0 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 31291 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 32646 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.15 C=C(CBr)C1=CC=CC=C1 35089 [0,0,0,0,0,0|1,0,3]=4 3 B10R1.15 C=C(CC)C1=CC=CC=C1 C73845 [0,0,0,0,0,0|1,0,3]=4 4 B10R1.15 C=CC(=O)C1=CC=CC=C1 77875 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.15 C=C[C@H](N)C1=CC=CC=C1 Y11941 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.15 C=C[C@H](N)C1=CC=CC=C1 Y11942 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.15 C=C[C@H](N)C1=CC=CC=C1 Y12425 [0,0,0,0,0,0|2,0,0]=2 8 B10R1.15 CCN(C)C1=CC=CC=C1 S10715 [0,0,0,0,0,0|2,0,1]=3 9 B10R1.15 CC[C@H](Br)C1=CC=CC=C1 A11640 [0,0,0,0,0,0|2,0,1]=3 10 B10R1.15 CC[C@H](N)C1=CC=CN=C1 31586 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.15 CC[C@H](N)C1=CC=CN=C1 74009 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.15 CC[C@H](N)C1=CC=NC=C1 31287 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.15 CC[C@H](N)C1=CC=NC=C1 74015 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.15 CC[C@H](N)C1=CC=NC=C1 74017 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.15 CC[C@H](N)C1=CC=NC=C1 D81379 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.15 CC[C@H](N)C1=NC=CC=C1 F16910 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.15 CC[C@H](N)C1=NC=CC=C1 I11245 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.15 CC[C@H](N)C1=NC=CC=C1 N10610 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.15 CC[C@H](N)C1=NC=CC=C1 Y11176 [0,0,0,0,0,0|3,0,1]=4 20 B10R1.15 CC[C@H](N)C1=NC=CC=C1 Y11466 [0,0,0,0,0,0|3,0,1]=4 21 B10R1.15 CC[C@H](N)C1=NC=CC=C1 Y12115 [0,0,0,0,0,0|3,0,1]=4 22 B10R1.15 CC[C@H](O)C1=CC=CC=C1 T71858 [0,0,0,0,0,0|2,0,1]=3 23 B10R1.15 CC[C@H](O)C1=CC=CC=C1 T72707 [0,0,0,0,0,0|2,0,1]=3 24 B10R1.15 CN(C=O)C1=NC=CC=C1 A12745 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.15 F[C@@H](CBr)C1=CC=CC=C1 32835 [0,0,0,0,0,0|2,0,1]=3 26 B10R1.15 N=C(NN)C1=CC=CC=C1 D97377 [0,0,0,0,0,0|3,0,1]=4 27 B10R1.15 NC[C@H](N)C1=CC=CC=C1 N12631 [0,0,0,0,0,0|2,0,1]=3 28 B10R1.15 NC[C@H](O)C1=NC=CC=C1 C77057 [0,0,0,0,0,0|3,0,1]=4 29 B10R1.15 NNC(=S)C1=CC=CC=C1 W10972 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 32217 [0,0,0,0,0,0|2,0,2]=4 31 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y11463 [0,0,0,0,0,0|2,0,2]=4 32 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y12121 [0,0,0,0,0,0|2,0,2]=4 33 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y13389 [0,0,0,0,0,0|2,0,2]=4 34 B10R1.15 N[C@@H](CO)C1=CN=CC=C1 F13354 [0,0,0,0,0,0|2,0,2]=4 35 B10R1.15 N[C@@H](CO)C1=CN=CC=C1 Y12482 [0,0,0,0,0,0|2,0,2]=4 36 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 D85222 [0,0,0,0,0,0|2,0,2]=4 37 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y13398 [0,0,0,0,0,0|2,0,2]=4 38 B10R1.15 O=C[C@H](Br)C1=CC=CC=C1 F13390 [0,0,0,0,0,0|1,0,0]=1 39 B10R1.15 O[C@@H](CF)C1=CC=CC=C1 C91661 [0,0,0,0,0,0|2,0,1]=3 40 B9R1.6 C=C(C)C1=NC=CC=C1 W17791 [1,0,0,0,0,0|1,0,1]=3 41 B9R1.6 CC(=O)C1=NN=CC=C1 37064 [1,0,0,0,0,0|2,0,1]=4 42 B9R1.6 C[C@H](Cl)C1=NC=CC=C1 F13294 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.6 C[C@H](N)C1=CC=CC=C1 D77753 [1,0,0,0,0,0|1,0,0]=2 44 B9R1.6 C[C@H](N)C1=CC=CN=C1 20316 [1,0,0,0,0,0|2,0,0]=3 45 B9R1.6 C[C@H](N)C1=CC=CN=C1 74003 [1,0,0,0,0,0|2,0,0]=3 46 B9R1.6 C[C@H](N)C1=CC=CN=C1 74005 [1,0,0,0,0,0|2,0,0]=3 47 B9R1.6 C[C@H](N)C1=CC=CN=C1 F31031 [1,0,0,0,0,0|2,0,0]=3 48 B9R1.6 C[C@H](N)C1=CC=CN=C1 F31032 [1,0,0,0,0,0|2,0,0]=3 49 B9R1.6 C[C@H](N)C1=CC=NC=C1 F31033 [1,0,0,0,0,0|2,0,0]=3 50 B9R1.6 C[C@H](N)C1=CC=NC=C1 N10538 [1,0,0,0,0,0|2,0,0]=3 51 B9R1.6 C[C@H](N)C1=CN=CN=C1 37059 [1,0,0,0,0,0|3,0,0]=4 52 B9R1.6 C[C@H](N)C1=CN=CN=C1 AT25773 [1,0,0,0,0,0|3,0,0]=4 53 B9R1.6 C[C@H](N)C1=CN=NC=C1 37052 [1,0,0,0,0,0|3,0,0]=4 54 B9R1.6 C[C@H](N)C1=NC=CC=N1 C90214 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.6 C[C@H](N)C1=NC=CC=N1 C90215 [1,0,0,0,0,0|3,0,0]=4 56 B9R1.6 C[C@H](N)C1=NC=CC=N1 C90324 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.6 C[C@H](N)C1=NC=CC=N1 S11170 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.6 C[C@H](N)C1=NC=CN=C1 24931 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.6 C[C@H](O)C1=NC=CC=C1 A11519 [1,0,0,0,0,0|1,0,1]=3 60 B9R1.6 C[C@H](O)C1=NC=CC=C1 C16040 [1,0,0,0,0,0|1,0,1]=3 61 B9R1.6 C[C@H](O)C1=NC=CC=N1 72303 [1,0,0,0,0,0|2,0,1]=4 62 B9R1.6 C[C@H](O)C1=NC=CC=N1 P19373 [1,0,0,0,0,0|2,0,1]=4 63 B9R1.6 C[C@H](O)C1=NC=CC=N1 P20178 [1,0,0,0,0,0|2,0,1]=4 64 B9R1.6 C[C@H](O)C1=NC=CN=C1 D82306 [1,0,0,0,0,0|2,0,1]=4 65 B9R1.6 C[S@](=O)C1=NC=CC=C1 C74099 [1,0,0,0,0,0|2,0,0]=3 66 B9R1.6 O=[S@]([O-])C1=NC=CC=C1 AT11818 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.8 BrC#CC1=CC=CC=C1 A51120 [1,0,0,0,0,0|1,0,2]=4 68 B9R1.8 BrCCC1=CC=NC=C1 C71689 [1,0,0,0,0,0|2,0,1]=4 69 B9R1.8 CNCC1=CC=NC=C1 AR1712 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.8 ClCCC1=CC=NC=C1 O11064 [1,0,0,0,0,0|2,0,1]=4 71 B9R1.8 NNCC1=CC=CN=C1 78930 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.8 NNCC1=CC=NC=C1 37009 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.8 NNCC1=CC=NC=C1 BL009189 [1,0,0,0,0,0|3,0,0]=4 74 B9R1.8 NNCC1=NC=CC=C1 78929 [1,0,0,0,0,0|3,0,0]=4 75 B9R1.8 NOCC1=CN=CC=C1 AC6038 [1,0,0,0,0,0|3,0,0]=4 76 B9R1.8 N\N=C\C1=CC=CC=C1 D81797 [1,0,0,0,0,0|2,0,1]=4 77 B9R1.8 O\N=C/C1=CC=CC=C1 N10040 [1,0,0,0,0,0|1,0,2]=4 78 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 C11398 [1,0,0,0,0,0|2,0,0]=3 79 B11R1.7 CC(C)(CN)C1=NC=CC=C1 D83381 [0,1,0,0,0,0|2,0,1]=4 80 B11R1.7 C[C@](N)(CO)C1=CC=CC=C1 66215 [0,1,0,0,0,0|0,0,2]=3 81 B11R1.7 NCC(F)(F)C1=CC=CC=C1 P11064 [0,1,0,0,0,0|2,0,1]=4 82 B11R1.12 CN[C@@H](CO)C1=CC=CC=C1 Y10222 [0,1,0,0,0,0|0,0,2]=3 83 B11R1.12 NC[C@@H](CO)C1=CC=CC=C1 70910 [0,1,0,0,0,0|0,0,2]=3 84 B11R1.16 C=CC[C@H](N)C1=CC=CC=C1 I11297 [0,1,0,0,0,0|2,0,0]=3 85 B11R1.16 C=CC[C@H](N)C1=CC=CC=C1 Y10366 [0,1,0,0,0,0|2,0,0]=3 86 B11R1.16 C=CC[C@H](N)C1=CC=CC=C1 Y12585 [0,1,0,0,0,0|2,0,0]=3 87 B11R1.16 C=CC[C@H](N)C1=CC=CC=C1 Y13293 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 Y10270 [0,1,0,0,0,0|2,0,1]=4 89 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 Y11637 [0,1,0,0,0,0|2,0,1]=4 90 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 Y11944 [0,1,0,0,0,0|2,0,1]=4 91 B11R1.16 COC[C@H](N)C1=CC=CC=C1 N12553 [0,1,0,0,0,0|1,0,2]=4 92 B11R1.16 C[C@@H](CCN)C1=CC=CC=C1 AC6042 [0,1,0,0,0,0|1,0,1]=3 93 B11R1.16 C[C@H](N=C=O)C1=CC=CC=C1 D87824 [0,1,0,0,0,0|0,0,1]=2 94 B11R1.16 N#CC[C@H](O)C1=CC=CC=C1 AB1470 [0,1,0,0,0,0|2,0,1]=4 95 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 65208 [0,1,0,0,0,0|1,0,2]=4 96 B11R1.22 C#C[C@@H](O)C1=CC=C(F)C=C1 W16136 [0,1,0,0,0,0|2,0,1]=4 97 B11R1.22 C=CC(=O)C1=CC=C(F)C=C1 AB9399 [0,1,0,0,0,0|2,0,1]=4 98 B11R1.22 C=C[C@H](N)C1=CC=C(Br)C=C1 D81372 [0,1,0,0,0,0|2,0,0]=3 99 B11R1.22 C=C[C@H](N)C1=CC=C(Br)C=C1 N15256 [0,1,0,0,0,0|2,0,0]=3 100 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 D81498 [0,1,0,0,0,0|1,0,2]=4 101 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 N10531 [0,1,0,0,0,0|1,0,2]=4 102 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 N11058 [0,1,0,0,0,0|1,0,2]=4 103 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 N11096 [0,1,0,0,0,0|1,0,2]=4 104 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 Y10547 [0,1,0,0,0,0|1,0,2]=4 105 