0 B9R1.8 BrC#CC1=CN=CC=C1 50128 [0,0,0,0,0,0|2,0,2]=4 1 B9R1.8 BrC#CC1=NC=CC=C1 94426 [0,0,0,0,0,0|2,0,2]=4 2 B9R1.8 BrCCC1=CN=CC=C1 C77647 [0,0,0,0,0,0|2,0,1]=3 3 B9R1.8 C#C[I+]C1=CC=CC=C1 T71678 [0,0,0,0,0,0|2,0,1]=3 4 B9R1.8 CCCC1=CC=CN=C1 O11051 [0,0,0,0,0,0|2,0,1]=3 5 B9R1.8 CCC[N+]1=CC=CC=C1 T72121 [0,0,0,0,0,0|2,0,1]=3 6 B9R1.8 CNCC1=CN=CN=C1 38577 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.8 CNCC1=NC=CC=N1 27199 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.8 CNCC1=NC=CC=N1 72796 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.8 CNCC1=NC=NC=C1 C14477 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.8 CNNC1=CC=CC=C1 C77159 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.8 FCCC1=CC=CC=C1 75534 [0,0,0,0,0,0|1,0,1]=2 12 B9R1.8 IC#CC1=CC=CC=C1 N11813 [0,0,0,0,0,0|1,0,2]=3 13 B9R1.8 NCCC1=CC=CC=C1 T71816 [0,0,0,0,0,0|1,0,1]=2 14 B9R1.8 NCCC1=CC=CC=C1 T72591 [0,0,0,0,0,0|1,0,1]=2 15 B9R1.8 NCCC1=NC=CC=N1 83201 [0,0,0,0,0,0|3,0,1]=4 16 B9R1.8 NCCC1=NC=CC=N1 P10852 [0,0,0,0,0,0|3,0,1]=4 17 B9R1.8 NCCC1=NC=CN=C1 AT22557 [0,0,0,0,0,0|3,0,1]=4 18 B9R1.8 NCCC1=NC=NC=C1 P10950 [0,0,0,0,0,0|3,0,1]=4 19 B9R1.8 NNCC1=NC=CC=C1 P10521 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.8 NNCC1=NC=CN=C1 D78817 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.8 NNCC1=NC=CN=C1 P19174 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.8 OCCC1=CC=NC=C1 T72404 [0,0,0,0,0,0|1,0,2]=3 23 B9R1.8 OCCC1=NN=CC=C1 D77083 [0,0,0,0,0,0|2,0,2]=4 24 B9R1.8 S=C=NC1=NC=CC=C1 C11368 [0,0,0,0,0,0|2,1,1]=4 25 B9R1.8 SCCC1=NC=CC=C1 F18309 [0,0,0,0,0,0|1,1,1]=3 26 B9R1.8 [C-]#[N+]CC1=CC=NC=C1 AC8779 [0,0,0,0,0,0|3,0,0]=3 27 B9R1.8 [C-]#[N+]CC1=CN=CC=C1 F16136 [0,0,0,0,0,0|3,0,0]=3 28 B8R1.2 BrCC1=CN=CN=C1 F52462 [1,0,0,0,0,0|3,0,0]=4 29 B8R1.2 BrCC1=NC=CC=N1 D79434 [1,0,0,0,0,0|3,0,0]=4 30 B8R1.2 C=CC1=CC=CN=C1 71366 [1,0,0,0,0,0|1,0,1]=3 31 B8R1.2 C=CC1=NC=CN=C1 T72447 [1,0,0,0,0,0|2,0,1]=4 32 B8R1.2 ClCC1=NC=NC=C1 A10562 [1,0,0,0,0,0|3,0,0]=4 33 B8R1.2 NCC1=CC=CC=C1 T70846 [1,0,0,0,0,0|1,0,0]=2 34 B8R1.2 SCC1=NC=CN=C1 78318 [1,0,0,0,0,0|2,1,0]=4 35 B8R1.2 [2H]OC1=CC=CC=C1 D99313 [1,0,0,0,0,0|2,0,0]=3 36 B10R1.1 BrC#CC1=CC=C(Br)C=C1 94425 [0,1,0,0,0,0|1,0,2]=4 37 B10R1.1 CC1=CC=C(C#CBr)C=C1 94424 [0,1,0,0,0,0|1,0,2]=4 38 B10R1.1 CC1=CC=C(CNN)C=C1 O10110 [0,1,0,0,0,0|2,0,0]=3 39 B10R1.1 CC1=CC=C(\C=N\O)C=C1 AC8737 [0,1,0,0,0,0|1,0,2]=4 40 B10R1.1 CC1=NC=C(CC#N)C=C1 54748 [0,1,0,0,0,0|2,0,1]=4 41 B10R1.1 CC1=NC=C(CNN)C=C1 F15210 [0,1,0,0,0,0|3,0,0]=4 42 B10R1.1 CC1=NC=C(\C=C\Br)C=C1 F50214 [0,1,0,0,0,0|2,0,1]=4 43 B10R1.1 CNCC1=NC=C(Cl)C=C1 AT26664 [0,1,0,0,0,0|3,0,0]=4 44 B10R1.1 COCC1=CC=C(S)C=C1 AT20980 [0,1,0,0,0,0|2,0,0]=3 45 B10R1.1 CSCC1=CC=C(Cl)C=C1 W18700 [0,1,0,0,0,0|2,0,0]=3 46 B10R1.1 ClC1=CC=C(C#CBr)C=C1 94423 [0,1,0,0,0,0|1,0,2]=4 47 B10R1.1 N#CCC1=NC=C(F)C=C1 O10489 [0,1,0,0,0,0|2,0,1]=4 48 B10R1.1 NC1=CC=C(OCF)C=C1 68782 [0,1,0,0,0,0|2,0,1]=4 49 B10R1.1 NCCC1=CC=C(I)C=C1 C78427 [0,1,0,0,0,0|1,0,1]=3 50 B10R1.1 NCCC1=NC=C(Br)C=C1 P10593 [0,1,0,0,0,0|2,0,1]=4 51 B10R1.1 NNCC1=CC=C(Br)C=C1 AC3503 [0,1,0,0,0,0|2,0,0]=3 52 B10R1.1 NNCC1=CC=C(Cl)C=C1 37006 [0,1,0,0,0,0|2,0,0]=3 53 B10R1.1 N\N=C\C1=CC=C(O)C=C1 F15571 [0,1,0,0,0,0|2,0,1]=4 54 B10R1.1 O=CNC1=CC=C(F)C=C1 F21300 [0,1,0,0,0,0|1,0,0]=2 55 B10R1.1 OCCC1=CN=C(Br)C=C1 AC9473 [0,1,0,0,0,0|1,0,2]=4 56 B10R1.1 OCCC1=CN=C(F)C=C1 AC9525 [0,1,0,0,0,0|1,0,2]=4 57 B10R1.1 [N-]=[N+]=NC1=CC=C(I)C=C1 AC6317 [0,1,0,0,0,0|3,0,0]=4 58 B10R1.4 C#CCN1C=CC=CC1=O AT19221 [0,1,0,0,0,0|2,0,1]=4 59 B10R1.4 CC1=C(CC=O)C=CC=C1 W16821 [0,1,0,0,0,0|0,0,0]=1 60 B10R1.4 CC1=C(CON)C=CC=C1 D77271 [0,1,0,0,0,0|2,0,0]=3 61 B10R1.4 CC1=CC=CN=C1CC#N C90297 [0,1,0,0,0,0|2,0,1]=4 62 B10R1.4 CCCC1=C(C)C=CC=C1 T71577 [0,1,0,0,0,0|1,0,1]=3 63 B10R1.4 CCNC1=C(F)C=CC=C1 D87863 [0,1,0,0,0,0|2,0,1]=4 64 B10R1.4 CCSC1=C(Br)C=CC=C1 AT20838 [0,1,0,0,0,0|2,0,1]=4 65 B10R1.4 CCSC1=C(O)C=CC=C1 AT20889 [0,1,0,0,0,0|2,0,1]=4 66 B10R1.4 CNCC1=C(F)C=CC=N1 P10655 [0,1,0,0,0,0|3,0,0]=4 67 B10R1.4 CNCC1=C(F)C=CC=N1 P20450 [0,1,0,0,0,0|3,0,0]=4 68 B10R1.4 CNCC1=C(N)C=CC=C1 F13330 [0,1,0,0,0,0|2,0,0]=3 69 B10R1.4 N#CCC1=C(Br)C=NC=C1 C72683 [0,1,0,0,0,0|2,0,1]=4 70 B10R1.4 N#CCN1C=CC=CC1=O AT19223 [0,1,0,0,0,0|2,0,1]=4 71 B10R1.4 NC1=C(CCF)C=NC=C1 P14647 [0,1,0,0,0,0|2,0,1]=4 72 B10R1.4 NCCN1C=CC=CC1=O F15207 [0,1,0,0,0,0|2,0,1]=4 73 B10R1.4 NNCC1=C(Cl)C=CC=C1 W12211 [0,1,0,0,0,0|2,0,0]=3 74 B10R1.4 O=C1C=CC=CN1CCBr AT19229 [0,1,0,0,0,0|2,0,1]=4 75 B10R1.4 O=CCC1=C(Cl)C=CC=C1 W16822 [0,1,0,0,0,0|0,0,0]=1 76 B10R1.4 O=CCN1N=CC=CC1=O 57075 [0,1,0,0,0,0|2,0,0]=3 77 B10R1.10 CC1=CC=CC(CC=O)=C1 74805 [0,1,0,0,0,0|0,0,0]=1 78 B10R1.10 CC1=CC=CC(CCBr)=N1 AC6969 [0,1,0,0,0,0|2,0,1]=4 79 B10R1.10 CC1=CC=CC(CCN)=N1 P19093 [0,1,0,0,0,0|2,0,1]=4 80 B10R1.10 CC1=NC=CC(CNN)=C1 F52070 [0,1,0,0,0,0|3,0,0]=4 81 B10R1.10 CC1=NC=CC(CNN)=C1 F52466 [0,1,0,0,0,0|3,0,0]=4 82 B10R1.10 CCCC1=CC=CC(F)=C1 36946 [0,1,0,0,0,0|1,0,1]=3 83 B10R1.10 CCNC1=CC=CC(Cl)=C1 L10102 [0,1,0,0,0,0|2,0,1]=4 84 B10R1.10 CCNC1=CC=CC(O)=C1 F16135 [0,1,0,0,0,0|2,0,1]=4 85 B10R1.10 CCOC1=CC=CC(S)=C1 T73015 [0,1,0,0,0,0|2,0,1]=4 86 B10R1.10 CCSC1=CC(N)=CC=C1 AT20857 [0,1,0,0,0,0|2,0,1]=4 87 B10R1.10 CNCC1=CC(Cl)=NC=C1 AT26616 [0,1,0,0,0,0|3,0,0]=4 88 B10R1.10 CNCC1=NC(C)=CC=C1 D87644 [0,1,0,0,0,0|3,0,0]=4 89 B10R1.10 CNCC1=NC=CC(Cl)=C1 CS1254 [0,1,0,0,0,0|3,0,0]=4 90 B10R1.10 COCC1=CC(N)=CC=C1 30379 [0,1,0,0,0,0|2,0,0]=3 91 B10R1.10 CSCC1=CC(N)=CC=C1 AT15211 [0,1,0,0,0,0|2,0,0]=3 92 B10R1.10 ClC1=CC=CC(C#CBr)=C1 55375 [0,1,0,0,0,0|1,0,2]=4 93 B10R1.10 N#CCC1=CC(Cl)=CN=C1 93159 [0,1,0,0,0,0|2,0,1]=4 94 B10R1.10 N#CCC1=CC(N)=NC=C1 AT18208 [0,1,0,0,0,0|2,0,1]=4 95 B10R1.10 N#CCC1=CC=CC(Cl)=N1 O10491 [0,1,0,0,0,0|2,0,1]=4 96 B10R1.10 NCCC1=CC=CC(I)=C1 C78608 [0,1,0,0,0,0|1,0,1]=3 97 B10R1.10 NNCC1=CC(Br)=CN=C1 P11105 [0,1,0,0,0,0|3,0,0]=4 98 B10R1.10 NNCC1=CC=CC(Cl)=C1 P15270 [0,1,0,0,0,0|2,0,0]=3 99 B10R1.10 NNCC1=CC=CC(O)=C1 D87672 [0,1,0,0,0,0|2,0,0]=3 100 B10R1.10 N\N=C\C1=CC=CC(O)=C1 F15561 [0,1,0,0,0,0|2,0,1]=4 101 B10R1.10 O=CCC1=CC=CC(Cl)=C1 W16823 [0,1,0,0,0,0|0,0,0]=1 102 B10R1.15 C#C[C@@H](O)C1=CC=NC=C1 O10327 [0,1,0,0,0,0|2,0,1]=4 103 B10R1.15 C#C[C@@H](O)C1=CN=CC=C1 AC5787 [0,1,0,0,0,0|2,0,1]=4 104 B10R1.15 C#C[C@@H](O)C1=NC=CC=C1 AC5788 [0,1,0,0,0,0|2,0,1]=4 105 B10R1.15 