0 B9R1.8 BrC#CC1=CC=CC=C1 A51120 [0,0,0,0,0,0|1,0,2]=3 1 B9R1.8 BrCCC1=CC=NC=C1 C71689 [0,0,0,0,0,0|2,0,1]=3 2 B9R1.8 CCNC1=CC=CN=C1 C15578 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.8 CNCC1=CC=NC=C1 AR1712 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.8 CNCC1=CN=NC=C1 P16258 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.8 CNCC1=NC=CC=N1 W11490 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.8 ClCCC1=CC=NC=C1 O11064 [0,0,0,0,0,0|2,0,1]=3 7 B9R1.8 N#CCC1=CN=NC=C1 37056 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.8 N#CCC1=NC=CC=N1 37061 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.8 N#CCC1=NC=CN=C1 50051 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.8 NCCC1=NC=CC=N1 P15951 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.8 NCCC1=NC=CN=C1 AR1061 [0,0,0,0,0,0|3,0,1]=4 12 B9R1.8 NCCC1=NC=NC=C1 P18517 [0,0,0,0,0,0|3,0,1]=4 13 B9R1.8 NNCC1=CC=CN=C1 78930 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.8 NNCC1=CC=NC=C1 37009 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.8 NNCC1=CC=NC=C1 BL009189 [0,0,0,0,0,0|3,0,0]=3 16 B9R1.8 NNCC1=CN=CN=C1 37093 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.8 NNCC1=NC=CC=C1 78929 [0,0,0,0,0,0|3,0,0]=3 18 B9R1.8 NNCC1=NC=CN=C1 37235 [0,0,0,0,0,0|4,0,0]=4 19 B9R1.8 NOCC1=CN=CC=C1 AC6038 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.8 N\N=C\C1=CC=CC=C1 D81797 [0,0,0,0,0,0|2,0,1]=3 21 B9R1.8 OCCC1=CN=CN=C1 27368 [0,0,0,0,0,0|2,0,2]=4 22 B9R1.8 OCCC1=NC=CC=N1 C14218 [0,0,0,0,0,0|2,0,2]=4 23 B9R1.8 O\N=C/C1=CC=CC=C1 N10040 [0,0,0,0,0,0|1,0,2]=3 24 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 C11398 [0,0,0,0,0,0|2,0,0]=2 25 B8R1.2 BrCC1=CN=CN=C1 O11299 [1,0,0,0,0,0|3,0,0]=4 26 B8R1.2 BrCC1=NC=CN=C1 31757 [1,0,0,0,0,0|3,0,0]=4 27 B8R1.2 BrCC1=NC=NC=C1 Y10744 [1,0,0,0,0,0|3,0,0]=4 28 B8R1.2 BrCC1=NN=CC=C1 27114 [1,0,0,0,0,0|3,0,0]=4 29 B8R1.2 CCC1=NC=NC=C1 F17281 [1,0,0,0,0,0|2,0,1]=4 30 B8R1.2 ClCC1=NC=CN=C1 37060 [1,0,0,0,0,0|3,0,0]=4 31 B8R1.2 ClCC1=NN=CC=C1 37063 [1,0,0,0,0,0|3,0,0]=4 32 B8R1.2 N#CC1=NC=CC=C1 D77869 [1,0,0,0,0,0|2,0,1]=4 33 B8R1.2 NCC1=CC=CC=C1 RB3068 [1,0,0,0,0,0|1,0,0]=2 34 B8R1.2 NCC1=CC=CN=N1 36976 [1,0,0,0,0,0|3,0,0]=4 35 B8R1.2 NCC1=CC=CN=N1 AT13034 [1,0,0,0,0,0|3,0,0]=4 36 B8R1.2 NCC1=CC=CN=N1 P15536 [1,0,0,0,0,0|3,0,0]=4 37 B8R1.2 NCC1=CC=NC=C1 35876 [1,0,0,0,0,0|2,0,0]=3 38 B8R1.2 NCC1=CN=CN=C1 26963 [1,0,0,0,0,0|3,0,0]=4 39 B8R1.2 NCC1=CN=NC=C1 27223 [1,0,0,0,0,0|3,0,0]=4 40 B8R1.2 NCC1=CN=NC=C1 36975 [1,0,0,0,0,0|3,0,0]=4 41 B8R1.2 NCC1=NC=CN=C1 67569 [1,0,0,0,0,0|3,0,0]=4 42 B8R1.2 NNC1=CC=CN=C1 S12141 [1,0,0,0,0,0|3,0,0]=4 43 B8R1.2 O=CC1=NC=NC=C1 26359 [1,0,0,0,0,0|2,0,0]=3 44 B8R1.2 OCC1=CN=NC=C1 37054 [1,0,0,0,0,0|2,0,1]=4 45 B8R1.2 SCC1=CC=NC=C1 F18336 [1,0,0,0,0,0|1,1,0]=3 46 B8R1.2 SCC1=CN=CC=C1 F18343 [1,0,0,0,0,0|1,1,0]=3 47 B8R1.2 SCC1=NC=CC=C1 Y10072 [1,0,0,0,0,0|1,1,0]=3 48 B8R1.2 [C-]#[N+]C1=CC=CC=C1 AB1473 [1,0,0,0,0,0|1,0,1]=3 49 B10R1.1 C=CCC1=CC=C(O)C=C1 AC1877 [0,1,0,0,0,0|1,0,0]=2 50 B10R1.1 CC1=CC=C(CNN)C=C1 O10109 [0,1,0,0,0,0|2,0,0]=3 51 B10R1.1 CC1=CN=C(CC#N)C=C1 C74949 [0,1,0,0,0,0|2,0,1]=4 52 B10R1.1 CC1=NC=C(CCO)C=C1 54746 [0,1,0,0,0,0|1,0,2]=4 53 B10R1.1 CCNC1=CC=C(F)C=C1 AB11321 [0,1,0,0,0,0|2,0,1]=4 54 B10R1.1 CCSC1=CC=C(C)C=C1 H10147 [0,1,0,0,0,0|2,0,1]=4 55 B10R1.1 CNCC1=CC=C(O)C=C1 31972 [0,1,0,0,0,0|2,0,0]=3 56 B10R1.1 COCC1=CC=C(O)C=C1 63646 [0,1,0,0,0,0|2,0,0]=3 57 B10R1.1 CSCC1=CC=C(Br)C=C1 W19176 [0,1,0,0,0,0|2,0,0]=3 58 B10R1.1 CSCC1=CC=C(C)C=C1 W19462 [0,1,0,0,0,0|2,0,0]=3 59 B10R1.1 CSCC1=CC=C(F)C=C1 W18716 [0,1,0,0,0,0|2,0,0]=3 60 B10R1.1 N#CCC1=CN=C(Br)C=C1 AB10135 [0,1,0,0,0,0|2,0,1]=4 61 B10R1.1 N#CCC1=CN=C(F)C=C1 93599 [0,1,0,0,0,0|2,0,1]=4 62 B10R1.1 N#CCC1=NC=C(N)C=C1 W17291 [0,1,0,0,0,0|2,0,1]=4 63 B10R1.1 NCCC1=CN=C(Cl)C=C1 85004 [0,1,0,0,0,0|2,0,1]=4 64 B10R1.1 NNCC1=CC=C(F)C=C1 36999 [0,1,0,0,0,0|2,0,0]=3 65 B10R1.1 NNCC1=CN=C(Cl)C=C1 W16788 [0,1,0,0,0,0|3,0,0]=4 66 B10R1.1 NOCC1=CC=C(Cl)C=C1 78769 [0,1,0,0,0,0|2,0,0]=3 67 B10R1.1 O=CCC1=CC=C(Cl)C=C1 74968 [0,1,0,0,0,0|0,0,0]=1 68 B10R1.1 OCCC1=NC=C(Br)C=C1 37598 [0,1,0,0,0,0|1,0,2]=4 69 B10R1.1 OCCC1=NC=C(F)C=C1 P18353 [0,1,0,0,0,0|1,0,2]=4 70 B10R1.4 CC1=C(CCN)C=CC=C1 C78305 [0,1,0,0,0,0|1,0,1]=3 71 B10R1.4 CC1=CC=CN=C1CCN C80033 [0,1,0,0,0,0|2,0,1]=4 72 B10R1.4 CCNC1=C(O)C=CC=C1 I11473 [0,1,0,0,0,0|2,0,1]=4 73 B10R1.4 CNCC1=CC=CN=C1C AC2519 [0,1,0,0,0,0|3,0,0]=4 74 B10R1.4 COCC1=C(O)C=CC=C1 AC1453 [0,1,0,0,0,0|2,0,0]=3 75 B10R1.4 N#CCC1=C(Br)C=CC=N1 P10900 [0,1,0,0,0,0|2,0,1]=4 76 B10R1.4 N#CCC1=C(Cl)C=NC=C1 AC8798 [0,1,0,0,0,0|2,0,1]=4 77 B10R1.4 N#CCC1=C(F)C=CC=N1 O10465 [0,1,0,0,0,0|2,0,1]=4 78 B10R1.4 N#CCC1=C(N)N=CC=C1 D81373 [0,1,0,0,0,0|2,0,1]=4 79 B10R1.4 N#CCC1=C(O)C=CC=C1 32266 [0,1,0,0,0,0|1,0,1]=3 80 B10R1.4 N#CCC1=CC=CN=C1Br C71752 [0,1,0,0,0,0|2,0,1]=4 81 B10R1.4 N#CCC1=NC=CC=C1N C71092 [0,1,0,0,0,0|2,0,1]=4 82 B10R1.4 NC1=C(CCO)C=CC=N1 70885 [0,1,0,0,0,0|1,0,2]=4 83 B10R1.4 NCCC1=C(Br)C=CC=N1 P10594 [0,1,0,0,0,0|2,0,1]=4 84 B10R1.4 NCCC1=C(O)C=CC=C1 83456 [0,1,0,0,0,0|1,0,1]=3 85 B10R1.4 NNCC1=C(Br)C=CC=C1 37005 [0,1,0,0,0,0|2,0,0]=3 86 B10R1.4 O=CCC1=C(Br)C=CC=C1 W16824 [0,1,0,0,0,0|0,0,0]=1 87 B10R1.4 O=CCC1=C(F)C=CC=C1 W16825 [0,1,0,0,0,0|0,0,0]=1 88 B10R1.4 OCCC1=C(F)C=CC=N1 P15943 [0,1,0,0,0,0|1,0,2]=4 89 B10R1.4 [BH3-]C1=C(CNC)C=CC=C1 AC8598 [0,1,0,0,0,0|2,0,0]=3 90 B10R1.10 C=CCC1=CC=CC(O)=C1 AC1729 [0,1,0,0,0,0|1,0,0]=2 91 B10R1.10 CC#CC1=CC=CC(Br)=C1 Y10633 [0,1,0,0,0,0|1,0,2]=4 92 B10R1.10 CC1=CC=CC(CCCl)=C1 C74996 [0,1,0,0,0,0|1,0,1]=3 93 B10R1.10 CCCC1=CC=CC(Br)=C1 W17019 [0,1,0,0,0,0|1,0,1]=3 94 B10R1.10 CCCC1=CC=CC(N)=C1 S11405 [0,1,0,0,0,0|1,0,1]=3 95 B10R1.10 CCNC1=CC=CC(F)=C1 AB11320 [0,1,0,0,0,0|2,0,1]=4 96 B10R1.10 CCNC1=CC=CC(O)=C1 T71675 [0,1,0,0,0,0|2,0,1]=4 97 B10R1.10 CNCC1=CC(C)=CC=C1 C78188 [0,1,0,0,0,0|2,0,0]=3 98 B10R1.10 CNCC1=CC=CC(Br)=N1 C76128 [0,1,0,0,0,0|3,0,0]=4 99 B10R1.10 COCC1=CC(Br)=CN=C1 W19232 [0,1,0,0,0,0|3,0,0]=4 100 B10R1.10 COCC1=CC(Cl)=NC=C1 CS1797 [0,1,0,0,0,0|3,0,0]=4 101 B10R1.10 CSCC1=CC(F)=CC=C1 A12575 [0,1,0,0,0,0|2,0,0]=3 102 B10R1.10 CSCC1=CC(N)=NC=C1 79313 [0,1,0,0,0,0|3,0,0]=4 103 B10R1.10 CSCC1=CC=CC(Br)=C1 W10420 [0,1,0,0,0,0|2,0,0]=3 104 B10R1.10 CSCC1=CC=CC(Cl)=C1 W19463 [0,1,0,0,0,0|2,0,0]=3 105 B10R1.10 N#CCC1=CC(Br)=CN=C1 69670 [0,1,0,0,0,0|2,0,1]=4 106 B10R1.10 N#CCC1=CC(Br)=NC=C1 81694 [0,1,0,0,0,0|2,0,1]=4 107 B10R1.10 N#CCC1=CC(Cl)=NC=C1 81695 [0,1,0,0,0,0|2,0,1]=4 108 B10R1.10 N#CCC1=CC(F)=CN=C1 39148 [0,1,0,0,0,0|2,0,1]=4 109 B10R1.10 N#CCC1=CC=CC(F)=N1 W13471 [0,1,0,0,0,0|2,0,1]=4 110 B10R1.10 N#CCC1=NC=CC(Br)=C1 O10478 [0,1,0,0,0,0|2,0,1]=4 111 B10R1.10 N#CCC1=NC=CC(F)=C1 C71012 [0,1,0,0,0,0|2,0,1]=4 112 B10R1.10 NCCC1=CC=CC(N)=C1 51444 [0,1,0,0,0,0|1,0,1]=3 113 B10R1.10 NNCC1=CC=CC(Br)=C1 AC3898 [0,1,0,0,0,0|2,0,0]=3 114 B10R1.10 NNCC1=CC=CC(F)=C1 75837 [0,1,0,0,0,0|2,0,0]=3 115 B10R1.10 O=CCC1=CC=CC(Br)=C1 AB10311 [0,1,0,0,0,0|0,0,0]=1 116 B10R1.10 O=CCC1=CC=CC(F)=C1 W16826 [0,1,0,0,0,0|0,0,0]=1 117 B10R1.10 OCCC1=CC(Cl)=NC=C1 70307 [0,1,0,0,0,0|1,0,2]=4 118 B10R1.10 OCCC1=CC=CC(Br)=N1 AC1439 [0,1,0,0,0,0|1,0,2]=4 119 B10R1.10 OCCC1=NC=CC(Br)=C1 73397 [0,1,0,0,0,0|1,0,2]=4 120 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 31291 [0,1,0,0,0,0|1,0,1]=3 121 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 32646 [0,1,0,0,0,0|1,0,1]=3 122 B10R1.15 C=C(CBr)C1=CC=CC=C1 35089 [0,1,0,0,0,0|1,0,2]=4 123 B10R1.15 C=C(CC)C1=CC=CC=C1 C73845 [0,1,0,0,0,0|1,0,2]=4 124 B10R1.15 C=CC(=O)C1=CC=CC=C1 77875 [0,1,0,0,0,0|1,0,1]=3 125 B10R1.15 C=C[C@H](N)C1=CC=CC=C1 Y11941 [0,1,0,0,0,0|1,0,0]=2 126 B10R1.15 C=C[C@H](N)C1=CC=CC=C1 Y11942 [0,1,0,0,0,0|1,0,0]=2 127 B10R1.15 C=C[C@H](N)C1=CC=CC=C1 Y12425 [0,1,0,0,0,0|1,0,0]=2 128 B10R1.15 CCN(C)C1=CC=CC=C1 S10715 [0,1,0,0,0,0|2,0,1]=4 129 B10R1.15 CC[C@H](Br)C1=CC=CC=C1 A11640 [0,1,0,0,0,0|1,0,1]=3 130 B10R1.15 CC[C@H](N)C1=CC=CN=C1 31586 [0,1,0,0,0,0|2,0,1]=4 131 B10R1.15 CC[C@H](N)C1=CC=CN=C1 74009 [0,1,0,0,0,0|2,0,1]=4 132 B10R1.15 CC[C@H](N)C1=CC=NC=C1 31287 [0,1,0,0,0,0|2,0,1]=4 133 B10R1.15 CC[C@H](N)C1=CC=NC=C1 74015 [0,1,0,0,0,0|2,0,1]=4 134 B10R1.15 CC[C@H](N)C1=CC=NC=C1 74017 [0,1,0,0,0,0|2,0,1]=4 135 B10R1.15 CC[C@H](N)C1=CC=NC=C1 D81379 [0,1,0,0,0,0|2,0,1]=4 136 B10R1.15 CC[C@H](N)C1=NC=CC=C1 F16910 [0,1,0,0,0,0|2,0,1]=4 137 B10R1.15 CC[C@H](N)C1=NC=CC=C1 I11245 [0,1,0,0,0,0|2,0,1]=4 138 B10R1.15 CC[C@H](N)C1=NC=CC=C1 N10610 [0,1,0,0,0,0|2,0,1]=4 139 B10R1.15 CC[C@H](N)C1=NC=CC=C1 Y11176 [0,1,0,0,0,0|2,0,1]=4 140 B10R1.15 CC[C@H](N)C1=NC=CC=C1 Y11466 [0,1,0,0,0,0|2,0,1]=4 141 B10R1.15 CC[C@H](N)C1=NC=CC=C1 Y12115 [0,1,0,0,0,0|2,0,1]=4 142 B10R1.15 CC[C@H](O)C1=CC=CC=C1 T71858 [0,1,0,0,0,0|1,0,1]=3 143 B10R1.15 CC[C@H](O)C1=CC=CC=C1 T72707 [0,1,0,0,0,0|1,0,1]=3 144 B10R1.15 CN(C=O)C1=NC=CC=C1 A12745 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.15 F[C@@H](CBr)C1=CC=CC=C1 32835 [0,1,0,0,0,0|1,0,1]=3 146 B10R1.15 N=C(NN)C1=CC=CC=C1 D97377 [0,1,0,0,0,0|2,0,1]=4 147 B10R1.15 NC[C@H](N)C1=CC=CC=C1 N12631 [0,1,0,0,0,0|1,0,1]=3 148 B10R1.15 NC[C@H](O)C1=NC=CC=C1 C77057 [0,1,0,0,0,0|2,0,1]=4 149 B10R1.15 NNC(=S)C1=CC=CC=C1 W10972 [0,1,0,0,0,0|2,0,1]=4 150 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 32217 [0,1,0,0,0,0|1,0,2]=4 151 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y11463 [0,1,0,0,0,0|1,0,2]=4 152 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y12121 [0,1,0,0,0,0|1,0,2]=4 153 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y13389 [0,1,0,0,0,0|1,0,2]=4 154 B10R1.15 N[C@@H](CO)C1=CN=CC=C1 F13354 [0,1,0,0,0,0|1,0,2]=4 155 B10R1.15 N[C@@H](CO)C1=CN=CC=C1 Y12482 [0,1,0,0,0,0|1,0,2]=4 156 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 D85222 [0,1,0,0,0,0|1,0,2]=4 157 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y13398 [0,1,0,0,0,0|1,0,2]=4 158 B10R1.15 O=C[C@H](Br)C1=CC=CC=C1 F13390 [0,1,0,0,0,0|0,0,0]=1 159 B10R1.15 O[C@@H](CF)C1=CC=CC=C1 C91661 [0,1,0,0,0,0|1,0,1]=3 160 B10R1.17 C=C\C=C\C1=CC=CC=C1 54349 [0,1,0,0,0,0|1,0,1]=3 161 B10R1.17 CCCCC1=CC=NC=C1 BL000376 [0,1,0,0,0,0|2,0,1]=4 162 B10R1.17 CCCOC1=CC=CC=C1 C75927 [0,1,0,0,0,0|1,0,1]=3 163 B10R1.17 CCNCC1=CC=CC=C1 D77748 [0,1,0,0,0,0|1,0,1]=3 164 B10R1.17 CNCCC1=CC=CN=C1 AR1271 [0,1,0,0,0,0|2,0,1]=4 165 B10R1.17 CNNCC1=CC=CC=C1 30192 [0,1,0,0,0,0|2,0,0]=3 166 B10R1.17 CNNCC1=CC=CN=C1 30189 [0,1,0,0,0,0|3,0,0]=4 167 B10R1.17 ICCCC1=CC=CC=C1 AC6098 [0,1,0,0,0,0|1,0,1]=3 168 B10R1.17 N#CCCC1=CC=NC=C1 P16939 [0,1,0,0,0,0|2,0,1]=4 169 B10R1.17 NCC#CC1=CC=CC=C1 AB10164 [0,1,0,0,0,0|1,0,2]=4 170 B10R1.17 NCCCC1=CC=CN=C1 31799 [0,1,0,0,0,0|2,0,1]=4 171 B10R1.17 NCCCC1=CC=NC=C1 S12068 [0,1,0,0,0,0|2,0,1]=4 172 B10R1.17 NCCOC1=CC=NC=C1 F31099 [0,1,0,0,0,0|2,0,1]=4 173 B10R1.17 NCCOC1=CC=NC=C1 Y10522 [0,1,0,0,0,0|2,0,1]=4 174 B10R1.17 OCCOC1=CN=CC=C1 D86242 [0,1,0,0,0,0|1,0,2]=4 175 B10R1.17 OC\C=C\C1=NC=CC=C1 AC7737 [0,1,0,0,0,0|1,0,2]=4 176 B10R1.17 SCCCC1=CC=NC=C1 F18251 [0,1,0,0,0,0|1,1,1]=4 177 B10R1.17 [C-]#[N+]CCC1=CC=CC=C1 50056 [0,1,0,0,0,0|1,0,1]=3 178 B10R1.18 BrC(Br)=CC1=CC=CC=C1 31017 [0,1,0,0,0,0|1,0,1]=3 179 B10R1.18 CC(=O)CC1=CN=CC=C1 28512 [0,1,0,0,0,0|1,0,0]=2 180 B10R1.18 CC(=O)NC1=CC=CC=C1 D72485 [0,1,0,0,0,0|1,0,0]=2 181 B10R1.18 C[C@H](N)CC1=NC=CC=C1 C80024 [0,1,0,0,0,0|2,0,1]=4 182 B10R1.18 FC(F)SC1=CC=CC=C1 I11988 [0,1,0,0,0,0|2,0,1]=4 183 B10R1.18 N=C(N)CC1=CC=CC=C1 F19863 [0,1,0,0,0,0|1,0,0]=2 184 B10R1.18 NC(=O)CC1=NC=CC=N1 26281 [0,1,0,0,0,0|2,0,0]=3 185 B10R1.18 NC(=O)NC1=NC=CN=C1 W17943 [0,1,0,0,0,0|3,0,0]=4 186 B10R1.18 NC(=S)CC1=CC=CC=C1 71029 [0,1,0,0,0,0|0,1,0]=2 187 B10R1.18 O=C(O)CC1=CN=CN=C1 24619 [0,1,0,0,0,0|2,0,0]=3 188 B10R1.18 O=C([O-])CC1=CN=NC=C1 P14654 [0,1,0,0,0,0|2,0,0]=3 189 B10R1.18 O=C([O-])CC1=NC=NC=C1 27827 [0,1,0,0,0,0|2,0,0]=3 190 B10R2.7 C1=CC2=C(C=C1)SN=N2 C74419 [0,0,0,1,0,0|2,1,0]=4 191 B10R2.7 C1=CC2=C(C=CO2)N=C1 BL002594 [0,0,0,1,0,0|1,0,2]=4 192 B10R2.7 C1=CC2=C(C=N1)CCN2 86683 [0,0,0,1,0,0|2,0,1]=4 193 B10R2.7 C1=CC2=C(C=N1)CNC2 83142 [0,0,0,1,0,0|3,0,0]=4 194 B10R2.7 C1=CC2=C(C=N1)CNC2 SC3491 [0,0,0,1,0,0|3,0,0]=4 195 B10R2.7 C1=CC2=C(C=N1)N=CO2 C74415 [0,0,0,1,0,0|2,0,1]=4 196 B10R2.7 C1=CC2=C(C=N1)NCC2 A10607 [0,0,0,1,0,0|2,0,1]=4 197 B10R2.7 C1=CC2=C(C=N1)NCC2 C73056 [0,0,0,1,0,0|2,0,1]=4 198 B10R2.7 C1=CC2=C(C=N1)SC=N2 26297 [0,0,0,1,0,0|2,1,0]=4 199 B10R2.7 C1=CC2=CC=CN2C=C1 D94752 [0,0,0,1,0,0|2,0,1]=4 200 B10R2.7 C1=CC2=CC=NN2C=C1 21533 [0,0,0,1,0,0|2,0,1]=4 201 B10R2.7 C1=CC2=CON=C2C=C1 T70698 [0,0,0,1,0,0|2,0,1]=4 202 B10R2.7 C1=CC2=NC=NN2C=C1 S11147 [0,0,0,1,0,0|3,0,0]=4 203 B10R2.7 C1=CC2=N[Se]N=C2C=C1 T70699 [0,0,0,1,0,0|3,0,0]=4 204 B10R2.7 C1=CN=C2CCNC2=C1 70854 [0,0,0,1,0,0|2,0,1]=4 205 B10R2.7 C1=CN=C2CNCC2=C1 83068 [0,0,0,1,0,0|3,0,0]=4 206 B10R2.7 C1=CN=C2CNCC2=C1 SC3341 [0,0,0,1,0,0|3,0,0]=4 207 B10R2.7 C1=CN=C2OC=CC2=C1 N13064 [0,0,0,1,0,0|1,0,2]=4 208 B10R2.7 C1=CN=C2OC=NC2=C1 32393 [0,0,0,1,0,0|2,0,1]=4 209 B10R2.320 O=C1CC2=C1C=CC=C2 67963 [0,0,0,1,0,0|0,0,0]=1 210 B8R1.8 BrCCC1=CSC=C1 F20032 [0,0,0,0,1,0|2,0,1]=4 211 B8R1.8 CNCC1=COC=C1 AC5678 [0,0,0,0,1,0|3,0,0]=4 212 B8R1.8 NCCC1=CC=CN1 31556 [0,0,0,0,1,0|2,0,1]=4 213 B8R1.8 NCCC1=CC=CN1 F10331 [0,0,0,0,1,0|2,0,1]=4 214 B8R1.8 NCCC1=CSC=C1 P10092 [0,0,0,0,1,0|2,0,1]=4 215 B8R1.8 O=C=NC1=CSC=C1 30314 [0,0,0,0,1,0|2,0,1]=4 216 B8R1.8 OCCC1=CC=CN1 AB10351 [0,0,0,0,1,0|1,0,2]=4 217 B8R1.8 OCCC1=CC=CO1 W10532 [0,0,0,0,1,0|1,0,2]=4 218 B8R1.8 OCCC1=COC=C1 D93026 [0,0,0,0,1,0|1,0,2]=4 219 B7R1.3 ClC1=CN=CC=C1 P19758 [2,0,0,0,0,0|2,0,0]=4 220 B7R1.3 NC1=CC=CC=C1 T70935 [2,0,0,0,0,0|1,0,0]=3 221 B7R1.3 NC1=CC=CC=C1 T71037 [2,0,0,0,0,0|1,0,0]=3 222 B7R1.3 O=C1C=CNN=C1 D87946 [2,0,0,0,0,0|2,0,0]=4 223 B9R1.1 BrCC1=NC=C(Br)C=C1 28859 [1,1,0,0,0,0|2,0,0]=4 224 B9R1.1 C#CC1=CC=C(I)C=C1 F21257 [1,1,0,0,0,0|0,0,2]=4 225 B9R1.1 C=CC1=CN=C(Cl)C=C1 F13416 [1,1,0,0,0,0|1,0,1]=4 226 B9R1.1 C=CC1=NC=C(Cl)C=C1 P17531 [1,1,0,0,0,0|1,0,1]=4 227 B9R1.1 CC1=CN=C(C=O)C=N1 36020 [1,1,0,0,0,0|2,0,0]=4 228 B9R1.1 CC1=CN=C(CCl)C=C1 A10650 [1,1,0,0,0,0|2,0,0]=4 229 B9R1.1 CC1=CN=C(CCl)C=C1 C16351 [1,1,0,0,0,0|2,0,0]=4 230 B9R1.1 CC1=NC=C(CCl)C=C1 CL0057 [1,1,0,0,0,0|2,0,0]=4 231 B9R1.1 CC1=NC=C(CN)C=C1 72232 [1,1,0,0,0,0|2,0,0]=4 232 B9R1.1 CCC1=CN=C(Br)C=C1 CS1557 [1,1,0,0,0,0|1,0,1]=4 233 B9R1.1 CCC1=CN=C(Cl)C=C1 72594 [1,1,0,0,0,0|1,0,1]=4 234 B9R1.1 CCC1=CN=C(O)C=C1 25325 [1,1,0,0,0,0|1,0,1]=4 235 B9R1.1 CCC1=NC=C(Br)C=C1 26547 [1,1,0,0,0,0|1,0,1]=4 236 B9R1.1 CCC1=NC=C(Cl)C=C1 C71513 [1,1,0,0,0,0|1,0,1]=4 237 B9R1.1 CCC1=NC=C(N)C=C1 C72111 [1,1,0,0,0,0|1,0,1]=4 238 B9R1.1 CNC1=CC=C(O)C=C1 D77985 [1,1,0,0,0,0|1,0,1]=4 239 B9R1.1 C[N+]1=CC=C(C=O)C=C1 D95156 [1,1,0,0,0,0|1,0,0]=3 240 B9R1.1 ClCC1=CC=C(I)C=C1 AB8901 [1,1,0,0,0,0|1,0,0]=3 241 B9R1.1 ClCC1=CN=C(Br)C=C1 C71417 [1,1,0,0,0,0|2,0,0]=4 242 B9R1.1 ClCC1=CN=C(Br)C=C1 C73235 [1,1,0,0,0,0|2,0,0]=4 243 B9R1.1 ClCC1=NC=C(Br)C=C1 12269 [1,1,0,0,0,0|2,0,0]=4 244 B9R1.1 ClCC1=NC=C(Br)C=C1 C77222 [1,1,0,0,0,0|2,0,0]=4 245 B9R1.1 FCC1=CC=C(Br)C=C1 W10394 [1,1,0,0,0,0|1,0,0]=3 246 B9R1.1 N#CC1=CC=C(S)C=C1 F31167 [1,1,0,0,0,0|1,0,1]=4 247 B9R1.1 NC1=CN=C(C=O)C=C1 D77164 [1,1,0,0,0,0|1,0,0]=3 248 B9R1.1 NC1=CN=C(C=O)C=N1 F31178 [1,1,0,0,0,0|2,0,0]=4 249 B9R1.1 NCC1=CC=C(O)C=C1 AC1832 [1,1,0,0,0,0|1,0,0]=3 250 B9R1.1 NCC1=CN=C(Br)C=C1 68600 [1,1,0,0,0,0|2,0,0]=4 251 B9R1.1 NCC1=CN=C(N)C=C1 F13784 [1,1,0,0,0,0|2,0,0]=4 252 B9R1.1 NCC1=CN=C(N)C=C1 P19117 [1,1,0,0,0,0|2,0,0]=4 253 B9R1.1 NCC1=NC=C(Br)C=C1 32062 [1,1,0,0,0,0|2,0,0]=4 254 B9R1.1 NCC1=NC=C(Cl)C=C1 W13681 [1,1,0,0,0,0|2,0,0]=4 255 B9R1.1 NCC1=NC=C(F)C=C1 70856 [1,1,0,0,0,0|2,0,0]=4 256 B9R1.1 NCC1=NC=C(N)C=C1 O11499 [1,1,0,0,0,0|2,0,0]=4 257 B9R1.1 NCC1=NC=C(N)C=C1 W11510 [1,1,0,0,0,0|2,0,0]=4 258 B9R1.1 NCC1=NC=C(O)C=C1 24338 [1,1,0,0,0,0|2,0,0]=4 259 B9R1.1 O=CC1=CN=C(O)N=C1 86751 [1,1,0,0,0,0|2,0,0]=4 260 B9R1.1 O=CC1=NC=C(Cl)C=N1 P10946 [1,1,0,0,0,0|2,0,0]=4 