0 B11R1.83 C#CC1=CC=C(C=C1)OCC Z1080385490 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.83 C/C=C/C1=CC=C(C=C1)OC Z2315575049 [0,0,0,0,0,0|0,0,0]=0 2 B11R1.83 C=CCC1=CC=C(C=C1)C=O Z1511744017 [0,0,0,0,0,0|2,0,2]=4 3 B11R1.83 CC#CC1=CC=C(C=C1)C=O Z1322793976 [0,0,0,0,0,0|2,0,2]=4 4 B11R1.83 CCC1=CC=C(C=C1)/C=N/O Z49568588 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.83 CCC1=CC=C(C=C1)CCN Z285143808 [0,0,0,0,0,0|2,0,2]=4 6 B11R1.83 CCC1=CC=C(C=C1)CCO Z992949606 [0,0,0,0,0,0|2,0,2]=4 7 B11R1.83 CCCC1=CC=C(C=C1)C=O Z147641436 [0,0,0,0,0,0|2,0,2]=4 8 B11R1.83 CCNC1=CC=C(C=C1)C#N Z126933712 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.83 CCNC1=CC=C(C=C1)CC Z286410160 [0,0,0,0,0,0|2,0,1]=3 10 B11R1.83 CCNC1=CC=C(C=C1)CN Z954985480 [0,0,0,0,0,0|3,0,1]=4 11 B11R1.83 CCNC1=CC=C(C=C1)OC Z286371004 [0,0,0,0,0,0|1,0,1]=2 12 B11R1.83 CCNC1=CN=C(C=C1)OC Z334876678 [0,0,0,0,0,0|2,0,1]=3 13 B11R1.83 CCOC1=CC=C(C=C1)C#N Z53834532 [0,0,0,0,0,0|3,0,1]=4 14 B11R1.83 CCOC1=CC=C(C=C1)C=O Z53833126 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.83 CCOC1=CC=C(C=C1)NC Z335255846 [0,0,0,0,0,0|2,0,1]=3 16 B11R1.83 CCSC1=CC=C(C=C1)C#N Z332378580 [0,0,0,0,0,0|3,0,1]=4 17 B11R1.83 CNCC1=CC=C(C=C1)C#N Z123857104 [0,0,0,0,0,0|3,0,1]=4 18 B11R1.83 CNCC1=CC=C(C=C1)CO Z5435726703 [0,0,0,0,0,0|3,0,1]=4 19 B11R1.83 CNCC1=CC=C(C=C1)OC Z56928625 [0,0,0,0,0,0|1,0,1]=2 20 B11R1.83 CNCC1=CC=C(C=C1)SC Z56960262 [0,0,0,0,0,0|1,1,1]=3 21 B11R1.83 CNCC1=CN=C(C=C1)OC Z2490025030 [0,0,0,0,0,0|2,0,1]=3 22 B11R1.83 CNCC1=NC=C(C=C1)OC Z1849014421 [0,0,0,0,0,0|2,0,1]=3 23 B11R1.83 COC1=CC=C(C=C1)/C=N/O Z49568452 [0,0,0,0,0,0|2,0,0]=2 24 B11R1.83 COC1=CC=C(C=C1)CC#N Z104476452 [0,0,0,0,0,0|1,0,2]=3 25 B11R1.83 COC1=CC=C(C=C1)CC=O Z993017620 [0,0,0,0,0,0|1,0,1]=2 26 B11R1.83 COC1=CC=C(C=C1)CCN Z104476454 [0,0,0,0,0,0|1,0,2]=3 27 B11R1.83 COC1=CC=C(C=C1)N=C=S Z56921427 [0,0,0,0,0,0|2,0,1]=3 28 B11R1.83 COC1=NC=C(C=C1)CC#N Z1198263571 [0,0,0,0,0,0|2,0,2]=4 29 B11R1.83 COCC1=CC=C(C=C1)C#N Z295205408 [0,0,0,0,0,0|3,0,1]=4 30 B11R1.83 COCC1=CC=C(C=C1)C=O Z1198331617 [0,0,0,0,0,0|3,0,1]=4 31 B11R1.83 COCC1=CC=C(C=C1)CN Z240084734 [0,0,0,0,0,0|3,0,1]=4 32 B11R1.83 COCC1=CC=C(C=C1)CO Z1255394253 [0,0,0,0,0,0|3,0,1]=4 33 B11R1.83 CSC1=CC=C(C=C1)/C=N/O Z49568577 [0,0,0,0,0,0|2,1,0]=3 34 B11R1.83 CSC1=CC=C(C=C1)CC#N Z1114998149 [0,0,0,0,0,0|1,1,2]=4 35 B11R1.83 CSC1=CC=C(C=C1)CC=O Z1198331627 [0,0,0,0,0,0|1,1,1]=3 36 B11R1.83 CSCC1=CC=C(C=C1)C#N Z432419878 [0,0,0,0,0,0|3,0,1]=4 37 B11R1.83 CSCC1=CC=C(C=C1)C=O Z2216784275 [0,0,0,0,0,0|3,0,1]=4 38 B11R1.83 CSCC1=CC=C(C=C1)SC Z599630492 [0,0,0,0,0,0|1,1,1]=3 39 B10R1.1 CC1=CC=C(C=C1)/C=N/O Z49568558 [1,0,0,0,0,0|2,0,0]=3 40 B10R1.1 CC1=CC=C(C=C1)CC#N Z285131444 [1,0,0,0,0,0|1,0,2]=4 41 B10R1.1 CC1=CC=C(C=C1)CC=O Z993017610 [1,0,0,0,0,0|1,0,1]=3 42 B10R1.1 CC1=CC=C(C=C1)CCN Z1268153218 [1,0,0,0,0,0|1,0,2]=4 43 B10R1.1 CC1=CC=C(C=C1)CCO Z397587076 [1,0,0,0,0,0|1,0,2]=4 44 B10R1.1 CCCC1=CC=C(C=C1)Br Z299596168 [1,0,0,0,0,0|1,0,2]=4 45 B10R1.1 CCCC1=CC=C(C=C1)N Z104492166 [1,0,0,0,0,0|1,0,2]=4 46 B10R1.1 CCNC1=CC=C(C=C1)Br Z286365048 [1,0,0,0,0,0|2,0,1]=4 47 B10R1.1 CCNC1=CC=C(C=C1)Cl Z2902298062 [1,0,0,0,0,0|2,0,1]=4 48 B10R1.1 CCNC1=CC=C(C=C1)F Z89270849 [1,0,0,0,0,0|2,0,1]=4 49 B10R1.1 CCNC1=CC=C(C=C1)N Z359511474 [1,0,0,0,0,0|2,0,1]=4 50 B10R1.1 CCNC1=CC=C(C=C1)O Z1823256830 [1,0,0,0,0,0|1,0,1]=3 51 B10R1.1 CCOC1=CC=C(C=C1)C Z53834228 [1,0,0,0,0,0|1,0,1]=3 52 B10R1.1 CCOC1=CC=C(C=C1)N Z57127438 [1,0,0,0,0,0|2,0,1]=4 53 B10R1.1 CCOC1=CC=C(C=C1)S Z166646982 [1,0,0,0,0,0|1,1,1]=4 54 B10R1.1 CNCC1=CC=C(C=C1)Br Z56175269 [1,0,0,0,0,0|2,0,1]=4 55 B10R1.1 CNCC1=CC=C(C=C1)C Z56944115 [1,0,0,0,0,0|1,0,1]=3 56 B10R1.1 CNCC1=CC=C(C=C1)Cl Z56956070 [1,0,0,0,0,0|2,0,1]=4 57 B10R1.1 CNCC1=CC=C(C=C1)F Z56963340 [1,0,0,0,0,0|2,0,1]=4 58 B10R1.1 CNCC1=CC=C(C=C1)I Z4242747560 [1,0,0,0,0,0|2,0,1]=4 59 B10R1.1 CNCC1=NC=C(C=C1)C Z1255425232 [1,0,0,0,0,0|2,0,1]=4 60 B10R1.1 COCC1=CC=C(C=C1)N Z240084568 [1,0,0,0,0,0|2,0,1]=4 61 B10R1.1 CSCC1=CC=C(C=C1)Br Z19854469 [1,0,0,0,0,0|2,0,1]=4 62 B10R1.1 CSCC1=CC=C(C=C1)N Z732207336 [1,0,0,0,0,0|2,0,1]=4 63 B10R1.1 N#CCC1=CC=C(C=C1)O Z90120144 [1,0,0,0,0,0|1,0,2]=4 64 B10R1.1 NCCC1=CC=C(C=C1)O Z744729058 [1,0,0,0,0,0|1,0,2]=4 65 B10R1.1 O/N=C/C1=CC=C(C=C1)Br Z49568330 [1,0,0,0,0,0|3,0,0]=4 66 B10R1.1 O/N=C/C1=CC=C(C=C1)Cl Z49568332 [1,0,0,0,0,0|3,0,0]=4 67 B10R1.1 O/N=C/C1=CC=C(C=C1)F Z49568341 [1,0,0,0,0,0|3,0,0]=4 68 B10R1.1 O/N=C/C1=CC=C(C=C1)O Z49568314 [1,0,0,0,0,0|2,0,0]=3 69 B10R1.1 O=CCC1=CC=C(C=C1)Br Z1079442512 [1,0,0,0,0,0|2,0,1]=4 70 B10R1.1 O=CCC1=CC=C(C=C1)Cl Z993017718 [1,0,0,0,0,0|2,0,1]=4 71 B10R1.1 O=CCC1=CC=C(C=C1)F Z993017752 [1,0,0,0,0,0|2,0,1]=4 72 B10R1.1 O=CNC1=CC=C(C=C1)O Z87002541 [1,0,0,0,0,0|2,0,0]=3 73 B10R1.1 OCCC1=CC=C(C=C1)O Z1250886919 [1,0,0,0,0,0|1,0,2]=4 74 B10R1.3 C#CC1=CC=C(C=C1)C=O Z1203159515 [1,0,0,0,0,0|2,0,1]=4 75 B10R1.3 C#CC1=CC=C(C=C1)CC Z1080385542 [1,0,0,0,0,0|1,0,2]=4 76 B10R1.3 C#CC1=NC=C(C=C1)OC Z1255436508 [1,0,0,0,0,0|1,0,2]=4 77 B10R1.3 C=CC1=CC=C(C=C1)C=O Z1198150327 [1,0,0,0,0,0|2,0,0]=3 78 B10R1.3 CCC1=CC=C(C=C1)C#N Z57900361 [1,0,0,0,0,0|2,0,1]=4 79 B10R1.3 CCC1=CC=C(C=C1)C=O Z104477712 [1,0,0,0,0,0|2,0,0]=3 80 B10R1.3 CCC1=CC=C(C=C1)CN Z239626560 [1,0,0,0,0,0|2,0,1]=4 81 B10R1.3 CCC1=CN=C(C=C1)C=O Z1198235245 [1,0,0,0,0,0|3,0,0]=4 82 B10R1.3 CCC1=NC=C(C=C1)C=O Z1255494858 [1,0,0,0,0,0|3,0,0]=4 83 B10R1.3 CNC1=CC=C(C=C1)C#N Z331873490 [1,0,0,0,0,0|2,0,1]=4 84 B10R1.3 CNC1=CC=C(C=C1)C=O Z1203730934 [1,0,0,0,0,0|2,0,0]=3 85 B10R1.3 CNC1=CC=C(C=C1)CN Z954985428 [1,0,0,0,0,0|2,0,1]=4 86 B10R1.3 CNC1=CC=C(C=C1)OC Z335282780 [1,0,0,0,0,0|1,0,0]=2 87 B10R1.3 CNC1=CC=C(C=C1)SC Z335261640 [1,0,0,0,0,0|1,1,0]=3 88 B10R1.3 CNC1=CN=C(C=C1)OC Z335249570 [1,0,0,0,0,0|2,0,0]=3 89 B10R1.3 CNC1=NC=C(C=C1)OC Z1255359415 [1,0,0,0,0,0|2,0,0]=3 90 B10R1.3 CNC1=NC=C(C=N1)OC Z1203748902 [1,0,0,0,0,0|3,0,0]=4 91 B10R1.3 COC1=CC=C(C=C1)C#N Z53834531 [1,0,0,0,0,0|1,0,1]=3 92 B10R1.3 COC1=CC=C(C=C1)C=O Z53833125 [1,0,0,0,0,0|1,0,0]=2 93 B10R1.3 COC1=CC=C(C=C1)CO Z54603098 [1,0,0,0,0,0|1,0,1]=3 94 B10R1.3 COC1=CC=C(C=C1)CS Z1255360358 [1,0,0,0,0,0|1,0,1]=3 95 B10R1.3 COC1=CC=C(C=C1)OC Z53833835 [1,0,0,0,0,0|1,0,0]=2 96 B10R1.3 COC1=CN=C(C=C1)C=O Z1198176556 [1,0,0,0,0,0|2,0,0]=3 97 B10R1.3 COC1=CN=C(N=C1)C=O Z1198277529 [1,0,0,0,0,0|3,0,0]=4 98 B10R1.3 COC1=NC=C(C=C1)C#N Z212050236 [1,0,0,0,0,0|2,0,1]=4 99 B10R1.3 COC1=NC=C(C=C1)C=O Z1255356725 [1,0,0,0,0,0|2,0,0]=3 100 B10R1.3 COC1=NC=C(C=C1)CO Z800297984 [1,0,0,0,0,0|2,0,1]=4 101 B10R1.3 COC1=NC=C(C=N1)C=O Z274574980 [1,0,0,0,0,0|3,0,0]=4 102 B10R1.3 COC1=NN=C(C=C1)C=O Z1198278266 [1,0,0,0,0,0|3,0,0]=4 103 B10R1.3 CSC1=CC=C(C=C1)C#N Z57900348 [1,0,0,0,0,0|1,1,1]=4 104 B10R1.3 CSC1=CC=C(C=C1)C=O Z104478194 [1,0,0,0,0,0|1,1,0]=3 105 B10R1.3 CSC1=CC=C(C=C1)CCl Z56347089 [1,0,0,0,0,0|1,1,1]=4 106 B10R1.3 CSC1=CC=C(C=C1)CN Z54751956 [1,0,0,0,0,0|1,1,1]=4 107 B10R1.3 N#CC1=CC=C(C=C1)C=O Z104478052 [1,0,0,0,0,0|3,0,0]=4 108 B10R1.3 NCC1=CC=C(C=C1)C=O Z2418414207 [1,0,0,0,0,0|3,0,0]=4 109 B10R1.3 O=CC1=CC=C(C=C1)C=O Z104478582 [1,0,0,0,0,0|3,0,0]=4 110 B10R1.3 O=CC1=CC=C(C=C1)CBr Z1201624503 [1,0,0,0,0,0|3,0,0]=4 111 B10R1.3 O=CC1=CC=C(C=C1)CCl Z1198151895 [1,0,0,0,0,0|3,0,0]=4 112 B10R1.3 O=CC1=CC=C(C=C1)CF Z1255498899 [1,0,0,0,0,0|3,0,0]=4 113 B10R1.3 O=CC1=CC=C(C=C1)CO Z1255384176 [1,0,0,0,0,0|3,0,0]=4 114 B12R1.4 C#CC1=CC=C(C=C1)NC(=O)C Z1509142033 [0,1,0,0,0,0|2,0,1]=4 115 B12R1.4 CC(=O)NC1=CC=C(C=C1)C#N Z30612220 [0,1,0,0,0,0|3,0,0]=4 116 B12R1.4 CC(=O)NC1=CC=C(C=C1)C=O Z104472864 [0,1,0,0,0,0|3,0,0]=4 117 B12R1.4 CC(=O)NC1=CC=C(C=C1)CN Z235336571 [0,1,0,0,0,0|3,0,0]=4 118 B12R1.4 CC(=O)NC1=CC=C(C=C1)CO Z228585230 [0,1,0,0,0,0|3,0,0]=4 119 B12R1.4 CC(=O)OC1=CC=C(C=C1)C=O Z57887890 [0,1,0,0,0,0|3,0,0]=4 120 B12R1.4 CC(=O)OC1=CC=C(C=C1)CCl Z1255365081 [0,1,0,0,0,0|3,0,0]=4 121 B12R1.4 CC(=O)OC1=CC=C(C=C1)CN Z2216303143 [0,1,0,0,0,0|3,0,0]=4 122 B12R1.4 CCC1=CC=C(C=C1)CC(=O)O Z274782844 [0,1,0,0,0,0|2,0,1]=4 123 B12R1.4 CCC1=CC=C(C=C1)NC(=O)C Z30917832 [0,1,0,0,0,0|2,0,0]=3 124 B12R1.4 CCC1=CC=C(C=C1)NC(=S)N Z271134316 [0,1,0,0,0,0|3,0,0]=4 125 B12R1.4 CCC1=CC=C(C=C1)NC(C)C Z266668684 [0,1,0,0,0,0|2,0,1]=4 126 B12R1.4 CNC1=CC=C(C=C1)NC(=O)C Z335252368 [0,1,0,0,0,0|2,0,0]=3 127 B12R1.4 CNC1=CC=C(C=C1)OC(C)C Z1889917384 [0,1,0,0,0,0|2,0,1]=4 128 B12R1.4 COC1=CC=C(C=C1)CC(=O)N Z33546648 [0,1,0,0,0,0|1,0,1]=3 129 B12R1.4 COC1=CC=C(C=C1)CC(=O)O Z104476074 [0,1,0,0,0,0|1,0,1]=3 130 B12R1.4 COC1=CC=C(C=C1)CC(C)O Z228586162 [0,1,0,0,0,0|0,0,2]=3 131 B12R1.4 COC1=CC=C(C=C1)NC(=N)N Z118438372 [0,1,0,0,0,0|2,0,0]=3 132 B12R1.4 COC1=CC=C(C=C1)NC(=O)C Z28138902 [0,1,0,0,0,0|1,0,0]=2 133 B12R1.4 COC1=CC=C(C=C1)NC(=O)N Z56754681 [0,1,0,0,0,0|2,0,0]=3 134 B12R1.4 COC1=CC=C(C=C1)NC(=S)N Z56921428 [0,1,0,0,0,0|2,0,0]=3 135 B12R1.4 COC1=CC=C(C=C1)OC(=O)C Z30195429 [0,1,0,0,0,0|1,0,0]=2 136 B12R1.4 COC1=CN=C(C=C1)CC(=O)O Z1913661249 [0,1,0,0,0,0|2,0,1]=4 137 B12R1.4 COC1=NC=C(C=C1)CC(=O)C Z1216822629 [0,1,0,0,0,0|1,0,1]=3 138 B12R1.4 COC1=NC=C(C=C1)NC(=O)C Z26413930 [0,1,0,0,0,0|2,0,0]=3 139 B12R1.4 CSC1=CC=C(C=C1)CC(=O)O Z1212966448 [0,1,0,0,0,0|1,1,1]=4 140 B12R1.4 CSC1=CC=C(C=C1)NC(=O)C Z25066204 [0,1,0,0,0,0|1,1,0]=3 141 B12R1.5 C#CC1=CC=C(C=C1)C(=O)OC Z1198151571 [0,1,0,0,0,0|2,0,1]=4 142 B12R1.5 C=C(CO)C1=CC=C(C=C1)OC Z1896425058 [0,1,0,0,0,0|1,0,1]=3 143 B12R1.5 CCC(=O)C1=CC=C(C=C1)C#N Z1251353904 [0,1,0,0,0,0|2,0,1]=4 144 B12R1.5 CCC(=O)C1=CC=C(C=C1)CC Z285137084 [0,1,0,0,0,0|1,0,1]=3 145 B12R1.5 CCC(N)C1=CC=C(C=C1)OC Z85929849 [0,1,0,0,0,0|0,0,2]=3 146 B12R1.5 CCC(O)C1=CC=C(C=C1)OC Z228586320 [0,1,0,0,0,0|0,0,2]=3 147 B12R1.5 CCC1=CC=C(C=C1)/C(=N/O)/N Z104442610 [0,1,0,0,0,0|3,0,0]=4 148 B12R1.5 CCC1=CC=C(C=C1)C(=O)CCl Z56881220 [0,1,0,0,0,0|2,0,1]=4 149 B12R1.5 CCC1=CC=C(C=C1)C(=O)NN Z56926664 [0,1,0,0,0,0|3,0,0]=4 150 B12R1.5 CCC1=CC=C(C=C1)C(C)C=O Z1255424702 [0,1,0,0,0,0|2,0,1]=4 151 B12R1.5 CNC(=O)C1=CC=C(C=C1)C#N Z32016559 [0,1,0,0,0,0|3,0,0]=4 152 B12R1.5 CNC(=O)C1=CC=C(C=C1)C=O Z235353065 [0,1,0,0,0,0|3,0,0]=4 153 B12R1.5 CNC(=O)C1=CC=C(C=C1)CN Z234893745 [0,1,0,0,0,0|3,0,0]=4 154 B12R1.5 CNC(=O)C1=CC=C(C=C1)OC Z32016396 [0,1,0,0,0,0|1,0,0]=2 155 B12R1.5 CNC(=O)C1=CC=C(C=C1)SC Z51983114 [0,1,0,0,0,0|1,1,0]=3 156 B12R1.5 CNC(C)C1=CC=C(C=C1)OC Z239628826 [0,1,0,0,0,0|1,0,1]=3 157 B12R1.5 CNC1=CC=C(C=C1)C(=O)OC Z3014412034 [0,1,0,0,0,0|2,0,0]=3 158 B12R1.5 COC(=O)C1=CC=C(C=C1)C#N Z18372983 [0,1,0,0,0,0|3,0,0]=4 159 B12R1.5 COC(=O)C1=CC=C(C=C1)C=O Z18297598 [0,1,0,0,0,0|3,0,0]=4 160 B12R1.5 COC(=O)C1=CC=C(C=C1)CBr Z57358719 [0,1,0,0,0,0|3,0,0]=4 161 B12R1.5 COC(=O)C1=CC=C(C=C1)CN Z56839665 [0,1,0,0,0,0|3,0,0]=4 162 B12R1.5 COC(=O)C1=CC=C(C=C1)CO Z25262776 [0,1,0,0,0,0|3,0,0]=4 163 B12R1.5 COC(=O)C1=NC=C(N=C1)OC Z1255434649 [0,1,0,0,0,0|3,0,0]=4 164 B12R1.5 COC1=CC=C(C=C1)/C(=N/O)/N Z57169545 [0,1,0,0,0,0|2,0,0]=3 165 B12R1.5 COC1=CC=C(C=C1)C(=O)CCl Z56945957 [0,1,0,0,0,0|1,0,1]=3 166 B12R1.5 COC1=CC=C(C=C1)C(=O)CO Z228585822 [0,1,0,0,0,0|1,0,1]=3 167 B12R1.5 COC1=CC=C(C=C1)C(=O)NN Z57199662 [0,1,0,0,0,0|2,0,0]=3 168 B12R1.5 COC1=CC=C(C=C1)C(=O)NO Z59181957 [0,1,0,0,0,0|2,0,0]=3 169 B12R1.5 COC1=CC=C(C=C1)C(C)C=O Z1255380175 [0,1,0,0,0,0|1,0,1]=3 170 B12R1.5 COC1=CC=C(C=C1)C(N)CO Z1263714101 [0,1,0,0,0,0|1,0,2]=4 171 B12R1.5 COC1=CC=C(C=C1)[C@H](C)C=O Z1511751525 [0,1,0,0,0,0|1,0,1]=3 172 B12R1.5 CSC1=CC=C(C=C1)C(=O)C=O Z2289798581 [0,1,0,0,0,0|1,1,0]=3 173 B12R1.5 CSC1=CC=C(C=C1)C(=O)CCl Z104493412 [0,1,0,0,0,0|1,1,1]=4 174 B12R1.5 CSC1=CC=C(C=C1)C(C)C=O Z1511826610 [0,1,0,0,0,0|1,1,1]=4 175 B12R1.71 C#CCNC1=CC=C(C=C1)OC Z266490072 [0,1,0,0,0,0|0,0,3]=4 176 B12R1.71 CCC1=CC=C(C=C1)/C=C/CO Z1913661008 [0,1,0,0,0,0|1,0,0]=2 177 B12R1.71 CCC1=CC=C(C=C1)CCC=O Z993017820 [0,1,0,0,0,0|2,0,1]=4 178 B12R1.71 CCCCC1=CC=C(C=C1)NC Z1331041631 [0,1,0,0,0,0|1,0,2]=4 179 B12R1.71 CCCNC1=CC=C(C=C1)CC Z334948098 [0,1,0,0,0,0|1,0,2]=4 180 B12R1.71 CCNCC1=CC=C(C=C1)OC Z451452322 [0,1,0,0,0,0|0,0,2]=3 181 B12R1.71 CN/N=C/C1=CC=C(C=C1)C#N Z56817395 [0,1,0,0,0,0|3,0,0]=4 182 B12R1.71 CN/N=C/C1=CC=C(C=C1)SC Z56818293 [0,1,0,0,0,0|1,1,0]=3 183 B12R1.71 COC1=CC=C(C=C1)CCC=O Z1079442590 [0,1,0,0,0,0|1,0,1]=3 184 B12R1.71 COC1=CC=C(C=C1)CCCN Z291234224 [0,1,0,0,0,0|0,0,2]=3 185 B12R1.71 COC1=CC=C(C=C1)CCNN Z2327071096 [0,1,0,0,0,0|1,0,2]=4 186 B12R1.71 COC1=CC=C(C=C1)CN=C=S Z104482850 [0,1,0,0,0,0|1,0,2]=4 187 B12R1.71 COC1=CC=C(C=C1)NCC#N Z266491018 [0,1,0,0,0,0|1,0,2]=4 188 B12R1.71 COC1=CC=C(C=C1)OCC#N Z53792243 [0,1,0,0,0,0|1,0,2]=4 189 B12R1.71 COC1=CC=C(C=C1)OCCBr Z56886539 [0,1,0,0,0,0|1,0,1]=3 190 B12R1.71 COC1=CC=C(C=C1)OCCN Z54845983 [0,1,0,0,0,0|1,0,1]=3 191 B12R1.71 COC1=CC=C(C=C1)SCC=O