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 Y13360 [0,1,0,0,0,0|1,0,2]=4 106 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 F16933 [0,1,0,0,0,0|2,0,1]=4 107 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 N10949 [0,1,0,0,0,0|2,0,1]=4 108 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 N10950 [0,1,0,0,0,0|2,0,1]=4 109 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 N12584 [0,1,0,0,0,0|2,0,1]=4 110 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 Y10817 [0,1,0,0,0,0|2,0,1]=4 111 B11R1.22 CC[C@H](N)C1=CC=C(C)C=C1 Y10160 [0,1,0,0,0,0|2,0,1]=4 112 B11R1.22 CC[C@H](N)C1=CC=C(C)C=C1 Y10161 [0,1,0,0,0,0|2,0,1]=4 113 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 D81275 [0,1,0,0,0,0|2,0,1]=4 114 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 S11131 [0,1,0,0,0,0|2,0,1]=4 115 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 Y11768 [0,1,0,0,0,0|2,0,1]=4 116 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y10163 [0,1,0,0,0,0|2,0,1]=4 117 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y10164 [0,1,0,0,0,0|2,0,1]=4 118 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y10653 [0,1,0,0,0,0|2,0,1]=4 119 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y11063 [0,1,0,0,0,0|2,0,1]=4 120 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y11174 [0,1,0,0,0,0|2,0,1]=4 121 B11R1.22 CC[C@H](N)C1=CC=C(I)C=C1 Y14552 [0,1,0,0,0,0|2,0,1]=4 122 B11R1.22 CC[C@H](N)C1=CC=C(I)C=C1 Y14553 [0,1,0,0,0,0|2,0,1]=4 123 B11R1.22 CC[C@H](N)C1=CC=C(O)C=C1 N12238 [0,1,0,0,0,0|2,0,1]=4 124 B11R1.22 CC[C@H](O)C1=CC=C(Br)C=C1 AB6446 [0,1,0,0,0,0|2,0,1]=4 125 B11R1.22 CN[C@@H](C)C1=CC=C(Br)C=C1 N10761 [0,1,0,0,0,0|2,0,0]=3 126 B11R1.22 CN[C@@H](C)C1=CC=C(Br)C=C1 Y10719 [0,1,0,0,0,0|2,0,0]=3 127 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 F16874 [0,1,0,0,0,0|2,0,0]=3 128 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 F16927 [0,1,0,0,0,0|2,0,0]=3 129 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y10862 [0,1,0,0,0,0|2,0,0]=3 130 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y10897 [0,1,0,0,0,0|2,0,0]=3 131 B11R1.22 CN[C@@H](C)C1=CC=C(F)C=C1 N13109 [0,1,0,0,0,0|2,0,0]=3 132 B11R1.22 C[C@@H](CN)C1=CC=C(Br)C=C1 84993 [0,1,0,0,0,0|1,0,1]=3 133 B11R1.22 N#C[C@@H](O)C1=CC=C(Br)C=C1 W15228 [0,1,0,0,0,0|2,0,1]=4 134 B11R1.22 NC[C@H](O)C1=CC=C(Cl)C=C1 C78214 [0,1,0,0,0,0|2,0,1]=4 135 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 D83092 [0,1,0,0,0,0|1,0,2]=4 136 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 I11041 [0,1,0,0,0,0|1,0,2]=4 137 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 I11043 [0,1,0,0,0,0|1,0,2]=4 138 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 I11713 [0,1,0,0,0,0|1,0,2]=4 139 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 Y11114 [0,1,0,0,0,0|1,0,2]=4 140 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 N10527 [0,1,0,0,0,0|1,0,2]=4 141 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 N10528 [0,1,0,0,0,0|1,0,2]=4 142 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 Y10651 [0,1,0,0,0,0|1,0,2]=4 143 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 Y10776 [0,1,0,0,0,0|1,0,2]=4 144 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 F16942 [0,1,0,0,0,0|1,0,2]=4 145 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 I11004 [0,1,0,0,0,0|1,0,2]=4 146 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 I11005 [0,1,0,0,0,0|1,0,2]=4 147 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 I11499 [0,1,0,0,0,0|1,0,2]=4 148 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 Y10343 [0,1,0,0,0,0|1,0,2]=4 149 B11R1.22 N[C@@H](CO)C1=CC=C(I)C=C1 N10665 [0,1,0,0,0,0|1,0,2]=4 150 B11R1.22 N[C@@H](CO)C1=CC=C(I)C=C1 Y12067 [0,1,0,0,0,0|1,0,2]=4 151 B11R1.22 N[C@@H](CO)C1=CC=C(I)C=C1 Y12960 [0,1,0,0,0,0|1,0,2]=4 152 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 Y10690 [0,1,0,0,0,0|1,0,2]=4 153 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 Y10915 [0,1,0,0,0,0|1,0,2]=4 154 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 Y11472 [0,1,0,0,0,0|1,0,2]=4 155 B11R1.22 OC[C@H](O)C1=CC=C(Br)C=C1 11739 [0,1,0,0,0,0|1,0,2]=4 156 B11R1.23 C#C[C@@H](O)C1=CC=CC(F)=C1 79796 [0,1,0,0,0,0|2,0,1]=4 157 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 N11093 [0,1,0,0,0,0|1,0,2]=4 158 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 N11094 [0,1,0,0,0,0|1,0,2]=4 159 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 N11207 [0,1,0,0,0,0|1,0,2]=4 160 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 Y10647 [0,1,0,0,0,0|1,0,2]=4 161 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 Y10654 [0,1,0,0,0,0|1,0,2]=4 162 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 Y12450 [0,1,0,0,0,0|1,0,2]=4 163 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 N11059 [0,1,0,0,0,0|2,0,1]=4 164 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 N11060 [0,1,0,0,0,0|2,0,1]=4 165 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 N13204 [0,1,0,0,0,0|2,0,1]=4 166 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 N14300 [0,1,0,0,0,0|2,0,1]=4 167 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 Y12439 [0,1,0,0,0,0|2,0,1]=4 168 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 Y13349 [0,1,0,0,0,0|2,0,1]=4 169 B11R1.23 CC[C@H](N)C1=CC=CC(Br)=C1 N10470 [0,1,0,0,0,0|2,0,1]=4 170 B11R1.23 CC[C@H](N)C1=CC=CC(Br)=C1 N10952 [0,1,0,0,0,0|2,0,1]=4 171 B11R1.23 CC[C@H](N)C1=CC=CC(Br)=C1 N11195 [0,1,0,0,0,0|2,0,1]=4 172 B11R1.23 CC[C@H](N)C1=CC=CC(Br)=C1 Y10721 [0,1,0,0,0,0|2,0,1]=4 173 B11R1.23 CC[C@H](N)C1=CC=CC(Br)=C1 Y11058 [0,1,0,0,0,0|2,0,1]=4 174 B11R1.23 CC[C@H](N)C1=CC=CC(Cl)=C1 Y10291 [0,1,0,0,0,0|2,0,1]=4 175 B11R1.23 CC[C@H](N)C1=CC=CC(F)=C1 20089 [0,1,0,0,0,0|2,0,1]=4 176 B11R1.23 CC[C@H](N)C1=CC=CC(F)=C1 N10472 [0,1,0,0,0,0|2,0,1]=4 177 B11R1.23 CC[C@H](N)C1=CC=CC(F)=C1 N10473 [0,1,0,0,0,0|2,0,1]=4 178 B11R1.23 CC[C@H](N)C1=CC=CC(F)=C1 Y10473 [0,1,0,0,0,0|2,0,1]=4 179 B11R1.23 CC[C@H](N)C1=CC=CC(F)=C1 Y11089 [0,1,0,0,0,0|2,0,1]=4 180 B11R1.23 CC[C@H](N)C1=CC=CC(O)=C1 Y14524 [0,1,0,0,0,0|2,0,1]=4 181 B11R1.23 CN[C@@H](C)C1=CC(C)=CC=C1 Y11601 [0,1,0,0,0,0|2,0,0]=3 182 B11R1.23 CN[C@@H](C)C1=CC(C)=CC=C1 Y12434 [0,1,0,0,0,0|2,0,0]=3 183 B11R1.23 CN[C@@H](C)C1=CC=CC(Br)=C1 Y10927 [0,1,0,0,0,0|2,0,0]=3 184 B11R1.23 CN[C@@H](C)C1=CC=CC(Cl)=C1 Y12192 [0,1,0,0,0,0|2,0,0]=3 185 B11R1.23 CN[C@@H](C)C1=CC=CC(Cl)=C1 Y13371 [0,1,0,0,0,0|2,0,0]=3 186 B11R1.23 CN[C@@H](C)C1=CC=CC(Cl)=C1 Y13372 [0,1,0,0,0,0|2,0,0]=3 187 B11R1.23 CN[C@@H](C)C1=CC=CC(Cl)=C1 Y13373 [0,1,0,0,0,0|2,0,0]=3 188 B11R1.23 CN[C@@H](C)C1=CC=CC(F)=C1 Y14837 [0,1,0,0,0,0|2,0,0]=3 189 B11R1.23 CN[C@@H](C)C1=CC=CC(F)=C1 Y14849 [0,1,0,0,0,0|2,0,0]=3 190 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13444 [0,1,0,0,0,0|2,0,1]=4 191 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 Y10361 [0,1,0,0,0,0|2,0,1]=4 192 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 I11040 [0,1,0,0,0,0|1,0,2]=4 193 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 I11042 [0,1,0,0,0,0|1,0,2]=4 194 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 N11209 [0,1,0,0,0,0|1,0,2]=4 195 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 Y10525 [0,1,0,0,0,0|1,0,2]=4 196 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 F16952 [0,1,0,0,0,0|1,0,2]=4 197 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 I11003 [0,1,0,0,0,0|1,0,2]=4 198 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 Y10108 [0,1,0,0,0,0|1,0,2]=4 199 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 Y10643 [0,1,0,0,0,0|1,0,2]=4 200 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 F16917 [0,1,0,0,0,0|1,0,2]=4 201 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 N11105 [0,1,0,0,0,0|1,0,2]=4 202 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 Y10686 [0,1,0,0,0,0|1,0,2]=4 203 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 Y10867 [0,1,0,0,0,0|1,0,2]=4 204 B11R1.23 N[C@@H](CO)C1=CC=CC(O)=C1 Y10947 [0,1,0,0,0,0|1,0,2]=4 205 B11R1.23 O=CC(=O)C1=CC=CC(Cl)=C1 N16981 [0,1,0,0,0,0|1,0,1]=3 206 B11R1.23 OC[C@H](Cl)C1=CC=CC(Cl)=C1 58254 [0,1,0,0,0,0|1,0,2]=4 207 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 58256 [0,1,0,0,0,0|2,0,1]=4 208 B11R1.36 CC(=O)[C@H](N)C1=CC=CC=C1 N13201 [0,1,0,0,0,0|1,0,0]=2 209 B11R1.36 CC(=O)[C@H](O)C1=CC=CC=C1 AC1336 [0,1,0,0,0,0|1,0,0]=2 210 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 74050 [0,1,0,0,0,0|2,0,1]=4 211 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 F16904 [0,1,0,0,0,0|2,0,1]=4 212 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 Y11074 [0,1,0,0,0,0|2,0,1]=4 213 B11R1.36 C[C@@H](C(=N)N)C1=CC=CC=C1 71885 [0,1,0,0,0,0|1,0,0]=2 214 B11R1.36 C[C@@H](C(=O)O)C1=CN=CC=C1 79624 [0,1,0,0,0,0|1,0,0]=2 215 B11R1.36 C[C@@H](C1=CC=CC=C1)N(C)C A12149 [0,1,0,0,0,0|2,0,0]=3 216 B11R1.36 C[C@@H](O)[C@H](N)C1=CC=CC=C1 N16817 [0,1,0,0,0,0|1,0,2]=4 217 B11R1.36 N[C@@H](C(=O)O)C1=CN=CC=C1 AC7675 [0,1,0,0,0,0|2,0,0]=3 218 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 D80972 [0,1,0,0,0,0|1,0,2]=4 219 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 D81235 [0,1,0,0,0,0|1,0,2]=4 220 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 N11177 [0,1,0,0,0,0|1,0,2]=4 221 B11R1.222 CC1=C([C@@H](O)CN)C=CC=C1 AR2909 [0,1,0,0,0,0|2,0,1]=4 222 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 20083 [0,1,0,0,0,0|2,0,1]=4 223 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 F16885 [0,1,0,0,0,0|2,0,1]=4 224 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 N10518 [0,1,0,0,0,0|2,0,1]=4 225 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 N10519 [0,1,0,0,0,0|2,0,1]=4 226 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 Y10722 [0,1,0,0,0,0|2,0,1]=4 227 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y10294 [0,1,0,0,0,0|2,0,1]=4 228 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y10295 [0,1,0,0,0,0|2,0,1]=4 229 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y10316 [0,1,0,0,0,0|2,0,1]=4 230 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y11207 [0,1,0,0,0,0|2,0,1]=4 231 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y11964 [0,1,0,0,0,0|2,0,1]=4 232 B11R1.222 CC[C@H](N)C1=C(F)C=CC=C1 S10041 [0,1,0,0,0,0|2,0,1]=4 233 B11R1.222 CC[C@H](N)C1=C(F)C=CC=C1 Y10807 [0,1,0,0,0,0|2,0,1]=4 234 B11R1.222 CC[C@H](N)C1=C(O)C=CC=C1 Y14154 [0,1,0,0,0,0|2,0,1]=4 235 B11R1.222 CC[C@H](N)C1=C(O)C=CC=C1 Y14523 [0,1,0,0,0,0|2,0,1]=4 236 B11R1.222 CN[C@@H](C)C1=C(C)C=CC=C1 N13149 [0,1,0,0,0,0|2,0,0]=3 237 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y11428 [0,1,0,0,0,0|2,0,0]=3 238 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y11555 [0,1,0,0,0,0|2,0,0]=3 239 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y12189 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y13379 [0,1,0,0,0,0|2,0,0]=3 241 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y14597 [0,1,0,0,0,0|2,0,0]=3 242 B11R1.222 CN[C@@H](C)C1=C(F)C=CC=C1 H11712 [0,1,0,0,0,0|2,0,0]=3 243 B11R1.222 CN[C@@H](C)C1=C(F)C=CC=C1 N12637 [0,1,0,0,0,0|2,0,0]=3 244 B11R1.222 C\C(=N\O)C1=C(O)C=CC=C1 W19004 [0,1,0,0,0,0|1,0,2]=4 245 B11R1.222 NC[C@H](O)C1=C(Cl)C=CC=C1 AC1512 [0,1,0,0,0,0|2,0,1]=4 246 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 D81268 [0,1,0,0,0,0|1,0,2]=4 247 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 D81404 [0,1,0,0,0,0|1,0,2]=4 248 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 Y12047 [0,1,0,0,0,0|1,0,2]=4 249 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 Y12048 [0,1,0,0,0,0|1,0,2]=4 250 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 N11089 [0,1,0,0,0,0|1,0,2]=4 251 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 N11090 [0,1,0,0,0,0|1,0,2]=4 252 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 Y10773 [0,1,0,0,0,0|1,0,2]=4 253 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 Y13361 [0,1,0,0,0,0|1,0,2]=4 254 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 D83963 [0,1,0,0,0,0|1,0,2]=4 255 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 I11002 [0,1,0,0,0,0|1,0,2]=4 256 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 I11143 [0,1,0,0,0,0|1,0,2]=4 257 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 Y10336 [0,1,0,0,0,0|1,0,2]=4 258 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 Y12049 [0,1,0,0,0,0|1,0,2]=4 259 B11R2.1 CC1=CCC2=C1C=CC=C2 C76459 [0,0,0,1,0,0|1,0,1]=3 260 B11R2.1 CC1=CNC2=C1C=CN=C2 P11265 [0,0,0,1,0,0|2,0,1]=4 261 B11R2.1 CC1=CNC2=C1C=NC=C2 P11266 [0,0,0,1,0,0|2,0,1]=4 262 B11R2.1 CC1=CNC2=CC=CN=C12 F13594 [0,0,0,1,0,0|2,0,1]=4 263 B11R2.1 CN1C=CC2=C1C=NC=C2 P18393 [0,0,0,1,0,0|3,0,0]=4 264 B11R2.1 CN1C=CC2=CC=CN=C21 24845 [0,0,0,1,0,0|3,0,0]=4 265 B11R2.1 CN1C=NC2=C1C=CN=C2 D95006 [0,0,0,1,0,0|3,0,0]=4 266 B11R2.1 CN1C=NC2=NC=CC=C21 27557 [0,0,0,1,0,0|3,0,0]=4 267 B11R2.1 CN1CCC2=C1C=CC=C2 D83554 [0,0,0,1,0,0|2,0,1]=4 268 B11R2.1 CN1N=CC2=C1C=CC=C2 P10138 [0,0,0,1,0,0|3,0,0]=4 269 B11R2.1 C[C@@H]1NCC2=C1C=CC=C2 E72710 [0,0,0,1,0,0|2,0,0]=3 270 B11R2.1 C[C@H]1CNC2=C1C=CC=C2 I11746 [0,0,0,1,0,0|1,0,1]=3 271 B11R2.1 ClC1=COC2=C1C=CC=C2 F14423 [0,0,0,1,0,0|1,0,2]=4 272 B11R2.1 NC1=CNC2=C1C=CC=C2 51896 [0,0,0,1,0,0|2,0,1]=4 273 B11R2.1 NC1=CSC2=C1C=CC=C2 25380 [0,0,0,1,0,0|1,1,1]=4 274 B11R2.1 O=C1C=CC2=C1C=CC=C2 O10409 [0,0,0,1,0,0|2,0,1]=4 275 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 D70931 [0,0,0,1,0,0|2,0,1]=4 276 B11R2.4 NC1CC1C2=CC=CC=C2 P17182 [0,0,0,1,0,0|1,0,1]=3 277 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 C15693 [0,0,0,1,0,0|1,0,1]=3 278 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 C15694 [0,0,0,1,0,0|1,0,1]=3 279 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 D94291 [0,0,0,1,0,0|1,0,1]=3 280 B11R2.4 N[C@H]1C[C@H]1C2=CC=CC=C2 P16183 [0,0,0,1,0,0|1,0,1]=3 281 B11R2.4 OC1CC1C2=CC=CC=C2 F50832 [0,0,0,1,0,0|0,0,2]=3 282 B11R2.239 C1=CC(C2CNC2)=CC=N1 84193 [0,0,0,1,0,0|2,0,1]=4 283 B11R2.239 C1=CC=C(C2CNC2)C=C1 84171 [0,0,0,1,0,0|1,0,1]=3 284 B11R2.239 C1=CC=C(C2COC2)C=C1 F51875 [0,0,0,1,0,0|0,0,2]=3 285 B11R2.239 C1=CC=C([C@@H]2CCN2)C=C1 C90175 [0,0,0,1,0,0|2,0,0]=3 286 B11R2.239 C1=CN=C(C2CNC2)C=C1 85626 [0,0,0,1,0,0|2,0,1]=4 287 B11R2.239 C1=CN=CC(C2CNC2)=C1 84095 [0,0,0,1,0,0|2,0,1]=4 288 B9R1.11 O=CC(=O)C1=CC=CO1 D94856 [0,0,0,0,1,0|2,0,1]=4 289 B11R1.40 C#C[C@@H](O)CC1=CC=CC=C1 C75175 [0,0,0,0,0,1|2,0,1]=4 290 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 Y10008 [0,0,0,0,0,1|2,0,0]=3 291 B11R1.40 C[C@@H](C#N)NC1=CC=CC=C1 81451 [0,0,0,0,0,1|1,0,1]=3 292 B11R1.40 C[C@@H](CN)OC1=CC=CC=C1 AR3791 [0,0,0,0,0,1|1,0,1]=3 293 B11R1.40 OC[C@@H](Br)CC1=CC=CC=C1 D80460 [0,0,0,0,0,1|1,0,2]=4 294 B8R1.2 CCC1=NC=NC=C1 F17281 [2,0,0,0,0,0|2,0,0]=4 295 B8R1.2 NCC1=CC=CC=C1 RB3068 [2,0,0,0,0,0|1,0,0]=3 296 B8R1.2 