261 B9R1.1 O=CC1=NN=C(Br)C=C1 P20764 [1,1,0,0,0,0|2,0,0]=4 262 B9R1.1 O=CC1=NN=C(Cl)C=C1 25514 [1,1,0,0,0,0|2,0,0]=4 263 B9R1.1 O=CC1=NN=C(O)C=C1 C77199 [1,1,0,0,0,0|2,0,0]=4 264 B9R1.1 OCC1=CC=C(S)C=C1 Y11017 [1,1,0,0,0,0|0,0,1]=3 265 B9R1.2 C=CC1=CC(Br)=CN=C1 50995 [1,1,0,0,0,0|1,0,1]=4 266 B9R1.2 C=CC1=CC(Br)=NC=C1 60113 [1,1,0,0,0,0|1,0,1]=4 267 B9R1.2 C=CC1=CC(C)=CC=C1 F16162 [1,1,0,0,0,0|0,0,1]=3 268 B9R1.2 C=CC1=CC(C)=CN=C1 79122 [1,1,0,0,0,0|1,0,1]=4 269 B9R1.2 C=CC1=CC=CC(Br)=N1 27481 [1,1,0,0,0,0|1,0,1]=4 270 B9R1.2 C=CC1=NC(C)=CC=C1 C71408 [1,1,0,0,0,0|1,0,1]=4 271 B9R1.2 C=CC1=NC=CC(Br)=C1 C75345 [1,1,0,0,0,0|1,0,1]=4 272 B9R1.2 C=CC1=NC=CC(Cl)=C1 C77362 [1,1,0,0,0,0|1,0,1]=4 273 B9R1.2 C=CC1=NC=CC(N)=C1 D82535 [1,1,0,0,0,0|1,0,1]=4 274 B9R1.2 CC1=CC(CCl)=NC=C1 25774 [1,1,0,0,0,0|2,0,0]=4 275 B9R1.2 CC1=CC(CN)=NC=C1 72801 [1,1,0,0,0,0|2,0,0]=4 276 B9R1.2 CC1=CC(CN)=NC=C1 78899 [1,1,0,0,0,0|2,0,0]=4 277 B9R1.2 CC1=CC=CC(CN)=N1 W10146 [1,1,0,0,0,0|2,0,0]=4 278 B9R1.2 CC1=CN=CC(C=O)=N1 72066 [1,1,0,0,0,0|2,0,0]=4 279 B9R1.2 CC1=CN=CC(CN)=C1 72799 [1,1,0,0,0,0|2,0,0]=4 280 B9R1.2 CC1=NC=CC(CBr)=C1 D80184 [1,1,0,0,0,0|2,0,0]=4 281 B9R1.2 CC1=NC=CC(CN)=C1 72809 [1,1,0,0,0,0|2,0,0]=4 282 B9R1.2 CCC1=CC(Br)=CN=C1 25835 [1,1,0,0,0,0|1,0,1]=4 283 B9R1.2 CCC1=CC=CC(Br)=N1 O10692 [1,1,0,0,0,0|1,0,1]=4 284 B9R1.2 CCC1=NC=CC(Br)=C1 S10560 [1,1,0,0,0,0|1,0,1]=4 285 B9R1.2 CNC1=CC(N)=CC=C1 36494 [1,1,0,0,0,0|1,0,1]=4 286 B9R1.2 CSC1=CC(F)=CC=C1 A12732 [1,1,0,0,0,0|1,0,1]=4 287 B9R1.2 CSC1=CC(O)=CC=C1 W12966 [1,1,0,0,0,0|1,0,1]=4 288 B9R1.2 ClC1=CC=CC(CBr)=N1 55241 [1,1,0,0,0,0|2,0,0]=4 289 B9R1.2 ClC1=NC=CC(CBr)=C1 A10561 [1,1,0,0,0,0|2,0,0]=4 290 B9R1.2 ClCC1=CC=CC(Cl)=N1 F52578 [1,1,0,0,0,0|2,0,0]=4 291 B9R1.2 ClCC1=NC=CC(Cl)=C1 AC1913 [1,1,0,0,0,0|2,0,0]=4 292 B9R1.2 FC1=CC(CBr)=NC=C1 AC8874 [1,1,0,0,0,0|2,0,0]=4 293 B9R1.2 FC1=CC=CC(CBr)=N1 25716 [1,1,0,0,0,0|2,0,0]=4 294 B9R1.2 FC1=CC=CC(CCl)=N1 88353 [1,1,0,0,0,0|2,0,0]=4 295 B9R1.2 N#[N+]C1=CC=CC(Br)=C1 98381 [1,1,0,0,0,0|2,0,0]=4 296 B9R1.2 NC1=CC(CO)=CN=C1 20770 [1,1,0,0,0,0|1,0,1]=4 297 B9R1.2 NC1=CC(CO)=NC=C1 AC1095 [1,1,0,0,0,0|1,0,1]=4 298 B9R1.2 NC1=CC=CC(C=O)=C1 CK2096 [1,1,0,0,0,0|0,0,0]=2 299 B9R1.2 NC1=CC=CC(C=O)=N1 D70565 [1,1,0,0,0,0|1,0,0]=3 300 B9R1.2 NC1=CC=CC(CF)=C1 32172 [1,1,0,0,0,0|1,0,0]=3 301 B9R1.2 NC1=NC=CC(CBr)=C1 W11110 [1,1,0,0,0,0|2,0,0]=4 302 B9R1.2 NCC1=CC(Br)=CN=C1 Y14573 [1,1,0,0,0,0|2,0,0]=4 303 B9R1.2 NCC1=CC(Cl)=CN=C1 29807 [1,1,0,0,0,0|2,0,0]=4 304 B9R1.2 NCC1=CC(Cl)=NC=C1 71552 [1,1,0,0,0,0|2,0,0]=4 305 B9R1.2 NCC1=CC(F)=NC=C1 73765 [1,1,0,0,0,0|2,0,0]=4 306 B9R1.2 NCC1=CC=CC(=O)N1 78897 [1,1,0,0,0,0|2,0,0]=4 307 B9R1.2 NCC1=CC=CC(Br)=N1 CS1515 [1,1,0,0,0,0|2,0,0]=4 308 B9R1.2 NCC1=CC=CC(Cl)=N1 C73611 [1,1,0,0,0,0|2,0,0]=4 309 B9R1.2 NCC1=CC=CC(F)=N1 25846 [1,1,0,0,0,0|2,0,0]=4 310 B9R1.2 NCC1=CC=CC(N)=N1 H10329 [1,1,0,0,0,0|2,0,0]=4 311 B9R1.2 NCC1=CC=C[N+]([O-])=C1 W12624 [1,1,0,0,0,0|2,0,0]=4 312 B9R1.2 NCC1=NC=CC(Br)=C1 26881 [1,1,0,0,0,0|2,0,0]=4 313 B9R1.2 NCC1=NC=CC(Br)=C1 P17869 [1,1,0,0,0,0|2,0,0]=4 314 B9R1.2 NCC1=NC=CC(Cl)=C1 P18502 [1,1,0,0,0,0|2,0,0]=4 315 B9R1.2 NCC1=NC=CC(Cl)=C1 Y12031 [1,1,0,0,0,0|2,0,0]=4 316 B9R1.2 O=C1C=C(CCl)C=CN1 AT18186 [1,1,0,0,0,0|2,0,0]=4 317 B9R1.2 O=C1C=C(CO)C=CN1 37365 [1,1,0,0,0,0|1,0,1]=4 318 B9R1.2 O=CC1=CC(Br)=NC=N1 D70857 [1,1,0,0,0,0|2,0,0]=4 319 B9R1.2 O=CC1=CC=CC(=O)N1 N12900 [1,1,0,0,0,0|1,0,0]=3 320 B9R1.2 O=CC1=CC=NC(Cl)=N1 P10948 [1,1,0,0,0,0|2,0,0]=4 321 B9R1.2 O=CC1=CN=CC(Cl)=N1 70892 [1,1,0,0,0,0|2,0,0]=4 322 B9R1.2 O=CC1=C[N+]([O-])=CC=C1 O11007 [1,1,0,0,0,0|1,0,0]=3 323 B9R1.2 O=CC1=NC=CC(O)=C1 W18365 [1,1,0,0,0,0|1,0,0]=3 324 B9R1.2 O=CC1=NC=NC(O)=C1 82364 [1,1,0,0,0,0|2,0,0]=4 325 B9R1.2 OCC1=CC(Cl)=CN=C1 26741 [1,1,0,0,0,0|1,0,1]=4 326 B9R1.2 OCC1=NC=CC(I)=C1 W18502 [1,1,0,0,0,0|1,0,1]=4 327 B9R1.2 OCC1=NC=CC(O)=C1 O10524 [1,1,0,0,0,0|1,0,1]=4 328 B9R1.6 C=C(C)C1=NC=CC=C1 W17791 [1,1,0,0,0,0|1,0,1]=4 329 B9R1.6 CC(=O)C1=NN=CC=C1 37064 [1,1,0,0,0,0|2,0,0]=4 330 B9R1.6 C[C@H](Cl)C1=NC=CC=C1 F13294 [1,1,0,0,0,0|1,0,1]=4 331 B9R1.6 C[C@H](N)C1=CC=CC=C1 D77753 [1,1,0,0,0,0|0,0,1]=3 332 B9R1.6 C[C@H](N)C1=CC=CN=C1 20316 [1,1,0,0,0,0|1,0,1]=4 333 B9R1.6 C[C@H](N)C1=CC=CN=C1 74003 [1,1,0,0,0,0|1,0,1]=4 334 B9R1.6 C[C@H](N)C1=CC=CN=C1 74005 [1,1,0,0,0,0|1,0,1]=4 335 B9R1.6 C[C@H](N)C1=CC=CN=C1 F31031 [1,1,0,0,0,0|1,0,1]=4 336 B9R1.6 C[C@H](N)C1=CC=CN=C1 F31032 [1,1,0,0,0,0|1,0,1]=4 337 B9R1.6 C[C@H](N)C1=CC=NC=C1 F31033 [1,1,0,0,0,0|1,0,1]=4 338 B9R1.6 C[C@H](N)C1=CC=NC=C1 N10538 [1,1,0,0,0,0|1,0,1]=4 339 B9R1.6 C[C@H](O)C1=NC=CC=C1 A11519 [1,1,0,0,0,0|1,0,1]=4 340 B9R1.6 C[C@H](O)C1=NC=CC=C1 C16040 [1,1,0,0,0,0|1,0,1]=4 341 B9R1.6 C[S@](=O)C1=NC=CC=C1 C74099 [1,1,0,0,0,0|2,0,0]=4 342 B9R1.6 N=C(N)C1=NC=CC=C1 71518 [1,1,0,0,0,0|2,0,0]=4 343 B9R1.6 NC(=O)C1=CN=CN=C1 F13864 [1,1,0,0,0,0|2,0,0]=4 344 B9R1.6 NC(=O)C1=CN=NC=C1 F14288 [1,1,0,0,0,0|2,0,0]=4 345 B9R1.6 NC(=O)C1=NC=NC=C1 C74468 [1,1,0,0,0,0|2,0,0]=4 346 B9R1.6 NC(=O)C1=NN=CC=C1 F30255 [1,1,0,0,0,0|2,0,0]=4 347 B9R1.6 O=C(Cl)C1=NN=CC=C1 D93513 [1,1,0,0,0,0|2,0,0]=4 348 B9R1.6 O=C([O-])C1=NC=CC=N1 65419 [1,1,0,0,0,0|2,0,0]=4 349 B9R1.6 O=[S@]([O-])C1=NC=CC=C1 AT11818 [1,1,0,0,0,0|2,0,0]=4 350 B9R1.15 BrCC1=C(Br)C=CC=N1 N13045 [1,1,0,0,0,0|2,0,0]=4 351 B9R1.15 C=CC1=C(N)C=CC=C1 25265 [1,1,0,0,0,0|0,0,1]=3 352 B9R1.15 C=CC1=CC=CN=C1Br 83953 [1,1,0,0,0,0|1,0,1]=4 353 B9R1.15 C=CC1=CC=CN=C1C P11579 [1,1,0,0,0,0|1,0,1]=4 354 B9R1.15 CC1=C(C=O)C=CN=C1 AB10090 [1,1,0,0,0,0|1,0,0]=3 355 B9R1.15 CC1=C(CBr)C=CC=N1 F16424 [1,1,0,0,0,0|2,0,0]=4 356 B9R1.15 CC1=C(CCl)C=CC=N1 24248 [1,1,0,0,0,0|2,0,0]=4 357 B9R1.15 CC1=C(CCl)C=NC=C1 C72783 [1,1,0,0,0,0|2,0,0]=4 358 B9R1.15 CC1=C(CO)C=NC=C1 38669 [1,1,0,0,0,0|1,0,1]=4 359 B9R1.15 CC1=CC=CN=C1CN C72913 [1,1,0,0,0,0|2,0,0]=4 360 B9R1.15 CC1=NC=CC=C1CN 72802 [1,1,0,0,0,0|2,0,0]=4 361 B9R1.15 CC1=NC=CC=C1CN AB7634 [1,1,0,0,0,0|2,0,0]=4 362 B9R1.15 CC1=NC=CN=C1C=O 30985 [1,1,0,0,0,0|2,0,0]=4 363 B9R1.15 CCC1=C(Br)C=CC=N1 P11641 [1,1,0,0,0,0|1,0,1]=4 364 B9R1.15 CCC1=C(Br)C=CN=C1 38064 [1,1,0,0,0,0|1,0,1]=4 365 B9R1.15 CCC1=C(F)C=CC=C1 F20938 [1,1,0,0,0,0|0,0,1]=3 366 B9R1.15 CCC1=C(O)C=CC=N1 71246 [1,1,0,0,0,0|1,0,1]=4 367 B9R1.15 CCC1=CC=CN=C1Br D80252 [1,1,0,0,0,0|1,0,1]=4 368 B9R1.15 CCC1=CC=CN=C1N 55791 [1,1,0,0,0,0|1,0,1]=4 369 B9R1.15 ClCC1=C(Br)C=CC=N1 W15864 [1,1,0,0,0,0|2,0,0]=4 370 B9R1.15 ClCC1=C(Br)C=NC=C1 32531 [1,1,0,0,0,0|2,0,0]=4 371 B9R1.15 ClCC1=C(Cl)C=CC=N1 86866 [1,1,0,0,0,0|2,0,0]=4 372 B9R1.15 ClCC1=C(Cl)C=CC=N1 C71965 [1,1,0,0,0,0|2,0,0]=4 373 B9R1.15 FC1=C(CBr)C=CC=N1 72213 [1,1,0,0,0,0|2,0,0]=4 374 B9R1.15 FC1=C(CCl)C=CN=C1 72889 [1,1,0,0,0,0|2,0,0]=4 375 B9R1.15 FC1=CC=CN=C1CBr 38126 [1,1,0,0,0,0|2,0,0]=4 376 B9R1.15 FC1=CC=CN=C1CCl AC1446 [1,1,0,0,0,0|2,0,0]=4 377 B9R1.15 NC1=C(C=O)C=NC=N1 66183 [1,1,0,0,0,0|2,0,0]=4 378 B9R1.15 NC1=C(CO)C=CN=C1 F13531 [1,1,0,0,0,0|1,0,1]=4 379 B9R1.15 NC1=C(CO)C=NC=C1 28348 [1,1,0,0,0,0|1,0,1]=4 380 B9R1.15 NC1=CC=CN=C1C=O 80155 [1,1,0,0,0,0|1,0,0]=3 381 B9R1.15 NC1=CC=CN=C1CO H10562 [1,1,0,0,0,0|1,0,1]=4 382 B9R1.15 NC1=NC=CN=C1C=O 27460 [1,1,0,0,0,0|2,0,0]=4 383 B9R1.15 NCC1=C(Br)C=CC=N1 N13373 [1,1,0,0,0,0|2,0,0]=4 384 B9R1.15 NCC1=C(Br)C=CC=N1 Y13366 [1,1,0,0,0,0|2,0,0]=4 385 B9R1.15 NCC1=C(Br)C=CN=C1 F30244 [1,1,0,0,0,0|2,0,0]=4 386 B9R1.15 NCC1=C(Br)C=NC=C1 O10077 [1,1,0,0,0,0|2,0,0]=4 387 B9R1.15 NCC1=C(Cl)C=CC=N1 20194 [1,1,0,0,0,0|2,0,0]=4 388 B9R1.15 NCC1=C(Cl)C=CN=C1 73185 [1,1,0,0,0,0|2,0,0]=4 389 B9R1.15 NCC1=C(Cl)C=NC=C1 D79765 [1,1,0,0,0,0|2,0,0]=4 390 B9R1.15 NCC1=C(Cl)C=NC=C1 F50132 [1,1,0,0,0,0|2,0,0]=4 391 B9R1.15 NCC1=C(F)C=CC=N1 37501 [1,1,0,0,0,0|2,0,0]=4 392 B9R1.15 NCC1=C(F)C=CC=N1 71993 [1,1,0,0,0,0|2,0,0]=4 393 B9R1.15 NCC1=C(F)C=CC=N1 P10857 [1,1,0,0,0,0|2,0,0]=4 394 B9R1.15 NCC1=C(F)C=NC=C1 26837 [1,1,0,0,0,0|2,0,0]=4 395 B9R1.15 NCC1=C(F)C=NC=C1 78901 [1,1,0,0,0,0|2,0,0]=4 396 B9R1.15 NCC1=C(I)C=CC=C1 