0 B10R1.4 C=CCC1=C(C=CC=C1)O Z104493210 [0,0,0,0,0,0|0,0,0]=0 1 B10R1.4 CC1=C(C=CC=C1)/C=N/O Z49568554 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.4 CC1=C(C=CC=C1)CC#N Z57039593 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.4 CC1=C(C=CC=C1)CC=O Z993017618 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.4 CC1=C(C=CC=C1)CNN Z336481586 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.4 CC1=C(C=CC=N1)CC#N Z1198263560 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.4 CC1=C(C=NC=C1)CCN Z1198264124 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.4 CC1=C(N=CC=C1)CCN Z1098234132 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.4 CC1=C(N=CC=C1)CCO Z1198169041 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.4 CCCC1=C(C=CC=C1)Br Z1479686725 [0,0,0,0,0,0|1,0,2]=3 10 B10R1.4 CCCC1=C(C=CC=C1)I Z821158622 [0,0,0,0,0,0|1,0,2]=3 11 B10R1.4 CCCC1=C(C=CC=C1)N Z336087926 [0,0,0,0,0,0|1,0,2]=3 12 B10R1.4 CCNC1=C(C=CC=C1)C Z104477886 [0,0,0,0,0,0|2,0,2]=4 13 B10R1.4 CCNC1=C(C=CC=C1)F Z286518592 [0,0,0,0,0,0|2,0,2]=4 14 B10R1.4 CCNC1=C(C=CC=C1)I Z4405452872 [0,0,0,0,0,0|2,0,2]=4 15 B10R1.4 CCNC1=C(C=CC=C1)N Z359511482 [0,0,0,0,0,0|2,0,2]=4 16 B10R1.4 CCNC1=C(C=CC=C1)O Z5185414820 [0,0,0,0,0,0|1,0,2]=3 17 B10R1.4 CCOC1=C(C=CC=C1)Br Z153728256 [0,0,0,0,0,0|2,0,2]=4 18 B10R1.4 CCOC1=C(C=CC=C1)I Z406416174 [0,0,0,0,0,0|2,0,2]=4 19 B10R1.4 CCOC1=C(C=CC=C1)N Z104478442 [0,0,0,0,0,0|2,0,2]=4 20 B10R1.4 CCOC1=C(C=CC=C1)O Z104480244 [0,0,0,0,0,0|1,0,2]=3 21 B10R1.4 CCSC1=C(C=CC=C1)Br Z149386616 [0,0,0,0,0,0|2,0,2]=4 22 B10R1.4 CCSC1=C(C=CC=C1)N Z316174690 [0,0,0,0,0,0|2,0,2]=4 23 B10R1.4 CCSC1=C(C=CC=C1)O Z905204460 [0,0,0,0,0,0|1,0,2]=3 24 B10R1.4 CNCC1=C(C=CC=C1)C Z56948272 [0,0,0,0,0,0|2,0,1]=3 25 B10R1.4 CNCC1=C(C=CC=C1)Cl Z56955956 [0,0,0,0,0,0|2,0,1]=3 26 B10R1.4 CNCC1=C(C=CC=C1)F Z56953087 [0,0,0,0,0,0|2,0,1]=3 27 B10R1.4 CNCC1=C(C=CC=C1)N Z764242576 [0,0,0,0,0,0|2,0,1]=3 28 B10R1.4 CNCC1=C(C=CC=C1)O Z398513608 [0,0,0,0,0,0|1,0,1]=2 29 B10R1.4 CNCC1=C(C=CC=N1)Cl Z5392638231 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.4 CNCC1=C(C=NC=C1)F Z4545616296 [0,0,0,0,0,0|3,0,1]=4 31 B10R1.4 COCC1=C(C=CC=C1)I Z821093342 [0,0,0,0,0,0|2,0,1]=3 32 B10R1.4 COCC1=C(C=CC=C1)O Z821093528 [0,0,0,0,0,0|1,0,1]=2 33 B10R1.4 COCC1=C(N=CC=C1)N Z991490684 [0,0,0,0,0,0|3,0,1]=4 34 B10R1.4 CSCC1=C(C=CC=C1)N Z732207148 [0,0,0,0,0,0|2,0,1]=3 35 B10R1.4 N#CCC1=C(C=CC=C1)Cl Z56904744 [0,0,0,0,0,0|2,0,1]=3 36 B10R1.4 N#CCC1=C(C=CC=C1)F Z104477228 [0,0,0,0,0,0|2,0,1]=3 37 B10R1.4 N#CCC1=C(N=CC=C1)Cl Z1198263561 [0,0,0,0,0,0|3,0,1]=4 38 B10R1.4 N#CNC1=C(C=CC=C1)Cl Z991532350 [0,0,0,0,0,0|3,0,1]=4 39 B10R1.4 N#CSC1=C(C=CC=C1)F Z966424784 [0,0,0,0,0,0|3,0,1]=4 40 B10R1.4 NC1=C(C=CC=C1)CCO Z3417485770 [0,0,0,0,0,0|2,0,1]=3 41 B10R1.4 NCCC1=C(C=CC=C1)Br Z295382782 [0,0,0,0,0,0|2,0,1]=3 42 B10R1.4 NCCC1=C(C=CC=C1)Cl Z285143744 [0,0,0,0,0,0|2,0,1]=3 43 B10R1.4 NCCC1=C(C=CC=C1)F Z57051087 [0,0,0,0,0,0|2,0,1]=3 44 B10R1.4 NCCC1=C(C=CC=C1)O Z594038184 [0,0,0,0,0,0|1,0,1]=2 45 B10R1.4 NCCC1=C(N=CC=C1)O Z5862214540 [0,0,0,0,0,0|2,0,1]=3 46 B10R1.4 NCCN1C=CC=CC1=O Z1891776659 [0,0,0,0,0,0|2,0,2]=4 47 B10R1.4 O/N=C/C1=C(C=CC=C1)Br Z49568618 [0,0,0,0,0,0|3,0,1]=4 48 B10R1.4 O/N=C/C1=C(C=CC=C1)F Z49568531 [0,0,0,0,0,0|3,0,1]=4 49 B10R1.4 O/N=C/C1=C(C=CC=C1)O Z49568319 [0,0,0,0,0,0|2,0,1]=3 50 B10R1.4 O=C1C=CC=CN1CCO Z234898059 [0,0,0,0,0,0|2,0,2]=4 51 B10R1.4 O=CCC1=C(C=CC=C1)Br Z1183459130 [0,0,0,0,0,0|2,0,0]=2 52 B10R1.4 O=CCC1=C(C=CC=C1)F Z993017796 [0,0,0,0,0,0|2,0,0]=2 53 B10R1.4 OCCC1=C(C=CC=C1)Br Z1183459188 [0,0,0,0,0,0|2,0,1]=3 54 B10R1.4 OCCC1=C(C=CC=C1)F Z397587382 [0,0,0,0,0,0|2,0,1]=3 55 B9R1.8 CCCC1=CC=CC=C1 Z104479154 [1,0,0,0,0,0|0,0,2]=3 56 B9R1.8 CCCC1=NC=CC=C1 Z1255434741 [1,0,0,0,0,0|1,0,2]=4 57 B9R1.8 CCNC1=CC=CC=C1 Z104472482 [1,0,0,0,0,0|1,0,2]=4 58 B9R1.8 CNCC1=CC=NC=C1 Z57390007 [1,0,0,0,0,0|2,0,1]=4 59 B9R1.8 CNCC1=CN=CC=C1 Z56963341 [1,0,0,0,0,0|2,0,1]=4 60 B9R1.8 CSCC1=CN=CC=C1 Z599631354 [1,0,0,0,0,0|2,0,1]=4 61 B9R1.8 N#CCC1=CN=CC=C1 Z239871646 [1,0,0,0,0,0|2,0,1]=4 62 B9R1.8 N#CCC1=NC=CC=C1 Z104476888 [1,0,0,0,0,0|2,0,1]=4 63 B9R1.8 N#COC1=CC=CC=C1 Z1198165353 [1,0,0,0,0,0|2,0,1]=4 64 B9R1.8 NCCC1=CC=NC=C1 Z241056520 [1,0,0,0,0,0|2,0,1]=4 65 B9R1.8 NCCC1=CN=CC=C1 Z241056524 [1,0,0,0,0,0|2,0,1]=4 66 B9R1.8 NCCC1=NC=CC=C1 Z104478200 [1,0,0,0,0,0|2,0,1]=4 67 B9R1.8 NNCC1=CC=CC=C1 Z56969306 [1,0,0,0,0,0|2,0,0]=3 68 B9R1.8 NNCC1=CN=CC=C1 Z370706826 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.8 NOCC1=CC=CC=C1 Z90668722 [1,0,0,0,0,0|2,0,0]=3 70 B9R1.8 O=CCC1=CC=CC=C1 Z104472146 [1,0,0,0,0,0|1,0,0]=2 71 B9R1.8 OCCC1=CC=CC=C1 Z104473586 [1,0,0,0,0,0|1,0,1]=3 72 B9R1.8 OCCC1=CN=CC=C1 Z992949518 [1,0,0,0,0,0|2,0,1]=4 73 B9R1.8 OCCC1=NC=CC=C1 Z104473592 [1,0,0,0,0,0|2,0,1]=4 74 B9R1.8 S=C=NC1=CC=CC=C1 Z56904678 [1,0,0,0,0,0|2,0,1]=4 75 B9R1.15 BrCC1=C(C=CC=C1)Br Z56969700 [1,0,0,0,0,0|2,0,0]=3 76 B9R1.15 C#CC1=C(C=CC=C1)Cl Z1080385584 [1,0,0,0,0,0|1,0,2]=4 77 B9R1.15 C#CC1=C(C=CC=C1)F Z1080385538 [1,0,0,0,0,0|1,0,2]=4 78 B9R1.15 C=CC1=C(C=CC=C1)Cl Z957339910 [1,0,0,0,0,0|1,0,0]=2 79 B9R1.15 C=CC1=[N+](C=CC=C1)[O-] Z1255451651 [1,0,0,0,0,0|1,0,1]=3 80 B9R1.15 CC1=C(C=CC=C1)C=O Z104478122 [1,0,0,0,0,0|2,0,0]=3 81 B9R1.15 CC1=C(C=CC=C1)CO Z335244790 [1,0,0,0,0,0|2,0,0]=3 82 B9R1.15 CC1=C(C=CC=C1)NN Z56933829 [1,0,0,0,0,0|3,0,0]=4 83 B9R1.15 CC1=C(C=CC=N1)C=O Z1104852897 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.15 CC1=C(C=CN=C1)C=O Z1201621679 [1,0,0,0,0,0|3,0,0]=4 85 B9R1.15 CC1=C(C=CN=C1)CO Z1198163942 [1,0,0,0,0,0|3,0,0]=4 86 B9R1.15 CC1=C(C=NC=C1)C=O Z1198173330 [1,0,0,0,0,0|3,0,0]=4 87 B9R1.15 CC1=C(C=NC=C1)CO Z1198156922 [1,0,0,0,0,0|3,0,0]=4 88 B9R1.15 CC1=C(N=CC=C1)C=O Z1079442732 [1,0,0,0,0,0|3,0,0]=4 89 B9R1.15 CC1=C(N=CC=C1)CO Z976637084 [1,0,0,0,0,0|3,0,0]=4 90 B9R1.15 CCC1=C(C=CC=C1)Br Z1255457372 [1,0,0,0,0,0|1,0,1]=3 91 B9R1.15 CCC1=C(C=CC=C1)O Z104477226 [1,0,0,0,0,0|0,0,1]=2 92 B9R1.15 CCC1=C(C=NC=C1)N Z1203586904 [1,0,0,0,0,0|2,0,1]=4 93 B9R1.15 CCC1=C(C=NC=N1)O Z1618133826 [1,0,0,0,0,0|2,0,1]=4 94 B9R1.15 CCC1=C(N=CC=C1)N Z1192017773 [1,0,0,0,0,0|2,0,1]=4 95 B9R1.15 CCC1=C(N=CC=C1)O Z1198266674 [1,0,0,0,0,0|1,0,1]=3 96 B9R1.15 CCC1=CNC=CC1=N Z1525649973 [1,0,0,0,0,0|2,0,1]=4 97 B9R1.15 CC[N+]1=C(C=CC=C1)N Z56791107 [1,0,0,0,0,0|2,0,1]=4 98 B9R1.15 CNC1=C(C=CC=C1)Br Z2588063702 [1,0,0,0,0,0|2,0,1]=4 99 B9R1.15 CNC1=C(C=CC=C1)F Z335276746 [1,0,0,0,0,0|2,0,1]=4 100 B9R1.15 CNC1=C(C=CC=C1)N Z57472969 [1,0,0,0,0,0|2,0,1]=4 101 B9R1.15 COC1=C(C=CC=C1)F Z54600290 [1,0,0,0,0,0|2,0,1]=4 102 B9R1.15 COC1=C(C=CC=C1)O Z104474028 [1,0,0,0,0,0|1,0,1]=3 103 B9R1.15 COC1=C(C=CC=N1)O Z1255423921 [1,0,0,0,0,0|2,0,1]=4 104 B9R1.15 CSC1=C(C=CC=C1)C Z785054008 [1,0,0,0,0,0|2,0,1]=4 105 B9R1.15 CSC1=C(C=CC=C1)N Z104478220 [1,0,0,0,0,0|2,0,1]=4 106 B9R1.15 N#CC1=C(C=CC=C1)Br Z57899728 [1,0,0,0,0,0|2,0,1]=4 107 B9R1.15 N#CC1=C(C=CC=C1)Cl Z57756581 [1,0,0,0,0,0|2,0,1]=4 108 B9R1.15 N#CC1=C(C=CC=C1)I Z57899723 [1,0,0,0,0,0|2,0,1]=4 109 B9R1.15 N#CC1=C(C=CC=C1)N Z104478174 [1,0,0,0,0,0|2,0,1]=4 110 B9R1.15 N#CC1=C(C=CC=C1)O Z104477750 [1,0,0,0,0,0|1,0,1]=3 111 B9R1.15 N#CC1=C(C=NC=C1)O Z1255404294 [1,0,0,0,0,0|2,0,1]=4 112 B9R1.15 NC1=C(C=CC=C1)C=O Z3034936011 [1,0,0,0,0,0|2,0,0]=3 113 B9R1.15 NC1=C(C=CC=C1)CO Z104495736 [1,0,0,0,0,0|2,0,0]=3 114 B9R1.15 NC1=C(C=CC=N1)C=O Z787969952 [1,0,0,0,0,0|3,0,0]=4 115 B9R1.15 NC1=C(C=CN=C1)C=O Z1741972771 [1,0,0,0,0,0|3,0,0]=4 116 B9R1.15 NC1=C(C=CN=C1)CO Z1201623606 [1,0,0,0,0,0|3,0,0]=4 117 B9R1.15 NC1=C(C=NC=C1)C=O Z1157726300 [1,0,0,0,0,0|3,0,0]=4 118 B9R1.15 NCC1=C(C=CC=C1)Cl Z55002587 [1,0,0,0,0,0|2,0,0]=3 119 B9R1.15 NCC1=C(C=CC=C1)I Z2574934431 [1,0,0,0,0,0|2,0,0]=3 120 B9R1.15 NCC1=C(C=CC=C1)O Z993991142 [1,0,0,0,0,0|1,0,0]=2 121 B9R1.15 NCC1=C(C=CC=N1)F Z1575304378 [1,0,0,0,0,0|3,0,0]=4 122 B9R1.15 NCC1=C(C=CC=N1)N Z1198181626 [1,0,0,0,0,0|3,0,0]=4 123 B9R1.15 NCC1=C(C=CC=N1)O Z1198156472 [1,0,0,0,0,0|2,0,0]=3 124 B9R1.15 NCC1=C(C=CN=C1)Cl Z3386909551 [1,0,0,0,0,0|3,0,0]=4 125 B9R1.15 NCC1=C(C=CN=C1)N Z1742055036 [1,0,0,0,0,0|3,0,0]=4 126 B9R1.15 NCC1=C(C=NC=C1)Br Z2731710898 [1,0,0,0,0,0|3,0,0]=4 127 B9R1.15 NNC1=C(C=CC=C1)Br Z216309278 [1,0,0,0,0,0|3,0,0]=4 128 B9R1.15 NNC1=C(C=CC=C1)Cl Z56928643 [1,0,0,0,0,0|3,0,0]=4 129 B9R1.15 NNC1=C(C=CC=C1)F Z220383458 [1,0,0,0,0,0|3,0,0]=4 130 B9R1.15 O=CC1=C(C=CC=C1)Br Z104478338 [1,0,0,0,0,0|2,0,0]=3 131 B9R1.15 O=CC1=C(C=CC=C1)Cl Z104472866 [1,0,0,0,0,0|2,0,0]=3 132 B9R1.15 O=CC1=C(C=CC=C1)F Z104476570 [1,0,0,0,0,0|2,0,0]=3 133 B9R1.15 O=CC1=C(C=CC=C1)I Z56899024 [1,0,0,0,0,0|2,0,0]=3 134 B9R1.15 O=CC1=C(C=CC=C1)O Z57127523 [1,0,0,0,0,0|1,0,0]=2 135 B9R1.15 O=CC1=C(C=CC=N1)Br Z1201624233 [1,0,0,0,0,0|3,0,0]=4 136 B9R1.15 O=CC1=C(C=CC=N1)Cl Z1198267206 [1,0,0,0,0,0|3,0,0]=4 137 B9R1.15 O=CC1=C(C=CC=N1)F Z1201624236 [1,0,0,0,0,0|3,0,0]=4 138 B9R1.15 O=CC1=C(C=CC=N1)O Z1201623419 [1,0,0,0,0,0|2,0,0]=3 139 B9R1.15 O=CC1=C(C=CN=C1)Br Z1201623579 [1,0,0,0,0,0|3,0,0]=4 140 B9R1.15 O=CC1=C(C=CN=C1)Cl Z1198164100 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.15 O=CC1=C(C=CN=C1)O Z1198277591 [1,0,0,0,0,0|2,0,0]=3 142 B9R1.15 O=CC1=C(C=NC=C1)Br Z1192338771 [1,0,0,0,0,0|3,0,0]=4 143 B9R1.15 O=CC1=C(C=NC=C1)Cl Z1255391336 [1,0,0,0,0,0|3,0,0]=4 144 B9R1.15 O=CC1=C(C=NC=C1)F