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|2,0,0]=2 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|2,0,0]=2 5 B9R1.8 CCC[N+]1=CC=CC=C1 T72121 [0,0,0,0,0,0|2,0,0]=2 6 B9R1.8 CCNC1=NC=CN=C1 C76036 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.8 CNCC1=CN=CN=C1 38577 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.8 CNCC1=NC=CC=N1 27199 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.8 CNCC1=NC=CC=N1 72796 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.8 CNCC1=NC=NC=C1 C14477 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.8 CNNC1=CC=CC=C1 C77159 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.8 FCCC1=CC=CC=C1 75534 [0,0,0,0,0,0|1,0,0]=1 13 B9R1.8 IC#CC1=CC=CC=C1 N11813 [0,0,0,0,0,0|1,0,2]=3 14 B9R1.8 NCCC1=CC=CC=C1 T71816 [0,0,0,0,0,0|0,0,0]=0 15 B9R1.8 NCCC1=CC=CC=C1 T72591 [0,0,0,0,0,0|0,0,0]=0 16 B9R1.8 NCCC1=NC=CC=N1 83201 [0,0,0,0,0,0|2,0,0]=2 17 B9R1.8 NCCC1=NC=CC=N1 P10852 [0,0,0,0,0,0|2,0,0]=2 18 B9R1.8 NCCC1=NC=CN=C1 AT22557 [0,0,0,0,0,0|2,0,0]=2 19 B9R1.8 NCCC1=NC=NC=C1 P10950 [0,0,0,0,0,0|2,0,0]=2 20 B9R1.8 NNCC1=NC=CC=C1 P10521 [0,0,0,0,0,0|2,0,0]=2 21 B9R1.8 NNCC1=NC=CN=C1 D78817 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.8 NNCC1=NC=CN=C1 P19174 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.8 OCCC1=CC=NC=C1 T72404 [0,0,0,0,0,0|2,0,0]=2 24 B9R1.8 OCCC1=NN=CC=C1 D77083 [0,0,0,0,0,0|3,0,0]=3 25 B9R1.8 S=C=NC1=NC=CC=C1 C11368 [0,0,0,0,0,0|3,0,1]=4 26 B9R1.8 SCCC1=NC=CC=C1 F18309 [0,0,0,0,0,0|2,0,0]=2 27 B9R1.8 [C-]#[N+]CC1=CC=NC=C1 AC8779 [0,0,0,0,0,0|3,0,0]=3 28 B9R1.8 [C-]#[N+]CC1=CN=CC=C1 F16136 [0,0,0,0,0,0|3,0,0]=3 29 B8R1.2 BrCC1=CN=CN=C1 F52462 [1,0,0,0,0,0|3,0,0]=4 30 B8R1.2 BrCC1=NC=CC=N1 D79434 [1,0,0,0,0,0|3,0,0]=4 31 B8R1.2 C=CC1=CC=CN=C1 71366 [1,0,0,0,0,0|1,0,2]=4 32 B8R1.2 CNC1=CC=CN=N1 79165 [1,0,0,0,0,0|3,0,0]=4 33 B8R1.2 CSC1=NC=CC=N1 O10841 [1,0,0,0,0,0|3,0,0]=4 34 B8R1.2 ClCC1=NC=NC=C1 A10562 [1,0,0,0,0,0|3,0,0]=4 35 B8R1.2 NCC1=CC=CC=C1 T70846 [1,0,0,0,0,0|0,0,0]=1 36 B8R1.2 NNC1=CC=CN=N1 C15759 [1,0,0,0,0,0|3,0,0]=4 37 B8R1.2 NNC1=NC=NC=C1 57488 [1,0,0,0,0,0|3,0,0]=4 38 B8R1.2 SCC1=NC=CN=C1 78318 [1,0,0,0,0,0|3,0,0]=4 39 B8R1.2 [2H]OC1=CC=CC=C1 D99313 [1,0,0,0,0,0|2,0,0]=3 40 B10R1.1 BrC#CC1=CC=C(Br)C=C1 94425 [0,1,0,0,0,0|1,0,2]=4 41 B10R1.1 CC1=CC=C(C#CBr)C=C1 94424 [0,1,0,0,0,0|1,0,2]=4 42 B10R1.1 CC1=CC=C(CNN)C=C1 O10110 [0,1,0,0,0,0|1,0,0]=2 43 B10R1.1 CC1=CC=C(\C=N\O)C=C1 AC8737 [0,1,0,0,0,0|2,0,1]=4 44 B10R1.1 CC1=CN=C(CCN)N=C1 AT18271 [0,1,0,0,0,0|2,0,0]=3 45 B10R1.1 CC1=NC=C(CC#N)C=C1 54748 [0,1,0,0,0,0|1,0,2]=4 46 B10R1.1 CC1=NC=C(CNN)C=C1 F15210 [0,1,0,0,0,0|2,0,0]=3 47 B10R1.1 CCOC1=NC=C(O)C=C1 D75011 [0,1,0,0,0,0|3,0,0]=4 48 B10R1.1 CNCC1=NC=C(Cl)C=C1 AT26664 [0,1,0,0,0,0|3,0,0]=4 49 B10R1.1 COCC1=CC=C(S)C=C1 AT20980 [0,1,0,0,0,0|2,0,0]=3 50 B10R1.1 CSCC1=CC=C(Cl)C=C1 W18700 [0,1,0,0,0,0|2,0,0]=3 51 B10R1.1 ClC1=CC=C(C#CBr)C=C1 94423 [0,1,0,0,0,0|1,0,2]=4 52 B10R1.1 N#CCC1=NC=C(F)C=C1 O10489 [0,1,0,0,0,0|1,0,2]=4 53 B10R1.1 NC1=CC=C(OCF)C=C1 68782 [0,1,0,0,0,0|2,0,0]=3 54 B10R1.1 NCCC1=CC=C(I)C=C1 C78427 [0,1,0,0,0,0|0,0,0]=1 55 B10R1.1 NCCC1=NC=C(Br)C=C1 P10593 [0,1,0,0,0,0|1,0,0]=2 56 B10R1.1 NNCC1=CC=C(Br)C=C1 AC3503 [0,1,0,0,0,0|1,0,0]=2 57 B10R1.1 NNCC1=CC=C(Cl)C=C1 37006 [0,1,0,0,0,0|1,0,0]=2 58 B10R1.1 N\N=C\C1=CC=C(O)C=C1 F15571 [0,1,0,0,0,0|1,0,1]=3 59 B10R1.1 O=C1N=CC(CCO)=CN1 AT18210 [0,1,0,0,0,0|3,0,0]=4 60 B10R1.1 O=CNC1=CC=C(F)C=C1 F21300 [0,1,0,0,0,0|2,0,1]=4 61 B10R1.1 OCCC1=CN=C(Br)C=C1 AC9473 [0,1,0,0,0,0|2,0,0]=3 62 B10R1.1 OCCC1=CN=C(F)C=C1 AC9525 [0,1,0,0,0,0|2,0,0]=3 63 B10R1.1 OCCC1=CN=C(S)N=C1 AT18279 [0,1,0,0,0,0|3,0,0]=4 64 B10R1.1 [N-]=[N+]=NC1=CC=C(I)C=C1 AC6317 [0,1,0,0,0,0|2,0,1]=4 65 B10R1.4 C#CCN1C=CC=CC1=O AT19221 [0,1,0,0,0,0|2,0,1]=4 66 B10R1.4 CC1=C(CC=O)C=CC=C1 W16821 [0,1,0,0,0,0|1,0,1]=3 67 B10R1.4 CC1=C(CON)C=CC=C1 D77271 [0,1,0,0,0,0|1,0,0]=2 68 B10R1.4 CC1=CC=CN=C1CC#N C90297 [0,1,0,0,0,0|1,0,2]=4 69 B10R1.4 CCCC1=C(C)C=CC=C1 T71577 [0,1,0,0,0,0|1,0,0]=2 70 B10R1.4 CCCC1=CN=CN=C1Cl F11792 [0,1,0,0,0,0|3,0,0]=4 71 B10R1.4 CCNC1=C(F)C=CC=C1 D87863 [0,1,0,0,0,0|2,0,0]=3 72 B10R1.4 CCNC1=CC=CN=C1O F30124 [0,1,0,0,0,0|3,0,0]=4 73 B10R1.4 CCNC1=NC=CC=C1N AC7989 [0,1,0,0,0,0|3,0,0]=4 74 B10R1.4 CCOC1=C(C)C=CN=C1 AC4346 [0,1,0,0,0,0|3,0,0]=4 75 B10R1.4 CCOC1=C(F)C=CC=N1 F53248 [0,1,0,0,0,0|3,0,0]=4 76 B10R1.4 CCOC1=CC=CN=C1Cl W17868 [0,1,0,0,0,0|3,0,0]=4 77 B10R1.4 CCSC1=C(Br)C=CC=C1 AT20838 [0,1,0,0,0,0|2,0,0]=3 78 B10R1.4 CCSC1=C(O)C=CC=C1 AT20889 [0,1,0,0,0,0|2,0,0]=3 79 B10R1.4 CNCC1=C(F)C=CC=N1 P10655 [0,1,0,0,0,0|3,0,0]=4 80 B10R1.4 CNCC1=C(F)C=CC=N1 P20450 [0,1,0,0,0,0|3,0,0]=4 81 B10R1.4 CNCC1=C(N)C=CC=C1 F13330 [0,1,0,0,0,0|2,0,0]=3 82 B10R1.4 N#CCC1=C(Br)C=NC=C1 C72683 [0,1,0,0,0,0|1,0,2]=4 83 B10R1.4 N#CCN1C=CC=CC1=O AT19223 [0,1,0,0,0,0|1,0,2]=4 84 B10R1.4 NC1=C(CCF)C=NC=C1 P14647 [0,1,0,0,0,0|2,0,0]=3 85 B10R1.4 NCCN1C=CC=CC1=O F15207 [0,1,0,0,0,0|1,0,0]=2 86 B10R1.4 NCCN1C=CC=NC1=O AT13871 [0,1,0,0,0,0|2,0,0]=3 87 B10R1.4 NCCN1C=NC=CC1=O AT13878 [0,1,0,0,0,0|2,0,0]=3 88 B10R1.4 NNCC1=C(Cl)C=CC=C1 W12211 [0,1,0,0,0,0|1,0,0]=2 89 B10R1.4 O=C1C=CC=CN1CCBr AT19229 [0,1,0,0,0,0|2,0,0]=3 90 B10R1.4 O=C1C=CN=CN1CCO AT13876 [0,1,0,0,0,0|3,0,0]=4 91 B10R1.4 O=CCC1=C(Cl)C=CC=C1 W16822 [0,1,0,0,0,0|1,0,1]=3 92 B10R1.10 CC1=CC=CC(CC=O)=C1 74805 [0,1,0,0,0,0|1,0,1]=3 93 B10R1.10 CC1=CC=CC(CCBr)=N1 AC6969 [0,1,0,0,0,0|2,0,0]=3 94 B10R1.10 CC1=CC=CC(CCN)=N1 P19093 [0,1,0,0,0,0|1,0,0]=2 95 B10R1.10 CC1=NC=CC(CNN)=C1 F52070 [0,1,0,0,0,0|2,0,0]=3 96 B10R1.10 CC1=NC=CC(CNN)=C1 F52466 [0,1,0,0,0,0|2,0,0]=3 97 B10R1.10 CCCC1=CC=CC(F)=C1 36946 [0,1,0,0,0,0|1,0,0]=2 98 B10R1.10 CCNC1=CC=CC(Cl)=C1 L10102 [0,1,0,0,0,0|2,0,0]=3 99 B10R1.10 CCNC1=CC=CC(O)=C1 F16135 [0,1,0,0,0,0|2,0,0]=3 100 B10R1.10 CCOC1=CC=CC(S)=C1 T73015 [0,1,0,0,0,0|2,0,0]=3 101 B10R1.10 CCSC1=CC(N)=CC=C1 AT20857 [0,1,0,0,0,0|2,0,0]=3 102 B10R1.10 CNCC1=CC(Cl)=NC=C1 AT26616 [0,1,0,0,0,0|3,0,0]=4 103 B10R1.10 CNCC1=NC(C)=CC=C1 D87644 [0,1,0,0,0,0|3,0,0]=4 104 B10R1.10 CNCC1=NC=CC(Cl)=C1 CS1254 [0,1,0,0,0,0|3,0,0]=4 105 B10R1.10 COCC1=CC(N)=CC=C1 30379 [0,1,0,0,0,0|2,0,0]=3 106 B10R1.10 CSCC1=CC(N)=CC=C1 AT15211 [0,1,0,0,0,0|2,0,0]=3 107 B10R1.10 ClC1=CC=CC(C#CBr)=C1 55375 [0,1,0,0,0,0|1,0,2]=4 108 B10R1.10 N#CCC1=CC(Cl)=CN=C1 93159 [0,1,0,0,0,0|1,0,2]=4 109 B10R1.10 N#CCC1=CC(N)=NC=C1 AT18208 [0,1,0,0,0,0|1,0,2]=4 110 B10R1.10 N#CCC1=CC=CC(Cl)=N1 O10491 [0,1,0,0,0,0|1,0,2]=4 111 B10R1.10 NC1=CC(CCO)=NC=N1 AC8190 [0,1,0,0,0,0|3,0,0]=4 112 B10R1.10 NCCC1=CC=CC(I)=C1 C78608 [0,1,0,0,0,0|0,0,0]=1 113 B10R1.10 NNCC1=CC(Br)=CN=C1 P11105 [0,1,0,0,0,0|2,0,0]=3 114 B10R1.10 NNCC1=CC=CC(Cl)=C1 P15270 [0,1,0,0,0,0|1,0,0]=2 115 B10R1.10 NNCC1=CC=CC(O)=C1 D87672 [0,1,0,0,0,0|1,0,0]=2 116 B10R1.10 N\N=C\C1=CC=CC(O)=C1 F15561 [0,1,0,0,0,0|1,0,1]=3 117 B10R1.10 O=CCC1=CC=CC(Cl)=C1 W16823 [0,1,0,0,0,0|1,0,1]=3 118 B10R1.15 C#C[C@@H](O)C1=CC=NC=C1 O10327 [0,1,0,0,0,0|2,0,1]=4 119 B10R1.15 C#C[C@@H](O)C1=CN=CC=C1 AC5787 [0,1,0,0,0,0|2,0,1]=4 120 B10R1.15 C#C[C@@H](O)C1=NC=CC=C1 AC5788 [0,1,0,0,0,0|2,0,1]=4 121 B10R1.15 C=C(CO)C1=CC=CC=C1 A11577 [0,1,0,0,0,0|1,0,1]=3 122 B10R1.15 CCC(=O)C1=CC=NC=C1 N12310 [0,1,0,0,0,0|2,0,1]=4 123 B10R1.15 CCN(C)C1=NC=CC=C1 T72928 [0,1,0,0,0,0|3,0,0]=4 124 B10R1.15 CC[C@H](N)C1=CC=CC=C1 N12648 [0,1,0,0,0,0|1,0,0]=2 125 B10R1.15 CC[C@H](N)C1=NC=CC=C1 N10611 [0,1,0,0,0,0|2,0,0]=3 126 B10R1.15 CC[C@H](N)C1=NC=CN=C1 P11367 [0,1,0,0,0,0|3,0,0]=4 127 B10R1.15 CC[C@H](N)C1=NC=CN=C1 P15053 [0,1,0,0,0,0|3,0,0]=4 128 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 L10186 [0,1,0,0,0,0|2,0,0]=3 129 B10R1.15 COC(=N)C1=CC=CC=C1 W12775 [0,1,0,0,0,0|2,0,1]=4 130 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1146 [0,1,0,0,0,0|1,0,1]=3 131 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1167 [0,1,0,0,0,0|1,0,1]=3 132 B10R1.15 C[C@H](NO)C1=CC=CC=C1 P10550 [0,1,0,0,0,0|2,0,0]=3 133 B10R1.15 C[C@H](NO)C1=CC=CC=C1 P10551 [0,1,0,0,0,0|2,0,0]=3 134 B10R1.15 C[C@H](ON)C1=CC=CC=C1 AT14528 [0,1,0,0,0,0|1,0,0]=2 135 B10R1.15 C[C@H](ON)C1=CC=CC=C1 AT14530 [0,1,0,0,0,0|1,0,0]=2 136 B10R1.15 NCC(=O)C1=CN=CC=C1 D87739 [0,1,0,0,0,0|1,0,1]=3 137 B10R1.15 NCC(=O)C1=CN=CC=C1 F13353 [0,1,0,0,0,0|1,0,1]=3 138 B10R1.15 NC[C@H](O)C1=CC=NC=C1 C78562 [0,1,0,0,0,0|1,0,0]=2 139 B10R1.15 NC[C@H](O)C1=CN=CC=C1 33361 [0,1,0,0,0,0|1,0,0]=2 140 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y11546 [0,1,0,0,0,0|2,0,0]=3 141 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y12429 [0,1,0,0,0,0|2,0,0]=3 142 B10R1.15 N[C@@H](CO)C1=CN=CC=C1 Y12120 [0,1,0,0,0,0|2,0,0]=3 143 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y12118 [0,1,0,0,0,0|2,0,0]=3 144 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y12119 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y12430 [0,1,0,0,0,0|2,0,0]=3 146 B10R1.15 N\C(=N/O)C1=CC=CC=C1 L10027 [0,1,0,0,0,0|2,0,1]=4 147 B10R1.15 O=C(CO)C1=CC=NC=C1 AC5781 [0,1,0,0,0,0|2,0,1]=4 148 B10R1.15 O=C(CO)C1=CN=CC=C1 AC2803 [0,1,0,0,0,0|2,0,1]=4 149 B10R1.15 O[C@@H](CCl)C1=CN=CC=C1 Y10944 [0,1,0,0,0,0|2,0,0]=3 150 B10R1.17 BrCCSC1=CC=NC=C1 AT18153 [0,1,0,0,0,0|2,0,0]=3 151 B10R1.17 CCCCC1=CC=CN=N1 O10974 [0,1,0,0,0,0|3,0,0]=4 152 B10R1.17 CNCCC1=CC=CN=C1 C73747 [0,1,0,0,0,0|1,0,0]=2 153 B10R1.17 CNCCC1=CC=NC=C1 AR1715 [0,1,0,0,0,0|1,0,0]=2 154 B10R1.17 CNNCC1=NC=CC=C1 30190 [0,1,0,0,0,0|2,0,0]=3 155 B10R1.17 FCCNC1=CC=CC=C1 D77931 [0,1,0,0,0,0|1,0,0]=2 156 B10R1.17 NCCNC1=NC=CC=C1 O12009 [0,1,0,0,0,0|1,0,0]=2 157 B10R1.17 NCCNC1=NC=CC=N1 AT18241 [0,1,0,0,0,0|2,0,0]=3 158 B10R1.17 NCCOC1=NC=CC=N1 AT18221 [0,1,0,0,0,0|2,0,0]=3 159 B10R1.17 NC\C=C\C1=CC=CC=C1 A12523 [0,1,0,0,0,0|0,0,1]=2 160 B10R1.17 NNCCC1=CC=CC=C1 AC4670 [0,1,0,0,0,0|0,0,0]=1 161 B10R1.17 NOCCC1=CC=CC=C1 C10179 [0,1,0,0,0,0|0,0,0]=1 162 B10R1.17 O=CCCC1=NC=CC=C1 P20552 [0,1,0,0,0,0|2,0,0]=3 163 B10R1.17 O=CCOC1=CC=CC=C1 C15303 [0,1,0,0,0,0|1,0,1]=3 164 B10R1.17 O=CNCC1=NC=CC=C1 AC6369 [0,1,0,0,0,0|2,0,1]=4 165 B10R1.17 OCCCC1=CCC=CC1 72320 [0,1,0,0,0,0|1,0,2]=4 166 B10R1.17 OCCCC1=CN=CC=C1 AC5531 [0,1,0,0,0,0|2,0,0]=3 167 B10R1.17 OCCNC1=NC=CC=N1 AT18240 [0,1,0,0,0,0|3,0,0]=4 168 B10R1.17 OCCOC1=NC=CC=C1 C90307 [0,1,0,0,0,0|2,0,0]=3 169 B10R1.17 OC\C=C\C1=CC=NC=C1 AC1120 [0,1,0,0,0,0|2,0,1]=4 170 B10R1.17 SCCCC1=CN=CC=C1 F18019 [0,1,0,0,0,0|2,0,0]=3 171 B10R1.17 SCCCC1=NC=CC=C1 F18728 [0,1,0,0,0,0|2,0,0]=3 172 B10R1.18 CC(=O)[15NH]C1=CC=CC=C1 F21470 [0,1,0,0,0,0|2,0,1]=4 173 B10R1.18 CC(C)CC1=CC=NC=C1 AC2809 [0,1,0,0,0,0|2,0,0]=3 174 B10R1.18 C[C@H](N)CC1=CC=NC=C1 F11581 [0,1,0,0,0,0|1,0,0]=2 175 B10R1.18 C[C@H](N)CC1=NC=CC=C1 F13183 [0,1,0,0,0,0|1,0,0]=2 176 B10R1.18 C[C@H](O)CC1=CC=CC=C1 T71821 [0,1,0,0,0,0|1,0,0]=2 177 B10R1.18 C[C@H](O)CC1=CC=CC=C1 T71861 [0,1,0,0,0,0|1,0,0]=2 178 B10R1.18 C[S@](=O)CC1=CN=CC=C1 E72354 [0,1,0,0,0,0|3,0,0]=4 179 B10R1.18 N=C(N)CC1=CC=CC=C1 C15976 [0,1,0,0,0,0|0,0,1]=2 180 B10R1.18 NC(=O)CC1=CN=CN=C1 FD7229 [0,1,0,0,0,0|2,0,1]=4 181 B10R1.18 OB(O)CC1=CC=CC=C1 32975 [0,1,0,0,0,0|2,0,0]=3 182 B10R1.18 [2H]C([2H])=CC1=CC=CC=C1 D99670 [0,1,0,0,0,0|1,0,2]=4 183 B10R2.6 C1=CC(C2CC2)=CC=N1 59829 [0,0,0,1,0,0|2,0,0]=3 184 B10R2.6 C1=CN=C(C2CC2)N=C1 P12514 [0,0,0,1,0,0|3,0,0]=4 185 B10R2.7 C1=CC2=C(C=C1)SCO2 76474 [0,0,0,1,0,0|2,0,0]=3 186 B10R2.7 C1=CC2=C(C=C1)SCS2 D71935 [0,0,0,1,0,0|2,0,0]=3 187 B10R2.7 C1=CC2=C(C=N1)NN=C2 W10136 [0,0,0,1,0,0|2,0,1]=4 188 B10R2.7 C1=CN=C2NCCC2=C1 C13729 [0,0,0,1,0,0|1,0,0]=2 189 B10R2.7 C1=CN=C2NCCC2=N1 P20982 [0,0,0,1,0,0|2,0,0]=3 190 B10R2.7 C1=NC=C2CCNC2=N1 93647 [0,0,0,1,0,0|2,0,0]=3 191 B10R2.7 C1=NC=C2CCNC2=N1 C90715 [0,0,0,1,0,0|2,0,0]=3 192 B10R2.320 N[C@H]1CC2=C1C=CC=C2 AT20398 [0,0,0,1,0,0|0,0,0]=1 193 B8R1.8 BrCCC1=CC=CS1 F20027 [0,0,0,0,1,0|2,0,0]=3 194 B8R1.8 BrCCC1=CNN=C1 F14413 [0,0,0,0,1,0|3,0,0]=4 195 B8R1.8 CNCC1=CSC=C1 AT16803 [0,0,0,0,1,0|3,0,0]=4 196 B8R1.8 ClCCC1=CNC=N1 D82567 [0,0,0,0,1,0|3,0,0]=4 197 B8R1.8 ClCCC1=CNN=C1 AC2763 [0,0,0,0,1,0|3,0,0]=4 198 B8R1.8 N#CCN1C=CC=C1 F50604 [0,0,0,0,1,0|1,0,2]=4 199 B8R1.8 NCCC1=CN=CN1 S10979 [0,0,0,0,1,0|2,0,0]=3 200 B8R1.8 NCCC1=CNN=C1 AC1363 [0,0,0,0,1,0|2,0,0]=3 201 B8R1.8 NCCC1=CNN=C1 D85886 [0,0,0,0,1,0|2,0,0]=3 202 B8R1.8 NCCC1=COC=N1 AT18667 [0,0,0,0,1,0|2,0,0]=3 203 B8R1.8 NCCC1=NC=CS1 F51904 [0,0,0,0,1,0|2,0,0]=3 204 B8R1.8 NCCC1=NNC=C1 AC2815 [0,0,0,0,1,0|2,0,0]=3 205 B8R1.8 NCCN1C=CC=N1 AT10968 [0,0,0,0,1,0|2,0,0]=3 206 B8R1.8 NCCN1C=CN=N1 C90622 [0,0,0,0,1,0|3,0,0]=4 207 B8R1.8 NCCN1C=NN=C1 AT12145 [0,0,0,0,1,0|3,0,0]=4 208 B8R1.8 NNCC1=CC=CS1 P10519 [0,0,0,0,1,0|2,0,0]=3 209 B8R1.8 NNCC1=CSC=C1 P10771 [0,0,0,0,1,0|2,0,0]=3 210 B8R1.8 O=CCC1=CC=CS1 O10539 [0,0,0,0,1,0|2,0,1]=4 211 B7R0.1 C=CC\C=C\CCC T72633 [1,0,1,0,0,0|0,0,2]=4 212 B7R1.3 ClC1=CC=NC=C1 F17303 [2,0,0,0,0,0|2,0,0]=4 213 B7R1.3 FC1=CC=NC=C1 F19691 [2,0,0,0,0,0|2,0,0]=4 214 B7R1.3 F[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 40525 [2,0,0,0,0,0|1,0,0]=3 215 B7R1.3 [15NH2]C1=CC=CC=C1 41405 [2,0,0,0,0,0|0,0,0]=2 216 B7R1.3 [2H]C1=CC=CC=C1 D98570 [2,0,0,0,0,0|1,0,0]=3 217 B7R1.3 [2H]C1=CC=NC=C1 D98795 [2,0,0,0,0,0|2,0,0]=4 218 B7R1.3 [2H]C1=NC=CC=C1 D98277 [2,0,0,0,0,0|2,0,0]=4 219 B9R1.1 CC1=NC=C(CBr)C=C1 F52459 [1,1,0,0,0,0|2,0,0]=4 220 B9R1.1 CC1=NC=C(CCl)C=C1 D87733 [1,1,0,0,0,0|2,0,0]=4 221 B9R1.1 CC1=NC=C(NN)C=C1 P10368 [1,1,0,0,0,0|2,0,0]=4 222 B9R1.1 CCN1C=CC(=S)C=C1 W16146 [1,1,0,0,0,0|1,0,0]=3 223 B9R1.1 CNC1=CC=C(N)C=C1 C78356 [1,1,0,0,0,0|1,0,0]=3 224 B9R1.1 CNC1=NC=C(N)C=C1 Y13586 [1,1,0,0,0,0|2,0,0]=4 225 B9R1.1 COC1=CN=C(I)C=C1 F17075 [1,1,0,0,0,0|2,0,0]=4 226 B9R1.1 CSC1=NC=C(N)C=C1 D73901 [1,1,0,0,0,0|2,0,0]=4 227 B9R1.1 C[Se]C1=CC=C(Br)C=C1 97865 [1,1,0,0,0,0|1,0,0]=3 228 B9R1.1 ClC1=CN=C(CBr)C=C1 S12201 [1,1,0,0,0,0|2,0,0]=4 229 B9R1.1 ClCC1=CN=C(Cl)C=C1 W18630 [1,1,0,0,0,0|2,0,0]=4 230 B9R1.1 FC1=CN=C(CCl)C=C1 P19178 [1,1,0,0,0,0|2,0,0]=4 231 B9R1.1 NC1=NC=C(CCl)C=C1 AT22351 [1,1,0,0,0,0|2,0,0]=4 232 B9R1.1 NCC1=CC=C(F)C=C1 N12249 [1,1,0,0,0,0|0,0,0]=2 233 B9R1.1 NCC1=CC=C(S)C=C1 AT20992 [1,1,0,0,0,0|0,0,0]=2 234 B9R1.1 NCC1=CN=C(Br)C=N1 F30506 [1,1,0,0,0,0|2,0,0]=4 235 B9R1.1 NCC1=NC=C(F)C=C1 83593 [1,1,0,0,0,0|1,0,0]=3 236 B9R1.1 NCC1=NC=C(F)C=N1 W11735 [1,1,0,0,0,0|2,0,0]=4 237 B9R1.1 NCC1=NC=C(I)C=C1 C91084 [1,1,0,0,0,0|1,0,0]=3 238 B9R1.1 NCC1=NN=C(Cl)C=C1 D84868 [1,1,0,0,0,0|2,0,0]=4 239 B9R1.1 NNC1=CN=C(Br)C=C1 68947 [1,1,0,0,0,0|2,0,0]=4 240 B9R1.1 NNC1=CN=C(Br)C=C1 W15223 [1,1,0,0,0,0|2,0,0]=4 241 B9R1.1 NNC1=NC=C(I)C=C1 C91520 [1,1,0,0,0,0|2,0,0]=4 242 B9R1.1 O=C1C=CC(=NCl)C=C1 T72753 [1,1,0,0,0,0|2,0,0]=4 243 B9R1.1 [2H]CC1=CC=C(F)C=C1 D98910 [1,1,0,0,0,0|1,0,0]=3 244 B9R1.2 CC1=CC(CBr)=CN=C1 43925 [1,1,0,0,0,0|2,0,0]=4 245 B9R1.2 CC1=CC(CN)=NC=N1 AT18324 [1,1,0,0,0,0|2,0,0]=4 246 B9R1.2 CC1=CC=NC(CN)=N1 P10960 [1,1,0,0,0,0|2,0,0]=4 247 B9R1.2 CC1=CN=NC(CN)=C1 P13788 [1,1,0,0,0,0|2,0,0]=4 248 B9R1.2 CC1=NC=CC(CN)=N1 F14224 [1,1,0,0,0,0|2,0,0]=4 249 B9R1.2 CC1=NC=CC(NN)=C1 F16202 [1,1,0,0,0,0|2,0,0]=4 250 B9R1.2 CCC1=CC(Cl)=NN=C1 S11387 [1,1,0,0,0,0|2,0,0]=4 251 B9R1.2 CCC1=NC=CC(Cl)=N1 W12562 [1,1,0,0,0,0|2,0,0]=4 252 B9R1.2 CNC1=NC=CC(N)=C1 F12690 [1,1,0,0,0,0|2,0,0]=4 253 B9R1.2 COC1=CC(O)=NC=C1 F17762 [1,1,0,0,0,0|2,0,0]=4 254 B9R1.2 COC1=CN=CC(N)=C1 P11509 [1,1,0,0,0,0|2,0,0]=4 255 B9R1.2 CSC1=CC(Cl)=CN=C1 AT19857 [1,1,0,0,0,0|2,0,0]=4 256 B9R1.2 C\N=C1\C=C(C)C=CN1 