C75019 [1,1,0,0,0,0|1,0,0]=3 397 B9R1.15 NCC1=CC=CN=C1Br D82416 [1,1,0,0,0,0|2,0,0]=4 398 B9R1.15 NCC1=CC=CN=C1Cl 51113 [1,1,0,0,0,0|2,0,0]=4 399 B9R1.15 NCC1=CC=CN=C1N 89358 [1,1,0,0,0,0|2,0,0]=4 400 B9R1.15 NCC1=CC=CN=C1O 55767 [1,1,0,0,0,0|2,0,0]=4 401 B9R1.15 NCC1=NC=CC=C1N AC4283 [1,1,0,0,0,0|2,0,0]=4 402 B9R1.15 NNC1=C(I)C=CC=C1 C75827 [1,1,0,0,0,0|2,0,0]=4 403 B9R1.15 O=C1NC=CC=C1CO P16012 [1,1,0,0,0,0|1,0,1]=4 404 B9R1.15 O=CC1=C(Br)C=CN=C1 P16584 [1,1,0,0,0,0|1,0,0]=3 405 B9R1.15 O=CC1=C(Cl)C=CC=C1 D77644 [1,1,0,0,0,0|0,0,0]=2 406 B9R1.15 O=CC1=C(O)C=CN=C1 P10968 [1,1,0,0,0,0|1,0,0]=3 407 B9R1.15 O=CC1=C(O)C=NC=C1 25615 [1,1,0,0,0,0|1,0,0]=3 408 B9R1.15 O=CC1=NC=CN=C1Br P14054 [1,1,0,0,0,0|2,0,0]=4 409 B9R1.15 O=CC1=NC=CN=C1Cl P10456 [1,1,0,0,0,0|2,0,0]=4 410 B9R1.15 OCC1=C(Br)C=CN=C1 71972 [1,1,0,0,0,0|1,0,1]=4 411 B9R1.15 OCC1=C(F)C=CN=C1 P15839 [1,1,0,0,0,0|1,0,1]=4 412 B9R1.15 OCC1=C(O)C=NC=C1 D84251 [1,1,0,0,0,0|1,0,1]=4 413 B9R1.11 O=CC(=O)C1=CC=CO1 D94856 [0,1,0,0,1,0|1,0,1]=4 414 B9R1.13 CC(=O)CC1=CC=CS1 W16827 [0,1,0,0,1,0|1,0,0]=3 415 B9R1.13 O=C(O)CC1=CC=CN1 29609 [0,1,0,0,1,0|1,0,0]=3 416 B9R1.13 O=C(O)CC1=CC=CO1 W10208 [0,1,0,0,1,0|1,0,0]=3 417 B9R1.13 O=C(O)CC1=CC=NO1 AC1452 [0,1,0,0,1,0|2,0,0]=4 418 B9R1.13 O=C(O)CC1=CCC=C1 78226 [0,1,0,0,1,0|0,0,1]=3 419 B9R1.13 O=C(O)CC1=CN=CS1 P10574 [0,1,0,0,1,0|2,0,0]=4 420 B9R1.13 O=C(O)CC1=CNC=C1 65416 [0,1,0,0,1,0|1,0,0]=3 421 B9R1.13 O=C(O)CC1=CNC=N1 C16158 [0,1,0,0,1,0|2,0,0]=4 422 B9R1.13 O=C(O)CC1=CNN=C1 71976 [0,1,0,0,1,0|2,0,0]=4 423 B9R1.13 O=C(O)CC1=NC=CN1 F17266 [0,1,0,0,1,0|2,0,0]=4 424 B9R1.13 O=C(O)CC1=NC=CS1 26228 [0,1,0,0,1,0|2,0,0]=4 425 B9R1.13 O=C(O)CC1=NNC=C1 71426 [0,1,0,0,1,0|2,0,0]=4 426 B9R1.13 O=C(O)CC1=NOC=C1 Y10092 [0,1,0,0,1,0|2,0,0]=4 427 B11R1.1 C#CCOC1=CC=C(Cl)C=C1 W16039 [0,2,0,0,0,0|1,0,1]=4 428 B11R1.1 C=CCCC1=CC=C(Br)C=C1 VT1222 [0,2,0,0,0,0|1,0,0]=3 429 B11R1.1 C=CCCC1=CC=C(O)C=C1 AC1840 [0,2,0,0,0,0|1,0,0]=3 430 B11R1.1 CCNCC1=CC=C(C)C=C1 78307 [0,2,0,0,0,0|1,0,1]=4 431 B11R1.1 CCNCC1=CC=C(N)C=C1 AC1810 [0,2,0,0,0,0|1,0,1]=4 432 B11R1.1 CCNCC1=CC=C(O)C=C1 31967 [0,2,0,0,0,0|1,0,1]=4 433 B11R1.1 CCOCC1=CC=C(Br)C=C1 W19177 [0,2,0,0,0,0|1,0,1]=4 434 B11R1.1 CCOCC1=CC=C(O)C=C1 27758 [0,2,0,0,0,0|1,0,1]=4 435 B11R1.1 CNCCC1=CC=C(N)C=C1 76010 [0,2,0,0,0,0|1,0,1]=4 436 B11R1.1 ClCCOC1=CC=C(Cl)C=C1 C72197 [0,2,0,0,0,0|1,0,1]=4 437 B11R1.1 FC1=CC=C(CCCBr)C=C1 AB8466 [0,2,0,0,0,0|1,0,1]=4 438 B11R1.1 FC1=CC=C(CCCI)C=C1 AC3098 [0,2,0,0,0,0|1,0,1]=4 439 B11R1.1 N#CCCC1=CC=C(Br)C=C1 O10869 [0,2,0,0,0,0|1,0,1]=4 440 B11R1.1 N#C\C=C\C1=CC=C(F)C=C1 A12335 [0,2,0,0,0,0|1,0,1]=4 441 B11R1.1 NCCCC1=CC=C(F)C=C1 C72058 [0,2,0,0,0,0|1,0,1]=4 442 B11R1.1 O=CCCC1=CC=C(Br)C=C1 29444 [0,2,0,0,0,0|0,0,0]=2 443 B11R1.1 O=CCCC1=CC=C(Cl)C=C1 AB6893 [0,2,0,0,0,0|0,0,0]=2 444 B11R1.1 O=CCCC1=CC=C(O)C=C1 F19751 [0,2,0,0,0,0|0,0,0]=2 445 B11R1.1 OCCOC1=CC=C(Br)C=C1 AC1411 [0,2,0,0,0,0|0,0,2]=4 446 B11R1.1 OC\C=C\C1=CC=C(O)C=C1 A11786 [0,2,0,0,0,0|0,0,2]=4 447 B11R1.20 CC(=O)NC1=CN=C(C)C=C1 N16920 [0,2,0,0,0,0|2,0,0]=4 448 B11R1.20 CC(=O)NC1=CN=C(O)C=C1 C75099 [0,2,0,0,0,0|2,0,0]=4 449 B11R1.20 CC(=O)NC1=NC=C(O)C=C1 C73008 [0,2,0,0,0,0|2,0,0]=4 450 B11R1.20 CC1=CC=C(C[C@H](C)N)C=C1 N10874 [0,2,0,0,0,0|1,0,1]=4 451 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 56191 [0,2,0,0,0,0|1,0,0]=3 452 B11R1.20 C[C@H](N)CC1=CC=C(Br)C=C1 84989 [0,2,0,0,0,0|1,0,1]=4 453 B11R1.20 C[C@H](N)CC1=CC=C(Br)C=C1 Y14838 [0,2,0,0,0,0|1,0,1]=4 454 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 N11301 [0,2,0,0,0,0|1,0,1]=4 455 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 N11302 [0,2,0,0,0,0|1,0,1]=4 456 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 Y11173 [0,2,0,0,0,0|1,0,1]=4 457 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 Y11623 [0,2,0,0,0,0|1,0,1]=4 458 B11R1.20 C[C@H](N)CC1=CC=C(O)C=C1 84990 [0,2,0,0,0,0|1,0,1]=4 459 B11R1.20 C[C@H](O)CC1=CC=C(F)C=C1 C75202 [0,2,0,0,0,0|0,0,2]=4 460 B11R1.20 N=C(N)NC1=CC=C(Cl)C=C1 24230 [0,2,0,0,0,0|2,0,0]=4 461 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 69913 [0,2,0,0,0,0|0,0,0]=2 462 B11R1.20 NC(=O)CC1=CN=C(Cl)C=C1 84999 [0,2,0,0,0,0|1,0,0]=3 463 B11R1.20 NC(=O)CC1=NC=C(Br)C=C1 F19774 [0,2,0,0,0,0|1,0,0]=3 464 B11R1.20 NC1=NC=C(CC(=O)O)C=C1 F18175 [0,2,0,0,0,0|1,0,0]=3 465 B11R1.20 O=C(O)CC1=CC=C(S)C=C1 52120 [0,2,0,0,0,0|0,0,0]=2 466 B11R1.20 O=C(O)CC1=NC=C(Cl)C=C1 89138 [0,2,0,0,0,0|1,0,0]=3 467 B11R1.20 O=C(O)CC1=NC=C(Cl)C=N1 P10959 [0,2,0,0,0,0|2,0,0]=4 468 B11R1.20 O=C(O)CC1=NC=C(F)C=C1 89139 [0,2,0,0,0,0|1,0,0]=3 469 B11R1.20 O=C(O)CC1=NC=C(F)C=N1 27383 [0,2,0,0,0,0|2,0,0]=4 470 B11R1.20 O=C(O)CC1=NC=C(I)C=C1 P12089 [0,2,0,0,0,0|1,0,0]=3 471 B11R1.20 O=C(O)CC1=NC=C(O)C=C1 W18187 [0,2,0,0,0,0|1,0,0]=3 472 B11R1.20 O=C([O-])CC1=NC=C(Br)C=N1 P16752 [0,2,0,0,0,0|2,0,0]=4 473 B11R1.22 C#C[C@@H](O)C1=CC=C(F)C=C1 W16136 [0,2,0,0,0,0|1,0,1]=4 474 B11R1.22 C=CC(=O)C1=CC=C(F)C=C1 AB9399 [0,2,0,0,0,0|1,0,1]=4 475 B11R1.22 C=C[C@H](N)C1=CC=C(Br)C=C1 D81372 [0,2,0,0,0,0|1,0,0]=3 476 B11R1.22 C=C[C@H](N)C1=CC=C(Br)C=C1 N15256 [0,2,0,0,0,0|1,0,0]=3 477 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 D81498 [0,2,0,0,0,0|0,0,2]=4 478 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 N10531 [0,2,0,0,0,0|0,0,2]=4 479 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 N11058 [0,2,0,0,0,0|0,0,2]=4 480 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 N11096 [0,2,0,0,0,0|0,0,2]=4 481 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 Y10547 [0,2,0,0,0,0|0,0,2]=4 482 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 Y13360 [0,2,0,0,0,0|0,0,2]=4 483 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 F16933 [0,2,0,0,0,0|1,0,1]=4 484 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 N10949 [0,2,0,0,0,0|1,0,1]=4 485 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 N10950 [0,2,0,0,0,0|1,0,1]=4 486 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 N12584 [0,2,0,0,0,0|1,0,1]=4 487 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 Y10817 [0,2,0,0,0,0|1,0,1]=4 488 B11R1.22 CC[C@H](N)C1=CC=C(C)C=C1 Y10160 [0,2,0,0,0,0|1,0,1]=4 489 B11R1.22 CC[C@H](N)C1=CC=C(C)C=C1 Y10161 [0,2,0,0,0,0|1,0,1]=4 490 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 D81275 [0,2,0,0,0,0|1,0,1]=4 491 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 S11131 [0,2,0,0,0,0|1,0,1]=4 492 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 Y11768 [0,2,0,0,0,0|1,0,1]=4 493 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y10163 [0,2,0,0,0,0|1,0,1]=4 494 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y10164 [0,2,0,0,0,0|1,0,1]=4 495 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y10653 [0,2,0,0,0,0|1,0,1]=4 496 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y11063 [0,2,0,0,0,0|1,0,1]=4 497 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y11174 [0,2,0,0,0,0|1,0,1]=4 498 B11R1.22 CC[C@H](N)C1=CC=C(I)C=C1 Y14552 [0,2,0,0,0,0|1,0,1]=4 499 B11R1.22 CC[C@H](N)C1=CC=C(I)C=C1 Y14553 [0,2,0,0,0,0|1,0,1]=4 500 B11R1.22 CC[C@H](N)C1=CC=C(O)C=C1 N12238 [0,2,0,0,0,0|1,0,1]=4 501 B11R1.22 CC[C@H](O)C1=CC=C(Br)C=C1 AB6446 [0,2,0,0,0,0|1,0,1]=4 502 B11R1.22 CN[C@@H](C)C1=CC=C(Br)C=C1 N10761 [0,2,0,0,0,0|2,0,0]=4 503 B11R1.22 CN[C@@H](C)C1=CC=C(Br)C=C1 Y10719 [0,2,0,0,0,0|2,0,0]=4 504 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 F16874 [0,2,0,0,0,0|2,0,0]=4 505 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 F16927 [0,2,0,0,0,0|2,0,0]=4 506 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y10862 [0,2,0,0,0,0|2,0,0]=4 507 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y10897 [0,2,0,0,0,0|2,0,0]=4 508 B11R1.22 CN[C@@H](C)C1=CC=C(F)C=C1 N13109 [0,2,0,0,0,0|2,0,0]=4 509 B11R1.22 C[C@@H](CN)C1=CC=C(Br)C=C1 84993 [0,2,0,0,0,0|1,0,1]=4 510 B11R1.22 N#C[C@@H](O)C1=CC=C(Br)C=C1 W15228 [0,2,0,0,0,0|1,0,1]=4 511 B11R1.22 NC[C@H](O)C1=CC=C(Cl)C=C1 C78214 [0,2,0,0,0,0|1,0,1]=4 