0 B11R1.17 BrCCCC1=C(Br)C=CC=C1 C77748 [0,0,0,0,0,0|2,1,0]=3 1 B11R1.17 C#CCOC1=C(Br)C=CC=C1 AT23367 [0,0,0,0,0,0|2,1,1]=4 2 B11R1.17 C#CCOC1=C(Cl)C=CC=C1 AT23368 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.17 C#CCOC1=C(I)C=CC=C1 AT23373 [0,0,0,0,0,0|2,1,1]=4 4 B11R1.17 C=CCCC1=C(Br)C=NC=C1 S10194 [0,0,0,0,0,0|2,1,1]=4 5 B11R1.17 CC1=CC=CN=C1CCCN W10139 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.17 CCCOC1=C(N)C=CC=C1 AC7746 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.17 CCNCC1=C(Cl)C=CC=C1 C16114 [0,0,0,0,0,0|2,0,0]=2 8 B11R1.17 CNCCC1=C(C)C=CC=C1 C78447 [0,0,0,0,0,0|1,0,0]=1 9 B11R1.17 CNCCC1=C(Cl)C=CC=C1 C78279 [0,0,0,0,0,0|0,0,0]=0 10 B11R1.17 ClC1=C(CCCBr)C=CC=C1 C78298 [0,0,0,0,0,0|2,0,0]=2 11 B11R1.17 N#CCOC1=C(Cl)C=CC=C1 AC7530 [0,0,0,0,0,0|3,0,0]=3 12 B11R1.17 NCCCC1=C(Cl)C=CC=C1 C78000 [0,0,0,0,0,0|2,0,0]=2 13 B11R1.17 NCCCC1=C(F)C=CC=C1 F20045 [0,0,0,0,0,0|2,1,0]=3 14 B11R1.17 NCCCN1C=CC=CC1=O AT19227 [0,0,0,0,0,0|4,0,0]=4 15 B11R1.17 NCCOC1=C(Cl)C=CC=C1 L10067 [0,0,0,0,0,0|3,0,0]=3 16 B11R1.17 O=C1C=CC=CN1CCCO AT19228 [0,0,0,0,0,0|4,0,0]=4 17 B11R1.17 OCC#CC1=C(Cl)C=CC=C1 A50678 [0,0,0,0,0,0|2,0,2]=4 18 B11R1.17 OCCCC1=C(O)C=CC=N1 85302 [0,0,0,0,0,0|4,0,0]=4 19 B10R1.4 CC1=C(CC=O)C=CC=C1 W16821 [1,0,0,0,0,0|2,0,1]=4 20 B10R1.4 CC1=C(CON)C=CC=C1 D77271 [1,0,0,0,0,0|2,0,0]=3 21 B10R1.4 CCCC1=C(C)C=CC=C1 T71577 [1,0,0,0,0,0|1,0,0]=2 22 B10R1.4 CCCC1=CN=CN=C1Cl F11792 [1,0,0,0,0,0|2,0,0]=3 23 B10R1.4 CCNC1=C(F)C=CC=C1 D87863 [1,0,0,0,0,0|1,1,0]=3 24 B10R1.4 CCNC1=CC=CN=C1O F30124 [1,0,0,0,0,0|3,0,0]=4 25 B10R1.4 CCNC1=NC=CC=C1N AC7989 [1,0,0,0,0,0|3,0,0]=4 26 B10R1.4 CCNC1=NC=CN=C1Cl AT24639 [1,0,0,0,0,0|3,0,0]=4 27 B10R1.4 CCOC1=C(C)C=CN=C1 AC4346 [1,0,0,0,0,0|3,0,0]=4 28 B10R1.4 CCOC1=C(F)C=CC=N1 F53248 [1,0,0,0,0,0|2,1,0]=4 29 B10R1.4 CCOC1=CC=CN=C1Cl W17868 [1,0,0,0,0,0|2,0,0]=3 30 B10R1.4 CCSC1=C(Br)C=CC=C1 AT20838 [1,0,0,0,0,0|1,1,0]=3 31 B10R1.4 CCSC1=C(O)C=CC=C1 AT20889 [1,0,0,0,0,0|2,0,0]=3 32 B10R1.4 CNCC1=C(F)C=CC=N1 P10655 [1,0,0,0,0,0|1,1,0]=3 33 B10R1.4 CNCC1=C(F)C=CC=N1 P20450 [1,0,0,0,0,0|1,1,0]=3 34 B10R1.4 CNCC1=C(N)C=CC=C1 F13330 [1,0,0,0,0,0|1,0,0]=2 35 B10R1.4 NC1=C(CCF)C=NC=C1 P14647 [1,0,0,0,0,0|3,0,0]=4 36 B10R1.4 NCCN1C=CC=CC1=O F15207 [1,0,0,0,0,0|2,0,0]=3 37 B10R1.4 NCCN1C=CC=NC1=O AT13871 [1,0,0,0,0,0|3,0,0]=4 38 B10R1.4 NCCN1C=NC=CC1=O AT13878 [1,0,0,0,0,0|3,0,0]=4 39 B10R1.4 NNCC1=C(Cl)C=CC=C1 W12211 [1,0,0,0,0,0|1,0,0]=2 40 B10R1.4 O=C1C=CC=CN1CCBr AT19229 [1,0,0,0,0,0|3,0,0]=4 41 B10R1.4 O=CCC1=C(Cl)C=CC=C1 W16822 [1,0,0,0,0,0|1,0,1]=3 42 B10R1.17 CCCCC1=CC=CN=N1 O10974 [1,0,0,0,0,0|3,0,0]=4 43 B10R1.17 CNCCC1=CC=CN=C1 C73747 [1,0,0,0,0,0|1,0,0]=2 44 B10R1.17 CNCCC1=CC=NC=C1 AR1715 [1,0,0,0,0,0|1,0,0]=2 45 B10R1.17 CNNCC1=NC=CC=C1 30190 [1,0,0,0,0,0|2,0,0]=3 46 B10R1.17 FCCNC1=CC=CC=C1 D77931 [1,0,0,0,0,0|3,0,0]=4 47 B10R1.17 NNCCC1=CC=CC=C1 AC4670 [1,0,0,0,0,0|1,0,0]=2 48 B10R1.17 NOCCC1=CC=CC=C1 C10179 [1,0,0,0,0,0|2,0,0]=3 49 B10R1.17 O=CCCC1=NC=CC=C1 P20552 [1,0,0,0,0,0|3,0,0]=4 50 B10R1.17 O=CCOC1=CC=CC=C1 C15303 [1,0,0,0,0,0|3,0,0]=4 51 B10R1.17 OCCCC1=CN=CC=C1 AC5531 [1,0,0,0,0,0|3,0,0]=4 52 B10R1.17 SCCCC1=CN=CC=C1 F18019 [1,0,0,0,0,0|3,0,0]=4 53 B10R1.17 SCCCC1=NC=CC=C1 F18728 [1,0,0,0,0,0|3,0,0]=4 54 B12R1.25 CCCOC1=C(C)C(N)=CC=C1 F17950 [0,1,0,0,0,0|3,0,0]=4 55 B12R1.69 CCNCC1=C(C)C=C(C)C=C1 W16027 [0,1,0,0,0,0|3,0,0]=4 56 B12R1.69 CNCCC1=C(Cl)C=C(Cl)C=C1 C78436 [0,1,0,0,0,0|0,0,0]=1 57 B12R1.69 FC1=CC(F)=C(CCCBr)C=C1 C77740 [0,1,0,0,0,0|2,1,0]=4 58 B12R1.69 NCCCC1=C(Cl)C=C(Cl)C=C1 F20099 [0,1,0,0,0,0|2,0,0]=3 59 B12R1.69 NCCCC1=C(F)C=C(F)C=C1 C78172 [0,1,0,0,0,0|2,1,0]=4 60 B12R1.69 OCCCC1=C(F)C=C(F)C=C1 C78631 [0,1,0,0,0,0|2,1,0]=4 61 B12R1.121 CNCCC1=C(OC)C=CC=C1 C77728 [0,1,0,0,0,0|1,0,0]=2 62 B12R1.121 COC1=C(CCCBr)C=CC=C1 C78175 [0,1,0,0,0,0|3,0,0]=4 63 B12R1.121 O=CCCC1=C(CO)C=CC=C1 F19762 [0,1,0,0,0,0|3,0,0]=4 64 B12R1.125 CC(=O)SCC1=C(Cl)C=CC=C1 W11173 [0,1,0,0,0,0|2,0,0]=3 65 B12R1.125 CC(C)NCC1=C(Br)C=CC=C1 C78572 [0,1,0,0,0,0|2,1,0]=4 66 B12R1.125 CC(C)NCC1=C(Cl)C=CC=C1 C78237 [0,1,0,0,0,0|2,0,0]=3 67 B12R1.125 CC(C)NCC1=C(F)C=CC=C1 C78588 [0,1,0,0,0,0|2,1,0]=4 68 B12R1.125 CC(C)OCC1=C(Br)C=CC=C1 N10193 [0,1,0,0,0,0|2,1,0]=4 69 B12R1.125 NC1=C(CCC(=O)O)C=CC=C1 F52868 [0,1,0,0,0,0|3,0,0]=4 70 B12R1.267 BrCCCCC1=C(Br)C=CC=C1 AT22148 [0,1,0,0,0,0|1,1,0]=3 71 B12R1.267 C=CCCOC1=C(Br)C=CC=C1 C11642 [0,1,0,0,0,0|1,1,1]=4 72 B12R1.267 C=CCOCC1=C(N)C=CC=C1 I11747 [0,1,0,0,0,0|2,0,1]=4 73 B12R1.267 CCCNCC1=C(Br)C=CC=C1 C78484 [0,1,0,0,0,0|1,1,0]=3 74 B12R1.267 CCCNCC1=C(C)C=CC=C1 C78482 [0,1,0,0,0,0|2,0,0]=3 75 B12R1.267 CCCNCC1=C(Cl)C=CC=C1 C78483 [0,1,0,0,0,0|1,0,0]=2 76 B12R1.267 CCCNCC1=C(F)C=CC=C1 C78370 [0,1,0,0,0,0|1,1,0]=3 77 B12R1.267 CCNCCC1=C(F)C=CC=C1 