0 B11R1.28 C#CCOCC1=CC=CC=C1 P589024 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.28 C1=CC=C(C=C1)CCCCBr B140194 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.28 C1=CC=C(C=C1)CCCCCl P404858 [0,0,0,0,0,0|2,0,0]=2 3 B11R1.28 C1=CC=C(C=C1)CCCCN B292880 [0,0,0,0,0,0|2,0,0]=2 4 B11R1.28 C1=CC=C(C=C1)CCCCN P160136 [0,0,0,0,0,0|2,0,0]=2 5 B11R1.28 C1=CC=C(C=C1)CCCCN P160137 [0,0,0,0,0,0|2,0,0]=2 6 B11R1.28 C1=CC=C(C=C1)CCCCN P493282 [0,0,0,0,0,0|2,0,0]=2 7 B11R1.28 C1=CC=C(C=C1)CCCCO P138687 [0,0,0,0,0,0|2,0,0]=2 8 B11R1.28 C1=CC=C(C=C1)CCN=C=O P160767 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.28 C1=CC=C(C=C1)CCN=C=S P102544 [0,0,0,0,0,0|3,0,1]=4 10 B11R1.28 C1=CC=C(C=C1)CCNC=O I168819 [0,0,0,0,0,0|3,0,1]=4 11 B11R1.28 C1=CC=C(C=C1)CCOC=O F302132 [0,0,0,0,0,0|3,0,1]=4 12 B11R1.28 C1=CC=C(C=C1)CNCCN B124211 [0,0,0,0,0,0|3,0,0]=3 13 B11R1.28 C1=CC=C(C=C1)CNCCO B111181 [0,0,0,0,0,0|3,0,0]=3 14 B11R1.28 C1=CC=C(C=C1)COCC=O B136421 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.28 C1=CC=C(C=C1)COCCBr B107737 [0,0,0,0,0,0|3,0,0]=3 16 B11R1.28 C1=CC=C(C=C1)COCCCl B132425 [0,0,0,0,0,0|3,0,0]=3 17 B11R1.28 C1=CC=C(C=C1)COCCN B193115 [0,0,0,0,0,0|3,0,0]=3 18 B11R1.28 C1=CC=C(C=C1)COCCO B111396 [0,0,0,0,0,0|3,0,0]=3 19 B11R1.28 C1=CC=C(C=C1)CSCCO B140387 [0,0,0,0,0,0|3,0,0]=3 20 B11R1.28 C1=CC=C(C=C1)NCCC#N A151772 [0,0,0,0,0,0|3,0,1]=4 21 B11R1.28 C1=CC=C(C=C1)NCCCO A151778 [0,0,0,0,0,0|3,0,0]=3 22 B11R1.28 C1=CC=C(C=C1)OCCCBr P160566 [0,0,0,0,0,0|3,0,0]=3 23 B11R1.28 C1=CC=C(C=C1)OCCCN P353595 [0,0,0,0,0,0|3,0,0]=3 24 B11R1.28 C1=CC=C(C=C1)OCCCO P160296 [0,0,0,0,0,0|3,0,0]=3 25 B11R1.28 C1=CC=NC(=C1)SSCCN P302155 [0,0,0,0,0,0|3,0,0]=3 26 B11R1.28 C1=CC=NC(=C1)SSCCO P404961 [0,0,0,0,0,0|3,0,0]=3 27 B11R1.28 C1=CN=CC=C1CCCCO P193755 [0,0,0,0,0,0|3,0,0]=3 28 B11R1.28 C=CCNCC1=CC=CC=C1 N158987 [0,0,0,0,0,0|2,0,2]=4 29 B11R1.28 C=CCOCC1=CC=CC=C1 A151095 [0,0,0,0,0,0|2,0,2]=4 30 B11R1.28 CCCC#CC1=CC=CC=C1 P404844 [0,0,0,0,0,0|1,0,2]=3 31 B11R1.28 CCCCCC1=CC=CC=C1 A151374 [0,0,0,0,0,0|1,0,0]=1 32 B11R1.28 CCCCCC1=CC=CC=N1 A132572 [0,0,0,0,0,0|0,0,0]=0 33 B11R1.28 CCCCCC1=CC=NC=C1 A151146 [0,0,0,0,0,0|2,0,0]=2 34 B11R1.28 CCCCCC1=NC=CN=C1 P345021 [0,0,0,0,0,0|1,0,0]=1 35 B11R1.28 CCCCNC1=CC=CC=C1 B140175 [0,0,0,0,0,0|2,0,0]=2 36 B11R1.28 CCCCNC1=CC=CC=C1 N590954 [0,0,0,0,0,0|2,0,0]=2 37 B11R1.28 CCCCOC1=CC=CC=C1 B153006 [0,0,0,0,0,0|2,0,0]=2 38 B11R1.28 CCCNCC1=CC=CC=C1 N191934 [0,0,0,0,0,0|2,0,0]=2 39 B11R1.28 CCOC=NC1=CC=CC=C1 E156427 [0,0,0,0,0,0|3,0,1]=4 40 B11R1.28 CNCCOC1=CC=CC=C1 N169984 [0,0,0,0,0,0|3,0,0]=3 41 B11R1.28 OCCSCc1ccccc1 H109405 [0,0,0,0,0,0|3,0,0]=3 42 B10R1.17 C#CCCC1=CC=CC=C1 P160653 [1,0,0,0,0,0|1,0,2]=4 43 B10R1.17 C1=CC=C(C=C1)CCC#N P160077 [1,0,0,0,0,0|2,0,1]=4 44 B10R1.17 C1=CC=C(C=C1)CCC=O P109695 [1,0,0,0,0,0|2,0,1]=4 45 B10R1.17 C1=CC=C(C=C1)CCCBr B106986 [1,0,0,0,0,0|2,0,0]=3 46 B10R1.17 C1=CC=C(C=C1)CCCCl C122445 [1,0,0,0,0,0|2,0,0]=3 47 B10R1.17 C1=CC=C(C=C1)CCCI I469194 [1,0,0,0,0,0|2,0,0]=3 48 B10R1.17 C1=CC=C(C=C1)CCCN P109694 [1,0,0,0,0,0|2,0,0]=3 49 B10R1.17 C1=CC=C(C=C1)CCCN P292870 [1,0,0,0,0,0|2,0,0]=3 50 B10R1.17 C1=CC=C(C=C1)CCCO P103663 [1,0,0,0,0,0|2,0,0]=3 51 B10R1.17 C1=CC=C(C=C1)CCNN P132003 [1,0,0,0,0,0|3,0,0]=4 52 B10R1.17 C1=CC=C(C=C1)CCNN P421872 [1,0,0,0,0,0|3,0,0]=4 53 B10R1.17 C1=CC=C(C=C1)COCCl B107578 [1,0,0,0,0,0|3,0,0]=4 