512 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 D83092 [0,2,0,0,0,0|0,0,2]=4 513 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 I11041 [0,2,0,0,0,0|0,0,2]=4 514 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 I11043 [0,2,0,0,0,0|0,0,2]=4 515 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 I11713 [0,2,0,0,0,0|0,0,2]=4 516 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 Y11114 [0,2,0,0,0,0|0,0,2]=4 517 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 N10527 [0,2,0,0,0,0|0,0,2]=4 518 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 N10528 [0,2,0,0,0,0|0,0,2]=4 519 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 Y10651 [0,2,0,0,0,0|0,0,2]=4 520 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 Y10776 [0,2,0,0,0,0|0,0,2]=4 521 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 F16942 [0,2,0,0,0,0|0,0,2]=4 522 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 I11004 [0,2,0,0,0,0|0,0,2]=4 523 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 I11005 [0,2,0,0,0,0|0,0,2]=4 524 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 I11499 [0,2,0,0,0,0|0,0,2]=4 525 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 Y10343 [0,2,0,0,0,0|0,0,2]=4 526 B11R1.22 N[C@@H](CO)C1=CC=C(I)C=C1 N10665 [0,2,0,0,0,0|0,0,2]=4 527 B11R1.22 N[C@@H](CO)C1=CC=C(I)C=C1 Y12067 [0,2,0,0,0,0|0,0,2]=4 528 B11R1.22 N[C@@H](CO)C1=CC=C(I)C=C1 Y12960 [0,2,0,0,0,0|0,0,2]=4 529 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 Y10690 [0,2,0,0,0,0|0,0,2]=4 530 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 Y10915 [0,2,0,0,0,0|0,0,2]=4 531 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 Y11472 [0,2,0,0,0,0|0,0,2]=4 532 B11R1.22 OC[C@H](O)C1=CC=C(Br)C=C1 11739 [0,2,0,0,0,0|0,0,2]=4 533 B11R1.81 CC1=CC(C)=C(NC=O)C=C1 E70411 [0,2,0,0,0,0|1,0,0]=3 534 B11R1.81 CCCC1=C(O)C=C(O)C=C1 C73634 [0,2,0,0,0,0|1,0,1]=4 535 B11R1.81 COCC1=C(Br)C=C(F)C=C1 N11828 [0,2,0,0,0,0|2,0,0]=4 536 B11R1.81 COCC1=C(F)C=C(N)C=C1 I10129 [0,2,0,0,0,0|2,0,0]=4 537 B11R1.81 COCC1=C(N)C=C(Br)C=C1 CL9392 [0,2,0,0,0,0|2,0,0]=4 538 B11R1.81 ClC1=CC(Br)=C(CCBr)C=C1 O10665 [0,2,0,0,0,0|1,0,1]=4 539 B11R1.81 ClC1=CC(Cl)=C(CCBr)C=C1 C77752 [0,2,0,0,0,0|1,0,1]=4 540 B11R1.81 OCCC1=C(Cl)C=C(Br)C=C1 F50644 [0,2,0,0,0,0|0,0,2]=4 541 B11R1.81 OCCC1=C(Cl)C=C(F)C=C1 CL8845 [0,2,0,0,0,0|0,0,2]=4 542 B11R1.83 C=COC1=CC=C(CO)C=C1 D80867 [0,2,0,0,0,0|2,0,0]=4 543 B11R1.83 CCCC1=CC=C(CN)C=C1 35547 [0,2,0,0,0,0|1,0,1]=4 544 B11R1.83 CCCC1=CC=C(CN)C=C1 Y14555 [0,2,0,0,0,0|1,0,1]=4 545 B11R1.83 CNC1=CC=C(CCO)C=C1 AB11620 [0,2,0,0,0,0|0,0,2]=4 546 B11R1.83 CNCC1=CC=C(C#N)C=C1 C74766 [0,2,0,0,0,0|2,0,0]=4 547 B11R1.83 COC1=CC=C(CC=O)C=C1 F11615 [0,2,0,0,0,0|0,0,0]=2 548 B11R1.83 COC1=CC=C(CSC)C=C1 W18269 [0,2,0,0,0,0|2,0,0]=4 549 B11R1.83 N#CC1=CC=C(CCBr)C=C1 26978 [0,2,0,0,0,0|1,0,1]=4 550 B11R1.83 N#CC1=CC=C(CCO)C=C1 30197 [0,2,0,0,0,0|0,0,2]=4 551 B11R1.83 NCCC1=CC=C(C=O)C=C1 51618 [0,2,0,0,0,0|1,0,1]=4 552 B11R1.83 O=CC1=CC=C(CCO)C=C1 CK2095 [0,2,0,0,0,0|0,0,2]=4 553 B11R1.83 OCCC1=CC=C(CO)C=C1 D82395 [0,2,0,0,0,0|0,0,2]=4 554 B11R1.192 CC1=C(Br)C=CC(CC#N)=C1 AB8407 [0,2,0,0,0,0|1,0,1]=4 555 B11R1.192 CC1=C(Br)C=CC(CCN)=C1 AB8409 [0,2,0,0,0,0|1,0,1]=4 556 B11R1.192 CC1=C(F)C=C(CC#N)C=C1 75825 [0,2,0,0,0,0|1,0,1]=4 557 B11R1.192 CCCC1=CC(F)=C(Br)C=C1 A12131 [0,2,0,0,0,0|1,0,1]=4 558 B11R1.192 CNCC1=CC(F)=C(F)C=C1 36786 [0,2,0,0,0,0|2,0,0]=4 559 B11R1.192 CNCC1=CC(O)=C(O)C=C1 31716 [0,2,0,0,0,0|2,0,0]=4 560 B11R1.192 COCC1=CC(Br)=C(F)C=C1 N10448 [0,2,0,0,0,0|2,0,0]=4 561 B11R1.192 COCC1=CC(N)=C(Br)C=C1 CL9396 [0,2,0,0,0,0|2,0,0]=4 562 B11R1.192 N#CCC1=CC(O)=C(O)C=C1 D82364 [0,2,0,0,0,0|1,0,1]=4 563 B11R1.192 NCCC1=CC(F)=C(Cl)C=C1 D79909 [0,2,0,0,0,0|1,0,1]=4 564 B11R1.192 OCCC1=CC(F)=C(F)C=C1 CL9076 [0,2,0,0,0,0|0,0,2]=4 565 B11R1.192 OCCC1=CC(O)=C(O)C=C1 68063 [0,2,0,0,0,0|0,0,2]=4 566 B11R1.13 CC1=C(Br)C=CC=C1CC#N CL9699 [0,2,0,0,0,0|1,0,1]=4 567 B11R1.13 CC1=C(F)C=CC=C1CC#N 22476 [0,2,0,0,0,0|1,0,1]=4 568 B11R1.13 CC1=C(I)C=CC=C1CC#N CL9701 [0,2,0,0,0,0|1,0,1]=4 569 B11R1.13 CNCC1=CC=CC(Cl)=C1Cl 23580 [0,2,0,0,0,0|2,0,0]=4 570 B11R1.13 CNCC1=CC=CC(Cl)=C1F 36790 [0,2,0,0,0,0|2,0,0]=4 571 B11R1.13 CNCC1=CC=CC(Cl)=C1F 76700 [0,2,0,0,0,0|2,0,0]=4 572 B11R1.13 CNCC1=CC=CC(F)=C1F AC1201 [0,2,0,0,0,0|2,0,0]=4 573 B11R1.13 COCC1=CC=CC(Br)=C1F 79640 [0,2,0,0,0,0|2,0,0]=4 574 B11R1.13 NCCC1=CC=CC(F)=C1F Y13621 [0,2,0,0,0,0|1,0,1]=4 575 B11R1.13 OCCC1=CC=CC(F)=C1F A11216 [0,2,0,0,0,0|0,0,2]=4 576 B11R1.17 C#CCOC1=C(O)C=CC=C1 W16056 [0,2,0,0,0,0|1,0,1]=4 577 B11R1.17 C=CCCC1=C(Br)C=CC=C1 20639 [0,2,0,0,0,0|1,0,0]=3 578 B11R1.17 C=CCOC1=C(O)C=CC=C1 H11445 [0,2,0,0,0,0|1,0,0]=3 579 B11R1.17 CC1=C(NCCO)C=CC=C1 29426 [0,2,0,0,0,0|0,0,2]=4 580 B11R1.17 CC1=C(OCCBr)C=CC=C1 71086 [0,2,0,0,0,0|1,0,1]=4 581 B11R1.17 CCNCC1=C(O)C=CC=C1 AC1355 [0,2,0,0,0,0|1,0,1]=4 582 B11R1.17 COCCC1=C(O)C=CC=C1 D94967 [0,2,0,0,0,0|0,0,2]=4 583 B11R1.17 FC1=C(CCCBr)C=CC=C1 AB10312 [0,2,0,0,0,0|1,0,1]=4 584 B11R1.17 FC1=C(OCCBr)C=CC=C1 F50418 [0,2,0,0,0,0|1,0,1]=4 585 B11R1.17 NC1=C(CCCO)C=CC=C1 Y12219 [0,2,0,0,0,0|0,0,2]=4 586 B11R1.17 NCCCC1=C(Br)C=CC=C1 AC1659 [0,2,0,0,0,0|1,0,1]=4 587 B11R1.17 O=CCCC1=C(Cl)C=CC=C1 20776 [0,2,0,0,0,0|0,0,0]=2 588 B11R1.17 O=C\C=C\C1=C(F)C=CC=C1 24137 [0,2,0,0,0,0|0,0,1]=3 589 B11R1.17 OCCCC1=C(Cl)C=CC=C1 AB3571 [0,2,0,0,0,0|0,0,2]=4 590 B11R1.17 OCCCC1=C(F)C=CC=C1 AB3823 [0,2,0,0,0,0|0,0,2]=4 591 B11R1.41 CNCC1=C(CO)C=CC=C1 31935 [0,2,0,0,0,0|2,0,0]=4 592 B11R1.41 COC1=C(CC=O)C=CC=C1 29933 [0,2,0,0,0,0|0,0,0]=2 593 B11R1.41 COC1=C(CCN)C=CC=C1 C11486 [0,2,0,0,0,0|1,0,1]=4 594 B11R1.41 COCC1=C(C=O)C=CC=C1 A11867 [0,2,0,0,0,0|2,0,0]=4 595 B11R1.41 N#CC1=C(CCBr)C=CC=C1 C71089 [0,2,0,0,0,0|1,0,1]=4 596 B11R1.41 N#CCC1=C(CBr)C=CC=C1 C76332 [0,2,0,0,0,0|1,0,1]=4 597 B11R1.41 N#CCC1=C(CCl)C=CC=C1 75268 [0,2,0,0,0,0|1,0,1]=4 598 B11R1.86 CC(=O)NC1=C(I)C=CC=C1 AR2168 [0,2,0,0,0,0|1,0,0]=3 599 B11R1.86 C[C@H](N)CC1=C(F)C=CC=C1 N10828 [0,2,0,0,0,0|1,0,1]=4 600 B11R1.86 C[C@H](O)CC1=C(Cl)C=CC=C1 D84375 [0,2,0,0,0,0|0,0,2]=4 601 B11R1.86 FC1=C(C=C(Br)Br)C=CC=C1 D79986 [0,2,0,0,0,0|1,0,1]=4 602 B11R1.86 NC(=O)NC1=C(Cl)C=CC=C1 W18608 [0,2,0,0,0,0|1,0,0]=3 603 B11R1.86 O=C(O)CC1=C(Br)C=CC=N1 73446 [0,2,0,0,0,0|1,0,0]=3 604 B11R1.86 O=C(O)CC1=C(F)C=CC=N1 S10090 [0,2,0,0,0,0|1,0,0]=3 605 B11R1.86 O=C(O)CC1=CC=CN=C1Br D85902 [0,2,0,0,0,0|1,0,0]=3 606 B11R1.86 O=C(O)CC1=NC=CN=C1Cl P11662 [0,2,0,0,0,0|2,0,0]=4 607 B11R1.86 O=C(O)CN1C=CC=CC1=O 71529 [0,2,0,0,0,0|1,0,0]=3 608 B11R1.86 O=C(O)CN1C=CC=NC1=O W12296 [0,2,0,0,0,0|2,0,0]=4 609 B11R1.86 O=C([O-])CC1=C(Cl)C=CC=N1 27510 [0,2,0,0,0,0|1,0,0]=3 610 B11R1.86 O=C([O-])CC1=C(F)C=CC=N1 98377 [0,2,0,0,0,0|1,0,0]=3 611 B11R1.86 O=C([O-])CC1=NC=CN=C1Cl P15537 [0,2,0,0,0,0|2,0,0]=4 612 B11R1.182 C=CCC1=C(O)C=CC(C)=C1 D96076 [0,2,0,0,0,0|1,0,0]=3 613 B11R1.182 CNCC1=C(O)C=CC(Cl)=C1 31930 [0,2,0,0,0,0|2,0,0]=4 614 B11R1.182 CNCC1=C(O)C=CC(F)=C1 32252 [0,2,0,0,0,0|2,0,0]=4 615 B11R1.182 COCC1=C(F)C=CC(Br)=C1 N10199 [0,2,0,0,0,0|2,0,0]=4 616 B11R1.182 COCC1=C(N)C=CC(N)=C1 C74735 [0,2,0,0,0,0|2,0,0]=4 617 B11R1.182 O=C=NC1=C(F)C=CC(F)=C1 A12487 [0,2,0,0,0,0|1,0,1]=4 618 B11R1.182 OCCC1=C(F)C=CC(F)=C1 A50721 [0,2,0,0,0,0|0,0,2]=4 619 B11R1.182 OCCC1=C(O)C=CC(Br)=C1 W15209 [0,2,0,0,0,0|0,0,2]=4 620 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 D80972 [0,2,0,0,0,0|0,0,2]=4 621 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 D81235 [0,2,0,0,0,0|0,0,2]=4 622 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 N11177 [0,2,0,0,0,0|0,0,2]=4 623 B11R1.222 CC1=C([C@@H](O)CN)C=CC=C1 AR2909 [0,2,0,0,0,0|1,0,1]=4 624 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 20083 [0,2,0,0,0,0|1,0,1]=4 625 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 F16885 [0,2,0,0,0,0|1,0,1]=4 626 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 N10518 [0,2,0,0,0,0|1,0,1]=4 627 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 