NCC1=CC=NC=C1 35876 [2,0,0,0,0,0|2,0,0]=4 297 B8R1.2 O=CC1=NC=NC=C1 26359 [2,0,0,0,0,0|2,0,0]=4 298 B8R1.2 SCC1=CC=NC=C1 F18336 [2,0,0,0,0,0|1,1,0]=4 299 B8R1.2 SCC1=CN=CC=C1 F18343 [2,0,0,0,0,0|1,1,0]=4 300 B8R1.2 SCC1=NC=CC=C1 Y10072 [2,0,0,0,0,0|1,1,0]=4 301 B8R1.2 [C-]#[N+]C1=CC=CC=C1 AB1473 [2,0,0,0,0,0|1,0,1]=4 302 B10R1.13 C=C(C)C1=CC=C(I)C=C1 AC1339 [1,1,0,0,0,0|0,0,1]=3 303 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 AC7918 [1,1,0,0,0,0|0,0,1]=3 304 B10R1.13 CC(=O)C1=NC=C(N)C=C1 D94999 [1,1,0,0,0,0|1,0,1]=4 305 B10R1.13 CC(=O)C1=NC=C(O)C=C1 53717 [1,1,0,0,0,0|1,0,1]=4 306 B10R1.13 CC(C)C1=CC=C(O)C=C1 D72532 [1,1,0,0,0,0|0,0,1]=3 307 B10R1.13 CC(C)C1=NC=C(Br)C=C1 C71514 [1,1,0,0,0,0|1,0,1]=4 308 B10R1.13 CC(C)C1=NC=C(N)C=C1 D81293 [1,1,0,0,0,0|1,0,1]=4 309 B10R1.13 CC(C)C1=NC=C(N)C=C1 RB1132 [1,1,0,0,0,0|1,0,1]=4 310 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 20068 [1,1,0,0,0,0|1,0,0]=3 311 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 Y14023 [1,1,0,0,0,0|1,0,0]=3 312 B10R1.13 CC1=CC=C([C@H](C)O)C=C1 W19044 [1,1,0,0,0,0|0,0,1]=3 313 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 97006 [1,1,0,0,0,0|2,0,0]=4 314 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 A11173 [1,1,0,0,0,0|2,0,0]=4 315 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 T73083 [1,1,0,0,0,0|1,0,0]=3 316 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 Y10810 [1,1,0,0,0,0|2,0,0]=4 317 B10R1.13 CC1=CN=C([C@H](C)O)C=C1 AB7629 [1,1,0,0,0,0|1,0,1]=4 318 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 F16847 [1,1,0,0,0,0|2,0,0]=4 319 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 Y11095 [1,1,0,0,0,0|2,0,0]=4 320 B10R1.13 CN(N)C1=CC=C(Br)C=C1 E10129 [1,1,0,0,0,0|2,0,0]=4 321 B10R1.13 C[C@H](Cl)C1=CC=C(F)C=C1 AC6174 [1,1,0,0,0,0|1,0,0]=3 322 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 C16655 [1,1,0,0,0,0|1,0,0]=3 323 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 Y10310 [1,1,0,0,0,0|1,0,0]=3 324 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 Y10311 [1,1,0,0,0,0|1,0,0]=3 325 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 20069 [1,1,0,0,0,0|1,0,0]=3 326 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 20071 [1,1,0,0,0,0|1,0,0]=3 327 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 O11060 [1,1,0,0,0,0|1,0,0]=3 328 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 Y11752 [1,1,0,0,0,0|1,0,0]=3 329 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 Y11753 [1,1,0,0,0,0|1,0,0]=3 330 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 Y10879 [1,1,0,0,0,0|1,0,0]=3 331 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 Y14795 [1,1,0,0,0,0|1,0,0]=3 332 B10R1.13 C[C@H](N)C1=CN=C(Br)C=C1 81501 [1,1,0,0,0,0|2,0,0]=4 333 B10R1.13 C[C@H](N)C1=CN=C(Cl)C=C1 N11108 [1,1,0,0,0,0|2,0,0]=4 334 B10R1.13 C[C@H](N)C1=CN=C(Cl)C=C1 N11223 [1,1,0,0,0,0|2,0,0]=4 335 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 66671 [1,1,0,0,0,0|2,0,0]=4 336 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 74099 [1,1,0,0,0,0|2,0,0]=4 337 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 74101 [1,1,0,0,0,0|2,0,0]=4 338 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 81462 [1,1,0,0,0,0|2,0,0]=4 339 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 D82399 [1,1,0,0,0,0|2,0,0]=4 340 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 N11298 [1,1,0,0,0,0|2,0,0]=4 341 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 Y11564 [1,1,0,0,0,0|2,0,0]=4 342 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 N13196 [1,1,0,0,0,0|2,0,0]=4 343 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 Y12226 [1,1,0,0,0,0|2,0,0]=4 344 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 90530 [1,1,0,0,0,0|2,0,0]=4 345 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 F17006 [1,1,0,0,0,0|2,0,0]=4 346 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 N11135 [1,1,0,0,0,0|2,0,0]=4 347 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 Y10461 [1,1,0,0,0,0|2,0,0]=4 348 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 Y11597 [1,1,0,0,0,0|2,0,0]=4 349 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 Y13385 [1,1,0,0,0,0|2,0,0]=4 350 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 SC1272 [1,1,0,0,0,0|0,0,1]=3 351 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 SC1278 [1,1,0,0,0,0|0,0,1]=3 352 B10R1.13 C[C@H](O)C1=CC=C(O)C=C1 25877 [1,1,0,0,0,0|0,0,1]=3 353 B10R1.13 C[C@H](O)C1=CN=C(Br)C=C1 AT11876 [1,1,0,0,0,0|1,0,1]=4 354 B10R1.13 C[C@H](O)C1=NC=C(Br)C=C1 Y13723 [1,1,0,0,0,0|1,0,1]=4 355 B10R1.13 FC(F)C1=CC=C(I)C=C1 C71790 [1,1,0,0,0,0|2,0,0]=4 356 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 A11465 [1,1,0,0,0,0|1,0,1]=4 357 B10R1.28 CC(C)(N)C1=CC=CN=C1 27050 [1,1,0,0,0,0|1,0,1]=4 358 B10R1.28 CC(C)(N)C1=CC=NC=C1 F17065 [1,1,0,0,0,0|1,0,1]=4 359 B10R1.28 CC(C)(N)C1=NC=CC=C1 F20062 [1,1,0,0,0,0|1,0,1]=4 360 B10R1.28 CC(C)(O)C1=CN=CC=C1 50806 [1,1,0,0,0,0|1,0,1]=4 361 B10R1.28 CC(C)(O)C1=NC=CC=C1 W17538 [1,1,0,0,0,0|1,0,1]=4 362 B10R1.28 CS(=O)(=O)C1=CC=NC=C1 C15067 [1,1,0,0,0,0|2,0,0]=4 363 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 D77743 [1,1,0,0,0,0|1,0,1]=4 364 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 D77813 [1,1,0,0,0,0|1,0,1]=4 365 B10R1.28 C[S@](=N)(=O)C1=CC=CC=C1 W16234 [1,1,0,0,0,0|1,0,0]=3 366 B10R1.61 C=C(C)C1=C(Br)C=CC=C1 W17018 [1,1,0,0,0,0|0,0,1]=3 367 B10R1.61 CC(=O)C1=C(Br)C=CC=N1 80328 [1,1,0,0,0,0|1,0,1]=4 368 B10R1.61 CC(=O)C1=C(C)N=CC=C1 C73307 [1,1,0,0,0,0|1,0,1]=4 369 B10R1.61 CC(=O)C1=C(Cl)C=CC=N1 27067 [1,1,0,0,0,0|1,0,1]=4 370 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 Y14823 [1,1,0,0,0,0|1,0,1]=4 371 B10R1.61 CC(=O)C1=C(Cl)C=NC=C1 N12959 [1,1,0,0,0,0|1,0,1]=4 372 B10R1.61 CC(=O)C1=C(O)C=NC=C1 27646 [1,1,0,0,0,0|1,0,1]=4 373 B10R1.61 CC(=O)C1=C(O)N=CC=C1 93481 [1,1,0,0,0,0|1,0,1]=4 374 B10R1.61 CC(=O)C1=CC=CN=C1F F31395 [1,1,0,0,0,0|1,0,1]=4 375 B10R1.61 CC(=O)C1=CNC=CC1=O C74936 [1,1,0,0,0,0|1,0,1]=4 376 B10R1.61 CC(=O)C1=NC=CC=C1N 80156 [1,1,0,0,0,0|1,0,1]=4 377 B10R1.61 CC(=O)C1=NC=CC=C1O 80210 [1,1,0,0,0,0|1,0,1]=4 378 B10R1.61 CC(C)C1=C(N)C=CN=C1 C77054 [1,1,0,0,0,0|1,0,1]=4 379 B10R1.61 CC(C)C1=C(O)C=CC=N1 72523 [1,1,0,0,0,0|1,0,1]=4 380 B10R1.61 CC(C)C1=C(S)C=CC=C1 29274 [1,1,0,0,0,0|0,0,1]=3 381 B10R1.61 CC(C)C1=CC=CN=C1Br C72641 [1,1,0,0,0,0|1,0,1]=4 382 B10R1.61 CC(C)C1=CC=CN=C1N 60027 [1,1,0,0,0,0|1,0,1]=4 383 B10R1.61 CC(C)C1=NC=CC=C1N C72482 [1,1,0,0,0,0|1,0,1]=4 384 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 52748 [1,1,0,0,0,0|1,0,0]=3 385 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 52749 [1,1,0,0,0,0|1,0,0]=3 386 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 N10464 [1,1,0,0,0,0|1,0,0]=3 387 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 Y10511 [1,1,0,0,0,0|1,0,0]=3 388 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y11090 [1,1,0,0,0,0|2,0,0]=4 389 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y12107 [1,1,0,0,0,0|2,0,0]=4 390 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y12108 [1,1,0,0,0,0|2,0,0]=4 391 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y13392 [1,1,0,0,0,0|2,0,0]=4 392 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y13393 [1,1,0,0,0,0|2,0,0]=4 393 B10R1.61 CC1=CC=CN=C1[C@H](C)O 21080 [1,1,0,0,0,0|1,0,1]=4 394 B10R1.61 CC1=NC=CC=C1[C@H](C)N Y12491 [1,1,0,0,0,0|2,0,0]=4 