AC6701 [0,1,0,0,0,0|0,1,0]=2 78 B12R1.267 COCOCC1=C(Br)C=CC=C1 C11531 [0,1,0,0,0,0|1,1,0]=3 79 B12R1.267 ClCCCOC1=C(Br)C=CC=C1 N10153 [0,1,0,0,0,0|2,1,0]=4 80 B12R1.267 NCCCOC1=C(F)C=CC=C1 AC7557 [0,1,0,0,0,0|2,1,0]=4 81 B12R1.267 OCCNCC1=C(F)C=CC=C1 AT15322 [0,1,0,0,0,0|2,1,0]=4 82 B12R1.308 C=CC[C@H](O)C1=C(Cl)C=CC=C1 F14511 [0,1,0,0,0,0|1,0,1]=3 83 B12R1.308 CCCC(=O)C1=C(Br)C=CC=C1 N13959 [0,1,0,0,0,0|1,1,1]=4 84 B12R1.308 CCCC(=O)C1=C(C)C=CC=C1 N13966 [0,1,0,0,0,0|2,0,1]=4 85 B12R1.308 CCCC(=O)C1=C(Cl)C=CC=C1 N12776 [0,1,0,0,0,0|1,0,1]=3 86 B12R1.308 CCCC(=O)C1=C(Cl)C=CN=C1 N14268 [0,1,0,0,0,0|2,0,1]=4 87 B12R1.308 CCCC(=O)C1=C(F)C=CC=C1 N13948 [0,1,0,0,0,0|1,1,1]=4 88 B12R1.308 CCC[C@H](N)C1=NC=CC=C1C N13874 [0,1,0,0,0,0|3,0,0]=4 89 B12R1.308 CCC[C@H](N)C1=NC=CC=C1C N13875 [0,1,0,0,0,0|3,0,0]=4 90 B12R1.308 CCC[C@H](N)C1=NC=CC=C1C N13876 [0,1,0,0,0,0|3,0,0]=4 91 B12R1.308 CCC[C@H](N)C1=NC=CC=C1C N13884 [0,1,0,0,0,0|3,0,0]=4 92 B12R1.308 CCC[C@H](N)C1=NC=CC=C1C N13885 [0,1,0,0,0,0|3,0,0]=4 93 B12R1.308 N[C@@H](CCO)C1=C(Br)C=CC=C1 N13027 [0,1,0,0,0,0|2,1,0]=4 94 B12R1.308 N[C@@H](CCO)C1=C(Cl)C=CC=C1 58181 [0,1,0,0,0,0|2,0,0]=3 95 B12R1.308 N[C@@H](CCO)C1=C(F)C=CC=C1 N10902 [0,1,0,0,0,0|2,1,0]=4 96 B12R1.371 CC1=C(C[C@H](N)CO)C=CC=C1 C78603 [0,1,0,0,0,0|3,0,0]=4 97 B12R1.371 CC1=C(C[C@H](N)CO)C=CC=C1 N11149 [0,1,0,0,0,0|3,0,0]=4 98 B12R1.371 CCC(=O)CC1=C(Br)C=CC=C1 N12602 [0,1,0,0,0,0|1,1,1]=4 99 B12R1.371 CCC(=O)CC1=C(C)C=CC=C1 N14163 [0,1,0,0,0,0|2,0,1]=4 100 B12R1.371 CCC(=O)CC1=C(Cl)C=CC=C1 N14147 [0,1,0,0,0,0|1,0,1]=3 101 B12R1.371 CC[C@H](N)CC1=C(Br)C=CC=C1 N14510 [0,1,0,0,0,0|1,1,0]=3 102 B12R1.371 CC[C@H](N)CC1=C(C)C=CC=C1 N14512 [0,1,0,0,0,0|2,0,0]=3 103 B12R1.371 CC[C@H](N)CC1=C(Cl)C=CC=C1 N14502 [0,1,0,0,0,0|1,0,0]=2 104 B12R1.371 CC[C@H](N)CC1=C(F)C=CC=C1 N14507 [0,1,0,0,0,0|1,1,0]=3 105 B12R1.371 NC[C@@H](N)CC1=C(F)C=CC=C1 N14640 [0,1,0,0,0,0|2,1,0]=4 106 B12R1.371 N[C@H](CO)CC1=C(Br)C=CC=C1 C77829 [0,1,0,0,0,0|2,1,0]=4 107 B12R1.371 N[C@H](CO)CC1=C(Cl)C=CC=C1 N11299 [0,1,0,0,0,0|2,0,0]=3 108 B12R1.371 N[C@H](CO)CC1=C(Cl)C=CC=C1 N11304 [0,1,0,0,0,0|2,0,0]=3 109 B12R1.371 N[C@H](CO)CC1=C(F)C=CC=C1 N11418 [0,1,0,0,0,0|2,1,0]=4 110 B12R1.374 CCOCC1=C(Br)C=CC(F)=C1 N10175 [0,1,0,0,0,0|2,1,0]=4 111 B12R1.374 CCOCC1=C(F)C=CC(Br)=C1 N10200 [0,1,0,0,0,0|2,1,0]=4 112 B12R1.374 FC1=CC(CCCBr)=C(F)C=C1 C77741 [0,1,0,0,0,0|2,1,0]=4 113 B12R1.374 OCCCC1=C(F)C=CC(F)=C1 C78523 [0,1,0,0,0,0|2,1,0]=4 114 B12R1.1631 N#CCCC1=C(Cl)C=CC=C1Cl S10123 [0,1,0,0,0,0|2,0,0]=3 115 B12R2.24 Br[C@H]1CCC2=C(C=CC=C2)C1 F13406 [0,0,0,1,0,0|3,0,0]=4 116 B12R2.24 CC1=CC2=C(C=CC=C2)CN1 F12577 [0,0,0,1,0,0|3,0,0]=4 117 B12R2.24 C[C@@H]1CNC2=C(C=CC=C2)C1 F50994 [0,0,0,1,0,0|3,0,0]=4 118 B12R2.24 C[C@H]1CC2=C(C=CC=C2)CN1 12711 [0,0,0,1,0,0|3,0,0]=4 119 B12R2.24 C[C@H]1CC2=C(C=CC=C2)CN1 C74526 [0,0,0,1,0,0|3,0,0]=4 120 B12R2.24 C[C@H]1CSC2=C(C=CC=C2)N1 W10084 [0,0,0,1,0,0|3,0,0]=4 121 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 F13193 [0,0,0,1,0,0|3,0,0]=4 122 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 F18883 [0,0,0,1,0,0|3,0,0]=4 123 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 F18889 [0,0,0,1,0,0|3,0,0]=4 124 B12R2.32 CNC1CC2=C(C=CC=C2)C1 D86972 [0,0,0,1,0,0|1,0,0]=2 125 B12R2.41 C1=CC2=C(C=C1)NCCNC2 66604 [0,0,0,1,0,0|3,0,0]=4 126 B12R2.41 C1=CC2=C(C=C1)NCCOC2 98337 [0,0,0,1,0,0|3,0,0]=4 127 B12R2.41 C1=CC2=C(C=C1)OCCCN2 VT1384 [0,0,0,1,0,0|3,0,0]=4 128 B12R2.41 C1=CC2=C(C=C1)OCCNC2 C80018 [0,0,0,1,0,0|3,0,0]=4 129 B12R2.41 C1=CC2=C(C=N1)NCCCC2 D87077 [0,0,0,1,0,0|3,0,0]=4 130 B12R2.41 C1=CN=C2CCCCCC2=C1 F53451 [0,0,0,1,0,0|3,0,0]=4 131 B12R2.196 CC1=CC=CC2=C1CC[C@@H]2N N10987 [0,0,0,1,0,0|3,0,0]=4 132 B12R2.196 CC1=CC=CC2=C1CC[C@@H]2N N10988 [0,0,0,1,0,0|3,0,0]=4 133 B12R2.196 CC1=CC=CC2=C1CC[C@@H]2N N10989 [0,0,0,1,0,0|3,0,0]=4 134 B12R2.196 CC1=CC=CC2=C1CC[C@@H]2N N12838 [0,0,0,1,0,0|3,0,0]=4 135 B12R2.196 CN1CCC2=C(Br)C=CN=C21 F12668 [0,0,0,1,0,0|1,1,0]=3 136 B12R2.196 CN1CCC2=C1C=CC=C2N AC8036 [0,0,0,1,0,0|1,0,0]=2 137 B12R2.196 N[C@H]1CCC2=C(Cl)C=CC=C21 Y11667 [0,0,0,1,0,0|2,0,0]=3 138 B12R2.196 N[C@H]1CCC2=C(F)C=CC=C21 F16929 [0,0,0,1,0,0|2,1,0]=4 139 B12R2.196 N[C@H]1CCC2=C(F)C=CC=C21 N10489 [0,0,0,1,0,0|2,1,0]=4 140 B12R2.196 N[C@H]1COC2=C(Cl)C=CC=C21 59816 [0,0,0,1,0,0|3,0,0]=4 141 B12R2.196 N[C@H]1COC2=C(Cl)C=CC=C21 F16958 [0,0,0,1,0,0|3,0,0]=4 142 B12R2.225 BrC1=C(NC2CC2)C=CC=C1 AT17125 [0,0,0,1,0,0|2,1,0]=4 143 B12R2.225 BrC1=C(SC2CC2)C=CC=C1 AT20841 [0,0,0,1,0,0|2,1,0]=4 144 B12R2.225 FC1=C(OC2CC2)C=CC=C1 AT21296 [0,0,0,1,0,0|2,1,0]=4 145 B12R2.225 IC1=C(OC2CC2)C=CC=C1 F53780 [0,0,0,1,0,0|2,1,0]=4 146 B12R2.517 BrC1=C(C2CNC2)C=CC=C1 85614 [0,0,0,1,0,0|0,1,0]=2 147 B12R2.517 ClC1=NC=CN=C1C2CNC2 83847 [0,0,0,1,0,0|2,0,0]=3 