N10519 [0,2,0,0,0,0|1,0,1]=4 628 B11R1.222 CC[C@H](N)C1=C(C)C=CC=C1 Y10722 [0,2,0,0,0,0|1,0,1]=4 629 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y10294 [0,2,0,0,0,0|1,0,1]=4 630 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y10295 [0,2,0,0,0,0|1,0,1]=4 631 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y10316 [0,2,0,0,0,0|1,0,1]=4 632 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y11207 [0,2,0,0,0,0|1,0,1]=4 633 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 Y11964 [0,2,0,0,0,0|1,0,1]=4 634 B11R1.222 CC[C@H](N)C1=C(F)C=CC=C1 S10041 [0,2,0,0,0,0|1,0,1]=4 635 B11R1.222 CC[C@H](N)C1=C(F)C=CC=C1 Y10807 [0,2,0,0,0,0|1,0,1]=4 636 B11R1.222 CC[C@H](N)C1=C(O)C=CC=C1 Y14154 [0,2,0,0,0,0|1,0,1]=4 637 B11R1.222 CC[C@H](N)C1=C(O)C=CC=C1 Y14523 [0,2,0,0,0,0|1,0,1]=4 638 B11R1.222 CN[C@@H](C)C1=C(C)C=CC=C1 N13149 [0,2,0,0,0,0|2,0,0]=4 639 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y11428 [0,2,0,0,0,0|2,0,0]=4 640 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y11555 [0,2,0,0,0,0|2,0,0]=4 641 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y12189 [0,2,0,0,0,0|2,0,0]=4 642 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y13379 [0,2,0,0,0,0|2,0,0]=4 643 B11R1.222 CN[C@@H](C)C1=C(Cl)C=CC=C1 Y14597 [0,2,0,0,0,0|2,0,0]=4 644 B11R1.222 CN[C@@H](C)C1=C(F)C=CC=C1 H11712 [0,2,0,0,0,0|2,0,0]=4 645 B11R1.222 CN[C@@H](C)C1=C(F)C=CC=C1 N12637 [0,2,0,0,0,0|2,0,0]=4 646 B11R1.222 NC[C@H](O)C1=C(Cl)C=CC=C1 AC1512 [0,2,0,0,0,0|1,0,1]=4 647 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 D81268 [0,2,0,0,0,0|0,0,2]=4 648 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 D81404 [0,2,0,0,0,0|0,0,2]=4 649 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 Y12047 [0,2,0,0,0,0|0,0,2]=4 650 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 Y12048 [0,2,0,0,0,0|0,0,2]=4 651 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 N11089 [0,2,0,0,0,0|0,0,2]=4 652 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 N11090 [0,2,0,0,0,0|0,0,2]=4 653 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 Y10773 [0,2,0,0,0,0|0,0,2]=4 654 B11R1.222 N[C@@H](CO)C1=C(Cl)C=CC=C1 Y13361 [0,2,0,0,0,0|0,0,2]=4 655 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 D83963 [0,2,0,0,0,0|0,0,2]=4 656 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 I11002 [0,2,0,0,0,0|0,0,2]=4 657 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 I11143 [0,2,0,0,0,0|0,0,2]=4 658 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 Y10336 [0,2,0,0,0,0|0,0,2]=4 659 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 Y12049 [0,2,0,0,0,0|0,0,2]=4 660 B11R1.605 C=CCC1=C(I)C=CN=C1F 51253 [0,2,0,0,0,0|2,0,0]=4 661 B11R1.605 CNCC1=C(Cl)C=CC=C1Cl 23581 [0,2,0,0,0,0|2,0,0]=4 662 B11R1.23 C#C[C@@H](O)C1=CC=CC(F)=C1 79796 [0,2,0,0,0,0|1,0,1]=4 663 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 N11093 [0,2,0,0,0,0|0,0,2]=4 664 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 N11094 [0,2,0,0,0,0|0,0,2]=4 665 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 N11207 [0,2,0,0,0,0|0,0,2]=4 666 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 Y10647 [0,2,0,0,0,0|0,0,2]=4 667 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 Y10654 [0,2,0,0,0,0|0,0,2]=4 668 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 Y12450 [0,2,0,0,0,0|0,0,2]=4 669 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 N11059 [0,2,0,0,0,0|1,0,1]=4 670 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 N11060 [0,2,0,0,0,0|1,0,1]=4 671 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 N13204 [0,2,0,0,0,0|1,0,1]=4 672 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 N14300 [0,2,0,0,0,0|1,0,1]=4 673 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 Y12439 [0,2,0,0,0,0|1,0,1]=4 674 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 Y13349 [0,2,0,0,0,0|1,0,1]=4 675 B11R1.23 CC[C@H](N)C1=CC=CC(Br)=C1 N10470 [0,2,0,0,0,0|1,0,1]=4 676 B11R1.23 CC[C@H](N)C1=CC=CC(Br)=C1 N10952 [0,2,0,0,0,0|1,0,1]=4 677 B11R1.23 CC[C@H](N)C1=CC=CC(Br)=C1 N11195 [0,2,0,0,0,0|1,0,1]=4 678 B11R1.23 CC[C@H](N)C1=CC=CC(Br)=C1 Y10721 [0,2,0,0,0,0|1,0,1]=4 679 B11R1.23 CC[C@H](N)C1=CC=CC(Br)=C1 Y11058 [0,2,0,0,0,0|1,0,1]=4 680 B11R1.23 CC[C@H](N)C1=CC=CC(Cl)=C1 Y10291 [0,2,0,0,0,0|1,0,1]=4 681 B11R1.23 CC[C@H](N)C1=CC=CC(F)=C1 20089 [0,2,0,0,0,0|1,0,1]=4 682 B11R1.23 CC[C@H](N)C1=CC=CC(F)=C1 N10472 [0,2,0,0,0,0|1,0,1]=4 683 B11R1.23 CC[C@H](N)C1=CC=CC(F)=C1 N10473 [0,2,0,0,0,0|1,0,1]=4 684 B11R1.23 CC[C@H](N)C1=CC=CC(F)=C1 Y10473 [0,2,0,0,0,0|1,0,1]=4 685 B11R1.23 CC[C@H](N)C1=CC=CC(F)=C1 Y11089 [0,2,0,0,0,0|1,0,1]=4 686 B11R1.23 CC[C@H](N)C1=CC=CC(O)=C1 Y14524 [0,2,0,0,0,0|1,0,1]=4 687 B11R1.23 CN[C@@H](C)C1=CC(C)=CC=C1 Y11601 [0,2,0,0,0,0|2,0,0]=4 688 B11R1.23 CN[C@@H](C)C1=CC(C)=CC=C1 Y12434 [0,2,0,0,0,0|2,0,0]=4 689 B11R1.23 CN[C@@H](C)C1=CC=CC(Br)=C1 Y10927 [0,2,0,0,0,0|2,0,0]=4 690 B11R1.23 CN[C@@H](C)C1=CC=CC(Cl)=C1 Y12192 [0,2,0,0,0,0|2,0,0]=4 691 B11R1.23 CN[C@@H](C)C1=CC=CC(Cl)=C1 Y13371 [0,2,0,0,0,0|2,0,0]=4 692 B11R1.23 CN[C@@H](C)C1=CC=CC(Cl)=C1 Y13372 [0,2,0,0,0,0|2,0,0]=4 693 B11R1.23 CN[C@@H](C)C1=CC=CC(Cl)=C1 Y13373 [0,2,0,0,0,0|2,0,0]=4 694 B11R1.23 CN[C@@H](C)C1=CC=CC(F)=C1 Y14837 [0,2,0,0,0,0|2,0,0]=4 695 B11R1.23 CN[C@@H](C)C1=CC=CC(F)=C1 Y14849 [0,2,0,0,0,0|2,0,0]=4 696 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13444 [0,2,0,0,0,0|1,0,1]=4 697 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 Y10361 [0,2,0,0,0,0|1,0,1]=4 698 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 I11040 [0,2,0,0,0,0|0,0,2]=4 699 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 I11042 [0,2,0,0,0,0|0,0,2]=4 700 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 N11209 [0,2,0,0,0,0|0,0,2]=4 701 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 Y10525 [0,2,0,0,0,0|0,0,2]=4 702 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 F16952 [0,2,0,0,0,0|0,0,2]=4 703 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 I11003 [0,2,0,0,0,0|0,0,2]=4 704 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 Y10108 [0,2,0,0,0,0|0,0,2]=4 705 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 Y10643 [0,2,0,0,0,0|0,0,2]=4 706 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 F16917 [0,2,0,0,0,0|0,0,2]=4 707 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 N11105 [0,2,0,0,0,0|0,0,2]=4 708 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 Y10686 [0,2,0,0,0,0|0,0,2]=4 709 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 Y10867 [0,2,0,0,0,0|0,0,2]=4 710 B11R1.23 N[C@@H](CO)C1=CC=CC(O)=C1 Y10947 [0,2,0,0,0,0|0,0,2]=4 711 B11R1.23 O=CC(=O)C1=CC=CC(Cl)=C1 N16981 [0,2,0,0,0,0|0,0,1]=3 712 B11R1.23 OC[C@H](Cl)C1=CC=CC(Cl)=C1 58254 [0,2,0,0,0,0|0,0,2]=4 713 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 58256 [0,2,0,0,0,0|1,0,1]=4 714 B11R1.24 CC1=CC=CC(OCCBr)=C1 D86494 [0,2,0,0,0,0|1,0,1]=4 715 B11R1.24 CC1=CC=CC(OCCN)=C1 30931 [0,2,0,0,0,0|1,0,1]=4 716 B11R1.24 CCCCC1=CC=CC(F)=C1 36944 [0,2,0,0,0,0|1,0,1]=4 717 B11R1.24 CCNCC1=CC=CC(O)=C1 31617 [0,2,0,0,0,0|1,0,1]=4 718 B11R1.24 FC1=CC=CC(OCCBr)=C1 71908 [0,2,0,0,0,0|1,0,1]=4 719 B11R1.24 NCCCC1=CC=CC(Cl)=C1 F20098 [0,2,0,0,0,0|1,0,1]=4 720 B11R1.24 O=CCCC1=CC=CC(Br)=C1 A10169 [0,2,0,0,0,0|0,0,0]=2 721 B11R1.24 OCCCC1=CC=CC(Cl)=C1 AB3572 [0,2,0,0,0,0|0,0,2]=4 722 B11R1.24 OCCCC1=CC=CC(F)=C1 AB3824 [0,2,0,0,0,0|0,0,2]=4 723 B11R1.34 CCCC1=CC(F)=CC(F)=C1 T70464 [0,2,0,0,0,0|1,0,1]=4 724 B11R1.34 CNCC1=CC(Cl)=CC(Cl)=C1 77974 [0,2,0,0,0,0|2,0,0]=4 725 B11R1.34 CNCC1=CC(Cl)=CC(Cl)=C1 N16813 [0,2,0,0,0,0|2,0,0]=4 726 B11R1.34 CNCC1=CC(F)=CC(F)=C1 36789 [0,2,0,0,0,0|2,0,0]=4 727 B11R1.34 FC1=CC(F)=CC(CCBr)=C1 C78634 [0,2,0,0,0,0|1,0,1]=4 728 B11R1.34 N#CCC1=CC(Br)=CC(Br)=C1 60096 [0,2,0,0,0,0|1,0,1]=4 729 B11R1.34 N#CCC1=CC(Br)=CC(Cl)=C1 35726 [0,2,0,0,0,0|1,0,1]=4 730 B11R1.34 OCCC1=CC(Cl)=CC(Cl)=C1 CK1128 [0,2,0,0,0,0|0,0,2]=4 731 B11R1.34 OCCC1=CC(F)=CC(F)=C1 