|1,0,1]=4 1448 B11R1.167 C[C@H](N)C1=C(O)C=CC(F)=C1 Y11758 [0,2,0,0,0,0|1,0,1]=4 1449 B11R1.167 C[C@H](N)C1=C(O)C=CC(F)=C1 Y12285 [0,2,0,0,0,0|1,0,1]=4 1450 B11R1.167 C[C@H](O)C1=C(I)C=CC(F)=C1 C91309 [0,2,0,0,0,0|0,0,2]=4 1451 B11R1.167 N=C(N)C1=C(F)C=CC(Br)=C1 D83462 [0,2,0,0,0,0|2,0,0]=4 1452 B11R1.167 N=C(N)C1=C(F)C=CC(Cl)=C1 C90520 [0,2,0,0,0,0|2,0,0]=4 1453 B11R1.167 NC(=O)C1=C(N)C=CC(Br)=N1 F30972 [0,2,0,0,0,0|2,0,0]=4 1454 B11R1.167 NC(=O)C1=CC(Br)=NC=C1F C73428 [0,2,0,0,0,0|2,0,0]=4 1455 B11R1.167 NC(=O)C1=CC(Cl)=NC=C1N D79795 [0,2,0,0,0,0|2,0,0]=4 1456 B11R1.167 NC(=O)C1=CC(F)=CNC1=O D83259 [0,2,0,0,0,0|2,0,0]=4 1457 B11R1.167 NC1=C(C(=O)O)N=C(Br)C=C1 F31145 [0,2,0,0,0,0|2,0,0]=4 1458 B11R1.167 NC1=CC(C(=O)O)=C(N)C=C1 F52721 [0,2,0,0,0,0|1,0,0]=3 1459 B11R1.167 NC1=CN=C(Cl)C(C(=O)O)=C1 37564 [0,2,0,0,0,0|2,0,0]=4 1460 B11R1.167 NC1=CN=C(F)C=C1C(=O)O 71434 [0,2,0,0,0,0|2,0,0]=4 1461 B11R1.167 NC1=NC(C(=O)O)=C(Br)C=C1 F31274 [0,2,0,0,0,0|2,0,0]=4 1462 B11R1.167 NC1=NC=C(F)C=C1C(=O)O P15966 [0,2,0,0,0,0|2,0,0]=4 1463 B11R1.167 O=C(Cl)C1=C(O)C=CC(Cl)=C1 W16064 [0,2,0,0,0,0|1,0,0]=3 1464 B11R1.167 O=C(O)C1=C(Br)C=CC(F)=N1 80162 [0,2,0,0,0,0|2,0,0]=4 1465 B11R1.167 O=C(O)C1=C(Br)C=NC(F)=C1 F31180 [0,2,0,0,0,0|2,0,0]=4 1466 B11R1.167 O=C(O)C1=C(Cl)C=CC(O)=N1 O10988 [0,2,0,0,0,0|2,0,0]=4 1467 B11R1.167 O=C(O)C1=C(F)C=CC(Br)=N1 85645 [0,2,0,0,0,0|2,0,0]=4 1468 B11R1.167 O=C(O)C1=C(I)C=CC(O)=C1 69861 [0,2,0,0,0,0|1,0,0]=3 1469 B11R1.167 O=C(O)C1=C(O)C=CC(Br)=N1 26690 [0,2,0,0,0,0|2,0,0]=4 1470 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Cl 22950 [0,2,0,0,0,0|2,0,0]=4 1471 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1O A10724 [0,2,0,0,0,0|2,0,0]=4 1472 B11R1.167 O=C(O)C1=CC(F)=CN=C1Br 24198 [0,2,0,0,0,0|2,0,0]=4 1473 B11R1.167 O=C(O)C1=CC(F)=CN=C1F AT10057 [0,2,0,0,0,0|2,0,0]=4 1474 B11R1.167 O=C(O)C1=CC(F)=CN=C1O A12916 [0,2,0,0,0,0|2,0,0]=4 