54 B10R1.17 C1=CC=C(C=C1)NCCN N159346 [1,0,0,0,0,0|3,0,0]=4 55 B10R1.17 C1=CC=C(C=C1)NCCO N140440 [1,0,0,0,0,0|3,0,0]=4 56 B10R1.17 C1=CC=C(C=C1)OCCBr B100876 [1,0,0,0,0,0|3,0,0]=4 57 B10R1.17 C1=CC=C(C=C1)OCCCl B135225 [1,0,0,0,0,0|3,0,0]=4 58 B10R1.17 C1=CC=C(C=C1)OCCN P132517 [1,0,0,0,0,0|3,0,0]=4 59 B10R1.17 C1=CC=C(C=C1)OCCO E109367 [1,0,0,0,0,0|3,0,0]=4 60 B10R1.17 C1=CC=C(C=C1)OCCO E109368 [1,0,0,0,0,0|3,0,0]=4 61 B10R1.17 C1=CC=C(C=C1)OCCO E109369 [1,0,0,0,0,0|3,0,0]=4 62 B10R1.17 C1=CC=C(C=C1)OCCO E109370 [1,0,0,0,0,0|3,0,0]=4 63 B10R1.17 C1=CC=C(C=C1)OCCO P407596 [1,0,0,0,0,0|3,0,0]=4 64 B10R1.17 C1=CC=C(C=C1)SCCBr B152504 [1,0,0,0,0,0|3,0,0]=4 65 B10R1.17 C1=CC=C(C=C1)SCCCl C101832 [1,0,0,0,0,0|3,0,0]=4 66 B10R1.17 C1=CC=C(C=C1)SCCO P101545 [1,0,0,0,0,0|3,0,0]=4 67 B10R1.17 C1=CC=NC(=C1)CCCO P133143 [1,0,0,0,0,0|1,0,0]=2 68 B10R1.17 C1=CN=CC=C1CCCN P192638 [1,0,0,0,0,0|3,0,0]=4 69 B10R1.17 C1=CN=CC=C1CCCO P160633 [1,0,0,0,0,0|3,0,0]=4 70 B10R1.17 C=CCCC1=CC=CC=C1 P160313 [1,0,0,0,0,0|1,0,2]=4 71 B10R1.17 CCC#CC1=CC=CC=C1 P107031 [1,0,0,0,0,0|1,0,2]=4 72 B10R1.17 CCCCC1=CC=CC=C1 B100020 [1,0,0,0,0,0|1,0,0]=2 73 B10R1.17 CCCCC1=CC=CC=C1 B100021 [1,0,0,0,0,0|1,0,0]=2 74 B10R1.17 CCCCC1=CC=CC=C1 B128171 [1,0,0,0,0,0|1,0,0]=2 75 B10R1.17 CCCCC1=CN=CC=C1 B115782 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.17 CCCC[N+]1=CC=CC=C1 B101511 [1,0,0,0,0,0|2,0,0]=3 77 B10R1.17 CCCC[N+]1=CC=CC=C1 B102654 [1,0,0,0,0,0|2,0,0]=3 78 B10R1.17 CCCC[N+]1=CC=CC=C1 B102663 [1,0,0,0,0,0|2,0,0]=3 79 B10R1.17 CCCC[N+]1=CC=CC=C1 B120504 [1,0,0,0,0,0|2,0,0]=3 80 B10R1.17 CCCOC1=CC=CC=C1 P405762 [1,0,0,0,0,0|2,0,0]=3 81 B10R1.17 CCNCC1=CC=CC=C1 E113368 [1,0,0,0,0,0|2,0,0]=3 82 B10R1.17 CCNCC1=CC=CC=N1 N170728 [1,0,0,0,0,0|1,0,0]=2 83 B10R1.17 CCNCC1=CC=CC=N1 N598953 [1,0,0,0,0,0|1,0,0]=2 84 B10R1.17 CCNCC1=CC=NC=C1 E124679 [1,0,0,0,0,0|3,0,0]=4 85 B10R1.17 CCOCC1=CC=CC=C1 E193820 [1,0,0,0,0,0|2,0,0]=3 86 B10R1.17 CNCCC1=CC=CC=C1 N159074 [1,0,0,0,0,0|2,0,0]=3 87 B10R1.17 CNCCC1=CC=CC=N1 B102783 [1,0,0,0,0,0|1,0,0]=2 88 B10R1.17 CNCCC1=CC=CC=N1 B152161 [1,0,0,0,0,0|1,0,0]=2 89 B10R1.17 CNCCC1=CC=CC=N1 B301305 [1,0,0,0,0,0|1,0,0]=2 90 B10R1.17 CNCCC1=CC=CC=N1 B424673 [1,0,0,0,0,0|1,0,0]=2 91 B10R1.17 CNCCC1=CC=CC=N1 M424771 [1,0,0,0,0,0|1,0,0]=2 92 B10R1.17 COCCC1=CC=CC=C1 P160567 [1,0,0,0,0,0|2,0,0]=3 93 B10R1.17 COCCC1=CC=CC=N1 M157981 [1,0,0,0,0,0|1,0,0]=2 94 B10R1.17 COCSC1=CC=CC=C1 M158419 [1,0,0,0,0,0|3,0,0]=4 95 B12R1.1 C1=CC(=CC=C1OCCCCl)F C124480 [0,1,0,0,0,0|3,0,0]=4 96 B12R1.1 C1=CC(=CC=C1OCCCN)F F179792 [0,1,0,0,0,0|3,0,0]=4 97 B12R1.1 CCCCCC1=CC=C(C=C1)Br P115517 [0,1,0,0,0,0|1,0,0]=2 98 B12R1.1 CCCCCC1=CC=C(C=C1)N A151044 [0,1,0,0,0,0|1,0,0]=2 99 B12R1.1 CCCCCC1=CC=C(C=C1)O A131897 [0,1,0,0,0,0|1,0,0]=2 100 B12R1.1 CCCCOC1=CC=C(C=C1)N B151816 [0,1,0,0,0,0|2,0,0]=3 101 B12R1.1 CCCCOC1=CC=C(C=C1)O B152847 [0,1,0,0,0,0|2,0,0]=3 102 B12R1.8 C1=CC=C(C=C1)C#CCCCO P160163 [0,1,0,0,0,0|1,0,2]=4 103 B12R1.8 C1=CC=C(C=C1)CCCCCBr B404856 [0,1,0,0,0,0|1,0,0]=2 104 B12R1.8 C1=CC=C(C=C1)CCCCCO P160162 [0,1,0,0,0,0|1,0,0]=2 105 B12R1.8 C1=CC=C(C=C1)CCCN=C=O B301366 [0,1,0,0,0,0|2,0,1]=4 106 B12R1.8 C1=CC=C(C=C1)CNCCC#N B300485 [0,1,0,0,0,0|2,0,1]=4 107 B12R1.8 C1=CC=C(C=C1)CNCCCN N158976 [0,1,0,0,0,0|2,0,0]=3 108 B12R1.8 C1=CC=C(C=C1)CNCCCO B151809 [0,1,0,0,0,0|2,0,0]=3 109 B12R1.8 C1=CC=C(C=C1)COCCCBr