Z1203162407 [1,0,0,0,0,0|3,0,0]=4 145 B9R1.15 O=CC1=CC=CNC1=O Z1198173495 [1,0,0,0,0,0|2,0,1]=4 146 B9R1.15 OCC1=C(C=CC=C1)Br Z335245004 [1,0,0,0,0,0|2,0,0]=3 147 B9R1.15 OCC1=C(C=CC=C1)Cl Z104476786 [1,0,0,0,0,0|2,0,0]=3 148 B9R1.15 OCC1=C(C=CC=C1)F Z104495204 [1,0,0,0,0,0|2,0,0]=3 149 B9R1.15 OCC1=C(C=CC=C1)I Z57472670 [1,0,0,0,0,0|2,0,0]=3 150 B9R1.15 OCC1=C(C=CC=C1)O Z335244902 [1,0,0,0,0,0|1,0,0]=2 151 B9R1.15 OCC1=C(C=CN=C1)Cl Z1741982140 [1,0,0,0,0,0|3,0,0]=4 152 B9R1.15 OCC1=C(C=NC=C1)Cl Z1198261848 [1,0,0,0,0,0|3,0,0]=4 153 B9R1.15 OCC1=C(C=NC=C1)F Z1251273325 [1,0,0,0,0,0|3,0,0]=4 154 B9R1.15 OCC1=C(N=CC=C1)Cl Z979431808 [1,0,0,0,0,0|3,0,0]=4 155 B9R1.15 SCC1=C(C=CC=C1)Cl Z55948221 [1,0,0,0,0,0|2,0,0]=3 156 B11R1.13 C=CCC1=CC=CC(=C1O)O Z56778453 [0,1,0,0,0,0|0,0,0]=1 157 B11R1.13 CC1=C(C(=CC=C1)CC#N)F Z1255416252 [0,1,0,0,0,0|2,0,1]=4 158 B11R1.13 CC1=C(C(=CC=C1)CCN)C Z4927171483 [0,1,0,0,0,0|2,0,1]=4 159 B11R1.13 CNCC1=C(C(=CC=C1)Br)O Z4658970144 [0,1,0,0,0,0|1,0,1]=3 160 B11R1.13 CNCC1=C(C(=CC=C1)Cl)F Z3013893037 [0,1,0,0,0,0|2,0,1]=4 161 B11R1.13 CNCC1=C(C(=CC=C1)F)F Z4658970152 [0,1,0,0,0,0|2,0,1]=4 162 B11R1.13 CSCC1=C(C(=CC=C1)N)C Z732207424 [0,1,0,0,0,0|2,0,1]=4 163 B11R1.13 N#CCC1=C(C(=CC=C1)Br)Cl Z1269187155 [0,1,0,0,0,0|2,0,1]=4 164 B11R1.13 N#CCC1=C(C(=CC=C1)Br)O Z1269134802 [0,1,0,0,0,0|1,0,1]=3 165 B11R1.13 N#CCC1=C(C(=CC=C1)Cl)F Z1201621210 [0,1,0,0,0,0|2,0,1]=4 166 B11R1.13 N#CCC1=CC=CC(=C1Cl)F Z1198263827 [0,1,0,0,0,0|2,0,1]=4 167 B11R1.13 NCCC1=C(C(=CC=C1)Br)O Z1953500453 [0,1,0,0,0,0|1,0,1]=3 168 B11R1.13 NCCC1=C(C(=CC=C1)Cl)Cl Z444350066 [0,1,0,0,0,0|2,0,1]=4 169 B11R1.13 NCCC1=C(C(=CC=C1)Cl)F Z3301588304 [0,1,0,0,0,0|2,0,1]=4 170 B11R1.13 NCCC1=C(C(=CC=C1)F)Cl Z4926042702 [0,1,0,0,0,0|2,0,1]=4 171 B11R1.13 NCCC1=C(C(=CC=C1)F)F Z1267773780 [0,1,0,0,0,0|2,0,1]=4 172 B11R1.13 O=CCC1=C(C(=CC=C1)Br)F Z1868320120 [0,1,0,0,0,0|2,0,0]=3 173 B11R1.13 O=CCC1=CC=CC(=C1F)F Z1183458992 [0,1,0,0,0,0|2,0,0]=3 174 B11R1.13 OCCC1=C(C(=CC=C1)F)F Z1183459328 [0,1,0,0,0,0|2,0,1]=4 175 B11R1.17 C#CCNC1=C(C=CC=C1)F Z267213460 [0,1,0,0,0,0|1,0,2]=4 176 B11R1.17 C#CCOC1=C(C=CC=C1)Cl Z54471915 [0,1,0,0,0,0|1,0,2]=4 177 B11R1.17 C#CCOC1=C(C=CC=C1)F Z54554294 [0,1,0,0,0,0|1,0,2]=4 178 B11R1.17 C#CCOC1=C(C=CC=C1)N Z730514548 [0,1,0,0,0,0|1,0,2]=4 179 B11R1.17 C#CCOC1=C(C=CC=C1)O Z381415368 [0,1,0,0,0,0|0,0,2]=3 180 B11R1.17 C=CCSC1=C(C=CC=C1)N Z89272864 [0,1,0,0,0,0|1,0,0]=2 181 B11R1.17 CC1=C(C=CC=C1)CCCN Z424782962 [0,1,0,0,0,0|1,0,2]=4 182 B11R1.17 CC1=C(C=CC=C1)CCCO Z979436644 [0,1,0,0,0,0|1,0,2]=4 183 B11R1.17 CC1=C(C=CC=C1)OCC#N Z53791706 [0,1,0,0,0,0|2,0,1]=4 184 B11R1.17 CC1=C(C=CC=C1)OCCN Z223656356 [0,1,0,0,0,0|2,0,1]=4 185 B11R1.17 CC1=C(C=NC=C1)CCC=O Z1270653786 [0,1,0,0,0,0|2,0,1]=4 186 B11R1.17 CCCNC1=C(C=CC=C1)F Z334942896 [0,1,0,0,0,0|1,0,2]=4 187 B11R1.17 CCCNC1=C(C=CC=C1)N Z94601320 [0,1,0,0,0,0|1,0,2]=4 188 B11R1.17 CCCOC1=C(C=CC=C1)Br Z54722000 [0,1,0,0,0,0|1,0,2]=4 189 B11R1.17 CCCOC1=C(C=CC=C1)N Z56968930 [0,1,0,0,0,0|1,0,2]=4 190 B11R1.17 CCCOC1=C(C=CC=C1)O Z55993120 [0,1,0,0,0,0|0,0,2]=3 191 B11R1.17 CCNCC1=C(C=CC=C1)Br Z1982494002 [0,1,0,0,0,0|1,0,2]=4 192 B11R1.17 CCNCC1=C(C=CC=C1)C Z90513218 [0,1,0,0,0,0|1,0,2]=4 193 B11R1.17 CCNCC1=C(C=CC=C1)Cl Z90513164 [0,1,0,0,0,0|1,0,2]=4 194 B11R1.17 CCNCC1=C(C=CC=C1)F Z286282968 [0,1,0,0,0,0|1,0,2]=4 195 B11R1.17 CCNCC1=C(C=CC=C1)N Z2351947311 [0,1,0,0,0,0|1,0,2]=4 196 B11R1.17 CCOCC1=C(C=CC=C1)N Z285163822 [0,1,0,0,0,0|1,0,2]=4 197 B11R1.17 CNCCC1=C(C=CC=C1)C Z2234185664 [0,1,0,0,0,0|1,0,2]=4 198 B11R1.17 CNCCC1=C(C=CC=C1)Cl Z4935566656 [0,1,0,0,0,0|1,0,2]=4 199 B11R1.17 CNCCC1=C(C=CC=C1)F Z163192604 [0,1,0,0,0,0|1,0,2]=4 200 B11R1.17 CNCCC1=C(C=CC=C1)O Z1665033474 [0,1,0,0,0,0|0,0,2]=3 201 B11R1.17 COCCC1=C(C=CC=C1)N Z992259832 [0,1,0,0,0,0|1,0,2]=4 202 B11R1.17 ClC1=C(C=CC=C1)OCCBr Z56886267 [0,1,0,0,0,0|2,0,1]=4 203 B11R1.17 N#CCCC1=C(C=CC=C1)Br Z815260584 [0,1,0,0,0,0|1,0,2]=4 204 B11R1.17 N#CCOC1=C(C=CC=C1)Br Z54684411 [0,1,0,0,0,0|2,0,1]=4 205 B11R1.17 N#CCSC1=C(C=CC=C1)Br Z149386606 [0,1,0,0,0,0|2,0,1]=4 206 B11R1.17 N#CCSC1=C(C=CC=C1)Cl Z18459623 [0,1,0,0,0,0|2,0,1]=4 207 B11R1.17 N#CCSC1=C(C=CC=C1)F Z18098612 [0,1,0,0,0,0|2,0,1]=4 208 B11R1.17 NC1=C(C=CC=C1)CCCO Z1198265858 [0,1,0,0,0,0|1,0,2]=4 209 B11R1.17 NC1=C(C=CC=C1)NCCO Z55928991 [0,1,0,0,0,0|2,0,1]=4 210 B11R1.17 NC1=C(C=CC=C1)OCCO Z3445703033 [0,1,0,0,0,0|2,0,1]=4 211 B11R1.17 NCCCC1=C(C=CC=C1)Cl Z1695729033 [0,1,0,0,0,0|1,0,2]=4 212 B11R1.17 NCCCC1=C(C=CC=C1)F Z424783030 [0,1,0,0,0,0|1,0,2]=4 213 B11R1.17 NCCNC1=C(C=CC=C1)N Z991530054 [0,1,0,0,0,0|2,0,1]=4 214 B11R1.17 NCCOC1=C(C=CC=C1)Br Z803145324 [0,1,0,0,0,0|2,0,1]=4 215 B11R1.17 NCCOC1=C(C=CC=C1)Cl Z54747867 [0,1,0,0,0,0|2,0,1]=4 216 B11R1.17 NCCOC1=C(C=CC=C1)F Z1272739857 [0,1,0,0,0,0|2,0,1]=4 217 B11R1.17 NCCOC1=C(C=CC=C1)O Z3217405430 [0,1,0,0,0,0|1,0,1]=3 218 B11R1.17 NCCSC1=C(C=CC=C1)F Z57971449 [0,1,0,0,0,0|2,0,1]=4 219 B11R1.17 NNCCC1=C(C=CC=C1)F Z285144176 [0,1,0,0,0,0|2,0,1]=4 220 B11R1.17 O=CCCC1=C(C=CC=C1)F Z993017602 [0,1,0,0,0,0|1,0,1]=3 221 B11R1.17 OCCCC1=C(C=CC=C1)Br Z992949552 [0,1,0,0,0,0|1,0,2]=4 222 B11R1.17 OCCOC1=C(C=CC=C1)Br Z149303034 [0,1,0,0,0,0|2,0,1]=4 223 B11R1.17 OCCOC1=C(C=CC=C1)F Z425795714 [0,1,0,0,0,0|2,0,1]=4 224 B11R1.17 OCCOC1=C(C=CC=C1)O Z56755902 [0,1,0,0,0,0|1,0,1]=3 225 B11R1.17 OCCSC1=C(C=CC=C1)Br Z149386602 [0,1,0,0,0,0|2,0,1]=4 226 B11R1.17 OCCSC1=C(C=CC=C1)Cl Z149174540 [0,1,0,0,0,0|2,0,1]=4 227 B11R1.41 C/N=C/C1=C(C=CC=C1)OC Z239604388 [0,1,0,0,0,0|1,0,2]=4 228 B11R1.41 C=CCC1=C(C=CC=C1)C=O Z1511741429 [0,1,0,0,0,0|0,0,1]=2 229 B11R1.41 CCC1=C(C=CC=C1)CC#N Z1198263420 [0,1,0,0,0,0|2,0,1]=4 230 B11R1.41 CCC1=C(C=CC=C1)CNC Z5510186140 [0,1,0,0,0,0|2,0,1]=4 231 B11R1.41 CCCC1=C(C=CC=C1)CN Z3241253417 [0,1,0,0,0,0|1,0,2]=4 232 B11R1.41 CNCC1=C(C=CC=C1)OC Z56944118 [0,1,0,0,0,0|1,0,1]=3 233 B11R1.41 COC1=C(C=CC=C1)/C=N/O Z49568534 [0,1,0,0,0,0|2,0,1]=4 234 B11R1.41 COC1=C(C=CC=C1)CC=O Z3224150690 [0,1,0,0,0,0|1,0,0]=2 235 B11R1.41 COC1=C(C=CC=C1)CCN Z104493472 [0,1,0,0,0,0|1,0,1]=3 236 B11R1.41 COC1=C(C=CC=C1)N=C=S Z56921378 [0,1,0,0,0,0|2,0,1]=4 237 B11R1.41 COC1=C(C=CC=N1)CCO Z1504674309 [0,1,0,0,0,0|2,0,1]=4 238 B11R1.41 COC1=C(C=NC=C1)CCN Z2752229904 [0,1,0,0,0,0|2,0,1]=4 239 B11R1.41 COCC1=C(C=CC=C1)C#N Z295205402 [0,1,0,0,0,0|2,0,1]=4 240 B11R1.41 COCC1=C(C=CC=C1)C=O Z1266890219 [0,1,0,0,0,0|1,0,2]=4 241 B11R1.41 COCC1=C(C=CC=C1)CN Z240084736 [0,1,0,0,0,0|2,0,1]=4 242 B11R1.41 N#CC1=C(C=CC=C1)CCN Z1198235631 [0,1,0,0,0,0|2,0,1]=4 243 B11R1.41 N#CCC1=C(C=CC=C1)C#N Z104478592 [0,1,0,0,0,0|2,0,1]=4 244 B11R1.41 O=CC1=C(C=CC=C1)CCCl Z420006804 [0,1,0,0,0,0|1,0,2]=4 245 B11R1.81 CC1=C(C=CC(=C1)Br)CC#N Z1269226853 [0,1,0,0,0,0|2,0,1]=4 246 B11R1.81 CC1=C(C=CC(=C1)Cl)CC#N Z1198263432 [0,1,0,0,0,0|2,0,1]=4 247 B11R1.81 CC1=C(C=CC(=C1)F)CC#N Z1198164414 [0,1,0,0,0,0|2,0,1]=4 248 B11R1.81 CC1=C(C=CC(=C1)F)CCN Z959351734 [0,1,0,0,0,0|2,0,1]=4 249 B11R1.81 CC1=CC(=C(C=C1)CC=O)C Z1020787114 [0,1,0,0,0,0|2,0,0]=3 250 B11R1.81 CC1=CC(=C(C=C1)CCN)Br Z4658970056 [0,1,0,0,0,0|2,0,1]=4 251 B11R1.81 CC1=CC(=C(C=C1)CCN)C Z285143724 [0,1,0,0,0,0|2,0,1]=4 252 B11R1.81 CC1=CC(=C(C=C1)CCN)Cl Z5010254329 [0,1,0,0,0,0|2,0,1]=4 253 B11R1.81 CNCC1=C(C=C(C=C1)Br)Cl Z448247304 [0,1,0,0,0,0|2,0,1]=4 254 B11R1.81 CNCC1=C(C=C(C=C1)C)Br Z5345778789 [0,1,0,0,0,0|2,0,1]=4 255 B11R1.81 CNCC1=C(C=C(C=C1)C)C Z89283370 [0,1,0,0,0,0|2,0,1]=4 256 B11R1.81 CNCC1=C(C=C(C=C1)C)Cl Z5465034350 [0,1,0,0,0,0|2,0,1]=4 257 B11R1.81 CNCC1=C(C=C(C=C1)Cl)Br Z5214955384 [0,1,0,0,0,0|2,0,1]=4 258 B11R1.81 CNCC1=C(C=C(C=C1)Cl)Cl Z56959746 [0,1,0,0,0,0|2,0,1]=4 259 B11R1.81 CNCC1=C(C=C(C=C1)Cl)F Z385446922 [0,1,0,0,0,0|2,0,1]=4 260 B11R1.81 CNCC1=C(C=C(C=C1)F)Br Z1836652109 [0,1,0,0,0,0|2,0,1]=4 261 B11R1.81 CNCC1=C(C=C(C=C1)F)C Z4189742481 [0,1,0,0,0,0|2,0,1]=4 262 B11R1.81 CNCC1=C(C=C(C=C1)F)Cl Z138105392 [0,1,0,0,0,0|2,0,1]=4 263 B11R1.81 CNCC1=C(C=C(C=C1)F)F Z102767946 [0,1,0,0,0,0|2,0,1]=4 264 B11R1.81 COCC1=C(C=C(C=C1)Br)F Z823854350 [0,1,0,0,0,0|2,0,1]=4 265 B11R1.81 COCC1=C(C=C(C=C1)O)F Z1551937213 [0,1,0,0,0,0|2,0,1]=4 266 B11R1.81 N#CCC1=C(C=C(C=C1)Br)Cl Z1269172560 [0,1,0,0,0,0|2,0,1]=4 267 B11R1.81 N#CCC1=C(C=C(C=C1)Br)I Z1269139987 [0,1,0,0,0,0|2,0,1]=4 268 B11R1.81 N#CCC1=C(C=C(C=C1)Cl)Br Z1269120223 [0,1,0,0,0,0|2,0,1]=4 269 B11R1.81 N#CCC1=C(C=C(C=C1)Cl)Cl Z104477208 [0,1,0,0,0,0|2,0,1]=4 270 B11R1.81 N#CCC1=C(C=C(C=C1)Cl)F Z1201620925 [0,1,0,0,0,0|2,0,1]=4 271 B11R1.81 N#CCC1=C(C=C(C=C1)F)Cl Z285184576 [0,1,0,0,0,0|2,0,1]=4 272 B11R1.81 N#CCC1=C(C=C(C=C1)F)F Z963395642 [0,1,0,0,0,0|2,0,1]=4 273 B11R1.81 NC1=CC(=C(C=C1)CCO)F Z1255436579 [0,1,0,0,0,0|2,0,1]=4 274 B11R1.81 NCCC1=C(C=C(C=C1)Br)Cl Z4668045321 [0,1,0,0,0,0|2,0,1]=4 275 B11R1.81 NCCC1=C(C=C(C=C1)Br)F Z405046450 [0,1,0,0,0,0|2,0,1]=4 276 B11R1.81 NCCC1=C(C=C(C=C1)Cl)Br Z2941505410 [0,1,0,0,0,0|2,0,1]=4 277 B11R1.81 NCCC1=C(C=C(C=C1)F)Cl Z1267881686 [0,1,0,0,0,0|2,0,1]=4 278 B11R1.81 NCCC1=C(C=C(C=C1)F)F Z285143768 [0,1,0,0,0,0|2,0,1]=4 279 B11R1.81 NCCC1=C(C=C(C=C1)O)O Z1166113553 [0,1,0,0,0,0|1,0,1]=3 280 B11R1.81 NNCC1=C(C=C(C=C1)Cl)Cl Z367452298 [0,1,0,0,0,0|3,0,0]=4 281 B11R1.81 NOCC1=C(C=C(C=C1)F)Br Z1318533831 [0,1,0,0,0,0|3,0,0]=4 282 B11R1.81 O=CCC1=C(C=C(C=C1)Cl)Cl Z1183459048 [0,1,0,0,0,0|2,0,0]=3 