C=C(CO)C1=CC=CC=C1 A11577 [0,1,0,0,0,0|0,0,3]=4 106 B10R1.15 CC[C@H](N)C1=CC=CC=C1 N12648 [0,1,0,0,0,0|1,0,1]=3 107 B10R1.15 CC[C@H](N)C1=NC=CC=C1 N10611 [0,1,0,0,0,0|2,0,1]=4 108 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 L10186 [0,1,0,0,0,0|2,0,0]=3 109 B10R1.15 COC(=N)C1=CC=CC=C1 W12775 [0,1,0,0,0,0|2,0,1]=4 110 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1146 [0,1,0,0,0,0|0,0,0]=1 111 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1167 [0,1,0,0,0,0|0,0,0]=1 112 B10R1.15 C[C@H](NO)C1=CC=CC=C1 P10550 [0,1,0,0,0,0|1,0,1]=3 113 B10R1.15 C[C@H](NO)C1=CC=CC=C1 P10551 [0,1,0,0,0,0|1,0,1]=3 114 B10R1.15 C[C@H](ON)C1=CC=CC=C1 AT14528 [0,1,0,0,0,0|2,0,0]=3 115 B10R1.15 C[C@H](ON)C1=CC=CC=C1 AT14530 [0,1,0,0,0,0|2,0,0]=3 116 B10R1.15 NC[C@H](O)C1=CC=NC=C1 C78562 [0,1,0,0,0,0|2,0,1]=4 117 B10R1.15 NC[C@H](O)C1=CN=CC=C1 33361 [0,1,0,0,0,0|2,0,1]=4 118 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y11546 [0,1,0,0,0,0|1,0,2]=4 119 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y12429 [0,1,0,0,0,0|1,0,2]=4 120 B10R1.15 N[C@@H](CO)C1=CN=CC=C1 Y12120 [0,1,0,0,0,0|1,0,2]=4 121 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y12118 [0,1,0,0,0,0|1,0,2]=4 122 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y12119 [0,1,0,0,0,0|1,0,2]=4 123 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y12430 [0,1,0,0,0,0|1,0,2]=4 124 B10R1.15 N\C(=N/O)C1=CC=CC=C1 L10027 [0,1,0,0,0,0|1,0,2]=4 125 B10R1.15 O[C@@H](CCl)C1=CN=CC=C1 Y10944 [0,1,0,0,0,0|2,0,1]=4 126 B10R1.17 BrCCSC1=CC=NC=C1 AT18153 [0,1,0,0,0,0|2,0,1]=4 127 B10R1.17 CNCCC1=CC=CN=C1 C73747 [0,1,0,0,0,0|2,0,1]=4 128 B10R1.17 CNCCC1=CC=NC=C1 AR1715 [0,1,0,0,0,0|2,0,1]=4 129 B10R1.17 CNNCC1=NC=CC=C1 30190 [0,1,0,0,0,0|3,0,0]=4 130 B10R1.17 FCCNC1=CC=CC=C1 D77931 [0,1,0,0,0,0|1,0,1]=3 131 B10R1.17 NCCNC1=NC=CC=C1 O12009 [0,1,0,0,0,0|2,0,1]=4 132 B10R1.17 NC\C=C\C1=CC=CC=C1 A12523 [0,1,0,0,0,0|1,0,1]=3 133 B10R1.17 NNCCC1=CC=CC=C1 AC4670 [0,1,0,0,0,0|1,0,1]=3 134 B10R1.17 NOCCC1=CC=CC=C1 C10179 [0,1,0,0,0,0|0,0,2]=3 135 B10R1.17 O=CCCC1=NC=CC=C1 P20552 [0,1,0,0,0,0|1,0,0]=2 136 B10R1.17 O=CCOC1=CC=CC=C1 C15303 [0,1,0,0,0,0|0,0,0]=1 137 B10R1.17 O=CNCC1=NC=CC=C1 AC6369 [0,1,0,0,0,0|1,0,0]=2 138 B10R1.17 O=C\C=C\C1=CC=NC=C1 T72403 [0,1,0,0,0,0|1,0,1]=3 139 B10R1.17 OCCCC1=CN=CC=C1 AC5531 [0,1,0,0,0,0|1,0,2]=4 140 B10R1.17 OCCOC1=NC=CC=C1 C90307 [0,1,0,0,0,0|1,0,2]=4 141 B10R1.17 OC\C=C\C1=CC=NC=C1 AC1120 [0,1,0,0,0,0|1,0,2]=4 142 B10R1.17 SCCCC1=CN=CC=C1 F18019 [0,1,0,0,0,0|1,1,1]=4 143 B10R1.17 SCCCC1=NC=CC=C1 F18728 [0,1,0,0,0,0|1,1,1]=4 144 B10R1.18 CC(=O)NC1=CN=CN=C1 F18145 [0,1,0,0,0,0|3,0,0]=4 145 B10R1.18 CC(=O)[15NH]C1=CC=CC=C1 F21470 [0,1,0,0,0,0|1,0,0]=2 146 B10R1.18 CC(C)CC1=CC=NC=C1 AC2809 [0,1,0,0,0,0|2,0,1]=4 147 B10R1.18 C[C@H](N)CC1=CC=NC=C1 F11581 [0,1,0,0,0,0|2,0,1]=4 148 B10R1.18 C[C@H](N)CC1=NC=CC=C1 F13183 [0,1,0,0,0,0|2,0,1]=4 149 B10R1.18 C[C@H](O)CC1=CC=CC=C1 T71821 [0,1,0,0,0,0|0,0,2]=3 150 B10R1.18 C[C@H](O)CC1=CC=CC=C1 T71861 [0,1,0,0,0,0|0,0,2]=3 151 B10R1.18 C[S@](=O)CC1=CN=CC=C1 E72354 [0,1,0,0,0,0|2,0,0]=3 152 B10R1.18 N=C(N)CC1=CC=CC=C1 C15976 [0,1,0,0,0,0|1,0,0]=2 153 B10R1.18 NC(=O)CC1=CN=CN=C1 FD7229 [0,1,0,0,0,0|2,0,0]=3 154 B10R1.18 OB(O)CC1=CC=CC=C1 32975 [0,1,0,0,0,0|1,0,1]=3 155 B10R1.18 [2H]C([2H])=CC1=CC=CC=C1 D99670 [0,1,0,0,0,0|1,0,1]=3 156 B10R2.6 C1=CC(C2CC2)=CC=N1 59829 [0,0,0,1,0,0|2,0,1]=4 157 B10R2.7 C1=CC2=C(C=C1)SCO2 76474 [0,0,0,1,0,0|1,0,2]=4 158 B10R2.7 C1=CC2=C(C=C1)SCS2 D71935 [0,0,0,1,0,0|1,1,1]=4 159 B10R2.7 C1=CC2=C(C=CO2)C=N1 D74565 [0,0,0,1,0,0|1,0,2]=4 160 B10R2.7 C1=CN=C2NCCC2=C1 C13729 [0,0,0,1,0,0|2,0,1]=4 161 B10R2.320 N[C@H]1CC2=C1C=CC=C2 AT20398 [0,0,0,1,0,0|1,0,1]=3 162 B8R1.8 BrCCC1=CC=CS1 F20027 [0,0,0,0,1,0|2,0,1]=4 163 B8R1.8 CNCC1=CSC=C1 AT16803 [0,0,0,0,1,0|3,0,0]=4 164 B8R1.8 N#CCN1C=CC=C1 F50604 [0,0,0,0,1,0|2,0,1]=4 165 B8R1.8 NNCC1=CC=CS1 P10519 [0,0,0,0,1,0|3,0,0]=4 166 B8R1.8 NNCC1=CSC=C1 P10771 [0,0,0,0,1,0|3,0,0]=4 167 B8R1.8 O=CCC1=CC=CS1 O10539 [0,0,0,0,1,0|1,0,0]=2 168 B8R1.8 O=CCC1=NC=CS1 D88143 [0,0,0,0,1,0|2,0,0]=3 169 B8R1.8 O=CCC1=NN=CO1 W10330 [0,0,0,0,1,0|3,0,0]=4 170 B7R1.3 ClC1=CC=NC=C1 F17303 [2,0,0,0,0,0|2,0,0]=4 171 B7R1.3 FC1=CC=NC=C1 F19691 [2,0,0,0,0,0|2,0,0]=4 172 B7R1.3 F[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 40525 [2,0,0,0,0,0|1,0,0]=3 173 B7R1.3 [15NH2]C1=CC=CC=C1 41405 [2,0,0,0,0,0|1,0,0]=3 174 B7R1.3 [2H]C1=CC=CC=C1 D98570 [2,0,0,0,0,0|1,0,0]=3 175 B7R1.3 [2H]C1=CC=NC=C1 D98795 [2,0,0,0,0,0|2,0,0]=4 176 B7R1.3 [2H]C1=NC=CC=C1 D98277 [2,0,0,0,0,0|2,0,0]=4 177 B9R1.1 C=CC1=CN=C(F)C=C1 79557 [1,1,0,0,0,0|1,0,1]=4 178 B9R1.1 CC1=NC=C(CBr)C=C1 F52459 [1,1,0,0,0,0|2,0,0]=4 179 B9R1.1 CC1=NC=C(CCl)C=C1 D87733 [1,1,0,0,0,0|2,0,0]=4 180 B9R1.1 CCN1C=CC(=S)C=C1 W16146 [1,1,0,0,0,0|1,0,1]=4 181 B9R1.1 CNC1=CC=C(N)C=C1 C78356 [1,1,0,0,0,0|1,0,1]=4 182 B9R1.1 C[Se]C1=CC=C(Br)C=C1 97865 [1,1,0,0,0,0|1,0,1]=4 183 B9R1.1 ClC1=CN=C(CBr)C=C1 S12201 [1,1,0,0,0,0|2,0,0]=4 184 B9R1.1 ClCC1=CN=C(Cl)C=C1 W18630 [1,1,0,0,0,0|2,0,0]=4 185 B9R1.1 FC1=CN=C(CCl)C=C1 P19178 [1,1,0,0,0,0|2,0,0]=4 186 B9R1.1 NC1=NC=C(CCl)C=C1 AT22351 [1,1,0,0,0,0|2,0,0]=4 187 B9R1.1 NCC1=CC=C(F)C=C1 N12249 [1,1,0,0,0,0|1,0,0]=3 188 B9R1.1 NCC1=CC=C(S)C=C1 AT20992 [1,1,0,0,0,0|1,0,0]=3 189 B9R1.1 NCC1=NC=C(F)C=C1 83593 [1,1,0,0,0,0|2,0,0]=4 190 B9R1.1 NCC1=NC=C(I)C=C1 C91084 [1,1,0,0,0,0|2,0,0]=4 191 B9R1.1 O=C1C=CC(=NCl)C=C1 T72753 [1,1,0,0,0,0|2,0,0]=4 192 B9R1.1 O=CC1=CN=C(Br)N=C1 55465 [1,1,0,0,0,0|2,0,0]=4 193 B9R1.1 O=CC1=CN=C(F)C=N1 P15039 [1,1,0,0,0,0|2,0,0]=4 194 B9R1.1 O=CC1=NC=C(Br)C=N1 38375 [1,1,0,0,0,0|2,0,0]=4 195 B9R1.1 [2H]CC1=CC=C(F)C=C1 D98910 [1,1,0,0,0,0|1,0,0]=3 196 B9R1.2 CC1=CC(C=O)=NC=N1 AT18315 [1,1,0,0,0,0|2,0,0]=4 197 B9R1.2 CC1=CC(CBr)=CN=C1 43925 [1,1,0,0,0,0|2,0,0]=4 198 B9R1.2 ClC1=NC=CC(CBr)=C1 C16429 [1,1,0,0,0,0|2,0,0]=4 199 B9R1.2 ClCC1=NC=CC(Cl)=C1 C13998 [1,1,0,0,0,0|2,0,0]=4 200 B9R1.2 FC1=CC(CCl)=CN=C1 O10881 [1,1,0,0,0,0|2,0,0]=4 201 B9R1.2 NC1=NC=CC(C=O)=C1 O10660 [1,1,0,0,0,0|1,0,0]=3 202 B9R1.2 NCC1=CC(=O)NC=C1 37540 [1,1,0,0,0,0|2,0,0]=4 203 B9R1.2 NCC1=CC(Br)=CN=C1 F19818 [1,1,0,0,0,0|2,0,0]=4 204 B9R1.2 NCC1=CC(F)=NC=C1 W18404 [1,1,0,0,0,0|2,0,0]=4 205 B9R1.2 NCC1=CC(N)=NC=C1 AC6477 [1,1,0,0,0,0|2,0,0]=4 206 B9R1.2 NCC1=CC=CC(Cl)=N1 C72946 [1,1,0,0,0,0|2,0,0]=4 