Z854102788 [0,1,0,0,0,0|1,0,1]=3 192 B12R1.71 COC1=NC=C(C=C1)NCCO Z335249622 [0,1,0,0,0,0|2,0,1]=4 193 B12R1.71 N#CC1=CC=C(C=C1)/C=C/C=O Z2240804591 [0,1,0,0,0,0|2,0,1]=4 194 B12R1.113 C/N=C/C1=CC=C(C=C1)C(C)C Z56944543 [0,1,0,0,0,0|2,0,0]=3 195 B12R1.113 CC(C)C1=CC=C(C=C1)/C=N/O Z49568517 [0,1,0,0,0,0|3,0,0]=4 196 B12R1.113 CC(C)C1=CC=C(C=C1)CC=O Z1020792742 [0,1,0,0,0,0|2,0,1]=4 197 B12R1.113 CCCC1=CC=C(C=C1)[C@@H](C)O Z360056068 [0,1,0,0,0,0|1,0,2]=4 198 B12R1.113 CCOC1=CC=C(C=C1)C(=O)C Z53832961 [0,1,0,0,0,0|2,0,1]=4 199 B12R1.113 CCOC1=CC=C(C=C1)C(C)N Z203884180 [0,1,0,0,0,0|2,0,1]=4 200 B12R1.113 CCOC1=CC=C(C=C1)[C@@H](C)O Z360055638 [0,1,0,0,0,0|2,0,1]=4 201 B12R1.113 CCOC1=CC=C(C=C1)[C@H](C)O Z360055632 [0,1,0,0,0,0|2,0,1]=4 202 B12R1.113 CCSC1=CC=C(C=C1)C(=O)C Z332382324 [0,1,0,0,0,0|2,0,1]=4 203 B12R1.113 CCSC1=CC=C(C=C1)C(C)N Z332384546 [0,1,0,0,0,0|2,0,1]=4 204 B12R1.113 CN(C)C1=CC=C(C=C1)/C=N/O Z49568328 [0,1,0,0,0,0|3,0,0]=4 205 B12R1.113 CNCC1=CC=C(C=C1)C(C)C Z56951193 [0,1,0,0,0,0|2,0,1]=4 206 B12R1.113 CNCC1=CC=C(C=C1)N(C)C Z57327129 [0,1,0,0,0,0|2,0,1]=4 207 B12R1.113 CNCC1=CC=C(C=C1)S(=O)C Z1262607272 [0,1,0,0,0,0|1,1,1]=4 208 B12R1.113 O=[N+]([O-])C1=CC=C(C=C1)/C=C/Br Z1269168638 [0,1,0,0,0,0|3,0,0]=4 209 B12R1.114 CCOC1=C(C=C(C=C1)OC)N Z239604774 [0,1,0,0,0,0|1,0,1]=3 210 B12R1.114 COC1=CC(=C(C=C1)CC=O)C Z1198313230 [0,1,0,0,0,0|1,0,1]=3 211 B12R1.114 COC1=CC(=C(C=C1)CCN)Cl Z1198183309 [0,1,0,0,0,0|1,0,2]=4 212 B12R1.116 CCOC1=CC=C(C=C1)/C=N/O Z49568529 [0,1,0,0,0,0|2,0,0]=3 213 B12R1.116 CNCC1=CC=C(C=C1)CNC Z5600604489 [0,1,0,0,0,0|2,0,1]=4 214 B12R1.288 CCCC1=CC(=C(C=C1)OC)O Z87001810 [0,1,0,0,0,0|0,0,2]=3 215 B12R1.288 CNCC1=CC(=C(C=C1)OC)Br Z3243654223 [0,1,0,0,0,0|1,0,1]=3 216 B12R1.288 CNCC1=CC(=C(C=C1)OC)C Z1101435075 [0,1,0,0,0,0|1,0,1]=3 217 B12R1.288 CNCC1=CC(=C(C=C1)OC)Cl Z839166898 [0,1,0,0,0,0|1,0,1]=3 218 B12R1.288 CNCC1=CC(=C(C=C1)OC)F Z85956704 [0,1,0,0,0,0|1,0,1]=3 219 B12R1.288 CNCC1=CC(=C(C=C1)OC)O Z57842333 [0,1,0,0,0,0|1,0,1]=3 220 B12R1.288 COC1=C(C=C(C=C1)CC#N)F Z96091881 [0,1,0,0,0,0|1,0,2]=4 221 B12R1.288 COC1=C(C=C(C=C1)CCN)Br Z5122698103 [0,1,0,0,0,0|1,0,2]=4 222 B12R1.288 COC1=C(C=C(C=C1)CCN)Cl Z3295464152 [0,1,0,0,0,0|1,0,2]=4 223 B12R1.288 COC1=C(C=C(C=C1)CCN)F Z382820754 [0,1,0,0,0,0|1,0,2]=4 224 B12R1.288 COC1=C(C=C(C=C1)CCO)O Z1198339386 [0,1,0,0,0,0|1,0,2]=4 225 B12R1.288 COC1=C(C=C(C=C1)NC#N)Cl Z991532186 [0,1,0,0,0,0|2,0,1]=4 226 B12R2.9 CCC1=CC=C(C=C1)C2CO2 Z285186478 [0,0,0,1,0,0|2,0,1]=4 227 B12R2.9 COC1=CC=C(C=C1)C2CO2 Z278165224 [0,0,0,1,0,0|1,0,1]=3 228 B12R2.44 CCC1=CC2=C(C=C1)NC=N2 Z1474026103 [0,0,0,1,0,0|3,0,0]=4 229 B12R2.44 CCC1=CC2=C(C=C1)NCC2 Z1270207865 [0,0,0,1,0,0|2,0,1]=4 230 B12R2.44 COC1=CC2=C(C=C1)NC=C2 Z104507276 [0,0,0,1,0,0|1,0,1]=3 231 B12R2.44 COC1=CC2=C(C=C1)NCC2 Z235539064 [0,0,0,1,0,0|1,0,1]=3 232 B12R2.44 COC1=CC2=C(C=C1)OC=N2 Z1198314976 [0,0,0,1,0,0|2,0,0]=3 233 B12R2.44 COC1=CC2=C(C=C1)SC=N2 Z1198169594 [0,0,0,1,0,0|2,0,0]=3 234 B12R2.44 COC1=NC2=C(C=CN2)C=C1 Z1203732536 [0,0,0,1,0,0|2,0,0]=3 235 B12R2.44 N#CC1=CC2=C(C=CN2)C=C1 Z1201617280 [0,0,0,1,0,0|3,0,0]=4 236 B12R2.44 NCC1=CC2=C(C=CO2)C=C1 Z965074230 [0,0,0,1,0,0|3,0,0]=4 237 B12R2.44 O=CC1=CC2=C(C=CN2)C=C1 Z1203162328 [0,0,0,1,0,0|3,0,0]=4 238 B9R1.1 C=CC1=CN=C(C=C1)Cl Z4879401150 [2,0,0,0,0,0|2,0,0]=4 239 B9R1.1 C=CC1=CN=C(C=C1)F Z1255363901 [2,0,0,0,0,0|2,0,0]=4 240 B9R1.1 C=CC1=NC=C(C=C1)C Z1198181628 [2,0,0,0,0,0|1,0,0]=3 241 B9R1.1 CC1=CC=C(C=C1)C#N Z56965882 [2,0,0,0,0,0|1,0,1]=4 242 B9R1.1 CC1=CC=C(C=C1)C=O Z104477698 [2,0,0,0,0,0|1,0,0]=3 243 B9R1.1 CC1=CC=C(C=C1)NN Z56911942 [2,0,0,0,0,0|2,0,0]=4 244 B9R1.1 CC1=CN=C(C=C1)C=O Z1198172069 [2,0,0,0,0,0|2,0,0]=4 245 B9R1.1 CC1=NC=C(C=C1)C=O Z744849420 [2,0,0,0,0,0|2,0,0]=4 246 B9R1.1 CCC1=CC=C(C=C1)I Z381540768 [2,0,0,0,0,0|1,0,1]=4 247 B9R1.1 CCC1=CC=C(C=C1)N Z104477836 [2,0,0,0,0,0|1,0,1]=4 248 B9R1.1 CCC1=CC=C(C=C1)O Z104479728 [2,0,0,0,0,0|0,0,1]=3 249 B9R1.1 CNC1=CC=C(C=C1)I Z744582716 [2,0,0,0,0,0|2,0,0]=4 250 B9R1.1 CNC1=CC=C(C=C1)O Z940713298 [2,0,0,0,0,0|1,0,0]=3 251 B9R1.1 CNC1=NC=C(C=C1)C Z359297596 [2,0,0,0,0,0|2,0,0]=4 252 B9R1.1 COC1=CC=C(C=C1)C Z53834227 [2,0,0,0,0,0|0,0,0]=2 253 B9R1.1 COC1=CC=C(C=C1)F Z53834743 [2,0,0,0,0,0|1,0,0]=3 254 B9R1.1 COC1=CC=C(C=C1)N Z56938150 [2,0,0,0,0,0|1,0,0]=3 255 B9R1.1 COC1=CC=C(C=C1)O Z104474598 [2,0,0,0,0,0|1,0,0]=3 256 B9R1.1 COC1=CN=C(C=C1)C Z1198232754 [2,0,0,0,0,0|1,0,0]=3 257 B9R1.1 COC1=NC=C(C=C1)Br Z808608370 [2,0,0,0,0,0|2,0,0]=4 258 B9R1.1 COC1=NC=C(C=C1)Cl Z1094698482 [2,0,0,0,0,0|2,0,0]=4 259 B9R1.1 COC1=NC=C(C=C1)N Z56899049 [2,0,0,0,0,0|2,0,0]=4 260 B9R1.1 COC1=NC=C(C=C1)O Z1201623942 [2,0,0,0,0,0|2,0,0]=4 261 B9R1.1 CSC1=CC=C(C=C1)N Z104511114 [2,0,0,0,0,0|1,1,0]=4 262 B9R1.1 N#CC1=CC=C(C=C1)O Z104473840 [2,0,0,0,0,0|1,0,1]=4 263 B9R1.1 NCC1=CC=C(C=C1)O Z235348101 [2,0,0,0,0,0|1,0,1]=4 264 B9R1.1 O=CC1=CC=C(C=C1)Br Z57162109 [2,0,0,0,0,0|2,0,0]=4 265 B9R1.1 O=CC1=CC=C(C=C1)Cl Z57772447 [2,0,0,0,0,0|2,0,0]=4 266 B9R1.1 O=CC1=CC=C(C=C1)F Z104472914 [2,0,0,0,0,0|2,0,0]=4 267 B9R1.1 O=CC1=CC=C(C=C1)I Z57887684 [2,0,0,0,0,0|2,0,0]=4 268 B9R1.1 O=CC1=CC=C(C=C1)O Z57127520 [2,0,0,0,0,0|1,0,0]=3 269 B9R1.1 O=CC1=CC=C(C=C1)S Z1198150788 [2,0,0,0,0,0|1,1,0]=4 270 B9R1.1 O=CC1=CN=C(C=C1)O Z1741969170 [2,0,0,0,0,0|2,0,0]=4 271 B9R1.1 O=CC1=NC=C(C=C1)O Z1741979912 [2,0,0,0,0,0|2,0,0]=4 272 B9R1.8 CCCC1=CC=CC=C1 Z104479154 [2,0,0,0,0,0|0,0,2]=4 273 B9R1.8 CCNC1=CC=CC=C1 Z104472482 [2,0,0,0,0,0|1,0,1]=4 274 B9R1.8 O=CCC1=CC=CC=C1 Z104472146 [2,0,0,0,0,0|1,0,1]=4 275 B11R1.1 C=CCOC1=CC=C(C=C1)O Z381414818 [1,1,0,0,0,0|0,0,2]=4 276 B11R1.1 CC1=CC=C(C=C1)CCCN Z4639316723 [1,1,0,0,0,0|0,0,2]=4 277 B11R1.1 CC1=CC=C(C=C1)OCCBr Z56886357 [1,1,0,0,0,0|1,0,1]=4 278 B11R1.1 CC1=CC=C(C=C1)OCCN Z54747869 [1,1,0,0,0,0|1,0,1]=4 279 B11R1.1 CC1=CC=C(C=C1)SCCCl Z90122598 [1,1,0,0,0,0|1,0,1]=4 280 B11R1.1 CC1=CC=C(C=C1)SCCO Z149178580 [1,1,0,0,0,0|1,0,1]=4 281 B11R1.1 CC1=NC=C(C=C1)/C=C/C=O Z1695735078 [1,1,0,0,0,0|1,0,1]=4 282 B11R1.1 CNCCC1=CC=C(C=C1)C Z5115849578 [1,1,0,0,0,0|0,0,2]=4 283 B11R1.1 COCCC1=CC=C(C=C1)O Z104485614 [1,1,0,0,0,0|0,0,2]=4 284 B11R1.1 N#C/C=C/C1=CC=C(C=C1)Cl Z57640817 [1,1,0,0,0,0|1,0,1]=4 285 B11R1.1 NC/C=C/C1=CC=C(C=C1)Br Z2235681463 [1,1,0,0,0,0|1,0,0]=3 286 B11R1.1 NCCCC1=CC=C(C=C1)O Z1270210797 [1,1,0,0,0,0|0,0,2]=4 