B111397 [0,1,0,0,0,0|2,0,0]=3 110 B12R1.8 C1=CC=C(C=C1)COCCCBr B165144 [0,1,0,0,0,0|2,0,0]=3 111 B12R1.8 C1=CC=C(C=C1)COCCCO B151933 [0,1,0,0,0,0|2,0,0]=3 112 B12R1.8 C1=CC=C(C=C1)OCCCCBr P160718 [0,1,0,0,0,0|2,0,0]=3 113 B12R1.8 C1=CC=C(C=C1)OCCCCCl P335977 [0,1,0,0,0,0|2,0,0]=3 114 B12R1.8 CCCCC#CC1=CC=CC=C1 P160657 [0,1,0,0,0,0|1,0,1]=3 115 B12R1.8 CCCCCCC1=CC=CC=C1 H107002 [0,1,0,0,0,0|1,0,0]=2 116 B12R1.8 CCCCCCC1=CC=CC=C1 H107003 [0,1,0,0,0,0|1,0,0]=2 117 B12R1.8 CCCCCC[N+]1=CC=CC=C1 H157301 [0,1,0,0,0,0|2,0,0]=3 118 B12R1.8 CCCCCC[N+]1=CC=CC=C1 N304538 [0,1,0,0,0,0|2,0,0]=3 119 B12R1.8 CCCCNCC1=CC=CC=C1 N159171 [0,1,0,0,0,0|1,0,0]=2 120 B12R1.27 C1=CC=C(C=C1)OCC(CO)O P133480 [0,1,0,0,0,0|3,0,0]=4 121 B12R1.27 CC(CO)NCC1=CC=CC=C1 S589912 [0,1,0,0,0,0|3,0,0]=4 122 B12R1.27 CCC(=O)OCC1=CC=CC=C1 B151869 [0,1,0,0,0,0|2,0,1]=4 123 B12R1.27 COC(=O)CCC1=CC=CC=C1 M103601 [0,1,0,0,0,0|2,0,1]=4 124 B12R1.27 COC(=O)CCC1=CC=CC=C1 M140616 [0,1,0,0,0,0|2,0,1]=4 125 B12R1.28 CCCCCC1=CC=CC(=O)O1 P134904 [0,1,0,0,0,0|1,0,0]=2 126 B12R1.28 CCCCOC1=CC=CC(=C1)O B152843 [0,1,0,0,0,0|2,0,0]=3 127 B12R1.30 C1=CC=NC(=C1)C(=O)NCCO N419977 [0,1,0,0,0,0|2,0,1]=4 128 B12R1.30 CCCCC(=O)C1=CC=CC=C1 V107009 [0,1,0,0,0,0|1,0,1]=3 129 B12R1.30 CCCCC(C1=CC=CC=C1)O P160160 [0,1,0,0,0,0|1,0,0]=2 130 B12R1.30 CCCCC(C1=CC=CC=C1)O P424881 [0,1,0,0,0,0|1,0,0]=2 131 B12R1.30 CCCOC(=O)C1=CC=CC=C1 P160151 [0,1,0,0,0,0|2,0,1]=4 132 B12R1.30 CN(CCCN)C1=CC=CC=C1 N158989 [0,1,0,0,0,0|3,0,0]=4 133 B12R1.30 CNCCC(C1=CC=CC=C1)O A136323 [0,1,0,0,0,0|2,0,0]=3 134 B12R1.32 CCOC(=O)CC1=CC=CC=C1 E103494 [0,1,0,0,0,0|2,0,1]=4 135 B12R1.32 CCOC(=O)CC1=CC=CC=C1 E103495 [0,1,0,0,0,0|2,0,1]=4 136 B12R1.32 CCOC(=O)CC1=CC=CC=N1 E138597 [0,1,0,0,0,0|1,0,1]=3 137 B12R1.32 CN(CCO)CC1=CC=CC=C1 M134243 [0,1,0,0,0,0|3,0,0]=4 138 B12R1.252 C1=CC=C(C=C1)CCCC(=O)O P132032 [0,1,0,0,0,0|2,0,1]=4 139 B12R1.252 C1=CC=C(C=C1)CCCC(=O)O P422236 [0,1,0,0,0,0|2,0,1]=4 140 B12R1.252 C1=CC=C(C=C1)CCCC(=O)[O-] S305161 [0,1,0,0,0,0|2,0,1]=4 141 B12R1.252 CC(=O)COCC1=CC=CC=C1 B168757 [0,1,0,0,0,0|2,0,1]=4 142 B12R1.252 CC(=O)NCCC1=CC=CC=C1 N159423 [0,1,0,0,0,0|2,0,1]=4 143 B12R1.252 CC(=O)OCCC1=CC=CC=C1 P160150 [0,1,0,0,0,0|2,0,1]=4 144 B12R1.252 CC(COCC1=CC=CC=C1)O B123078 [0,1,0,0,0,0|2,0,0]=3 145 B12R1.252 CC(COCC1=CC=CC=C1)O B123080 [0,1,0,0,0,0|2,0,0]=3 146 B10R0.71 CCCCCC=CC=CC=O D107642 [0,0,1,0,0,0|1,0,0]=2 147 B10R0.71 CCCCCC=CC=CC=O D303153 [0,0,1,0,0,0|1,0,0]=2 148 B10R0.71 CCCCCCCC=CC=O D117855 [0,0,1,0,0,0|1,0,2]=4 149 B10R0.91 CCCCCC(=O)C=CC=O O274680 [0,0,1,0,0,0|2,0,0]=3 150 B10R0.91 CCCCCC(=O)OCC=C A109767 [0,0,1,0,0,0|2,0,1]=4 151 B10R0.91 CCCCCC(C=CC=O)O H274882 [0,0,1,0,0,0|2,0,1]=4 152 B12R2.2 C1CC(=NC1)C2=CC=CC=C2 P341771 [0,0,0,1,0,0|2,0,1]=4 153 B12R2.2 C1CC(NC1)C2=CC=CC=C2 P345688 [0,0,0,1,0,0|2,0,0]=3 154 B12R2.2 C1CC(NC1)C2=CC=CC=C2 R176807 [0,0,0,1,0,0|2,0,0]=3 155 B12R2.2 C1CC(NC1)C2=CN=CC=C2 N113829 [0,0,0,1,0,0|3,0,0]=4 156 B12R2.2 C1CCN(C1)C2=CC=CC=C2 P332600 [0,0,0,1,0,0|2,0,0]=3 157 B12R2.2 C1CCN(C1)C2=CC=NC=C2 P121075 [0,0,0,1,0,0|3,0,0]=4 158 B12R2.2 C1CSC(S1)C2=CC=CC=C2 P404945 [0,0,0,1,0,0|3,0,0]=4 159 B12R2.1081 C1CC(C2=CC=CC=C2C1)N T102999 [0,0,0,1,0,0|2,0,0]=3 160 B12R2.1081 C1CC(C2=CC=CC=C2C1)N T113718 [0,0,0,1,0,0|2,0,0]=3 161 B12R2.1081 C1CC(C2=CC=CC=C2C1)N T113722 [0,0,0,1,0,0|2,0,0]=3 162 B12R2.1081 C1CC(C2=CC=CC=C2C1)N