283 B11R1.81 O=CCC1=C(C=C(C=C1)F)Cl Z1183459114 [0,1,0,0,0,0|2,0,0]=3 284 B11R1.81 O=CCC1=C(C=C(C=C1)F)F Z1020790242 [0,1,0,0,0,0|2,0,0]=3 285 B11R1.81 OCCC1=C(C=C(C=C1)F)F Z1020790240 [0,1,0,0,0,0|2,0,1]=4 286 B11R1.81 OCCC1=C(C=C(C=C1)O)O Z1513827466 [0,1,0,0,0,0|1,0,1]=3 287 B11R1.86 CC(=O)CC1=C(C=CC=C1)C Z329711570 [0,1,0,0,0,0|1,0,1]=3 288 B11R1.86 CC(=O)CC1=C(C=CC=C1)Cl Z329711556 [0,1,0,0,0,0|1,0,1]=3 289 B11R1.86 CC(=O)CC1=C(C=CC=C1)I Z1335657335 [0,1,0,0,0,0|1,0,1]=3 290 B11R1.86 CC(=O)CC1=C(C=CC=C1)O Z1198152110 [0,1,0,0,0,0|0,0,1]=2 291 B11R1.86 CC(=O)CC1=C(C=NC=C1)C Z4958080575 [0,1,0,0,0,0|2,0,1]=4 292 B11R1.86 CC(=O)CN1C=CC=CC1=O Z1881599491 [0,1,0,0,0,0|1,0,2]=4 293 B11R1.86 CC(=O)NC1=C(C=CC=C1)N Z239120544 [0,1,0,0,0,0|2,0,1]=4 294 B11R1.86 CC(=O)NC1=C(C=CC=C1)O Z57040482 [0,1,0,0,0,0|1,0,1]=3 295 B11R1.86 CC(=O)OC1=C(C=CC=C1)O Z1513803522 [0,1,0,0,0,0|1,0,1]=3 296 B11R1.86 CC(C)CC1=C(C=CC=C1)N Z1171158156 [0,1,0,0,0,0|1,0,2]=4 297 B11R1.86 CC(N)CC1=C(C=CC=C1)Br Z1416200939 [0,1,0,0,0,0|1,0,2]=4 298 B11R1.86 CC(N)CC1=C(C=CC=C1)Cl Z415728108 [0,1,0,0,0,0|1,0,2]=4 299 B11R1.86 CC1=C(C=CC=C1)CC(=N)N Z1374778803 [0,1,0,0,0,0|2,0,0]=3 300 B11R1.86 CC1=C(C=CC=C1)CC(=O)N Z52214433 [0,1,0,0,0,0|2,0,0]=3 301 B11R1.86 CC1=C(C=CC=C1)CC(=O)O Z104503424 [0,1,0,0,0,0|2,0,0]=3 302 B11R1.86 CC1=C(C=CC=C1)CC(C)N Z594038086 [0,1,0,0,0,0|1,0,2]=4 303 B11R1.86 CC1=C(C=CC=C1)NC(=S)N Z199467218 [0,1,0,0,0,0|3,0,0]=4 304 B11R1.86 CC1=C(C=CC=N1)CC(=O)O Z2050687800 [0,1,0,0,0,0|3,0,0]=4 305 B11R1.86 CC1=C(C=NC=C1)CC(=O)O Z1198264460 [0,1,0,0,0,0|3,0,0]=4 306 B11R1.86 CN(C)CC1=C(C=CC=C1)Cl Z54750062 [0,1,0,0,0,0|2,0,1]=4 307 B11R1.86 CN(C)CC1=C(C=CC=C1)N Z285162890 [0,1,0,0,0,0|2,0,1]=4 308 B11R1.86 CN(C)CC1=C(C=CC=N1)O Z56957565 [0,1,0,0,0,0|2,0,1]=4 309 B11R1.86 CS(=O)CC1=C(C=CC=C1)N Z802580910 [0,1,0,0,0,0|2,0,1]=4 310 B11R1.86 N=C(N)CC1=C(C=CC=C1)Br Z1742055055 [0,1,0,0,0,0|2,0,0]=3 311 B11R1.86 N=C(N)CC1=C(C=CC=C1)F Z1695738915 [0,1,0,0,0,0|2,0,0]=3 312 B11R1.86 NC(=O)CC1=C(C=CC=C1)Cl Z33547171 [0,1,0,0,0,0|2,0,0]=3 313 B11R1.86 NC(=O)CC1=C(C=CC=C1)F Z33546803 [0,1,0,0,0,0|2,0,0]=3 314 B11R1.86 NC(=O)CC1=C(C=CC=C1)N Z239125326 [0,1,0,0,0,0|2,0,0]=3 315 B11R1.86 NC(=O)CC1=C(C=CC=C1)O Z1255356155 [0,1,0,0,0,0|1,0,0]=2 316 B11R1.86 NC(=O)NC1=C(C=CC=C1)Br Z247615996 [0,1,0,0,0,0|3,0,0]=4 317 B11R1.86 NC(=O)NC1=C(C=CC=C1)Cl Z56754680 [0,1,0,0,0,0|3,0,0]=4 318 B11R1.86 NC(=O)NC1=C(C=CC=C1)F Z57028527 [0,1,0,0,0,0|3,0,0]=4 319 B11R1.86 NC(=S)NC1=C(C=CC=C1)F Z199467164 [0,1,0,0,0,0|3,0,0]=4 320 B11R1.86 NC1=C(C=CC=N1)CC(=O)O Z1889710265 [0,1,0,0,0,0|3,0,0]=4 321 B11R1.86 O=C(O)CC1=C(C=CC=C1)Br Z285184626 [0,1,0,0,0,0|2,0,0]=3 322 B11R1.86 O=C(O)CC1=C(C=CC=C1)Cl Z56911957 [0,1,0,0,0,0|2,0,0]=3 323 B11R1.86 O=C(O)CC1=C(C=CC=C1)F Z104495526 [0,1,0,0,0,0|2,0,0]=3 324 B11R1.86 O=C(O)CC1=C(C=CC=C1)I Z1269196288 [0,1,0,0,0,0|2,0,0]=3 325 B11R1.86 O=C(O)CC1=C(C=CC=C1)O Z608061328 [0,1,0,0,0,0|1,0,0]=2 326 B11R1.86 O=C(O)CC1=C(C=CN=C1)Cl Z2096659743 [0,1,0,0,0,0|3,0,0]=4 327 B11R1.86 O=C(O)CC1=C(C=CN=C1)O Z1255444750 [0,1,0,0,0,0|2,0,0]=3 328 B11R1.86 O=C(O)CC1=C(N=CC=C1)Br Z1269238080 [0,1,0,0,0,0|3,0,0]=4 329 B11R1.86 O=C(O)CN1C=CC=CC1=O Z57985357 [0,1,0,0,0,0|2,0,1]=4 330 B11R1.86 O=[N+]([O-])CC1=C(C=CC=C1)F Z2182028452 [0,1,0,0,0,0|3,0,0]=4 331 B11R1.86 OB(O)CC1=C(C=CC=C1)Cl Z1147227737 [0,1,0,0,0,0|3,0,0]=4 332 B11R1.86 OC1=C(C=CC=C1)OC(F)F Z381415218 [0,1,0,0,0,0|2,0,1]=4 333 B11R1.86 OC1=C(C=CC=C1)SC(F)F Z905204310 [0,1,0,0,0,0|2,0,1]=4 334 B11R1.182 C=CCN1C=C(C=CC1=O)F Z1822535570 [0,1,0,0,0,0|1,0,1]=3 335 B11R1.182 CC1=C(C=C(C=C1)Br)CC#N Z1269111419 [0,1,0,0,0,0|2,0,1]=4 336 B11R1.182 CC1=C(C=C(C=C1)F)CCN Z4751180899 [0,1,0,0,0,0|2,0,1]=4 337 B11R1.182 CC1=CC(=C(C=C1)C)CC#N Z820092518 [0,1,0,0,0,0|2,0,1]=4 338 B11R1.182 CC1=CC(=C(C=C1)C)CC=O Z993017798 [0,1,0,0,0,0|2,0,0]=3 339 B11R1.182 CC1=CC(=C(C=C1)F)CC#N Z1198173739 [0,1,0,0,0,0|2,0,1]=4 340 B11R1.182 CNCC1=C(C=CC(=C1)Br)F Z1262250889 [0,1,0,0,0,0|2,0,1]=4 341 B11R1.182 CNCC1=C(C=CC(=C1)C)C Z4243490762 [0,1,0,0,0,0|2,0,1]=4 342 B11R1.182 CNCC1=C(C=CC(=C1)Cl)Br Z4670285096 [0,1,0,0,0,0|2,0,1]=4 343 B11R1.182 CNCC1=C(C=CC(=C1)Cl)C Z4925996401 [0,1,0,0,0,0|2,0,1]=4 344 B11R1.182 CNCC1=C(C=CC(=C1)Cl)Cl Z5390405610 [0,1,0,0,0,0|2,0,1]=4 345 B11R1.182 CNCC1=C(C=CC(=C1)Cl)F Z4658970150 [0,1,0,0,0,0|2,0,1]=4 346 B11R1.182 CNCC1=C(C=CC(=C1)F)Br Z1875111390 [0,1,0,0,0,0|2,0,1]=4 347 B11R1.182 CNCC1=C(C=CC(=C1)F)C Z1878107281 [0,1,0,0,0,0|2,0,1]=4 348 B11R1.182 COCC1=C(C=CC(=C1)F)N Z2472857186 [0,1,0,0,0,0|2,0,1]=4 349 B11R1.182 COCC1=C(C=CC(=C1)N)Cl Z394691692 [0,1,0,0,0,0|2,0,1]=4 350 B11R1.182 COCC1=C(C=CC(=C1)O)N Z1262683212 [0,1,0,0,0,0|2,0,1]=4 351 B11R1.182 N#CCC1=C(C=CC(=C1)Br)Br Z1269147323 [0,1,0,0,0,0|2,0,1]=4 352 B11R1.182 N#CCC1=C(C=CC(=C1)Br)F Z285225830 [0,1,0,0,0,0|2,0,1]=4 353 B11R1.182 N#CCC1=C(C=CC(=C1)Cl)Cl Z1182702336 [0,1,0,0,0,0|2,0,1]=4 354 B11R1.182 N#CCC1=C(C=CC(=C1)Cl)N Z1255505578 [0,1,0,0,0,0|2,0,1]=4 355 B11R1.182 NCCC1=C(C=CC(=C1)Br)F Z285143732 [0,1,0,0,0,0|2,0,1]=4 356 B11R1.182 NCCC1=C(C=CC(=C1)Cl)Br Z1474026680 [0,1,0,0,0,0|2,0,1]=4 357 B11R1.182 NCCC1=C(C=CC(=C1)Cl)Cl Z1268152320 [0,1,0,0,0,0|2,0,1]=4 358 B11R1.182 NCCC1=C(C=CC(=C1)F)Br Z3681530426 [0,1,0,0,0,0|2,0,1]=4 359 B11R1.182 NCCC1=C(C=CC(=C1)F)Cl Z4668068102 [0,1,0,0,0,0|2,0,1]=4 360 B11R1.182 NCCC1=C(C=CC(=C1)F)F Z415635654 [0,1,0,0,0,0|2,0,1]=4 361 B11R1.182 NCCC1=C(C=CC(=C1)O)Br Z3376089277 [0,1,0,0,0,0|2,0,1]=4 362 B11R1.182 OCCC1=C(C=CC(=C1)Br)O Z1269218042 [0,1,0,0,0,0|1,0,1]=3 363 B11R1.222 CC(C=O)C1=C(C=CC=C1)Br Z1269159201 [0,1,0,0,0,0|2,0,0]=3 364 B11R1.222 CC(C=O)C1=C(C=CC=C1)Cl Z1222424635 [0,1,0,0,0,0|2,0,0]=3 365 B11R1.222 CC(C=O)C1=C(C=CC=C1)F Z1222424647 [0,1,0,0,0,0|2,0,0]=3 366 B11R1.222 CC1=C(C=CC=C1)C(=O)C=O Z2472857037 [0,1,0,0,0,0|2,0,1]=4 367 B11R1.222 CC1=C(C=CC=C1)C(C)C#N Z415654748 [0,1,0,0,0,0|2,0,1]=4 368 B11R1.222 CC1=C(C=CC=C1)C(C)C=O Z1222424657 [0,1,0,0,0,0|2,0,0]=3 369 B11R1.222 CC1=C(C=CC=C1)C(N)C#N Z4658101942 [0,1,0,0,0,0|2,0,1]=4 370 B11R1.222 CC1=C(C=CC=C1)C(N)CF Z3092528504 [0,1,0,0,0,0|2,0,1]=4 371 B11R1.222 CC1=C(C=CC=C1)C(N)CO Z385458414 [0,1,0,0,0,0|2,0,1]=4 372 B11R1.222 CC1=C(C=CC=C1)C(O)CN Z336086534 [0,1,0,0,0,0|2,0,1]=4 373 B11R1.222 CCC(N)C1=C(C=CC=C1)Br Z851790482 [0,1,0,0,0,0|1,0,2]=4 374 B11R1.222 CCC(N)C1=C(C=CC=C1)O Z1266854970 [0,1,0,0,0,0|0,0,2]=3 375 B11R1.222 CNC(=O)C1=C(C=CC=C1)O Z57148963 [0,1,0,0,0,0|1,0,2]=4 376 B11R1.222 CNC(C)C1=C(C=CC=C1)Br Z1497158706 [0,1,0,0,0,0|2,0,1]=4 377 B11R1.222 CNC(C)C1=C(C=CC=C1)C Z159528196 [0,1,0,0,0,0|2,0,1]=4 378 B11R1.222 CNC(C)C1=C(C=CC=C1)Cl Z138106016 [0,1,0,0,0,0|2,0,1]=4 379 B11R1.222 CNC(C)C1=C(C=CC=C1)O Z316170358 [0,1,0,0,0,0|1,0,1]=3 380 B11R1.222 COC(=O)C1=C(C=CC=C1)O Z19703590 [0,1,0,0,0,0|1,0,2]=4 381 B11R1.222 N#CC(N)C1=C(C=CC=C1)Br Z2526438961 [0,1,0,0,0,0|2,0,1]=4 382 B11R1.222 N#CC(N)C1=C(C=CC=C1)Cl Z993967186 [0,1,0,0,0,0|2,0,1]=4 383 B11R1.222 N#CC(N)C1=C(C=CC=C1)F Z1263602437 [0,1,0,0,0,0|2,0,1]=4 384 B11R1.222 NC(CF)C1=C(C=CC=C1)Br Z4444282330 [0,1,0,0,0,0|2,0,1]=4 385 B11R1.222 NC(CO)C1=C(C=CC=C1)F Z1268152413 [0,1,0,0,0,0|2,0,1]=4 386 B11R1.222 NC(CO)C1=C(C=CC=C1)I Z2941400807 [0,1,0,0,0,0|2,0,1]=4 387 B11R1.222 NCC(O)C1=C(C=CC=C1)Cl Z1255523275 [0,1,0,0,0,0|2,0,1]=4 388 B11R1.222 NNC(=O)C1=C(C=CC=C1)O Z57241860 [0,1,0,0,0,0|2,0,1]=4 389 B11R1.222 O=C(NO)C1=C(C=CC=C1)O Z57842350 [0,1,0,0,0,0|2,0,1]=4 390 B11R1.222 O=CC(=O)C1=C(C=CC=C1)Br Z1516173728 [0,1,0,0,0,0|2,0,1]=4 391 B11R1.605 CC1=C(C(=CC=C1)Cl)CC#N Z1255383050 [0,1,0,0,0,0|2,0,1]=4 392 B11R1.605 CC1=CC=CC(=C1CCO)C Z1198264906 [0,1,0,0,0,0|2,0,1]=4 393 B11R1.605 CNCC1=C(C=CC=C1C)C Z2932033934 [0,1,0,0,0,0|2,0,1]=4 394 B11R1.605 CNCC1=C(C=CC=C1Cl)Cl Z57327142 [0,1,0,0,0,0|2,0,1]=4 395 B11R1.605 CNCC1=C(C=CC=C1F)Cl Z56957511 [0,1,0,0,0,0|2,0,1]=4 396 B11R1.605 COCC1=C(C=CC=C1N)Br Z394690378 [0,1,0,0,0,0|2,0,1]=4 397 B11R1.605 COCC1=C(C=CC=C1N)Cl Z1416200943 [0,1,0,0,0,0|2,0,1]=4 398 B11R1.605 FC1=C(C(=CC=C1)Cl)CCCl Z397587568 [0,1,0,0,0,0|2,0,1]=4 399 B11R1.605 N#CCC1=C(C=CC=C1Cl)Cl Z56911945 [0,1,0,0,0,0|2,0,1]=4 400 B11R1.605 N#CCC1=C(C=CC=C1Cl)F Z57040512 [0,1,0,0,0,0|2,0,1]=4 401 B11R1.605 N#CCC1=C(C=CC=C1F)F Z1203161886 [0,1,0,0,0,0|2,0,1]=4 402 B11R1.605 NCCC1=C(C=CC=C1F)Br Z4870683590 [0,1,0,0,0,0|2,0,1]=4 403 B11R1.605 NCCC1=C(C=CC=C1F)Cl Z1431002711 [0,1,0,0,0,0|2,0,1]=4 404 B11R1.605 OCCC1=C(C=CC=C1Cl)Cl Z1183459248 [0,1,0,0,0,0|2,0,1]=4 405 B9R0.15 C=CCC(CC=C)C(=O)O Z1198157966 [0,0,1,0,0,0|1,0,2]=4 406 B11R2.10 BrC1=NC2=C(O1)C=CC=C2 Z733303132 [0,0,0,1,0,0|2,0,0]=3 407 B11R2.10 BrC1=NC2=C(S1)C=CC=C2 Z415645026 [0,0,0,1,0,0|2,1,0]=4 408 B11R2.10 CC1=CC2=C(O1)C=CC=C2 Z1255386706 [0,0,0,1,0,0|0,0,2]=3 409 B11R2.10 CC1=NC2=C(N1)C=CC=C2 Z55692894 [0,0,0,1,0,0|2,0,1]=4 410 B11R2.10 CC1=NC2=C(S1)C=CC=C2 Z2854344256 [0,0,0,1,0,0|1,1,1]=4 411 B11R2.10 CC1CC2=C(N1)C=CC=C2 Z104472410 [0,0,0,1,0,0|1,0,2]=4 412 B11R2.10 CC1CC2=C(O1)C=CC=C2 Z104378304 [0,0,0,1,0,0|0,0,2]=3 413 B11R2.10 ClC1=NC2=C(N1)C=CC=C2 Z276129254 [0,0,0,1,0,0|3,0,0]=4 414 B11R2.10 ClC1=NC2=C(O1)C=CC=C2 Z235343929 [0,0,0,1,0,0|2,0,0]=3 415 B11R2.10 NC1=NC2=C(C1)C=CC=C2 Z2692198892 [0,0,0,1,0,0|2,0,0]=3 416 B11R2.10 NC1=NC2=C(N1)C=CC=C2 Z104378302 [0,0,0,1,0,0|3,0,0]=4 417 B11R2.10 NC1=NC2=C(O1)C=CC=C2 