287 B11R1.1 NCCNC1=CC=C(C=C1)O Z3386315806 [1,1,0,0,0,0|1,0,1]=4 288 B11R1.1 O=C/C=C/C1=CC=C(C=C1)Br Z1269187977 [1,1,0,0,0,0|1,0,1]=4 289 B11R1.1 O=C/C=C/C1=CC=C(C=C1)Cl Z2242062296 [1,1,0,0,0,0|1,0,1]=4 290 B11R1.1 O=C/C=C/C1=CC=C(C=C1)F Z2768202189 [1,1,0,0,0,0|1,0,1]=4 291 B11R1.1 OC/C=C/C1=CC=C(C=C1)O Z2235811101 [1,1,0,0,0,0|0,0,0]=2 292 B11R1.1 OCCOC1=CC=C(C=C1)O Z381414946 [1,1,0,0,0,0|1,0,1]=4 293 B11R1.20 C/[N+](=C/C1=CC=C(C=C1)Br)/[O-] Z57107891 [1,1,0,0,0,0|2,0,0]=4 294 B11R1.20 C/[N+](=C/C1=CC=C(C=C1)Cl)/[O-] Z57107890 [1,1,0,0,0,0|2,0,0]=4 295 B11R1.20 CC(=O)CC1=CC=C(C=C1)F Z329711590 [1,1,0,0,0,0|1,0,1]=4 296 B11R1.20 CC(=O)NC1=CC=C(C=C1)C Z28134680 [1,1,0,0,0,0|1,0,0]=3 297 B11R1.20 CC(=O)NC1=CC=C(C=C1)Cl Z28161730 [1,1,0,0,0,0|2,0,0]=4 298 B11R1.20 CC(=O)NC1=CC=C(C=C1)F Z27805821 [1,1,0,0,0,0|2,0,0]=4 299 B11R1.20 CC(=O)NC1=CC=C(C=C1)I Z30316374 [1,1,0,0,0,0|2,0,0]=4 300 B11R1.20 CC(=O)NC1=CC=C(C=C1)N Z56926521 [1,1,0,0,0,0|2,0,0]=4 301 B11R1.20 CC(=O)NC1=CC=C(C=C1)O Z56946051 [1,1,0,0,0,0|1,0,0]=3 302 B11R1.20 CC(=O)NC1=CC=C(C=C1)S Z104484984 [1,1,0,0,0,0|1,1,0]=4 303 B11R1.20 CC(=O)OC1=CC=C(C=C1)O Z1198155166 [1,1,0,0,0,0|1,0,0]=3 304 B11R1.20 CC(=S)NC1=CC=C(C=C1)F Z56756640 [1,1,0,0,0,0|2,0,0]=4 305 B11R1.20 CC(N)CC1=CC=C(C=C1)O Z57102382 [1,1,0,0,0,0|0,0,2]=4 306 B11R1.20 CC1=CC=C(C=C1)CC(=N)N Z3244909870 [1,1,0,0,0,0|1,0,1]=4 307 B11R1.20 CC1=CC=C(C=C1)CC(=O)O Z104507548 [1,1,0,0,0,0|1,0,1]=4 308 B11R1.20 CC1=CC=C(C=C1)NC(=O)N Z56754677 [1,1,0,0,0,0|2,0,0]=4 309 B11R1.20 CC1=CC=C(C=C1)NC(=S)N Z57965505 [1,1,0,0,0,0|2,0,0]=4 310 B11R1.20 CC1=CC=C(C=C1)NC(C)C Z992717194 [1,1,0,0,0,0|1,0,1]=4 311 B11R1.20 CC1=CC=C(C=C1)OC(C)C Z53834229 [1,1,0,0,0,0|1,0,1]=4 312 B11R1.22 C=C(CO)C1=CC=C(C=C1)C Z1896562587 [1,1,0,0,0,0|1,0,1]=4 313 B11R1.22 C=CC(=O)C1=CC=C(C=C1)O Z1416178613 [1,1,0,0,0,0|0,0,1]=3 314 B11R1.22 CC1=CC=C(C=C1)/C(=N/O)/N Z57626985 [1,1,0,0,0,0|2,0,0]=4 315 B11R1.22 CC1=CC=C(C=C1)C(=O)CBr Z104481640 [1,1,0,0,0,0|1,0,1]=4 316 B11R1.22 CC1=CC=C(C=C1)C(=O)CCl Z56886309 [1,1,0,0,0,0|1,0,1]=4 317 B11R1.22 CC1=CC=C(C=C1)C(=O)CN Z275368898 [1,1,0,0,0,0|1,0,1]=4 318 B11R1.22 CC1=CC=C(C=C1)C(=O)CO Z228585628 [1,1,0,0,0,0|1,0,1]=4 319 B11R1.22 CC1=CC=C(C=C1)C(=O)NO Z59182007 [1,1,0,0,0,0|2,0,0]=4 320 B11R1.22 CC1=CC=C(C=C1)C(C)C=O Z1198150045 [1,1,0,0,0,0|1,0,1]=4 321 B11R1.22 CCC(=O)C1=CC=C(C=C1)Br Z104485724 [1,1,0,0,0,0|1,0,1]=4 322 B11R1.22 CCC(=O)C1=CC=C(C=C1)Cl Z104477486 [1,1,0,0,0,0|1,0,1]=4 323 B11R1.22 CCC(=O)C1=CC=C(C=C1)F Z104477898 [1,1,0,0,0,0|1,0,1]=4 324 B11R1.22 CCC(=O)C1=CC=C(C=C1)I Z285137052 [1,1,0,0,0,0|1,0,1]=4 325 B11R1.22 CCC(=O)C1=CC=C(C=C1)N Z1203578051 [1,1,0,0,0,0|1,0,1]=4 326 B11R1.22 CCC(=O)C1=CC=C(C=C1)O Z104499156 [1,1,0,0,0,0|0,0,1]=3 327 B11R1.22 CCC(C)C1=CC=C(C=C1)O Z104484172 [1,1,0,0,0,0|0,0,2]=4 328 B11R1.22 CCC(N)C1=CC=C(C=C1)C Z90662186 [1,1,0,0,0,0|0,0,2]=4 329 B11R1.22 CCC(O)C1=CC=C(C=C1)C Z228586316 [1,1,0,0,0,0|0,0,2]=4 330 B11R1.22 CCC(O)C1=CC=C(C=C1)O Z228586170 [1,1,0,0,0,0|0,0,2]=4 331 B11R1.22 CNC(=O)C1=CC=C(C=C1)Br Z30272262 [1,1,0,0,0,0|2,0,0]=4 332 B11R1.22 CNC(=O)C1=CC=C(C=C1)C Z32016517 [1,1,0,0,0,0|1,0,0]=3 333 B11R1.22 CNC(=O)C1=CC=C(C=C1)Cl Z32016366 [1,1,0,0,0,0|2,0,0]=4 334 B11R1.22 CNC(=O)C1=CC=C(C=C1)I Z30272273 [1,1,0,0,0,0|2,0,0]=4 335 B11R1.22 CNC(=O)C1=CC=C(C=C1)N Z56985799 [1,1,0,0,0,0|2,0,0]=4 336 B11R1.22 CNC(=O)C1=CC=C(C=C1)O Z183855140 [1,1,0,0,0,0|1,0,0]=3 337 B11R1.22 CNC(C)C1=CC=C(C=C1)C Z239628686 [1,1,0,0,0,0|1,0,1]=4 338 B11R1.22 CNC(C)C1=CC=C(C=C1)O Z316170374 [1,1,0,0,0,0|1,0,1]=4 339 B11R1.22 COC(=O)C1=CC=C(C=C1)Br Z19682625 [1,1,0,0,0,0|2,0,0]=4 340 B11R1.22 COC(=O)C1=CC=C(C=C1)I Z19776689 [1,1,0,0,0,0|2,0,0]=4 341 B11R1.22 COC(=O)C1=CC=C(C=C1)N Z54178705 [1,1,0,0,0,0|2,0,0]=4 342 B11R1.22 COC(=O)C1=CC=C(C=C1)O Z19674820 [1,1,0,0,0,0|1,0,0]=3 343 B11R1.22 COC(=O)C1=CN=C(C=C1)C Z237546062 [1,1,0,0,0,0|2,0,0]=4 344 B11R1.22 N/C(=N\O)/C1=CC=C(C=C1)O Z156964722 [1,1,0,0,0,0|2,0,0]=4 345 B11R1.22 NCC(=O)C1=CC=C(C=C1)O Z1198177329 [1,1,0,0,0,0|1,0,1]=4 346 B11R1.22 NNC(=O)C1=CC=C(C=C1)O Z57036327 [1,1,0,0,0,0|2,0,0]=4 347 B11R1.22 O=C(CCl)C1=CC=C(C=C1)O Z104378296 [1,1,0,0,0,0|1,0,1]=4 348 B11R1.22 O=CC(=O)C1=CC=C(C=C1)Br Z1269163105 [1,1,0,0,0,0|2,0,0]=4 349 B11R1.81 CC1=CC(=C(C=C1)CC=O)C Z1020787114 [1,1,0,0,0,0|1,0,1]=4 350 B11R1.81 CCNC1=C(C=C(C=C1)C)C Z744754524 [1,1,0,0,0,0|1,0,1]=4 351 B11R1.81 CCNC1=C(C=C(C=C1)C)N Z394649004 [1,1,0,0,0,0|1,0,1]=4 352 B11R1.81 CNCC1=C(C=C(C=C1)C)Br Z5345778789 [1,1,0,0,0,0|1,0,1]=4 353 B11R1.81 CNCC1=C(C=C(C=C1)C)C Z89283370 [1,1,0,0,0,0|1,0,1]=4 354 B11R1.81 CNCC1=C(C=C(C=C1)C)Cl Z5465034350 [1,1,0,0,0,0|1,0,1]=4 355 B11R1.81 COCC1=C(C=C(C=C1)O)F Z1551937213 [1,1,0,0,0,0|1,0,1]=4 356 B11R1.192 CC1=C(C=C(C=C1)CC=O)C Z993017804 [1,1,0,0,0,0|1,0,1]=4 357 B11R1.192 CCNC1=CC(=C(C=C1)C)C Z5214919889 [1,1,0,0,0,0|1,0,1]=4 358 B11R1.192 CCNC1=CC(=C(C=C1)C)F Z2306658828 [1,1,0,0,0,0|1,0,1]=4 359 B11R1.192 CNCC1=CC(=C(C=C1)C)C Z2238897979 [1,1,0,0,0,0|1,0,1]=4 360 B11R1.192 CNCC1=CC(=C(C=C1)C)Cl Z5390415454 [1,1,0,0,0,0|1,0,1]=4 361 B11R1.192 CNCC1=CC(=C(C=C1)C)F Z385447006 [1,1,0,0,0,0|1,0,1]=4 362 B11R1.3 C=CC1=CC=C(C=C1)B(O)O Z1255403096 [1,1,0,0,0,0|2,0,0]=4 363 B11R1.3 C=CC1=CC=C(C=C1)C(=O)N Z1203578780 [1,1,0,0,0,0|2,0,0]=4 364 B11R1.3 CC(=O)C1=CC=C(C=C1)C#N Z56820417 [1,1,0,0,0,0|2,0,0]=4 365 B11R1.3 CC(=O)C1=CC=C(C=C1)CN Z3018118044 [1,1,0,0,0,0|2,0,0]=4 366 B11R1.3 CC(C)C1=CC=C(C=C1)C=O Z104476006 [1,1,0,0,0,0|2,0,0]=4 367 B11R1.3 CCC1=CC=C(C=C1)C(=N)N Z1268152427 [1,1,0,0,0,0|2,0,0]=4 368 B11R1.3 CCC1=CC=C(C=C1)C(=O)O Z104478474 [1,1,0,0,0,0|2,0,0]=4 369 B11R1.3 CCC1=CC=C(C=C1)C(=S)N Z57989304 [1,1,0,0,0,0|2,0,0]=4 370 B11R1.3 CCC1=CC=C(C=C1)C(C)N Z56347251 [1,1,0,0,0,0|1,0,1]=4 371 B11R1.3 CCC1=CC=C(C=C1)[C@H](C)N Z1536943321 [1,1,0,0,0,0|1,0,1]=4 372 B11R1.3 CN(C)C1=CC=C(C=C1)C=O Z57127528 [1,1,0,0,0,0|2,0,0]=4 373 B11R1.3 CNC1=CC=C(C=C1)C(=N)N Z1815149179 [1,1,0,0,0,0|2,0,0]=4 374 B11R1.3 CNC1=CC=C(C=C1)C(=O)C Z1082871512 [1,1,0,0,0,0|1,0,0]=3 375 B11R1.3 CNC1=CC=C(C=C1)C(=O)N Z744754554 [1,1,0,0,0,0|2,0,0]=4 376 B11R1.3 CNC1=CC=C(C=C1)C(=O)O Z727574068 [1,1,0,0,0,0|2,0,0]=4 377 B11R1.3 CNC1=CC=C(C=C1)C(C)C Z1431904364 [1,1,0,0,0,0|1,0,1]=4 378 B11R1.3 COC1=CC=C(C=C1)B(O)O Z336079536 [1,1,0,0,0,0|2,0,0]=4 379 B11R1.3 COC1=CC=C(C=C1)C(=N)N Z228583094 [1,1,0,0,0,0|1,0,0]=3 380 B11R1.3 COC1=CC=C(C=C1)C(=O)C Z53832960 [1,1,0,0,0,0|0,0,0]=2 381 B11R1.3 COC1=CC=C(C=C1)C(=O)N Z33546492 [1,1,0,0,0,0|1,0,0]=3 382 B11R1.3 COC1=CC=C(C=C1)C(=O)O Z56931884 [1,1,0,0,0,0|1,0,0]=3 383 B11R1.3 COC1=CC=C(C=C1)C(=S)N Z56964598 [1,1,0,0,0,0|1,0,0]=3 384 B11R1.3 COC1=CC=C(C=C1)C(C)O Z335245134 [1,1,0,0,0,0|0,0,1]=3 385 B11R1.3 COC1=CC=C(C=C1)N(C)C Z57243982 [1,1,0,0,0,0|1,0,0]=3 386 B11R1.3 COC1=CC=C(C=C1)[C@@H](C)O Z360055358 [1,1,0,0,0,0|0,0,1]=3 387 B11R1.3 COC1=CC=C(C=C1)[C@H](C)O Z360055354 [1,1,0,0,0,0|0,0,1]=3 388 B11R1.3 COC1=CC=C(C=C1)[N+](=O)[O-] Z31131411 [1,1,0,0,0,0|2,0,0]=4 389 B11R1.3 COC1=CN=C(C=C1)C(=N)N Z1255420591 [1,1,0,0,0,0|2,0,0]=4 390 B11R1.3 COC1=NC=C(C=C1)C(=N)N Z594272030 [1,1,0,0,0,0|2,0,0]=4 391 B11R1.3 COC1=NC=C(C=C1)C(=O)O Z135188086 [1,1,0,0,0,0|2,0,0]=4 392 B11R1.3 COC1=NC=C(C=C1)C(C)N Z3083124760 [1,1,0,0,0,0|1,0,1]=4 393 B11R1.3 CS(=O)C1=CC=C(C=C1)C=O Z1184878668 [1,1,0,0,0,0|1,1,0]=4 394 B11R1.3 CSC1=CC=C(C=C1)C(=N)N Z1267881768 [1,1,0,0,0,0|1,1,0]=4 395 B11R1.3 CSC1=CC=C(C=C1)C(=O)C Z57036277 [1,1,0,0,0,0|0,1,0]=3 396 B11R1.3 CSC1=CC=C(C=C1)C(=O)O Z57989066 [1,1,0,0,0,0|1,1,0]=4 397 B11R1.3 CSC1=CC=C(C=C1)C(C)N Z425449608 [1,1,0,0,0,0|0,1,1]=4 398 B11R1.279 C#CC1=C(C=C(C=C1)OC)Cl Z1862017872 [1,1,0,0,0,0|0,0,2]=4 399 B11R1.279 C#CC1=CC(=C(C=C1)OC)Br Z1269196997 [1,1,0,0,0,0|0,0,2]=4 400 B11R1.279 C#CC1=CC(=C(C=C1)OC)Cl Z1649746536 [1,1,0,0,0,0|0,0,2]=4 401 B11R1.279 C#CC1=CC(=C(C=C1)OC)F Z1080385564 [1,1,0,0,0,0|0,0,2]=4 402 B11R1.279 C=CC1=CC(=C(C=C1)OC)O Z1513804703 [1,1,0,0,0,0|0,0,0]=2 403 B11R1.279 CCC1=C(C=C(C=C1)C=O)F Z2472525344 [1,1,0,0,0,0|2,0,0]=4 404 B11R1.279 CCC1=CC(=C(C=C1)C=O)C Z1511897707 [1,1,0,0,0,0|2,0,0]=4 405 B11R1.279 CCC1=CC(=C(C=C1)C=O)F Z3244744229 [1,1,0,0,0,0|2,0,0]=4 406 B11R1.279 CCC1=CC(=C(C=C1)CC)Br Z1203016482 [1,1,0,0,0,0|1,0,1]=4 407 B11R1.279 CCC1=CC(=C(C=C1)CC)N Z1276502928 [1,1,0,0,0,0|1,0,1]=4 408 B11R1.279 CCC1=CC(=C(C=C1)OC)N Z1209420082 [1,1,0,0,0,0|0,0,1]=3 409 B11R1.279 CNC1=C(C=C(C=C1)OC)I Z1878448486 [1,1,0,0,0,0|1,0,0]=3 410 B11R1.279 CNC1=CC(=C(C=C1)C=O)O Z1255444978 [1,1,0,0,0,0|2,0,0]=4 411 B11R1.279 CNC1=CC(=C(C=C1)OC)Br Z5133569872 [1,1,0,0,0,0|1,0,0]=3 412 B11R1.279 COC1=C(C=C(C=C1)C#N)C Z57900343 [1,1,0,0,0,0|1,0,1]=4 413 B11R1.279 COC1=C(C=C(C=C1)C#N)N Z425853642 [1,1,0,0,0,0|1,0,1]=4 414 B11R1.279 COC1=C(C=C(C=C1)C=O)Br Z54603118 [1,1,0,0,0,0|1,0,0]=3 415 B11R1.279 COC1=C(C=C(C=C1)C=O)C Z199532230 [1,1,0,0,0,0|1,0,0]=3 416 B11R1.279 COC1=C(C=C(C=C1)C=O)Cl Z57313891 [1,1,0,0,0,0|1,0,0]=3 417 B11R1.279 COC1=C(C=C(C=C1)C=O)F Z94599216 [1,1,0,0,0,0|1,0,0]=3 418 B11R1.279 COC1=C(C=C(C=C1)C=O)O Z104478184 [1,1,0,0,0,0|1,0,0]=3 419 B11R1.279 COC1=C(C=C(C=C1)CCl)Br Z104341250 [1,1,0,0,0,0|1,0,1]=4 420 B11R1.279 COC1=C(C=C(C=C1)CCl)F Z57980555 [1,1,0,0,0,0|1,0,1]=4 421 B11R1.279 COC1=C(C=C(C=C1)CN)C Z446021090 [1,1,0,0,0,0|1,0,1]=4 422 B11R1.279 COC1=C(C=C(C=C1)CN)Cl Z815287230 [1,1,0,0,0,0|1,0,1]=4 423 B11R1.279 COC1=C(C=C(C=C1)CN)F Z355423270 [1,1,0,0,0,0|1,0,1]=4 424 B11R1.279 COC1=C(C=C(C=C1)CN)O Z415728036 [1,1,0,0,0,0|1,0,1]=4 425 B11R1.279 COC1=C(C=C(C=C1)CO)Cl Z385370262 [1,1,0,0,0,0|1,0,1]=4 426 B11R1.279 COC1=C(C=C(C=N1)C=O)Br Z1269227157 [1,1,0,0,0,0|2,0,0]=4 427 B11R1.279 COC1=C(C=C(C=N1)C=O)C Z1255428321 [1,1,0,0,0,0|2,0,0]=4 428 B11R1.279 COC1=C(C=C(C=N1)C=O)Cl Z1198165226 [1,1,0,0,0,0|2,0,0]=4 429 B11R1.279 COC1=C(C=C(C=N1)C=O)F Z1198164109 [1,1,0,0,0,0|2,0,0]=4 430 B11R1.279 COC1=C(C=C(N=C1)C=O)Cl Z1255459195 [1,1,0,0,0,0|2,0,0]=4 431 B11R1.279 COC1=C(C=C(N=C1)C=O)O Z1201626854 [1,1,0,0,0,0|2,0,0]=4 432 B11R1.279 COC1=C(N=C(C=C1)C=O)C Z1255392726 [1,1,0,0,0,0|2,0,0]=4 433 B11R1.279 COC1=CC(=C(C=C1)C#N)F Z1160930711 [1,1,0,0,0,0|1,0,1]=4 434 B11R1.279 COC1=CC(=C(C=C1)C#N)N Z1198165398 [1,1,0,0,0,0|1,0,1]=4 435 B11R1.279 COC1=CC(=C(C=C1)C=O)Br Z1190318854 [1,1,0,0,0,0|1,0,0]=3 436 B11R1.279 COC1=CC(=C(C=C1)C=O)C Z385370020 [1,1,0,0,0,0|1,0,0]=3 437 B11R1.279 COC1=CC(=C(C=C1)C=O)Cl Z178955320 [1,1,0,0,0,0|1,0,0]=3 438 B11R1.279 COC1=CC(=C(C=C1)C=O)F Z1190318848 [1,1,0,0,0,0|1,0,0]=3 439 B11R1.279 COC1=CC(=C(C=C1)C=O)O Z188964138 [1,1,0,0,0,0|1,0,0]=3 440 B11R1.279 COC1=CC(=C(C=C1)CN)C Z1190318959 [1,1,0,0,0,0|1,0,1]=4 441 B11R1.279 COC1=CC(=C(C=C1)CN)Cl Z5510271229 [1,1,0,0,0,0|1,0,1]=4 442 B11R1.279 COC1=CC(=C(C=C1)CN)F Z1416282396 [1,1,0,0,0,0|1,0,1]=4 443 B11R1.279 COC1=CC(=C(C=C1)CN)O Z2472857389 [1,1,0,0,0,0|1,0,1]=4 444 B11R1.279 COC1=CC(=C(C=C1)OC)Br Z299596102 [1,1,0,0,0,0|1,0,0]=3 445 B11R1.279 COC1=CC(=C(C=C1)OC)N Z56973491 [1,1,0,0,0,0|1,0,0]=3 446 B11R1.279 COC1=CC(=C(N=C1)C=O)C Z1255504594 [1,1,0,0,0,0|2,0,0]=4 447 B11R1.279 COC1=CC(=C(N=C1)C=O)Cl Z1255463662 [1,1,0,0,0,0|2,0,0]=4 448 B11R1.279 COC1=NC(=C(C=C1)C=O)C Z1198307211 [1,1,0,0,0,0|2,0,0]=4 449 B11R1.279 COC1=NC(=C(C=C1)C=O)F Z1255500299 [1,1,0,0,0,0|2,0,0]=4 450 B11R1.279 COC1=NC=C(C(=C1)Br)C=O Z1269207586 [1,1,0,0,0,0|2,0,0]=4 451 B11R1.279 COC1=NC=C(C(=C1)C)C=O Z1198172235 [1,1,0,0,0,0|2,0,0]=4 452 B11R1.279 CSC1=C(C=C(C=C1)C=O)Cl Z1436297421 [1,1,0,0,0,0|1,1,0]=4 453 B11R1.279 CSC1=CC(=C(C=C1)C=O)Br Z1948219399 [1,1,0,0,0,0|1,1,0]=4 454 B11R1.279 CSC1=CC(=C(C=C1)C=O)F Z1686577681 [1,1,0,0,0,0|1,1,0]=4 455 B13R1.4 COC1=CC=C(C=C1)CC(C)(C)N Z1117893987 [0,2,0,0,0,0|0,0,2]=4 456 B13R1.5 C=CC(=O)NC1=CC=C(C=C1)OC Z440633656 [0,2,0,0,0,0|0,0,1]=3 457 B13R1.5 C=CC(=O)NC1=CN=C(C=C1)OC Z440633620 [0,2,0,0,0,0|1,0,1]=4 458 B13R1.5 CCC(=O)NC1=CC=C(C=C1)CC Z30917878 [0,2,0,0,0,0|1,0,1]=4 459 B13R1.5 CCC(=O)NC1=CC=C(C=C1)SC Z110120998 [0,2,0,0,0,0|0,1,1]=4 460 B13R1.5 CCC(=O)NC1=CN=C(C=C1)OC Z26413976 [0,2,0,0,0,0|1,0,1]=4 461 B13R1.5 CCC1=CC=C(C=C1)NC(=O)CCl Z56886400 [0,2,0,0,0,0|2,0,0]=4 462 B13R1.5 CNC(=O)NC1=CC=C(C=C1)OC Z104757974 [0,2,0,0,0,0|1,0,0]=3 463 B13R1.5 COC1=CC=C(C=C1)/C=C(\C)/C=O Z2417557210 [0,2,0,0,0,0|0,0,0]=2 464 B13R1.5 COC1=CC=C(C=C1)C/C(=N/O)/N Z285225846 [0,2,0,0,0,0|1,0,1]=4 465 B13R1.5 COC1=CC=C(C=C1)CC(=O)NN Z56347401 [0,2,0,0,0,0|1,0,1]=4 466 B13R1.5 COC1=CC=C(C=C1)CC(=O)NO Z59182049 [0,2,0,0,0,0|1,0,1]=4 467 B13R1.5 COC1=CC=C(C=C1)CC(C)CN Z992310982 [0,2,0,0,0,0|0,0,2]=4 468 B13R1.5 COC1=CC=C(C=C1)NC(=O)CCl Z56862381 [0,2,0,0,0,0|1,0,0]=3 469 B13R1.5 COC1=CC=C(C=C1)NC(=O)CN Z46280202 [0,2,0,0,0,0|1,0,0]=3 470 B13R1.5 COC1=CC=C(C=C1)NC(=S)NN Z56827765 [0,2,0,0,0,0|2,0,0]=4 