T401554 [0,0,0,1,0,0|2,0,0]=3 163 B12R2.1081 C1CC(C2=CC=CC=C2C1)O R160835 [0,0,0,1,0,0|2,0,0]=3 164 B12R2.1081 C1CC(C2=CC=CC=C2C1)O S161373 [0,0,0,1,0,0|2,0,0]=3 165 B12R2.1081 C1CC(C2=CC=CC=C2C1)O T161537 [0,0,0,1,0,0|2,0,0]=3 166 B12R2.1081 C1CC2=C(C=CC=N2)C(=O)C1 T176711 [0,0,0,1,0,0|1,0,1]=3 167 B12R2.1081 C1CC2=CC=CC=C2C(=O)C1 T106838 [0,0,0,1,0,0|2,0,1]=4 168 B12R2.1081 CC1C2=CC=CC=C2CCN1 M193575 [0,0,0,1,0,0|2,0,0]=3 169 B12R2.1081 CC1CNCC2=CC=CC=C12 P165923 [0,0,0,1,0,0|2,0,0]=3 170 B12R2.2057 C1C(O1)COC2=CC=CC=C2 G156841 [0,0,0,1,0,0|3,0,0]=4 171 B12R2.2057 C1C(O1)COC2=CC=CC=C2 O123062 [0,0,0,1,0,0|3,0,0]=4 172 B12R2.2057 C1C(O1)COC2=CC=CC=C2 S139208 [0,0,0,1,0,0|3,0,0]=4 173 B12R2.2057 C1CC1NCC2=CC=CC=C2 N181212 [0,0,0,1,0,0|2,0,0]=3 174 B12R2.2057 C1CC1NCC2=CN=CC=C2 C351317 [0,0,0,1,0,0|3,0,0]=4 175 B10R1.21 C1=COC(=C1)CSCCN F156651 [0,0,0,0,1,0|3,0,0]=4 176 B10R1.21 CCCCCC1=CC=CO1 P103007 [0,0,0,0,1,0|1,0,0]=2 177 B10R1.21 CCCCCC1=CC=CS1 P160668 [0,0,0,0,1,0|1,0,0]=2 178 B10R1.21 CCCCCN1C=CN=C1 P330951 [0,0,0,0,1,0|2,0,0]=3 179 B9R0.5 CCCCCC(=O)OC=C V162949 [1,0,1,0,0,0|2,0,0]=4 180 B9R0.45 CCCCC=CC=CC=O N102611 [1,0,1,0,0,0|1,0,0]=3 181 B9R0.45 CCCCCCC=CC=O T162631 [1,0,1,0,0,0|1,0,1]=4 182 B9R1.8 C1=CC=C(C=C1)CCBr B106895 [2,0,0,0,0,0|2,0,0]=4 183 B9R1.8 C1=CC=C(C=C1)CCCl C136679 [2,0,0,0,0,0|2,0,0]=4 184 B9R1.8 C1=CC=C(C=C1)CCI I138375 [2,0,0,0,0,0|2,0,0]=4 185 B9R1.8 C1=CC=C(C=C1)CCN P105641 [2,0,0,0,0,0|2,0,0]=4 186 B9R1.8 C1=CC=C(C=C1)CCN P160641 [2,0,0,0,0,0|2,0,0]=4 187 B9R1.8 C1=CC=C(C=C1)CCN P290339 [2,0,0,0,0,0|2,0,0]=4 188 B9R1.8 C1=CC=C(C=C1)CCN P408003 [2,0,0,0,0,0|2,0,0]=4 189 B9R1.8 C1=CC=C(C=C1)CCN P421867 [2,0,0,0,0,0|2,0,0]=4 190 B9R1.8 C1=CC=C(C=C1)CCN P425250 [2,0,0,0,0,0|2,0,0]=4 191 B9R1.8 C1=CC=C(C=C1)CCN P491880 [2,0,0,0,0,0|2,0,0]=4 192 B9R1.8 C1=CC=C(C=C1)CCN P493037 [2,0,0,0,0,0|2,0,0]=4 193 B9R1.8 C1=CC=C(C=C1)CCN P493125 [2,0,0,0,0,0|2,0,0]=4 194 B9R1.8 C1=CC=C(C=C1)CCO P108195 [2,0,0,0,0,0|2,0,0]=4 195 B9R1.8 C1=CC=C(C=C1)CCO P108197 [2,0,0,0,0,0|2,0,0]=4 196 B9R1.8 C1=CC=C(C=C1)CCO P424995 [2,0,0,0,0,0|2,0,0]=4 197 B9R1.8 C1=CC=C(C=C1)CCS P160530 [2,0,0,0,0,0|2,0,0]=4 198 B9R1.8 C1=CC=NC(=C1)CC#N P160781 [2,0,0,0,0,0|1,0,1]=4 199 B9R1.8 C1=CC=NC(=C1)CCBr B186289 [2,0,0,0,0,0|1,0,0]=3 200 B9R1.8 C1=CC=NC(=C1)CCN A151790 [2,0,0,0,0,0|1,0,0]=3 201 B9R1.8 C1=CC=NC(=C1)CCO P160791 [2,0,0,0,0,0|1,0,0]=3 202 B9R1.8 C1=CN=C(C=N1)CCS M103122 [2,0,0,0,0,0|2,0,0]=4 203 B9R1.8 CCCC1=CC=CC=C1 P104621 [2,0,0,0,0,0|1,0,0]=3 204 B9R1.8 CCCC1=CC=CC=C1 P104624 [2,0,0,0,0,0|1,0,0]=3 205 B9R1.8 CCCC1=CC=CC=C1 P104625 [2,0,0,0,0,0|1,0,0]=3 206 B9R1.8 CCCC1=CC=CC=C1 P104626 [2,0,0,0,0,0|1,0,0]=3 207 B9R1.8 CCCC1=CC=CC=C1 P128158 [2,0,0,0,0,0|1,0,0]=3 208 B9R1.8 CCCC1=CC=CC=N1 P160637 [2,0,0,0,0,0|0,0,0]=2 209 B9R1.8 CCCC1=CC=NC=C1 P160632 [2,0,0,0,0,0|2,0,0]=4 210 B9R1.8 CCCC1=NC=CN=C1 P132679 [2,0,0,0,0,0|1,0,0]=3 211 B9R1.8 CCC[N+]1=CC=CC=C1 P404861 [2,0,0,0,0,0|2,0,0]=4 212 B9R1.8 CCNC1=CC=CC=C1 E103974 [2,0,0,0,0,0|2,0,0]=4 213 B9R1.8 CCOC1=CC=CC=C1 E108654 [2,0,0,0,0,0|2,0,0]=4 214 B9R1.8 CCOC1=CC=CC=C1 E108655 [2,0,0,0,0,0|2,0,0]=4 215 B9R1.8 CCOC1=CC=CC=N1 E137467 [2,0,0,0,0,0|1,0,0]=3 216 B9R1.8 CCOC1=NC=CN=C1 E136587 [2,0,0,0,0,0|2,0,0]=4 217 B9R1.8 CCSC1=CC=CC=C1 E101809 [2,0,0,0,0,0|2,0,0]=4 218 B9R1.8 CNCC1=CC=CC=C1 B106919 [2,0,0,0,0,0|2,0,0]=4 