207 B9R1.2 NCC1=CC=CC(I)=C1 CK2420 [1,1,0,0,0,0|1,0,0]=3 208 B9R1.2 NCC1=CC=CC(O)=N1 F10425 [1,1,0,0,0,0|2,0,0]=4 209 B9R1.2 NCC1=NC=CC(Br)=C1 26892 [1,1,0,0,0,0|2,0,0]=4 210 B9R1.2 NCC1=NC=CC(F)=C1 C71953 [1,1,0,0,0,0|2,0,0]=4 211 B9R1.2 NCC1=NC=CC(N)=C1 77886 [1,1,0,0,0,0|2,0,0]=4 212 B9R1.2 O=CC1=CC(I)=CN=C1 H10413 [1,1,0,0,0,0|1,0,0]=3 213 B9R1.2 [2H]CC1=CC=CC(F)=C1 D99661 [1,1,0,0,0,0|1,0,0]=3 214 B9R1.2 [O-][N+]1=CC=CC(CCl)=C1 96310 [1,1,0,0,0,0|2,0,0]=4 215 B9R1.6 C[C@H](Cl)C1=NC=CC=C1 F13293 [1,1,0,0,0,0|1,0,1]=4 216 B9R1.6 C[C@H](N)C1=CC=CN=C1 S11132 [1,1,0,0,0,0|1,0,1]=4 217 B9R1.6 C[C@H](N)C1=CC=NC=C1 F31048 [1,1,0,0,0,0|1,0,1]=4 218 B9R1.6 C[C@H](N)C1=NC=CC=C1 90514 [1,1,0,0,0,0|1,0,1]=4 219 B9R1.6 N=C(N)C1=CC=NC=C1 71449 [1,1,0,0,0,0|2,0,0]=4 220 B9R1.6 NC(=O)C1=NC=CC=N1 C11052 [1,1,0,0,0,0|2,0,0]=4 221 B9R1.6 O=C(Cl)C1=CC=NC=C1 D78267 [1,1,0,0,0,0|1,0,0]=3 222 B9R1.6 O=C([O-])C1=NC=CC=C1 T71798 [1,1,0,0,0,0|1,0,0]=3 223 B9R1.6 O=[13C](O)C1=CC=CC=C1 F13987 [1,1,0,0,0,0|0,0,0]=2 224 B9R1.6 [2H]C(=C)C1=CC=CC=C1 D97969 [1,1,0,0,0,0|0,0,1]=3 225 B9R1.6 [2H]N([2H])C1=CC=CC=C1 D98688 [1,1,0,0,0,0|2,0,0]=4 226 B9R1.15 C=CC1=C(C)C=CC=C1 T72704 [1,1,0,0,0,0|0,0,1]=3 227 B9R1.15 C=CC1=C(C)C=CN=C1 P11580 [1,1,0,0,0,0|1,0,1]=4 228 B9R1.15 C=CC1=CC=CN=C1F P13082 [1,1,0,0,0,0|1,0,1]=4 229 B9R1.15 CC1=C(C=O)C=NC=N1 O11269 [1,1,0,0,0,0|2,0,0]=4 230 B9R1.15 CC1=C(CBr)C=CC=N1 FD9046 [1,1,0,0,0,0|2,0,0]=4 231 B9R1.15 CC1=C(CBr)C=CC=N1 P11218 [1,1,0,0,0,0|2,0,0]=4 232 B9R1.15 CC1=C(CCl)C=CC=N1 P10970 [1,1,0,0,0,0|2,0,0]=4 233 B9R1.15 CC1=C(CCl)C=NC=C1 P10971 [1,1,0,0,0,0|2,0,0]=4 234 B9R1.15 CC1=CC=CN=C1CBr D97530 [1,1,0,0,0,0|2,0,0]=4 235 B9R1.15 CCC1=C(Br)C=CN=C1 H11182 [1,1,0,0,0,0|1,0,1]=4 236 B9R1.15 CCC1=CC=CN=C1C 75814 [1,1,0,0,0,0|1,0,1]=4 237 B9R1.15 ClC1=CC=CN=C1CBr 79180 [1,1,0,0,0,0|2,0,0]=4 238 B9R1.15 ClC1=CC=CN=C1CBr 86640 [1,1,0,0,0,0|2,0,0]=4 239 B9R1.15 ClCC1=CC=CN=C1Br 55187 [1,1,0,0,0,0|2,0,0]=4 240 B9R1.15 FC1=C(CBr)C=CC=N1 AT20654 [1,1,0,0,0,0|2,0,0]=4 241 B9R1.15 N#CC1=C(S)C=CC=C1 AT20892 [1,1,0,0,0,0|1,0,1]=4 242 B9R1.15 NC1=C(C=O)C=NC=C1 W12249 [1,1,0,0,0,0|1,0,0]=3 243 B9R1.15 NC1=C(CCl)C=CC=N1 89794 [1,1,0,0,0,0|2,0,0]=4 244 B9R1.15 NCC1=C(Br)C=NC=C1 98160 [1,1,0,0,0,0|2,0,0]=4 245 B9R1.15 NCC1=C(Cl)C=CN=C1 C11073 [1,1,0,0,0,0|2,0,0]=4 246 B9R1.15 NCC1=C(F)C=CN=C1 C90218 [1,1,0,0,0,0|2,0,0]=4 247 B9R1.15 NCC1=C(I)C=CC=C1 AT26620 [1,1,0,0,0,0|1,0,0]=3 248 B9R1.15 NCC1=C(O)C=CC=N1 C73700 [1,1,0,0,0,0|2,0,0]=4 249 B9R1.15 NCC1=C(O)C=CN=C1 AT18117 [1,1,0,0,0,0|2,0,0]=4 250 B9R1.15 NCC1=CC=CN=C1Cl 37571 [1,1,0,0,0,0|2,0,0]=4 251 B9R1.15 NCC1=CC=CN=C1N CL0345 [1,1,0,0,0,0|2,0,0]=4 252 B9R1.15 NCC1=[N+]([O-])C=CC=C1 D86206 [1,1,0,0,0,0|2,0,0]=4 253 B9R1.15 O=CC1=CNC=CC1=O O11278 [1,1,0,0,0,0|1,0,0]=3 254 B9R1.15 OCC1=C(F)C=CN=C1 P11878 [1,1,0,0,0,0|1,0,1]=4 255 B9R1.15 [2H]CC1=C(F)C=CC=C1 D99779 [1,1,0,0,0,0|1,0,0]=3 256 B9R1.15 [C-]#[N+]C1=C(Cl)C=CC=C1 AC9402 [1,1,0,0,0,0|1,0,1]=4 257 B9R1.11 C=C[C@H](N)C1=CC=CO1 N16701 [0,1,0,0,1,0|2,0,0]=4 258 B9R1.11 C=C[C@H](N)C1=CC=CO1 N16702 [0,1,0,0,1,0|2,0,0]=4 259 B9R1.11 C=C[C@H](N)C1=CC=CO1 N16703 [0,1,0,0,1,0|2,0,0]=4 260 B9R1.11 C=C[C@H](N)C1=COC=C1 N16733 [0,1,0,0,1,0|2,0,0]=4 261 B9R1.11 C=C[C@H](N)C1=COC=C1 N16734 [0,1,0,0,1,0|2,0,0]=4 262 B9R1.11 C=C[C@H](N)C1=COC=C1 N16735 [0,1,0,0,1,0|2,0,0]=4 263 B9R1.11 O=CC(=O)C1=CSC=C1 AT16766 [0,1,0,0,1,0|1,0,1]=4 264 B9R1.12 O=CCCN1C=CC=N1 H11819 [0,1,0,0,1,0|2,0,0]=4 265 B9R1.13 CC(=O)CC1=CSC=C1 66590 [0,1,0,0,1,0|1,0,0]=3 266 B9R1.13 CC(=O)CN1C=CC=N1 AT23998 [0,1,0,0,1,0|2,0,0]=4 267 B9R1.13 N=C(N)CN1C=CC=C1 F50603 [0,1,0,0,1,0|2,0,0]=4 268 B9R1.13 NC(=O)CC1=CC=CN1 72456 [0,1,0,0,1,0|1,0,0]=3 269 B9R1.13 O=C(O)CC1=CC=NN1 79593 [0,1,0,0,1,0|2,0,0]=4 270 B9R1.13 O=C(O)CC1=CNN=C1 AT16113 [0,1,0,0,1,0|2,0,0]=4 271 B9R1.13 O=C(O)CC1=CSC=N1 AC3265 [0,1,0,0,1,0|2,0,0]=4 272 B11R1.1 C#CCNC1=CC=C(Cl)C=C1 D75666 [0,2,0,0,0,0|1,0,1]=4 273 B11R1.1 C#CCOC1=CC=C(I)C=C1 AT23376 [0,2,0,0,0,0|1,0,1]=4 274 B11R1.1 C=CCOC1=CC=C(Br)C=C1 71195 [0,2,0,0,0,0|1,0,0]=3 275 B11R1.1 C=C\C=C\C1=CC=C(F)C=C1 59824 [0,2,0,0,0,0|1,0,1]=4 276 B11R1.1 CC1=CC=C(CCCN)C=C1 C78299 [0,2,0,0,0,0|1,0,1]=4 277 B11R1.1 CC1=CC=C(OCC#N)C=C1 AC7568 [0,2,0,0,0,0|1,0,1]=4 278 B11R1.1 CNCCC1=CC=C(Br)C=C1 C78422 [0,2,0,0,0,0|1,0,1]=4 279 B11R1.1 CNCCC1=CC=C(C)C=C1 C78074 [0,2,0,0,0,0|1,0,1]=4 280 B11R1.1 COCCC1=CC=C(Br)C=C1 28244 [0,2,0,0,0,0|0,0,2]=4 281 B11R1.1 COCCC1=CC=C(N)C=C1 F11764 [0,2,0,0,0,0|0,0,2]=4 282 B11R1.1 CONCC1=CC=C(Br)C=C1 N11596 [0,2,0,0,0,0|1,0,1]=4 283 B11R1.1 ClC1=CC=C(CCCBr)C=C1 S11935 [0,2,0,0,0,0|1,0,1]=4 284 B11R1.1 ClC1=CC=C(\C=C\CBr)C=C1 72674 [0,2,0,0,0,0|1,0,1]=4 285 B11R1.1 N#CCCC1=CC=C(O)C=C1 C15091 [0,2,0,0,0,0|1,0,1]=4 286 B11R1.1 NC1=CC=C(OCCCl)C=C1 72016 [0,2,0,0,0,0|1,0,1]=4 287 B11R1.1 NC1=CC=C(OCCO)C=C1 F16836 [0,2,0,0,0,0|0,0,2]=4 288 B11R1.1 NCCCC1=CC=C(N)C=C1 C78351 [0,2,0,0,0,0|1,0,1]=4 289 B11R1.1 NCCSC1=CC=C(Br)C=C1 C78402 [0,2,0,0,0,0|1,0,1]=4 290 B11R1.1 O=CNCC1=CC=C(Cl)C=C1 AB6809 [0,2,0,0,0,0|0,0,0]=2 291 B11R1.1 OCCNC1=CC=C(F)C=C1 I11182 [0,2,0,0,0,0|0,0,2]=4 292 B11R1.1 OCCSC1=CC=C(Br)C=C1 AT20956 [0,2,0,0,0,0|0,0,2]=4 293 B11R1.1 OC\C=C\C1=CC=C(Br)C=C1 AT26502 [0,2,0,0,0,0|0,0,2]=4 294 B11R1.20 CC(=O)NC1=NC=C(F)C=C1 N11494 [0,2,0,0,0,0|2,0,0]=4 295 B11R1.20 CC1=CC=C(CB(O)O)C=C1 F20813 [0,2,0,0,0,0|1,0,1]=4 296 B11R1.20 CC1=CC=C(C[C@H](C)N)C=C1 N14354 [0,2,0,0,0,0|1,0,1]=4 297 B11R1.20 CC1=CN=C(CC(=O)[O-])C=C1 R10046 [0,2,0,0,0,0|1,0,0]=3 298 B11R1.20 CC1=CN=C(CC(=O)[O-])C=N1 C91526 [0,2,0,0,0,0|2,0,0]=4 299 B11R1.20 C[C@H](N)CC1=CC=C(Br)C=C1 Y11268 [0,2,0,0,0,0|1,0,1]=4 300 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 N10873 [0,2,0,0,0,0|1,0,1]=4 301 B11R1.20 C[C@H](N)CC1=CC=C(O)C=C1 85180 [0,2,0,0,0,0|1,0,1]=4 302 B11R1.20 FC1=CC=C(OC(=S)Cl)C=C1 T72468 [0,2,0,0,0,0|1,1,0]=4 303 B11R1.20 N=C(N)NC1=CC=C(Cl)C=C1 28377 [0,2,0,0,0,0|2,0,0]=4 304 B11R1.20 N=C(N)NC1=CC=C(F)C=C1 C16184 [0,2,0,0,0,0|2,0,0]=4 305 B11R1.20 NC(=O)CC1=NN=C(Cl)C=C1 W10904 [0,2,0,0,0,0|2,0,0]=4 306 B11R1.20 NC(=O)NC1=CC=C(N)C=C1 51818 [0,2,0,0,0,0|1,0,0]=3 307 B11R1.22 C#C[C@@H](O)C1=CC=C(Br)C=C1 AC6934 [0,2,0,0,0,0|1,0,1]=4 308 B11R1.22 C#C[C@@H](O)C1=CC=C(C)C=C1 AC6704 [0,2,0,0,0,0|1,0,1]=4 309 B11R1.22 C#C[C@@H](O)C1=CC=C(Cl)C=C1 AC5833 [0,2,0,0,0,0|1,0,1]=4 310 