471 B13R1.5 COC1=CC=C(C=C1)NC(=S)SC Z56757835 [0,2,0,0,0,0|1,0,0]=3 472 B13R1.5 COC1=CC=C(C=C1)OC(C)CN Z844632002 [0,2,0,0,0,0|1,0,1]=4 473 B13R1.5 COC1=NC=C(C=C1)NC(=O)CCl Z57043501 [0,2,0,0,0,0|2,0,0]=4 474 B13R1.5 CSC1=CC=C(C=C1)NC(=O)CCl Z199423718 [0,2,0,0,0,0|1,1,0]=4 475 B13R1.35 COC1=C(C=C(C=C1)CC(=N)N)F Z1263602367 [0,2,0,0,0,0|1,0,1]=4 476 B13R1.35 COC1=C(C=C(C=C1)CC(=O)O)Cl Z1205414415 [0,2,0,0,0,0|1,0,1]=4 477 B13R1.35 COC1=C(C=C(C=C1)CC(=O)O)F Z94598730 [0,2,0,0,0,0|1,0,1]=4 478 B13R1.35 COC1=C(C=C(C=C1)CC(=O)O)O Z1065613560 [0,2,0,0,0,0|1,0,1]=4 479 B13R1.35 COC1=C(C=C(C=C1)CC(C)N)O Z4574899614 [0,2,0,0,0,0|0,0,2]=4 480 B13R1.35 COC1=C(C=C(C=C1)NC(=S)N)Cl Z291279070 [0,2,0,0,0,0|2,0,0]=4 481 B13R1.35 COC1=C(C=C(C=C1)NC(C)C)F Z1262254324 [0,2,0,0,0,0|1,0,1]=4 482 B13R1.35 CSC1=C(C=C(C=C1)NC(=O)C)Cl Z1324842283 [0,2,0,0,0,0|1,1,0]=4 483 B13R1.36 CCC1=CC=C(C=C1)C(=O)C(C)C Z385417736 [0,2,0,0,0,0|1,0,1]=4 484 B13R1.36 CCC1=CC=C(C=C1)C(=O)C(C)Cl Z56921769 [0,2,0,0,0,0|1,0,1]=4 485 B13R1.36 CCC1=CC=C(C=C1)C(=O)N(C)C Z32014673 [0,2,0,0,0,0|2,0,0]=4 486 B13R1.36 COC1=CC=C(C=C1)C(=O)C(C)Br Z325370254 [0,2,0,0,0,0|0,0,1]=3 487 B13R1.36 COC1=CC=C(C=C1)C(=O)C(C)C Z385418276 [0,2,0,0,0,0|0,0,1]=3 488 B13R1.36 COC1=CC=C(C=C1)C(=O)C(C)Cl Z56968902 [0,2,0,0,0,0|0,0,1]=3 489 B13R1.36 COC1=CC=C(C=C1)C(C)C(=O)C Z1276728136 [0,2,0,0,0,0|0,0,1]=3 490 B13R1.36 COC1=CC=C(C=C1)C(C)C(=O)O Z792377298 [0,2,0,0,0,0|1,0,1]=4 491 B13R1.36 COC1=CC=C(C=C1)C(N)C(=O)O Z56755722 [0,2,0,0,0,0|1,0,1]=4 492 B13R1.36 COC1=CC=C(C=C1)C(N)C(C)C Z99599002 [0,2,0,0,0,0|0,0,2]=4 493 B13R1.36 COC1=CC=C(C=C1)C(N)C(C)O Z3037763603 [0,2,0,0,0,0|0,0,2]=4 494 B13R1.36 COC1=CC=C(C=C1)C(O)C(C)N Z1526453885 [0,2,0,0,0,0|0,0,2]=4 495 B13R1.36 COC1=CC=C(C=C1)N(C)C(=O)N Z905094782 [0,2,0,0,0,0|2,0,0]=4 496 B13R1.36 COC1=NC=C(C=C1)C(=O)N(C)C Z184827862 [0,2,0,0,0,0|2,0,0]=4 497 B13R1.36 CSC1=CC=C(C=C1)C(=O)N(C)C Z52080914 [0,2,0,0,0,0|1,1,0]=4 498 B13R1.142 CC(=O)NC1=CC=C(C=C1)CCN Z285143822 [0,2,0,0,0,0|2,0,0]=4 499 B13R1.142 CC(=O)NC1=CC=C(C=C1)CCO Z785801482 [0,2,0,0,0,0|2,0,0]=4 500 B13R1.142 CCOC1=CC=C(C=C1)CC(=O)O Z56877838 [0,2,0,0,0,0|1,0,1]=4 501 B13R1.142 CCOC1=CC=C(C=C1)NC(=O)C Z27807932 [0,2,0,0,0,0|1,0,0]=3 502 B13R1.142 CCOC1=CC=C(C=C1)NC(=O)N Z56754688 [0,2,0,0,0,0|2,0,0]=4 503 B13R1.142 CNCC1=CC=C(C=C1)NC(=O)C Z2452335463 [0,2,0,0,0,0|2,0,0]=4 504 B13R1.142 CNCC1=CC=C(C=C1)OC(F)F Z56950494 [0,2,0,0,0,0|1,0,1]=4 505 B13R1.142 O/N=C/C1=CC=C(C=C1)OC(F)F Z49568476 [0,2,0,0,0,0|2,0,0]=4 506 B13R1.142 O=CCC1=CC=C(C=C1)OC(F)F Z1250885383 [0,2,0,0,0,0|1,0,1]=4 507 B13R1.585 CC(=O)NC1=CC=C(C=C1)C(=O)C Z27699519 [0,2,0,0,0,0|2,0,0]=4 508 B13R1.585 CC(=O)OC1=CC=C(C=C1)C(=O)C Z28188387 [0,2,0,0,0,0|2,0,0]=4 509 B13R1.653 COC1=CC(=C(C=C1)CC(=O)O)C Z1198160688 [0,2,0,0,0,0|1,0,1]=4 510 B13R1.653 COC1=CC(=C(C=C1)CC(=O)O)Cl Z1269126399 [0,2,0,0,0,0|1,0,1]=4 511 B13R1.653 COC1=CC(=C(C=C1)CC(=O)O)F Z1201623880 [0,2,0,0,0,0|1,0,1]=4 512 B13R1.653 COC1=CC(=C(C=C1)NC(=O)C)C Z56871751 [0,2,0,0,0,0|1,0,0]=3 513 B13R1.653 COC1=CC(=C(C=C1)NC(=O)C)N Z239120272 [0,2,0,0,0,0|1,0,0]=3 514 B13R1.653 COC1=CC(=C(C=C1)NC(=O)N)I Z1875070570 [0,2,0,0,0,0|2,0,0]=4 515 B13R1.653 COC1=CC(=C(C=C1)OC(C)C)N Z239604782 [0,2,0,0,0,0|1,0,1]=4 516 B13R1.39 CCC(C=O)C1=CC=C(C=C1)OC Z1255400148 [0,2,0,0,0,0|0,0,2]=4 517 B13R1.39 CNC(CO)C1=CC=C(C=C1)OC Z734147394 [0,2,0,0,0,0|1,0,1]=4 518 B13R1.39 COC1=CC=C(C=C1)C(CN)OC Z4261448724 [0,2,0,0,0,0|1,0,1]=4 519 B13R1.95 CNC(=O)C1=C(C=C(C=C1)OC)F Z135505270 [0,2,0,0,0,0|1,0,0]=3 520 B13R1.95 COC(=O)C1=C(C=C(C=C1)OC)F Z88016191 [0,2,0,0,0,0|1,0,0]=3 521 B13R1.95 COC(=O)C1=C(C=C(C=C1)OC)N Z847464376 [0,2,0,0,0,0|1,0,0]=3 522 B13R1.95 COC(=O)C1=C(C=C(C=C1)OC)O Z24769843 [0,2,0,0,0,0|1,0,0]=3 523 B13R1.139 CCOC1=CC=C(C=C1)C(=O)CBr Z56968562 [0,2,0,0,0,0|1,0,1]=4 524 B13R1.139 CCOC1=CC=C(C=C1)C(=O)CCl Z90661771 [0,2,0,0,0,0|1,0,1]=4 525 B13R1.139 CCOC1=CC=C(C=C1)C(=O)NN Z56862721 [0,2,0,0,0,0|2,0,0]=4 526 B13R1.139 CCOC1=CC=C(C=C1)C(C)C=O Z1255425331 [0,2,0,0,0,0|1,0,1]=4 527 B13R1.139 CNC(=O)C1=CC=C(C=C1)CCN Z2786070966 [0,2,0,0,0,0|2,0,0]=4 528 B13R1.139 CNC(=O)C1=CC=C(C=C1)CSC Z32015680 [0,2,0,0,0,0|1,1,0]=4 529 B13R1.139 CNCC1=CC=C(C=C1)C(=O)NC Z104378218 [0,2,0,0,0,0|2,0,0]=4 530 B13R1.139 CNCC1=CC=C(C=C1)C(=O)OC Z1245537813 [0,2,0,0,0,0|1,0,1]=4 531 B13R1.139 COC(=O)C1=CC=C(C=C1)/C=N/O Z49568623 [0,2,0,0,0,0|2,0,0]=4 532 B13R1.139 COC(=O)C1=CC=C(C=C1)CCN Z367678640 [0,2,0,0,0,0|2,0,0]=4 533 B13R1.139 COCC1=CC=C(C=C1)C(=O)OC Z51567779 [0,2,0,0,0,0|1,0,0]=3 534 B13R1.187 CNS(=O)(=O)C1=CC=C(C=C1)OC Z45527657 [0,2,0,0,0,0|2,0,0]=4 535 B13R1.452 CCC1=CC=C(C=C1)C(=O)/C=C/[O-] Z1097067713 [0,2,0,0,0,0|1,0,1]=4 536 B13R1.452 CCCC(=O)C1=CC=C(C=C1)OC Z385418282 [0,2,0,0,0,0|0,0,1]=3 537 B13R1.452 CCCC(N)C1=CC=C(C=C1)OC Z1509094932 [0,2,0,0,0,0|0,0,2]=4 538 B13R1.452 CCNC(=O)C1=CC=C(C=C1)OC Z32024428 [0,2,0,0,0,0|0,0,1]=3 539 B13R1.452 CCOC(=O)C1=CC=C(C=C1)SC Z292454850 [0,2,0,0,0,0|0,1,1]=4 540 B13R1.452 COC1=CC=C(C=C1)/C(=C/C#N)/Cl Z56969677 [0,2,0,0,0,0|0,0,1]=3 541 B13R1.452 COC1=CC=C(C=C1)/C(=N/C#N)/N Z56759641 [0,2,0,0,0,0|1,0,1]=4 542 B13R1.452 COC1=CC=C(C=C1)C(=O)/C=C/[O-] Z2259173493 [0,2,0,0,0,0|0,0,1]=3 543 B13R1.452 COC1=CC=C(C=C1)C(=O)CC#N Z55928932 [0,2,0,0,0,0|0,0,2]=4 544 B13R1.452 COC1=CC=C(C=C1)C(C)CCN Z851015012 [0,2,0,0,0,0|0,0,2]=4 545 B13R1.452 CONC(=O)C1=CC=C(C=C1)OC Z240605130 [0,2,0,0,0,0|1,0,0]=3 546 B13R1.537 CCC(=O)C1=CC=C(C=C1)N(C)C Z1255458026 [0,2,0,0,0,0|1,0,1]=4 547 B13R1.537 CNC(=O)C1=CC=C(C=C1)N(C)C Z32016576 [0,2,0,0,0,0|2,0,0]=4 548 B13R1.537 COC(=O)C1=CC=C(C=C1)C(=O)C Z419615084 [0,2,0,0,0,0|2,0,0]=4 549 B13R1.537 COC(=O)C1=CC=C(C=C1)C(C)O Z816113634 [0,2,0,0,0,0|2,0,0]=4 550 B13R1.3088 CCC(=O)C1=CC(=C(C=C1)OC)Cl Z362839112 [0,2,0,0,0,0|0,0,1]=3 551 B13R1.3088 CNC(=O)C1=CC(=C(C=C1)OC)Cl Z2212094371 [0,2,0,0,0,0|1,0,0]=3 552 B13R1.3088 CNC(=O)C1=CC(=C(C=C1)OC)F Z87539849 [0,2,0,0,0,0|1,0,0]=3 553 B13R1.3088 CNC(=O)C1=CC(=C(C=C1)OC)N Z239124744 [0,2,0,0,0,0|1,0,0]=3 554 B13R1.3088 CNC1=C(C=C(C=C1)C(=O)OC)N Z802832548 [0,2,0,0,0,0|2,0,0]=4 555 B13R1.3088 COC(=O)C1=CC(=C(C=C1)OC)Br Z57204686 [0,2,0,0,0,0|1,0,0]=3 556 B13R1.3088 COC(=O)C1=CC(=C(C=C1)OC)Cl Z335793416 [0,2,0,0,0,0|1,0,0]=3 557 B13R1.3088 COC(=O)C1=CC(=C(N=C1)OC)N Z1262634957 [0,2,0,0,0,0|2,0,0]=4 558 B13R1.3088 COC(=O)C1=NC(=C(C=C1)OC)C