219 B9R1.8 CNCC1=CC=CC=N1 M168526 [2,0,0,0,0,0|1,0,0]=3 220 B9R1.8 COCC1=CC=CC=C1 B103161 [2,0,0,0,0,0|2,0,0]=4 221 B9R1.8 COCC1=CC=CC=C1 B591251 [2,0,0,0,0,0|2,0,0]=4 222 B9R1.8 CSCC1=CC=CC=C1 B152510 [2,0,0,0,0,0|2,0,0]=4 223 B11R0.3 CCCCCCC=CC=CC=O T347359 [0,1,1,0,0,0|1,0,0]=3 224 B11R1.1 C1=CC(=CC=C1CCCN)Cl C191754 [1,1,0,0,0,0|2,0,0]=4 225 B11R1.1 C1=CC(=CC=C1CCCO)Br B135402 [1,1,0,0,0,0|2,0,0]=4 226 B11R1.1 C1=CC(=CC=C1CCCO)Cl C405534 [1,1,0,0,0,0|2,0,0]=4 227 B11R1.1 C1=CC(=CC=C1CCCO)O W132591 [1,1,0,0,0,0|2,0,0]=4 228 B11R1.1 CCCCC1=CC=C(C=C1)Br B115516 [1,1,0,0,0,0|1,0,0]=3 229 B11R1.1 CCCCC1=CC=C(C=C1)Cl B167540 [1,1,0,0,0,0|1,0,0]=3 230 B11R1.1 CCCCC1=CC=C(C=C1)I B124312 [1,1,0,0,0,0|1,0,0]=3 231 B11R1.1 CCCCC1=CC=C(C=C1)N B100731 [1,1,0,0,0,0|1,0,0]=3 232 B11R1.1 CCCCC1=CC=C(C=C1)O B152848 [1,1,0,0,0,0|1,0,0]=3 233 B11R1.1 CCCC[N+]1=CC=C(C=C1)C B120508 [1,1,0,0,0,0|2,0,0]=4 234 B11R1.1 CCCC[N+]1=CC=C(C=C1)C B120511 [1,1,0,0,0,0|2,0,0]=4 235 B11R1.1 CCCC[N+]1=CC=C(C=C1)C B120512 [1,1,0,0,0,0|2,0,0]=4 236 B11R1.1 CCCC[N+]1=CC=C(C=C1)C B343853 [1,1,0,0,0,0|2,0,0]=4 237 B11R1.1 CCCC[N+]1=CC=C(C=C1)C W196192 [1,1,0,0,0,0|2,0,0]=4 238 B11R1.1 CCCOC1=CC=C(C=C1)Br B138795 [1,1,0,0,0,0|2,0,0]=4 239 B11R1.1 CCCOC1=CC=C(C=C1)N P420032 [1,1,0,0,0,0|2,0,0]=4 240 B11R1.1 CCCOC1=CC=C(C=C1)O P132532 [1,1,0,0,0,0|2,0,0]=4 241 B11R1.1 CCOCC1=CC=C(C=C1)O E194029 [1,1,0,0,0,0|2,0,0]=4 242 B11R1.1 COCCC1=CC=C(C=C1)O M136398 [1,1,0,0,0,0|2,0,0]=4 243 B11R1.16 C1=CC=C(C=C1)C(CCCl)O C123100 [1,1,0,0,0,0|2,0,0]=4 244 B11R1.16 C1=CC=C(C=C1)C(CCCl)O C123101 [1,1,0,0,0,0|2,0,0]=4 245 B11R1.16 C1=CC=C(C=C1)C(CCCl)O C153387 [1,1,0,0,0,0|2,0,0]=4 246 B11R1.16 C1=CC=C(C=C1)C(CCO)N A101338 [1,1,0,0,0,0|2,0,0]=4 247 B11R1.16 C1=CC=C(C=C1)C(CCO)N A101343 [1,1,0,0,0,0|2,0,0]=4 248 B11R1.16 C1=CC=C(C=C1)C(CCO)N A101349 [1,1,0,0,0,0|2,0,0]=4 249 B11R1.16 CC(CCO)C1=CC=CC=C1 P169190 [1,1,0,0,0,0|2,0,0]=4 250 B11R1.16 CC(CCO)C1=CC=CC=C1 P638679 [1,1,0,0,0,0|2,0,0]=4 251 B11R1.16 CC(CNC)C1=CC=CC=C1 P342591 [1,1,0,0,0,0|2,0,0]=4 252 B11R1.16 CCCC(=O)C1=CC=CC=C1 B100860 [1,1,0,0,0,0|1,0,1]=4 253 B11R1.16 CCCC(=O)C1=CC=CC=N1 B588269 [1,1,0,0,0,0|0,0,1]=3 254 B11R1.16 CCCC(C1=CC=CC=C1)O P160157 [1,1,0,0,0,0|1,0,0]=3 255 B11R1.16 CCCC(C1=CC=CC=C1)O R468963 [1,1,0,0,0,0|1,0,0]=3 256 B11R1.16 CCCC(C1=CC=CC=C1)O S468962 [1,1,0,0,0,0|1,0,0]=3 257 B11R1.16 CCOC(=O)C1=CC=CC=N1 E133202 [1,1,0,0,0,0|1,0,1]=4 258 B11R1.16 CNCC(C1=CC=CC=C1)O M351446 [1,1,0,0,0,0|2,0,0]=4 259 B11R1.16 COCC(C1=CC=CC=C1)N R185788 [1,1,0,0,0,0|2,0,0]=4 260 B11R1.17 C1=CC=C(C(=C1)CCCO)Br B193732 [1,1,0,0,0,0|2,0,0]=4 261 B11R1.17 CCCCC1=CC=CC=C1N B151822 [1,1,0,0,0,0|1,0,0]=3 262 B11R1.24 C1=CC(=CC(=C1)F)CCCBr B587429 [1,1,0,0,0,0|2,0,0]=4 263 B11R1.24 CCCC[N+]1=CC=CC(=C1)C B120506 [1,1,0,0,0,0|2,0,0]=4 264 B11R1.24 CCCC[N+]1=CC=CC(=C1)C B120507 [1,1,0,0,0,0|2,0,0]=4 265 B11R1.24 CCNCC1=CC(=CC=C1)F N187982 [1,1,0,0,0,0|2,0,0]=4 266 B11R1.40 C1=CC=C(C=C1)CC(CO)N P100530 [1,1,0,0,0,0|2,0,0]=4 267 B11R1.40 C1=CC=C(C=C1)CC(CO)N P109244 [1,1,0,0,0,0|2,0,0]=4 268 B11R1.40 C1=CC=C(C=C1)CC(CO)N S160981 [1,1,0,0,0,0|2,0,0]=4 269 B11R1.40 CCC(=O)CC1=CC=CC=C1 P160130 [1,1,0,0,0,0|1,0,1]=4 270 B11R1.40 CCC(CC1=CC=CC=C1)N P344719 [1,1,0,0,0,0|1,0,0]=3 271 B11R1.40 CCC(CC1=CC=CC=C1)O E352402 [1,1,0,0,0,0|1,0,0]=3 272 B11R1.40 COC(=O)CC1=CC=CC=N1 M131920 [1,1,0,0,0,0|1,0,1]=4 273 B11R1.91 C1=CC=NC(=C1)CCC(=O)O P167476 [1,1,0,0,0,0|1,0,1]=4 274 B11R1.91 CC(=O)CCC1=CC=CC=C1 P106914 [1,1,0,0,0,0|1,0,1]=4 275 B11R1.91 CC(C)NCC1=CC=CC=C1 B100437 [1,1,0,0,0,0|2,0,0]=4 276 B11R1.91 CC(CCC1=CC=CC=C1)N M168739 [1,1,0,0,0,0|1,0,0]=3 277 B11R1.91 CC(CCC1=CC=CC=C1)O I168710 [1,1,0,0,0,0|1,0,0]=3 278 B11R1.91 CC(CCC1=CC=CC=C1)O I170111 [1,1,0,0,0,0|1,0,0]=3 279 B11R1.91 CC(CCC1=CC=CC=C1)O P160159 [1,1,0,0,0,0|1,0,0]=3 280 B11R1.91 CC(COC1=CC=CC=C1)O B299831 [1,1,0,0,0,0|2,0,0]=4 281 B11R1.91 CC(COC1=CC=CC=C1)O P135297 [1,1,0,0,0,0|2,0,0]=4 282 B11R1.91 CN(C)CCC1=CC=CC=C1 N302096 [1,1,0,0,0,0|2,0,0]=4 283 B11R1.4 CCCCCCC1=CC=CS1 H111808 [0,1,0,0,1,0|1,0,0]=3 284 B11R1.4 CCCCCCC1=CSC=C1 H110541 [0,1,0,0,1,0|1,0,0]=3 285 B11R1.4 CCCCCCN1C=CN=C1 H189113 [0,1,0,0,1,0|2,0,0]=4 286 B11R1.4 CCCCCCN1C=CN=C1 H406316 [0,1,0,0,1,0|2,0,0]=4 287 B11R1.27 CCCCCN1C=C[N+](=C1)C M588370 [0,1,0,0,1,0|2,0,0]=4 288 B11R1.27 CCCCCN1C=C[N+](=C1)C M588550 [0,1,0,0,1,0|2,0,0]=4 289 B11R1.29 CNCCC(C1=CC=CS1)O S160977 [0,1,0,0,1,0|2,0,0]=4 290 B11R1.180 CCCCCC1=CCCC1=O P160131 [0,1,0,0,1,0|0,0,2]=4 291 B13R1.9 CCCCCCC1=CC=C(C=C1)Br B115518 [0,2,0,0,0,0|1,0,0]=3 292 B13R1.9 CCCCCCC1=CC=C(C=C1)N H157102 [0,2,0,0,0,0|1,0,0]=3 293 B13R1.9 CCCCCCC1=CC=C(C=C1)O H133197 [0,2,0,0,0,0|1,0,0]=3 294 B13R1.9 CCCCCOC1=CC=C(C=C1)O A135781 [0,2,0,0,0,0|1,0,0]=3 295 B13R1.17 CCCCC(=O)C1=CC=C(C=C1)Br B133573 [0,2,0,0,0,0|1,0,1]=4 296 B13R1.17 CCCCC(=O)C1=CC=C(C=C1)Cl C133286 [0,2,0,0,0,0|1,0,1]=4 297 B13R1.17 CCCCC(=O)C1=CC=C(C=C1)O H103147 [0,2,0,0,0,0|1,0,1]=4 298 B13R1.19 CCCC(=O)NC1=NC=C(C=C1)Br N587329 [0,2,0,0,0,0|1,0,1]=4 299 B13R1.19 CCOC(=O)CC1=NC=C(C=C1)Br E171863 [0,2,0,0,0,0|1,0,1]=4 300 B13R1.19 CCOC(=O)CC1=NC=C(C=C1)F E586112 [0,2,0,0,0,0|1,0,1]=4 301 B13R1.369 CCCCCC1=C(C=C(C=C1)C)O A151165 [0,2,0,0,0,0|1,0,0]=3 302 B13R1.369 CCCCCC1=C(C=C(C=C1)C)O A421174 [0,2,0,0,0,0|1,0,0]=3 303 B13R1.371 CCCCCC1=CC=C(C=C1)C#C E115543 [0,2,0,0,0,0|1,0,0]=3 304 B13R1.371 CCCCOC1=CC=C(C=C1)C#N B184944 [0,2,0,0,0,0|2,0,0]=4 305 B13R1.371 CCCCOC1=CC=C(C=C1)C=O B129998 [0,2,0,0,0,0|2,0,0]=4 306 B13R1.371 CCCCOC1=CC=C(C=C1)CO B137646 [0,2,0,0,0,0|2,0,0]=4 307 B13R1.371 COC1=CC=C(C=C1)CCCCO W135951 [0,2,0,0,0,0|2,0,0]=4 308 B13R1.513 CC(C)CCOC1=CC=C(C=C1)N C338229 [0,2,0,0,0,0|2,0,0]=4 309 B13R1.24 CCCCCC(=O)C1=CC=CC=C1 H156993 [0,2,0,0,0,0|1,0,0]=3 310 B13R1.24 CCCCCC(C1=CC=CC=C1)O P160139 [0,2,0,0,0,0|1,0,0]=3 311 B13R1.24 CCCCOC(=O)C1=CC=CC=C1 B110620 [0,2,0,0,0,0|1,0,1]=4 312 B13R1.24 CCCCOC(=O)C1=CC=CC=C1 B110621 [0,2,0,0,0,0|1,0,1]=4 313 B13R1.24 CCCCOC(=O)C1=CC=CC=C1 B110622 [0,2,0,0,0,0|1,0,1]=4 314 B13R1.24 CCCCSC(=O)C1=CC=CC=C1 S161293 [0,2,0,0,0,0|1,0,1]=4 315 B13R1.28 C1=CC=C(C=C1)CNCCCCO B152480 [0,2,0,0,0,0|1,0,0]=3 316 B13R1.28 C1=CC=C(C=C1)COCCCCBr B124385 [0,2,0,0,0,0|1,0,0]=3 317 B13R1.28 C1=CC=C(C=C1)COCCCCO B471125 [0,2,0,0,0,0|1,0,0]=3 318 B13R1.28 C1=CC=C(C=C1)OCCCCCBr P339830 [0,2,0,0,0,0|1,0,0]=3 319 B13R1.28 C1=CC=C(C=C1)OCCOCCO D154350 [0,2,0,0,0,0|2,0,0]=4 320 B13R1.28 CCCCCCCC1=CC=CC=C1 H157141 [0,2,0,0,0,0|1,0,0]=3 321 B13R1.42 CCCC(=O)OCC1=CC=CC=C1 B151844 [0,2,0,0,0,0|1,0,1]=4 322 B13R1.42 CCCC(C#CC1=CC=CC=C1)O P468870 [0,2,0,0,0,0|1,0,1]=4 323 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 E107514 [0,2,0,0,0,0|1,0,1]=4 324 B13R1.337 C1=CC=C(C=C1)CCCCC(=O)O P160206 [0,2,0,0,0,0|1,0,1]=4 325 B13R1.337 C1=CC=C(C=C1)CCCCC(=O)O P422720 [0,2,0,0,0,0|1,0,1]=4 326 B13R1.337 CC(=O)CCOCC1=CC=CC=C1 B464409 [0,2,0,0,0,0|1,0,1]=4 327 B13R1.718 C1=CC=C(C=C1)COCC(CBr)O B151934 [0,2,0,0,0,0|2,0,0]=4 328 B13R1.718 C1=CC=C(C=C1)COCC(CO)O R139002 [0,2,0,0,0,0|2,0,0]=4 329 B13R1.718 C1=CC=C(C=C1)COCC(CO)O S138373 [0,2,0,0,0,0|2,0,0]=4 330 B13R1.718 CCC(=O)OCCC1=CC=CC=C1 P160125 [0,2,0,0,0,0|1,0,1]=4 331 B13R1.16 CCCCOC1=C(C(=CC=C1)F)F N131967 [0,2,0,0,0,0|2,0,0]=4 332 B13R1.20 CCOC(=O)CC1=NC(=CC=C1)Cl E587673 [0,2,0,0,0,0|1,0,1]=4 333 B13R1.55 CCCCCC1=CC(=CC(=C1)O)O O135157 [0,2,0,0,0,0|1,0,0]=3 334 B13R1.55 CCCCCC1=CC(=CC(=C1)O)O O424314 [0,2,0,0,0,0|1,0,0]=3 335 B13R1.348 CC(C)CC(=O)CC1=CC=CC=C1 M193800 [0,2,0,0,0,0|1,0,1]=4 336 B13R1.348 CC(C)CC(CC1=CC=CC=C1)O M158741 [0,2,0,0,0,0|1,0,0]=3 337 B13R1.470 CCOC(=O)CC1=C(C=CC=N1)Br E175457 [0,2,0,0,0,0|1,0,1]=4 338 B13R1.3523 CC(C)(CNCC1=CC=CC=C1)O B590223 [0,2,0,0,0,0|2,0,0]=4 339 B13R1.3523 C[Si](C)(CCCC1=CC=CC=C1)Cl C153515 [0,2,0,0,0,0|1,1,0]=4 340 B11R2.1 C1CC2=C(C1O)C=CC=N2 D586296 [1,0,0,1,0,0|1,0,0]=3 341 B11R2.1 C1CC2=CC=CC=C2C1N A114505 [1,0,0,1,0,0|2,0,0]=4 342 B11R2.1 C1CC2=CC=CC=C2C1N D186125 [1,0,0,1,0,0|2,0,0]=4 343 B11R2.1 C1CC2=CC=CC=C2C1N S192732 [1,0,0,1,0,0|2,0,0]=4 344 B11R2.1 C1CC2=CC=CC=C2C1N S469445 [1,0,0,1,0,0|2,0,0]=4 345 B11R2.1 C1CC2=CC=CC=C2C1O H157335 [1,0,0,1,0,0|2,0,0]=4 346 B11R2.1 C1CC2=CC=CC=C2C1O H419517 [1,0,0,1,0,0|2,0,0]=4 347 B11R2.1 C1CC2=CC=CC=C2C1O H592262 [1,0,0,1,0,0|2,0,0]=4 348 B11R2.1 CC1CCC2=CC=CC=C12 M304586 [1,0,0,1,0,0|1,0,0]=3 349 B11R2.1 CC1CCC2=NC=CN=C12 M111400 [1,0,0,1,0,0|1,0,0]=3 350 B11R2.1 CC1CNC2=CC=CC=C12 M589123 [1,0,0,1,0,0|2,0,0]=4 351 B11R2.4 C1C(C1N)C2=CC=CC=C2 R132818 [1,0,0,1,0,0|2,0,0]=4 352 B11R2.4 C1C(C1N)C2=CC=CC=C2 T275460 [1,0,0,1,0,0|2,0,0]=4 353 B11R2.4 C1C(C1N)C2=CC=CC=C2 T422413 [1,0,0,1,0,0|2,0,0]=4 354 B11R2.20 C1CC2=C(C=CC=N2)OC1 D186135 [1,0,0,1,0,0|1,0,0]=3 355 B11R2.20 C1CC2=CC=CC=C2NC1 T107484 [1,0,0,1,0,0|2,0,0]=4 356 B11R2.20 C1CCC2=C(C1)C=CC=N2 T108003 [1,0,0,1,0,0|0,0,0]=2 357 B11R2.20 C1CCC2=C(C1)C=CN=C2 T162590 [1,0,0,1,0,0|2,0,0]=4 358 B11R2.20 C1CCC2=CC=CC=C2C1 T100976 [1,0,0,1,0,0|1,0,0]=3 359 B11R2.20 C1CCC2=CC=CC=C2C1 T100978 [1,0,0,1,0,0|1,0,0]=3 360 B11R2.20 C1CCC2=CC=CC=C2C1 T100979 [1,0,0,1,0,0|1,0,0]=3 361 B11R2.20 C1CCC2=CC=CC=C2C1 T100981 [1,0,0,1,0,0|1,0,0]=3 362 B11R2.20 C1CCC2=CC=CC=C2C1 T119673 [1,0,0,1,0,0|1,0,0]=3 363 B11R2.20 C1CCC2=NC=CN=C2C1 T161676 [1,0,0,1,0,0|1,0,0]=3 364 B11R2.20 C1CNCC2=C1C=CC=N2 T176221 [1,0,0,1,0,0|1,0,0]=3 365 B11R2.20 C1CNCC2=CC=CC=C21 T139420 [1,0,0,1,0,0|2,0,0]=4 366 B11R2.20 C1COC2=C(N1)C=CC=N2 D179428 [1,0,0,1,0,0|2,0,0]=4 367 B11R2.20 C1COC2=C(O1)C=CC=N2 D166866 [1,0,0,1,0,0|2,0,0]=4 368 B11R2.20 C1COCC2=CC=CC=C21 I122961 [1,0,0,1,0,0|2,0,0]=4 369 B11R2.238 C1C(N1)CC2=CC=CC=C2 S304496 [1,0,0,1,0,0|2,0,0]=4 370 B11R2.238 C1C(O1)CC2=CC=CC=C2 E472459 [1,0,0,1,0,0|2,0,0]=4 371 B11R2.238 C1CC1SC2=CC=CC=C2 C101828 [1,0,0,1,0,0|2,0,0]=4 372 B13R2.12 C1CC(NC1)C2=CC=C(C=C2)Br B184178 [0,1,0,1,0,0|2,0,0]=4 373 B13R2.12 C1CCC(C1)C2=CC=C(C=C2)O C477108 [0,1,0,1,0,0|1,0,0]=3 374 B13R2.12 C1CCN(C1)C2=CC=C(C=C2)Br B151811 [0,1,0,1,0,0|2,0,0]=4 375 B13R2.12 C1CCN(C1)C2=NN=C(C=C2)Cl C185896 [0,1,0,1,0,0|2,0,0]=4 376 B13R2.12 CC1=CC=C(C=C1)C2CCCC2 C195195 [0,1,0,1,0,0|1,0,0]=3 377 B13R2.3 