148 B12R2.517 FC1=C(C2CNC2)C=CC=C1 85610 [0,0,0,1,0,0|0,1,0]=2 149 B12R2.1081 CC1=CC=CC2=C1CCOC2 N14603 [0,0,0,1,0,0|2,0,0]=3 150 B12R2.1081 ClC1=C2CCCNC2=CC=C1 N14207 [0,0,0,1,0,0|2,0,0]=3 151 B12R2.1081 ClC1=C2CCNCC2=CC=C1 24212 [0,0,0,1,0,0|0,0,0]=1 152 B12R2.1081 ClC1=C2CCOCC2=CC=C1 N14602 [0,0,0,1,0,0|1,0,0]=2 153 B12R2.1081 ClC1=C2NCCSC2=CC=C1 72679 [0,0,0,1,0,0|3,0,0]=4 154 B12R2.1081 ClC1=C2SCCNC2=CC=C1 72678 [0,0,0,1,0,0|3,0,0]=4 155 B12R2.1081 ClC1=NC=CC2=C1CCNC2 F53692 [0,0,0,1,0,0|1,0,0]=2 156 B12R2.1081 ClC1=NC=NC2=C1CCCC2 N12394 [0,0,0,1,0,0|3,0,0]=4 157 B12R2.1081 ClC1=NC=NC2=C1CCNC2 70943 [0,0,0,1,0,0|2,0,0]=3 158 B12R2.1081 ClC1=NC=NC2=C1CCNC2 AC5242 [0,0,0,1,0,0|2,0,0]=3 159 B12R2.1081 FC1=C2CCOCC2=CC=C1 N14601 [0,0,0,1,0,0|1,1,0]=3 160 B12R2.1081 NC1=C2CCCCC2=CN=C1 F13768 [0,0,0,1,0,0|3,0,0]=4 161 B12R2.1081 NC1=C2CNCCC2=CC=C1 C10171 [0,0,0,1,0,0|3,0,0]=4 162 B12R2.1081 O=C1NC=NC2=C1CCNC2 F21479 [0,0,0,1,0,0|3,0,0]=4 163 B12R2.1081 O=C1NN=CC2=C1CCNC2 84330 [0,0,0,1,0,0|3,0,0]=4 164 B12R2.1081 OC1=C2CCNCC2=CC=C1 20736 [0,0,0,1,0,0|1,0,0]=2 165 B12R2.1081 OC1=C2CNCCC2=CC=C1 AT24057 [0,0,0,1,0,0|3,0,0]=4 166 B12R2.1081 OC1=C2CNCCC2=CC=C1 C15586 [0,0,0,1,0,0|3,0,0]=4 167 B12R2.1081 OC1=C2OCCCC2=CC=C1 76490 [0,0,0,1,0,0|3,0,0]=4 168 B10R1.29 CNCCN1C=CN=C1C D75971 [0,0,0,0,1,0|3,0,0]=4 169 B9R1.8 BrCCC1=CN=CC=C1 C77647 [2,0,0,0,0,0|2,0,0]=4 170 B9R1.8 CCCC1=CC=CN=C1 O11051 [2,0,0,0,0,0|1,0,0]=3 171 B9R1.8 CCC[N+]1=CC=CC=C1 T72121 [2,0,0,0,0,0|1,0,0]=3 172 B9R1.8 CNCC1=CN=CN=C1 38577 [2,0,0,0,0,0|2,0,0]=4 173 B9R1.8 CNCC1=NC=CC=N1 27199 [2,0,0,0,0,0|2,0,0]=4 174 B9R1.8 CNCC1=NC=CC=N1 72796 [2,0,0,0,0,0|2,0,0]=4 175 B9R1.8 CNCC1=NC=NC=C1 C14477 [2,0,0,0,0,0|2,0,0]=4 176 B9R1.8 CNNC1=CC=CC=C1 C77159 [2,0,0,0,0,0|1,0,0]=3 177 B9R1.8 FCCC1=CC=CC=C1 75534 [2,0,0,0,0,0|1,0,0]=3 178 B9R1.8 NCCC1=CC=CC=C1 T71816 [2,0,0,0,0,0|0,0,0]=2 179 B9R1.8 NCCC1=CC=CC=C1 T72591 [2,0,0,0,0,0|0,0,0]=2 180 B9R1.8 NCCC1=NC=CC=N1 83201 [2,0,0,0,0,0|2,0,0]=4 181 B9R1.8 NCCC1=NC=CC=N1 P10852 [2,0,0,0,0,0|2,0,0]=4 182 B9R1.8 NCCC1=NC=CN=C1 AT22557 [2,0,0,0,0,0|2,0,0]=4 183 B9R1.8 NCCC1=NC=NC=C1 P10950 [2,0,0,0,0,0|2,0,0]=4 184 B9R1.8 NNCC1=NC=CC=C1 P10521 [2,0,0,0,0,0|2,0,0]=4 185 B9R1.8 OCCC1=CC=NC=C1 T72404 [2,0,0,0,0,0|2,0,0]=4 186 B9R1.8 SCCC1=NC=CC=C1 F18309 [2,0,0,0,0,0|2,0,0]=4 187 B9R1.15 CCC1=C(Br)C=CN=C1 H11182 [2,0,0,0,0,0|1,1,0]=4 188 B9R1.15 CCC1=CC=CN=C1C 75814 [2,0,0,0,0,0|2,0,0]=4 189 B9R1.15 ClC1=CC=CN=C1CBr 79180 [2,0,0,0,0,0|2,0,0]=4 190 B9R1.15 ClC1=CC=CN=C1CBr 86640 [2,0,0,0,0,0|2,0,0]=4 191 B9R1.15 NCC1=C(Br)C=NC=C1 98160 [2,0,0,0,0,0|1,1,0]=4 192 B9R1.15 NCC1=C(Cl)C=CN=C1 C11073 [2,0,0,0,0,0|1,0,0]=3 193 B9R1.15 NCC1=C(F)C=CN=C1 C90218 [2,0,0,0,0,0|1,1,0]=4 194 B9R1.15 NCC1=C(I)C=CC=C1 AT26620 [2,0,0,0,0,0|0,1,0]=3 195 B9R1.15 NCC1=C(O)C=CC=N1 C73700 [2,0,0,0,0,0|2,0,0]=4 196 B9R1.15 NCC1=C(O)C=CN=C1 AT18117 [2,0,0,0,0,0|2,0,0]=4 197 B9R1.15 NCC1=CC=CN=C1Cl 37571 [2,0,0,0,0,0|1,0,0]=3 198 B9R1.15 NCC1=CC=CN=C1N CL0345 [2,0,0,0,0,0|2,0,0]=4 199 B9R1.15 NCC1=[N+]([O-])C=CC=C1 D86206 [2,0,0,0,0,0|2,0,0]=4 200 B9R1.15 NNC1=CC=CN=C1Cl D76828 [2,0,0,0,0,0|2,0,0]=4 201 B9R1.15 [2H]CC1=C(F)C=CC=C1 D99779 [2,0,0,0,0,0|1,1,0]=4 202 B9R1.15 [C-]#[N+]C1=C(Cl)C=CC=C1 AC9402 [2,0,0,0,0,0|0,0,2]=4 203 B11R1.13 CC#CC1=CC=CC(Br)=C1Cl 94168 [1,1,0,0,0,0|0,0,2]=4 204 B11R1.13 CCOC1=C(C)C(N)=CC=C1 F18648 [1,1,0,0,0,0|2,0,0]=4 205 B11R1.13 ClC1=CC=CC(CCBr)=C1Cl C78633 [1,1,0,0,0,0|1,0,0]=3 206 B11R1.13 N#CCC1=CC=CC(Br)=C1Cl D96283 [1,1,0,0,0,0|0,0,2]=4 207 B11R1.13 N#CCC1=CC=CC(F)=C1Cl 94661 [1,1,0,0,0,0|0,0,2]=4 208 B11R1.41 CCC1=C(CCO)C=CC=C1 C15362 [1,1,0,0,0,0|2,0,0]=4 209 B11R1.41 CCSC1=C(C#N)C=CC=C1 AT20895 [1,1,0,0,0,0|2,0,0]=4 210 B11R1.41 COC1=C(CNN)C=CC=C1 P10476 [1,1,0,0,0,0|2,0,0]=4 211 B11R1.81 CCCC1=C(O)C=C(C)C=C1 A10895 [1,1,0,0,0,0|1,0,0]=3 212 B11R1.81 CCNC1=C(N)C=C(Br)C=C1 89427 [1,1,0,0,0,0|2,0,0]=4 213 B11R1.81 CCOC1=C(Br)C=C(N)C=C1 N12647 [1,1,0,0,0,0|1,1,0]=4 214 B11R1.81 CCOC1=C(C)C=C(N)C=C1 N12561 [1,1,0,0,0,0|2,0,0]=4 215 B11R1.81 CNCC1=C(Cl)C=C(F)C=C1 76695 [1,1,0,0,0,0|0,0,0]=2 216 B11R1.81 CNCC1=C(F)C=C(F)C=C1 36787 [1,1,0,0,0,0|0,1,0]=3 217 B11R1.81 COCC1=C(Cl)C=C(Br)C=C1 N11614 [1,1,0,0,0,0|1,0,0]=3 218 B11R1.81 NCCC1=C(Br)C=C(Br)C=C1 P18612 [1,1,0,0,0,0|0,1,0]=3 219 B11R1.81 NCCC1=C(Br)C=C(Cl)C=C1 AC3186 [1,1,0,0,0,0|0,1,0]=3 220 B11R1.81 NCCC1=C(Br)C=C(F)C=C1 AC7044 [1,1,0,0,0,0|0,1,0]=3 221 B11R1.81 NCCC1=C(F)C=C(Br)C=C1 50240 [1,1,0,0,0,0|0,1,0]=3 222 B11R1.81 NCCC1=C(F)C=C(O)C=C1 F51014 [1,1,0,0,0,0|0,1,0]=3 223 B11R1.81 NNCC1=C(Br)C=C(F)C=C1 AC5368 [1,1,0,0,0,0|1,1,0]=4 224 B11R1.81 NNCC1=C(Cl)C=C(Cl)C=C1 AC4339 [1,1,0,0,0,0|1,0,0]=3 225 B11R1.81 NNCC1=C(Cl)C=C(Cl)C=C1 P10432 [1,1,0,0,0,0|1,0,0]=3 226 B11R1.81 