Z57069972 [0,0,0,1,0,0|2,0,0]=3 418 B11R2.10 NC1=NC2=C(O1)C=CC=N2 Z1198313417 [0,0,0,1,0,0|3,0,0]=4 419 B11R2.10 NC1=NC2=C(O1)C=CN=C2 Z1255498597 [0,0,0,1,0,0|3,0,0]=4 420 B11R2.10 NC1=NC2=C(O1)N=CC=C2 Z1255498595 [0,0,0,1,0,0|3,0,0]=4 421 B11R2.10 NC1=NC2=C(S1)C=CC=C2 Z56912586 [0,0,0,1,0,0|2,1,0]=4 422 B11R2.10 NC1CC2=C(C1)C=CC=C2 Z1741971562 [0,0,0,1,0,0|2,0,1]=4 423 B11R2.10 O=C1CC2=C(C1)C=CC=C2 Z104486120 [0,0,0,1,0,0|2,0,0]=3 424 B11R2.10 O=C1CC2=C(N1)C=CC=C2 Z104478112 [0,0,0,1,0,0|2,0,0]=3 425 B11R2.10 O=C1CC2=C(N1)C=CC=N2 Z1198159859 [0,0,0,1,0,0|3,0,0]=4 426 B11R2.10 O=C1NC2=C(N1)C=CC=C2 Z56924489 [0,0,0,1,0,0|3,0,0]=4 427 B11R2.10 O=C1NC2=C(O1)C=CC=C2 Z56854468 [0,0,0,1,0,0|2,0,0]=3 428 B11R2.10 O=C1NC2=C(O1)C=CN=C2 Z1509173044 [0,0,0,1,0,0|3,0,0]=4 429 B11R2.10 O=C1NC2=C(S1)C=CC=C2 Z57728688 [0,0,0,1,0,0|2,1,0]=4 430 B11R2.10 S=C1SC2=C(S1)C=CC=C2 Z1198152357 [0,0,0,1,0,0|2,1,0]=4 431 B11R2.10 SC1=NC2=C(N1)C=CC=C2 Z203045044 [0,0,0,1,0,0|3,0,0]=4 432 B11R2.10 SC1=NC2=C(O1)C=CC=C2 Z104499134 [0,0,0,1,0,0|2,0,0]=3 433 B11R2.10 SC1=NC2=C(O1)C=CC=N2 Z1201620735 [0,0,0,1,0,0|3,0,0]=4 434 B11R2.10 SC1=NC2=C(S1)C=CC=C2 Z104499140 [0,0,0,1,0,0|2,1,0]=4 435 B11R2.20 C1=CC2=C(C=C1)C=CC=C2 Z104506008 [0,0,0,1,0,0|1,0,1]=3 436 B11R2.20 C1=CC2=C(C=C1)C=NC=C2 Z104472854 [0,0,0,1,0,0|2,0,1]=4 437 B11R2.20 C1=CC2=C(C=C1)CCC=C2 Z237493310 [0,0,0,1,0,0|1,0,1]=3 438 B11R2.20 C1=CC2=C(C=C1)CNCC2 Z57834231 [0,0,0,1,0,0|2,0,1]=4 439 B11R2.20 C1=CC2=C(C=C1)COCC2 Z756090080 [0,0,0,1,0,0|2,0,1]=4 440 B11R2.20 C1=CC2=C(C=C1)CONC2 Z2096086829 [0,0,0,1,0,0|3,0,0]=4 441 B11R2.20 C1=CC2=C(C=C1)N=CC=C2 Z104472852 [0,0,0,1,0,0|1,0,1]=3 442 B11R2.20 C1=CC2=C(C=C1)N=CC=N2 Z104495568 [0,0,0,1,0,0|2,0,0]=3 443 B11R2.20 C1=CC2=C(C=C1)OCCC2 Z728136016 [0,0,0,1,0,0|0,0,2]=3 444 B11R2.20 C1=CC2=C(C=C1)OCCN2 Z228584850 [0,0,0,1,0,0|1,0,2]=4 445 B11R2.20 C1=CC2=C(C=CC=N2)N=C1 Z212045452 [0,0,0,1,0,0|2,0,1]=4 446 B11R2.20 C1=CC2=C(C=CN=C2)N=C1 Z1201618481 [0,0,0,1,0,0|2,0,1]=4 447 B11R2.20 C1=CC2=C(C=NC=C2)N=C1 Z1198330965 [0,0,0,1,0,0|2,0,1]=4 448 B11R2.20 C1=CC2=C(N=C1)N=CC=C2 Z1201618482 [0,0,0,1,0,0|2,0,1]=4 449 B11R2.55 BrC1=C(C=CC=C1)C2CO2 Z278165218 [0,0,0,1,0,0|2,0,1]=4 450 B11R2.55 CC1=C(C=CC=C1)C2CO2 Z278165272 [0,0,0,1,0,0|2,0,1]=4 451 B11R2.55 ClC1=C(C=CC=C1)C2CO2 Z278165192 [0,0,0,1,0,0|2,0,1]=4 452 B11R2.55 ClC1=C(C=CC=C1)[C@@H]2CO2 Z1575341712 [0,0,0,1,0,0|2,0,1]=4 453 B11R2.55 ClC1=C(C=CC=C1)[C@H]2CO2 Z1575341825 [0,0,0,1,0,0|2,0,1]=4 454 B11R2.55 FC1=C(C=CC=C1)C2CO2 Z278165212 [0,0,0,1,0,0|2,0,1]=4 455 B11R2.55 FC1=C(C=CC=C1)[C@@H]2CO2 Z1575341650 [0,0,0,1,0,0|2,0,1]=4 456 B11R2.55 NC1=C(C=CC=C1)C2CC2 Z336079888 [0,0,0,1,0,0|1,0,2]=4 457 B11R2.106 BrC1=C2C=CNC2=CC=C1 Z1255488032 [0,0,0,1,0,0|2,0,1]=4 458 B11R2.106 BrC1=C2C=COC2=CC=C1 Z1198184786 [0,0,0,1,0,0|2,0,1]=4 459 B11R2.106 BrC1=C2CCNC2=CC=C1 Z1198172382 [0,0,0,1,0,0|2,0,1]=4 460 B11R2.106 BrC1=C2CNCC2=CC=C1 Z1715153806 [0,0,0,1,0,0|2,0,1]=4 461 B11R2.106 BrC1=C2COCC2=CC=C1 Z1504682798 [0,0,0,1,0,0|2,0,1]=4 462 B11R2.106 BrC1=C2N=CNC2=CC=C1 Z1198223652 [0,0,0,1,0,0|3,0,0]=4 463 B11R2.106 BrC1=C2N=CSC2=CC=C1 Z1269177018 [0,0,0,1,0,0|3,0,0]=4 464 B11R2.106 BrC1=C2OC=CC2=CC=C1 Z1201624951 [0,0,0,1,0,0|2,0,0]=3 465 B11R2.106 BrC1=C2OC=NC2=CC=C1 Z1198176459 [0,0,0,1,0,0|3,0,0]=4 466 B11R2.106 BrC1=C2SC=CC2=CC=C1 Z1269180460 [0,0,0,1,0,0|2,0,0]=3 467 B11R2.106 BrC1=C2SC=NC2=CC=C1 Z1269130621 [0,0,0,1,0,0|3,0,0]=4 468 B11R2.106 BrC1=CC=CC2=CNN=C12 Z1116381744 [0,0,0,1,0,0|3,0,0]=4 469 B11R2.106 CC1=C2C=CNC2=CC=C1 Z384970526 [0,0,0,1,0,0|2,0,1]=4 470 B11R2.106 CC1=C2CCNC2=CC=C1 Z916962812 [0,0,0,1,0,0|2,0,1]=4 471 B11R2.106 CC1=C2CNCC2=CC=C1 Z3244819771 [0,0,0,1,0,0|2,0,1]=4 472 B11R2.106 CC1=C2NC=CC2=CC=C1 Z1171217428 [0,0,0,1,0,0|2,0,0]=3 473 B11R2.106 CC1=C2SC=CC2=CC=C1 Z1171716174 [0,0,0,1,0,0|2,0,0]=3 474 B11R2.106 ClC1=C2C=CNC2=CC=C1 Z1203162552 [0,0,0,1,0,0|2,0,1]=4 475 B11R2.106 ClC1=C2CCNC2=CC=C1 Z1407007539 [0,0,0,1,0,0|2,0,1]=4 476 B11R2.106 ClC1=C2CNCC2=CC=C1 Z1198176551 [0,0,0,1,0,0|2,0,1]=4 477 B11R2.106 ClC1=C2N=CNC2=CC=C1 Z2787257831 [0,0,0,1,0,0|3,0,0]=4 478 B11R2.106 ClC1=C2N=CSC2=CC=C1 Z1198305220 [0,0,0,1,0,0|3,0,0]=4 479 B11R2.106 ClC1=C2SC=CC2=NC=C1 Z1198178447 [0,0,0,1,0,0|3,0,0]=4 480 B11R2.106 FC1=C2C=CNC2=CC=C1 Z1203161966 [0,0,0,1,0,0|2,0,1]=4 481 B11R2.106 FC1=C2CCNC2=CC=C1 Z1688198379 [0,0,0,1,0,0|2,0,1]=4 482 B11R2.106 FC1=C2N=CNC2=CC=C1 Z1203731926 [0,0,0,1,0,0|3,0,0]=4 483 B11R2.106 IC1=C2N=CNC2=CC=C1 Z4765819468 [0,0,0,1,0,0|3,0,0]=4 484 B11R2.106 NC1=C2C=CNC2=CC=C1 Z970344664 [0,0,0,1,0,0|2,0,1]=4 485 B11R2.106 NC1=C2C=COC2=CC=C1 Z3617770745 [0,0,0,1,0,0|2,0,1]=4 486 B11R2.106 NC1=C2C=CSC2=CC=C1 Z1198158929 [0,0,0,1,0,0|2,0,1]=4 487 B11R2.106 NC1=C2CCOC2=CC=C1 Z1198169532 [0,0,0,1,0,0|2,0,1]=4 488 B11R2.106 NC1=C2CNCC2=CC=C1 Z3234889976 [0,0,0,1,0,0|2,0,1]=4 489 B11R2.106 NC1=C2N=CNC2=CC=C1 Z1259162108 [0,0,0,1,0,0|3,0,0]=4 490 B11R2.106 NC1=C2N=COC2=CC=C1 Z1201620730 [0,0,0,1,0,0|3,0,0]=4 491 B11R2.106 NC1=C2NC=CC2=CC=C1 Z1201621605 [0,0,0,1,0,0|2,0,0]=3 492 B11R2.106 NC1=C2NN=CC2=CC=C1 Z235348069 [0,0,0,1,0,0|3,0,0]=4 493 B11R2.106 NC1=C2OC=CC2=CC=C1 Z3244747114 [0,0,0,1,0,0|2,0,0]=3 494 B11R2.106 NC1=C2SC=CC2=CC=C1 Z1511495074 [0,0,0,1,0,0|2,0,0]=3 495 B11R2.106 NC1=C2SN=CC2=CC=C1 Z1198157385 [0,0,0,1,0,0|3,0,0]=4 496 B11R2.106 NC1=CC=CN2C1=NC=C2 Z3235023303 [0,0,0,1,0,0|3,0,0]=4 497 B11R2.106 O=C1C=CNC2=C1SC=C2 Z1948933786 [0,0,0,1,0,0|2,0,1]=4 498 B11R2.106 O=C1NC=CC2=C1NC=C2 Z1065582766 [0,0,0,1,0,0|2,0,1]=4 499 B11R2.106 O=C1NC=CC2=C1SC=C2 Z1216812547 [0,0,0,1,0,0|2,0,1]=4 500 B11R2.106 OC1=C2C=CNC2=CC=C1 Z1203730747 [0,0,0,1,0,0|1,0,1]=3 501 B11R2.106 OC1=C2C=CNC2=NC=C1 Z1198176784 [0,0,0,1,0,0|2,0,1]=4 502 B11R2.106 OC1=C2C=CSC2=CC=C1 Z1198157413 [0,0,0,1,0,0|1,0,1]=3 503 B11R2.106 OC1=C2C=NNC2=CC=C1 Z596251856 [0,0,0,1,0,0|2,0,1]=4 504 B11R2.106 OC1=C2CCCC2=CC=C1 Z1198149277 [0,0,0,1,0,0|0,0,2]=3 505 B11R2.106 OC1=C2CCNC2=CC=C1 Z1715153863 [0,0,0,1,0,0|1,0,1]=3 506 B11R2.106 OC1=C2CCNC2=CC=N1 Z3033557931 [0,0,0,1,0,0|2,0,1]=4 507 B11R2.106 OC1=C2CCOC2=CC=C1 Z1198181637 [0,0,0,1,0,0|1,0,1]=3 508 B11R2.106 OC1=C2CNCC2=CC=C1 Z1198279842 [0,0,0,1,0,0|1,0,1]=3 509 B11R2.106 OC1=C2CNCC2=NC=C1 Z4511420933 [0,0,0,1,0,0|2,0,1]=4 510 B11R2.106 OC1=C2N=CNC2=CC=C1 Z1198155823 [0,0,0,1,0,0|2,0,0]=3 511 B11R2.106 OC1=C2N=COC2=CC=C1 Z1198170499 [0,0,0,1,0,0|2,0,0]=3 512 B11R2.106 OC1=C2NC=CC2=NC=C1 Z1255400430 [0,0,0,1,0,0|2,0,0]=3 513 B11R2.106 OC1=C2NC=NC2=CC=N1 Z2692093689 [0,0,0,1,0,0|3,0,0]=4 514 B11R2.106 OC1=C2NN=NC2=CC=C1 Z1198168465 [0,0,0,1,0,0|3,0,0]=4 515 B11R2.106 OC1=C2OC=NC2=CC=C1 Z1255385602 [0,0,0,1,0,0|2,0,0]=3 516 B11R2.106 OC1=C2OCCC2=CC=C1 Z1486027488 [0,0,0,1,0,0|1,0,2]=4 517 B11R2.106 OC1=C2OCOC2=CC=C1 Z409065236 [0,0,0,1,0,0|2,0,1]=4 518 B11R2.106 OC1=C2ON=CC2=CC=C1 Z1198182558 [0,0,0,1,0,0|2,0,0]=3 519 B11R2.106 OC1=C2SC=CC2=CN=N1 Z3039311070 [0,0,0,1,0,0|3,0,0]=4 520 B11R2.106 OC1=CC=CC2=CNN=C12 Z1262398563 [0,0,0,1,0,0|2,0,0]=3 521 B11R2.106 OC1=CC=CC2=NC=NN12 Z1504687202 [0,0,0,1,0,0|3,0,0]=4 522 B11R2.106 OC1=CC=CN2C1=CC=N2 Z1198155673 [0,0,0,1,0,0|2,0,1]=4 523 B11R2.106 OC1=CC=CN2C1=NC=C2 Z1201623531 [0,0,0,1,0,0|2,0,0]=3 524 B11R2.988 NCC1CC2=C1C=CC=C2 Z234895091 [0,0,0,1,0,0|2,0,1]=4 525 B9R1.33 C=CC[N+]1=C(SC=C1)N Z56788824 [0,0,0,0,1,0|3,0,0]=4 526 B9R1.33 CC1=C(SC=C1)CC=O Z1250885386 [0,0,0,0,1,0|3,0,0]=4 527 B8R1.2 C=CC1=CC=CC=C1 Z104474664 [2,0,0,0,0,0|0,0,0]=2 528 B8R1.2 C=CC1=NC=CC=C1 Z104495554 [2,0,0,0,0,0|1,0,0]=3 529 B8R1.2 CCC1=CC=CC=C1 Z104473632 [2,0,0,0,0,0|0,0,1]=3 530 B8R1.2 CCC1=CC=NC=C1 Z1251171246 [2,0,0,0,0,0|1,0,1]=4 531 B8R1.2 CCC1=CN=CC=C1 Z104476778 [2,0,0,0,0,0|1,0,1]=4 532 B8R1.2 CCC1=NC=CC=C1 Z113558650 [2,0,0,0,0,0|1,0,1]=4 533 B8R1.2 CNC1=CC=CC=C1 Z104472478 [2,0,0,0,0,0|1,0,1]=4 534 B8R1.2 COC1=CC=CC=C1 Z53833865 [2,0,0,0,0,0|1,0,1]=4 535 B8R1.2 Cl[Se]C1=CC=CC=C1 Z1255485131 [2,0,0,0,0,0|2,0,0]=4 536 B8R1.2 N#CC1=CC=CC=C1 Z104473628 [2,0,0,0,0,0|1,0,1]=4 537 B8R1.2 NCC1=CC=CC=C1 Z54748260 [2,0,0,0,0,0|1,0,0]=3 538 B8R1.2 NCC1=CC=NC=C1 Z104474354 [2,0,0,0,0,0|2,0,0]=4 539 B8R1.2 NCC1=CN=CC=C1 Z104474366 [2,0,0,0,0,0|2,0,0]=4 540 B8R1.2 NCC1=NC=CC=C1 Z104474352 [2,0,0,0,0,0|2,0,0]=4 541 B8R1.2 NNC1=CC=CC=C1 Z104472442 [2,0,0,0,0,0|2,0,0]=4 542 B8R1.2 O=CC1=CC=NC=C1 Z57161993 [2,0,0,0,0,0|2,0,0]=4 543 B8R1.2 O=CC1=CN=CC=C1 Z104472124 [2,0,0,0,0,0|2,0,0]=4 544 B8R1.2 O=CC1=NC=CC=C1 Z104472152 [2,0,0,0,0,0|2,0,0]=4 545 B8R1.2 OCC1=CC=CC=C1 Z104476418 [2,0,0,0,0,0|1,0,0]=3 546 B8R1.2 OCC1=CC=NC=C1 Z335244866 [2,0,0,0,0,0|2,0,0]=4 547 B8R1.2 OCC1=CN=CC=C1 Z104495622 [2,0,0,0,0,0|2,0,0]=4 548 B8R1.2 OCC1=NC=CC=C1 Z57921252 [2,0,0,0,0,0|2,0,0]=4 549 B8R1.5 CC1=C(C=CC=C1)C Z212053190 [2,0,0,0,0,0|1,0,0]=3 550 B8R1.5 CC1=C(C=CC=C1)F Z104474026 [2,0,0,0,0,0|1,0,0]=3 551 B8R1.5 CC1=C(C=CC=C1)N Z57127943 [2,0,0,0,0,0|1,0,0]=3 552 B8R1.5 CC1=C(C=CC=C1)O Z104473822 [2,0,0,0,0,0|0,0,0]=2 553 B8R1.5 CC1=C(C=CC=N1)I Z1269190410 [2,0,0,0,0,0|2,0,0]=4 554 B8R1.5 CC1=C(C=CN=C1)Br Z1201621264 [2,0,0,0,0,0|2,0,0]=4 555 B8R1.5 CC1=C(C=NC=C1)Br Z1255379175 [2,0,0,0,0,0|2,0,0]=4 556 B8R1.5 CC1=C(C=NC=C1)N Z625801040 [2,0,0,0,0,0|2,0,0]=4 557 B8R1.5 CC1=C(N=CC=C1)Br Z968908232 [2,0,0,0,0,0|2,0,0]=4 558 B8R1.5 CC1=C(N=CC=C1)C Z104472816 [2,0,0,0,0,0|2,0,0]=4 559 B8R1.5 CC1=C(N=CC=C1)N