395 B10R1.61 C[C@H](Cl)C1=C(F)C=NC=C1 W10402 [1,1,0,0,0,0|2,0,0]=4 396 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 21516 [1,1,0,0,0,0|1,0,0]=3 397 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 21517 [1,1,0,0,0,0|1,0,0]=3 398 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 Y10364 [1,1,0,0,0,0|1,0,0]=3 399 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 70080 [1,1,0,0,0,0|2,0,0]=4 400 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 90519 [1,1,0,0,0,0|2,0,0]=4 401 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 D81561 [1,1,0,0,0,0|2,0,0]=4 402 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 20095 [1,1,0,0,0,0|1,0,0]=3 403 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 SC1344 [1,1,0,0,0,0|1,0,0]=3 404 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 SC1353 [1,1,0,0,0,0|1,0,0]=3 405 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=N1 90516 [1,1,0,0,0,0|2,0,0]=4 406 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 52754 [1,1,0,0,0,0|1,0,0]=3 407 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 52755 [1,1,0,0,0,0|1,0,0]=3 408 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 I10701 [1,1,0,0,0,0|1,0,0]=3 409 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 Y10447 [1,1,0,0,0,0|1,0,0]=3 410 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 Y11656 [1,1,0,0,0,0|1,0,0]=3 411 B10R1.61 C[C@H](N)C1=C(F)C=CC=N1 N13070 [1,1,0,0,0,0|2,0,0]=4 412 B10R1.61 C[C@H](N)C1=C(F)C=CC=N1 N13095 [1,1,0,0,0,0|2,0,0]=4 413 B10R1.61 C[C@H](N)C1=C(N)C=CC=C1 C78195 [1,1,0,0,0,0|1,0,0]=3 414 B10R1.61 C[C@H](O)C1=C(Br)C=CC=C1 SC1257 [1,1,0,0,0,0|0,0,1]=3 415 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 SC1230 [1,1,0,0,0,0|0,0,1]=3 416 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 SC1233 [1,1,0,0,0,0|0,0,1]=3 417 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=N1 P19330 [1,1,0,0,0,0|1,0,1]=4 418 B10R1.61 C[C@H](O)C1=C(F)C=CC=N1 F13157 [1,1,0,0,0,0|1,0,1]=4 419 B10R1.61 C[C@H](O)C1=C(O)C=CC=C1 W16007 [1,1,0,0,0,0|0,0,1]=3 420 B10R1.61 C[C@H](O)C1=CC=CN=C1F F15555 [1,1,0,0,0,0|1,0,1]=4 421 B10R1.61 NC1=C(C(F)F)C=CC=C1 72620 [1,1,0,0,0,0|2,0,0]=4 422 B10R1.113 C=C(C)C1=CC(Br)=CN=C1 27507 [1,1,0,0,0,0|1,0,1]=4 423 B10R1.113 C=C(C)C1=CC(C)=CC=C1 AC1343 [1,1,0,0,0,0|0,0,1]=3 424 B10R1.113 C=C(C)C1=CC=CC(Cl)=C1 AC1313 [1,1,0,0,0,0|0,0,1]=3 425 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 A10170 [1,1,0,0,0,0|1,0,1]=4 426 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 W17608 [1,1,0,0,0,0|1,0,1]=4 427 B10R1.113 CC(=O)C1=CC(C)=NC=C1 27585 [1,1,0,0,0,0|1,0,1]=4 428 B10R1.113 CC(=O)C1=CC(Cl)=CN=C1 78890 [1,1,0,0,0,0|1,0,1]=4 429 B10R1.113 CC(=O)C1=CC(F)=CN=C1 N13069 [1,1,0,0,0,0|1,0,1]=4 430 B10R1.113 CC(=O)C1=CC(F)=NC=C1 52239 [1,1,0,0,0,0|1,0,1]=4 431 B10R1.113 CC(=O)C1=CC(N)=NC=C1 82952 [1,1,0,0,0,0|1,0,1]=4 432 B10R1.113 CC(=O)C1=CC=CC(Cl)=C1 D77821 [1,1,0,0,0,0|0,0,1]=3 433 B10R1.113 CC(=O)C1=CC=CC(F)=N1 F30144 [1,1,0,0,0,0|1,0,1]=4 434 B10R1.113 CC(=O)C1=C[N+]([O-])=CC=C1 31268 [1,1,0,0,0,0|1,0,1]=4 435 B10R1.113 CC(=O)C1=NC=CC(Br)=C1 RB1136 [1,1,0,0,0,0|1,0,1]=4 436 B10R1.113 CC(=O)C1=NC=CC(N)=C1 C72011 [1,1,0,0,0,0|1,0,1]=4 437 B10R1.113 CC(C)C1=CC(Br)=CN=C1 C71734 [1,1,0,0,0,0|1,0,1]=4 438 B10R1.113 CC(C)C1=CC=CC(=O)N1 D96359 [1,1,0,0,0,0|1,0,1]=4 439 B10R1.113 CC(C)C1=CC=CC(Br)=N1 35873 [1,1,0,0,0,0|1,0,1]=4 440 B10R1.113 CC(C)C1=CC=CC(Cl)=N1 O10744 [1,1,0,0,0,0|1,0,1]=4 441 B10R1.113 CC(C)C1=CN=CC(N)=C1 C72026 [1,1,0,0,0,0|1,0,1]=4 442 B10R1.113 CC(C)C1=NC=CC(Br)=C1 F52115 [1,1,0,0,0,0|1,0,1]=4 443 B10R1.113 CC(C)C1=NC=CC(Cl)=C1 C77363 [1,1,0,0,0,0|1,0,1]=4 444 B10R1.113 CC(C)C1=NC=CC(N)=C1 F52587 [1,1,0,0,0,0|1,0,1]=4 445 B10R1.113 CC1=CC([C@H](C)O)=NC=C1 AB7628 [1,1,0,0,0,0|1,0,1]=4 446 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 79174 [1,1,0,0,0,0|1,0,0]=3 447 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 I11812 [1,1,0,0,0,0|1,0,0]=3 448 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 Y10001 [1,1,0,0,0,0|1,0,0]=3 449 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 Y10156 [1,1,0,0,0,0|1,0,0]=3 450 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 Y11645 [1,1,0,0,0,0|1,0,0]=3 451 B10R1.113 CC1=CC=CC([C@H](C)O)=C1 W11160 [1,1,0,0,0,0|0,0,1]=3 452 B10R1.113 CC1=CC=CC([C@H](C)O)=C1 W11161 [1,1,0,0,0,0|0,0,1]=3 453 B10R1.113 CC1=CC=CC([C@H](C)O)=N1 AB7630 [1,1,0,0,0,0|1,0,1]=4 454 B10R1.113 CC1=NC=CC([C@H](C)N)=C1 Y11263 [1,1,0,0,0,0|2,0,0]=4 455 B10R1.113 CC1=NC=CC([C@H](C)N)=C1 Y11474 [1,1,0,0,0,0|2,0,0]=4 456 B10R1.113 C[C@H](N)C1=CC(Br)=CN=C1 D81619 [1,1,0,0,0,0|2,0,0]=4 457 B10R1.113 C[C@H](N)C1=CC(Br)=CN=C1 N10536 [1,1,0,0,0,0|2,0,0]=4 458 B10R1.113 C[C@H](N)C1=CC(Br)=CN=C1 Y11879 [1,1,0,0,0,0|2,0,0]=4 459 B10R1.113 C[C@H](N)C1=CC(Br)=CN=C1 Y13386 [1,1,0,0,0,0|2,0,0]=4 460 B10R1.113 C[C@H](N)C1=CC(Br)=NC=C1 Y10857 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.113 C[C@H](N)C1=CC(Br)=NC=C1 Y11465 [1,1,0,0,0,0|2,0,0]=4 462 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 N10750 [1,1,0,0,0,0|2,0,0]=4 463 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 N10751 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 Y11065 [1,1,0,0,0,0|2,0,0]=4 465 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 Y13387 [1,1,0,0,0,0|2,0,0]=4 466 B10R1.113 C[C@H](N)C1=CC(Cl)=NC=C1 74119 [1,1,0,0,0,0|2,0,0]=4 467 B10R1.113 C[C@H](N)C1=CC(Cl)=NC=C1 N11225 [1,1,0,0,0,0|2,0,0]=4 468 B10R1.113 C[C@H](N)C1=CC(Cl)=NC=C1 Y12112 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.113 C[C@H](N)C1=CC(Cl)=NC=C1 Y13390 [1,1,0,0,0,0|2,0,0]=4 470 B10R1.113 C[C@H](N)C1=CC(Cl)=NC=C1 Y13391 [1,1,0,0,0,0|2,0,0]=4 471 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 90830 [1,1,0,0,0,0|2,0,0]=4 472 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 Y10994 [1,1,0,0,0,0|2,0,0]=4 473 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 Y11212 [1,1,0,0,0,0|2,0,0]=4 474 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 20368 [1,1,0,0,0,0|1,0,0]=3 475 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 Y10443 [1,1,0,0,0,0|1,0,0]=3 476 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 90542 [1,1,0,0,0,0|2,0,0]=4 477 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 D81642 [1,1,0,0,0,0|2,0,0]=4 478 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 D81648 [1,1,0,0,0,0|2,0,0]=4 479 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 N11222 [1,1,0,0,0,0|2,0,0]=4 480 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 Y12109 [1,1,0,0,0,0|2,0,0]=4 481 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 Y12110 [1,1,0,0,0,0|2,0,0]=4 482 B10R1.113 C[C@H](N)C1=CC=CC(Br)=N1 Y13396 [1,1,0,0,0,0|2,0,0]=4 483 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=C1 80051 [1,1,0,0,0,0|1,0,0]=3 484 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=C1 Y10165 [1,1,0,0,0,0|1,0,0]=3 485 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=C1 Y11266 [1,1,0,0,0,0|1,0,0]=3 486 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=N1 N11224 [1,1,0,0,0,0|2,0,0]=4 487 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=N1 Y11269 [1,1,0,0,0,0|2,0,0]=4 488 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 35666 [1,1,0,0,0,0|1,0,0]=3 489 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 I10702 [1,1,0,0,0,0|1,0,0]=3 490 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 