35629 [0,2,0,0,0,0|0,0,2]=4 732 B11R1.34 SCCC1=CC(Cl)=CC(Cl)=C1 F50628 [0,2,0,0,0,0|0,1,1]=4 733 B11R1.157 CC(=O)NC1=NC=CC(Br)=C1 36520 [0,2,0,0,0,0|2,0,0]=4 734 B11R1.157 CC(=O)NC1=NC=CC(N)=C1 FD10602 [0,2,0,0,0,0|2,0,0]=4 735 B11R1.157 CC(=O)OC1=CC=CC(Cl)=C1 Y11318 [0,2,0,0,0,0|1,0,0]=3 736 B11R1.157 CC(=O)OC1=CC=CC(I)=C1 C75148 [0,2,0,0,0,0|1,0,0]=3 737 B11R1.157 CC(C)CC1=CC=CC(Br)=C1 C72557 [0,2,0,0,0,0|1,0,1]=4 738 B11R1.157 CC1=CC(CC(=O)O)=CN=C1 D80704 [0,2,0,0,0,0|1,0,0]=3 739 B11R1.157 CC1=CC(CC(=O)O)=CN=C1 P17359 [0,2,0,0,0,0|1,0,0]=3 740 B11R1.157 CC1=CC(CC(=O)O)=NC=C1 S10096 [0,2,0,0,0,0|1,0,0]=3 741 B11R1.157 CC1=CC=CC(CC(=O)O)=N1 26369 [0,2,0,0,0,0|1,0,0]=3 742 B11R1.157 CC1=CC=CC(CC(=O)[O-])=N1 36391 [0,2,0,0,0,0|1,0,0]=3 743 B11R1.157 CN(C)CC1=CC=CC(O)=C1 C75839 [0,2,0,0,0,0|2,0,0]=4 744 B11R1.157 C[C@H](N)CC1=CC=CC(Br)=C1 N10830 [0,2,0,0,0,0|1,0,1]=4 745 B11R1.157 C[C@H](N)CC1=CC=CC(Br)=C1 Y11543 [0,2,0,0,0,0|1,0,1]=4 746 B11R1.157 C[C@H](O)CC1=CC=CC(Cl)=C1 W16410 [0,2,0,0,0,0|0,0,2]=4 747 B11R1.157 N=C(N)NC1=CC=CC(Br)=C1 C16548 [0,2,0,0,0,0|2,0,0]=4 748 B11R1.157 NC(=O)CC1=CC(N)=CC=C1 C72191 [0,2,0,0,0,0|0,0,0]=2 749 B11R1.157 NC(=O)CC1=CC=CC(Cl)=C1 57489 [0,2,0,0,0,0|0,0,0]=2 750 B11R1.157 NC1=NC=CC(CC(=O)O)=C1 Y11285 [0,2,0,0,0,0|1,0,0]=3 751 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 39149 [0,2,0,0,0,0|1,0,0]=3 752 B11R1.157 O=C(O)CC1=CC=CC(Br)=N1 C71333 [0,2,0,0,0,0|1,0,0]=3 753 B11R1.157 O=C(O)CC1=CC=CC(Cl)=N1 F14480 [0,2,0,0,0,0|1,0,0]=3 754 B11R1.157 O=C(O)CC1=CC=CC(F)=N1 P10854 [0,2,0,0,0,0|1,0,0]=3 755 B11R1.157 O=C(O)CC1=CN=CC(Cl)=N1 26805 [0,2,0,0,0,0|2,0,0]=4 756 B11R1.157 O=C(O)CC1=NC=CC(Br)=C1 C71755 [0,2,0,0,0,0|1,0,0]=3 757 B11R1.189 CNCC1=CC=CC(C#N)=C1 C77059 [0,2,0,0,0,0|2,0,0]=4 758 B11R1.189 COC1=CC=CC(CC=O)=C1 W16819 [0,2,0,0,0,0|0,0,0]=2 759 B11R1.189 COC1=CC=CC(CSC)=C1 W19464 [0,2,0,0,0,0|2,0,0]=4 760 B11R1.189 COCC1=CC(CN)=CC=C1 O10066 [0,2,0,0,0,0|2,0,0]=4 761 B11R1.189 COCC1=CC=CC(C=O)=C1 Y14420 [0,2,0,0,0,0|2,0,0]=4 762 B11R1.189 N#CC1=CC(CNN)=CC=C1 D95131 [0,2,0,0,0,0|2,0,0]=4 763 B11R1.189 N#CC1=CC=CC(CCO)=C1 72018 [0,2,0,0,0,0|0,0,2]=4 764 B11R1.7 C[C@](N)(CO)C1=CC=CC=C1 66215 [0,2,0,0,0,0|0,0,2]=4 765 B11R1.7 NCC(F)(F)C1=CC=CC=C1 P11064 [0,2,0,0,0,0|1,0,1]=4 766 B11R1.12 CN[C@@H](CO)C1=CC=CC=C1 Y10222 [0,2,0,0,0,0|0,0,2]=4 767 B11R1.12 NC[C@@H](CO)C1=CC=CC=C1 70910 [0,2,0,0,0,0|0,0,2]=4 768 B11R1.16 C=CC[C@H](N)C1=CC=CC=C1 I11297 [0,2,0,0,0,0|1,0,0]=3 769 B11R1.16 C=CC[C@H](N)C1=CC=CC=C1 Y10366 [0,2,0,0,0,0|1,0,0]=3 770 B11R1.16 C=CC[C@H](N)C1=CC=CC=C1 Y12585 [0,2,0,0,0,0|1,0,0]=3 771 B11R1.16 C=CC[C@H](N)C1=CC=CC=C1 Y13293 [0,2,0,0,0,0|1,0,0]=3 772 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 Y10270 [0,2,0,0,0,0|1,0,1]=4 773 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 Y11637 [0,2,0,0,0,0|1,0,1]=4 774 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 Y11944 [0,2,0,0,0,0|1,0,1]=4 775 B11R1.16 COC[C@H](N)C1=CC=CC=C1 N12553 [0,2,0,0,0,0|0,0,2]=4 776 B11R1.16 C[C@@H](CCN)C1=CC=CC=C1 AC6042 [0,2,0,0,0,0|1,0,1]=4 777 B11R1.16 C[C@H](N=C=O)C1=CC=CC=C1 D87824 [0,2,0,0,0,0|0,0,1]=3 778 B11R1.16 N#CC[C@H](O)C1=CC=CC=C1 AB1470 [0,2,0,0,0,0|1,0,1]=4 779 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 65208 [0,2,0,0,0,0|0,0,2]=4 780 B11R1.16 O=C(CCO)C1=CC=CC=C1 A11168 [0,2,0,0,0,0|0,0,2]=4 781 B11R1.36 CC(=O)[C@H](N)C1=CC=CC=C1 N13201 [0,2,0,0,0,0|0,0,0]=2 782 B11R1.36 CC(=O)[C@H](O)C1=CC=CC=C1 AC1336 [0,2,0,0,0,0|0,0,0]=2 783 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 74050 [0,2,0,0,0,0|1,0,1]=4 784 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 F16904 [0,2,0,0,0,0|1,0,1]=4 785 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 Y11074 [0,2,0,0,0,0|1,0,1]=4 786 B11R1.36 C[C@@H](C(=N)N)C1=CC=CC=C1 71885 [0,2,0,0,0,0|1,0,0]=3 787 B11R1.36 C[C@@H](C(=O)O)C1=CN=CC=C1 79624 [0,2,0,0,0,0|1,0,0]=3 788 B11R1.36 C[C@@H](C1=CC=CC=C1)N(C)C A12149 [0,2,0,0,0,0|2,0,0]=4 789 B11R1.36 C[C@@H](O)[C@H](N)C1=CC=CC=C1 N16817 [0,2,0,0,0,0|0,0,2]=4 790 B11R1.36 N[C@@H](C(=O)O)C1=CN=CC=C1 AC7675 [0,2,0,0,0,0|1,0,0]=3 791 B11R1.28 BrCCSCC1=CC=CC=C1 D80856 [0,2,0,0,0,0|1,0,1]=4 792 B11R1.28 C#CCNCC1=CC=CC=C1 W16389 [0,2,0,0,0,0|1,0,1]=4 793 B11R1.28 CC#CCOC1=CC=CC=C1 W17093 [0,2,0,0,0,0|1,0,1]=4 794 B11R1.28 CNCCCC1=CC=CC=C1 AR3929 [0,2,0,0,0,0|1,0,1]=4 795 B11R1.28 ICCOCC1=CC=CC=C1 70075 [0,2,0,0,0,0|1,0,1]=4 796 B11R1.28 N#CCNCC1=CC=CC=C1 80731 [0,2,0,0,0,0|1,0,1]=4 797 B11R1.28 NCCCOC1=CC=CC=C1 76995 [0,2,0,0,0,0|1,0,1]=4 798 B11R1.28 NCCCOC1=CC=CC=C1 AB7704 [0,2,0,0,0,0|1,0,1]=4 799 B11R1.28 O=CCCCC1=CN=CC=C1 P16929 [0,2,0,0,0,0|1,0,0]=3 800 B11R1.40 C#C[C@@H](O)CC1=CC=CC=C1 C75175 [0,2,0,0,0,0|0,0,2]=4 801 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 Y10008 [0,2,0,0,0,0|1,0,0]=3 802 B11R1.40 CNC(=O)CC1=CN=CC=C1 C71252 [0,2,0,0,0,0|1,0,0]=3 803 B11R1.40 CNC(=O)OC1=CC=CC=C1 C10489 [0,2,0,0,0,0|1,0,0]=3 804 B11R1.40 COC(=O)CC1=CN=CC=C1 31754 [0,2,0,0,0,0|1,0,0]=3 805 B11R1.40 COC(=O)CC1=NC=NC=C1 P11690 [0,2,0,0,0,0|2,0,0]=4 806 B11R1.40 C[C@@H](C#N)NC1=CC=CC=C1 81451 [0,2,0,0,0,0|1,0,1]=4 807 B11R1.40 C[C@@H](CN)OC1=CC=CC=C1 AR3791 [0,2,0,0,0,0|1,0,1]=4 808 B11R1.40 NCC(=O)CC1=CC=CC=C1 A10565 [0,2,0,0,0,0|0,0,0]=2 809 B11R1.40 NCC(=O)NC1=CC=CC=C1 AB22065 [0,2,0,0,0,0|1,0,0]=3 810 B11R1.40 NCC(=O)NC1=CC=CC=C1 AB22066 [0,2,0,0,0,0|1,0,0]=3 811 B11R1.40 NNC(=O)CC1=CC=NC=C1 25064 [0,2,0,0,0,0|1,0,0]=3 812 B11R1.40 NNC(=O)OC1=CC=CC=C1 Y11606 [0,2,0,0,0,0|1,0,0]=3 813 B11R1.40 N\C(CC1=CC=CC=C1)=N/O W18702 [0,2,0,0,0,0|0,0,1]=3 814 B11R1.40 O=C(CCl)CC1=CC=CC=C1 Y10931 [0,2,0,0,0,0|0,0,0]=2 815 B11R1.40 O=C(CO)NC1=CC=CC=C1 C77599 [0,2,0,0,0,0|1,0,0]=3 816 B11R1.40 OC[C@@H](Br)CC1=CC=CC=C1 D80460 [0,2,0,0,0,0|0,0,2]=4 817 B11R1.91 CC(=O)C#CC1=CC=CC=C1 F21355 [0,2,0,0,0,0|0,0,1]=3 818 B11R1.91 C[C@H](N)CCC1=CC=CC=C1 Y11691 [0,2,0,0,0,0|1,0,1]=4 819 B11R1.91 NC(=O)CCC1=CC=NC=C1 AC6902 [0,2,0,0,0,0|1,0,0]=3 820 B11R1.91 NC(=O)CCC1=CN=CC=C1 AC6901 [0,2,0,0,0,0|1,0,0]=3 821 B11R1.91 NC(=O)COC1=CC=CC=C1 N16863 [0,2,0,0,0,0|0,0,0]=2 822 B11R1.91 O=C(O)C#CC1=CC=NC=C1 AC1699 [0,2,0,0,0,0|1,0,1]=4 823 B11R1.91 O=C(O)C#CC1=CN=CC=C1 O10892 [0,2,0,0,0,0|1,0,1]=4 824 B11R1.91 O=C(O)C#CC1=NC=CC=C1 W11288 [0,2,0,0,0,0|1,0,1]=4 825 B11R1.91 O=C(O)CCC1=CN=CN=C1 72064 [0,2,0,0,0,0|2,0,0]=4 826 B11R1.91 O=C(O)CCC1=CN=NC=C1 P17753 [0,2,0,0,0,0|2,0,0]=4 827 B11R1.91 O=C(O)CNC1=CC=NC=C1 CS1833 [0,2,0,0,0,0|1,0,0]=3 828 B11R1.91 O=C(O)COC1=CC=NC=C1 C75738 [0,2,0,0,0,0|1,0,0]=3 829 B11R1.91 O=C(O)COC1=NC=CC=C1 SC3951 [0,2,0,0,0,0|1,0,0]=3 830 B11R1.91 O=C([O-])CCC1=CC=CC=C1 A11567 [0,2,0,0,0,0|0,0,0]=2 831 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 35117 [0,2,0,0,0,0|0,0,1]=3 832 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 D70623 [0,2,0,0,0,0|0,0,2]=4 833 B11R1.509 C[S@](=N)(=O)CC1=CC=CC=C1 W18265 [0,2,0,0,0,0|1,0,0]=3 834 B11R1.509 NS(=O)(=O)CC1=CN=CC=C1 F53446 [0,2,0,0,0,0|2,0,0]=4 835 B11R1.509 O=S(=O)(O)CC1=NC=CC=C1 95731 [0,2,0,0,0,0|2,0,0]=4 836 B11R1.509 O=S(=O)([O-])CC1=CC=NC=C1 F53353 [0,2,0,0,0,0|2,0,0]=4 837 B9R1.5 NC1=CC=CC=CC1=O F11661 [0,0,1,1,0,0|1,0,1]=4 838 B11R2.34 NC1=CC=C(C2CC2)C=C1 26267 [0,1,0,1,0,0|1,0,1]=4 839 B11R2.34 NC1=CC=C(C2CC2)C=C1 33400 [0,1,0,1,0,0|1,0,1]=4 840 B11R2.36 BrC1=CC2=C(C=C1)CCC2 Y10449 [0,1,0,1,0,0|1,0,1]=4 841 B11R2.36 BrC1=CC2=C(C=C1)CCN2 73495 [0,1,0,1,0,0|1,0,1]=4 842 B11R2.36 BrC1=CC2=C(C=C1)COC2 71931 [0,1,0,1,0,0|2,0,0]=4 843 B11R2.36 CC1=CC2=C(C=C1)CCC2 Y11729 [0,1,0,1,0,0|1,0,1]=4 844 B11R2.36 CC1=CC2=C(C=C1)SC=C2 F11127 [0,1,0,1,0,0|0,1,1]=4 845 B11R2.36 CC1=CC2=C(C=CS2)C=C1 C73204 [0,1,0,1,0,0|0,1,1]=4 846 B11R2.36 ClC1=CC2=C(C=C1)CC=C2 53583 [0,1,0,1,0,0|1,0,0]=3 847 B11R2.36 ClC1=CC2=C(C=C1)CCC2 N12723 [0,1,0,1,0,0|1,0,1]=4 848 B11R2.36 ClC1=CC2=C(C=C1)CCN2 F11859 [0,1,0,1,0,0|1,0,1]=4 849 B11R2.36 ClC1=CC2=C(C=C1)CNC2 AB6849 [0,1,0,1,0,0|2,0,0]=4 850 B11R2.36 ClC1=CC2=C(C=C1)N=CO2 W17078 [0,1,0,1,0,0|1,0,1]=4 