Z203045034 [2,0,0,0,0,0|2,0,0]=4 560 B8R1.5 CC1=C(N=CC=C1)S Z968907338 [2,0,0,0,0,0|1,1,0]=4 561 B8R1.5 CC1=C(N=CC=N1)O Z1198157257 [2,0,0,0,0,0|2,0,0]=4 562 B8R1.5 CC1=CC=CNC1=O Z1013766914 [2,0,0,0,0,0|1,0,1]=4 563 B8R1.5 CC1=CNC=CC1=N Z1263529539 [2,0,0,0,0,0|2,0,0]=4 564 B8R1.5 CC1=[N+](C=CC=C1)C Z56791140 [2,0,0,0,0,0|2,0,0]=4 565 B8R1.5 CC1=[N+](C=CC=C1)N Z57931449 [2,0,0,0,0,0|2,0,0]=4 566 B8R1.5 CN1C=CC=CC1=S Z56928900 [2,0,0,0,0,0|1,1,0]=4 567 B8R1.5 C[N+]1=C(C=CC=C1)Br Z56756330 [2,0,0,0,0,0|2,0,0]=4 568 B8R1.5 C[N+]1=C(C=CC=C1)Cl Z104501460 [2,0,0,0,0,0|2,0,0]=4 569 B8R1.5 C[N+]1=C(C=CC=C1)N Z56872249 [2,0,0,0,0,0|2,0,0]=4 570 B8R1.5 ClC1=C(C=CC=C1)Cl Z104473644 [2,0,0,0,0,0|2,0,0]=4 571 B8R1.5 FC1=C(C=CC=C1)Br Z756953644 [2,0,0,0,0,0|2,0,0]=4 572 B8R1.5 FC1=C(C=CC=C1)F Z104473256 [2,0,0,0,0,0|2,0,0]=4 573 B8R1.5 NC1=C(C=CC=C1)Br Z104472512 [2,0,0,0,0,0|2,0,0]=4 574 B8R1.5 NC1=C(C=CC=C1)F Z104474198 [2,0,0,0,0,0|2,0,0]=4 575 B8R1.5 NC1=C(C=CC=C1)I Z104472778 [2,0,0,0,0,0|2,0,0]=4 576 B8R1.5 NC1=C(C=CC=C1)N Z104472742 [2,0,0,0,0,0|2,0,0]=4 577 B8R1.5 NC1=C(C=CC=C1)O Z57127952 [2,0,0,0,0,0|1,0,0]=3 578 B8R1.5 NC1=C(C=CC=N1)O Z104495292 [2,0,0,0,0,0|2,0,0]=4 579 B8R1.5 NC1=C(C=CN=C1)O Z370653926 [2,0,0,0,0,0|2,0,0]=4 580 B8R1.5 NC1=C(C=NC=C1)O Z1664348606 [2,0,0,0,0,0|2,0,0]=4 581 B8R1.5 NC1=C(N=CC=C1)O Z969560564 [2,0,0,0,0,0|2,0,0]=4 582 B8R1.5 O=C1C=CC=CN1O Z1198152560 [2,0,0,0,0,0|2,0,0]=4 583 B8R1.5 O=C1C=COC=C1O Z1198235068 [2,0,0,0,0,0|2,0,0]=4 584 B8R1.5 O=C1NC=CC=C1O Z104495360 [2,0,0,0,0,0|2,0,0]=4 585 B8R1.5 O=C1OC=CC=C1O Z1198156687 [2,0,0,0,0,0|2,0,0]=4 586 B8R1.5 OC1=C(C=CC=C1)Br Z56347198 [2,0,0,0,0,0|1,0,0]=3 587 B8R1.5 OC1=C(C=CC=C1)Cl Z104473270 [2,0,0,0,0,0|1,0,0]=3 588 B8R1.5 OC1=C(C=CC=C1)I Z384970702 [2,0,0,0,0,0|1,0,0]=3 589 B8R1.5 OC1=C(C=CC=C1)O Z104473810 [2,0,0,0,0,0|1,0,0]=3 590 B8R1.5 OC1=C(C=CC=N1)F Z850327726 [2,0,0,0,0,0|2,0,0]=4 591 B8R1.5 OC1=C(N=CC=C1)F Z1198164106 [2,0,0,0,0,0|2,0,0]=4 592 B10R1.1 CC1=CC=C(C=C1)CC#N Z285131444 [1,1,0,0,0,0|1,0,1]=4 593 B10R1.1 CC1=CC=C(C=C1)CC=O Z993017610 [1,1,0,0,0,0|1,0,0]=3 594 B10R1.1 CC1=CC=C(C=C1)CCN Z1268153218 [1,1,0,0,0,0|1,0,1]=4 595 B10R1.1 CC1=CC=C(C=C1)CCO Z397587076 [1,1,0,0,0,0|1,0,1]=4 596 B10R1.1 CCCC1=CC=C(C=C1)Br Z299596168 [1,1,0,0,0,0|0,0,2]=4 597 B10R1.1 CCCC1=CC=C(C=C1)N Z104492166 [1,1,0,0,0,0|0,0,2]=4 598 B10R1.1 CNCC1=CC=C(C=C1)Br Z56175269 [1,1,0,0,0,0|1,0,1]=4 599 B10R1.1 CNCC1=CC=C(C=C1)C Z56944115 [1,1,0,0,0,0|1,0,1]=4 600 B10R1.1 CNCC1=CC=C(C=C1)Cl Z56956070 [1,1,0,0,0,0|1,0,1]=4 601 B10R1.1 CNCC1=CC=C(C=C1)F Z56963340 [1,1,0,0,0,0|1,0,1]=4 602 B10R1.1 CNCC1=CC=C(C=C1)I Z4242747560 [1,1,0,0,0,0|1,0,1]=4 603 B10R1.1 COCC1=CC=C(C=C1)N Z240084568 [1,1,0,0,0,0|1,0,1]=4 604 B10R1.1 CSCC1=CC=C(C=C1)Br Z19854469 [1,1,0,0,0,0|1,0,1]=4 605 B10R1.1 CSCC1=CC=C(C=C1)N Z732207336 [1,1,0,0,0,0|1,0,1]=4 606 B10R1.1 N#CCC1=CC=C(C=C1)F Z89283961 [1,1,0,0,0,0|1,0,1]=4 607 B10R1.1 N#CCC1=CC=C(C=C1)N Z90122117 [1,1,0,0,0,0|1,0,1]=4 608 B10R1.1 N#CCC1=CC=C(C=C1)O Z90120144 [1,1,0,0,0,0|1,0,1]=4 609 B10R1.1 NC1=CC=C(C=C1)CCO Z276600190 [1,1,0,0,0,0|1,0,1]=4 610 B10R1.1 NCCC1=CC=C(C=C1)Br Z285143750 [1,1,0,0,0,0|1,0,1]=4 611 B10R1.1 NCCC1=CC=C(C=C1)Cl Z57051065 [1,1,0,0,0,0|1,0,1]=4 612 B10R1.1 NCCC1=CC=C(C=C1)F Z90122126 [1,1,0,0,0,0|1,0,1]=4 613 B10R1.1 NCCC1=CC=C(C=C1)I Z2515133713 [1,1,0,0,0,0|1,0,1]=4 614 B10R1.1 NCCC1=CC=C(C=C1)O Z744729058 [1,1,0,0,0,0|1,0,1]=4 615 B10R1.1 NOCC1=CC=C(C=C1)Cl Z1198164677 [1,1,0,0,0,0|2,0,0]=4 616 B10R1.1 O=CCC1=CC=C(C=C1)Br Z1079442512 [1,1,0,0,0,0|1,0,0]=3 617 B10R1.1 O=CCC1=CC=C(C=C1)Cl Z993017718 [1,1,0,0,0,0|1,0,0]=3 618 B10R1.1 O=CCC1=CC=C(C=C1)F Z993017752 [1,1,0,0,0,0|1,0,0]=3 619 B10R1.1 O=CNC1=CC=C(C=C1)O Z87002541 [1,1,0,0,0,0|2,0,0]=4 620 B10R1.1 OCCC1=CC=C(C=C1)Br Z397587340 [1,1,0,0,0,0|1,0,1]=4 621 B10R1.1 OCCC1=CC=C(C=C1)F Z397587326 [1,1,0,0,0,0|1,0,1]=4 622 B10R1.1 OCCC1=CC=C(C=C1)O Z1250886919 [1,1,0,0,0,0|1,0,1]=4 623 B10R1.10 C=COC1=CC=CC(=C1)C Z1269547004 [1,1,0,0,0,0|1,0,0]=3 624 B10R1.10 CC1=CC(=CC=C1)CC#N Z285131450 [1,1,0,0,0,0|1,0,1]=4 625 B10R1.10 CC1=CC(=CC=C1)CCN Z241056516 [1,1,0,0,0,0|1,0,1]=4 626 B10R1.10 CCCC1=CC(=CC=C1)Br Z1541586975 [1,1,0,0,0,0|0,0,2]=4 627 B10R1.10 CNCC1=CC(=CC=C1)C Z102766992 [1,1,0,0,0,0|1,0,1]=4 628 B10R1.10 CNCC1=CC(=CC=C1)Cl Z56963343 [1,1,0,0,0,0|1,0,1]=4 629 B10R1.10 CNCC1=CC(=CC=C1)F Z56946085 [1,1,0,0,0,0|1,0,1]=4 630 B10R1.10 CNCC1=CC(=CC=C1)I Z3302798080 [1,1,0,0,0,0|1,0,1]=4 631 B10R1.10 CNCC1=CC(=CC=C1)O Z102766970 [1,1,0,0,0,0|1,0,1]=4 632 B10R1.10 COCC1=CC(=CC=C1)N Z285163816 [1,1,0,0,0,0|1,0,1]=4 633 B10R1.10 COCC1=CC(=CC=C1)O Z821093526 [1,1,0,0,0,0|1,0,1]=4 634 B10R1.10 CSCC1=CC(=CC=C1)Br Z17129082 [1,1,0,0,0,0|1,0,1]=4 635 B10R1.10 CSCC1=CC(=CC=C1)N Z732207152 [1,1,0,0,0,0|1,0,1]=4 636 B10R1.10 N#CCC1=CC=CC(=C1)Cl Z57039594 [1,1,0,0,0,0|1,0,1]=4 637 B10R1.10 N#CCC1=CC=CC(=C1)F Z104477994 [1,1,0,0,0,0|1,0,1]=4 638 B10R1.10 N#CCC1=CC=CC(=C1)N Z90120426 [1,1,0,0,0,0|1,0,1]=4 639 B10R1.10 N#CCC1=CC=CC(=C1)O Z1198161712 [1,1,0,0,0,0|1,0,1]=4 640 B10R1.10 NC1=CC(=CC=C1)CCO Z1198160776 [1,1,0,0,0,0|1,0,1]=4 641 B10R1.10 NC1=CC(=CC=C1)NC=O Z1203578959 [1,1,0,0,0,0|2,0,0]=4 642 B10R1.10 NCCC1=CC(=CC=C1)Br Z285143760 [1,1,0,0,0,0|1,0,1]=4 643 B10R1.10 NCCC1=CC(=CC=C1)Cl Z57051063 [1,1,0,0,0,0|1,0,1]=4 644 B10R1.10 NCCC1=CC(=CC=C1)F Z96092963 [1,1,0,0,0,0|1,0,1]=4 645 B10R1.10 NCCC1=CC(=CC=C1)I Z4874662549 [1,1,0,0,0,0|1,0,1]=4 646 B10R1.10 NCCC1=CC(=CC=C1)O Z935140764 [1,1,0,0,0,0|1,0,1]=4 647 B10R1.10 NOCC1=CC(=CC=C1)Cl Z1198339567 [1,1,0,0,0,0|2,0,0]=4 648 B10R1.10 O=CCC1=CC=CC(=C1)Br Z1079442816 [1,1,0,0,0,0|1,0,0]=3 649 B10R1.10 O=CCC1=CC=CC(=C1)Cl Z993017836 [1,1,0,0,0,0|1,0,0]=3 650 B10R1.10 O=CNC1=CC=CC(=C1)O Z56886391 [1,1,0,0,0,0|2,0,0]=4 651 B10R1.10 OCCC1=CC(=CC=C1)Cl Z992289382 [1,1,0,0,0,0|1,0,1]=4 652 B10R1.10 OCCC1=CC(=CC=C1)F Z397587224 [1,1,0,0,0,0|1,0,1]=4 653 B10R1.15 C=CC(O)C1=CC=CC=C1 Z1255438717 [1,1,0,0,0,0|0,0,0]=2 654 B10R1.15 CC(C=O)C1=CC=CC=C1 Z104495674 [1,1,0,0,0,0|1,0,0]=3 655 B10R1.15 CC(CBr)C1=CC=CC=C1 Z756118300 [1,1,0,0,0,0|1,0,1]=4 656 B10R1.15 CCC(N)C1=CC=CC=C1 Z1262252904 [1,1,0,0,0,0|0,0,2]=4 657 B10R1.15 CCC(O)C1=CC=CC=C1 Z335245178 [1,1,0,0,0,0|0,0,2]=4 658 B10R1.15 CNC(C)C1=CC=CC=C1 Z85917524 [1,1,0,0,0,0|1,0,1]=4 659 B10R1.15 C[C@H](CN)C1=CC=CC=C1 Z1203578128 [1,1,0,0,0,0|1,0,1]=4 660 B10R1.15 N#CC(Br)C1=CC=CC=C1 Z1198157485 [1,1,0,0,0,0|1,0,1]=4 661 B10R1.15 NC(CO)C1=CC=CC=C1 Z381674942 [1,1,0,0,0,0|1,0,1]=4 662 B10R1.15 NCC(N)C1=CC=CC=C1 Z425861034 [1,1,0,0,0,0|1,0,1]=4 663 B10R1.15 NCC(O)C1=CC=CC=C1 Z104476088 [1,1,0,0,0,0|1,0,1]=4 664 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 Z1201618614 [1,1,0,0,0,0|1,0,1]=4 665 B10R1.15 N[C@H](CO)C1=CC=CC=C1 Z1101444224 [1,1,0,0,0,0|1,0,1]=4 666 B10R1.15 O=CC(=O)C1=CC=CC=C1 Z1954804411 [1,1,0,0,0,0|1,0,1]=4 667 B10R1.17 BrCCOC1=CC=CC=C1 Z56950513 [1,1,0,0,0,0|1,0,1]=4 668 B10R1.17 CCCCC1=CC=CC=C1 Z104492496 [1,1,0,0,0,0|0,0,2]=4 669 B10R1.17 CCNCC1=CC=CC=C1 Z57327176 [1,1,0,0,0,0|0,0,2]=4 670 B10R1.17 CNCCC1=CC=CC=C1 Z445226260 [1,1,0,0,0,0|0,0,2]=4 671 B10R1.17 COCCC1=CC=CC=C1 Z104494216 [1,1,0,0,0,0|0,0,2]=4 672 B10R1.17 N#CCCC1=CC=CC=C1 Z104507980 [1,1,0,0,0,0|0,0,2]=4 673 B10R1.17 N#CCNC1=CC=CC=C1 Z56347332 [1,1,0,0,0,0|1,0,1]=4 674 B10R1.17 N#CCOC1=CC=CC=C1 Z53792061 [1,1,0,0,0,0|1,0,1]=4 675 B10R1.17 N#CCSC1=CC=CC=C1 Z19751391 [1,1,0,0,0,0|1,0,1]=4 676 B10R1.17 NC/C=C/C1=CC=CC=C1 Z2953771905 [1,1,0,0,0,0|0,0,2]=4 677 B10R1.17 NCCCC1=CC=CC=C1 Z104478312 [1,1,0,0,0,0|0,0,2]=4 678 B10R1.17 NCCOC1=CC=CC=C1 Z355423232 [1,1,0,0,0,0|1,0,1]=4 679 B10R1.17 NCCSC1=CC=CC=C1 Z57970213 [1,1,0,0,0,0|1,0,1]=4 680 B10R1.17 NNCCC1=CC=CC=C1 Z927192062 [1,1,0,0,0,0|1,0,1]=4 681 B10R1.17 O=C/C=C/C1=CC=CC=C1 Z3219847383 [1,1,0,0,0,0|0,0,1]=3 682 B10R1.17 O=C/C=C/C1=CC=NC=C1 Z2417822722 [1,1,0,0,0,0|1,0,1]=4 683 B10R1.17 O=C/C=C/C1=NC=CC=C1 Z1255366309 [1,1,0,0,0,0|1,0,1]=4 684 B10R1.17 O=CC#CC1=CC=CC=C1 Z1255485337 [1,1,0,0,0,0|0,0,2]=4 685 B10R1.17 O=CCCC1=CC=CC=C1 Z87002472 [1,1,0,0,0,0|0,0,1]=3 686 B10R1.17 O=CCCC1=CC=NC=C1 Z1070006438 [1,1,0,0,0,0|1,0,1]=4 687 B10R1.17 O=CCCC1=CN=CC=C1 Z1198276578 [1,1,0,0,0,0|1,0,1]=4 688 B10R1.17 O=CCCC1=NC=CC=C1 Z1079158816 [1,1,0,0,0,0|1,0,1]=4 689 B10R1.17 O=CCOC1=CC=CC=C1 Z854102570 [1,1,0,0,0,0|1,0,0]=3 690 B10R1.17 O=CCOC1=NC=CC=C1 Z1255434510 [1,1,0,0,0,0|2,0,0]=4 691 B10R1.17 O=CNCC1=CC=CC=C1 Z1203730748 [1,1,0,0,0,0|1,0,0]=3 692 B10R1.17 O=CNNC1=CC=CC=C1 Z1198148433 [1,1,0,0,0,0|2,0,0]=4 693 B10R1.17 OC/C=C/C1=CC=CC=C1 Z104473562 [1,1,0,0,0,0|0,0,2]=4 694 B10R1.17 OCCCC1=CC=CC=C1 Z104476660 [1,1,0,0,0,0|0,0,2]=4 695 B10R1.17 OCCOC1=CC=CC=C1 Z104473570 [1,1,0,0,0,0|1,0,1]=4 696 B10R1.17 OCCSC1=CC=CC=C1 Z149157348 [1,1,0,0,0,0|1,0,1]=4 697 B10R1.17 S=C=NCC1=CC=CC=C1 Z56869309 [1,1,0,0,0,0|1,0,1]=4 698 B10R1.18 CC(=O)CC1=CC=NC=C1 Z992409812 [1,1,0,0,0,0|1,0,1]=4 699 B10R1.18 CC(=O)NC1=CC=CC=C1 Z27782600 [1,1,0,0,0,0|1,0,1]=4 700 B10R1.18 CC(C)CC1=CC=CC=C1 Z104486386 [1,1,0,0,0,0|0,0,2]=4 701 B10R1.18 CC(O)CC1=CC=CC=C1 Z513749298 [1,1,0,0,0,0|0,0,2]=4 702 B10R1.18 N=C(N)CC1=CC=CC=C1 Z600428462 [1,1,0,0,0,0|1,0,0]=3 703 B10R1.18 N=C(N)CC1=CC=NC=C1 Z2441004470 [1,1,0,0,0,0|2,0,0]=4 704 B10R1.18 N=C(N)CC1=CN=CC=C1 Z2350941593 [1,1,0,0,0,0|2,0,0]=4 705 B10R1.18 