SC1338 [1,1,0,0,0,0|1,0,0]=3 491 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 Y10157 [1,1,0,0,0,0|1,0,0]=3 492 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 Y14762 [1,1,0,0,0,0|1,0,0]=3 493 B10R1.113 C[C@H](N)C1=CC=CC(F)=N1 90537 [1,1,0,0,0,0|2,0,0]=4 494 B10R1.113 C[C@H](N)C1=CC=CC(F)=N1 90538 [1,1,0,0,0,0|2,0,0]=4 495 B10R1.113 C[C@H](N)C1=CC=CC(F)=N1 Y11175 [1,1,0,0,0,0|2,0,0]=4 496 B10R1.113 C[C@H](N)C1=CC=CC(F)=N1 Y14741 [1,1,0,0,0,0|2,0,0]=4 497 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 70881 [1,1,0,0,0,0|1,0,0]=3 498 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 Y13415 [1,1,0,0,0,0|1,0,0]=3 499 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 N12887 [1,1,0,0,0,0|1,0,0]=3 500 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 N13189 [1,1,0,0,0,0|1,0,0]=3 501 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 Y10220 [1,1,0,0,0,0|1,0,0]=3 502 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 Y10873 [1,1,0,0,0,0|1,0,0]=3 503 B10R1.113 C[C@H](O)C1=CC=CC(Br)=C1 SC1266 [1,1,0,0,0,0|0,0,1]=3 504 B10R1.113 C[C@H](O)C1=CC=CC(Cl)=C1 SC1260 [1,1,0,0,0,0|0,0,1]=3 505 B10R1.113 C[C@H](O)C1=CC=CC(Cl)=C1 SC1269 [1,1,0,0,0,0|0,0,1]=3 506 B10R1.113 C[C@H](O)C1=CC=CC(F)=C1 SC1248 [1,1,0,0,0,0|0,0,1]=3 507 B10R1.113 C[C@H](O)C1=NC=CC(Br)=C1 AC1228 [1,1,0,0,0,0|1,0,1]=4 508 B10R1.113 FC(F)C1=CC=CC(I)=C1 72424 [1,1,0,0,0,0|2,0,0]=4 509 B10R1.113 NC(=O)C1=CC(O)=CC=C1 C75901 [1,1,0,0,0,0|1,0,1]=4 510 B10R1.113 OC1=CC=CC(C(F)F)=C1 71582 [1,1,0,0,0,0|2,0,0]=4 511 B10R1.1 C=CCC1=CC=C(O)C=C1 AC1877 [1,1,0,0,0,0|1,0,0]=3 512 B10R1.1 CC1=CC=C(CNN)C=C1 O10109 [1,1,0,0,0,0|2,0,0]=4 513 B10R1.1 CNCC1=CC=C(O)C=C1 31972 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.1 COCC1=CC=C(O)C=C1 63646 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.1 CSCC1=CC=C(Br)C=C1 W19176 [1,1,0,0,0,0|2,0,0]=4 516 B10R1.1 CSCC1=CC=C(C)C=C1 W19462 [1,1,0,0,0,0|2,0,0]=4 517 B10R1.1 CSCC1=CC=C(F)C=C1 W18716 [1,1,0,0,0,0|2,0,0]=4 518 B10R1.1 NNCC1=CC=C(F)C=C1 36999 [1,1,0,0,0,0|2,0,0]=4 519 B10R1.1 NOCC1=CC=C(Cl)C=C1 78769 [1,1,0,0,0,0|2,0,0]=4 520 B10R1.1 O=CCC1=CC=C(Cl)C=C1 74968 [1,1,0,0,0,0|0,0,0]=2 521 B10R1.4 CC1=C(CCN)C=CC=C1 C78305 [1,1,0,0,0,0|1,0,1]=4 522 B10R1.4 COCC1=C(O)C=CC=C1 AC1453 [1,1,0,0,0,0|2,0,0]=4 523 B10R1.4 N#CCC1=C(O)C=CC=C1 32266 [1,1,0,0,0,0|1,0,1]=4 524 B10R1.4 NCCC1=C(O)C=CC=C1 83456 [1,1,0,0,0,0|1,0,1]=4 525 B10R1.4 NNCC1=C(Br)C=CC=C1 37005 [1,1,0,0,0,0|2,0,0]=4 526 B10R1.4 O=CCC1=C(Br)C=CC=C1 W16824 [1,1,0,0,0,0|0,0,0]=2 527 B10R1.4 O=CCC1=C(F)C=CC=C1 W16825 [1,1,0,0,0,0|0,0,0]=2 528 B10R1.4 [BH3-]C1=C(CNC)C=CC=C1 AC8598 [1,1,0,0,0,0|2,0,0]=4 529 B10R1.10 C=CCC1=CC=CC(O)=C1 AC1729 [1,1,0,0,0,0|1,0,0]=3 530 B10R1.10 CC1=CC=CC(CCCl)=C1 C74996 [1,1,0,0,0,0|1,0,1]=4 531 B10R1.10 CCCC1=CC=CC(Br)=C1 W17019 [1,1,0,0,0,0|1,0,1]=4 532 B10R1.10 CCCC1=CC=CC(N)=C1 S11405 [1,1,0,0,0,0|1,0,1]=4 533 B10R1.10 CNCC1=CC(C)=CC=C1 C78188 [1,1,0,0,0,0|2,0,0]=4 534 B10R1.10 CSCC1=CC(F)=CC=C1 A12575 [1,1,0,0,0,0|2,0,0]=4 535 B10R1.10 CSCC1=CC=CC(Br)=C1 W10420 [1,1,0,0,0,0|2,0,0]=4 536 B10R1.10 CSCC1=CC=CC(Cl)=C1 W19463 [1,1,0,0,0,0|2,0,0]=4 537 B10R1.10 NCCC1=CC=CC(N)=C1 51444 [1,1,0,0,0,0|1,0,1]=4 538 B10R1.10 NNCC1=CC=CC(Br)=C1 AC3898 [1,1,0,0,0,0|2,0,0]=4 539 B10R1.10 NNCC1=CC=CC(F)=C1 75837 [1,1,0,0,0,0|2,0,0]=4 540 B10R1.10 O=CCC1=CC=CC(Br)=C1 AB10311 [1,1,0,0,0,0|0,0,0]=2 541 B10R1.10 O=CCC1=CC=CC(F)=C1 W16826 [1,1,0,0,0,0|0,0,0]=2 542 B10R1.17 C=C\C=C\C1=CC=CC=C1 54349 [1,1,0,0,0,0|1,0,1]=4 543 B10R1.17 CCCOC1=CC=CC=C1 C75927 [1,1,0,0,0,0|1,0,1]=4 544 B10R1.17 CCNCC1=CC=CC=C1 D77748 [1,1,0,0,0,0|1,0,1]=4 545 B10R1.17 CNNCC1=CC=CC=C1 30192 [1,1,0,0,0,0|2,0,0]=4 546 B10R1.17 ICCCC1=CC=CC=C1 AC6098 [1,1,0,0,0,0|1,0,1]=4 547 B10R1.17 [C-]#[N+]CCC1=CC=CC=C1 50056 [1,1,0,0,0,0|1,0,1]=4 548 B10R1.18 BrC(Br)=CC1=CC=CC=C1 31017 [1,1,0,0,0,0|1,0,1]=4 549 B10R1.18 CC(=O)CC1=CN=CC=C1 28512 [1,1,0,0,0,0|1,0,0]=3 550 B10R1.18 CC(=O)NC1=CC=CC=C1 D72485 [1,1,0,0,0,0|1,0,0]=3 551 B10R1.18 N=C(N)CC1=CC=CC=C1 F19863 [1,1,0,0,0,0|1,0,0]=3 552 B10R1.18 NC(=O)CC1=NC=CC=N1 26281 [1,1,0,0,0,0|2,0,0]=4 553 B10R1.18 NC(=S)CC1=CC=CC=C1 71029 [1,1,0,0,0,0|0,1,0]=3 554 B10R1.18 O=C(O)CC1=CN=CN=C1 24619 [1,1,0,0,0,0|2,0,0]=4 555 B10R1.18 O=C([O-])CC1=CN=NC=C1 P14654 [1,1,0,0,0,0|2,0,0]=4 556 B10R1.18 O=C([O-])CC1=NC=NC=C1 27827 [1,1,0,0,0,0|2,0,0]=4 557 B10R1.23 N[C@@H](C(=O)O)C1=CSC=C1 AC1517 [0,1,0,0,1,0|2,0,0]=4 558 B12R1.34 CCC(C)C(N)C1=CC=CC=C1 FD10503 [0,1,0,0,0,1|1,0,1]=4 559 B12R1.34 CCC(C)[C@H](N)C1=CC=CC=C1 F31005 [0,1,0,0,0,1|1,0,1]=4 560 B12R1.43 CC(=O)[C@@H](C)CC1=CC=CC=C1 Y10616 [0,1,0,0,0,1|0,0,0]=2 561 B12R1.43 C[C@@H](CC1=NC=CC=C1)C(=O)O F14472 [0,1,0,0,0,1|1,0,0]=3 562 B12R1.43 C[C@@H](CC1=NC=CC=N1)C(=O)O W18320 [0,1,0,0,0,1|2,0,0]=4 563 B12R1.43 C[C@H](NC1=CC=CC=C1)C(=O)O D82882 [0,1,0,0,0,1|0,0,0]=2 564 B12R1.43 C[C@H](OC1=NC=CC=C1)C(=O)O W18936 [0,1,0,0,0,1|1,0,0]=3 565 B12R1.43 C\C(=C/C1=NC=CC=C1)C(=O)O F14501 [0,1,0,0,0,1|1,0,1]=4 566 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O C73515 [0,1,0,0,0,1|1,0,0]=3 567 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O F16404 [0,1,0,0,0,1|2,0,0]=4 568 B12R1.43 O=C(O)C(=O)NC1=CC=CC=C1 W18568 [0,1,0,0,0,1|1,0,1]=4 569 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 F16780 [0,1,0,0,0,1|1,0,0]=3 570 B12R1.49 CC1=CC=C(O[C@@H](C)CN)C=C1 AR3806 [0,1,0,0,0,1|1,0,1]=4 571 B12R1.49 C[C@@H](CN)OC1=CC=C(F)C=C1 AR3803 [0,1,0,0,0,1|1,0,1]=4 572 B12R1.49 C[C@@H](CN)OC1=CC=C(F)C=C1 AR3971 [0,1,0,0,0,1|1,0,1]=4 573 B12R1.118 CN[C@H](CO)CC1=CC=CC=C1 N12599 [0,1,0,0,0,1|0,0,2]=4 574 B12R1.118 N#C[C@H](CO)CC1=CC=CC=C1 AC5751 [0,1,0,0,0,1|1,0,1]=4 575 B12R1.118 OCC(CO)CC1=CC=CC=C1 20620 [0,1,0,0,0,1|0,0,2]=4 576 B12R1.371 C[C@@H](CN)OC1=C(Cl)C=CC=C1 AR3974 [0,1,0,0,0,1|1,0,1]=4 577 B12R1.9 CC1=CC=C(C(C)(C)C#N)C=C1 74578 [0,2,0,0,0,0|1,0,1]=4 578 B12R1.10 CC(C)(C#N)C1=CC=CC(Br)=C1 68341 [0,2,0,0,0,0|1,0,1]=4 579 B12R1.10 CC(C)(C#N)C1=CC=CC(Cl)=C1 D97016 [0,2,0,0,0,0|1,0,1]=4 580 B12R1.10 CC(C)(CO)C1=CC=CC(Br)=C1 C76612 [0,2,0,0,0,0|0,0,2]=4 581 B12R1.39 CC(C)(CC=O)C1=CC=CC=C1 C75972 [0,2,0,0,0,0|0,0,0]=2 582 B12R1.195 CC(C)(C#N)C1=C(Cl)C=CC=C1 A12772 [0,2,0,0,0,0|1,0,1]=4 583 B12R1.195 CC(C)(C#N)C1=C(N)C=CC=C1 D75903 [0,2,0,0,0,0|1,0,1]=4 584 B12R1.195 CC(C)(CO)C1=C(Cl)C=CC=C1 P11280 [0,2,0,0,0,0|0,0,2]=4 585 B12R1.253 C[C@](N)(C(=O)O)C1=CC=CC=C1 67278 [0,2,0,0,0,0|0,0,0]=2 586 B12R1.253 C[C@](N)(C(=O)O)C1=CC=CC=C1 75104 [0,2,0,0,0,0|0,0,0]=2 587 B12R1.253 C[C@](N)(C(=O)O)C1=CC=CC=C1 75105 [0,2,0,0,0,0|0,0,0]=2 588 B12R1.475 C#C[C@](O)(CC)C1=CC=CC=C1 65662 [0,2,0,0,0,0|1,0,1]=4 589 B12R1.12 N#C[C@@H](CO)C1=CC=C(Br)C=C1 86253 [0,2,0,0,0,0|1,0,1]=4 590 B12R1.478 CC(=O)[C@H](C#N)C1=NC=CC=C1 C75676 [0,2,0,0,0,0|1,0,1]=4 591 B12R1.478 CC(C)[C@H](CN)C1=CC=CC=C1 A11872 [0,2,0,0,0,0|1,0,1]=4 592 B12R1.478 CC[C@@H](C(=O)O)C1=CC=CC=C1 35104 [0,2,0,0,0,0|0,0,0]=2 593 B12R1.478 CN[C@@H](C(=O)O)C1=CC=CC=C1 86305 [0,2,0,0,0,0|0,0,0]=2 594 B12R1.478 N#C[C@@H](C(=O)O)C1=CC=CC=C1 AC8944 [0,2,0,0,0,0|0,0,1]=3 595 B12R1.478 NC(=O)[C@H](CO)C1=CC=CC=C1 F16398 [0,2,0,0,0,0|0,0,0]=2 596 B12R1.478 NC[C@@H](C(=O)O)C1=CC=CC=C1 F15276 [0,2,0,0,0,0|0,0,0]=2 597 B12R1.16 C=CC[C@H](N)C1=CC=C(F)C=C1 74243 [0,2,0,0,0,0|2,0,0]=4 598 B12R1.16 C=CC[C@H](N)C1=CC=C(F)C=C1 74244 [0,2,0,0,0,0|2,0,0]=4 599 B12R1.16 C=CC[C@H](N)C1=CC=C(F)C=C1 74245 [0,2,0,0,0,0|2,0,0]=4 