NNCC1=C(Cl)C=C(F)C=C1 A12240 [1,1,0,0,0,0|1,0,0]=3 227 B11R1.81 NNCC1=C(Cl)C=C(F)C=C1 P10526 [1,1,0,0,0,0|1,0,0]=3 228 B11R1.81 NNCC1=C(F)C=C(Br)C=C1 AC5349 [1,1,0,0,0,0|1,1,0]=4 229 B11R1.81 NNCC1=C(F)C=C(F)C=C1 AC5364 [1,1,0,0,0,0|1,1,0]=4 230 B11R1.81 O=CCC1=C(Cl)C=C(Cl)C=C1 C15524 [1,1,0,0,0,0|1,0,1]=4 231 B11R1.81 OCCC1=C(Br)C=C(Cl)C=C1 D85895 [1,1,0,0,0,0|1,1,0]=4 232 B11R1.81 OCCC1=C(F)C=C(F)C=C1 A50720 [1,1,0,0,0,0|1,1,0]=4 233 B11R1.86 CC(C)NC1=C(Br)C=CC=C1 C77931 [1,1,0,0,0,0|1,1,0]=4 234 B11R1.86 CC(C)NC1=C(Cl)C=CC=C1 C78464 [1,1,0,0,0,0|1,0,0]=3 235 B11R1.86 CC(C)NC1=C(F)C=CC=C1 C77765 [1,1,0,0,0,0|1,1,0]=4 236 B11R1.86 CC(C)NC1=C(S)C=CC=C1 AC8476 [1,1,0,0,0,0|2,0,0]=4 237 B11R1.86 CC1=C(C[C@H](C)N)C=CC=C1 N10867 [1,1,0,0,0,0|1,0,0]=3 238 B11R1.86 C[C@H](N)CC1=C(Br)C=CC=C1 N11144 [1,1,0,0,0,0|0,1,0]=3 239 B11R1.86 C[C@H](N)CC1=C(Cl)C=CC=C1 N11063 [1,1,0,0,0,0|0,0,0]=2 240 B11R1.86 C[C@H](O)CC1=C(Br)C=NC=C1 AT12941 [1,1,0,0,0,0|1,1,0]=4 241 B11R1.86 FC(F)OC1=C(Cl)C=CC=C1 F19093 [1,1,0,0,0,0|2,0,0]=4 242 B11R1.182 CC1=C(CCN)C=C(Cl)C=C1 AT13431 [1,1,0,0,0,0|1,0,0]=3 243 B11R1.182 CCCC1=C(Br)C=CC(O)=C1 57995 [1,1,0,0,0,0|0,1,0]=3 244 B11R1.182 CCCN1C=C(N)C=CC1=O AT19282 [1,1,0,0,0,0|2,0,0]=4 245 B11R1.182 CCOC1=C(F)C=CC(Br)=C1 H11056 [1,1,0,0,0,0|1,1,0]=4 246 B11R1.182 CNCC1=C(Cl)C=CC(Cl)=C1 76693 [1,1,0,0,0,0|0,0,0]=2 247 B11R1.182 CNCC1=C(F)C=CC(Br)=C1 36267 [1,1,0,0,0,0|0,1,0]=3 248 B11R1.182 COCC1=C(Br)C=CC(F)=C1 N11817 [1,1,0,0,0,0|1,1,0]=4 249 B11R1.182 COCC1=CC(Cl)=CN=C1Cl 55140 [1,1,0,0,0,0|2,0,0]=4 250 B11R1.182 ClC1=CC(CCBr)=C(Cl)C=C1 C78205 [1,1,0,0,0,0|1,0,0]=3 251 B11R1.182 NCCC1=C(Br)C=CC(Cl)=C1 AT11063 [1,1,0,0,0,0|0,1,0]=3 252 B11R1.182 NCCC1=C(F)C=CC(Br)=C1 N12525 [1,1,0,0,0,0|0,1,0]=3 253 B11R1.182 NCCC1=C(F)C=CC(F)=C1 AT21560 [1,1,0,0,0,0|0,1,0]=3 254 B11R1.182 NCCN1C=C(Br)C=CC1=O AT19269 [1,1,0,0,0,0|2,0,0]=4 255 B11R1.182 NNCC1=C(Br)C=CC(Cl)=C1 AC5350 [1,1,0,0,0,0|1,1,0]=4 256 B11R1.182 NNCC1=C(Cl)C=CC(F)=C1 AC5377 [1,1,0,0,0,0|1,0,0]=3 257 B11R1.182 NNCC1=C(F)C=CC(Br)=C1 AC5379 [1,1,0,0,0,0|1,1,0]=4 258 B11R1.222 C#C[C@@H](O)C1=C(Cl)C=CC=C1 AC5063 [1,1,0,0,0,0|0,0,2]=4 259 B11R1.222 C=C[C@H](N)C1=C(Cl)C=CC=C1 N15239 [1,1,0,0,0,0|0,0,2]=4 260 B11R1.222 C=C[C@H](N)C1=C(Cl)C=CC=C1 N15240 [1,1,0,0,0,0|0,0,2]=4 261 B11R1.222 C=C[C@H](N)C1=C(Cl)C=CC=C1 N15241 [1,1,0,0,0,0|0,0,2]=4 262 B11R1.222 CC1=C([C@@H](N)CF)C=CC=C1 N14610 [1,1,0,0,0,0|2,0,0]=4 263 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13426 [1,1,0,0,0,0|1,0,0]=3 264 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13427 [1,1,0,0,0,0|1,0,0]=3 265 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13428 [1,1,0,0,0,0|1,0,0]=3 266 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13449 [1,1,0,0,0,0|1,0,0]=3 267 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13450 [1,1,0,0,0,0|1,0,0]=3 268 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13451 [1,1,0,0,0,0|1,0,0]=3 269 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 N15069 [1,1,0,0,0,0|2,0,0]=4 270 B11R1.222 CC1=CC=CN=C1[C@@H](N)CN N14901 [1,1,0,0,0,0|2,0,0]=4 271 B11R1.222 CCC(=O)C1=C(Br)C=CC=C1 72058 [1,1,0,0,0,0|0,1,1]=4 272 B11R1.222 CCC(=O)C1=C(Cl)C=CN=C1 N14267 [1,1,0,0,0,0|1,0,1]=4 273 B11R1.222 CCC(=O)C1=CC=CN=C1Cl N14262 [1,1,0,0,0,0|1,0,1]=4 274 B11R1.222 CC[C@H](C)C1=C(N)C=CC=C1 35361 [1,1,0,0,0,0|1,0,0]=3 275 B11R1.222 CC[C@H](N)C1=C(Br)C=CC=C1 N13015 [1,1,0,0,0,0|0,1,0]=3 276 B11R1.222 CC[C@H](N)C1=C(Cl)C=NC=C1 N14403 [1,1,0,0,0,0|1,0,0]=3 277 B11R1.222 CC[C@H](N)C1=NC=CC=C1C N13856 [1,1,0,0,0,0|2,0,0]=4 278 B11R1.222 CC[C@H](N)C1=NC=CC=C1C N13857 [1,1,0,0,0,0|2,0,0]=4 279 B11R1.222 CC[C@H](N)C1=NC=CC=C1C N13858 [1,1,0,0,0,0|2,0,0]=4 280 B11R1.222 CC[C@H](N)C1=NC=CC=C1C N13859 [1,1,0,0,0,0|2,0,0]=4 281 B11R1.222 CC[C@H](O)C1=C(Br)C=CC=C1 N12628 [1,1,0,0,0,0|0,1,0]=3 282 B11R1.222 CC[C@H](O)C1=C(C)C=CC=C1 N14414 [1,1,0,0,0,0|1,0,0]=3 283 B11R1.222 CC[C@H](O)C1=C(Cl)C=CC=C1 N14413 [1,1,0,0,0,0|0,0,0]=2 284 B11R1.222 CNC(=O)C1=C(I)C=CC=C1 E72599 [1,1,0,0,0,0|0,1,1]=4 285 B11R1.222 CN[C@@H](C)C1=C(Br)C=CC=C1 N12718 [1,1,0,0,0,0|0,1,0]=3 286 B11R1.222 CN[C@@H](C)C1=C(C)C=CC=C1 N12531 [1,1,0,0,0,0|1,0,0]=3 287 B11R1.222 CN[C@@H](C)C1=C(O)C=CC=C1 N12719 [1,1,0,0,0,0|1,0,0]=3 288 B11R1.222 NCC(=O)C1=C(Br)C=CC=C1 W17616 [1,1,0,0,0,0|0,1,1]=4 289 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13418 [1,1,0,0,0,0|0,1,0]=3 290 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13419 [1,1,0,0,0,0|0,1,0]=3 291 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13441 [1,1,0,0,0,0|0,1,0]=3 292 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13442 [1,1,0,0,0,0|0,1,0]=3 293 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13403 [1,1,0,0,0,0|0,0,0]=2 294 