1475 B11R1.167 O=C(O)C1=CC(O)=CN=C1Cl F13413 [0,2,0,0,0,0|2,0,0]=4 1476 B11R1.167 O=C1C=C(C(=O)O)C(Br)=CN1 54617 [0,2,0,0,0,0|2,0,0]=4 1477 B11R1.74 CC(=O)C1=CC(C)=CC(Br)=C1 CL9440 [0,2,0,0,0,0|0,0,0]=2 1478 B11R1.74 CC(=O)C1=CC(Cl)=NC(C)=C1 90620 [0,2,0,0,0,0|1,0,0]=3 1479 B11R1.74 CC(=O)C1=CC(Cl)=NC(Cl)=C1 72212 [0,2,0,0,0,0|1,0,0]=3 1480 B11R1.74 CC(=O)C1=CC(I)=CC(Br)=C1 D93344 [0,2,0,0,0,0|0,0,0]=2 1481 B11R1.74 CC(=O)C1=CC(O)=CC(C)=C1 98263 [0,2,0,0,0,0|0,0,0]=2 1482 B11R1.74 CC(=O)C1=NC(C)=CC(C)=C1 N10847 [0,2,0,0,0,0|1,0,0]=3 1483 B11R1.74 CC(C)C1=CC(Br)=CC(N)=C1 98235 [0,2,0,0,0,0|1,0,1]=4 1484 B11R1.74 CC1=CC(Br)=CC(C(=O)O)=N1 D95055 [0,2,0,0,0,0|2,0,0]=4 1485 B11R1.74 CC1=CC(C(=O)O)=CC(Br)=N1 90621 [0,2,0,0,0,0|2,0,0]=4 1486 B11R1.74 CC1=CC(C(=O)O)=CC(C)=N1 85554 [0,2,0,0,0,0|2,0,0]=4 1487 B11R1.74 CC1=CC(C(=O)O)=CC(N)=C1 34945 [0,2,0,0,0,0|1,0,0]=3 1488 B11R1.74 CC1=CC(C)=CC(N(C)C)=C1 N16883 [0,2,0,0,0,0|2,0,0]=4 1489 B11R1.74 CC1=CC(C)=CC([C@H](C)N)=C1 20077 [0,2,0,0,0,0|1,0,1]=4 1490 B11R1.74 CC1=CC(C)=CC([C@H](C)N)=C1 N14381 [0,2,0,0,0,0|1,0,1]=4 1491 B11R1.74 CC1=CC(C)=CC([C@H](C)N)=C1 Y11912 [0,2,0,0,0,0|1,0,1]=4 1492 B11R1.74 CC1=CC(C)=CC([C@H](C)N)=C1 Y12441 [0,2,0,0,0,0|1,0,1]=4 1493 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=N1 96460 [0,2,0,0,0,0|2,0,0]=4 1494 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=N1 C73547 [0,2,0,0,0,0|2,0,0]=4 1495 B11R1.74 CC1=CC(I)=CC(C(=O)O)=C1 C77507 [0,2,0,0,0,0|1,0,0]=3 1496 B11R1.74 CC1=CC([N+](=O)[O-])=CC(O)=C1 29785 [0,2,0,0,0,0|2,0,0]=4 1497 B11R1.74 C[C@H](N)C1=CC(Cl)=CC(Cl)=C1 33671 [0,2,0,0,0,0|1,0,1]=4 1498 B11R1.74 C[C@H](N)C1=CC(Cl)=CC(Cl)=C1 AC1216 [0,2,0,0,0,0|1,0,1]=4 1499 B11R1.74 C[C@H](N)C1=CC(Cl)=CC(Cl)=C1 D81151 [0,2,0,0,0,0|1,0,1]=4 1500 B11R1.74 C[C@H](N)C1=CC(Cl)=CC(Cl)=C1 D81427 [0,2,0,0,0,0|1,0,1]=4 1501 B11R1.74 C[C@H](N)C1=CC(Cl)=CC(Cl)=C1 SC1356 [0,2,0,0,0,0|1,0,1]=4 1502 B11R1.74 C[C@H](N)C1=CC(Cl)=CC(F)=C1 I10853 [0,2,0,0,0,0|1,0,1]=4 1503 B11R1.74 C[C@H](N)C1=CC(Cl)=CC(F)=C1 N11036 [0,2,0,0,0,0|1,0,1]=4 1504 B11R1.74 C[C@H](N)C1=CC(Cl)=CC(F)=C1 N11317 [0,2,0,0,0,0|1,0,1]=4 1505 B11R1.74 C[C@H](N)C1=CC(Cl)=CC(F)=C1 Y10800 [0,2,0,0,0,0|1,0,1]=4 1506 B11R1.74 C[C@H](N)C1=CC(F)=CC(F)=C1 I11046 [0,2,0,0,0,0|1,0,1]=4 1507 B11R1.74 C[C@H](N)C1=CC(F)=CC(F)=C1 Y10003 [0,2,0,0,0,0|1,0,1]=4 1508 B11R1.74 C[C@H](N)C1=CC(F)=CC(F)=C1 Y10167 [0,2,0,0,0,0|1,0,1]=4 1509 B11R1.74 C[C@H](N)C1=CC(F)=CC(F)=C1 Y11002 [0,2,0,0,0,0|1,0,1]=4 1510 B11R1.74 N=C(N)C1=CC(F)=CC(F)=C1 BL002354 [0,2,0,0,0,0|2,0,0]=4 1511 B11R1.74 NC(=O)C1=CC(Cl)=CC(Cl)=N1 D78983 [0,2,0,0,0,0|2,0,0]=4 1512 B11R1.74 NC1=CC(C(=O)O)=CC(Cl)=N1 Y14716 [0,2,0,0,0,0|2,0,0]=4 1513 B11R1.74 NC1=CC(N)=CC([N+](=O)[O-])=C1 C75359 [0,2,0,0,0,0|2,0,0]=4 1514 B11R1.74 O=C(O)C1=CC(Br)=CC(Cl)=N1 O11188 [0,2,0,0,0,0|2,0,0]=4 1515 B11R1.74 O=C(O)C1=CC(Br)=NC(F)=C1 70340 [0,2,0,0,0,0|2,0,0]=4 1516 B11R1.74 O=C(O)C1=CC(Cl)=CC(Br)=N1 C71247 [0,2,0,0,0,0|2,0,0]=4 1517 B11R1.74 O=C(O)C1=CC(Cl)=NC(O)=C1 RB1152 [0,2,0,0,0,0|2,0,0]=4 1518 B11R1.74 O=C(O)C1=CC(O)=CC(Br)=N1 F53706 [0,2,0,0,0,0|2,0,0]=4 1519 B11R1.74 O=[N+]([O-])C1=CC(F)=CC(O)=C1 61010 [0,2,0,0,0,0|2,0,0]=4 1520 B11R1.74 O=[N+]([O-])C1=CC(I)=CC(Br)=C1 75185 [0,2,0,0,0,0|2,0,0]=4 1521 B11R1.74 O=[N+]([O-])C1=CC(I)=CC(Cl)=C1 C71906 [0,2,0,0,0,0|2,0,0]=4 1522 B11R1.74 O=[N+]([O-])C1=CC(I)=CC(I)=C1 N11815 [0,2,0,0,0,0|2,0,0]=4 1523 B11R1.266 C=CC1=CC=CC(C(=O)O)=C1 F16168 [0,2,0,0,0,0|1,0,0]=3 1524 B11R1.266 CC(=O)C1=CC(C#N)=NC=C1 29163 [0,2,0,0,0,0|1,0,0]=3 1525 B11R1.266 CC(=O)C1=NC(C#N)=CC=C1 C73010 [0,2,0,0,0,0|1,0,0]=3 1526 B11R1.266 CC(=O)C1=NC(CO)=CC=C1 58596 [0,2,0,0,0,0|1,0,0]=3 1527 B11R1.266 CC(C)C1=CC=CC(CBr)=C1 39101 [0,2,0,0,0,0|1,0,1]=4 1528 B11R1.266 CCC1=CC(C(=O)O)=NC=C1 FD10613 [0,2,0,0,0,0|2,0,0]=4 