NC(=O)CC1=CC=CC=C1 Z33546508 [1,1,0,0,0,0|1,0,0]=3 706 B10R1.18 NC(=O)CC1=CC=NC=C1 Z234895093 [1,1,0,0,0,0|2,0,0]=4 707 B10R1.18 NC(=O)OC1=CC=CC=C1 Z33547080 [1,1,0,0,0,0|2,0,0]=4 708 B10R1.18 NC(=S)CC1=CC=CC=C1 Z56928578 [1,1,0,0,0,0|1,0,0]=3 709 B10R1.18 NC(=S)NC1=CC=CC=C1 Z57474172 [1,1,0,0,0,0|2,0,0]=4 710 B10R1.18 O=C(O)CC1=CC=NC=C1 Z271099418 [1,1,0,0,0,0|2,0,0]=4 711 B10R1.18 O=C(O)CC1=CN=CC=C1 Z285131558 [1,1,0,0,0,0|2,0,0]=4 712 B10R1.18 O=S(O)CC1=CC=CC=C1 Z3211806022 [1,1,0,0,0,0|2,0,0]=4 713 B10R1.18 O=[N+]([O-])CC1=CC=CC=C1 Z995236210 [1,1,0,0,0,0|2,0,0]=4 714 B10R1.18 OB(O)CC1=CC=CC=C1 Z1147227831 [1,1,0,0,0,0|2,0,0]=4 715 B10R1.2 CC1=C(C(=CC=C1)C=O)Br Z1255464769 [1,1,0,0,0,0|2,0,0]=4 716 B10R1.2 CC1=C(C(=CC=C1)C=O)C Z147641438 [1,1,0,0,0,0|2,0,0]=4 717 B10R1.2 CC1=C(C(=CC=C1)C=O)F Z1255387503 [1,1,0,0,0,0|2,0,0]=4 718 B10R1.2 CC1=C(C(=CC=C1)C=O)N Z1203582628 [1,1,0,0,0,0|2,0,0]=4 719 B10R1.2 CC1=C(C(=CC=C1)C=O)O Z406682006 [1,1,0,0,0,0|1,0,0]=3 720 B10R1.2 CC1=C(C(=CC=C1)CN)Br Z1269115079 [1,1,0,0,0,0|2,0,0]=4 721 B10R1.2 CC1=C(C(=CC=C1)CN)N Z4703758409 [1,1,0,0,0,0|2,0,0]=4 722 B10R1.2 CC1=C(C(=CC=C1)CN)O Z2568737629 [1,1,0,0,0,0|1,0,0]=3 723 B10R1.2 CC1=C(C(=CC=C1)CO)Br Z1269244302 [1,1,0,0,0,0|2,0,0]=4 724 B10R1.2 CC1=C(C(=CC=C1)CO)I Z1269243400 [1,1,0,0,0,0|2,0,0]=4 725 B10R1.2 CC1=C(C=CC=C1Br)C=O Z1255373549 [1,1,0,0,0,0|2,0,0]=4 726 B10R1.2 CC1=C(C=CC=C1Br)CO Z1263881346 [1,1,0,0,0,0|2,0,0]=4 727 B10R1.2 CC1=C(C=CC=C1Cl)C=O Z1198308873 [1,1,0,0,0,0|2,0,0]=4 728 B10R1.2 CC1=C(C=CC=C1Cl)CN Z1198307715 [1,1,0,0,0,0|2,0,0]=4 729 B10R1.2 CC1=C(C=CC=C1Cl)CO Z1198223504 [1,1,0,0,0,0|2,0,0]=4 730 B10R1.2 CC1=C(C=CC=C1F)C=O Z1255402882 [1,1,0,0,0,0|2,0,0]=4 731 B10R1.2 CC1=C(C=CC=C1F)CN Z1198307705 [1,1,0,0,0,0|2,0,0]=4 732 B10R1.2 CC1=C(C=CC=C1I)CO Z1269226759 [1,1,0,0,0,0|2,0,0]=4 733 B10R1.2 CC1=C(C=CC=C1N)CO Z425792776 [1,1,0,0,0,0|2,0,0]=4 734 B10R1.2 CC1=C(C=CC=C1O)CN Z4452492342 [1,1,0,0,0,0|2,0,0]=4 735 B10R1.2 CCC1=C(C(=CC=C1)C)N Z104472756 [1,1,0,0,0,0|1,0,1]=4 736 B10R1.2 CCC1=C(C(=CC=C1)F)Br Z2631039917 [1,1,0,0,0,0|1,0,1]=4 737 B10R1.2 CCC1=C(C(=CC=C1)F)N Z4658051452 [1,1,0,0,0,0|1,0,1]=4 738 B10R1.2 CCC1=C(C(=CC=C1)N)O Z2895200771 [1,1,0,0,0,0|0,0,1]=3 739 B10R1.2 CCC1=C(C(=CC=C1)O)C Z1255437459 [1,1,0,0,0,0|1,0,1]=4 740 B10R1.2 CCC1=C(C(=O)C=CO1)O Z1255465165 [1,1,0,0,0,0|1,0,1]=4 741 B10R1.2 COC1=C(C(=CC=C1)Br)O Z1269110250 [1,1,0,0,0,0|1,0,1]=4 742 B10R1.2 COC1=C(C(=CC=C1)F)O Z850124378 [1,1,0,0,0,0|1,0,1]=4 743 B10R1.2 COC1=C(C(=CC=C1)N)O Z1623872003 [1,1,0,0,0,0|1,0,1]=4 744 B10R1.2 N#CC1=CC=CC(=C1O)N Z1203579159 [1,1,0,0,0,0|1,0,1]=4 745 B10R1.2 NC1=C(C(=CC=C1)CO)Cl Z1255363918 [1,1,0,0,0,0|2,0,0]=4 746 B10R1.2 NC1=C(C=CC=C1Cl)C=O Z1255404490 [1,1,0,0,0,0|2,0,0]=4 747 B10R1.2 NC1=C(C=CC=C1F)C=O Z1203586128 [1,1,0,0,0,0|2,0,0]=4 748 B10R1.2 NC1=C(C=CC=C1F)CO Z1203653641 [1,1,0,0,0,0|2,0,0]=4 749 B10R1.2 NCC1=C(C(=CC=C1)Br)F Z1269181418 [1,1,0,0,0,0|2,0,0]=4 750 B10R1.2 NCC1=C(C(=CC=C1)Br)O Z1869802506 [1,1,0,0,0,0|1,0,0]=3 751 B10R1.2 NCC1=C(C(=CC=C1)Cl)Br Z5376599035 [1,1,0,0,0,0|2,0,0]=4 752 B10R1.2 NCC1=C(C(=CC=C1)Cl)O Z2935017011 [1,1,0,0,0,0|1,0,0]=3 753 B10R1.2 NCC1=C(C(=CC=C1)F)Br Z1269109049 [1,1,0,0,0,0|2,0,0]=4 754 B10R1.2 NCC1=C(C(=CC=C1)F)O Z2753740771 [1,1,0,0,0,0|1,0,0]=3 755 B10R1.2 NCC1=C(C(=CC=C1)O)F Z2755008804 [1,1,0,0,0,0|2,0,0]=4 756 B10R1.2 NCC1=C(C(=CC=C1)O)O Z2755766575 [1,1,0,0,0,0|1,0,0]=3 757 B10R1.2 NCC1=C(C(=CC=N1)O)O Z4613630127 [1,1,0,0,0,0|2,0,0]=4 758 B10R1.2 O=C1C=COC(=C1O)CO Z1513596409 [1,1,0,0,0,0|2,0,0]=4 759 B10R1.2 O=CC1=C(C(=CC=C1)Br)Cl Z1269190527 [1,1,0,0,0,0|2,0,0]=4 760 B10R1.2 O=CC1=C(C(=CC=C1)Br)F Z1205757906 [1,1,0,0,0,0|2,0,0]=4 761 B10R1.2 O=CC1=C(C(=CC=C1)Br)O Z354084788 [1,1,0,0,0,0|1,0,0]=3 762 B10R1.2 O=CC1=C(C(=CC=C1)Cl)F Z1203161792 [1,1,0,0,0,0|2,0,0]=4 763 B10R1.2 O=CC1=C(C(=CC=C1)Cl)O Z406682010 [1,1,0,0,0,0|1,0,0]=3 764 B10R1.2 O=CC1=C(C(=CC=C1)F)O Z406682008 [1,1,0,0,0,0|1,0,0]=3 765 B10R1.2 O=CC1=CC=CC(=C1Br)Br Z1269211860 [1,1,0,0,0,0|2,0,0]=4 766 B10R1.2 O=CC1=CC=CC(=C1Br)Cl Z1269133465 [1,1,0,0,0,0|2,0,0]=4 767 B10R1.2 O=CC1=CC=CC(=C1Br)F Z1269200334 [1,1,0,0,0,0|2,0,0]=4 768 B10R1.2 O=CC1=CC=CC(=C1Br)O Z1269217079 [1,1,0,0,0,0|2,0,0]=4 769 B10R1.2 O=CC1=CC=CC(=C1Cl)Cl Z104474602 [1,1,0,0,0,0|2,0,0]=4 770 B10R1.2 O=CC1=CC=CC(=C1Cl)F Z1198174775 [1,1,0,0,0,0|2,0,0]=4 771 B10R1.2 O=CC1=CC=CC(=C1Cl)O Z1255489787 [1,1,0,0,0,0|2,0,0]=4 772 B10R1.2 O=CC1=CC=CC(=C1F)F Z1079442742 [1,1,0,0,0,0|2,0,0]=4 773 B10R1.2 O=CC1=CC=CC(=C1F)O Z1198313363 [1,1,0,0,0,0|2,0,0]=4 774 B10R1.2 O=CC1=CC=CC(=C1I)F Z1269167420 [1,1,0,0,0,0|2,0,0]=4 775 B10R1.2 O=CC1=CC=CC(=C1O)O Z56899185 [1,1,0,0,0,0|1,0,0]=3 776 B10R1.2 OCC1=C(C(=CC=C1)Br)Br Z1269160611 [1,1,0,0,0,0|2,0,0]=4 777 B10R1.2 OCC1=C(C(=CC=C1)Br)Cl Z1269113383 [1,1,0,0,0,0|2,0,0]=4 778 B10R1.2 OCC1=C(C(=CC=C1)Cl)Br Z1269125525 [1,1,0,0,0,0|2,0,0]=4 779 B10R1.2 OCC1=C(C(=CC=C1)F)Br Z1269199218 [1,1,0,0,0,0|2,0,0]=4 780 B10R1.2 OCC1=C(C(=CC=C1)F)Cl Z1198306358 [1,1,0,0,0,0|2,0,0]=4 781 B10R1.2 OCC1=C(C(=CC=C1)F)I Z1269109517 [1,1,0,0,0,0|2,0,0]=4 782 B10R1.20 C#CC1=C(C=CC=C1)C=O Z1255373145 [1,1,0,0,0,0|2,0,0]=4 783 B10R1.20 C=CC1=C(C=CC=N1)C=O Z1198169175 [1,1,0,0,0,0|1,0,1]=4 784 B10R1.20 CCC1=C(C=CC=C1)C#N Z979777106 [1,1,0,0,0,0|1,0,1]=4 785 B10R1.20 CCC1=C(C=CC=C1)C=O Z979776466 [1,1,0,0,0,0|0,0,2]=4 786 B10R1.20 CCC1=C(C=CC=C1)CN Z979776472 [1,1,0,0,0,0|1,0,1]=4 787 B10R1.20 CCC1=C(C=CC=C1)NC Z335279298 [1,1,0,0,0,0|1,0,1]=4 788 B10R1.20 CNC1=C(C=CC=C1)C=O Z1203730947 [1,1,0,0,0,0|2,0,0]=4 789 B10R1.20 CNC1=C(C=CC=C1)CN Z4928209572 [1,1,0,0,0,0|2,0,0]=4 790 B10R1.20 COC1=C(C=CC=C1)C#N Z51119297 [1,1,0,0,0,0|1,0,1]=4 791 B10R1.20 COC1=C(C=CC=C1)C=O Z53833342 [1,1,0,0,0,0|1,0,0]=3 792 B10R1.20 COC1=C(C=CC=C1)CN Z57102476 [1,1,0,0,0,0|1,0,0]=3 793 B10R1.20 COC1=C(C=CC=C1)CO Z104479146 [1,1,0,0,0,0|1,0,0]=3 794 B10R1.20 COC1=C(C=CC=C1)OC Z53833941 [1,1,0,0,0,0|1,0,1]=4 795 B10R1.20 COC1=C(C=CC=N1)C=O Z1079442776 [1,1,0,0,0,0|2,0,0]=4 796 B10R1.20 COC1=C(C=CC=N1)CO Z800297974 [1,1,0,0,0,0|2,0,0]=4 797 B10R1.20 COC1=C(C=CN=C1)CN Z1973465553 [1,1,0,0,0,0|2,0,0]=4 798 B10R1.20 COC1=C(C=NC=C1)CO Z1198311138 [1,1,0,0,0,0|2,0,0]=4 799 B10R1.20 COC1=C(N=CC=C1)C=O Z1198165843 [1,1,0,0,0,0|2,0,0]=4 800 B10R1.20 CSC1=C(C=CC=C1)CN Z4617552846 [1,1,0,0,0,0|1,1,0]=4 801 B10R1.20 CSC1=C(C=CC=C1)CO Z1157829842 [1,1,0,0,0,0|1,0,1]=4 802 B10R1.20 N#CC1=C(C=CC=C1)C=O Z147641756 [1,1,0,0,0,0|2,0,0]=4 803 B10R1.20 N#CC1=C(C=CC=C1)CCl Z56757680 [1,1,0,0,0,0|2,0,0]=4 804 B10R1.20 NCC1=C(C=CC=C1)CO Z336080860 [1,1,0,0,0,0|1,0,0]=3 805 B10R1.20 O=CC1=C(C=CC=C1)C=O Z104494958 [1,1,0,0,0,0|1,0,1]=4 806 B10R1.20 O=CC1=C(C=CC=C1)CO Z1216844620 [1,1,0,0,0,0|1,0,0]=3 807 B10R1.25 C=CC1=C(N=C(C=C1)Cl)Cl Z1255390099 [1,1,0,0,0,0|2,0,0]=4 808 B10R1.25 CC1=C(C=CC(=C1)Br)C=O Z1079442722 [1,1,0,0,0,0|2,0,0]=4 809 B10R1.25 CC1=C(C=CC(=C1)Br)CN Z1266854915 [1,1,0,0,0,0|2,0,0]=4 810 B10R1.25 CC1=C(C=CC(=C1)Br)CO Z444299166 [1,1,0,0,0,0|2,0,0]=4 811 B10R1.25 CC1=C(C=CC(=C1)Cl)C=O Z1201621733 [1,1,0,0,0,0|2,0,0]=4 812 B10R1.25 CC1=C(C=CC(=C1)Cl)CN Z4862693322 [1,1,0,0,0,0|2,0,0]=4 813 B10R1.25 CC1=C(C=CC(=C1)F)C=O Z853084730 [1,1,0,0,0,0|2,0,0]=4 814 B10R1.25 CC1=C(C=CC(=C1)F)CN Z4450359823 [1,1,0,0,0,0|2,0,0]=4 815 B10R1.25 CC1=C(C=CC(=C1)F)CO Z959356974 [1,1,0,0,0,0|2,0,0]=4 816 B10R1.25 CC1=C(C=CC(=C1)N)CN Z2574928353 [1,1,0,0,0,0|2,0,0]=4 817 B10R1.25 CC1=C(C=CC(=C1)O)C=O Z1161074806 [1,1,0,0,0,0|2,0,0]=4 818 B10R1.25 CC1=CC(=C(C=C1)C=O)Br Z1255427913 [1,1,0,0,0,0|2,0,0]=4 819 B10R1.25 CC1=CC(=C(C=C1)C=O)C Z104479608 [1,1,0,0,0,0|2,0,0]=4 820 B10R1.25 CC1=CC(=C(C=C1)C=O)Cl Z1198280103 [1,1,0,0,0,0|2,0,0]=4 821 B10R1.25 CC1=CC(=C(C=C1)C=O)F Z732814038 [1,1,0,0,0,0|2,0,0]=4 822 B10R1.25 CC1=CC(=C(C=C1)C=O)N Z1198276968 [1,1,0,0,0,0|2,0,0]=4 823 B10R1.25 CC1=CC(=C(C=C1)C=O)O Z1203159482 [1,1,0,0,0,0|1,0,0]=3 824 B10R1.25 CC1=CC(=C(C=C1)CN)C Z239626330 [1,1,0,0,0,0|2,0,0]=4 825 B10R1.25 CC1=CC(=C(C=C1)CN)F Z3071128846 [1,1,0,0,0,0|2,0,0]=4 826 B10R1.25 CC1=CC(=C(C=C1)CN)N Z5524803288 [1,1,0,0,0,0|2,0,0]=4 827 B10R1.25 CC1=CC(=C(C=C1)CN)O Z4525848236 [1,1,0,0,0,0|1,0,0]=3 828 B10R1.25 CC1=CC(=C(C=C1)CO)C Z335244716 [1,1,0,0,0,0|2,0,0]=4 829 B10R1.25 CC1=CC(=C(C=C1)CO)Cl Z1255382519 [1,1,0,0,0,0|2,0,0]=4 830 B10R1.25 CC1=CC(=C(C=C1)CO)N Z1198176996 [1,1,0,0,0,0|2,0,0]=4 831 B10R1.25 CCC1=C(C=C(C=C1)Br)Cl Z1551924119 [1,1,0,0,0,0|1,0,1]=4 832 B10R1.25 CCC1=C(C=C(C=C1)C)O Z1198181015 [1,1,0,0,0,0|0,0,1]=3 833 B10R1.25 CCC1=C(C=C(C=C1)Cl)Cl Z1862006036 [1,1,0,0,0,0|1,0,1]=4 834 B10R1.25 CCC1=C(C=C(C=C1)F)N Z4670692131 [1,1,0,0,0,0|1,0,1]=4 835 B10R1.25 CCC1=C(C=C(C=C1)N)F Z1203583183 [1,1,0,0,0,0|1,0,1]=4 836 B10R1.25 CCC1=C(C=C(C=C1)N)I Z4120967362 [1,1,0,0,0,0|1,0,1]=4 837 B10R1.25 CCC1=C(C=C(C=C1)O)O Z104499414 [1,1,0,0,0,0|0,0,1]=3 838 B10R1.25 COC1=C(C=C(C=C1)N)O Z104494830 [1,1,0,0,0,0|1,0,1]=4 839 B10R1.25 ClCC1=C(C=C(C=C1)Cl)Cl Z57834457 [1,1,0,0,0,0|2,0,0]=4 840 B10R1.25 N#CC1=C(C=C(C=C1)Cl)O Z1082858088 [1,1,0,0,0,0|1,0,1]=4 841 B10R1.25 N#CC1=C(C=C(C=C1)O)O Z1255361029 [1,1,0,0,0,0|1,0,1]=4 842 B10R1.25 NC1=C(C=CC(=C1)Br)CO Z1269175206 [1,1,0,0,0,0|2,0,0]=4 843 B10R1.25 NC1=C(C=CC(=C1)Cl)CO Z955147660 [1,1,0,0,0,0|2,0,0]=4 844 B10R1.25 NC1=C(C=CC(=C1)F)CO Z1198159868 [1,1,0,0,0,0|2,0,0]=4 845 B10R1.25 NC1=CC(=C(C=C1)C=O)Cl Z1206884716 [1,1,0,0,0,0|2,0,0]=4 846 B10R1.25 NCC1=C(C=C(C=C1)Br)Br Z3244847417 [1,1,0,0,0,0|2,0,0]=4 847 B10R1.25 NCC1=C(C=C(C=C1)Br)Cl Z448247302 [1,1,0,0,0,0|2,0,0]=4 848 B10R1.25 NCC1=C(C=C(C=C1)Br)F Z1266933858 [1,1,0,0,0,0|2,0,0]=4 849 B10R1.25 NCC1=C(C=C(C=C1)Br)O Z1269160590 [1,1,0,0,0,0|1,0,0]=3 850 B10R1.25 NCC1=C(C=C(C=C1)Cl)Br Z2787455611 [1,1,0,0,0,0|2,0,0]=4 851 B10R1.25 NCC1=C(C=C(C=C1)Cl)Cl Z316170412 [1,1,0,0,0,0|2,0,0]=4 852 B10R1.25 NCC1=C(C=C(C=C1)Cl)F Z2238931004 [1,1,0,0,0,0|2,0,0]=4 853 B10R1.25 NCC1=C(C=C(C=C1)Cl)I Z1889706351 [1,1,0,0,0,0|2,0,0]=4 854 B10R1.25 NCC1=C(C=C(C=C1)F)Br Z2238930616 [1,1,0,0,0,0|2,0,0]=4 855 B10R1.25 NCC1=C(C=C(C=C1)F)F Z239626462 [1,1,0,0,0,0|2,0,0]=4 856 B10R1.25 NCC1=C(C=C(C=C1)I)Cl Z1973465512 [1,1,0,0,0,0|2,0,0]=4 857 B10R1.25 NCC1=C(C=C(C=C1)N)F Z5197774367 [1,1,0,0,0,0|2,0,0]=4 858 B10R1.25 NCC1=C(C=C(C=C1)N)O Z3034846582 [1,1,0,0,0,0|1,0,0]=3 859 B10R1.25 NCC1=C(C=C(C=C1)O)F Z3244923137 [1,1,0,0,0,0|2,0,0]=4 860 B10R1.25 NCC1=C(C=C(C=C1)O)O Z2350903951 [1,1,0,0,0,0|1,0,0]=3 861 B10R1.25 O=CC1=C(C=C(C=C1)Br)Br Z1269133882 [1,1,0,0,0,0|2,0,0]=4 862 B10R1.25 O=CC1=C(C=C(C=C1)Br)Cl Z1079442724 [1,1,0,0,0,0|2,0,0]=4 863 B10R1.25 O=CC1=C(C=C(C=C1)Br)F Z104486154 [1,1,0,0,0,0|2,0,0]=4 864 B10R1.25 O=CC1=C(C=C(C=C1)Br)I Z1269178376 [1,1,0,0,0,0|2,0,0]=4 865 B10R1.25 O=CC1=C(C=C(C=C1)Br)O Z405051414 [1,1,0,0,0,0|1,0,0]=3 866 B10R1.25 O=CC1=C(C=C(C=C1)Cl)Br Z1269165294 [1,1,0,0,0,0|2,0,0]=4 867 B10R1.25 O=CC1=C(C=C(C=C1)Cl)Cl Z57127525 [1,1,0,0,0,0|2,0,0]=4 868 B10R1.25 O=CC1=C(C=C(C=C1)Cl)F Z1079442614 [1,1,0,0,0,0|2,0,0]=4 869 B10R1.25 O=CC1=C(C=C(C=C1)Cl)O Z1201623478 [1,1,0,0,0,0|1,0,0]=3 870 B10R1.25 O=CC1=C(C=C(C=C1)F)Br Z1079442442 [1,1,0,0,0,0|2,0,0]=4 871 B10R1.25 O=CC1=C(C=C(C=C1)F)Cl Z1079442562 [1,1,0,0,0,0|2,0,0]=4 872 B10R1.25 O=CC1=C(C=C(C=C1)F)F Z104495222 [1,1,0,0,0,0|2,0,0]=4 873 B10R1.25 O=CC1=C(C=C(C=C1)F)I Z1269211883 [1,1,0,0,0,0|2,0,0]=4 874 B10R1.25 O=CC1=C(C=C(C=C1)F)O Z1201622454 [1,1,0,0,0,0|1,0,0]=3 875 B10R1.25 O=CC1=C(C=C(C=C1)I)Cl Z1269135461 [1,1,0,0,0,0|2,0,0]=4 876 B10R1.25 O=CC1=C(C=C(C=C1)O)Br Z622749802 [1,1,0,0,0,0|2,0,0]=4 877 B10R1.25 O=CC1=C(C=C(C=C1)O)Cl Z1255419357 [1,1,0,0,0,0|2,0,0]=4 878 B10R1.25 O=CC1=C(C=C(C=C1)O)F Z1201623850 [1,1,0,0,0,0|2,0,0]=4 879 B10R1.25 O=CC1=C(C=C(C=C1)O)O Z104497974 [1,1,0,0,0,0|1,0,0]=3 880 B10R1.25 O=CC1=C(C=C(C=N1)Br)O Z1269226619 [1,1,0,0,0,0|2,0,0]=4 881 B10R1.25 OCC1=C(C=C(C=C1)Br)Br Z1269234186 [1,1,0,0,0,0|2,0,0]=4 882 B10R1.25 OCC1=C(C=C(C=C1)Br)Cl Z448248274 [1,1,0,0,0,0|2,0,0]=4 883 B10R1.25 OCC1=C(C=C(C=C1)Br)I Z1269215229 [1,1,0,0,0,0|2,0,0]=4 884 B10R1.25 OCC1=C(C=C(C=C1)Cl)Br Z1269183118 [1,1,0,0,0,0|2,0,0]=4 885 B10R1.25 OCC1=C(C=C(C=C1)Cl)Cl Z111479786 [1,1,0,0,0,0|2,0,0]=4 886 B10R1.25 OCC1=C(C=C(C=C1)Cl)I Z1269244634 [1,1,0,0,0,0|2,0,0]=4 887 B10R1.25 OCC1=C(C=C(C=C1)F)Br Z397587428 [1,1,0,0,0,0|2,0,0]=4 888 B10R1.25 OCC1=C(C=C(C=C1)F)I Z1269118341 [1,1,0,0,0,0|2,0,0]=4 889 B10R1.25 OCC1=C(C=C(C=C1)I)Cl Z1269140641 [1,1,0,0,0,0|2,0,0]=4 890 B10R1.30 C=CC1=C(N=CC(=C1)Cl)F Z1618169063 [1,1,0,0,0,0|2,0,0]=4 891 B10R1.30 CC1=C(C=C(C=C1)Br)C=O Z871801782 [1,1,0,0,0,0|2,0,0]=4 892 B10R1.30 CC1=C(C=C(C=C1)Br)CO Z1259109160 [1,1,0,0,0,0|2,0,0]=4 893 B10R1.30 CC1=C(C=C(C=C1)Cl)C=O Z871801780 [1,1,0,0,0,0|2,0,0]=4 894 B10R1.30 CC1=C(C=C(C=C1)Cl)CN Z1741963038 [1,1,0,0,0,0|2,0,0]=4 895 B10R1.30 CC1=C(C=C(C=C1)F)C=O Z1080470282 [1,1,0,0,0,0|2,0,0]=4 896 B10R1.30 CC1=C(C=C(C=C1)N)CN Z2574928294 [1,1,0,0,0,0|2,0,0]=4 897 B10R1.30 CC1=C(C=C(C=C1)N)CO Z1203578809 [1,1,0,0,0,0|2,0,0]=4 898 B10R1.30 CC1=C(C=C(C=C1)O)CN Z2672012535 [1,1,0,0,0,0|2,0,0]=4 899 B10R1.30 CC1=CC(=C(C=C1)Br)C=O Z871833034 [1,1,0,0,0,0|2,0,0]=4 900 B10R1.30 CC1=CC(=C(C=C1)Br)CO Z1269153193 [1,1,0,0,0,0|2,0,0]=4 901 B10R1.30 CC1=CC(=C(C=C1)C)C=O Z104479610 [1,1,0,0,0,0|2,0,0]=4 902 B10R1.30 CC1=CC(=C(C=C1)Cl)C=O Z871801784 [1,1,0,0,0,0|2,0,0]=4 903 B10R1.30 CC1=CC(=C(C=C1)Cl)CN Z3244814492 [1,1,0,0,0,0|2,0,0]=4 904 B10R1.30 CC1=CC(=C(C=C1)F)C=O Z732814056 [1,1,0,0,0,0|2,0,0]=4 905 B10R1.30 CC1=CC(=C(C=C1)F)CN Z3013900167 [1,1,0,0,0,0|2,0,0]=4 906 B10R1.30 CC1=CC(=C(C=C1)F)CO Z992343034 [1,1,0,0,0,0|2,0,0]=4 907 B10R1.30 CC1=CC(=C(C=C1)I)CO Z1269210139 [1,1,0,0,0,0|2,0,0]=4 908 B10R1.30 CC1=CC(=C(C=C1)N)CO Z1203578305 [1,1,0,0,0,0|2,0,0]=4 909 B10R1.30 CC1=CC(=C(C=C1)O)C=O Z274774390 [1,1,0,0,0,0|1,0,0]=3 910 B10R1.30 CC1=NC(=C(C=C1)O)C=O Z1104852896 [1,1,0,0,0,0|2,0,0]=4 911 B10R1.30 CC1=NC(=C(C=C1)O)CN Z3476873846 [1,1,0,0,0,0|2,0,0]=4 912 B10R1.30 CC1=NC(=C(C=C1)O)CO Z1104852895 [1,1,0,0,0,0|2,0,0]=4 913 B10R1.30 CCC1=C(C=CC(=C1)Br)C Z1813137877 [1,1,0,0,0,0|1,0,1]=4 914 B10R1.30 CCC1=C(C=CC(=C1)Br)O Z1269214466 [1,1,0,0,0,0|0,0,1]=3 915 B10R1.30 CCC1=C(C=CC(=C1)F)N Z4449286205 [1,1,0,0,0,0|1,0,1]=4 916 B10R1.30 CCC1=C(C=CC(=C1)I)Br Z1269132508 [1,1,0,0,0,0|1,0,1]=4 917 B10R1.30 CCC1=C(C=CC(=C1)O)O Z1255360449 [1,1,0,0,0,0|0,0,1]=3 918 B10R1.30 CCC1=C(C=CC(=N1)C)O Z1741975119 [1,1,0,0,0,0|1,0,1]=4 919 B10R1.30 COC1=C(C=CC(=C1)N)O Z3244869289 [1,1,0,0,0,0|1,0,1]=4 920 B10R1.30 N#CC1=C(C=CC(=C1)Br)O Z1203161758 [1,1,0,0,0,0|1,0,1]=4 921 B10R1.30 NC1=C(C=C(C=C1)Br)C=O Z1269131915 [1,1,0,0,0,0|2,0,0]=4 922 B10R1.30 NC1=C(C=C(C=C1)Br)CO Z1269160989 [1,1,0,0,0,0|2,0,0]=4 923 B10R1.30 NC1=C(C=C(C=C1)F)CO Z424770278 [1,1,0,0,0,0|2,0,0]=4 924 B10R1.30 NC1=CC(=C(C=C1)Cl)CO Z394691946 [1,1,0,0,0,0|2,0,0]=4 925 B10R1.30 NCC1=C(C=CC(=C1)Br)Cl Z2865657278 [1,1,0,0,0,0|2,0,0]=4 926 B10R1.30 NCC1=C(C=CC(=C1)Br)F Z1741959521 [1,1,0,0,0,0|2,0,0]=4 927 B10R1.30 NCC1=C(C=CC(=C1)Br)N Z3241270951 [1,1,0,0,0,0|2,0,0]=4 928 B10R1.30 NCC1=C(C=CC(=C1)Br)O Z57102487 [1,1,0,0,0,0|1,0,0]=3 929 B10R1.30 NCC1=C(C=CC(=C1)Cl)I Z2489397007 [1,1,0,0,0,0|2,0,0]=4 930 B10R1.30 NCC1=C(C=CC(=C1)Cl)O Z594413668 [1,1,0,0,0,0|1,0,0]=3 931 B10R1.30 NCC1=C(C=CC(=C1)F)Br Z600428612 [1,1,0,0,0,0|2,0,0]=4 932 B10R1.30 NCC1=C(C=CC(=C1)F)F Z316096938 [1,1,0,0,0,0|2,0,0]=4 933 B10R1.30 NCC1=C(C=CC(=C1)N)F Z1198167770 [1,1,0,0,0,0|2,0,0]=4 934 B10R1.30 NCC1=C(C=CC(=C1)N)O Z2786366737 [1,1,0,0,0,0|1,0,0]=3 935 B10R1.30 NCC1=C(C=CC(=C1)O)Cl Z2768234857 [1,1,0,0,0,0|2,0,0]=4 936 B10R1.30 NCC1=C(C=CC(=C1)O)F Z4502872788 [1,1,0,0,0,0|2,0,0]=4 937 B10R1.30 NCC1=C(C=CC(=C1)O)O Z2757657768 [1,1,0,0,0,0|1,0,0]=3 938 B10R1.30 NCC1=C(N=CC(=C1)Br)O Z3401075126 [1,1,0,0,0,0|2,0,0]=4 939 B10R1.30 O=CC1=C(C=CC(=C1)Br)Br Z385370000 [1,1,0,0,0,0|2,0,0]=4 940 B10R1.30 O=CC1=C(C=CC(=C1)Br)Cl Z871801788 [1,1,0,0,0,0|2,0,0]=4 941 B10R1.30 O=CC1=C(C=CC(=C1)Br)F Z104482596 [1,1,0,0,0,0|2,0,0]=4 942 B10R1.30 O=CC1=C(C=CC(=C1)Br)I Z1269213434 [1,1,0,0,0,0|2,0,0]=4 943 B10R1.30 O=CC1=C(C=CC(=C1)Br)O Z57313901 [1,1,0,0,0,0|1,0,0]=3 944 B10R1.30 O=CC1=C(C=CC(=C1)Cl)Br Z871833038 [1,1,0,0,0,0|2,0,0]=4 945 B10R1.30 O=CC1=C(C=CC(=C1)Cl)Cl Z871801786 [1,1,0,0,0,0|2,0,0]=4 946 B10R1.30 O=CC1=C(C=CC(=C1)Cl)F Z819785594 [1,1,0,0,0,0|2,0,0]=4 947 B10R1.30 O=CC1=C(C=CC(=C1)Cl)I Z1269163931 [1,1,0,0,0,0|2,0,0]=4 948 B10R1.30 O=CC1=C(C=CC(=C1)Cl)O Z57772439 [1,1,0,0,0,0|1,0,0]=3 949 B10R1.30 O=CC1=C(C=CC(=C1)F)Br Z1079442476 [1,1,0,0,0,0|2,0,0]=4 950 B10R1.30 O=CC1=C(C=CC(=C1)F)Cl Z1201622451 [1,1,0,0,0,0|2,0,0]=4 951 B10R1.30 O=CC1=C(C=CC(=C1)F)F Z385369882 [1,1,0,0,0,0|2,0,0]=4 952 B10R1.30 O=CC1=C(C=CC(=C1)F)O Z415638796 [1,1,0,0,0,0|1,0,0]=3 953 B10R1.30 O=CC1=C(C=CC(=C1)I)Br Z1269223795 [1,1,0,0,0,0|2,0,0]=4 954 B10R1.30 O=CC1=C(C=CC(=C1)I)Cl Z1269146293 [1,1,0,0,0,0|2,0,0]=4 955 B10R1.30 O=CC1=C(C=CC(=C1)O)Br Z1269171271 [1,1,0,0,0,0|2,0,0]=4 956 B10R1.30 O=CC1=C(C=CC(=C1)O)Cl Z1198174868 [1,1,0,0,0,0|2,0,0]=4 957 B10R1.30 O=CC1=C(C=CC(=C1)O)O Z586251264 [1,1,0,0,0,0|1,0,0]=3 958 B10R1.30 O=CC1=C(C=NC(=C1)Cl)O Z1255357850 [1,1,0,0,0,0|2,0,0]=4 959 B10R1.30 O=CC1=C(N=CC(=C1)Br)O Z1269150338 [1,1,0,0,0,0|2,0,0]=4 960 B10R1.30 OCC1=C(C=CC(=C1)Br)Cl Z415730034 [1,1,0,0,0,0|2,0,0]=4 961 B10R1.30 OCC1=C(C=CC(=C1)Br)F Z228585288 [1,1,0,0,0,0|2,0,0]=4 962 B10R1.30 OCC1=C(C=CC(=C1)Br)I Z1269238357 [1,1,0,0,0,0|2,0,0]=4 963 B10R1.30 OCC1=C(C=CC(=C1)Br)O Z56969308 [1,1,0,0,0,0|1,0,0]=3 964 B10R1.30 OCC1=C(C=CC(=C1)Cl)Cl Z397587502 [1,1,0,0,0,0|2,0,0]=4 965 B10R1.30 OCC1=C(C=CC(=C1)Cl)I Z1269213471 [1,1,0,0,0,0|2,0,0]=4 966 B10R1.30 OCC1=C(C=CC(=C1)I)Br Z1269159494 [1,1,0,0,0,0|2,0,0]=4 967 B10R1.30 OCC1=C(C=CC(=C1)I)Cl Z1269167258 [1,1,0,0,0,0|2,0,0]=4 968 B10R1.30 OCC1=C(C=CC(=C1)O)Cl Z1198184474 [1,1,0,0,0,0|2,0,0]=4 969 B10R1.61 C=C(C)C1=C(C=CC=C1)Br Z1238836250 [1,1,0,0,0,0|1,0,0]=3 970 B10R1.61 CC(=O)C1=C(C=CC=C1)Br Z219997444 [1,1,0,0,0,0|1,0,1]=4 971 B10R1.61 CC(=O)C1=C(C=CC=C1)Cl Z104473116 [1,1,0,0,0,0|1,0,1]=4 972 B10R1.61 CC(=O)C1=C(C=CC=C1)F Z104475574 [1,1,0,0,0,0|1,0,1]=4 973 B10R1.61 CC(=O)C1=C(C=CC=C1)I Z1080378952 [1,1,0,0,0,0|1,0,1]=4 974 B10R1.61 CC(=O)C1=C(C=CC=C1)O Z57101014 [1,1,0,0,0,0|0,0,1]=3 975 B10R1.61 CC(=O)C1=C(C=CC=N1)O Z1198175942 [1,1,0,0,0,0|1,0,1]=4 976 B10R1.61 CC(=O)C1=C(C=NC=C1)O Z1255445560 [1,1,0,0,0,0|1,0,1]=4 977 B10R1.61 CC(C)C1=C(C=CC=C1)Br Z1201618204 [1,1,0,0,0,0|1,0,1]=4 978 B10R1.61 CC(C)C1=C(C=CC=C1)N Z104475672 [1,1,0,0,0,0|1,0,1]=4 979 B10R1.61 CC(C)C1=C(C=CC=C1)O Z104485440 [1,1,0,0,0,0|0,0,1]=3 980 B10R1.61 CC(C)C1=C(C=CN=C1)O Z1255421924 [1,1,0,0,0,0|1,0,1]=4 981 