B11R1.22 C=C[C@H](N)C1=CC=C(Br)C=C1 N15257 [0,2,0,0,0,0|1,0,0]=3 311 B11R1.22 C=C[C@H](N)C1=CC=C(Br)C=C1 N15258 [0,2,0,0,0,0|1,0,0]=3 312 B11R1.22 C=C[C@H](N)C1=CC=C(C)C=C1 N15265 [0,2,0,0,0,0|1,0,0]=3 313 B11R1.22 C=C[C@H](N)C1=CC=C(C)C=C1 N15266 [0,2,0,0,0,0|1,0,0]=3 314 B11R1.22 C=C[C@H](N)C1=CC=C(C)C=C1 N15267 [0,2,0,0,0,0|1,0,0]=3 315 B11R1.22 C=C[C@H](N)C1=CC=C(Cl)C=C1 E72771 [0,2,0,0,0,0|1,0,0]=3 316 B11R1.22 C=C[C@H](N)C1=CC=C(Cl)C=C1 N15246 [0,2,0,0,0,0|1,0,0]=3 317 B11R1.22 C=C[C@H](N)C1=CC=C(Cl)C=C1 N15247 [0,2,0,0,0,0|1,0,0]=3 318 B11R1.22 C=C[C@H](N)C1=CC=C(Cl)C=C1 N15248 [0,2,0,0,0,0|1,0,0]=3 319 B11R1.22 C=C[C@H](N)C1=CC=C(F)C=C1 N15237 [0,2,0,0,0,0|1,0,0]=3 320 B11R1.22 C=C[C@H](N)C1=CC=C(F)C=C1 N15238 [0,2,0,0,0,0|1,0,0]=3 321 B11R1.22 C=C[C@H](N)C1=CC=C(O)C=C1 N15298 [0,2,0,0,0,0|1,0,0]=3 322 B11R1.22 C=C[C@H](N)C1=CC=C(O)C=C1 N15299 [0,2,0,0,0,0|1,0,0]=3 323 B11R1.22 C=C[C@H](N)C1=CC=C(O)C=C1 N15300 [0,2,0,0,0,0|1,0,0]=3 324 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13432 [0,2,0,0,0,0|1,0,1]=4 325 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13433 [0,2,0,0,0,0|1,0,1]=4 326 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13434 [0,2,0,0,0,0|1,0,1]=4 327 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13455 [0,2,0,0,0,0|1,0,1]=4 328 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13456 [0,2,0,0,0,0|1,0,1]=4 329 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13457 [0,2,0,0,0,0|1,0,1]=4 330 B11R1.22 CC1=CC=C([C@@H](O)CN)C=C1 C78285 [0,2,0,0,0,0|1,0,1]=4 331 B11R1.22 CC[C@H](C)C1=CC=C(Br)C=C1 O10385 [0,2,0,0,0,0|1,0,1]=4 332 B11R1.22 CC[C@H](N)C1=CC=C(C)C=C1 N12295 [0,2,0,0,0,0|1,0,1]=4 333 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y11091 [0,2,0,0,0,0|2,0,0]=4 334 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y11092 [0,2,0,0,0,0|2,0,0]=4 335 B11R1.22 CO[C@@H](C)C1=CC=C(Br)C=C1 N11516 [0,2,0,0,0,0|2,0,0]=4 336 B11R1.22 C[C@@H](CN)C1=CC=C(Cl)C=C1 F20636 [0,2,0,0,0,0|1,0,1]=4 337 B11R1.22 C[C@@H](CN)C1=CC=C(O)C=C1 70995 [0,2,0,0,0,0|1,0,1]=4 338 B11R1.22 C[C@H](C#N)C1=CC=C(F)C=C1 AT19993 [0,2,0,0,0,0|1,0,1]=4 339 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13423 [0,2,0,0,0,0|1,0,1]=4 340 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13424 [0,2,0,0,0,0|1,0,1]=4 341 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13425 [0,2,0,0,0,0|1,0,1]=4 342 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13446 [0,2,0,0,0,0|1,0,1]=4 343 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13447 [0,2,0,0,0,0|1,0,1]=4 344 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13448 [0,2,0,0,0,0|1,0,1]=4 345 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N12560 [0,2,0,0,0,0|1,0,1]=4 346 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13414 [0,2,0,0,0,0|1,0,1]=4 347 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13415 [0,2,0,0,0,0|1,0,1]=4 348 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13416 [0,2,0,0,0,0|1,0,1]=4 349 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13438 [0,2,0,0,0,0|1,0,1]=4 350 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13439 [0,2,0,0,0,0|1,0,1]=4 351 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13400 [0,2,0,0,0,0|1,0,1]=4 352 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13401 [0,2,0,0,0,0|1,0,1]=4 353 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13402 [0,2,0,0,0,0|1,0,1]=4 354 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13406 [0,2,0,0,0,0|1,0,1]=4 355 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13407 [0,2,0,0,0,0|1,0,1]=4 356 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13408 [0,2,0,0,0,0|1,0,1]=4 357 B11R1.22 NC[C@H](O)C1=CC=C(Br)C=C1 58433 [0,2,0,0,0,0|1,0,1]=4 358 B11R1.22 NC[C@H](O)C1=CC=C(F)C=C1 C78230 [0,2,0,0,0,0|1,0,1]=4 359 B11R1.22 N[C@@H](CF)C1=CC=C(Br)C=C1 N14615 [0,2,0,0,0,0|1,0,1]=4 360 B11R1.22 N[C@@H](CF)C1=CC=C(F)C=C1 N14614 [0,2,0,0,0,0|1,0,1]=4 361 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 N11131 [0,2,0,0,0,0|0,0,2]=4 362 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 F16864 [0,2,0,0,0,0|0,0,2]=4 363 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 F16884 [0,2,0,0,0,0|0,0,2]=4 364 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 N10530 [0,2,0,0,0,0|0,0,2]=4 365 B11R1.22 O=CC(=O)C1=CC=C(Cl)C=C1 O10480 [0,2,0,0,0,0|0,0,1]=3 366 B11R1.22 OC[C@H](O)C1=CC=C(Cl)C=C1 FD1217 [0,2,0,0,0,0|0,0,2]=4 367 B11R1.22 O[C@@H](CCl)C1=CC=C(Br)C=C1 58431 [0,2,0,0,0,0|1,0,1]=4 368 B11R1.81 CCCC1=C(O)C=C(C)C=C1 A10895 [0,2,0,0,0,0|1,0,1]=4 369 B11R1.81 CNCC1=C(Cl)C=C(F)C=C1 76695 [0,2,0,0,0,0|2,0,0]=4 370 B11R1.81 CNCC1=C(F)C=C(F)C=C1 36787 [0,2,0,0,0,0|2,0,0]=4 371 B11R1.81 COCC1=C(Cl)C=C(Br)C=C1 N11614 [0,2,0,0,0,0|2,0,0]=4 372 B11R1.81 N#CCC1=C(I)C=C(Br)C=C1 D85729 [0,2,0,0,0,0|1,0,1]=4 373 B11R1.81 NCCC1=C(Br)C=C(Br)C=C1 P18612 [0,2,0,0,0,0|1,0,1]=4 374 B11R1.81 NCCC1=C(Br)C=C(Cl)C=C1 AC3186 [0,2,0,0,0,0|1,0,1]=4 375 B11R1.81 NCCC1=C(Br)C=C(F)C=C1 AC7044 [0,2,0,0,0,0|1,0,1]=4 376 B11R1.81 NCCC1=C(F)C=C(Br)C=C1 50240 [0,2,0,0,0,0|1,0,1]=4 377 B11R1.81 NCCC1=C(F)C=C(O)C=C1 F51014 [0,2,0,0,0,0|1,0,1]=4 378 B11R1.81 NNCC1=C(Br)C=C(F)C=C1 AC5368 [0,2,0,0,0,0|2,0,0]=4 379 B11R1.81 NNCC1=C(Cl)C=C(Cl)C=C1 AC4339 [0,2,0,0,0,0|2,0,0]=4 380 B11R1.81 NNCC1=C(Cl)C=C(Cl)C=C1 P10432 [0,2,0,0,0,0|2,0,0]=4 381 B11R1.81 NNCC1=C(Cl)C=C(F)C=C1 A12240 [0,2,0,0,0,0|2,0,0]=4 382 B11R1.81 NNCC1=C(Cl)C=C(F)C=C1 P10526 [0,2,0,0,0,0|2,0,0]=4 383 B11R1.81 NNCC1=C(F)C=C(Br)C=C1 AC5349 [0,2,0,0,0,0|2,0,0]=4 384 B11R1.81 NNCC1=C(F)C=C(F)C=C1 AC5364 [0,2,0,0,0,0|2,0,0]=4 385 B11R1.81 O=CCC1=C(Cl)C=C(Cl)C=C1 C15524 [0,2,0,0,0,0|0,0,0]=2 386 B11R1.81 O=CNC1=CN=C(Br)C=C1Br F18557 [0,2,0,0,0,0|2,0,0]=4 387 B11R1.81 OCCC1=C(Br)C=C(Cl)C=C1 D85895 [0,2,0,0,0,0|0,0,2]=4 388 B11R1.81 OCCC1=C(F)C=C(F)C=C1 A50720 [0,2,0,0,0,0|0,0,2]=4 389 B11R1.83 C=CC1=CC=C(CCCl)C=C1 AC7198 [0,2,0,0,0,0|1,0,1]=4 390 B11R1.83 C=CC1=CC=C(CCO)C=C1 AC6179 [0,2,0,0,0,0|0,0,2]=4 391 B11R1.83 CCCC1=CC=C(CBr)C=C1 C13395 [0,2,0,0,0,0|1,0,1]=4 392 B11R1.83 NCCC1=CC=C(CO)C=C1 20162 [0,2,0,0,0,0|1,0,1]=4 393 B11R1.83 [C-]#[N+]CC1=CC=C(OC)C=C1 AB1475 [0,2,0,0,0,0|2,0,0]=4 394 B11R1.192 CC1=C(Br)C=C(CC#N)C=C1 97483 [0,2,0,0,0,0|1,0,1]=4 395 B11R1.192 CC1=C(Cl)C=CC(CC#N)=C1 D96292 [0,2,0,0,0,0|1,0,1]=4 396 B11R1.192 