1529 B11R1.266 CCC1=CC=CC(C(=O)O)=C1 C13682 [0,2,0,0,0,0|1,0,0]=3 1530 B11R1.266 CCC1=CC=CC([C@H](C)N)=C1 Y12133 [0,2,0,0,0,0|1,0,1]=4 1531 B11R1.266 CCC1=CC=CC([C@H](C)N)=C1 Y12134 [0,2,0,0,0,0|1,0,1]=4 1532 B11R1.266 CCC1=CC=CC([C@H](C)N)=C1 Y12985 [0,2,0,0,0,0|1,0,1]=4 1533 B11R1.266 CCC1=CC=CC([N+](=O)[O-])=C1 C76351 [0,2,0,0,0,0|2,0,0]=4 1534 B11R1.266 CN(C)C1=CC(CN)=CC=C1 71130 [0,2,0,0,0,0|2,0,0]=4 1535 B11R1.266 CNC1=CC=CC(C(=O)O)=N1 O11509 [0,2,0,0,0,0|2,0,0]=4 1536 B11R1.266 CNC1=CC=CC([N+](=O)[O-])=C1 21307 [0,2,0,0,0,0|2,0,0]=4 1537 B11R1.266 COC1=CC(C(C)=O)=NC=C1 52385 [0,2,0,0,0,0|1,0,0]=3 1538 B11R1.266 COC1=CC([C@H](C)N)=CC=C1 Y11422 [0,2,0,0,0,0|1,0,1]=4 1539 B11R1.266 COC1=CC=CC(C(N)=O)=N1 C77359 [0,2,0,0,0,0|2,0,0]=4 1540 B11R1.266 COC1=CC=NC(C(C)=O)=N1 D83386 [0,2,0,0,0,0|2,0,0]=4 1541 B11R1.266 COC1=NC=CC(C(C)=O)=C1 29192 [0,2,0,0,0,0|1,0,0]=3 1542 B11R1.266 COC1=NC=CC(C(C)=O)=N1 D85888 [0,2,0,0,0,0|2,0,0]=4 1543 B11R1.266 C[C@H](N)C1=CC=CC(C#N)=C1 27268 [0,2,0,0,0,0|1,0,1]=4 1544 B11R1.266 C[C@H](N)C1=CC=CC(C#N)=C1 I11834 [0,2,0,0,0,0|1,0,1]=4 1545 B11R1.266 C[C@H](N)C1=CC=CC(C#N)=C1 Y10308 [0,2,0,0,0,0|1,0,1]=4 1546 B11R1.266 N#CC1=CC=CC(C(=O)O)=N1 O11586 [0,2,0,0,0,0|2,0,0]=4 1547 B11R1.266 N#CC1=CC=CC(C(N)=O)=C1 C77669 [0,2,0,0,0,0|1,0,0]=3 1548 B11R1.266 N#CC1=CC=CC(C(N)=O)=N1 A10044 [0,2,0,0,0,0|2,0,0]=4 1549 B11R1.266 NC(=O)C1=CC(CO)=CC=C1 W12789 [0,2,0,0,0,0|1,0,0]=3 1550 B11R1.266 NC(=O)C1=NC(CO)=CC=C1 35878 [0,2,0,0,0,0|2,0,0]=4 1551 B11R1.266 O=C(O)C1=CC(CO)=CC=C1 AB9436 [0,2,0,0,0,0|1,0,0]=3 1552 B11R1.266 O=C(O)C1=CC(CO)=NC=C1 A10630 [0,2,0,0,0,0|2,0,0]=4 1553 B11R1.266 O=CC1=CC=CC(C(=O)O)=N1 N13223 [0,2,0,0,0,0|2,0,0]=4 1554 B11R1.266 O=CC1=NC=CC(C(=O)O)=C1 36339 [0,2,0,0,0,0|2,0,0]=4 1555 B9R1.13 CC(=O)CC1=CC=CS1 W16827 [0,0,1,1,0,0|1,0,1]=4 1556 B9R1.5 NC1=CC=CC=CC1=O F11661 [0,0,1,1,0,0|1,0,1]=4 1557 