600 B12R1.16 C=CC[C@H](N)C1=CC=C(F)C=C1 I11603 [0,2,0,0,0,0|2,0,0]=4 601 B12R1.16 C=CC[C@H](N)C1=CC=C(F)C=C1 I11639 [0,2,0,0,0,0|2,0,0]=4 602 B12R1.16 C=CC[C@H](N)C1=CC=C(F)C=C1 N10600 [0,2,0,0,0,0|2,0,0]=4 603 B12R1.30 O=CNCC(=O)C1=CC=CC=C1 C76338 [0,2,0,0,0,0|1,0,1]=4 604 B12R1.107 C=C(NC(C)=O)C1=CC=CC=C1 84827 [0,2,0,0,0,0|0,0,2]=4 605 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 C74093 [0,2,0,0,0,0|1,0,0]=3 606 B12R1.107 C[C@@H](CC(=O)O)C1=CC=CC=C1 AC1152 [0,2,0,0,0,0|0,0,0]=2 607 B12R1.107 C[C@@H](CC(=O)O)C1=CC=CC=C1 AC6792 [0,2,0,0,0,0|0,0,0]=2 608 B12R1.107 C[C@@H](CC(=O)O)C1=NC=CC=C1 D93591 [0,2,0,0,0,0|1,0,0]=3 609 B12R1.107 C\C(=C/[N+](=O)[O-])C1=CC=CC=C1 Y14661 [0,2,0,0,0,0|0,0,1]=3 610 B12R1.107 NN(CC(=O)O)C1=CC=CC=C1 27905 [0,2,0,0,0,0|2,0,0]=4 611 B12R1.107 N[C@@H](CC(=O)O)C1=CC=NC=C1 Y11722 [0,2,0,0,0,0|2,0,0]=4 612 B12R1.107 N[C@@H](CC(=O)O)C1=NC=CC=C1 Y11797 [0,2,0,0,0,0|2,0,0]=4 613 B12R1.107 N[C@@H](CC(=O)O)C1=NC=CC=C1 Y11798 [0,2,0,0,0,0|2,0,0]=4 614 B12R1.107 O=C([O-])CC(=O)C1=CC=CC=C1 O12077 [0,2,0,0,0,0|1,0,1]=4 615 B12R1.5 COC1=CC=C(C(=O)C=O)C=C1 Y11290 [0,2,0,0,0,0|1,0,1]=4 616 B12R1.20 CC(=O)C(=O)C1=CC=C(Cl)C=C1 H10945 [0,2,0,0,0,0|1,0,1]=4 617 B12R1.20 CC(=O)N(C)C1=CC=C(C)C=C1 D93545 [0,2,0,0,0,0|1,0,0]=3 618 B12R1.20 CC1=CC=C([C@@H](N)C(=O)O)C=C1 D80223 [0,2,0,0,0,0|1,0,0]=3 619 B12R1.20 CC1=CC=C([C@@H](N)C(=O)O)C=C1 Y13382 [0,2,0,0,0,0|1,0,0]=3 620 B12R1.20 CC1=CC=C([C@@H](O)C(=O)O)C=C1 F20952 [0,2,0,0,0,0|1,0,0]=3 621 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(O)C=C1 AC1142 [0,2,0,0,0,0|0,0,0]=2 622 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(O)C=C1 AC3350 [0,2,0,0,0,0|0,0,0]=2 623 B12R1.20 C[C@@H](C(=O)O)C1=CN=C(Cl)C=C1 69943 [0,2,0,0,0,0|1,0,0]=3 624 B12R1.20 NC(=O)C(=O)C1=CC=C(Br)C=C1 A10635 [0,2,0,0,0,0|1,0,1]=4 625 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Br)C=C1 N12474 [0,2,0,0,0,0|1,0,0]=3 626 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Br)C=C1 Y10441 [0,2,0,0,0,0|1,0,0]=3 627 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Br)C=C1 Y11071 [0,2,0,0,0,0|1,0,0]=3 628 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(F)C=C1 61234 [0,2,0,0,0,0|1,0,0]=3 629 B12R1.20 O=C(O)C(=O)C1=CC=C(Br)C=C1 AB10481 [0,2,0,0,0,0|1,0,1]=4 630 B12R1.20 O=C(O)C(=O)C1=CC=C(Cl)C=C1 57454 [0,2,0,0,0,0|1,0,1]=4 631 B12R1.20 O=C(O)C(=O)C1=CC=C(F)C=C1 AB11475 [0,2,0,0,0,0|1,0,1]=4 632 B12R1.20 O=C(O)C(=O)C1=CC=C(O)C=C1 F16678 [0,2,0,0,0,0|1,0,1]=4 633 B12R1.20 O=C(O)[C@H](O)C1=CC=C(Cl)C=C1 25102 [0,2,0,0,0,0|1,0,0]=3 634 B12R1.20 O=C([O-])C(=O)C1=CC=C(O)C=C1 38640 [0,2,0,0,0,0|1,0,1]=4 635 B12R1.20 O=C([O-])[C@H](O)C1=CC=C(O)C=C1 C76190 [0,2,0,0,0,0|1,0,0]=3 636 B12R1.367 C=C[C@H](N)C1=CC(C)=C(Br)C=C1 N15452 [0,2,0,0,0,0|2,0,0]=4 637 B12R1.367 C=C[C@H](N)C1=CC(C)=C(Br)C=C1 N15453 [0,2,0,0,0,0|2,0,0]=4 638 B12R1.367 C=C[C@H](N)C1=CC(C)=C(Br)C=C1 N15454 [0,2,0,0,0,0|2,0,0]=4 639 B12R1.367 C=C[C@H](N)C1=CC(C)=C(Cl)C=C1 N15448 [0,2,0,0,0,0|2,0,0]=4 640 B12R1.367 C=C[C@H](N)C1=CC(C)=C(Cl)C=C1 N15449 [0,2,0,0,0,0|2,0,0]=4 641 B12R1.367 C=C[C@H](N)C1=CC(C)=C(Cl)C=C1 N15450 [0,2,0,0,0,0|2,0,0]=4 642 B12R1.367 C=C[C@H](N)C1=CC(C)=C(F)C=C1 N15445 [0,2,0,0,0,0|2,0,0]=4 643 B12R1.367 C=C[C@H](N)C1=CC(C)=C(F)C=C1 N15446 [0,2,0,0,0,0|2,0,0]=4 644 B12R1.367 C=C[C@H](N)C1=CC(C)=C(F)C=C1 N15447 [0,2,0,0,0,0|2,0,0]=4 645 B12R1.367 CN[C@@H](C)C1=CC(C)=C(Br)C=C1 Y12534 [0,2,0,0,0,0|2,0,0]=4 646 B12R1.367 CN[C@@H](C)C1=CC(C)=C(Br)C=C1 Y12535 [0,2,0,0,0,0|2,0,0]=4 647 B12R1.367 CN[C@@H](C)C1=CC(C)=C(Br)C=C1 Y13177 [0,2,0,0,0,0|2,0,0]=4 648 B12R1.225 CC(=O)C(=O)C1=CC=CC(F)=C1 D79282 [0,2,0,0,0,0|1,0,1]=4 649 B12R1.225 CC1=CC=CC([C@@H](C)C(=O)O)=C1 D85965 [0,2,0,0,0,0|0,0,0]=2 650 B12R1.225 CC1=CC=CC([C@@H](C)C(=O)O)=C1 F20906 [0,2,0,0,0,0|0,0,0]=2 651 B12R1.225 CC1=CC=CC([C@@H](N)C(=O)O)=C1 N15140 [0,2,0,0,0,0|1,0,0]=3 652 B12R1.225 CC1=CC=CC([C@@H](N)C(=O)O)=C1 Y14776 [0,2,0,0,0,0|1,0,0]=3 653 B12R1.225 NC(=O)[C@H](N)C1=CC=CC(F)=C1 D80946 [0,2,0,0,0,0|1,0,0]=3 654 B12R1.225 N[C@@H](C(=O)O)C1=CC(O)=CC=C1 Y11300 [0,2,0,0,0,0|1,0,0]=3 655 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(Br)=C1 Y10943 [0,2,0,0,0,0|1,0,0]=3 656 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(Br)=C1 Y11229 [0,2,0,0,0,0|1,0,0]=3 657 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(Cl)=C1 57493 [0,2,0,0,0,0|1,0,0]=3 658 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(Cl)=C1 N10486 [0,2,0,0,0,0|1,0,0]=3 659 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(Cl)=C1 Y10477 [0,2,0,0,0,0|1,0,0]=3 660 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(F)=C1 52230 [0,2,0,0,0,0|1,0,0]=3 661 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(F)=C1 AT23986 [0,2,0,0,0,0|1,0,0]=3 662 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(F)=C1 AT23988 [0,2,0,0,0,0|1,0,0]=3 663 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(F)=C1 Y11806 [0,2,0,0,0,0|1,0,0]=3 664 B12R1.225 O=C(O)C(=O)C1=CC=CC(Cl)=C1 AB11010 [0,2,0,0,0,0|1,0,1]=4 665 B12R1.225 O=C(O)[C@H](F)C1=CC=CC(Cl)=C1 98548 [0,2,0,0,0,0|1,0,0]=3 666 B12R1.225 O=C(O)[C@H](O)C1=CC=CC(Br)=C1 W18887 [0,2,0,0,0,0|1,0,0]=3 667 B12R1.225 O=C(O)[C@H](O)C1=CC=CC(Cl)=C1 SC4021 [0,2,0,0,0,0|1,0,0]=3 668 B12R1.225 O=C(O)[C@H](O)C1=CC=CC(F)=C1 C75007 [0,2,0,0,0,0|1,0,0]=3 669 B12R1.354 C=C[C@H](N)C1=C(Br)C=CC(F)=C1 Y12085 [0,2,0,0,0,0|2,0,0]=4 670 B12R1.354 C=C[C@H](N)C1=C(Br)C=CC(F)=C1 Y12086 [0,2,0,0,0,0|2,0,0]=4 671 B12R1.354 C=C[C@H](N)C1=C(Br)C=CC(F)=C1 Y13019 [0,2,0,0,0,0|2,0,0]=4 672 B12R1.354 C=C[C@H](N)C1=C(C)C=CC(F)=C1 Y12972 [0,2,0,0,0,0|2,0,0]=4 673 B12R1.354 C=C[C@H](N)C1=C(C)C=CC(F)=C1 Y13265 [0,2,0,0,0,0|2,0,0]=4 674 B12R1.354 C=C[C@H](N)C1=C(C)C=CC(F)=C1 Y13288 [0,2,0,0,0,0|2,0,0]=4 675 B12R1.354 C=C[C@H](N)C1=C(Cl)C=CC(F)=C1 Y12160 [0,2,0,0,0,0|2,0,0]=4 676 B12R1.354 C=C[C@H](N)C1=C(Cl)C=CC(F)=C1 Y12161 [0,2,0,0,0,0|2,0,0]=4 677 B12R1.354 C=C[C@H](N)C1=C(Cl)C=CC(F)=C1 Y12935 [0,2,0,0,0,0|2,0,0]=4 678 B12R1.354 C=C[C@H](N)C1=C(F)C=CC(Br)=C1 N15351 [0,2,0,0,0,0|2,0,0]=4 679 B12R1.354 CN[C@@H](C)C1=C(C)C=CC(F)=C1 Y12196 [0,2,0,0,0,0|2,0,0]=4 680 B12R1.354 CN[C@@H](C)C1=C(C)C=CC(F)=C1 Y12197 [0,2,0,0,0,0|2,0,0]=4 681 B12R1.354 CN[C@@H](C)C1=C(C)C=CC(F)=C1 Y12607 [0,2,0,0,0,0|2,0,0]=4 682 B12R1.358 C=C[C@H](N)C1=CC(C)=CC(C)=C1 N15455 [0,2,0,0,0,0|2,0,0]=4 683 B12R1.358 C=C[C@H](N)C1=CC(C)=CC(C)=C1 N15456 [0,2,0,0,0,0|2,0,0]=4 684 B12R1.358 C=C[C@H](N)C1=CC(C)=CC(C)=C1 N15457 [0,2,0,0,0,0|2,0,0]=4 685 B12R1.435 CN[C@@H](C)C1=CC=CC(OC)=C1 Y12193 [0,2,0,0,0,0|2,0,0]=4 686 B12R1.124 CC1=C([C@@H](N)C(=O)O)C=CC=C1 D83457 [0,2,0,0,0,0|1,0,0]=3 687 B12R1.124 CC1=C([C@@H](N)C(=O)O)C=CC=C1 Y11801 [0,2,0,0,0,0|1,0,0]=3 688 B12R1.124 C[C@@H](C(=O)O)N1C=CC=CC1=O W16391 [0,2,0,0,0,0|1,0,0]=3 689 B12R1.124 N[C@@H](C(=O)O)C1=C(Br)C=CC=C1 AT21607 [0,2,0,0,0,0|1,0,0]=3 690 B12R1.124 N[C@@H](C(=O)O)C1=C(Br)C=CC=C1 Y10528 [0,2,0,0,0,0|1,0,0]=3 691 B12R1.124 N[C@@H](C(=O)O)C1=C(Cl)C=CC=C1 Y11747 [0,2,0,0,0,0|1,0,0]=3 692 B12R1.124 N[C@@H](C(=O)O)C1=C(Cl)C=CC=C1 Y11901 [0,2,0,0,0,0|1,0,0]=3 693 B12R1.124 N[C@@H](C(=O)O)C1=C(F)C=CC=C1 Y13377 [0,2,0,0,0,0|1,0,0]=3 694 B12R1.124 N[C@@H](C(=O)O)C1=C(F)C=CC=C1 Y13378 [0,2,0,0,0,0|1,0,0]=3 695 B12R1.124 N[C@@H](C(=O)O)C1=C(O)C=CC=C1 Y10677 [0,2,0,0,0,0|1,0,0]=3 696 B12R1.124 O=C(O)C(=O)C1=C(Cl)C=CC=C1 AB11009 [0,2,0,0,0,0|1,0,1]=4 697 B12R1.124 O=C(O)C(=O)C1=C(F)C=CC=C1 