CCCC1=CC(Br)=C(Cl)C=C1 F31327 [0,2,0,0,0,0|1,0,1]=4 397 B11R1.192 CNCC1=CC(F)=C(F)C=C1 N12835 [0,2,0,0,0,0|2,0,0]=4 398 B11R1.192 ClC1=C(Cl)C=C(CCBr)C=C1 C78192 [0,2,0,0,0,0|1,0,1]=4 399 B11R1.192 FC1=C(Br)C=CC(CCBr)=C1 AC8493 [0,2,0,0,0,0|1,0,1]=4 400 B11R1.192 N#CCC1=CC(Br)=C(Cl)C=C1 D96285 [0,2,0,0,0,0|1,0,1]=4 401 B11R1.192 N#CCC1=CC(F)=C(O)C=C1 F13577 [0,2,0,0,0,0|1,0,1]=4 402 B11R1.192 NNCC1=CC(Br)=C(F)C=C1 E71963 [0,2,0,0,0,0|2,0,0]=4 403 B11R1.192 NNCC1=CC(Cl)=C(Cl)C=C1 AC5360 [0,2,0,0,0,0|2,0,0]=4 404 B11R1.192 NNCC1=CC(F)=C(F)C=C1 AC5348 [0,2,0,0,0,0|2,0,0]=4 405 B11R1.192 O=CCC1=CC(Cl)=C(Cl)C=C1 25894 [0,2,0,0,0,0|0,0,0]=2 406 B11R1.13 C=CCC1=C(O)C(C)=CC=C1 AC5932 [0,2,0,0,0,0|1,0,0]=3 407 B11R1.13 CC1=C(Cl)C=CC=C1CC#N C90793 [0,2,0,0,0,0|1,0,1]=4 408 B11R1.13 ClC1=CC=CC(CCBr)=C1Cl C78633 [0,2,0,0,0,0|1,0,1]=4 409 B11R1.13 N#CCC1=CC=CC(Br)=C1Cl D96283 [0,2,0,0,0,0|1,0,1]=4 410 B11R1.13 N#CCC1=CC=CC(F)=C1Cl 94661 [0,2,0,0,0,0|1,0,1]=4 411 B11R1.13 O=CCC1=CC=CC(F)=C1F 22736 [0,2,0,0,0,0|0,0,0]=2 412 B11R1.17 BrCCCC1=C(Br)C=CC=C1 C77748 [0,2,0,0,0,0|1,0,1]=4 413 B11R1.17 C#CCOC1=C(Br)C=CC=C1 AT23367 [0,2,0,0,0,0|1,0,1]=4 414 B11R1.17 C#CCOC1=C(Cl)C=CC=C1 AT23368 [0,2,0,0,0,0|1,0,1]=4 415 B11R1.17 C#CCOC1=C(I)C=CC=C1 AT23373 [0,2,0,0,0,0|1,0,1]=4 416 B11R1.17 C=CCCC1=C(Br)C=NC=C1 S10194 [0,2,0,0,0,0|2,0,0]=4 417 B11R1.17 CCCOC1=C(N)C=CC=C1 AC7746 [0,2,0,0,0,0|1,0,1]=4 418 B11R1.17 CCNCC1=C(Cl)C=CC=C1 C16114 [0,2,0,0,0,0|1,0,1]=4 419 B11R1.17 CNCCC1=C(C)C=CC=C1 C78447 [0,2,0,0,0,0|1,0,1]=4 420 B11R1.17 CNCCC1=C(Cl)C=CC=C1 C78279 [0,2,0,0,0,0|1,0,1]=4 421 B11R1.17 ClC1=C(CCCBr)C=CC=C1 C78298 [0,2,0,0,0,0|1,0,1]=4 422 B11R1.17 N#CCOC1=C(Cl)C=CC=C1 AC7530 [0,2,0,0,0,0|1,0,1]=4 423 B11R1.17 NCCCC1=C(Cl)C=CC=C1 C78000 [0,2,0,0,0,0|1,0,1]=4 424 B11R1.17 NCCCC1=C(F)C=CC=C1 F20045 [0,2,0,0,0,0|1,0,1]=4 425 B11R1.17 NCCOC1=C(Cl)C=CC=C1 L10067 [0,2,0,0,0,0|1,0,1]=4 426 B11R1.17 O=C\C=C\C1=C(Br)C=CC=C1 W16727 [0,2,0,0,0,0|0,0,1]=3 427 B11R1.17 O=C\C=C\C1=C(O)C=CC=C1 D90980 [0,2,0,0,0,0|0,0,1]=3 428 B11R1.41 CCC1=C(CCO)C=CC=C1 C15362 [0,2,0,0,0,0|0,0,2]=4 429 B11R1.41 COC1=C(CNN)C=CC=C1 P10476 [0,2,0,0,0,0|2,0,0]=4 430 B11R1.86 CC(=O)NC1=C(Br)C=CC=N1 F18386 [0,2,0,0,0,0|2,0,0]=4 431 B11R1.86 CC(=O)NC1=C(C)N=CC=C1 F14250 [0,2,0,0,0,0|2,0,0]=4 432 B11R1.86 CC(=O)NC1=C(I)C=NC=C1 D71943 [0,2,0,0,0,0|2,0,0]=4 433 B11R1.86 CC(=O)NC1=C(N)C=CN=C1 C16214 [0,2,0,0,0,0|2,0,0]=4 434 B11R1.86 CC(=O)OC1=C(Br)C=CC=C1 F13222 [0,2,0,0,0,0|1,0,0]=3 435 B11R1.86 CC(=S)NC1=C(Br)C=CC=C1 81280 [0,2,0,0,0,0|1,1,0]=4 436 B11R1.86 CC1=C(C[C@H](C)N)C=CC=C1 N10867 [0,2,0,0,0,0|1,0,1]=4 437 B11R1.86 CC1=NC=CN=C1CC(=O)O A51230 [0,2,0,0,0,0|2,0,0]=4 438 B11R1.86 C[C@H](N)CC1=C(Br)C=CC=C1 N11144 [0,2,0,0,0,0|1,0,1]=4 439 B11R1.86 C[C@H](N)CC1=C(Cl)C=CC=C1 N11063 [0,2,0,0,0,0|1,0,1]=4 440 B11R1.86 NC(=O)CC1=NC=CC=C1O D87092 [0,2,0,0,0,0|1,0,0]=3 441 B11R1.182 CC1=C(CC#N)C=C(Cl)C=C1 AT13429 [0,2,0,0,0,0|1,0,1]=4 442 B11R1.182 CC1=C(CCN)C=C(Cl)C=C1 AT13431 [0,2,0,0,0,0|1,0,1]=4 443 B11R1.182 CC1=CC(CC#N)=C(Br)C=C1 D96277 [0,2,0,0,0,0|1,0,1]=4 444 B11R1.182 CCCC1=C(Br)C=CC(O)=C1 57995 [0,2,0,0,0,0|1,0,1]=4 445 B11R1.182 CNCC1=C(Cl)C=CC(Cl)=C1 76693 [0,2,0,0,0,0|2,0,0]=4 446 B11R1.182 CNCC1=C(F)C=CC(Br)=C1 36267 [0,2,0,0,0,0|2,0,0]=4 447 B11R1.182 COCC1=C(Br)C=CC(F)=C1 N11817 [0,2,0,0,0,0|2,0,0]=4 448 B11R1.182 ClC1=CC(CCBr)=C(Cl)C=C1 C78205 [0,2,0,0,0,0|1,0,1]=4 449 B11R1.182 NCCC1=C(Br)C=CC(Cl)=C1 AT11063 [0,2,0,0,0,0|1,0,1]=4 450 B11R1.182 NCCC1=C(F)C=CC(Br)=C1 N12525 [0,2,0,0,0,0|1,0,1]=4 451 B11R1.182 NCCC1=C(F)C=CC(F)=C1 AT21560 [0,2,0,0,0,0|1,0,1]=4 452 B11R1.182 NNCC1=C(Br)C=CC(Cl)=C1 AC5350 [0,2,0,0,0,0|2,0,0]=4 453 B11R1.182 NNCC1=C(Cl)C=CC(F)=C1 AC5377 [0,2,0,0,0,0|2,0,0]=4 454 B11R1.182 NNCC1=C(F)C=CC(Br)=C1 AC5379 [0,2,0,0,0,0|2,0,0]=4 455 B11R1.222 C#C[C@@H](O)C1=C(Br)C=CC=C1 AC5641 [0,2,0,0,0,0|1,0,1]=4 456 B11R1.222 C#C[C@@H](O)C1=C(C)C=CC=C1 AC4137 [0,2,0,0,0,0|1,0,1]=4 457 B11R1.222 C#C[C@@H](O)C1=C(Cl)C=CC=C1 AC5063 [0,2,0,0,0,0|1,0,1]=4 458 B11R1.222 C#C[C@@H](O)C1=C(F)C=CC=C1 AC5690 [0,2,0,0,0,0|1,0,1]=4 459 B11R1.222 C#C[C@@H](O)C1=C(O)C=CC=C1 AC5065 [0,2,0,0,0,0|1,0,1]=4 460 B11R1.222 C=C[C@H](N)C1=C(Br)C=CC=C1 N15249 [0,2,0,0,0,0|1,0,0]=3 461 B11R1.222 C=C[C@H](N)C1=C(Br)C=CC=C1 N15250 [0,2,0,0,0,0|1,0,0]=3 462 B11R1.222 C=C[C@H](N)C1=C(Br)C=CC=C1 N15251 [0,2,0,0,0,0|1,0,0]=3 463 B11R1.222 C=C[C@H](N)C1=C(C)C=CC=C1 N15259 [0,2,0,0,0,0|1,0,0]=3 464 B11R1.222 C=C[C@H](N)C1=C(C)C=CC=C1 N15260 [0,2,0,0,0,0|1,0,0]=3 465 B11R1.222 C=C[C@H](N)C1=C(C)C=CC=C1 N15261 [0,2,0,0,0,0|1,0,0]=3 466 B11R1.222 C=C[C@H](N)C1=C(Cl)C=CC=C1 N15239 [0,2,0,0,0,0|1,0,0]=3 467 B11R1.222 C=C[C@H](N)C1=C(Cl)C=CC=C1 N15240 [0,2,0,0,0,0|1,0,0]=3 468 B11R1.222 C=C[C@H](N)C1=C(Cl)C=CC=C1 N15241 [0,2,0,0,0,0|1,0,0]=3 469 B11R1.222 C=C[C@H](N)C1=C(F)C=CC=C1 N15232 [0,2,0,0,0,0|1,0,0]=3 470 B11R1.222 C=C[C@H](N)C1=C(F)C=CC=C1 N15233 [0,2,0,0,0,0|1,0,0]=3 471 B11R1.222 C=C[C@H](N)C1=C(F)C=CC=C1 N15234 [0,2,0,0,0,0|1,0,0]=3 472 B11R1.222 C=C[C@H](N)C1=C(O)C=CC=C1 N15292 [0,2,0,0,0,0|1,0,0]=3 473 B11R1.222 C=C[C@H](N)C1=C(O)C=CC=C1 N15293 [0,2,0,0,0,0|1,0,0]=3 474 B11R1.222 C=C[C@H](N)C1=C(O)C=CC=C1 N15294 [0,2,0,0,0,0|1,0,0]=3 475 B11R1.222 C=C[C@H](N)C1=NC=CC=C1C N13860 [0,2,0,0,0,0|2,0,0]=4 476 B11R1.222 C=C[C@H](N)C1=NC=CC=C1C N13861 [0,2,0,0,0,0|2,0,0]=4 477 B11R1.222 C=C[C@H](N)C1=NC=CC=C1C N13864 [0,2,0,0,0,0|2,0,0]=4 478 B11R1.222 C=C[C@H](N)C1=NC=CC=C1C N13865 [0,2,0,0,0,0|2,0,0]=4 479 B11R1.222 C=C[C@H](N)C1=NC=CC=C1C N13866 [0,2,0,0,0,0|2,0,0]=4 480 B11R1.222 CC1=C([C@@H](N)CF)C=CC=C1 N14610 [0,2,0,0,0,0|1,0,1]=4 481 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13426 [0,2,0,0,0,0|1,0,1]=4 482 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13427 [0,2,0,0,0,0|1,0,1]=4 483 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13428 [0,2,0,0,0,0|1,0,1]=4 484 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13449 [0,2,0,0,0,0|1,0,1]=4 485 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13450 [0,2,0,0,0,0|1,0,1]=4 486 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13451 [0,2,0,0,0,0|1,0,1]=4 487 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 N15069 [0,2,0,0,0,0|0,0,2]=4 488 B11R1.222 CC[C@H](C)C1=C(N)C=CC=C1 35361 [0,2,0,0,0,0|1,0,1]=4 489 B11R1.222 CC[C@H](N)C1=C(Br)C=CC=C1 