W18359 [1,1,0,0,0,0|2,0,0]=4 257 B9R1.2 ClC1=NC=CC(CBr)=C1 C16429 [1,1,0,0,0,0|2,0,0]=4 258 B9R1.2 ClCC1=NC=CC(Cl)=C1 C13998 [1,1,0,0,0,0|2,0,0]=4 259 B9R1.2 FC1=CC(CCl)=CN=C1 O10881 [1,1,0,0,0,0|2,0,0]=4 260 B9R1.2 NCC1=CC(=O)NC=C1 37540 [1,1,0,0,0,0|1,0,0]=3 261 B9R1.2 NCC1=CC(Br)=CN=C1 F19818 [1,1,0,0,0,0|1,0,0]=3 262 B9R1.2 NCC1=CC(F)=NC=C1 W18404 [1,1,0,0,0,0|1,0,0]=3 263 B9R1.2 NCC1=CC(N)=NC=C1 AC6477 [1,1,0,0,0,0|1,0,0]=3 264 B9R1.2 NCC1=CC=CC(Cl)=N1 C72946 [1,1,0,0,0,0|1,0,0]=3 265 B9R1.2 NCC1=CC=CC(I)=C1 CK2420 [1,1,0,0,0,0|0,0,0]=2 266 B9R1.2 NCC1=CC=CC(O)=N1 F10425 [1,1,0,0,0,0|1,0,0]=3 267 B9R1.2 NCC1=NC=CC(Br)=C1 26892 [1,1,0,0,0,0|1,0,0]=3 268 B9R1.2 NCC1=NC=CC(F)=C1 C71953 [1,1,0,0,0,0|1,0,0]=3 269 B9R1.2 NCC1=NC=CC(N)=C1 77886 [1,1,0,0,0,0|1,0,0]=3 270 B9R1.2 NNC1=NC(N)=CC=C1 C91519 [1,1,0,0,0,0|2,0,0]=4 271 B9R1.2 [2H]CC1=CC=CC(F)=C1 D99661 [1,1,0,0,0,0|1,0,0]=3 272 B9R1.2 [O-][N+]1=CC=CC(CCl)=C1 96310 [1,1,0,0,0,0|2,0,0]=4 273 B9R1.6 C[C@H](Br)C1=NC=CN=C1 C77147 [1,1,0,0,0,0|2,0,0]=4 274 B9R1.6 C[C@H](Cl)C1=NC=CC=C1 F13293 [1,1,0,0,0,0|1,0,0]=3 275 B9R1.6 C[C@H](N)C1=CC=CN=C1 S11132 [1,1,0,0,0,0|1,0,0]=3 276 B9R1.6 C[C@H](N)C1=CC=NC=C1 F31048 [1,1,0,0,0,0|1,0,0]=3 277 B9R1.6 C[C@H](N)C1=CN=CN=C1 P14618 [1,1,0,0,0,0|2,0,0]=4 278 B9R1.6 C[C@H](N)C1=NC=CC=C1 90514 [1,1,0,0,0,0|1,0,0]=3 279 B9R1.6 C[C@H](N)C1=NC=CC=N1 72045 [1,1,0,0,0,0|2,0,0]=4 280 B9R1.6 C[C@H](N)C1=NC=CN=C1 C93141 [1,1,0,0,0,0|2,0,0]=4 281 B9R1.6 C[C@H](N)C1=NC=CN=C1 C93144 [1,1,0,0,0,0|2,0,0]=4 282 B9R1.6 C[C@H](N)C1=NC=NC=C1 N10689 [1,1,0,0,0,0|2,0,0]=4 283 B9R1.6 C[C@H](N)C1=NC=NC=C1 P10880 [1,1,0,0,0,0|2,0,0]=4 284 B9R1.6 C[C@H](O)C1=NC=NC=C1 AT18318 [1,1,0,0,0,0|2,0,0]=4 285 B9R1.6 N=C(N)C1=CC=NC=C1 71449 [1,1,0,0,0,0|1,0,1]=4 286 B9R1.6 O=[13C](O)C1=CC=CC=C1 F13987 [1,1,0,0,0,0|1,0,1]=4 287 B9R1.6 [2H]C(=C)C1=CC=CC=C1 D97969 [1,1,0,0,0,0|0,0,2]=4 288 B9R1.6 [2H]N([2H])C1=CC=CC=C1 D98688 [1,1,0,0,0,0|2,0,0]=4 289 B9R1.15 C=CC1=C(C)C=CC=C1 T72704 [1,1,0,0,0,0|0,0,2]=4 290 B9R1.15 CC1=C(CBr)C=CC=N1 FD9046 [1,1,0,0,0,0|2,0,0]=4 291 B9R1.15 CC1=C(CBr)C=CC=N1 P11218 [1,1,0,0,0,0|2,0,0]=4 292 B9R1.15 CC1=C(CCl)C=CC=N1 P10970 [1,1,0,0,0,0|2,0,0]=4 293 B9R1.15 CC1=C(CCl)C=NC=C1 P10971 [1,1,0,0,0,0|2,0,0]=4 294 B9R1.15 CC1=CC=CN=C1CBr D97530 [1,1,0,0,0,0|2,0,0]=4 295 B9R1.15 CC1=NC=CN=C1CN 38702 [1,1,0,0,0,0|2,0,0]=4 296 B9R1.15 CCC1=C(Br)C=CN=C1 H11182 [1,1,0,0,0,0|1,0,0]=3 297 B9R1.15 CCC1=C(N)N=NC=C1 S11451 [1,1,0,0,0,0|2,0,0]=4 298 B9R1.15 CCC1=CC=CN=C1C 75814 [1,1,0,0,0,0|1,0,0]=3 299 B9R1.15 CCC1=CN=CN=C1O C15413 [1,1,0,0,0,0|2,0,0]=4 300 B9R1.15 COC1=C(Br)C=CN=C1 F10479 [1,1,0,0,0,0|2,0,0]=4 301 B9R1.15 COC1=C(C)C=NC=C1 D74380 [1,1,0,0,0,0|2,0,0]=4 302 B9R1.15 ClC1=CC=CN=C1CBr 79180 [1,1,0,0,0,0|2,0,0]=4 303 B9R1.15 ClC1=CC=CN=C1CBr 86640 [1,1,0,0,0,0|2,0,0]=4 304 B9R1.15 ClCC1=CC=CN=C1Br 55187 [1,1,0,0,0,0|2,0,0]=4 305 B9R1.15 FC1=C(CBr)C=CC=N1 AT20654 [1,1,0,0,0,0|2,0,0]=4 306 B9R1.15 N#CC1=C(S)C=CC=C1 AT20892 [1,1,0,0,0,0|0,0,2]=4 307 B9R1.15 NC1=C(CCl)C=CC=N1 89794 [1,1,0,0,0,0|2,0,0]=4 308 B9R1.15 NCC1=C(Br)C=NC=C1 98160 [1,1,0,0,0,0|1,0,0]=3 309 B9R1.15 NCC1=C(Cl)C=CN=C1 C11073 [1,1,0,0,0,0|1,0,0]=3 310 B9R1.15 NCC1=C(F)C=CN=C1 C90218 [1,1,0,0,0,0|1,0,0]=3 311 B9R1.15 NCC1=C(I)C=CC=C1 AT26620 [1,1,0,0,0,0|0,0,0]=2 312 B9R1.15 NCC1=C(O)C=CC=N1 C73700 [1,1,0,0,0,0|1,0,0]=3 313 B9R1.15 NCC1=C(O)C=CN=C1 AT18117 [1,1,0,0,0,0|1,0,0]=3 314 B9R1.15 NCC1=CC=CN=C1Cl 37571 [1,1,0,0,0,0|1,0,0]=3 315 B9R1.15 NCC1=CC=CN=C1N CL0345 [1,1,0,0,0,0|1,0,0]=3 316 B9R1.15 NCC1=[N+]([O-])C=CC=C1 D86206 [1,1,0,0,0,0|1,0,0]=3 317 B9R1.15 NNC1=C(Br)C=CC=N1 F30216 [1,1,0,0,0,0|2,0,0]=4 318 B9R1.15 NNC1=CC=CN=C1Cl D76828 [1,1,0,0,0,0|2,0,0]=4 319 B9R1.15 OCC1=C(F)C=CN=C1 P11878 [1,1,0,0,0,0|2,0,0]=4 320 B9R1.15 [2H]CC1=C(F)C=CC=C1 D99779 [1,1,0,0,0,0|1,0,0]=3 321 B9R1.15 [C-]#[N+]C1=C(Cl)C=CC=C1 AC9402 [1,1,0,0,0,0|1,0,1]=4 322 B9R1.7 CC1=CC=C(CCN)S1 31616 [0,1,0,0,1,0|1,0,0]=3 323 B9R1.7 CC1=CNC(CCN)=N1 F17871 [0,1,0,0,1,0|2,0,0]=4 324 B9R1.7 CC1=CSC(CCN)=C1 96997 [0,1,0,0,1,0|1,0,0]=3 325 B9R1.7 CC1=NC(CCN)=CO1 AT18664 [0,1,0,0,1,0|2,0,0]=4 326 B9R1.7 NCCC1=CN=C(O)S1 S10248 [0,1,0,0,1,0|2,0,0]=4 327 B9R1.7 NCCC1=NC=C(Br)S1 AT14710 [0,1,0,0,1,0|2,0,0]=4 328 B9R1.7 NCCN1C=C(Br)C=N1 AT16015 [0,1,0,0,1,0|2,0,0]=4 329 B9R1.7 NNCC1=CC=C(Cl)S1 P10520 [0,1,0,0,1,0|2,0,0]=4 330 B9R1.11 CC[C@H](N)C1=COC=C1 N16720 [0,1,0,0,1,0|2,0,0]=4 331 B9R1.11 CC[C@H](N)C1=COC=C1 N16721 [0,1,0,0,1,0|2,0,0]=4 332 B9R1.11 CC[C@H](N)C1=COC=C1 N16722 [0,1,0,0,1,0|2,0,0]=4 333 B9R1.11 N[C@@H](CO)C1=CC=CO1 C78116 [0,1,0,0,1,0|2,0,0]=4 334 B9R1.11 N[C@@H](CO)C1=COC=C1 N16732 [0,1,0,0,1,0|2,0,0]=4 335 B9R1.11 N[C@@H](CO)C1=CSC=C1 N13030 [0,1,0,0,1,0|2,0,0]=4 336 B9R1.12 CNCCC1=CC=CS1 AT16732 [0,1,0,0,1,0|1,0,0]=3 337 B9R1.12 CNCCC1=CN=CN1 D86292 [0,1,0,0,1,0|2,0,0]=4 338 B9R1.12 ICCCC1=CC=CS1 AC6959 [0,1,0,0,1,0|2,0,0]=4 339 B9R1.12 NCCCC1=NC=CN1 F10426 [0,1,0,0,1,0|2,0,0]=4 340 B9R1.13 C[C@H](N)CC1=COC=C1 89732 [0,1,0,0,1,0|1,0,0]=3 341 B9R1.13 C[C@H](N)CC1=COC=C1 89733 [0,1,0,0,1,0|1,0,0]=3 342 B9R1.13 C[C@H](N)CC1=COC=C1 89734 [0,1,0,0,1,0|1,0,0]=3 343 B9R1.13 C[C@H](N)CC1=CSC=C1 89730 [0,1,0,0,1,0|1,0,0]=3 344 B9R1.13 C[C@H](N)CC1=NNC=C1 I11135 [0,1,0,0,1,0|2,0,0]=4 345 B9R1.13 C[C@H](O)CC1=CC=CO1 W11911 [0,1,0,0,1,0|2,0,0]=4 346 B9R1.13 C[C@H](O)CC1=CSC=C1 58210 [0,1,0,0,1,0|2,0,0]=4 347 B9R1.13 C[C@H](O)CC1=CSC=C1 58214 [0,1,0,0,1,0|2,0,0]=4 348 B9R1.13 C[C@H](O)CC1=CSC=C1 58218 [0,1,0,0,1,0|2,0,0]=4 349 B9R1.13 N=C(N)CN1C=CC=C1 F50603 [0,1,0,0,1,0|1,0,1]=4 350 B9R1.13 NC(=O)CC1=CC=CN1 72456 [0,1,0,0,1,0|1,0,1]=4 351 B9R1.33 CC1=C(CCN)N=CN1 C15676 [0,1,0,0,1,0|2,0,0]=4 352 B9R1.33 CC1=C(CCN)N=CO1 AT18666 [0,1,0,0,1,0|2,0,0]=4 353 B9R1.33 CC1=C(CCN)SC=N1 D84303 [0,1,0,0,1,0|2,0,0]=4 354 B9R1.33 CN1C=CN=C1CCN AT24187 [0,1,0,0,1,0|2,0,0]=4 355 B11R1.1 C#CCNC1=CC=C(Cl)C=C1 D75666 [0,2,0,0,0,0|1,0,1]=4 356 B11R1.1 C#CCOC1=CC=C(I)C=C1 AT23376 [0,2,0,0,0,0|1,0,1]=4 357 B11R1.1 C=CCOC1=CC=C(Br)C=C1 71195 [0,2,0,0,0,0|1,0,1]=4 358 B11R1.1 CC1=CC=C(CCCN)C=C1 C78299 [0,2,0,0,0,0|0,0,0]=2 359 B11R1.1 CC1=CC=C(OCC#N)C=C1 AC7568 [0,2,0,0,0,0|0,0,2]=4 360 B11R1.1 CNCCC1=CC=C(Br)C=C1 C78422 [0,2,0,0,0,0|0,0,0]=2 361 B11R1.1 CNCCC1=CC=C(C)C=C1 C78074 [0,2,0,0,0,0|0,0,0]=2 362 B11R1.1 CNCCC1=NC=C(Br)C=N1 AT18381 [0,2,0,0,0,0|2,0,0]=4 363 B11R1.1 COCCC1=CC=C(Br)C=C1 28244 [0,2,0,0,0,0|1,0,0]=3 364 B11R1.1 COCCC1=CC=C(N)C=C1 F11764 [0,2,0,0,0,0|1,0,0]=3 365 B11R1.1 CONCC1=CC=C(Br)C=C1 N11596 [0,2,0,0,0,0|2,0,0]=4 366 B11R1.1 ClC1=CC=C(CCCBr)C=C1 S11935 [0,2,0,0,0,0|1,0,0]=3 367 B11R1.1 ClC1=CC=C(\C=C\CBr)C=C1 72674 [0,2,0,0,0,0|1,0,1]=4 368 B11R1.1 N#CCCC1=CC=C(O)C=C1 C15091 [0,2,0,0,0,0|0,0,1]=3 369 B11R1.1 NC1=CC=C(OCCCl)C=C1 72016 [0,2,0,0,0,0|1,0,0]=3 370 B11R1.1 NC1=CC=C(OCCO)C=C1 F16836 [0,2,0,0,0,0|1,0,0]=3 371 B11R1.1 NCCCC1=CC=C(N)C=C1 C78351 [0,2,0,0,0,0|0,0,0]=2 372 B11R1.1 NCCSC1=CC=C(Br)C=C1 C78402 [0,2,0,0,0,0|0,0,0]=2 373 B11R1.1 O=CNCC1=CC=C(Cl)C=C1 AB6809 [0,2,0,0,0,0|1,0,1]=4 374 B11R1.1 OCC#CC1=CC=C(Br)C=C1 A50682 [0,2,0,0,0,0|1,0,1]=4 375 B11R1.1 OCCNC1=CC=C(F)C=C1 I11182 [0,2,0,0,0,0|1,0,0]=3 376 B11R1.1 OCCOC1=NC=C(Br)C=C1 F19748 [0,2,0,0,0,0|2,0,0]=4 377 B11R1.1 OCCSC1=CC=C(Br)C=C1 AT20956 [0,2,0,0,0,0|1,0,0]=3 378 B11R1.1 OC\C=C\C1=CC=C(Br)C=C1 AT26502 [0,2,0,0,0,0|1,0,1]=4 379 B11R1.20 CC1=CC=C(CB(O)O)C=C1 F20813 [0,2,0,0,0,0|2,0,0]=4 380 B11R1.20 CC1=CC=C(C[C@H](C)N)C=C1 N14354 [0,2,0,0,0,0|0,0,0]=2 381 B11R1.20 C[C@H](N)CC1=CC=C(Br)C=C1 Y11268 [0,2,0,0,0,0|0,0,0]=2 382 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 N10873 [0,2,0,0,0,0|0,0,0]=2 383 B11R1.20 C[C@H](N)CC1=CC=C(O)C=C1 85180 [0,2,0,0,0,0|0,0,0]=2 