AB7290 [0,2,0,0,0,0|1,0,1]=4 698 B12R1.124 O=C(O)[C@H](Br)C1=C(Br)C=CC=C1 P20733 [0,2,0,0,0,0|1,0,0]=3 699 B12R1.124 O=C(O)[C@H](F)C1=C(Cl)C=CC=C1 98561 [0,2,0,0,0,0|1,0,0]=3 700 B12R1.77 CN[C@@H](C)C1=C(OC)C=CC=C1 Y12190 [0,2,0,0,0,0|2,0,0]=4 701 B10R1.172 C=CC1=CC=CC(C=O)=C1 C15241 [0,0,1,1,0,0|0,0,2]=4 702 B10R1.172 C=CC1=CC=CC(C=O)=N1 W15331 [0,0,1,1,0,0|1,0,1]=4 703 B10R2.320 O=C1CC2=C1C=CC=C2 67963 [1,0,0,1,0,0|0,0,1]=3 704 B12R2.18 CC1=C(Br)C2=C(C=CC=C2)O1 54481 [0,0,0,1,0,1|1,0,1]=4 705 B12R2.18 CC1=C2C=CC=CC2=NN1C D83537 [0,0,0,1,0,1|2,0,0]=4 706 B12R2.18 CC1NC2=C(C=CC=C2)C1C C74121 [0,0,0,1,0,1|1,0,1]=4 707 B12R2.18 CN1N=C2C=CC=CC2=C1Br P13368 [0,0,0,1,0,1|2,0,0]=4 708 B12R2.18 CN1N=C2C=CC=CC2=C1N D83793 [0,0,0,1,0,1|2,0,0]=4 709 B12R2.24 C[C@H]1CNC2=C(C=CC=C2)O1 71634 [0,0,0,1,0,1|1,0,1]=4 710 B12R2.24 C[C@H]1COC2=C(C=CC=C2)N1 71352 [0,0,0,1,0,1|0,0,2]=4 711 B12R2.27 O=CC1CC1C2=CC=NC=C2 30186 [0,0,0,1,0,1|1,0,0]=3 712 B12R2.27 OCC1CC1C2=CC=CC=C2 Y11022 [0,0,0,1,0,1|0,0,2]=4 713 B12R2.27 OC[C@@H]1C[C@@H]1C2=CC=CC=C2 55231 [0,0,0,1,0,1|0,0,2]=4 714 B12R2.27 OC[C@H]1C[C@@H]1C2=CC=CC=C2 55237 [0,0,0,1,0,1|0,0,2]=4 715 B12R2.32 BrCC1CC2=C(C=CC=C2)C1 83149 [0,0,0,1,0,1|1,0,1]=4 716 B12R2.32 OC[C@H]1CC2=C(C=CC=C2)N1 30218 [0,0,0,1,0,1|0,0,2]=4 717 B12R2.32 OC[C@H]1CC2=C(C=CC=C2)N1 P12564 [0,0,0,1,0,1|0,0,2]=4 718 B12R2.32 OC[C@H]1CC2=C(C=CC=C2)O1 25158 [0,0,0,1,0,1|0,0,2]=4 719 B12R2.2058 C1=CC=C(CC2CNC2)C=C1 A50762 [0,0,0,1,0,1|1,0,1]=4 720 B12R2.2058 C1=CC=C(NC2CCC2)C=C1 W12187 [0,0,0,1,0,1|1,0,1]=4 721 B12R2.2058 C1=CC=C(OC2CNC2)C=C1 88509 [0,0,0,1,0,1|1,0,1]=4 722 B12R2.48 C#CC1(C2=CC=CC=C2)CC1 C14707 [0,1,0,1,0,0|1,0,1]=4 723 B12R2.48 NCC1(C2=CC=CC=C2)CC1 31434 [0,1,0,1,0,0|1,0,1]=4 724 B12R2.48 OCC1(C2=CC=CC=C2)CC1 71001 [0,1,0,1,0,0|0,0,2]=4 725 B12R2.116 FC1(C2=CC=CC=C2)CNC1 85150 [0,1,0,1,0,0|1,0,1]=4 726 B12R2.116 NC1(C2=CC=CC=C2)COC1 59767 [0,1,0,1,0,0|0,0,2]=4 727 B12R2.116 OC1(C2=CC=CC=C2)CNC1 38604 [0,1,0,1,0,0|1,0,1]=4 728 B12R2.2403 C[C@]1(O)CCC2=C1C=CC=C2 72298 [0,1,0,1,0,0|1,0,1]=4 729 B12R2.1 CO[C@H]1OCC2=C1C=CC=C2 T71210 [0,1,0,1,0,0|2,0,0]=4 730 B12R2.1 NCC1=CSC2=C1C=CC=C2 AC2201 [0,1,0,1,0,0|0,1,1]=4 731 B12R2.1 NCC1=CSC2=C1C=CC=C2 D94984 [0,1,0,1,0,0|0,1,1]=4 732 B12R2.1 NC[C@H]1CNC2=C1C=CC=C2 31906 [0,1,0,1,0,0|1,0,1]=4 733 B12R2.1 O=CC1=COC2=C1C=CC=C2 29951 [0,1,0,1,0,0|0,0,2]=4 734 B12R2.1 OC[C@H]1CNC2=C1C=CC=C2 AB9481 [0,1,0,1,0,0|0,0,2]=4 735 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 59896 [0,1,0,1,0,0|1,0,1]=4 736 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 59947 [0,1,0,1,0,0|1,0,1]=4 737 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 N11212 [0,1,0,1,0,0|1,0,1]=4 738 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 69529 [0,1,0,1,0,0|1,0,1]=4 739 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 P12556 [0,1,0,1,0,0|1,0,1]=4 740 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 P15250 [0,1,0,1,0,0|1,0,1]=4 741 B12R2.22 N[C@H]1C[C@H](C2=CC=CC=C2)C1 38954 [0,1,0,1,0,0|1,0,1]=4 742 B12R2.22 O[C@H]1C[C@@H](C2=CC=CC=C2)C1 91858 [0,1,0,1,0,0|0,0,2]=4 743 B12R2.22 O[C@H]1C[C@H](C2=CC=CC=C2)C1 91835 [0,1,0,1,0,0|0,0,2]=4 744 B12R2.1081 CC1=CN=CC2=CC=CC=C12 84296 [0,1,0,1,0,0|1,0,1]=4 745 B12R2.1081 CC1=NC=NC2=CC=CC=C21 C76230 [0,1,0,1,0,0|1,0,1]=4 746 B12R2.1081 C[C@H]1CCNC2=C1C=CC=C2 36617 [0,1,0,1,0,0|1,0,1]=4 747 B12R2.1081 C[C@H]1CCNC2=C1C=CC=C2 A10659 [0,1,0,1,0,0|1,0,1]=4 748 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 64901 [0,1,0,1,0,0|1,0,1]=4 749 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 72471 [0,1,0,1,0,0|1,0,1]=4 750 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 W10122 [0,1,0,1,0,0|1,0,1]=4 751 B12R2.2028 CN1C=C(Cl)C2=C1C=CC=C2 AB10986 [0,1,0,1,0,0|2,0,0]=4 752 B12R2.2028 CN1C=[N+](C)C2=C1C=CC=C2 C76285 [0,1,0,1,0,0|2,0,0]=4 753 B12R2.2028 CN1N=C(Br)C2=C1C=CC=C2 24258 [0,1,0,1,0,0|2,0,0]=4 754 B12R2.2028 CN1N=C(I)C2=C1C=CC=C2 87996 [0,1,0,1,0,0|2,0,0]=4 755 B12R2.2028 CN1NC(=O)C2=C1C=CC=C2 C71035 [0,1,0,1,0,0|1,0,0]=3 756 B12R2.2028 C[C@@H]1NC(=O)C2=C1C=CC=C2 72362 [0,1,0,1,0,0|0,0,0]=2 757 B12R2.2028 N[C@H]1NC(=O)C2=C1C=CC=C2 Y10046 [0,1,0,1,0,0|1,0,0]=3 758 B12R2.79 NC1CC1C2=CC=C(Br)C=C2 F31086 [0,1,0,1,0,0|1,0,1]=4 759 B12R2.79 NC1CC1C2=CC=C(F)C=C2 F31089 [0,1,0,1,0,0|1,0,1]=4 760 B12R2.79 N[C@H]1C[C@@H]1C2=CC=C(F)C=C2 F31004 [0,1,0,1,0,0|1,0,1]=4 761 B12R2.79 N[C@H]1C[C@@H]1C2=CC=C(F)C=C2 F31006 [0,1,0,1,0,0|1,0,1]=4 762 B12R2.290 CC1(C2=CC=C(Br)C=C2)CC1 D85572 [0,1,0,1,0,0|1,0,1]=4 763 B12R2.612 CC1=CNC2=C1C=CC(Br)=C2 50641 [0,1,0,1,0,0|1,0,1]=4 764 B12R2.612 CC1=CNC2=C1C=CC(Cl)=C2 82345 [0,1,0,1,0,0|1,0,1]=4 765 B12R2.612 CC1=CNC2=C1C=CC(F)=C2 D97643 [0,1,0,1,0,0|1,0,1]=4 766 B12R2.612 CC1=CNC2=C1C=CC(N)=C2 P11526 [0,1,0,1,0,0|1,0,1]=4 767 B12R2.612 CN1C=CC2=C1C=CC(Cl)=C2 A10102 [0,1,0,1,0,0|2,0,0]=4 768 B12R2.612 CN1C=CC2=C1C=CC(O)=C2 F14443 [0,1,0,1,0,0|2,0,0]=4 769 B12R2.2302 BrC1=CC=C(C2CCC2)C=C1 F52110 [0,1,0,1,0,0|1,0,1]=4 770 B12R2.2302 BrC1=CC=C(C2CNC2)C=C1 85616 [0,1,0,1,0,0|1,0,1]=4 771 B12R2.2302 FC1=CC=C(C2CNC2)C=C1 84084 [0,1,0,1,0,0|1,0,1]=4 772 B12R2.2302 NC1=CC=C(C2COC2)C=C1 85368 [0,1,0,1,0,0|0,0,2]=4 773 B12R2.80 NC1CC1C2=CC=CC(Cl)=C2 Y10415 [0,1,0,1,0,0|1,0,1]=4 774 B12R2.80 NC1CC1C2=CC=CC(F)=C2 F31083 [0,1,0,1,0,0|1,0,1]=4 775 B12R2.132 CC1=CC2=C(C=C1)N=CN2C F50516 [0,1,0,1,0,0|2,0,0]=4 776 B12R2.132 CC1=CNC2=C1C=C(F)C=C2 87157 [0,1,0,1,0,0|1,0,1]=4 777 B12R2.132 CN1C=CC2=C1C=C(Br)C=C2 78668 [0,1,0,1,0,0|2,0,0]=4 778 B12R2.132 CN1C=CC2=C1C=C(N)C=C2 C76766 [0,1,0,1,0,0|2,0,0]=4 779 B12R2.132 CN1C=NC2=C1C=C(N)C=C2 C74374 [0,1,0,1,0,0|2,0,0]=4 780 B12R2.196 CN1C=CC2=C(Br)C=CC=C21 69935 [0,1,0,1,0,0|2,0,0]=4 781 B12R2.196 CN1C=CC2=C(O)C=CC=C21 25848 [0,1,0,1,0,0|2,0,0]=4 782 B12R2.196 CN1C=CC2=C1C=CC=C2N 51446 [0,1,0,1,0,0|2,0,0]=4 783 B12R2.196 CN1C=NC2=C(Br)C=CC=C21 35894 [0,1,0,1,0,0|2,0,0]=4 784 B12R2.196 CN1C=NC2=C(N)C=CC=C21 O10421 [0,1,0,1,0,0|2,0,0]=4 785 B12R2.196 C[C@H]1CNC2=C(N)C=CC=C21 P20144 [0,1,0,1,0,0|1,0,1]=4 786 B12R2.2313 BrC1=CC(C2CNC2)=CC=C1 85615 [0,1,0,1,0,0|1,0,1]=4 787 B12R2.2313 BrC1=CC([C@@H]2CCN2)=CC=C1 P19006 [0,1,0,1,0,0|2,0,0]=4 788 B12R2.2313 BrC1=CC([C@@H]2CCN2)=CC=C1 P19042 [0,1,0,1,0,0|2,0,0]=4 789 B12R2.2313 FC1=CC(C2CNC2)=CC=C1 85611 [0,1,0,1,0,0|1,0,1]=4 790 B12R2.88 CC1(C2=C(Br)C=CC=C2)CC1 W16978 [0,1,0,1,0,0|1,0,1]=4 791 B12R2.203 CC1=CNC2=CC=CC(O)=C12 71522 [0,1,0,1,0,0|1,0,1]=4 792 B12R2.203 CN1C=NC2=C1C(N)=CC=C2 O10422 [0,1,0,1,0,0|2,0,0]=4 793 B12R2.203 CN1C=NC2=CC=CC(Br)=C21 91615 [0,1,0,1,0,0|2,0,0]=4 794 B12R2.517 ClC1=C(C2CNC2)C=CC=C1 85612 [0,1,0,1,0,0|1,0,1]=4 795 B12R2.517 IC1=C(C2COC2)C=CC=C1 86794 [0,1,0,1,0,0|0,0,2]=4 796 B8R1.7 CC(C)C1=CC=CO1 81450 [1,0,0,0,1,0|1,0,1]=4 797 B8R1.7 C[C@H](N)C1=CC=CO1 Y10899 [1,0,0,0,1,0|2,0,0]=4 798 B8R1.7 C[C@H](N)C1=CC=CO1 Y12106 [1,0,0,0,1,0|2,0,0]=4 799 B8R1.7 C[C@H](N)C1=CC=CS1 82880 [1,0,0,0,1,0|2,0,0]=4 800 B8R1.7 C[C@H](N)C1=CC=CS1 D81260 [1,0,0,0,1,0|2,0,0]=4 801 B8R1.7 C[C@H](N)C1=CC=CS1 N11134 [1,0,0,0,1,0|2,0,0]=4 802 B8R1.7 C[C@H](N)C1=CC=CS1 N12970 [1,0,0,0,1,0|2,0,0]=4 803 B8R1.7 C[C@H](N)C1=CC=CS1 Y10683 [1,0,0,0,1,0|2,0,0]=4 804 B8R1.7 C[C@H](N)C1=CSC=C1 27894 [1,0,0,0,1,0|2,0,0]=4 805 B8R1.7 C[C@H](N)C1=CSC=C1 Y14612 [1,0,0,0,1,0|2,0,0]=4 806 B8R1.7 C[C@H](O)C1=CSC=C1 79116 [1,0,0,0,1,0|1,0,1]=4 807 B12R1.27 C[C@@H](CO)OCC1=CC=CC=C1 Y10083 [0,0,0,0,0,2|0,0,2]=4