N13015 [0,2,0,0,0,0|1,0,1]=4 490 B11R1.222 CC[C@H](O)C1=C(Br)C=CC=C1 N12628 [0,2,0,0,0,0|1,0,1]=4 491 B11R1.222 CC[C@H](O)C1=C(C)C=CC=C1 N14414 [0,2,0,0,0,0|1,0,1]=4 492 B11R1.222 CC[C@H](O)C1=C(Cl)C=CC=C1 N14413 [0,2,0,0,0,0|1,0,1]=4 493 B11R1.222 CN[C@@H](C)C1=C(Br)C=CC=C1 N12718 [0,2,0,0,0,0|2,0,0]=4 494 B11R1.222 CN[C@@H](C)C1=C(C)C=CC=C1 N12531 [0,2,0,0,0,0|2,0,0]=4 495 B11R1.222 CN[C@@H](C)C1=C(O)C=CC=C1 N12719 [0,2,0,0,0,0|2,0,0]=4 496 B11R1.222 N#C[C@@H](N)C1=C(F)C=CC=C1 AT10485 [0,2,0,0,0,0|1,0,1]=4 497 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13418 [0,2,0,0,0,0|1,0,1]=4 498 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13419 [0,2,0,0,0,0|1,0,1]=4 499 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13441 [0,2,0,0,0,0|1,0,1]=4 500 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13442 [0,2,0,0,0,0|1,0,1]=4 501 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13403 [0,2,0,0,0,0|1,0,1]=4 502 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13409 [0,2,0,0,0,0|1,0,1]=4 503 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13410 [0,2,0,0,0,0|1,0,1]=4 504 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13390 [0,2,0,0,0,0|1,0,1]=4 505 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13391 [0,2,0,0,0,0|1,0,1]=4 506 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13392 [0,2,0,0,0,0|1,0,1]=4 507 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13393 [0,2,0,0,0,0|1,0,1]=4 508 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13394 [0,2,0,0,0,0|1,0,1]=4 509 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13395 [0,2,0,0,0,0|1,0,1]=4 510 B11R1.222 NC[C@H](O)C1=C(Br)C=CC=C1 71742 [0,2,0,0,0,0|1,0,1]=4 511 B11R1.222 NC[C@H](O)C1=C(F)C=CC=C1 C78140 [0,2,0,0,0,0|1,0,1]=4 512 B11R1.222 NC[C@H](O)C1=C(I)C=CC=C1 O10641 [0,2,0,0,0,0|1,0,1]=4 513 B11R1.222 N[C@@H](CF)C1=C(F)C=CC=C1 N14609 [0,2,0,0,0,0|1,0,1]=4 514 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 C77783 [0,2,0,0,0,0|0,0,2]=4 515 B11R1.222 N[C@@H](CO)C1=C(O)C=CC=C1 N15244 [0,2,0,0,0,0|0,0,2]=4 516 B11R1.222 N[C@@H](CO)C1=C(O)C=CC=C1 N15255 [0,2,0,0,0,0|0,0,2]=4 517 B11R1.605 CC1=CC=CC(Cl)=C1N=C=O D96311 [0,2,0,0,0,0|1,0,1]=4 518 B11R1.605 CNCC1=C(F)C=CC=C1F 36785 [0,2,0,0,0,0|2,0,0]=4 519 B11R1.605 ClC1=CC=CC(Cl)=C1CCBr C78204 [0,2,0,0,0,0|1,0,1]=4 520 B11R1.605 NCCC1=C(F)C=CC=C1F AT21561 [0,2,0,0,0,0|1,0,1]=4 521 B11R1.605 NCCC1=C(F)C=CC=C1O F50611 [0,2,0,0,0,0|1,0,1]=4 522 B11R1.605 O=CCC1=C(F)C=CC=C1F 36768 [0,2,0,0,0,0|0,0,0]=2 523 B11R1.605 OCCC1=C(F)C=CC=C1F A50722 [0,2,0,0,0,0|0,0,2]=4 524 B11R1.23 C#C[C@@H](O)C1=CC(C)=CC=C1 AC5841 [0,2,0,0,0,0|1,0,1]=4 525 B11R1.23 C#C[C@@H](O)C1=CC=CC(Br)=C1 AC5836 [0,2,0,0,0,0|1,0,1]=4 526 B11R1.23 C#C[C@@H](O)C1=CC=CC(Cl)=C1 AC5834 [0,2,0,0,0,0|1,0,1]=4 527 B11R1.23 C=C[C@H](N)C1=CC(C)=CC=C1 N15262 [0,2,0,0,0,0|1,0,0]=3 528 B11R1.23 C=C[C@H](N)C1=CC(C)=CC=C1 N15263 [0,2,0,0,0,0|1,0,0]=3 529 B11R1.23 C=C[C@H](N)C1=CC(C)=CC=C1 N15264 [0,2,0,0,0,0|1,0,0]=3 530 B11R1.23 C=C[C@H](N)C1=CC=CC(Br)=C1 N15252 [0,2,0,0,0,0|1,0,0]=3 531 B11R1.23 C=C[C@H](N)C1=CC=CC(Br)=C1 N15253 [0,2,0,0,0,0|1,0,0]=3 532 B11R1.23 C=C[C@H](N)C1=CC=CC(Br)=C1 N15254 [0,2,0,0,0,0|1,0,0]=3 533 B11R1.23 C=C[C@H](N)C1=CC=CC(Cl)=C1 N15242 [0,2,0,0,0,0|1,0,0]=3 534 B11R1.23 C=C[C@H](N)C1=CC=CC(Cl)=C1 N15243 [0,2,0,0,0,0|1,0,0]=3 535 B11R1.23 C=C[C@H](N)C1=CC=CC(Cl)=C1 N15245 [0,2,0,0,0,0|1,0,0]=3 536 B11R1.23 C=C[C@H](N)C1=CC=CC(F)=C1 N15235 [0,2,0,0,0,0|1,0,0]=3 537 B11R1.23 C=C[C@H](N)C1=CC=CC(F)=C1 N15236 [0,2,0,0,0,0|1,0,0]=3 538 B11R1.23 C=C[C@H](N)C1=CC=CC(O)=C1 N15295 [0,2,0,0,0,0|1,0,0]=3 539 B11R1.23 C=C[C@H](N)C1=CC=CC(O)=C1 N15296 [0,2,0,0,0,0|1,0,0]=3 540 B11R1.23 C=C[C@H](N)C1=CC=CC(O)=C1 N15297 [0,2,0,0,0,0|1,0,0]=3 541 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13429 [0,2,0,0,0,0|1,0,1]=4 542 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13430 [0,2,0,0,0,0|1,0,1]=4 543 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13431 [0,2,0,0,0,0|1,0,1]=4 544 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13452 [0,2,0,0,0,0|1,0,1]=4 545 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13453 [0,2,0,0,0,0|1,0,1]=4 546 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13454 [0,2,0,0,0,0|1,0,1]=4 547 B11R1.23 CC1=CC=CC([C@@H](O)CN)=C1 C78286 [0,2,0,0,0,0|1,0,1]=4 548 B11R1.23 CC[C@H](O)C1=CC(C)=CC=C1 N14416 [0,2,0,0,0,0|1,0,1]=4 549 B11R1.23 CC[C@H](O)C1=CC=CC(Br)=C1 N12527 [0,2,0,0,0,0|1,0,1]=4 550 B11R1.23 CC[C@H](O)C1=CC=CC(Cl)=C1 N12311 [0,2,0,0,0,0|1,0,1]=4 551 B11R1.23 CN[C@@H](C)C1=CC=CC(F)=C1 N12243 [0,2,0,0,0,0|2,0,0]=4 552 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13420 [0,2,0,0,0,0|1,0,1]=4 553 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13421 [0,2,0,0,0,0|1,0,1]=4 554 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13422 [0,2,0,0,0,0|1,0,1]=4 555 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13443 [0,2,0,0,0,0|1,0,1]=4 556 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13445 [0,2,0,0,0,0|1,0,1]=4 557 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13411 [0,2,0,0,0,0|1,0,1]=4 558 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13412 [0,2,0,0,0,0|1,0,1]=4 559 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13413 [0,2,0,0,0,0|1,0,1]=4 560 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13435 [0,2,0,0,0,0|1,0,1]=4 561 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13436 [0,2,0,0,0,0|1,0,1]=4 562 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13437 [0,2,0,0,0,0|1,0,1]=4 563 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13396 [0,2,0,0,0,0|1,0,1]=4 564 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13397 [0,2,0,0,0,0|1,0,1]=4 565 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13398 [0,2,0,0,0,0|1,0,1]=4 566 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13399 [0,2,0,0,0,0|1,0,1]=4 567 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13404 [0,2,0,0,0,0|1,0,1]=4 568 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13405 [0,2,0,0,0,0|1,0,1]=4 569 B11R1.23 NC[C@H](O)C1=CC=CC(Br)=C1 58439 [0,2,0,0,0,0|1,0,1]=4 570 B11R1.23 NC[C@H](O)C1=CC=CC(Br)=C1 71528 [0,2,0,0,0,0|1,0,1]=4 571 B11R1.23 NC[C@H](O)C1=CC=CC(Br)=C1 92116 [0,2,0,0,0,0|1,0,1]=4 572 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 