B11R2.4 NC1CC1C2=CC=CC=C2 P17182 [0,0,0,1,0,1|1,0,1]=4 1558 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 C15693 [0,0,0,1,0,1|1,0,1]=4 1559 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 C15694 [0,0,0,1,0,1|1,0,1]=4 1560 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 D94291 [0,0,0,1,0,1|1,0,1]=4 1561 B11R2.4 N[C@H]1C[C@H]1C2=CC=CC=C2 P16183 [0,0,0,1,0,1|1,0,1]=4 1562 B11R2.4 OC1CC1C2=CC=CC=C2 F50832 [0,0,0,1,0,1|0,0,2]=4 1563 B11R2.10 BrC1=CC2=C(C=CC=C2)O1 30106 [0,0,0,1,0,1|1,0,1]=4 1564 B11R2.10 CC1=CC2=C(C=CC=C2)O1 F11695 [0,0,0,1,0,1|0,0,1]=3 1565 B11R2.10 CC1=CC2=C(C=CN=C2)N1 36232 [0,0,0,1,0,1|2,0,0]=4 1566 B11R2.10 CC1=CC2=C(C=NC=C2)N1 64428 [0,0,0,1,0,1|2,0,0]=4 1567 B11R2.10 CC1=CC2=NC=CC=C2N1 27734 [0,0,0,1,0,1|2,0,0]=4 1568 B11R2.10 CC1=CN2C=CC=CC2=C1 AC8553 [0,0,0,1,0,1|2,0,0]=4 1569 B11R2.10 CC1=NC2=C(C=CN=C2)O1 F13462 [0,0,0,1,0,1|1,0,1]=4 1570 B11R2.10 CC1=NC2=CC=CN=C2O1 AC1641 [0,0,0,1,0,1|1,0,1]=4 1571 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 P16419 [0,0,0,1,0,1|1,0,1]=4 1572 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 VT1375 [0,0,0,1,0,1|1,0,1]=4 1573 B11R2.10 ClC1=CC2=C(C=CC=C2)N1 F11679 [0,0,0,1,0,1|1,0,1]=4 1574 B11R2.10 IC1=CC2=C(C=CC=C2)N1 F18254 [0,0,0,1,0,1|1,0,1]=4 1575 B11R2.10 IC1=CC2=C(C=CC=C2)O1 D83864 [0,0,0,1,0,1|1,0,1]=4 1576 B11R2.10 IC1=CC2=C(C=CC=C2)S1 F13439 [0,0,0,1,0,1|1,0,1]=4 1577 B11R2.10 NC1=CC2=C(C=CC=C2)S1 27373 [0,0,0,1,0,1|1,0,1]=4 1578 B11R2.10 O=C1CC2=C(C=CN=C2)N1 86499 [0,0,0,1,0,1|1,0,0]=3 1579 B11R2.10 O=C1CN2C=CC=CC2=N1 78878 [0,0,0,1,0,1|1,0,0]=3 1580 B11R2.10 O=C1NC2=C(C=CN=C2)O1 AC6441 [0,0,0,1,0,1|2,0,0]=4 1581 B11R2.10 O=C1NC2=C(C=NC=C2)O1 O12039 [0,0,0,1,0,1|2,0,0]=4 1582 B11R2.10 O=C1NC2=C(N=CC=C2)O1 O12038 [0,0,0,1,0,1|2,0,0]=4 1583 B11R2.34 NC1=CC=C(C2CC2)C=C1 26267 [0,1,0,1,0,0|1,0,1]=4 1584 B11R2.34 NC1=CC=C(C2CC2)C=C1 33400 [0,1,0,1,0,0|1,0,1]=4 