Z1255462452 [0,2,0,0,0,0|2,0,0]=4 559 B13R1.3088 COC1=C(C=C(C=C1)C(=O)CCl)Br Z57040445 [0,2,0,0,0,0|1,0,1]=4 560 B13R1.3088 COC1=C(C=C(C=C1)C(=O)CCl)Cl Z89267925 [0,2,0,0,0,0|1,0,1]=4 561 B13R1.3088 COC1=C(C=C(C=C1)C(=O)CCl)F Z85921959 [0,2,0,0,0,0|1,0,1]=4 562 B13R1.3088 COC1=C(C=C(C=C1)C(=O)CO)Cl Z228586064 [0,2,0,0,0,0|1,0,1]=4 563 B13R1.3088 COC1=C(C=C(C=C1)C(=O)NO)F Z88293978 [0,2,0,0,0,0|2,0,0]=4 564 B13R1.3 CCC1=CC=C(C=C1)/C=C/C(=O)O Z2942851866 [0,2,0,0,0,0|1,0,1]=4 565 B13R1.3 COC1=CC=C(C=C1)/C=C/C(=O)O Z56931888 [0,2,0,0,0,0|0,0,1]=3 566 B13R1.3 COC1=CC=C(C=C1)/C=C/[N+](=O)[O-] Z56755542 [0,2,0,0,0,0|1,0,0]=3 567 B13R1.3 COC1=CC=C(C=C1)C#CC(=O)O Z57100824 [0,2,0,0,0,0|1,0,1]=4 568 B13R1.3 COC1=CC=C(C=C1)CCC(=O)N Z33545386 [0,2,0,0,0,0|1,0,1]=4 569 B13R1.3 COC1=CC=C(C=C1)CCC(=O)O Z104486868 [0,2,0,0,0,0|1,0,1]=4 570 B13R1.3 COC1=CC=C(C=C1)CCC(C)N Z278080480 [0,2,0,0,0,0|0,0,2]=4 571 B13R1.3 COC1=CC=C(C=C1)CCN(C)C Z168912118 [0,2,0,0,0,0|0,0,2]=4 572 B13R1.3 COC1=CC=C(C=C1)CNC(=O)N Z198194812 [0,2,0,0,0,0|1,0,1]=4 573 B13R1.3 COC1=CC=C(C=C1)NCC(C)C Z2327691573 [0,2,0,0,0,0|0,0,2]=4 574 B13R1.3 COC1=CC=C(C=C1)OCC(=O)O Z57229609 [0,2,0,0,0,0|1,0,1]=4 575 B13R1.3 COC1=CC=C(C=C1)OCC(=S)N Z295395794 [0,2,0,0,0,0|1,0,1]=4 576 B13R1.3 COC1=CC=C(C=C1)SCC(=O)N Z51312064 [0,2,0,0,0,0|1,0,1]=4 577 B13R1.3 COC1=CC=C(C=C1)SCC(=O)O Z56770877 [0,2,0,0,0,0|1,0,1]=4 578 B13R1.3 COC1=CN=C(C=C1)/C=C/C(=O)O Z1815157394 [0,2,0,0,0,0|1,0,1]=4 579 B13R1.3 CSC1=CC=C(C=C1)/C=C/C(=O)O Z2895087258 [0,2,0,0,0,0|0,1,1]=4 580 B13R1.74 CN(C)C1=CC=C(C=C1)/C=C/C#N Z335243686 [0,2,0,0,0,0|1,0,1]=4 581 B13R1.74 CN(C)C1=CC=C(C=C1)/C=C/C=O Z3064090061 [0,2,0,0,0,0|1,0,1]=4 582 B13R1.75 COC1=CC(=C(C=C1)CCC=O)C Z1259123438 [0,2,0,0,0,0|1,0,1]=4 583 B13R1.75 COC1=CC(=C(C=C1)CCCO)C Z1198265545 [0,2,0,0,0,0|0,0,2]=4 584 B13R1.77 C=CCOC1=CC=C(C=C1)CNC Z56959745 [0,2,0,0,0,0|1,0,1]=4 585 B13R1.77 CCCOC1=CC=C(C=C1)CNC Z5590138558 [0,2,0,0,0,0|1,0,1]=4 586 B13R1.77 CCOC1=CC=C(C=C1)CCNC Z2941651413 [0,2,0,0,0,0|0,0,2]=4 587 B13R1.77 CCOC1=CC=C(C=C1)OCCBr Z56886341 [0,2,0,0,0,0|1,0,1]=4 588 B13R1.77 CCOC1=CC=C(C=C1)OCCCl Z56912620 [0,2,0,0,0,0|1,0,1]=4 589 B13R1.77 CNCC1=CC=C(C=C1)OCCO Z5507386892 [0,2,0,0,0,0|1,0,1]=4 590 B13R1.371 C=CCNCC1=CC=C(C=C1)OC Z89283335 [0,2,0,0,0,0|0,0,2]=4 591 B13R1.371 CCCNCC1=CC=C(C=C1)OC Z2689031662 [0,2,0,0,0,0|0,0,2]=4 592 B13R1.371 CNCCCC1=CC=C(C=C1)OC Z385446946 [0,2,0,0,0,0|0,0,2]=4 593 B13R1.371 CNCCOC1=CC=C(C=C1)OC Z85917518 [0,2,0,0,0,0|0,0,2]=4 594 B13R1.371 COC1=CC=C(C=C1)CCCCN Z1198155601 [0,2,0,0,0,0|0,0,2]=4 595 B13R1.371 COC1=CC=C(C=C1)COCC=O Z906205198 [0,2,0,0,0,0|1,0,1]=4 596 B13R1.371 COC1=CC=C(C=C1)COCCN Z335080350 [0,2,0,0,0,0|0,0,2]=4 597 B13R1.371 COC1=CC=C(C=C1)NCCC#N Z56886603 [0,2,0,0,0,0|1,0,1]=4 598 B13R1.371 COC1=CC=C(C=C1)NCCCO Z104638312 [0,2,0,0,0,0|0,0,2]=4 599 B13R1.371 COC1=CC=C(C=C1)OCCC#N Z54336972 [0,2,0,0,0,0|1,0,1]=4 600 B13R1.371 COC1=CC=C(C=C1)OCCCBr Z104508746 [0,2,0,0,0,0|0,0,2]=4 601 B13R1.371 COC1=CC=C(C=C1)OCCCN Z271006116 [0,2,0,0,0,0|0,0,2]=4 602 B13R1.371 COC1=CC=C(C=C1)SCCC#N Z103338286 [0,2,0,0,0,0|1,0,1]=4 603 B13R1.371 CSC1=CC=C(C=C1)/C=N/NC=O Z49645818 [0,2,0,0,0,0|1,1,0]=4 604 B13R1.577 CCNCC1=CC(=C(C=C1)OC)F Z85956705 [0,2,0,0,0,0|0,0,2]=4 605 B13R1.577 CNCCC1=CC(=C(C=C1)OC)F Z5105882170 [0,2,0,0,0,0|0,0,2]=4 606 B13R1.577 COC1=C(C=C(C=C1)CCC=O)C Z2311407327 [0,2,0,0,0,0|1,0,1]=4 607 B13R1.577 COC1=C(C=C(C=C1)CCC=O)F Z993017856 [0,2,0,0,0,0|1,0,1]=4 608 B13R1.577 COC1=C(C=C(C=C1)CCCN)Br Z5847596118 [0,2,0,0,0,0|0,0,2]=4 609 B13R1.577 COC1=C(C=C(C=C1)CCCN)O Z3599685490 [0,2,0,0,0,0|0,0,2]=4 610 B13R1.1249 CNCC1=C(C=C(C=C1)OC)OC Z56957486 [0,2,0,0,0,0|1,0,1]=4 611 B13R1.1249 COC1=CC(=C(C=C1)/C=N/O)OC Z49568453 [0,2,0,0,0,0|2,0,0]=4 612 B13R1.1249 COC1=CC(=C(C=C1)CC=O)OC Z1020782876 [0,2,0,0,0,0|1,0,1]=4 613 B13R1.1254 CNCC1=C(C(=C(C=C1)OC)F)F Z5597728819 [0,2,0,0,0,0|1,0,1]=4 614 B13R1.3945 CNCC1=C(C=C(C=C1F)OC)F Z5580873150 [0,2,0,0,0,0|1,0,1]=4 615 B13R1.386 C=CCC1=CC(=C(C=C1)OC)OC Z1255398904 [0,2,0,0,0,0|0,0,2]=4 616 B13R1.386 CCNC1=CC(=C(C=C1)OC)OC Z286407122 [0,2,0,0,0,0|1,0,1]=4 617 B13R1.386 CNCC1=CC(=C(C=C1)OC)OC Z56173976 [0,2,0,0,0,0|1,0,1]=4 618 B13R1.386 COC1=C(C=C(C=C1)/C=N/O)OC Z49568350 [0,2,0,0,0,0|2,0,0]=4 619 B13R1.386 COC1=C(C=C(C=C1)CC=O)OC Z1020779916 [0,2,0,0,0,0|1,0,1]=4 620 B11R1.267 CNC1=C(C(=CC=C1)OC)Br Z3864796658 [0,0,1,1,0,0|2,0,0]=4 621 B11R1.267 CNC1=C(C(=CC=C1)OC)N Z1255401544 [0,0,1,1,0,0|2,0,0]=4 622 B11R1.267 COC1=C(C(=CC=C1)C=O)Br Z1269149587 [0,0,1,1,0,0|2,0,0]=4 623 B11R1.267 COC1=C(C(=CC=C1)C=O)C Z1198307350 [0,0,1,1,0,0|1,0,1]=4 624 B11R1.267 COC1=C(C(=CC=C1)C=O)Cl Z1255387516 [0,0,1,1,0,0|2,0,0]=4 625 B11R1.267 COC1=C(C(=CC=C1)C=O)F Z1255373110 [0,0,1,1,0,0|2,0,0]=4 626 B11R1.267 COC1=C(C(=CC=C1)C=O)O Z57921503 [0,0,1,1,0,0|2,0,0]=4 627 B11R1.267 COC1=C(C(=CC=C1)SC)N Z1262669516 [0,0,1,1,0,0|2,0,0]=4 628 B11R1.267 COC1=CC=CC(=C1Br)OC Z1269143259 [0,0,1,1,0,0|2,0,0]=4 629 B11R1.267 COC1=CC=CC(=C1I)OC Z1269162770 [0,0,1,1,0,0|2,0,0]=4 630 B11R1.267 COC1=CC=CC(=C1O)OC Z104477654 [0,0,1,1,0,0|2,0,0]=4 631 B11R1.267 COC1=CC=CC(=C1S)OC Z1198177412 [0,0,1,1,0,0|2,0,0]=4 632 B11R1.280 CCC1=C(C=CC(=C1)OC)Br Z1269109771 [0,0,1,1,0,0|1,0,1]=4 633 B11R1.280 CNC1=C(C=CC(=C1)OC)Br Z5989973729 [0,0,1,1,0,0|2,0,0]=4 634 B11R1.280 COC1=CC(=C(C=C1)Br)C=O Z1079442692 [0,0,1,1,0,0|2,0,0]=4 635 B11R1.280 COC1=CC(=C(C=C1)Br)OC Z299596224 [0,0,1,1,0,0|2,0,0]=4 636 B11R1.280 COC1=CC(=C(C=C1)C)C=O Z1201626604 [0,0,1,1,0,0|1,0,1]=4 637 B11R1.280 COC1=CC(=C(C=C1)Cl)C=O Z1201625883 [0,0,1,1,0,0|2,0,0]=4 638 B11R1.280 COC1=CC(=C(C=C1)F)C=O Z1203161971 [0,0,1,1,0,0|2,0,0]=4 639 B11R1.280 COC1=CC(=C(C=C1)I)C=O Z1269167723 [0,0,1,1,0,0|2,0,0]=4 640 B11R1.280 COC1=CC(=C(C=C1)N)OC Z104478344 [0,0,1,1,0,0|2,0,0]=4 641 B11R1.280 COC1=CC(=C(C=C1)O)C=O Z56899054 [0,0,1,1,0,0|2,0,0]=4 642 B11R2.34 CC1=CC=C(C=C1)C2CO2 Z278165170 [1,0,0,1,0,0|1,0,1]=4 643 B11R2.36 BrC1=CC2=C(C=CN2)C=C1 Z752239748 [1,0,0,1,0,0|2,0,0]=4 644 B11R2.36 BrC1=CC2=C(C=CO2)C=C1 Z1198180633 [1,0,0,1,0,0|2,0,0]=4 645 B11R2.36 BrC1=CC2=C(C=CS2)C=C1 Z1269160602 [1,0,0,1,0,0|2,0,0]=4 646 B11R2.36 CC1=CC2=C(C=C1)CNC2 Z2238336530 [1,0,0,1,0,0|1,0,1]=4 647 B11R2.36 CC1=CC2=C(C=C1)N=CN2 Z3234957798 [1,0,0,1,0,0|2,0,0]=4 648 B11R2.36 CC1=CC2=C(C=C1)N=CS2 Z1198156828 [1,0,0,1,0,0|2,0,0]=4 649 B11R2.36 CC1=CC2=C(C=C1)NC=C2 Z979311300 [1,0,0,1,0,0|1,0,1]=4 650 B11R2.36 CC1=CC2=C(C=C1)NCC2 Z235539062 [1,0,0,1,0,0|1,0,1]=4 651 B11R2.36 CC1=CC2=C(C=C1)OC=C2 Z1198151070 [1,0,0,1,0,0|1,0,1]=4 652 B11R2.36 CC1=CC2=C(C=CN2)C=C1 Z384970524 [1,0,0,1,0,0|1,0,0]=3 653 B11R2.36 CC1=NC=C2C=CNC2=C1 Z1255420119 [1,0,0,1,0,0|2,0,0]=4 654 B11R2.36 ClC1=CC2=C(C=CN2)C=C1 Z382723678 [1,0,0,1,0,0|2,0,0]=4 655 B11R2.36 FC1=CC2=C(C=CN2)C=C1 Z382723676 [1,0,0,1,0,0|2,0,0]=4 656 B11R2.36 NC1=CC2=C(C=CN2)C=C1 Z752239752 [1,0,0,1,0,0|2,0,0]=4 657 B11R2.36 NC1=CC2=C(C=CO2)C=C1 Z1198313503 [1,0,0,1,0,0|2,0,0]=4 658 B11R2.36 NC1=CC2=C(C=CS2)C=C1 Z2651578500 [1,0,0,1,0,0|2,0,0]=4 659 B11R2.36 OC1=CC2=C(C=C1)C=NN2 Z1198147845 [1,0,0,1,0,0|2,0,0]=4 660 B11R2.36 OC1=CC2=C(C=C1)C=NS2 Z1513829991 [1,0,0,1,0,0|2,0,0]=4 661 B11R2.36 OC1=CC2=C(C=C1)CNC2 Z2489383861 [1,0,0,1,0,0|1,0,1]=4 662 B11R2.36 OC1=CC2=C(C=C1)NC=C2 Z1203162319 [1,0,0,1,0,0|1,0,1]=4 663 B11R2.36 OC1=CC2=C(C=C1)NC=N2 Z1042386518 [1,0,0,1,0,0|2,0,0]=4 664 B11R2.36 OC1=CC2=C(C=C1)OC=N2 Z1198313500 [1,0,0,1,0,0|2,0,0]=4 665 B11R2.36 OC1=CC2=C(C=C1)OCC2 Z1198182902 [1,0,0,1,0,0|1,0,1]=4 666 B11R2.36 OC1=CC2=C(C=C1)SC=C2 Z1255397714 [1,0,0,1,0,0|1,0,1]=4 667 B11R2.36 OC1=CC2=C(C=CN2)C=C1 Z1203162244 [1,0,0,1,0,0|1,0,0]=3 668 B11R2.36 OC1=CC2=NC=CN2C=C1 Z3270903809 [1,0,0,1,0,0|2,0,0]=4 669 B13R2.16 COC1=CC=C(C=C1)C2OC2C Z278165290 [0,1,0,1,0,0|0,0,2]=4 670 B13R2.16 COC1=CC=C(C=C1)[C@@H]2C[C@H]2N Z2298098001 [0,1,0,1,0,0|0,0,2]=4 671 B13R2.16 COC1=CC=C(C=C1)[C@@H]2O[C@H]2C Z2527564242 [0,1,0,1,0,0|0,0,2]=4 672 B13R2.2121 CC1=CC2=C(N1)C=C(C=C2)C#N Z1198219270 [0,1,0,1,0,0|2,0,0]=4 673 B13R2.2121 CNC1=CC2=C(C=C1)N=C(S2)C Z1082871498 [0,1,0,1,0,0|2,0,0]=4 674 B13R2.2121 CNC1=CC2=C(C=C1)NC(=N2)C Z1403499839 [0,1,0,1,0,0|2,0,0]=4 675 B13R2.2121 COC1=CC2=C(C=C1)N=C(S2)C Z90123542 [0,1,0,1,0,0|1,0,0]=3 676 B13R2.2121 COC1=CC2=C(C=C1)N=C(S2)N Z56756338 [0,1,0,1,0,0|2,0,0]=4 677 B13R2.2121 COC1=CC2=C(C=C1)NC(=C2)C Z1197882538 [0,1,0,1,0,0|1,0,0]=3 678 B13R2.2121 COC1=CC2=C(C=C1)NC(=N2)C Z1587257377 [0,1,0,1,0,0|1,0,0]=3 679 B13R2.2121 COC1=CC2=C(C=C1)NC(=N2)N Z1198160975 [0,1,0,1,0,0|2,0,0]=4 680 B13R2.2121 COC1=CC2=C(C=C1)NC(=N2)S Z221604426 [0,1,0,1,0,0|2,0,0]=4 681 B13R2.2121 COC1=CC2=C(C=C1)NC(C2)C Z1255421552 [0,1,0,1,0,0|1,0,1]=4 682 B13R2.2121 COC1=CC2=C(C=C1)OC(=N2)N Z1255435333 [0,1,0,1,0,0|2,0,0]=4 683 B13R2.186 COC1=CC=C(C=C1)C2(CC2)N Z1815149203 [0,1,0,1,0,0|0,0,2]=4 684 B13R2.2130 COC1=CC2=C(C=C1)B(OC2)O Z1198279536 [0,1,0,1,0,0|2,0,0]=4 685 B13R2.2130 COC1=CC2=C(C=C1)C(=CN2)C Z1255420864 [0,1,0,1,0,0|1,0,0]=3 686 B13R2.2130 COC1=CC2=C(C=C1)C(=NO2)N Z1216820032 [0,1,0,1,0,0|2,0,0]=4 687 B13R2.2130 COC1=CC2=C(C=C1)C(=O)CC2 Z1203162378 [0,1,0,1,0,0|0,0,1]=3 688 B13R2.2130 COC1=CC2=C(C=C1)C(=O)CO2 Z1089974846 [0,1,0,1,0,0|1,0,1]=4 689 B13R2.2130 COC1=CC2=C(C=C1)C(=O)NC2 Z1198177422 [0,1,0,1,0,0|1,0,0]=3 690 B13R2.2130 COC1=CC2=C(C=C1)C(=O)NN2 Z2160914711 [0,1,0,1,0,0|2,0,0]=4 691 B13R2.2130 COC1=CC2=C(C=C1)C(=O)NO2 Z1255432717 [0,1,0,1,0,0|2,0,0]=4 692 B13R2.2130 COC1=CC2=NNC(=C2C=C1)N Z1889917114 [0,1,0,1,0,0|2,0,0]=4 693 B13R2.57 CNC1=CC2=C(C=C1)C=NC=C2 Z3688943453 [0,1,0,1,0,0|1,0,1]=4 694 B13R2.57 CNC1=CC2=C(C=CC=C2)C=C1 Z56346953 [0,1,0,1,0,0|1,0,1]=4 695 B13R2.57 COC1=CC2=C(C=C1)C=NC=C2 Z1201622861 [0,1,0,1,0,0|0,0,1]=3 696 B13R2.57 COC1=CC2=C(C=C1)C=NC=N2 Z1255402381 [0,1,0,1,0,0|1,0,0]=3 697 B13R2.57 COC1=CC2=C(C=C1)CCC=C2 Z1198179971 [0,1,0,1,0,0|0,0,2]=4 698 B13R2.57 COC1=CC2=C(C=C1)N=CC=C2 Z166628264 [0,1,0,1,0,0|0,0,1]=3 699 B13R2.57 COC1=CC2=C(C=C1)NCCC2 Z169918896 [0,1,0,1,0,0|0,0,2]=4 700 B13R2.57 COC1=CC2=C(C=CC=C2)C=C1 Z53835290 [0,1,0,1,0,0|0,0,1]=3 701 B13R2.57 COC1=CC2=C(C=CC=N2)C=C1 Z1198155589 [0,1,0,1,0,0|0,0,1]=3 702 B13R2.57 COC1=CC2=C(C=CN=C2)C=C1 Z839575220 [0,1,0,1,0,0|0,0,1]=3 703 B13R2.669 CC1=CNC2=C1C=C(C=C2)C=O Z1198726192 [0,1,0,1,0,0|2,0,0]=4 704 B13R2.669 CC1=CSC2=C1C=C(C=C2)CO Z1896845856 [0,1,0,1,0,0|2,0,0]=4 705 B13R2.669 CN1C=CC2=C1C=C(C=C2)C=O Z1198180913 [0,1,0,1,0,0|2,0,0]=4 706 B13R2.669 COC1=CC2=C(C=C1)CCC2N Z3234887230 [0,1,0,1,0,0|0,0,2]=4 707 B13R2.669 COC1=CC2=C(C=C1)CNC2=O Z1198176505 [0,1,0,1,0,0|1,0,1]=4 708 B13R2.669 COC1=CC2=C(C=C1)NN=C2N Z1198276906 [0,1,0,1,0,0|2,0,0]=4 709 B13R2.669 COC1=CC2=C(C=C1)OCC2=O Z334863074 [0,1,0,1,0,0|1,0,1]=4 710 B13R2.669 COC1=NC2=C(C=C1)NC=C2I Z1269217997 [0,1,0,1,0,0|2,0,0]=4 711 B13R2.654 COC1=CC2=C(C=CN2)C(=C1)F Z1255426000 [0,1,0,1,0,0|1,0,0]=3 712 B13R2.654 COC1=CC2=C(C=NN2)C(=C1)F Z1198174750 [0,1,0,1,0,0|2,0,0]=4 713 B13R2.2170 COC1=CC(=C(C=C1)C2CC2)N Z2739151980 [0,1,0,1,0,0|0,0,2]=4 714 B13R2.449 CCOC1=CC2=C(C=C1)CNC2 Z2718930989 [0,1,0,1,0,0|1,0,1]=4 715 B13R2.449 CNCC1=CC2=C(C=C1)OCC2 Z1889710317 [0,1,0,1,0,0|1,0,1]=4 716 B13R2.449 CNCC1=CC2=C(C=C1)OCO2 Z57307088 [0,1,0,1,0,0|1,0,1]=4 717 B13R2.449 NCCC1=CC2=C(C=CN2)C=C1 Z1198178617 [0,1,0,1,0,0|2,0,0]=4 718 B13R2.449 O/N=C/C1=CC2=C(C=C1)OCO2 Z49568304 [0,1,0,1,0,0|2,0,0]=4 719 B13R2.449 O=CCC1=CC2=C(C=C1)OCO2 Z1198331621 [0,1,0,1,0,0|1,0,1]=4 720 B13R2.449 O=CNC1=CC2=C(C=C1)OCO2 Z1258520893 [0,1,0,1,0,0|2,0,0]=4 721 B13R2.84 COC1=C(C2=C(C=C1)C=NN2)F Z1681376243 [0,1,0,1,0,0|2,0,0]=4 722 B13R2.84 COC1=C(C2=C(C=C1)CCC2)Br Z1269137892 [0,1,0,1,0,0|0,0,2]=4 723 B13R2.84 COC1=C(C2=C(C=C1)CCC2)N Z1827894929 [0,1,0,1,0,0|0,0,2]=4 724 B13R2.84 COC1=C(C2=C(C=C1)NC=C2)Br Z1269188720 [0,1,0,1,0,0|1,0,1]=4 725 B13R2.84 COC1=C(C2=C(C=C1)NC=C2)N Z1216831022 [0,1,0,1,0,0|1,0,1]=4 726 B13R2.599 COC1=C(C=C2C=CNC2=C1)Cl Z1198165185 [0,1,0,1,0,0|1,0,0]=3 727 B13R2.599 COC1=C(C=C2C=NNC2=C1)Cl Z1198280323 [0,1,0,1,0,0|2,0,0]=4 728 B13R2.599 COC1=C(C=C2C=NNC2=C1)N Z1198280320 [0,1,0,1,0,0|2,0,0]=4 729 B13R2.599 COC1=C(C=C2CCCC2=C1)O Z1513818935 [0,1,0,1,0,0|0,0,2]=4 730 B13R2.599 COC1=C(C=C2COCC2=C1)Br Z3219627381 [0,1,0,1,0,0|1,0,1]=4 731 B13R2.599 COC1=C(C=C2N=CSC2=C1)N Z3243456329 [0,1,0,1,0,0|2,0,0]=4 732 B13R2.599 COC1=C(C=C2NC=CC2=C1)Cl Z1255373562 [0,1,0,1,0,0|1,0,1]=4 733 B13R2.599 COC1=CC2=NC=CN2C=C1Br Z1681369271 [0,1,0,1,0,0|2,0,0]=4 734 B13R2.2396 COC1=C(C=C(C=C1)C2CC2)N Z992239738 [0,1,0,1,0,0|0,0,2]=4 735 B13R2.2396 COC1=C(C=C(C=C1)C2CO2)F Z316089178 [0,1,0,1,0,0|1,0,1]=4 736 B9R1.21 COC1=CC=C(O1)C=O Z1309664827 [1,0,0,0,1,0|2,0,0]=4 737 B9R1.21 COC1=CC=C(S1)C=O Z1255429054 [1,0,0,0,1,0|2,0,0]=4