58428 [0,2,0,0,0,0|1,0,1]=4 573 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 C78287 [0,2,0,0,0,0|1,0,1]=4 574 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 D77208 [0,2,0,0,0,0|1,0,1]=4 575 B11R1.23 N[C@@H](CF)C1=CC=CC(Br)=C1 N14613 [0,2,0,0,0,0|1,0,1]=4 576 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 N12818 [0,2,0,0,0,0|0,0,2]=4 577 B11R1.23 O=CC(=O)C1=CC=CC(Cl)=C1 AB10250 [0,2,0,0,0,0|0,0,1]=3 578 B11R1.23 O[C@@H](CCl)C1=CC=CC(Br)=C1 58437 [0,2,0,0,0,0|1,0,1]=4 579 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 58424 [0,2,0,0,0,0|1,0,1]=4 580 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 C72678 [0,2,0,0,0,0|1,0,1]=4 581 B11R1.24 BrCCCC1=CC=CC(Br)=C1 C77758 [0,2,0,0,0,0|1,0,1]=4 582 B11R1.24 BrCCOC1=CC=CC(Br)=C1 98063 [0,2,0,0,0,0|1,0,1]=4 583 B11R1.24 CC1=CC=CC(CCC=O)=C1 C10532 [0,2,0,0,0,0|0,0,0]=2 584 B11R1.24 CCOCC1=CC=CC(Br)=C1 F17773 [0,2,0,0,0,0|1,0,1]=4 585 B11R1.24 CNCCC1=CC=CC(Br)=C1 C78466 [0,2,0,0,0,0|1,0,1]=4 586 B11R1.24 ClC1=CC=CC(CCCBr)=C1 C78574 [0,2,0,0,0,0|1,0,1]=4 587 B11R1.24 N#CCCC1=CC=CC(F)=C1 97618 [0,2,0,0,0,0|1,0,1]=4 588 B11R1.24 N#CCOC1=CC(O)=CC=C1 C77746 [0,2,0,0,0,0|1,0,1]=4 589 B11R1.24 NC1=CC=CC(OCCO)=C1 C78268 [0,2,0,0,0,0|0,0,2]=4 590 B11R1.24 NCCCC1=CC=CC(F)=C1 97619 [0,2,0,0,0,0|1,0,1]=4 591 B11R1.24 NCCCC1=CC=CC(N)=C1 C78147 [0,2,0,0,0,0|1,0,1]=4 592 B11R1.24 NCCCC1=CC=CC(O)=C1 C78310 [0,2,0,0,0,0|1,0,1]=4 593 B11R1.24 O=CCCC1=CC(O)=CC=C1 F19734 [0,2,0,0,0,0|0,0,0]=2 594 B11R1.24 O=CNCC1=CC=CC(F)=C1 Y10034 [0,2,0,0,0,0|0,0,0]=2 595 B11R1.24 O=C\C=C\C1=CC=CC(F)=C1 FD10704 [0,2,0,0,0,0|0,0,1]=3 596 B11R1.24 [C-]#[N+]CCC1=CC=CC(F)=C1 50335 [0,2,0,0,0,0|1,0,1]=4 597 B11R1.34 C=CCC1=CC(Br)=CC(F)=C1 C76836 [0,2,0,0,0,0|1,0,0]=3 598 B11R1.34 COCC1=CC(Br)=CC(Br)=C1 AT26748 [0,2,0,0,0,0|2,0,0]=4 599 B11R1.34 COCC1=CC(Br)=CC(F)=C1 94138 [0,2,0,0,0,0|2,0,0]=4 600 B11R1.34 COCC1=CC(F)=CC(F)=C1 AT26699 [0,2,0,0,0,0|2,0,0]=4 601 B11R1.34 ClC1=CC(Cl)=CC(CCBr)=C1 C78597 [0,2,0,0,0,0|1,0,1]=4 602 B11R1.34 N#CCC1=CC(Br)=CC(O)=C1 D96286 [0,2,0,0,0,0|1,0,1]=4 603 B11R1.34 NCCC1=CC(Cl)=CC(Cl)=C1 F12494 [0,2,0,0,0,0|1,0,1]=4 604 B11R1.34 NOCC1=CC(Cl)=CC(Cl)=C1 D74083 [0,2,0,0,0,0|2,0,0]=4 605 B11R1.34 OCCC1=CC(Br)=CC(Br)=C1 AT19150 [0,2,0,0,0,0|0,0,2]=4 606 B11R1.34 OCCC1=CC(O)=CC(O)=C1 AT19148 [0,2,0,0,0,0|0,0,2]=4 607 B11R1.157 CC(=O)CC1=CC(C)=CC=C1 N12785 [0,2,0,0,0,0|0,0,0]=2 608 B11R1.157 CC(=O)NC1=CC=CC(Cl)=N1 F17978 [0,2,0,0,0,0|2,0,0]=4 609 B11R1.157 CC(C)CC1=CC=CC(N)=C1 O11024 [0,2,0,0,0,0|1,0,1]=4 610 B11R1.157 CC1=CC(CC(=O)O)=NC=N1 C91524 [0,2,0,0,0,0|2,0,0]=4 611 B11R1.157 CC1=CC=CC(CC(=O)O)=N1 AC5601 [0,2,0,0,0,0|1,0,0]=3 612 B11R1.157 CC1=CC=CC(C[C@H](C)N)=C1 N11054 [0,2,0,0,0,0|1,0,1]=4 613 B11R1.157 C[C@H](N)CC1=CC=CC(Br)=C1 E72139 [0,2,0,0,0,0|1,0,1]=4 614 B11R1.157 C[C@H](N)CC1=CC=CC(Cl)=C1 83690 [0,2,0,0,0,0|1,0,1]=4 615 B11R1.157 C[C@H](N)CC1=CC=CC(Cl)=C1 N11066 [0,2,0,0,0,0|1,0,1]=4 616 B11R1.157 C[C@H](N)CC1=CC=CC(F)=C1 N10878 [0,2,0,0,0,0|1,0,1]=4 617 B11R1.157 C[S@](=O)CC1=CC(N)=CC=C1 AT15220 [0,2,0,0,0,0|1,0,0]=3 618 B11R1.157 N=C(N)NC1=CC=CC(Cl)=C1 C12447 [0,2,0,0,0,0|2,0,0]=4 619 B11R1.157 N=C(N)NC1=CC=CC(F)=C1 C16183 [0,2,0,0,0,0|2,0,0]=4 620 B11R1.157 N=C(N)NC1=CC=CC(O)=C1 S11159 [0,2,0,0,0,0|2,0,0]=4 621 B11R1.157 NC(=O)NC1=CC(N)=CC=C1 F19865 [0,2,0,0,0,0|1,0,0]=3 622 B11R1.157 NC1=CC=CC(CC(=O)O)=N1 S12253 [0,2,0,0,0,0|1,0,0]=3 623 B11R1.157 NC1=NC=CC(CC(=O)O)=C1 N10485 [0,2,0,0,0,0|1,0,0]=3 624 B11R1.157 NC1=NC=CC(CC(=O)O)=C1 Y10709 [0,2,0,0,0,0|1,0,0]=3 625 B11R1.157 O=C(O)CC1=CC(Br)=CN=C1 AT23257 [0,2,0,0,0,0|1,0,0]=3 626 B11R1.157 OB(O)CC1=CC=CC(F)=C1 D79888 [0,2,0,0,0,0|1,0,1]=4 627 B11R1.189 CCCC1=CC=CC(OC)=C1 AC9509 [0,2,0,0,0,0|1,0,1]=4 628 B11R1.189 COCC1=CC(C#N)=CC=C1 O10889 [0,2,0,0,0,0|2,0,0]=4 629 B11R1.189 COCC1=CC=CC(OC)=C1 N11528 [0,2,0,0,0,0|2,0,0]=4 630 B11R1.189 N#CC1=CC(CCN)=CC=C1 72737 [0,2,0,0,0,0|1,0,1]=4 631 B11R1.7 CC(C)(C=O)C1=CC=CC=C1 AT22663 [0,2,0,0,0,0|0,0,0]=2 632 B11R1.7 CC(C)(CBr)C1=CC=CC=C1 D78707 [0,2,0,0,0,0|1,0,1]=4 633 B11R1.7 C[C@@](N)(C#N)C1=CC=CC=C1 AC6143 [0,2,0,0,0,0|1,0,1]=4 634 B11R1.7 C[C@](N)(CO)C1=CC=CC=C1 N12768 [0,2,0,0,0,0|0,0,2]=4 635 B11R1.12 CCC(CC)C1=CC=CC=C1 T71625 [0,2,0,0,0,0|1,0,1]=4 636 B11R1.12 CN[C@@H](CO)C1=CC=CC=C1 N12976 [0,2,0,0,0,0|0,0,2]=4 637 B11R1.12 N#C\C(=C\O)C1=CC=CC=C1 58278 [0,2,0,0,0,0|0,0,2]=4 638 B11R1.16 C#CC[C@H](O)C1=CC=CC=C1 W15219 [0,2,0,0,0,0|1,0,1]=4 639 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 N12265 [0,2,0,0,0,0|1,0,1]=4 640 B11R1.16 CN(CCBr)C1=CC=CC=C1 W15250 [0,2,0,0,0,0|1,0,1]=4 641 B11R1.16 CNC[C@H](C)C1=CC=CC=C1 C11240 [0,2,0,0,0,0|1,0,1]=4 642 B11R1.16 CNC[C@H](O)C1=CC=CC=C1 C11214 [0,2,0,0,0,0|1,0,1]=4 643 B11R1.16 COC[C@H](N)C1=CC=CC=C1 AC6537 [0,2,0,0,0,0|0,0,2]=4 644 B11R1.16 NCC[C@H](N)C1=CC=CC=C1 N14729 [0,2,0,0,0,0|1,0,1]=4 645 B11R1.16 NCC[C@H](N)C1=CC=CC=C1 N14730 [0,2,0,0,0,0|1,0,1]=4 646 B11R1.16 OCC[C@H](O)C1=CC=CC=C1 C80043 [0,2,0,0,0,0|0,0,2]=4 647 B11R1.16 [N-]=[N+]=CC(=O)C1=CC=CC=C1 AT25592 [0,2,0,0,0,0|1,0,1]=4 648 B11R1.36 CC(=O)N(C)C1=NC=CC=C1 63680 [0,2,0,0,0,0|2,0,0]=4 649 B11R1.36 CC(=O)N(Cl)C1=CC=CC=C1 T71089 [0,2,0,0,0,0|1,0,0]=3 650 B11R1.36 CC(=O)[C@H](N)C1=CC=CC=C1 N15518 [0,2,0,0,0,0|0,0,0]=2 651 B11R1.36 CC(O)C(N)C1=CC=CC=C1 N11175 [0,2,0,0,0,0|0,0,2]=4 652 B11R1.36 CC(O)C(N)C1=CC=CC=C1 Y13368 [0,2,0,0,0,0|0,0,2]=4 653 B11R1.36 CC(O)[C@H](N)C1=CC=CC=C1 N15517 [0,2,0,0,0,0|0,0,2]=4 654 B11R1.36 C[C@@H](C(=O)[O-])C1=NC=CN=C1 97744 [0,2,0,0,0,0|2,0,0]=4 655 B11R1.36 C[C@@H](O)[C@H](N)C1=CC=CC=C1 N15522 [0,2,0,0,0,0|0,0,2]=4 656 B11R1.36 C[C@H](O)[C@H](N)C1=CC=CC=C1 N15519 [0,2,0,0,0,0|0,0,2]=4 657 B11R1.36 N[C@@H](C(=O)O)C1=CC=NC=C1 AT10021 [0,2,0,0,0,0|1,0,0]=3 658 B11R1.36 N[C@@H](C(=O)O)C1=CC=NC=C1 F15634 [0,2,0,0,0,0|1,0,0]=3 659 B11R1.36 N[C@@H](C(=O)O)C1=CN=CC=C1 AT21867 [0,2,0,0,0,0|1,0,0]=3 660 B11R1.36 N[C@@H](C(=O)O)C1=NC=CC=C1 AC3554 [0,2,0,0,0,0|1,0,0]=3 661 B11R1.36 N[C@@H](C(=O)O)C1=NC=CN=C1 66504 [0,2,0,0,0,0|2,0,0]=4 662 B11R1.36 N[C@H](C1=CC=CC=C1)C(F)F 94363 [0,2,0,0,0,0|1,0,1]=4 663 B11R1.36 O[C@H](C1=CC=CC=C1)C(F)F AT21493 [0,2,0,0,0,0|1,0,1]=4 664 B11R1.36 [2H]C([2H])=C([2H])C1=CC=CC=C1 D99675 [0,2,0,0,0,0|1,0,1]=4 665 B11R1.28 CCNCCC1=CC=CC=C1 AC5622 [0,2,0,0,0,0|1,0,1]=4 666 B11R1.28 NCC\C=C\C1=CC=CC=C1 F15194 [0,2,0,0,0,0|1,0,1]=4 667 B11R1.28 NNCCOC1=CC=CC=C1 AC4849 [0,2,0,0,0,0|1,0,1]=4 668 B11R1.28 NOCCOC1=CC=CC=C1 AT21707 [0,2,0,0,0,0|0,0,2]=4 669 B11R1.40 CC[C@H](N)CC1=CC=CC=C1 74053 [0,2,0,0,0,0|1,0,1]=4 670 B11R1.40 CNC(=S)NC1=CC=CC=C1 T72207 [0,2,0,0,0,0|1,1,0]=4 671 B11R1.40 COC(=O)CC1=CN=CN=C1 AT13806 [0,2,0,0,0,0|2,0,0]=4 672 B11R1.40 C[C@H](C=O)CC1=CC=CC=C1 F16111 [0,2,0,0,0,0|0,0,0]=2 673 B11R1.40 Cl\C=C(\Cl)OC1=CC=CC=C1 W12901 [0,2,0,0,0,0|1,0,1]=4 674 B11R1.40 N#CC(=O)CC1=CC=CC=C1 AC5929 [0,2,0,0,0,0|0,0,0]=2 675 B11R1.40 N#C[C@@H](F)SC1=CC=CC=C1 D90673 [0,2,0,0,0,0|1,0,1]=4 676 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14383 [0,2,0,0,0,0|1,0,1]=4 677 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14384 [0,2,0,0,0,0|1,0,1]=4 678 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14385 [0,2,0,0,0,0|1,0,1]=4 679 B11R1.40 NNC(=O)CC1=NC=CC=C1 AT10923 [0,2,0,0,0,0|1,0,0]=3 680 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 C78372 [0,2,0,0,0,0|0,0,2]=4 681 B11R1.40 O=C(CCl)NC1=CN=CC=C1 C78463 [0,2,0,0,0,0|2,0,0]=4 682 B11R1.40 O\N=C(/Cl)CC1=CC=CC=C1 AC6652 [0,2,0,0,0,0|0,0,1]=3 683 B11R1.91 CC(=O)CCC1=CC=NC=C1 AT24518 [0,2,0,0,0,0|1,0,0]=3 684 B11R1.91 CC(=O)COC1=NC=CC=C1 AC9007 [0,2,0,0,0,0|1,0,0]=3 685 B11R1.91 C[C@H](N)COC1=CC=CC=C1 N12753 [0,2,0,0,0,0|1,0,1]=4 686 B11R1.91 C[C@H](N)COC1=CC=CC=C1 N12763 [0,2,0,0,0,0|1,0,1]=4 687 B11R1.91 C[C@H](N)CSC1=CC=CC=C1 AT26670 [0,2,0,0,0,0|1,0,1]=4 688 B11R1.91 N=C(N)CCC1=NC=CC=C1 C14497 [0,2,0,0,0,0|2,0,0]=4 689 B11R1.91 N=C(N)NCC1=CC=CC=C1 S12114 [0,2,0,0,0,0|1,0,0]=3 690 B11R1.91 NC(=O)CCC1=NC=CC=C1 AC6900 [0,2,0,0,0,0|1,0,0]=3 691 B11R1.91 NC(=O)CCC1=NC=NC=C1 F13616 [0,2,0,0,0,0|2,0,0]=4 692 B11R1.91 NC(N)=NCC1=CC=CC=C1 H10078 [0,2,0,0,0,0|1,0,0]=3 693 B11R1.91 O=C(O)CCC1=NC=CN=C1 N12623 [0,2,0,0,0,0|2,0,0]=4 694 B11R1.91 O=C(O)CSC1=NC=CC=C1 AT20604 [0,2,0,0,0,0|1,0,0]=3 695 B11R1.509 CC(C)(Cl)CC1=CC=CC=C1 AC4724 [0,2,0,0,0,0|1,0,1]=4 696 B11R1.509 O=S(=O)(Cl)CC1=CC=NC=C1 AR1991 [0,2,0,0,0,0|2,0,0]=4 697 B11R1.509 O=S(=O)(Cl)CC1=CN=CC=C1 AR1640 [0,2,0,0,0,0|2,0,0]=4 698 B11R1.509 [2H]C([2H])([2H])CC1=CC=CC=C1 D99355 [0,2,0,0,0,0|1,0,1]=4 699 B11R2.34 CC1=CC=C(C2CC2)C=C1 AC9737 [0,1,0,1,0,0|1,0,1]=4 700 B11R2.34 ClC1=CC=C(C2CC2)C=C1 AC9567 [0,1,0,1,0,0|1,0,1]=4 701 B11R2.36 CC1=CC2=C(C=C1)CNC2 71833 [0,1,0,1,0,0|2,0,0]=4 702 B11R2.36 CC1=CC2=C(C=C1)CNC2 W10108 [0,1,0,1,0,0|2,0,0]=4 703 B11R2.36 ClC1=CC2=C(C=C1)OC=C2 A51024 [0,1,0,1,0,0|0,0,2]=4 704 B11R2.36 FC1=CC2=C(C=C1)CC=C2 N14223 [0,1,0,1,0,0|1,0,0]=3 705 B11R2.36 FC1=CC2=C(C=C1)CCC2 36515 [0,1,0,1,0,0|1,0,1]=4 706 B11R2.36 FC1=CC2=C(C=C1)N=CO2 AC5634 [0,1,0,1,0,0|1,0,1]=4 707 B11R2.36 FC1=CC2=C(C=C1)SC=C2 P15215 [0,1,0,1,0,0|0,1,1]=4 708 B11R2.36 IC1=CC2=C(C=C1)CCC2 C12643 [0,1,0,1,0,0|1,0,1]=4 709 B11R2.36 IC1=CC2=C(C=C1)CNC2 32000 [0,1,0,1,0,0|2,0,0]=4 710 B11R2.36 IC1=CC2=C(C=C1)SC=N2 D78574 [0,1,0,1,0,0|1,1,0]=4 711 B11R2.36 NC1=CC2=C(C=C1)CNC2 SC4171 [0,1,0,1,0,0|2,0,0]=4 712 B11R2.36 NC1=CC2=C(C=C1)OCC2 88994 [0,1,0,1,0,0|0,0,2]=4 713 B11R2.36 OC1=CC2=C(C=CS2)C=C1 A11012 [0,1,0,1,0,0|0,1,1]=4 714 B11R2.10 ClC1=CC2=C(C=CC=C2)O1 AC6512 [0,1,0,1,0,0|0,0,2]=4 715 B11R2.10 FC1=NC2=C(C=CC=C2)S1 T71604 [0,1,0,1,0,0|1,1,0]=4 716 B11R2.10 N=C1CC2=C(C=CC=C2)N1 30671 [0,1,0,1,0,0|1,0,0]=3 717 B11R2.10 NC1=CC2=C(C=CC=C2)N1 79767 [0,1,0,1,0,0|1,0,1]=4 718 B11R2.10 NC1=CC2=C(C=CC=C2)N1 F13373 [0,1,0,1,0,0|1,0,1]=4 719 B11R2.10 O=C1C=C2C=CC=CN2N1 W16687 [0,1,0,1,0,0|1,0,1]=4 720 B11R2.10 O=C1CC2=C(C=CC=C2)S1 A51238 [0,1,0,1,0,0|0,0,0]=2 721 B11R2.10 O=C1CC2=C(C=NC=C2)N1 61718 [0,1,0,1,0,0|1,0,0]=3 722 B11R2.10 O=C1NC2=C(C=CC=N2)S1 C72885 [0,1,0,1,0,0|2,0,0]=4 723 B11R2.10 O=C1NC2=CC=CN=C2S1 F13119 [0,1,0,1,0,0|2,0,0]=4 724 B11R2.20 C1=CC2=C(C=N1)N=CCN2 D87594 [0,1,0,1,0,0|2,0,0]=4 725 B11R2.55 CC1=C(C2CC2)C=CC=C1 AC9736 [0,1,0,1,0,0|1,0,1]=4 726 B11R2.55 ClC1=C([C@@H]2CO2)C=CC=C1 AT10463 [0,1,0,1,0,0|0,0,2]=4 727 B11R2.55 ClC1=C([C@@H]2CO2)C=CC=C1 CK2535 [0,1,0,1,0,0|0,0,2]=4 728 B11R2.55 NC1=C(C2CC2)C=CC=C1 A10978 [0,1,0,1,0,0|1,0,1]=4 729 B11R2.55 OC1=C(C2CC2)C=CC=C1 91444 [0,1,0,1,0,0|1,0,1]=4 730 B11R2.106 BrC1=C2CCOC2=CC=C1 F12556 [0,1,0,1,0,0|0,0,2]=4 731 B11R2.106 CC1=C2N=CNC2=CC=C1 31265 [0,1,0,1,0,0|2,0,0]=4 732 B11R2.106 CC1=CC=CC2=C1CNC2 W10109 [0,1,0,1,0,0|2,0,0]=4 733 B11R2.106 CC1=CC=CC2=C1N=CO2 F18678 [0,1,0,1,0,0|1,0,1]=4 734 B11R2.106 ClC1=C2CCCC2=CC=C1 N13077 [0,1,0,1,0,0|1,0,1]=4 735 B11R2.106 ClC1=C2CNCC2=CC=C1 FD13081 [0,1,0,1,0,0|2,0,0]=4 736 B11R2.106 ClC1=C2OC=NC2=CC=C1 AC3340 [0,1,0,1,0,0|1,0,1]=4 737 B11R2.106 ClC1=C2OCCC2=CC=C1 F53809 [0,1,0,1,0,0|0,0,2]=4 738 B11R2.106 FC1=C2NCCC2=CC=C1 C73504 [0,1,0,1,0,0|1,0,1]=4 739 B11R2.106 FC1=C2OC=NC2=CC=C1 AC3567 [0,1,0,1,0,0|1,0,1]=4 740 B11R2.106 IC1=C2CCOC2=CC=C1 E72245 [0,1,0,1,0,0|0,0,2]=4 741 B11R2.106 NC1=C2N=CNC2=CC=C1 P10197 [0,1,0,1,0,0|2,0,0]=4 742 B11R2.988 NC[C@H]1CC2=C1C=CC=C2 AT20374 [0,1,0,1,0,0|1,0,1]=4 743 B11R2.988 OC[C@H]1CC2=C1C=CC=C2 67862 [0,1,0,1,0,0|0,0,2]=4 744 B11R2.35 CC1=CC=CC(C2CC2)=C1 AC9451 [0,1,0,1,0,0|1,0,1]=4 745 B11R2.35 ClC1=CC(C2CC2)=CC=C1 97830 [0,1,0,1,0,0|1,0,1]=4 746 B11R2.35 OC1=CC(C2CC2)=CC=C1 97835 [0,1,0,1,0,0|1,0,1]=4 747 B11R2.1 BrC1=CCC2=C1C=CC=C2 D78625 [0,1,0,1,0,0|1,0,0]=3 748 B11R2.1 CC1=C2C=CC=CC2=NO1 AC6101 [0,1,0,1,0,0|2,0,0]=4 749 B11R2.1 C[C@H]1CNC2=C1C=CC=C2 W18948 [0,1,0,1,0,0|1,0,1]=4 750 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 41003 [0,1,0,1,0,0|1,0,1]=4 751 B11R2.1 N[C@H]1COC2=C1C=CC=C2 I11926 [0,1,0,1,0,0|0,0,2]=4 752 B11R2.1 O=C1COC2=C1C=CC=N2 O11821 [0,1,0,1,0,0|1,0,0]=3 753 B11R2.1 O=C1NCC2=CN=CN=C12 F52126 [0,1,0,1,0,0|2,0,0]=4 754 B11R2.1 OC1=CNC2=C1C=CC=C2 F18139 [0,1,0,1,0,0|0,0,2]=4 755 B11R2.1 OC1=CSC2=C1C=CC=C2 C15915 [0,1,0,1,0,0|0,0,2]=4 756 B11R2.1 O[C@H]1COC2=C1C=CC=C2 AT19563 [0,1,0,1,0,0|0,0,2]=4 757 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 C14923 [0,1,0,1,0,0|1,0,1]=4 758 B11R2.239 C1=CC=C(C2CCC2)C=C1 F52090 [0,1,0,1,0,0|1,0,1]=4 759 B11R2.239 C1=CC=C([C@@H]2CCN2)C=C1 A50749 [0,1,0,1,0,0|1,0,1]=4 760 B7R1.1 ClCC1=CSC=C1 AT17055 [1,0,0,0,1,0|2,0,0]=4 761 B7R1.1 NCC1=COC=C1 61502 [1,0,0,0,1,0|2,0,0]=4 762 B7R1.1 O=CC1=CSN=C1 83208 [1,0,0,0,1,0|2,0,0]=4 763 B7R1.1 OCC1=CC=CN1 AT16114 [1,0,0,0,1,0|1,0,1]=4 764 B7R1.1 SCC1=CC=CS1 T72725 [1,0,0,0,1,0|1,1,0]=4