384 B11R1.20 FC(F)SC1=CC=C(Br)C=C1 AT20957 [0,2,0,0,0,0|2,0,0]=4 385 B11R1.20 FC1=CC=C(OC(F)F)C=C1 F17627 [0,2,0,0,0,0|2,0,0]=4 386 B11R1.20 N=C(N)NC1=CC=C(Cl)C=C1 28377 [0,2,0,0,0,0|1,0,1]=4 387 B11R1.20 N=C(N)NC1=CC=C(F)C=C1 C16184 [0,2,0,0,0,0|1,0,1]=4 388 B11R1.20 NC(=O)NC1=CC=C(N)C=C1 51818 [0,2,0,0,0,0|1,0,1]=4 389 B11R1.20 NC1=CC=C(SC(F)F)C=C1 AT20968 [0,2,0,0,0,0|2,0,0]=4 390 B11R1.20 NC1=CC=C(SC(F)F)C=C1 AT20978 [0,2,0,0,0,0|2,0,0]=4 391 B11R1.22 C#C[C@@H](O)C1=CC=C(Br)C=C1 AC6934 [0,2,0,0,0,0|1,0,1]=4 392 B11R1.22 C#C[C@@H](O)C1=CC=C(C)C=C1 AC6704 [0,2,0,0,0,0|1,0,1]=4 393 B11R1.22 C#C[C@@H](O)C1=CC=C(Cl)C=C1 AC5833 [0,2,0,0,0,0|1,0,1]=4 394 B11R1.22 C=C[C@H](N)C1=CC=C(Br)C=C1 N15257 [0,2,0,0,0,0|1,0,1]=4 395 B11R1.22 C=C[C@H](N)C1=CC=C(Br)C=C1 N15258 [0,2,0,0,0,0|1,0,1]=4 396 B11R1.22 C=C[C@H](N)C1=CC=C(C)C=C1 N15265 [0,2,0,0,0,0|1,0,1]=4 397 B11R1.22 C=C[C@H](N)C1=CC=C(C)C=C1 N15266 [0,2,0,0,0,0|1,0,1]=4 398 B11R1.22 C=C[C@H](N)C1=CC=C(C)C=C1 N15267 [0,2,0,0,0,0|1,0,1]=4 399 B11R1.22 C=C[C@H](N)C1=CC=C(Cl)C=C1 E72771 [0,2,0,0,0,0|1,0,1]=4 400 B11R1.22 C=C[C@H](N)C1=CC=C(Cl)C=C1 N15246 [0,2,0,0,0,0|1,0,1]=4 401 B11R1.22 C=C[C@H](N)C1=CC=C(Cl)C=C1 N15247 [0,2,0,0,0,0|1,0,1]=4 402 B11R1.22 C=C[C@H](N)C1=CC=C(Cl)C=C1 N15248 [0,2,0,0,0,0|1,0,1]=4 403 B11R1.22 C=C[C@H](N)C1=CC=C(F)C=C1 N15237 [0,2,0,0,0,0|1,0,1]=4 404 B11R1.22 C=C[C@H](N)C1=CC=C(F)C=C1 N15238 [0,2,0,0,0,0|1,0,1]=4 405 B11R1.22 C=C[C@H](N)C1=CC=C(O)C=C1 N15298 [0,2,0,0,0,0|1,0,1]=4 406 B11R1.22 C=C[C@H](N)C1=CC=C(O)C=C1 N15299 [0,2,0,0,0,0|1,0,1]=4 407 B11R1.22 C=C[C@H](N)C1=CC=C(O)C=C1 N15300 [0,2,0,0,0,0|1,0,1]=4 408 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 C75563 [0,2,0,0,0,0|0,0,1]=3 409 B11R1.22 CC1=CC=C(C(=O)CO)C=C1 AC6089 [0,2,0,0,0,0|1,0,1]=4 410 B11R1.22 CC1=CC=C(C(=S)NN)C=C1 W10974 [0,2,0,0,0,0|1,0,1]=4 411 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13432 [0,2,0,0,0,0|0,0,0]=2 412 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13433 [0,2,0,0,0,0|0,0,0]=2 413 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13434 [0,2,0,0,0,0|0,0,0]=2 414 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13455 [0,2,0,0,0,0|0,0,0]=2 415 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13456 [0,2,0,0,0,0|0,0,0]=2 416 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13457 [0,2,0,0,0,0|0,0,0]=2 417 B11R1.22 CC1=CC=C([C@@H](O)CN)C=C1 C78285 [0,2,0,0,0,0|0,0,0]=2 418 B11R1.22 CC1=NC=C([C@@H](N)CO)C=C1 N11154 [0,2,0,0,0,0|2,0,0]=4 419 B11R1.22 CC1=NC=C([C@@H](N)CO)C=C1 N11155 [0,2,0,0,0,0|2,0,0]=4 420 B11R1.22 CC[C@H](C)C1=CC=C(Br)C=C1 O10385 [0,2,0,0,0,0|1,0,0]=3 421 B11R1.22 CC[C@H](N)C1=CC=C(C)C=C1 N12295 [0,2,0,0,0,0|1,0,0]=3 422 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y11091 [0,2,0,0,0,0|2,0,0]=4 423 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y11092 [0,2,0,0,0,0|2,0,0]=4 424 B11R1.22 CO[C@@H](C)C1=CC=C(Br)C=C1 N11516 [0,2,0,0,0,0|2,0,0]=4 425 B11R1.22 C[C@@H](CN)C1=CC=C(Cl)C=C1 F20636 [0,2,0,0,0,0|0,0,0]=2 426 B11R1.22 C[C@@H](CN)C1=CC=C(O)C=C1 70995 [0,2,0,0,0,0|0,0,0]=2 427 B11R1.22 C[C@H](C#N)C1=CC=C(F)C=C1 AT19993 [0,2,0,0,0,0|0,0,2]=4 428 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 24831 [0,2,0,0,0,0|0,0,1]=3 429 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 F14651 [0,2,0,0,0,0|0,0,1]=3 430 B11R1.22 NCC(=O)C1=NC=C(Br)C=C1 90935 [0,2,0,0,0,0|1,0,1]=4 431 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13423 [0,2,0,0,0,0|0,0,0]=2 432 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13424 [0,2,0,0,0,0|0,0,0]=2 433 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13425 [0,2,0,0,0,0|0,0,0]=2 434 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13446 [0,2,0,0,0,0|0,0,0]=2 435 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13447 [0,2,0,0,0,0|0,0,0]=2 436 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13448 [0,2,0,0,0,0|0,0,0]=2 437 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N12560 [0,2,0,0,0,0|0,0,0]=2 438 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13414 [0,2,0,0,0,0|0,0,0]=2 439 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13415 [0,2,0,0,0,0|0,0,0]=2 440 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13416 [0,2,0,0,0,0|0,0,0]=2 441 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13438 [0,2,0,0,0,0|0,0,0]=2 442 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13439 [0,2,0,0,0,0|0,0,0]=2 443 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13400 [0,2,0,0,0,0|0,0,0]=2 444 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13401 [0,2,0,0,0,0|0,0,0]=2 445 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13402 [0,2,0,0,0,0|0,0,0]=2 446 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13406 [0,2,0,0,0,0|0,0,0]=2 447 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13407 [0,2,0,0,0,0|0,0,0]=2 448 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13408 [0,2,0,0,0,0|0,0,0]=2 449 B11R1.22 NC[C@H](N)C1=CN=C(Br)C=C1 N14910 [0,2,0,0,0,0|1,0,0]=3 450 B11R1.22 NC[C@H](N)C1=NC=C(Br)C=C1 N14909 [0,2,0,0,0,0|1,0,0]=3 451 B11R1.22 NC[C@H](O)C1=CC=C(Br)C=C1 58433 [0,2,0,0,0,0|0,0,0]=2 452 B11R1.22 NC[C@H](O)C1=CC=C(F)C=C1 C78230 [0,2,0,0,0,0|0,0,0]=2 453 B11R1.22 N[C@@H](CF)C1=CC=C(Br)C=C1 N14615 [0,2,0,0,0,0|1,0,0]=3 454 B11R1.22 N[C@@H](CF)C1=CC=C(F)C=C1 N14614 [0,2,0,0,0,0|1,0,0]=3 455 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 N11131 [0,2,0,0,0,0|1,0,0]=3 456 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 F16864 [0,2,0,0,0,0|1,0,0]=3 457 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 F16884 [0,2,0,0,0,0|1,0,0]=3 458 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 N10530 [0,2,0,0,0,0|1,0,0]=3 459 B11R1.22 N[C@@H](CO)C1=CN=C(Br)C=C1 N11111 [0,2,0,0,0,0|2,0,0]=4 460 B11R1.22 N[C@@H](CO)C1=NC=C(Br)C=C1 Y11193 [0,2,0,0,0,0|2,0,0]=4 461 B11R1.22 O=C(CF)C1=CC=C(Br)C=C1 W17424 [0,2,0,0,0,0|1,0,1]=4 462 B11R1.22 O=C(CO)C1=CC=C(O)C=C1 D87702 [0,2,0,0,0,0|1,0,1]=4 463 B11R1.22 O=C([13CH2]Br)C1=CC=C(Br)C=C1 D97990 [0,2,0,0,0,0|1,0,1]=4 464 B11R1.22 OC[C@H](O)C1=CC=C(Cl)C=C1 FD1217 [0,2,0,0,0,0|1,0,0]=3 465 B11R1.22 O[C@@H](CCl)C1=CC=C(Br)C=C1 58431 [0,2,0,0,0,0|1,0,0]=3 466 B11R1.81 CCCC1=C(O)C=C(C)C=C1 A10895 [0,2,0,0,0,0|1,0,0]=3 467 B11R1.81 CCNC1=C(N)C=C(Br)C=C1 89427 [0,2,0,0,0,0|2,0,0]=4 468 B11R1.81 CCOC1=C(Br)C=C(N)C=C1 N12647 [0,2,0,0,0,0|2,0,0]=4 469 B11R1.81 CCOC1=C(C)C=C(N)C=C1 N12561 [0,2,0,0,0,0|2,0,0]=4 470 B11R1.81 CNCC1=C(Cl)C=C(F)C=C1 76695 [0,2,0,0,0,0|2,0,0]=4 471 B11R1.81 CNCC1=C(F)C=C(F)C=C1 36787 [0,2,0,0,0,0|2,0,0]=4 472 B11R1.81 COCC1=C(Cl)C=C(Br)C=C1 N11614 [0,2,0,0,0,0|2,0,0]=4 473 B11R1.81 N#CCC1=C(I)C=C(Br)C=C1 D85729 [0,2,0,0,0,0|0,0,2]=4 474 B11R1.81 NCCC1=C(Br)C=C(Br)C=C1 P18612 [0,2,0,0,0,0|0,0,0]=2 475 B11R1.81 NCCC1=C(Br)C=C(Cl)C=C1 AC3186 [0,2,0,0,0,0|0,0,0]=2 476 B11R1.81 NCCC1=C(Br)C=C(F)C=C1 AC7044 [0,2,0,0,0,0|0,0,0]=2 477 B11R1.81 NCCC1=C(F)C=C(Br)C=C1 50240 [0,2,0,0,0,0|0,0,0]=2 478 B11R1.81 NCCC1=C(F)C=C(O)C=C1 F51014 [0,2,0,0,0,0|0,0,0]=2 479 B11R1.81 NCCN1C=CC(=O)NC1=O F17292 [0,2,0,0,0,0|2,0,0]=4 480 B11R1.81 NCCN1C=CC(=O)NC1=O F20734 [0,2,0,0,0,0|2,0,0]=4 481 B11R1.81 NNCC1=C(Br)C=C(F)C=C1 AC5368 [0,2,0,0,0,0|1,0,0]=3 482 B11R1.81 NNCC1=C(Cl)C=C(Cl)C=C1 AC4339 [0,2,0,0,0,0|1,0,0]=3 483 B11R1.81 NNCC1=C(Cl)C=C(Cl)C=C1 P10432 [0,2,0,0,0,0|1,0,0]=3 484 B11R1.81 NNCC1=C(Cl)C=C(F)C=C1 A12240 [0,2,0,0,0,0|1,0,0]=3 485 B11R1.81 NNCC1=C(Cl)C=C(F)C=C1 P10526 [0,2,0,0,0,0|1,0,0]=3 486 B11R1.81 NNCC1=C(F)C=C(Br)C=C1 AC5349 [0,2,0,0,0,0|1,0,0]=3 487 B11R1.81 NNCC1=C(F)C=C(F)C=C1 AC5364 [0,2,0,0,0,0|1,0,0]=3 488 B11R1.81 N\N=C/C1=C(F)C=C(Br)C=C1 A50963 [0,2,0,0,0,0|1,0,1]=4 