851 B11R2.36 ClC1=CC2=C(C=C1)OCC2 W17536 [0,1,0,1,0,0|0,0,2]=4 852 B11R2.36 ClC1=CC2=C(C=CC2)C=C1 F13902 [0,1,0,1,0,0|1,0,0]=3 853 B11R2.36 FC1=CC2=C(C=C1)CCN2 F21334 [0,1,0,1,0,0|1,0,1]=4 854 B11R2.36 FC1=CC2=C(C=C1)CCO2 Y13232 [0,1,0,1,0,0|0,0,2]=4 855 B11R2.36 FC1=CC2=C(C=C1)N=CS2 F14497 [0,1,0,1,0,0|1,1,0]=4 856 B11R2.36 FC1=CC2=C(C=C1)OC=C2 F30233 [0,1,0,1,0,0|0,0,2]=4 857 B11R2.36 FC1=CC2=C(C=C1)SC=N2 C13797 [0,1,0,1,0,0|1,1,0]=4 858 B11R2.36 FC1=CC2=C(C=CS2)C=C1 P15213 [0,1,0,1,0,0|0,1,1]=4 859 B11R2.36 IC1=CC2=C(C=C1)N=CS2 Y11641 [0,1,0,1,0,0|1,1,0]=4 860 B11R2.36 NC1=CC2=C(C=C1)CCO2 F12399 [0,1,0,1,0,0|0,0,2]=4 861 B11R2.36 NC1=CC2=C(C=C1)CNC2 AB9521 [0,1,0,1,0,0|2,0,0]=4 862 B11R2.36 NC1=CC2=C(C=CO2)C=C1 D70068 [0,1,0,1,0,0|0,0,2]=4 863 B11R2.36 OC1=CC2=C(C=C1)CCN2 C75271 [0,1,0,1,0,0|1,0,1]=4 864 B11R2.36 OC1=CC2=C(C=C1)CCO2 27138 [0,1,0,1,0,0|0,0,2]=4 865 B11R2.36 OC1=CC2=C(C=C1)CNC2 20927 [0,1,0,1,0,0|2,0,0]=4 866 B11R2.36 OC1=CC2=C(C=C1)CNC2 52281 [0,1,0,1,0,0|2,0,0]=4 867 B11R2.36 OC1=CC2=C(C=C1)CNC2 52301 [0,1,0,1,0,0|2,0,0]=4 868 B11R2.36 OC1=CC2=C(C=C1)N=CO2 D77541 [0,1,0,1,0,0|1,0,1]=4 869 B11R2.36 OC1=CC2=C(C=C1)OC=N2 AC4843 [0,1,0,1,0,0|1,0,1]=4 870 B11R2.36 OC1=CC2=C(C=C1)OCC2 24188 [0,1,0,1,0,0|0,0,2]=4 871 B11R2.36 OC1=CC2=C(C=C1)SC=C2 59802 [0,1,0,1,0,0|0,1,1]=4 872 B11R2.36 OC1=CC2=C(C=C1)SC=N2 C76461 [0,1,0,1,0,0|1,1,0]=4 873 B11R2.36 OC1=CC2=C(C=CO2)C=C1 84605 [0,1,0,1,0,0|0,0,2]=4 874 B11R2.10 BrC1=CC2=C(C=CC=C2)O1 30106 [0,1,0,1,0,0|0,0,2]=4 875 B11R2.10 CC1=CC2=C(C=CC=C2)O1 F11695 [0,1,0,1,0,0|0,0,2]=4 876 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 P16419 [0,1,0,1,0,0|1,0,1]=4 877 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 VT1375 [0,1,0,1,0,0|1,0,1]=4 878 B11R2.10 ClC1=CC2=C(C=CC=C2)N1 F11679 [0,1,0,1,0,0|1,0,1]=4 879 B11R2.10 IC1=CC2=C(C=CC=C2)N1 F18254 [0,1,0,1,0,0|1,0,1]=4 880 B11R2.10 IC1=CC2=C(C=CC=C2)O1 D83864 [0,1,0,1,0,0|0,0,2]=4 881 B11R2.10 IC1=CC2=C(C=CC=C2)S1 F13439 [0,1,0,1,0,0|0,1,1]=4 882 B11R2.10 NC1=CC2=C(C=CC=C2)S1 27373 [0,1,0,1,0,0|0,1,1]=4 883 B11R2.10 O=C1CC2=C(C=CN=C2)N1 86499 [0,1,0,1,0,0|1,0,0]=3 884 B11R2.10 O=C1CN2C=CC=CC2=N1 78878 [0,1,0,1,0,0|1,0,0]=3 885 B11R2.10 O=C1NC2=C(C=CN=C2)O1 AC6441 [0,1,0,1,0,0|2,0,0]=4 886 B11R2.10 O=C1NC2=C(C=NC=C2)O1 O12039 [0,1,0,1,0,0|2,0,0]=4 887 B11R2.10 O=C1NC2=C(N=CC=C2)O1 O12038 [0,1,0,1,0,0|2,0,0]=4 888 B11R2.20 C1=CC2=C(C=C1)CCN=C2 F12436 [0,1,0,1,0,0|1,0,1]=4 889 B11R2.20 C1=CC2=C(C=C1)OCC=C2 N13096 [0,1,0,1,0,0|1,0,0]=3 890 B11R2.20 C1=CC=C2N=NC=CC2=C1 76492 [0,1,0,1,0,0|1,0,1]=4 891 B11R2.20 C1=CC=C2N=NC=CC2=C1 Y10640 [0,1,0,1,0,0|1,0,1]=4 892 B11R2.106 BrC1=C2CCCC2=CC=C1 38090 [0,1,0,1,0,0|1,0,1]=4 893 B11R2.106 CC1=C2CC=CC2=CC=C1 Y10332 [0,1,0,1,0,0|1,0,0]=3 894 B11R2.106 CC1=C2CCCC2=CC=C1 Y11654 [0,1,0,1,0,0|1,0,1]=4 895 B11R2.106 CC1=CC=CC2=C1C=CS2 C72689 [0,1,0,1,0,0|0,1,1]=4 896 B11R2.106 ClC1=C2CC=CC2=CC=C1 C75442 [0,1,0,1,0,0|1,0,0]=3 897 B11R2.106 ClC1=C2CCOC2=CC=C1 52389 [0,1,0,1,0,0|0,0,2]=4 898 B11R2.106 ClC1=C2CNCC2=CC=C1 SC1314 [0,1,0,1,0,0|2,0,0]=4 899 B11R2.106 ClC1=C2N=COC2=CC=C1 D76689 [0,1,0,1,0,0|1,0,1]=4 900 B11R2.106 ClC1=C2N=CSC2=CC=C1 25561 [0,1,0,1,0,0|1,1,0]=4 901 B11R2.106 ClC1=C2OC=CC2=CC=C1 AC5711 [0,1,0,1,0,0|0,0,2]=4 902 B11R2.106 ClC1=C2SC=CC2=CC=C1 82930 [0,1,0,1,0,0|0,1,1]=4 903 B11R2.106 FC1=C2CCCC2=CC=C1 Y12594 [0,1,0,1,0,0|1,0,1]=4 904 B11R2.106 FC1=C2N=COC2=CC=C1 AC4244 [0,1,0,1,0,0|1,0,1]=4 905 B11R2.106 FC1=C2OC=CC2=CC=C1 52893 [0,1,0,1,0,0|0,0,2]=4 906 B11R2.106 FC1=C2SC=CC2=CC=C1 F13949 [0,1,0,1,0,0|0,1,1]=4 907 B11R2.106 FC1=CC=CC2=C1C=CS2 70408 [0,1,0,1,0,0|0,1,1]=4 908 B11R2.106 FC1=CC=CC2=C1N=CS2 E70373 [0,1,0,1,0,0|1,1,0]=4 909 B11R2.106 IC1=C2CCCC2=CC=C1 N13267 [0,1,0,1,0,0|1,0,1]=4 910 B11R2.106 IC1=C2NC=CC2=CC=C1 94618 [0,1,0,1,0,0|1,0,1]=4 911 B11R2.106 NC1=C2NCCC2=CC=C1 AC5784 [0,1,0,1,0,0|1,0,1]=4 912 B11R2.106 NC1=C2OC=CC2=CC=C1 F20181 [0,1,0,1,0,0|0,0,2]=4 913 B11R2.106 NC1=C2OC=CC2=CC=C1 P16876 [0,1,0,1,0,0|0,0,2]=4 914 B11R2.106 NC1=C2OCCC2=CC=C1 Y10505 [0,1,0,1,0,0|0,0,2]=4 915 B11R2.106 NC1=C2SC=NC2=CC=C1 27175 [0,1,0,1,0,0|1,1,0]=4 916 B11R2.106 NC1=CC=CC2=C1C=CO2 52950 [0,1,0,1,0,0|0,0,2]=4 917 B11R2.106 NC1=CC=CC2=C1C=CS2 51426 [0,1,0,1,0,0|0,1,1]=4 918 B11R2.106 NC1=CC=CC2=C1C=CS2 Y11369 [0,1,0,1,0,0|0,1,1]=4 919 B11R2.106 NC1=CC=CC2=C1CCN2 O11831 [0,1,0,1,0,0|1,0,1]=4 920 B11R2.106 NC1=CC=CC2=C1CNC2 62888 [0,1,0,1,0,0|2,0,0]=4 921 B11R2.106 NC1=CC=CC2=C1CNC2 C90573 [0,1,0,1,0,0|2,0,0]=4 922 B11R2.106 NC1=CC=CC2=C1N=CS2 79115 [0,1,0,1,0,0|1,1,0]=4 923 B11R2.106 NC1=CC=CC2=C1NC=N2 26687 [0,1,0,1,0,0|2,0,0]=4 924 B11R2.106 OC1=C2CCNC2=CC=C1 76585 [0,1,0,1,0,0|1,0,1]=4 925 B11R2.106 OC1=C2NCCC2=CC=C1 D82764 [0,1,0,1,0,0|1,0,1]=4 926 B11R2.106 OC1=C2OC=CC2=CC=C1 70790 [0,1,0,1,0,0|0,0,2]=4 927 B11R2.106 OC1=CC=CC2=C1N=CO2 F17479 [0,1,0,1,0,0|1,0,1]=4 928 B11R2.35 NC1=CC(C2CC2)=CC=C1 C75291 [0,1,0,1,0,0|1,0,1]=4 929 B11R2.1 BrC1=NSC2=C1C=CC=C2 D84733 [0,1,0,1,0,0|2,0,0]=4 930 B11R2.1 C=C1CCC2=C1C=CC=C2 AC3155 [0,1,0,1,0,0|1,0,0]=3 931 B11R2.1 CC1=CCC2=C1C=CC=C2 C76459 [0,1,0,1,0,0|1,0,0]=3 932 B11R2.1 CN1CCC2=C1C=CC=C2 D83554 [0,1,0,1,0,0|1,0,1]=4 933 B11R2.1 C[C@@H]1NCC2=C1C=CC=C2 E72710 [0,1,0,1,0,0|1,0,1]=4 934 B11R2.1 C[C@H]1CNC2=C1C=CC=C2 I11746 [0,1,0,1,0,0|1,0,1]=4 935 B11R2.1 ClC1=COC2=C1C=CC=C2 F14423 [0,1,0,1,0,0|0,0,2]=4 936 B11R2.1 FC1=NNC2=C1C=CC=C2 F30837 [0,1,0,1,0,0|2,0,0]=4 937 B11R2.1 NC1=CNC2=C1C=CC=C2 51896 [0,1,0,1,0,0|1,0,1]=4 938 B11R2.1 NC1=CSC2=C1C=CC=C2 25380 [0,1,0,1,0,0|0,1,1]=4 939 B11R2.1 NC1=NCC2=C1C=CC=C2 32182 [0,1,0,1,0,0|1,0,0]=3 940 B11R2.1 NN1CCC2=C1C=CC=C2 C90200 [0,1,0,1,0,0|1,0,1]=4 941 B11R2.1 O=C1C=CC2=C1C=CC=C2 O10409 [0,1,0,1,0,0|0,0,1]=3 942 B11R2.1 O=C1CCC2=C1C=CN=C2 67473 [0,1,0,1,0,0|1,0,0]=3 943 B11R2.1 O=C1CCC2=C1C=NC=C2 P10633 [0,1,0,1,0,0|1,0,0]=3 944 B11R2.1 O=C1COC2=C1C=CN=C2 65977 [0,1,0,1,0,0|1,0,0]=3 945 B11R2.1 O=C1COC2=C1C=CN=C2 W17205 [0,1,0,1,0,0|1,0,0]=3 946 B11R2.1 O=C1CSC2=C1C=CC=C2 26760 [0,1,0,1,0,0|0,0,0]=2 947 B11R2.1 O=C1NCC2=C1C=CC=N2 84460 [0,1,0,1,0,0|1,0,0]=3 948 B11R2.1 O=C1NCC2=C1C=CN=C2 F19961 [0,1,0,1,0,0|1,0,0]=3 949 B11R2.1 O=C1NCC2=C1C=NC=C2 37545 [0,1,0,1,0,0|1,0,0]=3 950 B11R2.1 O=C1NCC2=C1CC=CC2 P15954 [0,1,0,1,0,0|0,0,2]=4 951 B11R2.1 O=C1NCC2=CC=CN=C12 87908 [0,1,0,1,0,0|1,0,0]=3 952 B11R2.1 O=C1NCC2=NC=CN=C12 AT22460 [0,1,0,1,0,0|2,0,0]=4 953 B11R2.1 O=C1NCC2=NC=CN=C12 P20256 [0,1,0,1,0,0|2,0,0]=4 954 B11R2.1 O=C1NNC2=C1C=CC=N2 36117 [0,1,0,1,0,0|2,0,0]=4 955 B11R2.1 O=C1NNC2=C1C=CN=C2 F50508 [0,1,0,1,0,0|2,0,0]=4 956 B11R2.1 O=C1NNC2=CC=CN=C12 36532 [0,1,0,1,0,0|2,0,0]=4 957 B11R2.1 OC1=NNC2=C1C=CC=C2 C71048 [0,1,0,1,0,0|1,0,1]=4 958 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 D70931 [0,1,0,1,0,0|0,0,2]=4 959 B11R2.4 NC1CC1C2=CC=CC=C2 P17182 [0,1,0,1,0,0|1,0,1]=4 960 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 C15693 [0,1,0,1,0,0|1,0,1]=4 961 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 C15694 [0,1,0,1,0,0|1,0,1]=4 962 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 D94291 [0,1,0,1,0,0|1,0,1]=4 963 B11R2.4 N[C@H]1C[C@H]1C2=CC=CC=C2 P16183 [0,1,0,1,0,0|1,0,1]=4 964 B11R2.4 OC1CC1C2=CC=CC=C2 F50832 [0,1,0,1,0,0|0,0,2]=4 965 B11R2.239 C1=CC=C(C2CNC2)C=C1 84171 [0,1,0,1,0,0|1,0,1]=4 966 B11R2.239 C1=CC=C(C2COC2)C=C1 F51875 [0,1,0,1,0,0|0,0,2]=4 967 B11R2.239 C1=CC=C([C@@H]2CCN2)C=C1 C90175 [0,1,0,1,0,0|1,0,1]=4 968 B7R1.1 C=CC1=CC=CS1 C10114 [1,0,0,0,1,0|1,0,1]=4 969 B7R1.1 ClCC1=CC=CS1 79790 [1,0,0,0,1,0|2,0,0]=4 970 B7R1.1 NCC1=CC=CN1 25931 [1,0,0,0,1,0|2,0,0]=4 971 B7R1.1 NCC1=CNC=C1 F12967 [1,0,0,0,1,0|2,0,0]=4 972 B7R1.1 O=CC1=CC=C[Se]1 T72165 [1,0,0,0,1,0|1,0,0]=3 973 B7R1.1 O=CC1=CC=NS1 62852 [1,0,0,0,1,0|2,0,0]=4 974 B7R1.1 O=CC1=CCC=C1 77835 [1,0,0,0,1,0|0,0,1]=3 975 B7R1.1 O=CC1=CN=CO1 39069 [1,0,0,0,1,0|2,0,0]=4 976 B7R1.1 O=CC1=CON=C1 95893 [1,0,0,0,1,0|2,0,0]=4 977 B7R1.1 O=CC1=NOC=C1 P10400 [1,0,0,0,1,0|2,0,0]=4