1585 B11R2.1 BrC1=NSC2=C1C=CC=C2 D84733 [0,1,0,1,0,0|1,1,0]=4 1586 B11R2.1 C=C1CCC2=C1C=CC=C2 AC3155 [0,1,0,1,0,0|1,0,0]=3 1587 B11R2.1 CC1=CCC2=C1C=CC=C2 C76459 [0,1,0,1,0,0|1,0,0]=3 1588 B11R2.1 CC1=CNC2=C1C=CN=C2 P11265 [0,1,0,1,0,0|2,0,0]=4 1589 B11R2.1 CC1=CNC2=C1C=NC=C2 P11266 [0,1,0,1,0,0|2,0,0]=4 1590 B11R2.1 CC1=CNC2=CC=CN=C12 F13594 [0,1,0,1,0,0|2,0,0]=4 1591 B11R2.1 CC1=NN=C2C=CC=CN12 26659 [0,1,0,1,0,0|2,0,0]=4 1592 B11R2.1 CC1=NNC2=C1C=CN=C2 CL4527 [0,1,0,1,0,0|2,0,0]=4 1593 B11R2.1 CC1=NNC2=C1C=NC=C2 86905 [0,1,0,1,0,0|2,0,0]=4 1594 B11R2.1 CN1CCC2=C1C=CC=C2 D83554 [0,1,0,1,0,0|2,0,0]=4 1595 B11R2.1 CN1N=CC2=C1C=CC=C2 P10138 [0,1,0,1,0,0|2,0,0]=4 1596 B11R2.1 C[C@@H]1NCC2=C1C=CC=C2 E72710 [0,1,0,1,0,0|1,0,1]=4 1597 B11R2.1 C[C@H]1CNC2=C1C=CC=C2 I11746 [0,1,0,1,0,0|1,0,1]=4 1598 B11R2.1 ClC1=COC2=C1C=CC=C2 F14423 [0,1,0,1,0,0|1,0,1]=4 1599 B11R2.1 FC1=NNC2=C1C=CC=C2 F30837 [0,1,0,1,0,0|2,0,0]=4 1600 B11R2.1 NC1=CNC2=C1C=CC=C2 51896 [0,1,0,1,0,0|1,0,1]=4 1601 B11R2.1 NC1=CSC2=C1C=CC=C2 25380 [0,1,0,1,0,0|1,0,1]=4 1602 B11R2.1 NC1=NCC2=C1C=CC=C2 32182 [0,1,0,1,0,0|1,0,0]=3 1603 B11R2.1 NN1CCC2=C1C=CC=C2 C90200 [0,1,0,1,0,0|2,0,0]=4 1604 B11R2.1 O=C1C=CC2=C1C=CC=C2 O10409 [0,1,0,1,0,0|0,0,1]=3 1605 B11R2.1 O=C1CCC2=C1C=CN=C2 67473 [0,1,0,1,0,0|1,0,0]=3 1606 B11R2.1 O=C1CCC2=C1C=NC=C2 P10633 [0,1,0,1,0,0|1,0,0]=3 1607 B11R2.1 O=C1COC2=C1C=CN=C2 65977 [0,1,0,1,0,0|1,0,0]=3 1608 B11R2.1 O=C1COC2=C1C=CN=C2 W17205 [0,1,0,1,0,0|1,0,0]=3 1609 B11R2.1 O=C1CSC2=C1C=CC=C2 26760 [0,1,0,1,0,0|0,0,0]=2 1610 B11R2.1 O=C1NCC2=C1C=CC=N2 84460 [0,1,0,1,0,0|1,0,0]=3 1611 B11R2.1 O=C1NCC2=C1C=CN=C2 F19961 [0,1,0,1,0,0|1,0,0]=3 1612 B11R2.1 O=C1NCC2=C1C=NC=C2 37545 [0,1,0,1,0,0|1,0,0]=3 1613 B11R2.1 O=C1NCC2=C1CC=CC2 P15954 [0,1,0,1,0,0|0,0,2]=4 1614 B11R2.1 O=C1NCC2=CC=CN=C12 87908 [0,1,0,1,0,0|1,0,0]=3 1615 B11R2.1 O=C1NCC2=NC=CN=C12 AT22460 [0,1,0,1,0,0|2,0,0]=4 