489 B11R1.81 O=C1C=C(Br)C=CN1CCO AT13847 [0,2,0,0,0,0|2,0,0]=4 490 B11R1.81 O=CCC1=C(Cl)C=C(Cl)C=C1 C15524 [0,2,0,0,0,0|1,0,1]=4 491 B11R1.81 OCCC1=C(Br)C=C(Cl)C=C1 D85895 [0,2,0,0,0,0|1,0,0]=3 492 B11R1.81 OCCC1=C(F)C=C(F)C=C1 A50720 [0,2,0,0,0,0|1,0,0]=3 493 B11R1.83 C=CC1=CC=C(CCCl)C=C1 AC7198 [0,2,0,0,0,0|1,0,0]=3 494 B11R1.83 C=CC1=CC=C(CCO)C=C1 AC6179 [0,2,0,0,0,0|1,0,0]=3 495 B11R1.83 CCCC1=CC=C(CBr)C=C1 C13395 [0,2,0,0,0,0|1,0,0]=3 496 B11R1.83 CCOC1=CC=C(CCl)C=C1 60965 [0,2,0,0,0,0|2,0,0]=4 497 B11R1.83 CCSC1=CC=C(CN)C=C1 AT20991 [0,2,0,0,0,0|2,0,0]=4 498 B11R1.83 COC1=CN=C(CCN)C=C1 C15008 [0,2,0,0,0,0|1,0,0]=3 499 B11R1.83 COC1=NC=C(CCN)C=C1 W10137 [0,2,0,0,0,0|1,0,0]=3 500 B11R1.83 COC1=NC=C(CCN)C=N1 AT18225 [0,2,0,0,0,0|2,0,0]=4 501 B11R1.83 COC1=NC=C(CCN)C=N1 AT18231 [0,2,0,0,0,0|2,0,0]=4 502 B11R1.83 NCCC1=CC=C(CO)C=C1 20162 [0,2,0,0,0,0|0,0,0]=2 503 B11R1.83 [C-]#[N+]CC1=CC=C(OC)C=C1 AB1475 [0,2,0,0,0,0|2,0,0]=4 504 B11R1.192 CC1=C(Br)C=C(CC#N)C=C1 97483 [0,2,0,0,0,0|0,0,2]=4 505 B11R1.192 CC1=C(Cl)C=CC(CC#N)=C1 D96292 [0,2,0,0,0,0|0,0,2]=4 506 B11R1.192 CCCC1=CC(Br)=C(Cl)C=C1 F31327 [0,2,0,0,0,0|1,0,0]=3 507 B11R1.192 CCOC1=CC(F)=C(O)C=C1 94989 [0,2,0,0,0,0|2,0,0]=4 508 B11R1.192 CCOC1=CC(N)=C(N)C=C1 34477 [0,2,0,0,0,0|2,0,0]=4 509 B11R1.192 CCSC1=CC(Cl)=C(Br)C=C1 89705 [0,2,0,0,0,0|2,0,0]=4 510 B11R1.192 CNCC1=CC(F)=C(F)C=C1 N12835 [0,2,0,0,0,0|2,0,0]=4 511 B11R1.192 ClC1=C(Cl)C=C(CCBr)C=C1 C78192 [0,2,0,0,0,0|1,0,0]=3 512 B11R1.192 FC1=C(Br)C=CC(CCBr)=C1 AC8493 [0,2,0,0,0,0|1,0,0]=3 513 B11R1.192 N#CCC1=CC(Br)=C(Cl)C=C1 D96285 [0,2,0,0,0,0|0,0,2]=4 514 B11R1.192 N#CCC1=CC(F)=C(O)C=C1 F13577 [0,2,0,0,0,0|0,0,2]=4 515 B11R1.192 NNCC1=CC(Br)=C(F)C=C1 E71963 [0,2,0,0,0,0|1,0,0]=3 516 B11R1.192 NNCC1=CC(Cl)=C(Cl)C=C1 AC5360 [0,2,0,0,0,0|1,0,0]=3 517 B11R1.192 NNCC1=CC(F)=C(F)C=C1 AC5348 [0,2,0,0,0,0|1,0,0]=3 518 B11R1.192 O=CCC1=CC(Cl)=C(Cl)C=C1 25894 [0,2,0,0,0,0|1,0,1]=4 519 B11R1.13 C=CCC1=C(O)C(C)=CC=C1 AC5932 [0,2,0,0,0,0|1,0,1]=4 520 B11R1.13 CC1=C(Cl)C=CC=C1CC#N C90793 [0,2,0,0,0,0|0,0,2]=4 521 B11R1.13 CCOC1=C(C)C(N)=CC=C1 F18648 [0,2,0,0,0,0|2,0,0]=4 522 B11R1.13 CN1C(=O)C=CN=C1CCN AT13879 [0,2,0,0,0,0|2,0,0]=4 523 B11R1.13 ClC1=CC=CC(CCBr)=C1Cl C78633 [0,2,0,0,0,0|1,0,0]=3 524 B11R1.13 N#CCC1=CC=CC(Br)=C1Cl D96283 [0,2,0,0,0,0|0,0,2]=4 525 B11R1.13 N#CCC1=CC=CC(F)=C1Cl 94661 [0,2,0,0,0,0|0,0,2]=4 526 B11R1.13 O=CCC1=CC=CC(F)=C1F 22736 [0,2,0,0,0,0|1,0,1]=4 527 B11R1.13 OCCC1=NC=CC(Cl)=C1Br W11042 [0,2,0,0,0,0|2,0,0]=4 528 B11R1.17 BrCCCC1=C(Br)C=CC=C1 C77748 [0,2,0,0,0,0|1,0,0]=3 529 B11R1.17 C#CCOC1=C(Br)C=CC=C1 AT23367 [0,2,0,0,0,0|1,0,1]=4 530 B11R1.17 C#CCOC1=C(Cl)C=CC=C1 AT23368 [0,2,0,0,0,0|1,0,1]=4 531 B11R1.17 C#CCOC1=C(I)C=CC=C1 AT23373 [0,2,0,0,0,0|1,0,1]=4 532 B11R1.17 C=CCCC1=C(Br)C=NC=C1 S10194 [0,2,0,0,0,0|2,0,0]=4 533 B11R1.17 CC1=CC=CN=C1CCCN W10139 [0,2,0,0,0,0|1,0,0]=3 534 B11R1.17 CCCOC1=C(N)C=CC=C1 AC7746 [0,2,0,0,0,0|1,0,0]=3 535 B11R1.17 CCNCC1=C(Cl)C=CC=C1 C16114 [0,2,0,0,0,0|1,0,0]=3 536 B11R1.17 CNCCC1=C(C)C=CC=C1 C78447 [0,2,0,0,0,0|0,0,0]=2 537 B11R1.17 CNCCC1=C(Cl)C=CC=C1 C78279 [0,2,0,0,0,0|0,0,0]=2 538 B11R1.17 ClC1=C(CCCBr)C=CC=C1 C78298 [0,2,0,0,0,0|1,0,0]=3 539 B11R1.17 N#CCOC1=C(Cl)C=CC=C1 AC7530 [0,2,0,0,0,0|0,0,2]=4 540 B11R1.17 NCCCC1=C(Cl)C=CC=C1 C78000 [0,2,0,0,0,0|0,0,0]=2 541 B11R1.17 NCCCC1=C(F)C=CC=C1 F20045 [0,2,0,0,0,0|0,0,0]=2 542 B11R1.17 NCCCN1C=CC=CC1=O AT19227 [0,2,0,0,0,0|1,0,0]=3 543 B11R1.17 NCCOC1=C(Cl)C=CC=C1 L10067 [0,2,0,0,0,0|0,0,0]=2 544 B11R1.17 O=C1C=CC=CN1CCCO AT19228 [0,2,0,0,0,0|2,0,0]=4 545 B11R1.17 OCC#CC1=C(Br)C=CC=C1 S11832 [0,2,0,0,0,0|1,0,1]=4 546 B11R1.17 OCC#CC1=C(Cl)C=CC=C1 A50678 [0,2,0,0,0,0|1,0,1]=4 547 B11R1.17 OCCCC1=C(O)C=CC=N1 85302 [0,2,0,0,0,0|2,0,0]=4 548 B11R1.41 CCC1=C(CCO)C=CC=C1 C15362 [0,2,0,0,0,0|1,0,0]=3 549 B11R1.41 CCSC1=C(C#N)C=CC=C1 AT20895 [0,2,0,0,0,0|2,0,0]=4 550 B11R1.41 COC1=C(CNN)C=CC=C1 P10476 [0,2,0,0,0,0|1,0,0]=3 551 B11R1.86 CC(C)NC1=C(Br)C=CC=C1 C77931 [0,2,0,0,0,0|2,0,0]=4 552 B11R1.86 CC(C)NC1=C(Cl)C=CC=C1 C78464 [0,2,0,0,0,0|2,0,0]=4 553 B11R1.86 CC(C)NC1=C(F)C=CC=C1 C77765 [0,2,0,0,0,0|2,0,0]=4 554 B11R1.86 CC(C)NC1=C(S)C=CC=C1 AC8476 [0,2,0,0,0,0|2,0,0]=4 555 B11R1.86 CC1=C(C[C@H](C)N)C=CC=C1 N10867 [0,2,0,0,0,0|0,0,0]=2 556 B11R1.86 C[C@H](N)CC1=C(Br)C=CC=C1 N11144 [0,2,0,0,0,0|0,0,0]=2 557 B11R1.86 C[C@H](N)CC1=C(Cl)C=CC=C1 N11063 [0,2,0,0,0,0|0,0,0]=2 558 B11R1.86 C[C@H](O)CC1=C(Br)C=NC=C1 AT12941 [0,2,0,0,0,0|2,0,0]=4 559 B11R1.86 FC(F)OC1=C(Cl)C=CC=C1 F19093 [0,2,0,0,0,0|2,0,0]=4 560 B11R1.86 FC1=C(OC(F)F)C=CC=C1 F18842 [0,2,0,0,0,0|2,0,0]=4 561 B11R1.86 NC(=O)CC1=NC=CC=C1O D87092 [0,2,0,0,0,0|1,0,1]=4 562 B11R1.182 CC1=C(CC#N)C=C(Cl)C=C1 AT13429 [0,2,0,0,0,0|0,0,2]=4 563 B11R1.182 CC1=C(CCN)C=C(Cl)C=C1 AT13431 [0,2,0,0,0,0|0,0,0]=2 564 B11R1.182 CC1=CC(CC#N)=C(Br)C=C1 D96277 [0,2,0,0,0,0|0,0,2]=4 565 B11R1.182 CCCC1=C(Br)C=CC(O)=C1 57995 [0,2,0,0,0,0|1,0,0]=3 566 B11R1.182 CCCN1C=C(N)C=CC1=O AT19282 [0,2,0,0,0,0|2,0,0]=4 567 B11R1.182 CCOC1=C(F)C=CC(Br)=C1 H11056 [0,2,0,0,0,0|2,0,0]=4 568 B11R1.182 CNCC1=C(Cl)C=CC(Cl)=C1 76693 [0,2,0,0,0,0|2,0,0]=4 569 B11R1.182 CNCC1=C(F)C=CC(Br)=C1 36267 [0,2,0,0,0,0|2,0,0]=4 570 B11R1.182 COCC1=C(Br)C=CC(F)=C1 N11817 [0,2,0,0,0,0|2,0,0]=4 571 B11R1.182 ClC1=CC(CCBr)=C(Cl)C=C1 C78205 [0,2,0,0,0,0|1,0,0]=3 572 B11R1.182 NC1=CN(CCO)C(=O)C=C1 AT19231 [0,2,0,0,0,0|2,0,0]=4 573 B11R1.182 NCCC1=C(Br)C=CC(Cl)=C1 AT11063 [0,2,0,0,0,0|0,0,0]=2 574 B11R1.182 NCCC1=C(F)C=CC(Br)=C1 N12525 [0,2,0,0,0,0|0,0,0]=2 575 B11R1.182 NCCC1=C(F)C=CC(F)=C1 AT21560 [0,2,0,0,0,0|0,0,0]=2 576 B11R1.182 NCCN1C=C(Br)C=CC1=O AT19269 [0,2,0,0,0,0|1,0,0]=3 577 B11R1.182 NNCC1=C(Br)C=CC(Cl)=C1 AC5350 [0,2,0,0,0,0|1,0,0]=3 578 B11R1.182 NNCC1=C(Cl)C=CC(F)=C1 AC5377 [0,2,0,0,0,0|1,0,0]=3 579 B11R1.182 NNCC1=C(F)C=CC(Br)=C1 AC5379 [0,2,0,0,0,0|1,0,0]=3 580 B11R1.182 N\N=C\C1=C(F)C=CC(Br)=C1 36791 [0,2,0,0,0,0|1,0,1]=4 581 B11R1.182 O=C1C=CC(Br)=CN1CCO AT13854 [0,2,0,0,0,0|2,0,0]=4 582 B11R1.222 C#C[C@@H](O)C1=C(Br)C=CC=C1 AC5641 [0,2,0,0,0,0|1,0,1]=4 583 B11R1.222 C#C[C@@H](O)C1=C(C)C=CC=C1 AC4137 [0,2,0,0,0,0|1,0,1]=4 584 B11R1.222 C#C[C@@H](O)C1=C(Cl)C=CC=C1 AC5063 [0,2,0,0,0,0|1,0,1]=4 585 B11R1.222 C#C[C@@H](O)C1=C(F)C=CC=C1 AC5690 [0,2,0,0,0,0|1,0,1]=4 586 B11R1.222 C#C[C@@H](O)C1=C(O)C=CC=C1 AC5065 [0,2,0,0,0,0|1,0,1]=4 587 B11R1.222 C=C[C@H](N)C1=C(Br)C=CC=C1 N15249 [0,2,0,0,0,0|1,0,1]=4 588 B11R1.222 C=C[C@H](N)C1=C(Br)C=CC=C1 N15250 [0,2,0,0,0,0|1,0,1]=4 589 B11R1.222 C=C[C@H](N)C1=C(Br)C=CC=C1 N15251 [0,2,0,0,0,0|1,0,1]=4 590 B11R1.222 C=C[C@H](N)C1=C(C)C=CC=C1 N15259 [0,2,0,0,0,0|1,0,1]=4 591 B11R1.222 C=C[C@H](N)C1=C(C)C=CC=C1 N15260 [0,2,0,0,0,0|1,0,1]=4 592 B11R1.222 C=C[C@H](N)C1=C(C)C=CC=C1 N15261 [0,2,0,0,0,0|1,0,1]=4 593 B11R1.222 C=C[C@H](N)C1=C(Cl)C=CC=C1 N15239 [0,2,0,0,0,0|1,0,1]=4 594 B11R1.222 C=C[C@H](N)C1=C(Cl)C=CC=C1 N15240 [0,2,0,0,0,0|1,0,1]=4 595 B11R1.222 C=C[C@H](N)C1=C(Cl)C=CC=C1 N15241 [0,2,0,0,0,0|1,0,1]=4 596 B11R1.222 C=C[C@H](N)C1=C(F)C=CC=C1 N15232 [0,2,0,0,0,0|1,0,1]=4 597 B11R1.222 C=C[C@H](N)C1=C(F)C=CC=C1 N15233 [0,2,0,0,0,0|1,0,1]=4 598 B11R1.222 C=C[C@H](N)C1=C(F)C=CC=C1 N15234 [0,2,0,0,0,0|1,0,1]=4 599 B11R1.222 C=C[C@H](N)C1=C(O)C=CC=C1 N15292 [0,2,0,0,0,0|1,0,1]=4 600 B11R1.222 C=C[C@H](N)C1=C(O)C=CC=C1 N15293 [0,2,0,0,0,0|1,0,1]=4 601 B11R1.222 C=C[C@H](N)C1=C(O)C=CC=C1 N15294 [0,2,0,0,0,0|1,0,1]=4 602 B11R1.222 CC1=C(C(=O)CO)C=CC=C1 AC4310 [0,2,0,0,0,0|1,0,1]=4 603 B11R1.222 CC1=C([C@@H](N)CF)C=CC=C1 N14610 [0,2,0,0,0,0|1,0,0]=3 604 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13426 [0,2,0,0,0,0|0,0,0]=2 605 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13427 [0,2,0,0,0,0|0,0,0]=2 606 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13428 [0,2,0,0,0,0|0,0,0]=2 607 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13449 [0,2,0,0,0,0|0,0,0]=2 608 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13450 [0,2,0,0,0,0|0,0,0]=2 609 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13451 [0,2,0,0,0,0|0,0,0]=2 610 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 N15069 [0,2,0,0,0,0|1,0,0]=3 611 B11R1.222 CC1=CC=CN=C1[C@@H](N)CN N14901 [0,2,0,0,0,0|1,0,0]=3 612 B11R1.222 CCC(=O)C1=C(Br)C=CC=C1 72058 [0,2,0,0,0,0|1,0,1]=4 613 B11R1.222 CC[C@H](C)C1=C(N)C=CC=C1 35361 [0,2,0,0,0,0|1,0,0]=3 614 B11R1.222 CC[C@H](N)C1=C(Br)C=CC=C1 N13015 [0,2,0,0,0,0|1,0,0]=3 615 B11R1.222 CC[C@H](N)C1=C(Cl)C=NC=C1 N14403 [0,2,0,0,0,0|2,0,0]=4 616 B11R1.222 CC[C@H](N)C1=NC=CC=C1C N13856 [0,2,0,0,0,0|2,0,0]=4 617 B11R1.222 CC[C@H](N)C1=NC=CC=C1C N13857 [0,2,0,0,0,0|2,0,0]=4 618 B11R1.222 CC[C@H](N)C1=NC=CC=C1C N13858 [0,2,0,0,0,0|2,0,0]=4 619 B11R1.222 CC[C@H](N)C1=NC=CC=C1C N13859 [0,2,0,0,0,0|2,0,0]=4 620 B11R1.222 CC[C@H](O)C1=C(Br)C=CC=C1 N12628 [0,2,0,0,0,0|1,0,0]=3 621 B11R1.222 CC[C@H](O)C1=C(C)C=CC=C1 N14414 [0,2,0,0,0,0|1,0,0]=3 622 B11R1.222 CC[C@H](O)C1=C(Cl)C=CC=C1 N14413 [0,2,0,0,0,0|1,0,0]=3 623 B11R1.222 CN[C@@H](C)C1=C(Br)C=CC=C1 N12718 [0,2,0,0,0,0|2,0,0]=4 624 B11R1.222 CN[C@@H](C)C1=C(C)C=CC=C1 N12531 [0,2,0,0,0,0|2,0,0]=4 625 B11R1.222 CN[C@@H](C)C1=C(O)C=CC=C1 N12719 [0,2,0,0,0,0|2,0,0]=4 626 B11R1.222 N#C[C@@H](N)C1=C(F)C=CC=C1 AT10485 [0,2,0,0,0,0|0,0,2]=4 627 B11R1.222 NC1=C(C(=O)CCl)C=CC=C1 72272 [0,2,0,0,0,0|1,0,1]=4 628 B11R1.222 NCC(=O)C1=C(Br)C=CC=C1 W17616 [0,2,0,0,0,0|0,0,1]=3 629 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13418 [0,2,0,0,0,0|0,0,0]=2 630 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13419 [0,2,0,0,0,0|0,0,0]=2 631 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13441 [0,2,0,0,0,0|0,0,0]=2 632 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13442 [0,2,0,0,0,0|0,0,0]=2 633 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13403 [0,2,0,0,0,0|0,0,0]=2 634 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13409 [0,2,0,0,0,0|0,0,0]=2 635 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13410 [0,2,0,0,0,0|0,0,0]=2 636 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13390 [0,2,0,0,0,0|0,0,0]=2 637 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13391 [0,2,0,0,0,0|0,0,0]=2 638 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13392 [0,2,0,0,0,0|0,0,0]=2 639 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13393 [0,2,0,0,0,0|0,0,0]=2 640 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13394 [0,2,0,0,0,0|0,0,0]=2 641 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13395 [0,2,0,0,0,0|0,0,0]=2 642 B11R1.222 NC[C@H](O)C1=C(Br)C=CC=C1 71742 [0,2,0,0,0,0|0,0,0]=2 643 B11R1.222 NC[C@H](O)C1=C(F)C=CC=C1 C78140 [0,2,0,0,0,0|0,0,0]=2 644 B11R1.222 NC[C@H](O)C1=C(I)C=CC=C1 O10641 [0,2,0,0,0,0|0,0,0]=2 645 B11R1.222 N[C@@H](CF)C1=C(F)C=CC=C1 N14609 [0,2,0,0,0,0|1,0,0]=3 646 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 C77783 [0,2,0,0,0,0|1,0,0]=3 647 B11R1.222 N[C@@H](CO)C1=C(Cl)C=NC=C1 N14404 [0,2,0,0,0,0|2,0,0]=4 648 B11R1.222 N[C@@H](CO)C1=C(O)C=CC=C1 N15244 [0,2,0,0,0,0|1,0,0]=3 649 B11R1.222 N[C@@H](CO)C1=C(O)C=CC=C1 N15255 [0,2,0,0,0,0|1,0,0]=3 650 B11R1.222 N[C@@H](CO)C1=C(O)C=CC=N1 N14918 [0,2,0,0,0,0|2,0,0]=4 651 B11R1.222 O=C(CCl)C1=C(Cl)C=CC=C1 D71120 [0,2,0,0,0,0|1,0,1]=4 652 B11R1.222 O=C(CO)C1=C(Br)C=CC=C1 AC7495 [0,2,0,0,0,0|1,0,1]=4 653 B11R1.222 O=C(CO)C1=C(F)C=CC=C1 AC5617 [0,2,0,0,0,0|1,0,1]=4 654 B11R1.222 O=C(CO)C1=C(I)C=CC=C1 AC7053 [0,2,0,0,0,0|1,0,1]=4 655 B11R1.222 O[C@@H](CF)C1=CC=CN=C1F AT10158 [0,2,0,0,0,0|2,0,0]=4 656 B11R1.605 CCOC1=C(Br)C=CC=C1C N10239 [0,2,0,0,0,0|2,0,0]=4 657 B11R1.605 CCOC1=C(Cl)C=CC=C1N C77678 [0,2,0,0,0,0|2,0,0]=4 658 B11R1.605 CNCC1=C(F)C=CC=C1F 36785 [0,2,0,0,0,0|2,0,0]=4 659 B11R1.605 ClC1=CC=CC(Cl)=C1CCBr C78204 [0,2,0,0,0,0|1,0,0]=3 660 B11R1.605 NCCC1=C(F)C=CC=C1F AT21561 [0,2,0,0,0,0|0,0,0]=2 661 B11R1.605 NCCC1=C(F)C=CC=C1O F50611 [0,2,0,0,0,0|0,0,0]=2 662 B11R1.605 NCCN1C(=O)C=CNC1=O C15628 [0,2,0,0,0,0|2,0,0]=4 663 B11R1.605 O=CCC1=C(F)C=CC=C1F 36768 [0,2,0,0,0,0|1,0,1]=4 664 B11R1.605 OCCC1=C(F)C=CC=C1F A50722 [0,2,0,0,0,0|1,0,0]=3 665 B11R1.23 C#C[C@@H](O)C1=CC(C)=CC=C1 AC5841 [0,2,0,0,0,0|1,0,1]=4 666 B11R1.23 C#C[C@@H](O)C1=CC=CC(Br)=C1 AC5836 [0,2,0,0,0,0|1,0,1]=4 667 B11R1.23 C#C[C@@H](O)C1=CC=CC(Cl)=C1 AC5834 [0,2,0,0,0,0|1,0,1]=4 668 B11R1.23 C=C[C@H](N)C1=CC(C)=CC=C1 N15262 [0,2,0,0,0,0|1,0,1]=4 669 B11R1.23 C=C[C@H](N)C1=CC(C)=CC=C1 N15263 [0,2,0,0,0,0|1,0,1]=4 670 B11R1.23 C=C[C@H](N)C1=CC(C)=CC=C1 N15264 [0,2,0,0,0,0|1,0,1]=4 671 B11R1.23 C=C[C@H](N)C1=CC=CC(Br)=C1 N15252 [0,2,0,0,0,0|1,0,1]=4 672 B11R1.23 C=C[C@H](N)C1=CC=CC(Br)=C1 N15253 [0,2,0,0,0,0|1,0,1]=4 673 B11R1.23 C=C[C@H](N)C1=CC=CC(Br)=C1 N15254 [0,2,0,0,0,0|1,0,1]=4 674 B11R1.23 C=C[C@H](N)C1=CC=CC(Cl)=C1 N15242 [0,2,0,0,0,0|1,0,1]=4 675 B11R1.23 C=C[C@H](N)C1=CC=CC(Cl)=C1 N15243 [0,2,0,0,0,0|1,0,1]=4 676 B11R1.23 C=C[C@H](N)C1=CC=CC(Cl)=C1 N15245 [0,2,0,0,0,0|1,0,1]=4 677 B11R1.23 C=C[C@H](N)C1=CC=CC(F)=C1 N15235 [0,2,0,0,0,0|1,0,1]=4 678 B11R1.23 C=C[C@H](N)C1=CC=CC(F)=C1 N15236 [0,2,0,0,0,0|1,0,1]=4 679 B11R1.23 C=C[C@H](N)C1=CC=CC(O)=C1 N15295 [0,2,0,0,0,0|1,0,1]=4 680 B11R1.23 C=C[C@H](N)C1=CC=CC(O)=C1 N15296 [0,2,0,0,0,0|1,0,1]=4 681 B11R1.23 C=C[C@H](N)C1=CC=CC(O)=C1 N15297 [0,2,0,0,0,0|1,0,1]=4 682 B11R1.23 CC1=CC=CC(C(=O)CO)=C1 AC3231 [0,2,0,0,0,0|1,0,1]=4 683 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13429 [0,2,0,0,0,0|0,0,0]=2 684 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13430 [0,2,0,0,0,0|0,0,0]=2 685 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13431 [0,2,0,0,0,0|0,0,0]=2 686 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13452 [0,2,0,0,0,0|0,0,0]=2 687 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13453 [0,2,0,0,0,0|0,0,0]=2 688 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13454 [0,2,0,0,0,0|0,0,0]=2 689 B11R1.23 CC1=CC=CC([C@@H](O)CN)=C1 C78286 [0,2,0,0,0,0|0,0,0]=2 690 B11R1.23 CCC(=O)C1=CC(N)=CC=C1 34175 [0,2,0,0,0,0|1,0,1]=4 691 B11R1.23 CC[C@H](O)C1=CC(C)=CC=C1 N14416 [0,2,0,0,0,0|1,0,0]=3 692 B11R1.23 CC[C@H](O)C1=CC=CC(Br)=C1 N12527 [0,2,0,0,0,0|1,0,0]=3 693 B11R1.23 CC[C@H](O)C1=CC=CC(Cl)=C1 N12311 [0,2,0,0,0,0|1,0,0]=3 694 B11R1.23 CN[C@@H](C)C1=CC=CC(F)=C1 N12243 [0,2,0,0,0,0|2,0,0]=4 695 B11R1.23 NCC(=O)C1=CC(O)=CC=C1 C77908 [0,2,0,0,0,0|0,0,1]=3 696 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13420 [0,2,0,0,0,0|0,0,0]=2 697 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13421 [0,2,0,0,0,0|0,0,0]=2 698 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13422 [0,2,0,0,0,0|0,0,0]=2 699 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13443 [0,2,0,0,0,0|0,0,0]=2 700 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13445 [0,2,0,0,0,0|0,0,0]=2 701 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13411 [0,2,0,0,0,0|0,0,0]=2 702 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13412 [0,2,0,0,0,0|0,0,0]=2 703 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13413 [0,2,0,0,0,0|0,0,0]=2 704 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13435 [0,2,0,0,0,0|0,0,0]=2 705 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13436 [0,2,0,0,0,0|0,0,0]=2 706 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13437 [0,2,0,0,0,0|0,0,0]=2 707 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13396 [0,2,0,0,0,0|0,0,0]=2 708 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13397 [0,2,0,0,0,0|0,0,0]=2 709 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13398 [0,2,0,0,0,0|0,0,0]=2 710 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13399 [0,2,0,0,0,0|0,0,0]=2 711 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13404 [0,2,0,0,0,0|0,0,0]=2 712 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13405 [0,2,0,0,0,0|0,0,0]=2 713 B11R1.23 NC[C@H](O)C1=CC=CC(Br)=C1 58439 [0,2,0,0,0,0|0,0,0]=2 714 B11R1.23 NC[C@H](O)C1=CC=CC(Br)=C1 71528 [0,2,0,0,0,0|0,0,0]=2 715 B11R1.23 NC[C@H](O)C1=CC=CC(Br)=C1 92116 [0,2,0,0,0,0|0,0,0]=2 716 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 58428 [0,2,0,0,0,0|0,0,0]=2 717 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 C78287 [0,2,0,0,0,0|0,0,0]=2 718 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 D77208 [0,2,0,0,0,0|0,0,0]=2 719 B11R1.23 N[C@@H](CF)C1=CC=CC(Br)=C1 N14613 [0,2,0,0,0,0|1,0,0]=3 720 B11R1.23 N[C@@H](CO)C1=CC(F)=CN=C1 N14406 [0,2,0,0,0,0|2,0,0]=4 721 B11R1.23 N[C@@H](CO)C1=CC(F)=CN=C1 N14407 [0,2,0,0,0,0|2,0,0]=4 722 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=N1 Y12117 [0,2,0,0,0,0|2,0,0]=4 723 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 N12818 [0,2,0,0,0,0|1,0,0]=3 724 B11R1.23 N[C@@H](CO)C1=NC=CC(Cl)=C1 N14937 [0,2,0,0,0,0|2,0,0]=4 725 B11R1.23 N[C@@H](CO)C1=NC=CC(Cl)=C1 N14938 [0,2,0,0,0,0|2,0,0]=4 726 B11R1.23 O=C(CO)C1=CC=CC(Br)=C1 AC6088 [0,2,0,0,0,0|1,0,1]=4 727 B11R1.23 O=C(CO)C1=CC=CC(F)=C1 AC5675 [0,2,0,0,0,0|1,0,1]=4 728 B11R1.23 O[C@@H](CCl)C1=CC=CC(Br)=C1 58437 [0,2,0,0,0,0|1,0,0]=3 729 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 58424 [0,2,0,0,0,0|1,0,0]=3 730 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 C72678 [0,2,0,0,0,0|1,0,0]=3 731 B11R1.24 BrCCCC1=CC=CC(Br)=C1 C77758 [0,2,0,0,0,0|1,0,0]=3 732 B11R1.24 BrCCOC1=CC=CC(Br)=C1 98063 [0,2,0,0,0,0|1,0,0]=3 733 B11R1.24 CC1=CC(CCCN)=NC=C1 W10140 [0,2,0,0,0,0|1,0,0]=3 734 B11R1.24 CC1=CC=CC(CCC=O)=C1 C10532 [0,2,0,0,0,0|1,0,0]=3 735 B11R1.24 CC1=CC=CC(OCCO)=N1 N10107 [0,2,0,0,0,0|2,0,0]=4 736 B11R1.24 CCCC[N+]1=CC(C)=CC=C1 C93515 [0,2,0,0,0,0|2,0,0]=4 737 B11R1.24 CCNCC1=CC(Br)=CN=C1 F19801 [0,2,0,0,0,0|2,0,0]=4 738 B11R1.24 CCOCC1=CC=CC(Br)=C1 F17773 [0,2,0,0,0,0|1,0,0]=3 739 B11R1.24 CNCCC1=CC=CC(Br)=C1 C78466 [0,2,0,0,0,0|0,0,0]=2 740 B11R1.24 COCCC1=CC(N)=NC=C1 AT18204 [0,2,0,0,0,0|2,0,0]=4 741 B11R1.24 ClC1=CC=CC(CCCBr)=C1 C78574 [0,2,0,0,0,0|1,0,0]=3 742 B11R1.24 ClCCNC1=CC(Cl)=NC=C1 98045 [0,2,0,0,0,0|2,0,0]=4 743 B11R1.24 N#CCCC1=CC=CC(F)=C1 97618 [0,2,0,0,0,0|0,0,1]=3 744 B11R1.24 N#CCOC1=CC(O)=CC=C1 C77746 [0,2,0,0,0,0|0,0,2]=4 745 B11R1.24 NC1=CC(CCCO)=NC=C1 AC5942 [0,2,0,0,0,0|2,0,0]=4 746 B11R1.24 NC1=CC=CC(OCCO)=C1 C78268 [0,2,0,0,0,0|1,0,0]=3 747 B11R1.24 NCCCC1=CC=CC(F)=C1 97619 [0,2,0,0,0,0|0,0,0]=2 748 B11R1.24 NCCCC1=CC=CC(N)=C1 C78147 [0,2,0,0,0,0|0,0,0]=2 749 B11R1.24 NCCCC1=CC=CC(O)=C1 C78310 [0,2,0,0,0,0|0,0,0]=2 750 B11R1.24 O=CCCC1=CC(O)=CC=C1 F19734 [0,2,0,0,0,0|1,0,0]=3 751 B11R1.24 O=CNCC1=CC=CC(F)=C1 Y10034 [0,2,0,0,0,0|1,0,1]=4 752 B11R1.24 OCCNC1=CC(Cl)=NC=C1 98044 [0,2,0,0,0,0|2,0,0]=4 753 B11R1.24 OCCOC1=CC(Cl)=CN=C1 AT19859 [0,2,0,0,0,0|2,0,0]=4 754 B11R1.24 [C-]#[N+]CCC1=CC=CC(F)=C1 50335 [0,2,0,0,0,0|0,0,1]=3 755 B11R1.34 C=CCC1=CC(Br)=CC(F)=C1 C76836 [0,2,0,0,0,0|1,0,1]=4 756 B11R1.34 CCOC1=CC(Br)=CC(Br)=C1 N11666 [0,2,0,0,0,0|2,0,0]=4 757 B11R1.34 COCC1=CC(Br)=CC(Br)=C1 AT26748 [0,2,0,0,0,0|2,0,0]=4 758 B11R1.34 COCC1=CC(Br)=CC(F)=C1 94138 [0,2,0,0,0,0|2,0,0]=4 759 B11R1.34 COCC1=CC(F)=CC(F)=C1 AT26699 [0,2,0,0,0,0|2,0,0]=4 760 B11R1.34 ClC1=CC(Cl)=CC(CCBr)=C1 C78597 [0,2,0,0,0,0|1,0,0]=3 761 B11R1.34 N#CCC1=CC(Br)=CC(O)=C1 D96286 [0,2,0,0,0,0|0,0,2]=4 762 B11R1.34 NCCC1=CC(Cl)=CC(Cl)=C1 F12494 [0,2,0,0,0,0|0,0,0]=2 763 B11R1.34 NOCC1=CC(Cl)=CC(Cl)=C1 D74083 [0,2,0,0,0,0|1,0,0]=3 764 B11R1.34 OCCC1=CC(Br)=CC(Br)=C1 AT19150 [0,2,0,0,0,0|1,0,0]=3 765 B11R1.34 OCCC1=CC(O)=CC(O)=C1 AT19148 [0,2,0,0,0,0|1,0,0]=3 766 B11R1.157 CC(=O)CC1=CC(C)=CC=C1 N12785 [0,2,0,0,0,0|1,0,1]=4 767 B11R1.157 CC(C)CC1=CC=CC(N)=C1 O11024 [0,2,0,0,0,0|1,0,0]=3 768 B11R1.157 CC(C)NC1=CC=CC(Br)=C1 C77831 [0,2,0,0,0,0|2,0,0]=4 769 B11R1.157 CC(C)NC1=CC=CC(Cl)=C1 C78133 [0,2,0,0,0,0|2,0,0]=4 770 B11R1.157 CC1=CC=CC(C[C@H](C)N)=C1 N11054 [0,2,0,0,0,0|0,0,0]=2 771 B11R1.157 C[C@H](N)CC1=CC=CC(Br)=C1 E72139 [0,2,0,0,0,0|0,0,0]=2 772 B11R1.157 C[C@H](N)CC1=CC=CC(Cl)=C1 83690 [0,2,0,0,0,0|0,0,0]=2 773 B11R1.157 C[C@H](N)CC1=CC=CC(Cl)=C1 N11066 [0,2,0,0,0,0|0,0,0]=2 774 B11R1.157 C[C@H](N)CC1=CC=CC(F)=C1 N10878 [0,2,0,0,0,0|0,0,0]=2 775 B11R1.157 C[S@](=O)CC1=CC(N)=CC=C1 AT15220 [0,2,0,0,0,0|2,0,0]=4 776 B11R1.157 FC(F)OC1=CC=CC(Cl)=C1 F19087 [0,2,0,0,0,0|2,0,0]=4 777 B11R1.157 N=C(N)NC1=CC=CC(Cl)=C1 C12447 [0,2,0,0,0,0|1,0,1]=4 778 B11R1.157 N=C(N)NC1=CC=CC(F)=C1 C16183 [0,2,0,0,0,0|1,0,1]=4 779 B11R1.157 N=C(N)NC1=CC=CC(O)=C1 S11159 [0,2,0,0,0,0|1,0,1]=4 780 B11R1.157 NC(=O)NC1=CC(N)=CC=C1 F19865 [0,2,0,0,0,0|1,0,1]=4 781 B11R1.157 OB(O)CC1=CC=CC(F)=C1 D79888 [0,2,0,0,0,0|2,0,0]=4 782 B11R1.189 CCCC1=CC=CC(OC)=C1 AC9509 [0,2,0,0,0,0|1,0,0]=3 783 B11R1.189 CCOC1=CC(CN)=CC=C1 N12140 [0,2,0,0,0,0|2,0,0]=4 784 B11R1.189 CCSC1=CC(C#N)=CC=C1 AT20900 [0,2,0,0,0,0|2,0,0]=4 785 B11R1.189 COC1=NC=CC(CCN)=C1 AT18209 [0,2,0,0,0,0|1,0,0]=3 786 B11R1.189 COCC1=CC(C#N)=CC=C1 O10889 [0,2,0,0,0,0|2,0,0]=4 787 B11R1.189 COCC1=CC=CC(OC)=C1 N11528 [0,2,0,0,0,0|2,0,0]=4 788 B11R1.189 N#CC1=CC(CCN)=CC=C1 72737 [0,2,0,0,0,0|0,0,0]=2 789 B11R1.7 CC(C)(C=O)C1=CC=CC=C1 AT22663 [0,2,0,0,0,0|1,0,1]=4 790 B11R1.7 CC(C)(CBr)C1=CC=CC=C1 D78707 [0,2,0,0,0,0|1,0,0]=3 791 B11R1.7 CC(C)(CN)C1=CC=NC=C1 AT18144 [0,2,0,0,0,0|1,0,0]=3 792 B11R1.7 C[C@@](N)(C#N)C1=CC=CC=C1 AC6143 [0,2,0,0,0,0|0,0,2]=4 793 B11R1.7 C[C@](N)(CO)C1=CC=CC=C1 N12768 [0,2,0,0,0,0|1,0,0]=3 794 B11R1.12 CCC(CC)C1=CC=CC=C1 T71625 [0,2,0,0,0,0|1,0,0]=3 795 B11R1.12 CN[C@@H](CO)C1=CC=CC=C1 N12976 [0,2,0,0,0,0|1,0,0]=3 796 B11R1.16 C#CC[C@H](O)C1=CC=CC=C1 W15219 [0,2,0,0,0,0|1,0,0]=3 797 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 N12265 [0,2,0,0,0,0|1,0,0]=3 798 B11R1.16 CN(CCBr)C1=CC=CC=C1 W15250 [0,2,0,0,0,0|1,0,0]=3 799 B11R1.16 CN(CCO)C1=CC=NC=C1 AT18109 [0,2,0,0,0,0|2,0,0]=4 800 B11R1.16 CNC[C@H](C)C1=CC=CC=C1 C11240 [0,2,0,0,0,0|0,0,0]=2 801 B11R1.16 CNC[C@H](O)C1=CC=CC=C1 C11214 [0,2,0,0,0,0|0,0,0]=2 802 B11R1.16 COC[C@H](N)C1=CC=CC=C1 AC6537 [0,2,0,0,0,0|1,0,0]=3 803 B11R1.16 NCC[C@H](N)C1=CC=CC=C1 N14729 [0,2,0,0,0,0|0,0,0]=2 804 B11R1.16 NCC[C@H](N)C1=CC=CC=C1 N14730 [0,2,0,0,0,0|0,0,0]=2 805 B11R1.16 OCC[C@H](O)C1=CC=CC=C1 C80043 [0,2,0,0,0,0|1,0,0]=3 806 B11R1.36 C=C(C1=CC=CC=C1)C(C)C W11468 [0,2,0,0,0,0|1,0,1]=4 807 B11R1.36 CC(=O)[C@H](N)C1=CC=CC=C1 N15518 [0,2,0,0,0,0|1,0,1]=4 808 B11R1.36 CC(C)[C@H](N)C1=CC=CN=C1 74043 [0,2,0,0,0,0|2,0,0]=4 809 B11R1.36 CC(C)[C@H](N)C1=NC=CC=C1 Y10672 [0,2,0,0,0,0|2,0,0]=4 810 B11R1.36 CC(C)[C@H](O)C1=CN=CC=C1 AC2743 [0,2,0,0,0,0|2,0,0]=4 811 B11R1.36 CC(O)C(N)C1=CC=CC=C1 N11175 [0,2,0,0,0,0|1,0,0]=3 812 B11R1.36 CC(O)C(N)C1=CC=CC=C1 Y13368 [0,2,0,0,0,0|1,0,0]=3 813 B11R1.36 CC(O)[C@H](N)C1=CC=CC=C1 N15517 [0,2,0,0,0,0|1,0,0]=3 814 B11R1.36 C[C@@H](O)[C@H](N)C1=CC=CC=C1 N15522 [0,2,0,0,0,0|1,0,0]=3 815 B11R1.36 C[C@H](N)C(=O)C1=CC=CC=C1 F13376 [0,2,0,0,0,0|0,0,1]=3 816 B11R1.36 C[C@H](O)[C@H](N)C1=CC=CC=C1 N15519 [0,2,0,0,0,0|1,0,0]=3 817 B11R1.36 N[C@H](C1=CC=CC=C1)C(F)F 94363 [0,2,0,0,0,0|1,0,0]=3 818 B11R1.36 O[C@H](C1=CC=CC=C1)C(F)F AT21493 [0,2,0,0,0,0|1,0,0]=3 819 B11R1.28 CCCCNC1=CC=NC=C1 F21501 [0,2,0,0,0,0|2,0,0]=4 820 B11R1.28 CCNCCC1=CC=CC=C1 AC5622 [0,2,0,0,0,0|0,0,0]=2 821 B11R1.28 N#CCCNC1=NC=CC=C1 N13320 [0,2,0,0,0,0|1,0,1]=4 822 B11R1.28 