C1CC(CC=C1)C2=CC=CC=C2 P160395 [0,1,0,1,0,0|1,0,1]=4 378 B13R2.3 C1CC(CNC1)C2=CC=CC=C2 P138790 [0,1,0,1,0,0|1,0,0]=3 379 B13R2.3 C1CCC(=CC1)C2=CC=CC=C2 P134539 [0,1,0,1,0,0|1,0,1]=4 380 B13R2.3 C1CCC(CC1)C2=CC=CC=C2 P111365 [0,1,0,1,0,0|1,0,0]=3 381 B13R2.3 C1CCN(CC1)C2=CC=CC=C2 P160168 [0,1,0,1,0,0|1,0,0]=3 382 B13R2.3 C1CCN(CC1)C2=CC=NC=C2 P121066 [0,1,0,1,0,0|2,0,0]=4 383 B13R2.3 C1CCNC(C1)C2=CC=CC=C2 R467341 [0,1,0,1,0,0|1,0,0]=3 384 B13R2.3 C1CCNC(C1)C2=CC=CC=N2 R467036 [0,1,0,1,0,0|0,0,0]=2 385 B13R2.3 C1CCNC(C1)C2=CN=CC=C2 A109397 [0,1,0,1,0,0|2,0,0]=4 386 B13R2.3 C1CCNC(C1)C2=CN=CC=C2 A124541 [0,1,0,1,0,0|2,0,0]=4 387 B13R2.3 C1CCNC(C1)C2=CN=CC=C2 A124543 [0,1,0,1,0,0|2,0,0]=4 388 B13R2.3 C1CCNC(C1)C2=CN=CC=C2 A493484 [0,1,0,1,0,0|2,0,0]=4 389 B13R2.3 C1CN(CCN1)C2=CC=CC=C2 P101918 [0,1,0,1,0,0|2,0,0]=4 390 B13R2.3 C1CN(CCN1)C2=CC=CC=C2 P137528 [0,1,0,1,0,0|2,0,0]=4 391 B13R2.3 C1CN(CCN1)C2=CC=CC=N2 P106881 [0,1,0,1,0,0|1,0,0]=3 392 B13R2.3 C1CN(CCN1)C2=NC=CC=N2 P132556 [0,1,0,1,0,0|2,0,0]=4 393 B13R2.3 C1CN(CCN1)C2=NC=CC=N2 P160729 [0,1,0,1,0,0|2,0,0]=4 394 B13R2.3 C1CNC(CN1)C2=CC=CC=C2 P468169 [0,1,0,1,0,0|2,0,0]=4 395 B13R2.3 C1CNCCC1C2=CC=CC=C2 P119111 [0,1,0,1,0,0|1,0,0]=3 396 B13R2.3 C1CNCCC1C2=CC=NC=C2 P400607 [0,1,0,1,0,0|2,0,0]=4 397 B13R2.3 C1COC(CN1)C2=CC=CC=C2 R586682 [0,1,0,1,0,0|2,0,0]=4 398 B13R2.3 C1COCCN1C2=CC=CC=C2 P118291 [0,1,0,1,0,0|2,0,0]=4 399 B13R2.3 C1COCCN1C2=CC=CC=N2 M168945 [0,1,0,1,0,0|1,0,0]=3 400 B13R2.3 C1COCOC1C2=CC=CC=C2 P160795 [0,1,0,1,0,0|2,0,0]=4 401 B13R2.15 CN1CCCC1C2=CN=CC=C2 D474156 [0,1,0,1,0,0|2,0,0]=4 402 B13R2.15 CN1CCCC1C2=CN=CC=C2 N274769 [0,1,0,1,0,0|2,0,0]=4 403 B13R2.15 CN1CCCC1C2=CN=CC=C2 N334654 [0,1,0,1,0,0|2,0,0]=4 404 B13R2.15 CN1CCCC1C2=CN=CC=C2 R333277 [0,1,0,1,0,0|2,0,0]=4 405 B13R2.15 CN1CCC[C@H]1C2=CN=CC=C2 N159378 [0,1,0,1,0,0|2,0,0]=4 406 B13R2.64 C1CCN(C1)CC2=CC=CC=C2 B192606 [0,1,0,1,0,0|1,0,0]=3 407 B13R2.64 C1COC(O1)CC2=CC=CC=C2 B153143 [0,1,0,1,0,0|2,0,0]=4 408 B13R2.64 C1COCN1CC2=CC=CC=C2 B151820 [0,1,0,1,0,0|2,0,0]=4 409 B13R2.1613 C1CC(C2=CC=CC=C2C1)C#N T405043 [0,1,0,1,0,0|1,0,1]=4 410 B13R2.2382 C1C(O1)COCC2=CC=CC=C2 B119627 [0,1,0,1,0,0|2,0,0]=4 411 B13R2.2382 C1C(O1)COCC2=CC=CC=C2 B119630 [0,1,0,1,0,0|2,0,0]=4 412 B13R2.2382 C1C(O1)COCC2=CC=CC=C2 P136148 [0,1,0,1,0,0|2,0,0]=4 413 B13R2.2383 C1C(CN1)OCC2=CC=CC=C2 B195675 [0,1,0,1,0,0|2,0,0]=4 414 B13R2.5252 C1CCC(=O)C2=CC=CC=C2C1 T162135 [0,1,0,1,0,0|1,0,1]=4 415 B13R2.10 C1CN(CC1N)C2=CC=CC=C2 P587810 [0,1,0,1,0,0|2,0,0]=4 416 B13R2.10 CC1COC(O1)C2=CC=CC=C2 B117532 [0,1,0,1,0,0|2,0,0]=4 417 B13R2.10 CC1COC(O1)C2=CC=CC=C2 B140514 [0,1,0,1,0,0|2,0,0]=4 418 B13R2.13 C1CC(NC1)C2=CC(=CC=C2)Br B342393 [0,1,0,1,0,0|2,0,0]=4 419 B13R2.371 CC1CCC(=O)C2=CC=CC=C12 M168319 [0,1,0,1,0,0|1,0,1]=4 420 B13R2.31 C1C(CN1CC2=CC=CC=C2)O B185153 [0,1,0,1,0,0|2,0,0]=4 421 B13R2.18 C1CC(NC1)C2=CC=CC=C2Br B586924 [0,1,0,1,0,0|2,0,0]=4 422 B13R2.3587 C1CC1COC2=C(C=CC=N2)I C186505 [0,1,0,1,0,0|1,0,0]=3 423 B9R1.12 C1=CN(C=C1)CCCBr B152723 [1,0,0,0,1,0|2,0,0]=4 424 B9R1.12 C1=CN(C=C1)CCCO H157253 [1,0,0,0,1,0|2,0,0]=4 425 B9R1.12 CCCCC1=CC=CO1 B152372 [1,0,0,0,1,0|1,0,0]=3 426 B9R1.12 CCCCC1=CC=CS1 N189024 [1,0,0,0,1,0|1,0,0]=3 427 B9R1.12 CCCCC1=CSC=C1 B100752 [1,0,0,0,1,0|1,0,0]=3 428 B9R1.12 CCCCC1=NC=CN1 B152375 [1,0,0,0,1,0|1,0,0]=3 429 B9R1.12 CCCCN1C=CN=C1 B152373 [1,0,0,0,1,0|2,0,0]=4