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13409 [1,1,0,0,0,0|0,0,0]=2 295 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13410 [1,1,0,0,0,0|0,0,0]=2 296 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13390 [1,1,0,0,0,0|0,1,0]=3 297 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13391 [1,1,0,0,0,0|0,1,0]=3 298 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13392 [1,1,0,0,0,0|0,1,0]=3 299 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13393 [1,1,0,0,0,0|0,1,0]=3 300 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13394 [1,1,0,0,0,0|0,1,0]=3 301 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13395 [1,1,0,0,0,0|0,1,0]=3 302 B11R1.222 NC[C@H](O)C1=C(Br)C=CC=C1 71742 [1,1,0,0,0,0|0,1,0]=3 303 B11R1.222 NC[C@H](O)C1=C(F)C=CC=C1 C78140 [1,1,0,0,0,0|0,1,0]=3 304 B11R1.222 NC[C@H](O)C1=C(I)C=CC=C1 O10641 [1,1,0,0,0,0|0,1,0]=3 305 B11R1.222 N[C@@H](CF)C1=C(F)C=CC=C1 N14609 [1,1,0,0,0,0|1,1,0]=4 306 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 C77783 [1,1,0,0,0,0|1,1,0]=4 307 B11R1.222 N[C@@H](CO)C1=C(Cl)C=NC=C1 N14404 [1,1,0,0,0,0|2,0,0]=4 308 B11R1.222 N[C@@H](CO)C1=C(O)C=CC=C1 N15244 [1,1,0,0,0,0|2,0,0]=4 309 B11R1.222 N[C@@H](CO)C1=C(O)C=CC=C1 N15255 [1,1,0,0,0,0|2,0,0]=4 310 B11R1.222 O=C(CCl)C1=C(Cl)C=CC=C1 D71120 [1,1,0,0,0,0|1,0,1]=4 311 B11R1.605 CCOC1=C(Br)C=CC=C1C N10239 [1,1,0,0,0,0|1,1,0]=4 312 B11R1.605 CCOC1=C(Cl)C=CC=C1N C77678 [1,1,0,0,0,0|1,0,0]=3 313 B11R1.605 CNCC1=C(F)C=CC=C1F 36785 [1,1,0,0,0,0|0,1,0]=3 314 B11R1.605 ClC1=CC=CC(Cl)=C1CCBr C78204 [1,1,0,0,0,0|1,0,0]=3 315 B11R1.605 NCCC1=C(F)C=CC=C1F AT21561 [1,1,0,0,0,0|0,1,0]=3 316 B11R1.605 NCCC1=C(F)C=CC=C1O F50611 [1,1,0,0,0,0|0,1,0]=3 317 B11R1.605 OCCC1=C(F)C=CC=C1F A50722 [1,1,0,0,0,0|1,1,0]=4 318 B11R1.1 CC1=CC=C(CCCN)C=C1 C78299 [1,1,0,0,0,0|2,0,0]=4 319 B11R1.1 CNCCC1=CC=C(Br)C=C1 C78422 [1,1,0,0,0,0|0,0,0]=2 320 B11R1.1 CNCCC1=CC=C(C)C=C1 C78074 [1,1,0,0,0,0|0,0,0]=2 321 B11R1.1 CNCCC1=NC=C(Br)C=N1 AT18381 [1,1,0,0,0,0|2,0,0]=4 322 B11R1.1 COCCC1=CC=C(Br)C=C1 28244 [1,1,0,0,0,0|1,0,0]=3 323 B11R1.1 COCCC1=CC=C(N)C=C1 F11764 [1,1,0,0,0,0|1,0,0]=3 324 B11R1.1 CONCC1=CC=C(Br)C=C1 N11596 [1,1,0,0,0,0|2,0,0]=4 325 B11R1.1 ClC1=CC=C(CCCBr)C=C1 S11935 [1,1,0,0,0,0|2,0,0]=4 326 B11R1.1 N#CCCC1=CC=C(O)C=C1 C15091 [1,1,0,0,0,0|2,0,0]=4 327 B11R1.1 NCCCC1=CC=C(N)C=C1 C78351 [1,1,0,0,0,0|2,0,0]=4 328 B11R1.16 C#CC[C@H](O)C1=CC=CC=C1 W15219 [1,1,0,0,0,0|1,0,1]=4 329 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 N12265 [1,1,0,0,0,0|1,0,0]=3 330 B11R1.16 CNC[C@H](C)C1=CC=CC=C1 C11240 [1,1,0,0,0,0|0,0,0]=2 331 B11R1.16 CNC[C@H](O)C1=CC=CC=C1 C11214 [1,1,0,0,0,0|0,0,0]=2 332 B11R1.16 COC[C@H](N)C1=CC=CC=C1 AC6537 [1,1,0,0,0,0|1,0,0]=3 333 B11R1.16 NCC[C@H](N)C1=CC=CC=C1 N14729 [1,1,0,0,0,0|2,0,0]=4 334 B11R1.16 NCC[C@H](N)C1=CC=CC=C1 N14730 [1,1,0,0,0,0|2,0,0]=4 335 B11R1.16 OCC[C@H](O)C1=CC=CC=C1 C80043 [1,1,0,0,0,0|2,0,0]=4 336 B11R1.24 BrCCCC1=CC=CC(Br)=C1 C77758 [1,1,0,0,0,0|2,0,0]=4 337 B11R1.24 CC1=CC=CC(CCC=O)=C1 C10532 [1,1,0,0,0,0|2,0,0]=4 338 B11R1.24 CCCC[N+]1=CC(C)=CC=C1 C93515 [1,1,0,0,0,0|2,0,0]=4 339 B11R1.24 CCOCC1=CC=CC(Br)=C1 F17773 [1,1,0,0,0,0|2,0,0]=4 340 B11R1.24 CNCCC1=CC=CC(Br)=C1 C78466 [1,1,0,0,0,0|0,0,0]=2 341 B11R1.24 COCCC1=CC(N)=NC=C1 AT18204 [1,1,0,0,0,0|2,0,0]=4 342 B11R1.24 ClC1=CC=CC(CCCBr)=C1 C78574 [1,1,0,0,0,0|2,0,0]=4 343 B11R1.24 N#CCCC1=CC=CC(F)=C1 97618 [1,1,0,0,0,0|2,0,0]=4 344 B11R1.24 NCCCC1=CC=CC(F)=C1 97619 [1,1,0,0,0,0|2,0,0]=4 345 B11R1.24 NCCCC1=CC=CC(N)=C1 C78147 [1,1,0,0,0,0|2,0,0]=4 346 B11R1.24 NCCCC1=CC=CC(O)=C1 C78310 [1,1,0,0,0,0|2,0,0]=4 347 B11R1.24 O=CCCC1=CC(O)=CC=C1 F19734 [1,1,0,0,0,0|2,0,0]=4 348 B11R1.24 [C-]#[N+]CCC1=CC=CC(F)=C1 50335 [1,1,0,0,0,0|0,0,2]=4 349 B11R1.28 CCCCNC1=CC=NC=C1 F21501 [1,1,0,0,0,0|2,0,0]=4 350 B11R1.28 CCNCCC1=CC=CC=C1 AC5622 [1,1,0,0,0,0|0,0,0]=2 351 B11R1.28 NNCCOC1=CC=CC=C1 AC4849 [1,1,0,0,0,0|1,0,0]=3 352 B11R1.28 NOCCOC1=CC=CC=C1 AT21707 [1,1,0,0,0,0|2,0,0]=4 353 B11R1.28 OCCCCC1=CC=NC=C1 31475 [1,1,0,0,0,0|2,0,0]=4 354 B11R1.40 CC[C@H](N)CC1=CC=CC=C1 74053 [1,1,0,0,0,0|1,0,0]=3 355 B11R1.40 CNC(=S)NC1=CC=CC=C1 T72207 [1,1,0,0,0,0|1,0,1]=4 356 B11R1.40 C[C@H](C=O)CC1=CC=CC=C1 F16111 [1,1,0,0,0,0|2,0,0]=4 357 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14383 [1,1,0,0,0,0|2,0,0]=4 358 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14384 [1,1,0,0,0,0|2,0,0]=4 359 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14385 [1,1,0,0,0,0|2,0,0]=4 360 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 C78372 [1,1,0,0,0,0|2,0,0]=4 361 B11R1.91 CC(=O)CCC1=CC=NC=C1 AT24518 [1,1,0,0,0,0|2,0,0]=4 362 B11R1.91 C[C@H](N)COC1=CC=CC=C1 N12753 [1,1,0,0,0,0|2,0,0]=4 363 B11R1.91 C[C@H](N)COC1=CC=CC=C1 N12763 [1,1,0,0,0,0|2,0,0]=4 364 B11R1.91 