NCC\C=C\C1=CC=CC=C1 F15194 [0,2,0,0,0,0|0,0,0]=2 823 B11R1.28 NNCCOC1=CC=CC=C1 AC4849 [0,2,0,0,0,0|0,0,0]=2 824 B11R1.28 NOCCOC1=CC=CC=C1 AT21707 [0,2,0,0,0,0|0,0,0]=2 825 B11R1.28 OCCCCC1=CC=NC=C1 31475 [0,2,0,0,0,0|2,0,0]=4 826 B11R1.28 OCCSSC1=NC=CC=C1 AT21148 [0,2,0,0,0,0|2,0,0]=4 827 B11R1.40 CC[C@H](N)CC1=CC=CC=C1 74053 [0,2,0,0,0,0|0,0,0]=2 828 B11R1.40 CNC(=S)NC1=CC=CC=C1 T72207 [0,2,0,0,0,0|1,0,1]=4 829 B11R1.40 C[C@H](C=O)CC1=CC=CC=C1 F16111 [0,2,0,0,0,0|1,0,0]=3 830 B11R1.40 N#CC(=O)CC1=CC=CC=C1 AC5929 [0,2,0,0,0,0|0,0,2]=4 831 B11R1.40 N#C[C@@H](F)SC1=CC=CC=C1 D90673 [0,2,0,0,0,0|0,0,2]=4 832 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14383 [0,2,0,0,0,0|0,0,0]=2 833 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14384 [0,2,0,0,0,0|0,0,0]=2 834 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14385 [0,2,0,0,0,0|0,0,0]=2 835 B11R1.40 NNC(=O)CC1=NC=CC=C1 AT10923 [0,2,0,0,0,0|1,0,1]=4 836 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 C78372 [0,2,0,0,0,0|0,0,0]=2 837 B11R1.40 O\N=C(/Cl)CC1=CC=CC=C1 AC6652 [0,2,0,0,0,0|0,0,2]=4 838 B11R1.91 CC(=O)CCC1=CC=NC=C1 AT24518 [0,2,0,0,0,0|2,0,0]=4 839 B11R1.91 CC(C)NCC1=CC=CN=C1 AC5151 [0,2,0,0,0,0|2,0,0]=4 840 B11R1.91 CC(C)NCC1=CC=NC=C1 AC6648 [0,2,0,0,0,0|2,0,0]=4 841 B11R1.91 C[C@H](N)COC1=CC=CC=C1 N12753 [0,2,0,0,0,0|0,0,0]=2 842 B11R1.91 C[C@H](N)COC1=CC=CC=C1 N12763 [0,2,0,0,0,0|0,0,0]=2 843 B11R1.91 C[C@H](N)CSC1=CC=CC=C1 AT26670 [0,2,0,0,0,0|0,0,0]=2 844 B11R1.91 N=C(N)CCC1=NC=CC=C1 C14497 [0,2,0,0,0,0|1,0,0]=3 845 B11R1.91 N=C(N)NCC1=CC=CC=C1 S12114 [0,2,0,0,0,0|0,0,1]=3 846 B11R1.91 NC(=O)CCC1=NC=CC=C1 AC6900 [0,2,0,0,0,0|1,0,0]=3 847 B11R1.91 NC(=O)CCC1=NC=NC=C1 F13616 [0,2,0,0,0,0|2,0,0]=4 848 B11R1.91 NC(N)=NCC1=CC=CC=C1 H10078 [0,2,0,0,0,0|0,0,1]=3 849 B11R1.509 CC(C)(Cl)CC1=CC=CC=C1 AC4724 [0,2,0,0,0,0|1,0,0]=3 850 B11R1.509 [2H]C([2H])([2H])CC1=CC=CC=C1 D99355 [0,2,0,0,0,0|1,0,0]=3 851 B11R1.509 [2H]C([2H])([2H])OC1=CC=CC=C1 D99695 [0,2,0,0,0,0|2,0,0]=4 852 B11R2.34 CC1=CC=C(C2CC2)C=C1 AC9737 [0,1,0,1,0,0|1,0,0]=3 853 B11R2.34 ClC1=CC=C(C2CC2)C=C1 AC9567 [0,1,0,1,0,0|1,0,0]=3 854 B11R2.36 CC1=CC2=C(C=C1)CNC2 71833 [0,1,0,1,0,0|2,0,0]=4 855 B11R2.36 CC1=CC2=C(C=C1)CNC2 W10108 [0,1,0,1,0,0|2,0,0]=4 856 B11R2.36 FC1=CC2=C(C=C1)CC=C2 N14223 [0,1,0,1,0,0|1,0,1]=4 857 B11R2.36 FC1=CC2=C(C=C1)CCC2 36515 [0,1,0,1,0,0|1,0,0]=3 858 B11R2.36 IC1=CC2=C(C=C1)CCC2 C12643 [0,1,0,1,0,0|1,0,0]=3 859 B11R2.36 IC1=CC2=C(C=C1)CNC2 32000 [0,1,0,1,0,0|2,0,0]=4 860 B11R2.36 NC1=CC2=C(C=C1)CNC2 SC4171 [0,1,0,1,0,0|2,0,0]=4 861 B11R2.36 NC1=CC2=C(C=C1)OCC2 88994 [0,1,0,1,0,0|1,0,0]=3 862 B11R2.36 NC1=CN=C2CCCC2=C1 F30816 [0,1,0,1,0,0|2,0,0]=4 863 B11R2.36 OC1=CN=C2CCCC2=C1 F30817 [0,1,0,1,0,0|2,0,0]=4 864 B11R2.36 OC1=NC2=C(C=C1)CCC2 20278 [0,1,0,1,0,0|2,0,0]=4 865 B11R2.36 SC1=CC2=C(C=C1)NN=C2 F18088 [0,1,0,1,0,0|1,0,1]=4 866 B11R2.10 N=C1CC2=C(C=CC=C2)N1 30671 [0,1,0,1,0,0|0,0,1]=3 867 B11R2.10 NC1=CC2=C(C=CC=C2)N1 79767 [0,1,0,1,0,0|0,0,2]=4 868 B11R2.10 NC1=CC2=C(C=CC=C2)N1 F13373 [0,1,0,1,0,0|0,0,2]=4 869 B11R2.10 O=C1CC2=C(C=CC=C2)S1 A51238 [0,1,0,1,0,0|1,0,1]=4 870 B11R2.10 O=C1CC2=C(C=NC=C2)N1 61718 [0,1,0,1,0,0|1,0,1]=4 871 B11R2.20 C1=CC2=C(C=N1)N=CCN2 D87594 [0,1,0,1,0,0|1,0,1]=4 872 B11R2.20 C1=CC2=C(C=N1)NCCN2 78662 [0,1,0,1,0,0|1,0,0]=3 873 B11R2.20 C1=CC2=C(C=N1)NCCO2 AT21908 [0,1,0,1,0,0|1,0,0]=3 874 B11R2.20 C1=CN=C2CNCCC2=C1 P10652 [0,1,0,1,0,0|1,0,0]=3 875 B11R2.20 C1=NC=C2CCNCC2=N1 P19161 [0,1,0,1,0,0|2,0,0]=4 876 B11R2.55 BrC1=C(C2CC2)C=CN=C1 AT12865 [0,1,0,1,0,0|2,0,0]=4 877 B11R2.55 CC1=C(C2CC2)C=CC=C1 AC9736 [0,1,0,1,0,0|1,0,0]=3 878 B11R2.55 CC1=CC=CN=C1C2CC2 AC9685 [0,1,0,1,0,0|2,0,0]=4 879 B11R2.55 CC1=NC=CC=C1C2CC2 F13571 [0,1,0,1,0,0|2,0,0]=4 880 B11R2.55 ClC1=C([C@@H]2CO2)C=CC=C1 AT10463 [0,1,0,1,0,0|1,0,0]=3 881 B11R2.55 ClC1=C([C@@H]2CO2)C=CC=C1 CK2535 [0,1,0,1,0,0|1,0,0]=3 882 B11R2.55 NC1=C(C2CC2)C=CC=C1 A10978 [0,1,0,1,0,0|1,0,0]=3 883 B11R2.55 NC1=C(C2CC2)C=CN=C1 AT16333 [0,1,0,1,0,0|2,0,0]=4 884 B11R2.55 OC1=C(C2CC2)C=CC=C1 91444 [0,1,0,1,0,0|1,0,0]=3 885 B11R2.106 BrC1=C2CCCC2=NC=C1 F53407 [0,1,0,1,0,0|2,0,0]=4 886 B11R2.106 BrC1=C2CCOC2=CC=C1 F12556 [0,1,0,1,0,0|1,0,0]=3 887 B11R2.106 CC1=C2CCOC2=NC=C1 97225 [0,1,0,1,0,0|2,0,0]=4 888 B11R2.106 CC1=C2N=CNC2=CC=C1 31265 [0,1,0,1,0,0|1,0,1]=4 889 B11R2.106 CC1=CC=CC2=C1CNC2 W10109 [0,1,0,1,0,0|2,0,0]=4 890 B11R2.106 CC1=CC=CC2=C1N=NN2 C80091 [0,1,0,1,0,0|2,0,0]=4 891 B11R2.106 ClC1=C2CCCC2=CC=C1 N13077 [0,1,0,1,0,0|1,0,0]=3 892 B11R2.106 ClC1=C2CCOC2=NC=C1 97228 [0,1,0,1,0,0|2,0,0]=4 893 B11R2.106 ClC1=C2CNCC2=CC=C1 FD13081 [0,1,0,1,0,0|2,0,0]=4 894 B11R2.106 ClC1=C2OCCC2=CC=C1 F53809 [0,1,0,1,0,0|1,0,0]=3 895 B11R2.106 FC1=C2NCCC2=CC=C1 C73504 [0,1,0,1,0,0|0,0,0]=2 896 B11R2.106 IC1=C2CCOC2=CC=C1 E72245 [0,1,0,1,0,0|1,0,0]=3 897 B11R2.106 IC1=C2N=NNC2=CC=C1 O11246 [0,1,0,1,0,0|2,0,0]=4 898 B11R2.106 NC1=C2N=CNC2=CC=C1 P10197 [0,1,0,1,0,0|1,0,1]=4 899 B11R2.106 NC1=C2OCCC2=CC=N1 F53509 [0,1,0,1,0,0|2,0,0]=4 900 B11R2.106 NC1=NC=NC2=C1CCN2 C16504 [0,1,0,1,0,0|2,0,0]=4 901 B11R2.106 O=C1C=CC=C2NCCN12 O10576 [0,1,0,1,0,0|1,0,0]=3 902 B11R2.988 NC[C@H]1CC2=C1C=CC=C2 AT20374 [0,1,0,1,0,0|0,0,0]=2 903 B11R2.988 OC[C@H]1CC2=C1C=CC=C2 67862 [0,1,0,1,0,0|1,0,0]=3 904 B11R2.35 CC1=CC(C2CC2)=NC=C1 AC9117 [0,1,0,1,0,0|2,0,0]=4 905 B11R2.35 CC1=CC=CC(C2CC2)=C1 AC9451 [0,1,0,1,0,0|1,0,0]=3 906 B11R2.35 CC1=CC=CC(C2CC2)=N1 AC9039 [0,1,0,1,0,0|2,0,0]=4 907 B11R2.35 ClC1=CC(C2CC2)=CC=C1 97830 [0,1,0,1,0,0|1,0,0]=3 908 B11R2.35 NC1=CC(C2CC2)=CN=C1 S11509 [0,1,0,1,0,0|2,0,0]=4 909 B11R2.35 NC1=CC(C2CC2)=NC=C1 F52584 [0,1,0,1,0,0|2,0,0]=4 910 B11R2.35 NC1=NC(C2CC2)=CC=C1 AT24911 [0,1,0,1,0,0|2,0,0]=4 911 B11R2.35 OC1=CC(C2CC2)=CC=C1 97835 [0,1,0,1,0,0|1,0,0]=3 912 B11R2.35 OC1=CC(C2CC2)=NC=C1 55360 [0,1,0,1,0,0|2,0,0]=4 913 B11R2.1 BrC1=CCC2=C1C=CC=C2 D78625 [0,1,0,1,0,0|1,0,1]=4 914 B11R2.1 C[C@H]1CNC2=C1C=CC=C2 W18948 [0,1,0,1,0,0|0,0,0]=2 915 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 41003 [0,1,0,1,0,0|0,0,0]=2 916 B11R2.1 N[C@H]1CCC2=CC=CN=C21 D81362 [0,1,0,1,0,0|1,0,0]=3 917 B11R2.1 N[C@H]1CCC2=NC=CC=C21 D79496 [0,1,0,1,0,0|1,0,0]=3 918 B11R2.1 N[C@H]1COC2=C1C=CC=C2 I11926 [0,1,0,1,0,0|0,0,0]=2 919 B11R2.1 OC1=CNC2=C1C=CC=C2 F18139 [0,1,0,1,0,0|0,0,2]=4 920 B11R2.1 ON1N=CC2=C1C=CC=C2 E70293 [0,1,0,1,0,0|1,0,1]=4 921 B11R2.1 O[C@H]1COC2=C1C=CC=C2 AT19563 [0,1,0,1,0,0|1,0,0]=3 922 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 C14923 [0,1,0,1,0,0|0,0,0]=2 923 B11R2.40 NC1(C2=CC=NC=C2)CC1 28304 [0,1,0,1,0,0|2,0,0]=4 924 B11R2.40 NC1(C2=NC=CC=C2)CC1 80305 [0,1,0,1,0,0|2,0,0]=4 925 B11R2.40 NC1(C2=NC=CC=C2)CC1 80312 [0,1,0,1,0,0|2,0,0]=4 926 B11R2.239 C1=CC(C2CNC2)=NC=N1 74669 [0,1,0,1,0,0|2,0,0]=4 927 B11R2.239 C1=CC=C(C2CCC2)C=C1 F52090 [0,1,0,1,0,0|1,0,0]=3 928 B11R2.239 C1=CC=C([C@@H]2CCN2)C=C1 A50749 [0,1,0,1,0,0|0,0,0]=2 929 B11R2.239 C1=CN=C(C2CNC2)C=C1 F31095 [0,1,0,1,0,0|1,0,0]=3 930 B7R1.1 CCC1=CN=CO1 C77473 [1,0,0,0,1,0|2,0,0]=4 931 B7R1.1 CCC1=COC=N1 C77618 [1,0,0,0,1,0|2,0,0]=4 932 B7R1.1 ClCC1=CSC=C1 AT17055 [1,0,0,0,1,0|2,0,0]=4 933 B7R1.1 NCC1=CC=NN1 P10323 [1,0,0,0,1,0|2,0,0]=4 934 B7R1.1 NCC1=CC=NS1 AT13366 [1,0,0,0,1,0|2,0,0]=4 935 B7R1.1 NCC1=CNC=N1 C90275 [1,0,0,0,1,0|2,0,0]=4 936 B7R1.1 NCC1=CNN=C1 83328 [1,0,0,0,1,0|2,0,0]=4 937 B7R1.1 NCC1=COC=C1 61502 [1,0,0,0,1,0|1,0,0]=3 938 B7R1.1 NCC1=COC=N1 73632 [1,0,0,0,1,0|2,0,0]=4 939 B7R1.1 NCC1=CSN=C1 AT21214 [1,0,0,0,1,0|2,0,0]=4 940 B7R1.1 NCC1=NSC=C1 P10783 [1,0,0,0,1,0|2,0,0]=4 941 B7R1.1 NNC1=CC=CS1 W17128 [1,0,0,0,1,0|2,0,0]=4 942 B7R1.1 OCC1=CC=CN1 AT16114 [1,0,0,0,1,0|2,0,0]=4 943 B7R1.1 SCC1=CC=CS1 T72725 [1,0,0,0,1,0|2,0,0]=4