1616 B11R2.1 O=C1NCC2=NC=CN=C12 P20256 [0,1,0,1,0,0|2,0,0]=4 1617 B11R2.1 O=C1NNC2=C1C=CC=N2 36117 [0,1,0,1,0,0|2,0,0]=4 1618 B11R2.1 O=C1NNC2=C1C=CN=C2 F50508 [0,1,0,1,0,0|2,0,0]=4 1619 B11R2.1 O=C1NNC2=CC=CN=C12 36532 [0,1,0,1,0,0|2,0,0]=4 1620 B11R2.1 OC1=NNC2=C1C=CC=C2 C71048 [0,1,0,1,0,0|1,0,1]=4 1621 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 D70931 [0,1,0,1,0,0|0,0,2]=4 1622 B11R2.239 C1=CC=C(C2CNC2)C=C1 84171 [0,1,0,1,0,0|1,0,1]=4 1623 B11R2.239 C1=CC=C(C2COC2)C=C1 F51875 [0,1,0,1,0,0|0,0,2]=4 1624 B11R2.239 C1=CC=C([C@@H]2CCN2)C=C1 C90175 [0,1,0,1,0,0|1,0,1]=4 1625 B11R2.35 NC1=CC(C2CC2)=CC=C1 C75291 [0,1,0,1,0,0|1,0,1]=4 1626 B7R1.1 C=CC1=CC=CS1 C10114 [1,0,0,0,1,0|1,0,1]=4 1627 B7R1.1 O=CC1=CC=C[Se]1 T72165 [1,0,0,0,1,0|1,0,0]=3 1628 B7R1.1 O=CC1=CC=NS1 62852 [1,0,0,0,1,0|2,0,0]=4 1629 B7R1.1 O=CC1=CCC=C1 77835 [1,0,0,0,1,0|0,0,1]=3 1630 B7R1.1 O=CC1=CN=CO1 39069 [1,0,0,0,1,0|2,0,0]=4 1631 B7R1.1 O=CC1=CON=C1 95893 [1,0,0,0,1,0|2,0,0]=4 1632 B7R1.1 O=CC1=NOC=C1 P10400 [1,0,0,0,1,0|2,0,0]=4 1633 B11R1.91 CC(=O)C#CC1=CC=CC=C1 F21355 [0,0,0,0,0,2|0,0,0]=2 1634 B11R1.91 C[C@H](N)CCC1=CC=CC=C1 Y11691 [0,0,0,0,0,2|1,0,1]=4 1635 B11R1.91 NC(=O)CCC1=CC=NC=C1 AC6902 [0,0,0,0,0,2|2,0,0]=4 1636 B11R1.91 NC(=O)CCC1=CN=CC=C1 AC6901 [0,0,0,0,0,2|2,0,0]=4 1637 B11R1.91 NC(=O)COC1=CC=CC=C1 N16863 [0,0,0,0,0,2|1,0,0]=3 1638 B11R1.91 O=C(O)C#CC1=CC=NC=C1 AC1699 [0,0,0,0,0,2|2,0,0]=4 1639 B11R1.91 O=C(O)C#CC1=CN=CC=C1 O10892 [0,0,0,0,0,2|2,0,0]=4 1640 B11R1.91 O=C(O)C#CC1=NC=CC=C1 W11288 [0,0,0,0,0,2|2,0,0]=4 1641 B11R1.91 O=C(O)CNC1=CC=NC=C1 CS1833 [0,0,0,0,0,2|2,0,0]=4 1642 B11R1.91 O=C(O)COC1=CC=NC=C1 C75738 [0,0,0,0,0,2|2,0,0]=4 1643 B11R1.91 O=C(O)COC1=NC=CC=C1 SC3951 [0,0,0,0,0,2|2,0,0]=4 1644 B11R1.91 O=C([O-])CCC1=CC=CC=C1 A11567 [0,0,0,0,0,2|1,0,0]=3 1645 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 35117 [0,0,0,0,0,2|2,0,0]=4