C[C@H](N)CSC1=CC=CC=C1 AT26670 [1,1,0,0,0,0|2,0,0]=4 365 B13R1.12 CC1=CC=CC([C@@H](N)CC#N)=C1Cl N15054 [0,2,0,0,0,0|2,0,0]=4 366 B13R1.12 CC1=CC=CC([C@@H](N)CC#N)=C1Cl N15055 [0,2,0,0,0,0|2,0,0]=4 367 B13R1.12 CC1=CC=CC([C@@H](N)CC#N)=C1Cl N15056 [0,2,0,0,0,0|2,0,0]=4 368 B13R1.12 CCCC(=O)C1=CC=CC(Cl)=C1Cl N14075 [0,2,0,0,0,0|1,0,1]=4 369 B13R1.12 CCC[C@H](N)C1=C(C)C(C)=CC=C1 N11289 [0,2,0,0,0,0|2,0,0]=4 370 B13R1.12 CCC[C@H](N)C1=CC=CC(F)=C1F N11378 [0,2,0,0,0,0|1,1,0]=4 371 B13R1.12 N#CC[C@H](N)C1=CC=CC(Br)=C1Cl N15051 [0,2,0,0,0,0|2,0,0]=4 372 B13R1.12 N#CC[C@H](N)C1=CC=CC(Br)=C1Cl N15052 [0,2,0,0,0,0|2,0,0]=4 373 B13R1.12 N#CC[C@H](N)C1=CC=CC(Br)=C1Cl N15053 [0,2,0,0,0,0|2,0,0]=4 374 B13R1.12 N#CC[C@H](N)C1=CC=CC(Cl)=C1Cl N15048 [0,2,0,0,0,0|2,0,0]=4 375 B13R1.12 N#CC[C@H](N)C1=CC=CC(Cl)=C1Cl N15049 [0,2,0,0,0,0|2,0,0]=4 376 B13R1.12 N#CC[C@H](N)C1=CC=CC(Cl)=C1Cl N15050 [0,2,0,0,0,0|2,0,0]=4 377 B13R1.12 N#CC[C@H](N)C1=CC=CC(F)=C1Cl N15000 [0,2,0,0,0,0|2,0,0]=4 378 B13R1.12 N#CC[C@H](N)C1=CC=CC(F)=C1Cl N15001 [0,2,0,0,0,0|2,0,0]=4 379 B13R1.12 N#CC[C@H](N)C1=CC=CC(F)=C1Cl N15002 [0,2,0,0,0,0|2,0,0]=4 380 B13R1.12 N[C@@H](CCO)C1=CC=CC(O)=C1Cl N14748 [0,2,0,0,0,0|2,0,0]=4 381 B13R1.12 N[C@@H](CCO)C1=CC=CC(O)=C1Cl N14749 [0,2,0,0,0,0|2,0,0]=4 382 B13R1.16 N#CCCOC1=C(Cl)C(O)=CC=C1 95999 [0,2,0,0,0,0|2,0,0]=4 383 B13R1.150 O=C(O)CCC1=CC=CC(Br)=C1Cl 95973 [0,2,0,0,0,0|2,0,0]=4 384 B13R1.164 CC(C)NCC1=C(Cl)C=C(Cl)C=C1 N14374 [0,2,0,0,0,0|2,0,0]=4 385 B13R1.164 CC(C)NCC1=C(Cl)C=C(Cl)C=C1 N14375 [0,2,0,0,0,0|2,0,0]=4 386 B13R1.164 CC1=CC(Cl)=C(CCC(=O)O)C=C1 F52923 [0,2,0,0,0,0|2,0,0]=4 387 B13R1.1511 CC1=CC(Cl)=C([C@@H](N)CC#N)C=C1 N15070 [0,2,0,0,0,0|2,0,0]=4 388 B13R1.1511 CC1=CC(Cl)=C([C@@H](N)CC#N)C=C1 N15071 [0,2,0,0,0,0|2,0,0]=4 389 B13R1.1511 CC1=CC(Cl)=C([C@@H](N)CC#N)C=C1 N15072 [0,2,0,0,0,0|2,0,0]=4 390 B13R1.1511 CCC[C@H](N)C1=C(C)C=C(C)C=C1 N11167 [0,2,0,0,0,0|2,0,0]=4 391 B13R1.1511 CCC[C@H](N)C1=C(F)C=C(F)C=C1 N11163 [0,2,0,0,0,0|1,1,0]=4 392 B13R1.1511 N#CC[C@H](N)C1=C(Cl)C=C(Br)C=C1 N15066 [0,2,0,0,0,0|2,0,0]=4 393 B13R1.1511 N#CC[C@H](N)C1=C(Cl)C=C(Br)C=C1 N15067 [0,2,0,0,0,0|2,0,0]=4 394 B13R1.1511 N#CC[C@H](N)C1=C(Cl)C=C(Br)C=C1 N15068 [0,2,0,0,0,0|2,0,0]=4 395 B13R1.1511 N#CC[C@H](N)C1=C(Cl)C=C(Cl)C=C1 N15063 [0,2,0,0,0,0|2,0,0]=4 396 B13R1.1511 N#CC[C@H](N)C1=C(Cl)C=C(Cl)C=C1 N15064 [0,2,0,0,0,0|2,0,0]=4 397 B13R1.1511 N#CC[C@H](N)C1=C(Cl)C=C(Cl)C=C1 N15065 [0,2,0,0,0,0|2,0,0]=4 398 B13R1.2679 CCC(=O)CC1=C(Cl)C=C(Cl)C=C1 N12604 [0,2,0,0,0,0|1,0,1]=4 399 B13R1.2679 CC[C@H](N)CC1=C(F)C=C(F)C=C1 N14564 [0,2,0,0,0,0|1,1,0]=4 400 B13R1.84 CNCCCC1=C(OC)C=CC=C1 C77726 [0,2,0,0,0,0|1,0,0]=3 401 B13R1.91 CC[C@H](N)CC1=C(OC)C=CC=C1 N14517 [0,2,0,0,0,0|2,0,0]=4 402 B13R1.91 CN[C@@H](C)CC1=C(OC)C=CC=C1 N10866 [0,2,0,0,0,0|1,0,0]=3 403 B13R1.464 CCC[C@H](N)C1=C(CO)C=CC=C1 Y13013 [0,2,0,0,0,0|2,0,0]=4 404 B13R1.157 CC(C)(C)NCC1=C(Cl)C=CC=C1 C78238 [0,2,0,0,0,0|2,0,0]=4 405 B13R1.157 CC(C)(O)CCC1=C(O)C=CC=C1 F52496 [0,2,0,0,0,0|2,0,0]=4 406 B13R1.201 CC(C)C[C@H](N)C1=C(Cl)C=CC=C1 N14466 [0,2,0,0,0,0|1,0,0]=3 407 B13R1.201 CC(C)C[C@H](N)C1=C(Cl)C=CC=C1 N14467 [0,2,0,0,0,0|1,0,0]=3 408 B13R1.201 CC(C)C[C@H](N)C1=C(F)C=CC=C1 N14464 [0,2,0,0,0,0|1,1,0]=4 409 B13R1.201 CC1=C([C@@H](N)CC(C)C)C=CC=C1 N14472 [0,2,0,0,0,0|2,0,0]=4 410 B13R1.201 CC1=C([C@@H](N)CC(C)C)C=CC=C1 N14473 [0,2,0,0,0,0|2,0,0]=4 411 B13R1.201 CC1=C([C@@H](N)CC(C)C)C=CC=C1 N14474 [0,2,0,0,0,0|2,0,0]=4 412 B13R1.201 N[C@@H](CC(=O)O)C1=C(Cl)C=CC=C1 N13091 [0,2,0,0,0,0|2,0,0]=4 413 B13R1.202 CC(C)[C@@H](N)CC1=C(Br)C=CC=C1 N14509 [0,2,0,0,0,0|1,1,0]=4 414 B13R1.202 CC(C)[C@@H](N)CC1=C(Cl)C=CC=C1 N14498 [0,2,0,0,0,0|1,0,0]=3 415 B13R1.202 CC(C)[C@@H](N)CC1=C(F)C=CC=C1 N14504 [0,2,0,0,0,0|1,1,0]=4 416 B13R1.202 CC1=C(C[C@H](N)C(C)C)C=CC=C1 N14515 [0,2,0,0,0,0|2,0,0]=4 417 B13R1.528 CNC(=O)CCC1=C(Br)C=CC=C1 W10434 [0,2,0,0,0,0|0,1,0]=3 418 B13R1.528 CNC(=O)COC1=C(Br)C=CC=C1 F13304 [0,2,0,0,0,0|0,1,1]=4 419 B13R1.158 O=C(O)CNCC1=C(Cl)C=CC=C1 W15239 [0,2,0,0,0,0|2,0,0]=4 420 B13R1.470 CCCC(=O)CC1=C(Br)C=CC=C1 N14157 [0,2,0,0,0,0|1,1,0]=4 421 B13R1.470 CCCC(=O)CC1=C(C)C=CC=C1 N14164 [0,2,0,0,0,0|2,0,0]=4 422 B13R1.470 CCCC(=O)CC1=C(Cl)C=CC=C1 N14148 [0,2,0,0,0,0|1,0,0]=3 423 B13R1.470 CCCC(=O)CC1=C(F)C=CC=C1 N14135 [0,2,0,0,0,0|1,1,0]=4 424 B13R1.470 CCC[C@H](N)CC1=C(Br)C=CC=C1 N14511 [0,2,0,0,0,0|1,1,0]=4 425 B13R1.470 CCC[C@H](N)CC1=C(C)C=CC=C1 N14513 [0,2,0,0,0,0|2,0,0]=4 426 B13R1.470 CCC[C@H](N)CC1=C(Cl)C=CC=C1 N14501 [0,2,0,0,0,0|1,0,0]=3 427 B13R1.470 CCC[C@H](N)CC1=C(F)C=CC=C1 N14506 [0,2,0,0,0,0|1,1,0]=4 428 B13R1.555 BrCCCCOC1=C(Br)C=CC=C1 F50545 [0,2,0,0,0,0|1,1,0]=4 429 B13R1.555 CCCCC#CC1=C(N)C=CC=C1 F21403 [0,2,0,0,0,0|2,0,0]=4 430 B13R1.555 CCCCNCC1=C(Br)C=CC=C1 C78340 [0,2,0,0,0,0|1,1,0]=4 431 B13R1.555 CCCCNCC1=C(C)C=CC=C1 C78343 [0,2,0,0,0,0|2,0,0]=4 432 B13R1.555 CCCCNCC1=C(Cl)C=CC=C1 C77946 [0,2,0,0,0,0|1,0,0]=3 433 B13R1.555 CCCCNCC1=C(F)C=CC=C1 C78337 [0,2,0,0,0,0|1,1,0]=4 434 B13R1.674 CCCCC(=O)C1=C(C)C=CC=C1 N13967 [0,2,0,0,0,0|2,0,0]=4 435 B13R1.674 CCCCC(=O)C1=C(Cl)C=CC=C1 N13953 [0,2,0,0,0,0|1,0,0]=3 436 B13R1.674 COCC[C@H](N)C1=C(C)C=CC=C1 N13829 [0,2,0,0,0,0|2,0,0]=4 437 B13R1.674 COCC[C@H](N)C1=C(Cl)C=CC=C1 N13826 [0,2,0,0,0,0|1,0,0]=3 438 B13R1.674 COCC[C@H](N)C1=C(F)C=CC=C1 N13795 [0,2,0,0,0,0|1,1,0]=4 439 B13R1.446 CC1=CC([C@@H](N)CC#N)=C(Cl)C=C1 N15082 [0,2,0,0,0,0|2,0,0]=4 440 B13R1.446 CC1=CC([C@@H](N)CC#N)=C(Cl)C=C1 N15083 [0,2,0,0,0,0|2,0,0]=4 441 B13R1.446 CC1=CC([C@@H](N)CC#N)=C(Cl)C=C1 N15084 [0,2,0,0,0,0|2,0,0]=4 442 B13R1.446 CCCC(=O)C1=C(Cl)C=CC(Cl)=C1 N14113 [0,2,0,0,0,0|1,0,1]=4 443 B13R1.446 CCC[C@H](N)C1=C(F)C=CC(F)=C1 N11166 [0,2,0,0,0,0|1,1,0]=4 444 B13R1.446 COC[C@H](N)C1=C(C)C=CC(C)=C1 Y12175 [0,2,0,0,0,0|2,0,0]=4 445 B13R1.446 COC[C@H](N)C1=C(Cl)C=CC(Br)=C1 Y12853 [0,2,0,0,0,0|1,0,0]=3 446 B13R1.446 COC[C@H](N)C1=C(Cl)C=CC(Br)=C1 Y12901 [0,2,0,0,0,0|1,0,0]=3 447 B13R1.446 COC[C@H](N)C1=C(Cl)C=CC(Br)=C1 Y12924 [0,2,0,0,0,0|1,0,0]=3 448 B13R1.446 N#CC[C@H](N)C1=C(Cl)C=CC(Br)=C1 N15079 [0,2,0,0,0,0|2,0,0]=4 449 B13R1.446 N#CC[C@H](N)C1=C(Cl)C=CC(Br)=C1 N15080 [0,2,0,0,0,0|2,0,0]=4 450 B13R1.446 N#CC[C@H](N)C1=C(Cl)C=CC(Br)=C1 N15081 [0,2,0,0,0,0|2,0,0]=4 451 B13R1.446 N#CC[C@H](N)C1=C(Cl)C=CC(Cl)=C1 N15076 [0,2,0,0,0,0|2,0,0]=4 452 B13R1.446 N#CC[C@H](N)C1=C(Cl)C=CC(Cl)=C1 N15077 [0,2,0,0,0,0|2,0,0]=4 453 B13R1.446 N#CC[C@H](N)C1=C(Cl)C=CC(Cl)=C1 N15078 [0,2,0,0,0,0|2,0,0]=4 454 B13R1.446 N[C@@H](CCO)C1=C(Cl)C=CC(F)=C1 Y12238 [0,2,0,0,0,0|2,0,0]=4 455 B13R1.446 N[C@@H](CCO)C1=C(Cl)C=CC(F)=C1 Y12239 [0,2,0,0,0,0|2,0,0]=4 456 B13R1.446 N[C@@H](CCO)C1=C(Cl)C=CC(F)=C1 Y12940 [0,2,0,0,0,0|2,0,0]=4 457 B13R1.2819 C#CC[C@](C)(O)C1=C(Cl)C=CC=C1 AC3857 [0,2,0,0,0,0|1,0,1]=4 458 B13R1.4453 CC1=CC=CC(Cl)=C1[C@@H](N)CC#N N15097 [0,2,0,0,0,0|2,0,0]=4 459 B13R1.4453 CC1=CC=CC(Cl)=C1[C@@H](N)CC#N N15098 [0,2,0,0,0,0|2,0,0]=4 460 B13R1.4453 CC1=CC=CC(Cl)=C1[C@@H](N)CC#N N15099 [0,2,0,0,0,0|2,0,0]=4 461 B13R1.4453 N#CC[C@H](N)C1=C(Br)C=CC=C1Cl N15094 [0,2,0,0,0,0|2,0,0]=4 462 B13R1.4453 N#CC[C@H](N)C1=C(Br)C=CC=C1Cl N15095 [0,2,0,0,0,0|2,0,0]=4 463 B13R1.4453 N#CC[C@H](N)C1=C(Br)C=CC=C1Cl N15096 [0,2,0,0,0,0|2,0,0]=4 464 B13R1.4453 N#CC[C@H](N)C1=C(Cl)C=CC=C1Cl N15091 [0,2,0,0,0,0|2,0,0]=4 465 B13R1.4453 N#CC[C@H](N)C1=C(Cl)C=CC=C1Cl N15092 [0,2,0,0,0,0|2,0,0]=4 466 B13R1.4453 N#CC[C@H](N)C1=C(Cl)C=CC=C1Cl N15093 [0,2,0,0,0,0|2,0,0]=4 467 B13R1.4453 N#CC[C@H](N)C1=C(Cl)C=CC=C1F N14994 [0,2,0,0,0,0|2,0,0]=4 468 B13R1.4453 N#CC[C@H](N)C1=C(Cl)C=CC=C1F N14995 [0,2,0,0,0,0|2,0,0]=4 469 B13R1.4453 N#CC[C@H](N)C1=C(Cl)C=CC=C1F N14996 [0,2,0,0,0,0|2,0,0]=4 470 B13R1.335 COC(CC1=C(N)C=CC=C1)OC H11772 [0,2,0,0,0,0|2,0,0]=4 471 B13R1.2872 COC(=O)CC1=C(Cl)C=CC(N)=C1 C90867 [0,2,0,0,0,0|1,0,1]=4 472 B13R1.4928 CCC(=O)CC1=C(Cl)C=CC=C1Cl N14572 [0,2,0,0,0,0|1,0,1]=4 473 B13R1.4928 CC[C@H](N)CC1=C(Cl)C=CC=C1Cl N14578 [0,2,0,0,0,0|1,0,0]=3 474 B11R2.20 C1=CN=C2CNCCC2=C1 P10652 [1,0,0,1,0,0|2,0,0]=4 475 B11R2.55 BrC1=C(C2CC2)C=CN=C1 AT12865 [1,0,0,1,0,0|1,1,0]=4 476 B11R2.55 CC1=C(C2CC2)C=CC=C1 AC9736 [1,0,0,1,0,0|1,0,0]=3 477 B11R2.55 CC1=CC=CN=C1C2CC2 AC9685 [1,0,0,1,0,0|2,0,0]=4 478 B11R2.55 CC1=NC=CC=C1C2CC2 F13571 [1,0,0,1,0,0|2,0,0]=4 479 B11R2.55 ClC1=C([C@@H]2CO2)C=CC=C1 AT10463 [1,0,0,1,0,0|1,0,0]=3 480 B11R2.55 ClC1=C([C@@H]2CO2)C=CC=C1 CK2535 [1,0,0,1,0,0|1,0,0]=3 481 B11R2.55 NC1=C(C2CC2)C=CC=C1 A10978 [1,0,0,1,0,0|1,0,0]=3 482 B11R2.55 NC1=C(C2CC2)C=CN=C1 AT16333 [1,0,0,1,0,0|2,0,0]=4 483 B11R2.55 OC1=C(C2CC2)C=CC=C1 91444 [1,0,0,1,0,0|1,0,0]=3 484 B11R2.106 BrC1=C2CCCC2=NC=C1 F53407 [1,0,0,1,0,0|1,1,0]=4 485 B11R2.106 BrC1=C2CCOC2=CC=C1 F12556 [1,0,0,1,0,0|1,1,0]=4 486 B11R2.106 BrC1=NC=CC2=C1CNC2 D97047 [1,0,0,1,0,0|1,1,0]=4 487 B11R2.106 CC1=CC=CC2=C1CNC2 W10109 [1,0,0,1,0,0|1,0,0]=3 488 B11R2.106 ClC1=C2CCCC2=CC=C1 N13077 [1,0,0,1,0,0|0,0,0]=2 489 B11R2.106 ClC1=C2CCOC2=NC=C1 97228 [1,0,0,1,0,0|2,0,0]=4 490 B11R2.106 ClC1=C2CNCC2=CC=C1 FD13081 [1,0,0,1,0,0|0,0,0]=2 491 B11R2.106 ClC1=C2CNCC2=NC=C1 S11449 [1,0,0,1,0,0|1,0,0]=3 492 B11R2.106 ClC1=C2OCCC2=CC=C1 F53809 [1,0,0,1,0,0|1,0,0]=3 493 B11R2.106 FC1=C2NCCC2=CC=C1 C73504 [1,0,0,1,0,0|1,1,0]=4 494 B11R2.106 IC1=C2CCOC2=CC=C1 E72245 [1,0,0,1,0,0|1,1,0]=4 495 B11R2.106 O=C1C=CC=C2NCCN12 O10576 [1,0,0,1,0,0|2,0,0]=4 496 B11R2.988 NC[C@H]1CC2=C1C=CC=C2 AT20374 [1,0,0,1,0,0|1,0,0]=3 497 B11R2.988 OC[C@H]1CC2=C1C=CC=C2 67862 [1,0,0,1,0,0|2,0,0]=4 498 B11R2.1 C[C@H]1CNC2=C1C=CC=C2 W18948 [1,0,0,1,0,0|2,0,0]=4 499 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 41003 [1,0,0,1,0,0|2,0,0]=4 500 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 C14923 [1,0,0,1,0,0|2,0,0]=4 501 B11R2.239 C1=CC(C2CNC2)=NC=N1 74669 [1,0,0,1,0,0|2,0,0]=4 502 B11R2.239 C1=CC=C(C2CCC2)C=C1 F52090 [1,0,0,1,0,0|1,0,0]=3 503 B11R2.239 C1=CC=C([C@@H]2CCN2)C=C1 A50749 [1,0,0,1,0,0|2,0,0]=4 504 B11R2.239 C1=CN=C(C2CNC2)C=C1 F31095 [1,0,0,1,0,0|1,0,0]=3 505 B13R2.32 FC1=C(Cl)C=CC2=C1CCNC2 84514 [0,1,0,1,0,0|0,1,0]=3 506 B13R2.32 FC1=C(F)C2=C(C=C1)CNCC2 AT19623 [0,1,0,1,0,0|0,1,0]=3 507 B13R2.32 FC1=C(F)C2=C(C=C1)CNCC2 AT19624 [0,1,0,1,0,0|0,1,0]=3 508 B13R2.32 OC1=CC=C2CCCOC2=C1Cl 90438 [0,1,0,1,0,0|2,0,0]=4 509 B13R2.4820 BrC1=C2NCCCCC2=CC=C1 AT10609 [0,1,0,1,0,0|1,1,0]=4 510 B13R2.4820 BrC1=C2OCCNCC2=CC=C1 AT22675 [0,1,0,1,0,0|0,1,0]=3 511 B13R2.4820 BrC1=C2OCCOCC2=CC=C1 F53184 [0,1,0,1,0,0|1,1,0]=4 512 B13R2.5180 N[C@H]1CCC2=C1C=CC(Cl)=C2Cl N11000 [0,1,0,1,0,0|2,0,0]=4 513 B13R2.5180 N[C@H]1CCC2=C1C=CC(Cl)=C2Cl N12982 [0,1,0,1,0,0|2,0,0]=4 514 B13R2.5180 N[C@H]1CCC2=C1C=CC(Cl)=C2Cl Y11817 [0,1,0,1,0,0|2,0,0]=4 515 B13R2.5180 N[C@H]1CCC2=C1C=CC(F)=C2Cl N11355 [0,1,0,1,0,0|2,0,0]=4 516 B13R2.5180 O[C@H]1CCC2=C1C=CC(Cl)=C2Cl N14442 [0,1,0,1,0,0|2,0,0]=4 517 B13R2.155 C[C@H]1CCC2=C(C=C(Br)C=C2)O1 94713 [0,1,0,1,0,0|2,0,0]=4 518 B13R2.328 CN1CC(=O)C2=C(C=CC=C2)C1 F12572 [0,1,0,1,0,0|1,0,1]=4 519 B13R2.328 CN1CC(=O)C2=C(C=CC=C2)C1 F12579 [0,1,0,1,0,0|1,0,1]=4 520 B13R2.3742 CC1=CC(Cl)=C2CCC(=O)C2=C1 N11141 [0,1,0,1,0,0|2,0,0]=4 521 B13R2.3742 N[C@H]1CCC2=C(Cl)C=C(Cl)C=C21 N11001 [0,1,0,1,0,0|2,0,0]=4 522 B13R2.3742 O[C@H]1CCC2=C(Cl)C=C(Cl)C=C21 N12902 [0,1,0,1,0,0|2,0,0]=4 523 B13R2.1 CNCC1=CNC2=C1C=CC=C2 71407 [0,1,0,1,0,0|1,0,1]=4 524 B13R2.57 CN[C@@H]1CNC2=C(C=CC=C2)C1 C13061 [0,1,0,1,0,0|1,0,0]=3 525 B13R2.57 NC[C@H]1CCC2=C(C=CC=C2)O1 50369 [0,1,0,1,0,0|2,0,0]=4 526 B13R2.57 NN[C@H]1CCC2=C(C=CC=C2)C1 D87945 [0,1,0,1,0,0|2,0,0]=4 527 B13R2.57 OC[C@H]1CCC2=C(C=CC=C2)N1 C75079 [0,1,0,1,0,0|2,0,0]=4 528 B13R2.2528 COC1=C(C2CNC2)C=CC=C1 85602 [0,1,0,1,0,0|1,0,0]=3 529 B13R2.216 O=C1CC(C2=C(Cl)C=CC=C2)C1 AC2850 [0,1,0,1,0,0|1,0,0]=3 530 B13R2.222 CC1(C)CCC2=C(C=CC=C2)N1 AT10904 [0,1,0,1,0,0|2,0,0]=4 531 B13R2.222 CC1(C)CCC2=C(C=CC=C2)N1 C13569 [0,1,0,1,0,0|2,0,0]=4 532 B13R2.222 CC1(C)CCC2=C(C=CC=C2)O1 F30281 [0,1,0,1,0,0|2,0,0]=4 533 B13R2.5179 O=C1CCC2=C(C=CC=C2O)C1 88359 [0,1,0,1,0,0|2,0,0]=4 534 B13R2.18 BrC1=C(N2CCCC2)C=CC=C1 AC7051 [0,1,0,1,0,0|1,1,0]=4 535 B13R2.18 CC1=C([C@H]2CCNC2)C=CC=C1 N10930 [0,1,0,1,0,0|1,0,0]=3 536 B13R2.18 ClC1=C(N2CCCC2)N=CC=C1 N11745 [0,1,0,1,0,0|2,0,0]=4 537 B13R2.18 ClC1=C([C@@H]2CCCN2)C=CC=C1 N12754 [0,1,0,1,0,0|1,0,0]=3 538 B13R2.18 ClC1=C([C@H]2CCNC2)C=CC=C1 83033 [0,1,0,1,0,0|0,0,0]=2 539 B13R2.18 FC1=C([C@H]2CCNC2)C=CC=C1 65751 [0,1,0,1,0,0|0,1,0]=3 540 B13R2.18 FC1=C([C@H]2CCNC2)C=CC=C1 65753 [0,1,0,1,0,0|0,1,0]=3 541 B13R2.18 FC1=C([C@H]2CCNC2)C=CC=C1 65780 [0,1,0,1,0,0|0,1,0]=3 542 B13R2.18 FC1=C([C@H]2CCNC2)C=CC=C1 N10834 [0,1,0,1,0,0|0,1,0]=3 543 B13R2.18 NC1=C(N2CCCC2)C=CC=C1 C78056 [0,1,0,1,0,0|2,0,0]=4 544 B13R2.18 NC1=C([C@H]2CCNC2)C=CC=C1 N14871 [0,1,0,1,0,0|1,0,0]=3 545 B13R2.18 OC1=C([C@@H]2CCCN2)C=CC=C1 I11883 [0,1,0,1,0,0|2,0,0]=4 546 B13R2.342 CN1CCOC2=C1C=CC=C2N AT20464 [0,1,0,1,0,0|1,0,0]=3 547 B13R2.342 N[C@H]1CCCC2=C(Br)C=CC=C21 F16889 [0,1,0,1,0,0|1,1,0]=4 548 B13R2.342 N[C@H]1CCCC2=C(Cl)C=CC=C21 I10729 [0,1,0,1,0,0|1,0,0]=3 549 B13R2.342 N[C@H]1CCCC2=C(O)C=CC=C21 N12814 [0,1,0,1,0,0|2,0,0]=4 550 B13R2.342 N[C@H]1CCOC2=C(Cl)C=CC=C21 N12845 [0,1,0,1,0,0|2,0,0]=4 551 B13R2.342 O=C1CCSC2=C(Cl)C=CC=C12 N12579 [0,1,0,1,0,0|2,0,0]=4 552 B13R2.342 O[C@H]1CCCC2=C(Cl)C=CC=C21 N14445 [0,1,0,1,0,0|1,0,0]=3 553 B13R2.342 O[C@H]1CCCC2=C(F)C=CC=C21 E72763 [0,1,0,1,0,0|1,1,0]=4 554 B13R2.342 O[C@H]1CCOC2=C(Cl)C=CC=C21 N12789 [0,1,0,1,0,0|2,0,0]=4 555 B13R2.3097 N[C@H](C1=C(F)C=CC=C1)C2CC2 Y13769 [0,1,0,1,0,0|1,1,0]=4 556 B13R2.3569 NC1(C2=C(Br)C=CC=C2)CCC1 69043 [0,1,0,1,0,0|1,1,0]=4 557 B13R2.3569 NC1(C2=C(Br)C=CC=C2)CCC1 AC3286 [0,1,0,1,0,0|1,1,0]=4 558 B13R2.3569 NC1(C2=C(F)C=CC=C2)CCC1 28201 [0,1,0,1,0,0|1,1,0]=4 559 B13R2.3569 NC1(C2=C(F)C=CC=C2)CCC1 69069 [0,1,0,1,0,0|1,1,0]=4 560 B13R2.4825 C[C@H]1CC2=C(Cl)C=CC=C2C1=O N13055 [0,1,0,1,0,0|2,0,0]=4 561 B13R2.371 ClC1=C2CNCCC2=C(Br)C=C1 33428 [0,1,0,1,0,0|0,1,0]=3 562 B13R2.3683 CN1CCC2=C(C=CC(Br)=C2)C1 98419 [0,1,0,1,0,0|1,0,0]=3 563 B13R2.3683 C[C@H]1CCC2=C(C=CC(F)=C2)N1 51483 [0,1,0,1,0,0|2,0,0]=4 564 B13R2.3683 C[C@H]1CCC2=C(C=CC(F)=C2)N1 51485 [0,1,0,1,0,0|2,0,0]=4 565 B13R2.5151 CC1=C2C(=O)CCC2=C(Cl)C=C1 F52801 [0,1,0,1,0,0|2,0,0]=4 566 B13R2.5151 O[C@H]1CCC2=C(Cl)C=CC(Cl)=C21 N14443 [0,1,0,1,0,0|2,0,0]=4 567 B9R1.12 CNCCC1=CC=CS1 AT16732 [1,0,0,0,1,0|1,0,0]=3 568 B9R1.12 CNCCC1=CN=CN1 D86292 [1,0,0,0,1,0|2,0,0]=4