B10R1.61 CC(N)C1=C(C=CC=C1)F Z56347426 [1,1,0,0,0,0|1,0,1]=4 982 B10R1.61 CC(N)C1=C(C=CC=C1)O Z234895795 [1,1,0,0,0,0|0,0,1]=3 983 B10R1.61 CC(N)C1=C(C=CN=C1)O Z4515690259 [1,1,0,0,0,0|1,0,1]=4 984 B10R1.61 CC(O)C1=C(C=CC=C1)Cl Z335244972 [1,1,0,0,0,0|1,0,1]=4 985 B10R1.61 CC(O)C1=C(C=CC=C1)N Z734526976 [1,1,0,0,0,0|1,0,1]=4 986 B10R1.61 CC1=C(C=CC=C1)C(=N)N Z1483957011 [1,1,0,0,0,0|2,0,0]=4 987 B10R1.61 CC1=C(C=CC=C1)C(=O)O Z104495626 [1,1,0,0,0,0|2,0,0]=4 988 B10R1.61 CC1=C(C=CC=C1)C(=S)N Z57046956 [1,1,0,0,0,0|2,0,0]=4 989 B10R1.61 CC1=C(C=CC=C1)C(C)O Z335245068 [1,1,0,0,0,0|1,0,1]=4 990 B10R1.61 CC1=C(C=CC=C1)[C@@H](C)O Z360055768 [1,1,0,0,0,0|1,0,1]=4 991 B10R1.61 CN(C)C1=C(C=CC=C1)O Z2681253687 [1,1,0,0,0,0|1,0,1]=4 992 B10R1.61 C[C@@H](N)C1=C(C=CC=C1)Br Z1696289917 [1,1,0,0,0,0|1,0,1]=4 993 B10R1.61 C[C@@H](N)C1=C(C=CC=C1)Cl Z360055184 [1,1,0,0,0,0|1,0,1]=4 994 B10R1.61 C[C@@H](O)C1=C(C=CC=C1)Br Z1127664407 [1,1,0,0,0,0|1,0,1]=4 995 B10R1.61 C[C@@H](O)C1=C(C=CC=C1)Cl Z360055178 [1,1,0,0,0,0|1,0,1]=4 996 B10R1.61 C[C@H](N)C1=C(C=CC=C1)Br Z1696289881 [1,1,0,0,0,0|1,0,1]=4 997 B10R1.61 C[C@H](O)C1=C(C=CC=C1)Br Z1127664292 [1,1,0,0,0,0|1,0,1]=4 998 B10R1.61 C[C@H](O)C1=C(C=CC=C1)Cl Z360055172 [1,1,0,0,0,0|1,0,1]=4 999 B10R1.61 N=C(N)C1=C(C=CC=C1)Br Z1266823189 [1,1,0,0,0,0|2,0,0]=4 1000 B10R1.61 N=C(N)C1=C(C=CC=C1)Cl Z1695669929 [1,1,0,0,0,0|2,0,0]=4 1001 B10R1.61 N=C(N)C1=C(C=CC=C1)F Z2442104317 [1,1,0,0,0,0|2,0,0]=4 1002 B10R1.61 N=C(N)C1=C(C=CC=C1)N Z199055442 [1,1,0,0,0,0|2,0,0]=4 1003 B10R1.61 N=C(N)C1=C(C=CC=C1)O Z1431002716 [1,1,0,0,0,0|1,0,0]=3 1004 B10R1.61 NC(=O)C1=C(C=CC=C1)Cl Z33546379 [1,1,0,0,0,0|2,0,0]=4 1005 B10R1.61 NC(=O)C1=C(C=CC=C1)F Z33546498 [1,1,0,0,0,0|2,0,0]=4 1006 B10R1.61 NC(=O)C1=C(C=CC=C1)I Z33546623 [1,1,0,0,0,0|2,0,0]=4 1007 B10R1.61 NC(=O)C1=C(C=CC=C1)N Z57036632 [1,1,0,0,0,0|2,0,0]=4 1008 B10R1.61 NC(=O)C1=C(C=CC=C1)O Z68590124 [1,1,0,0,0,0|1,0,0]=3 1009 B10R1.61 NC(=O)C1=C(C=CN=C1)O Z1198177193 [1,1,0,0,0,0|2,0,0]=4 1010 B10R1.61 NC(=S)C1=C(C=CC=C1)N Z99601360 [1,1,0,0,0,0|2,0,0]=4 1011 B10R1.61 O=C(O)C1=C(C=CC=C1)Br Z57825381 [1,1,0,0,0,0|2,0,0]=4 1012 B10R1.61 O=C(O)C1=C(C=CC=C1)Cl Z57127537 [1,1,0,0,0,0|2,0,0]=4 1013 B10R1.61 O=C(O)C1=C(C=CC=C1)F Z57914061 [1,1,0,0,0,0|2,0,0]=4 1014 B10R1.61 O=C(O)C1=C(C=CC=C1)I Z57637028 [1,1,0,0,0,0|2,0,0]=4 1015 B10R1.61 O=C(O)C1=C(C=CC=C1)O Z56757226 [1,1,0,0,0,0|1,0,0]=3 1016 B10R1.61 O=C(O)C1=C(C=CC=C1)S Z104477754 [1,1,0,0,0,0|1,1,0]=4 1017 B10R1.61 O=C(O)C1=C(C=CC=N1)O Z608353738 [1,1,0,0,0,0|2,0,0]=4 1018 B10R1.61 OB(O)C1=C(C=CC=C1)O Z1201620791 [1,1,0,0,0,0|2,0,0]=4 1019 B10R1.245 CC1=C(C(=CC=C1)Br)C=O Z1255468524 [1,1,0,0,0,0|2,0,0]=4 1020 B10R1.245 CC1=C(C(=CC=C1)Br)CN Z5528425344 [1,1,0,0,0,0|2,0,0]=4 1021 B10R1.245 CC1=C(C(=CC=C1)Br)CO Z1269136839 [1,1,0,0,0,0|2,0,0]=4 1022 B10R1.245 CC1=C(C(=CC=C1)Cl)C=O Z1203162282 [1,1,0,0,0,0|2,0,0]=4 1023 B10R1.245 CC1=C(C(=CC=C1)Cl)CN Z1198307714 [1,1,0,0,0,0|2,0,0]=4 1024 B10R1.245 CC1=C(C(=CC=C1)Cl)CO Z1198166613 [1,1,0,0,0,0|2,0,0]=4 1025 B10R1.245 CC1=C(C(=CC=C1)F)C=O Z1255490372 [1,1,0,0,0,0|2,0,0]=4 1026 B10R1.245 CC1=C(C(=CC=C1)F)CN Z600584282 [1,1,0,0,0,0|2,0,0]=4 1027 B10R1.245 CC1=C(C(=CC=C1)O)C=O Z1255404975 [1,1,0,0,0,0|1,0,0]=3 1028 B10R1.245 CC1=CC=CC(=C1C=O)C Z1233237340 [1,1,0,0,0,0|2,0,0]=4 1029 B10R1.245 CC1=CC=CC(=C1CN)C Z1198728420 [1,1,0,0,0,0|2,0,0]=4 1030 B10R1.245 CNC1=C(C=CC=C1O)F Z3689709670 [1,1,0,0,0,0|1,0,1]=4 1031 B10R1.245 N#CC1=C(C=CC=C1Cl)O Z992258522 [1,1,0,0,0,0|1,0,1]=4 1032 B10R1.245 N#CC1=C(C=CC=C1F)O Z425420618 [1,1,0,0,0,0|1,0,1]=4 1033 B10R1.245 NCC1=C(C=CC=C1Cl)Br Z4945494436 [1,1,0,0,0,0|2,0,0]=4 1034 B10R1.245 NCC1=C(C=CC=C1N)F Z1203161711 [1,1,0,0,0,0|2,0,0]=4 1035 B10R1.245 NCC1=C(C=CC=C1O)Br Z3182659555 [1,1,0,0,0,0|1,0,0]=3 1036 B10R1.245 NCC1=C(C=CC=C1O)F Z2787034658 [1,1,0,0,0,0|1,0,0]=3 1037 B10R1.245 NCC1=C(C=CC=C1O)O Z2906109104 [1,1,0,0,0,0|1,0,0]=3 1038 B10R1.245 O=CC1=C(C=CC=C1Br)Br Z1269166406 [1,1,0,0,0,0|2,0,0]=4 1039 B10R1.245 O=CC1=C(C=CC=C1Br)Cl Z1269187937 [1,1,0,0,0,0|2,0,0]=4 1040 B10R1.245 O=CC1=C(C=CC=C1Br)F Z1138557911 [1,1,0,0,0,0|2,0,0]=4 1041 B10R1.245 O=CC1=C(C=CC=C1Br)O Z1269175728 [1,1,0,0,0,0|1,0,0]=3 1042 B10R1.245 O=CC1=C(C=CC=C1Cl)Cl Z57773430 [1,1,0,0,0,0|2,0,0]=4 1043 B10R1.245 O=CC1=C(C=CC=C1Cl)F Z104472904 [1,1,0,0,0,0|2,0,0]=4 1044 B10R1.245 O=CC1=C(C=CC=C1Cl)O Z385458800 [1,1,0,0,0,0|1,0,0]=3 1045 B10R1.245 O=CC1=C(C=CC=C1F)F Z104477798 [1,1,0,0,0,0|2,0,0]=4 1046 B10R1.245 O=CC1=C(C=CC=C1F)O Z1201620838 [1,1,0,0,0,0|1,0,0]=3 1047 B10R1.245 O=CC1=C(C=CC=C1I)F Z1269131251 [1,1,0,0,0,0|2,0,0]=4 1048 B10R1.245 O=CC1=C(C=CC=C1O)O Z1198175863 [1,1,0,0,0,0|1,0,0]=3 1049 B10R1.245 O=CC1=C(C=NC=C1Cl)O Z1255504780 [1,1,0,0,0,0|2,0,0]=4 1050 B10R1.245 OCC1=C(C=CC=C1Br)Br Z1269239829 [1,1,0,0,0,0|2,0,0]=4 1051 B10R1.5 C=CCC1=C(C=CO1)C=O Z1511896697 [0,1,0,0,1,0|1,0,1]=4 1052 B10R1.187 C=CCN1C(=CC=C1C)C Z56877840 [0,1,0,0,1,0|2,0,0]=4 1053 B10R1.187 C=CCN1C(=O)C=CC1=O Z381005686 [0,1,0,0,1,0|1,0,1]=4 1054 B12R1.40 C=CCN1C=C(C=C(C1=O)C)Br Z1514064359 [0,2,0,0,0,0|1,0,1]=4 1055 B12R1.224 CC1=C(C(=CC=C1)CC(=O)O)Br Z1269227300 [0,2,0,0,0,0|2,0,0]=4 1056 B12R1.224 CC1=C(C(=CC=C1)CC(=O)O)Cl Z1198264659 [0,2,0,0,0,0|2,0,0]=4 1057 B12R1.224 CC1=C(C=CC=C1Br)CC(=O)O Z1269111906 [0,2,0,0,0,0|2,0,0]=4 1058 B12R1.224 NC(=O)CC1=C(C(=CC=C1)Cl)F Z2169650265 [0,2,0,0,0,0|2,0,0]=4 1059 B12R1.224 NC1=C(C(=CC=C1)CC(=O)O)N Z1551954875 [0,2,0,0,0,0|2,0,0]=4 1060 B12R1.224 O=C(O)CC1=C(C(=CC=C1)Br)Cl Z1269150472 [0,2,0,0,0,0|2,0,0]=4 1061 B12R1.224 O=C(O)CC1=C(C(=CC=C1)Br)I Z1269162570 [0,2,0,0,0,0|2,0,0]=4 1062 B12R1.224 O=C(O)CC1=C(C(=CC=C1)Cl)Cl Z982129970 [0,2,0,0,0,0|2,0,0]=4 1063 B12R1.224 O=C(O)CC1=C(C(=CC=C1)F)F Z445167096 [0,2,0,0,0,0|2,0,0]=4 1064 B12R1.224 O=C(O)CC1=C(C(=CC=C1)O)F Z1198218753 [0,2,0,0,0,0|2,0,0]=4 1065 B12R1.542 CNCC1=C(C(=CC=C1)Br)OC Z815292202 [0,2,0,0,0,0|1,0,1]=4 1066 B12R1.542 CNCC1=C(C(=CC=C1)Cl)OC Z5378131731 [0,2,0,0,0,0|1,0,1]=4 1067 B12R1.69 C=CCOC1=C(C=C(C=C1)Br)N Z1263545294 [0,2,0,0,0,0|1,0,0]=3 1068 B12R1.69 O=C/C=C/C1=C(C=C(C=C1)F)F Z1198173301 [0,2,0,0,0,0|1,0,1]=4 1069 B12R1.69 O=CCCC1=C(C=C(C=C1)Cl)Cl Z993017674 [0,2,0,0,0,0|1,0,1]=4 1070 B12R1.69 O=CCCC1=C(C=C(C=C1)F)F Z993017790 [0,2,0,0,0,0|1,0,1]=4 1071 B12R1.121 C#CCOC1=C(C=CC=C1)OC Z54471924 [0,2,0,0,0,0|0,0,2]=4 1072 B12R1.121 C#CCSC1=C(C=CC=C1)OC Z804946238 [0,2,0,0,0,0|0,0,2]=4 1073 B12R1.121 C=CCCC1=C(C=CC=C1)C=O Z1511744014 [0,2,0,0,0,0|0,0,1]=3 1074 B12R1.121 C=CCOC1=C(C=CC=C1)C=O Z54337089 [0,2,0,0,0,0|0,0,1]=3 1075 B12R1.121 C=CCOC1=C(C=CC=C1)CN Z446020710 [0,2,0,0,0,0|1,0,0]=3 1076 B12R1.121 CNCCC1=C(C=CC=C1)OC Z159528470 [0,2,0,0,0,0|0,0,2]=4 1077 B12R1.121 COC1=C(C=CC=C1)/C=C/C=O Z2573655488 [0,2,0,0,0,0|0,0,1]=3 1078 B12R1.121 COC1=C(C=CC=C1)CCC=O Z993017838 [0,2,0,0,0,0|0,0,1]=3 1079 B12R1.121 COC1=C(C=CC=C1)NCCO Z335255666 [0,2,0,0,0,0|1,0,1]=4 1080 B12R1.121 COC1=C(C=CC=C1)OCCBr Z57842348 [0,2,0,0,0,0|1,0,1]=4 1081 B12R1.121 COC1=C(C=CC=C1)OCCCl Z381039148 [0,2,0,0,0,0|1,0,1]=4 1082 B12R1.121 COC1=C(C=CC=C1)OCCN Z56968779 [0,2,0,0,0,0|1,0,1]=4 1083 B12R1.125 C=C(C)CNC1=C(C=CC=C1)Br Z297649770 [0,2,0,0,0,0|1,0,0]=3 1084 B12R1.125 CC(=O)/C=C/C1=C(C=CC=C1)F Z1217226767 [0,2,0,0,0,0|1,0,1]=4 1085 B12R1.125 CC(=O)CCC1=C(C=CC=C1)F Z406376954 [0,2,0,0,0,0|1,0,1]=4 1086 B12R1.125 CC(=O)NCC1=C(C=CC=C1)F Z29857733 [0,2,0,0,0,0|1,0,1]=4 1087 B12R1.125 CC(=O)NCC1=C(C=CC=C1)N Z3711224127 [0,2,0,0,0,0|1,0,1]=4 1088 B12R1.125 CC1=C(C=CC=C1)/C=C/C(=O)O Z2417574586 [0,2,0,0,0,0|1,0,1]=4 1089 B12R1.125 CC1=C(C=CC=C1)CCC(=O)O Z317037960 [0,2,0,0,0,0|1,0,1]=4 1090 B12R1.125 CC1=C(C=CC=C1)NCC(=O)N Z104590676 [0,2,0,0,0,0|2,0,0]=4 1091 B12R1.125 CC1=C(C=CC=C1)OCC(=N)N Z823287452 [0,2,0,0,0,0|2,0,0]=4 1092 B12R1.125 CC1=C(C=CC=C1)OCC(=O)N Z19733874 [0,2,0,0,0,0|2,0,0]=4 1093 B12R1.125 CC1=C(C=CC=C1)OCC(=O)O Z56820406 [0,2,0,0,0,0|2,0,0]=4 1094 B12R1.125 CC1=C(C=CC=C1)SCC(=O)O Z56870728 [0,2,0,0,0,0|2,0,0]=4 1095 B12R1.125 N=C(N)NCC1=C(C=CC=C1)F Z3034959360 [0,2,0,0,0,0|2,0,0]=4 1096 B12R1.125 N=C(N)SCC1=C(C=CC=C1)Cl Z48820396 [0,2,0,0,0,0|2,0,0]=4 1097 B12R1.125 NC(=O)CCC1=C(C=CC=C1)Br Z741559968 [0,2,0,0,0,0|1,0,1]=4 1098 B12R1.125 NC(=O)CCC1=C(C=CC=C1)N Z414316848 [0,2,0,0,0,0|1,0,1]=4 1099 B12R1.125 NC(=O)CCC1=C(C=CC=C1)O Z371352778 [0,2,0,0,0,0|0,0,1]=3 1100 B12R1.125 NC(=O)CNC1=C(C=CC=C1)Br Z137588472 [0,2,0,0,0,0|2,0,0]=4 1101 B12R1.125 NC(=O)CNC1=C(C=CC=C1)Cl Z104528166 [0,2,0,0,0,0|2,0,0]=4 1102 B12R1.125 NC(=O)CNC1=C(C=CC=C1)I Z133437412 [0,2,0,0,0,0|2,0,0]=4 1103 B12R1.125 NC(=O)COC1=C(C=CC=C1)Br Z17829253 [0,2,0,0,0,0|2,0,0]=4 1104 B12R1.125 NC(=O)COC1=C(C=CC=C1)Cl Z19726626 [0,2,0,0,0,0|2,0,0]=4 1105 B12R1.125 NC(=O)COC1=C(C=CC=C1)F Z19724798 [0,2,0,0,0,0|2,0,0]=4 1106 B12R1.125 NC(=O)COC1=C(C=CC=C1)I Z406416164 [0,2,0,0,0,0|2,0,0]=4 1107 B12R1.125 NC(=O)CSC1=C(C=CC=C1)Br Z149386624 [0,2,0,0,0,0|2,0,0]=4 1108 B12R1.125 NC(=O)CSC1=C(C=CC=C1)Cl Z18459622 [0,2,0,0,0,0|2,0,0]=4 1109 B12R1.125 NC(=O)CSC1=C(C=CC=C1)N Z57332466 [0,2,0,0,0,0|2,0,0]=4 1110 B12R1.125 NC(=O)NCC1=C(C=CC=C1)Cl Z198194806 [0,2,0,0,0,0|2,0,0]=4 1111 B12R1.125 NC(=O)NCC1=C(C=CC=C1)F Z198194842 [0,2,0,0,0,0|2,0,0]=4 1112 B12R1.125 O=C(O)/C=C/C1=C(C=CC=C1)Br Z2315575361 [0,2,0,0,0,0|1,0,1]=4 1113 B12R1.125 O=C(O)/C=C/C1=C(C=CC=C1)Cl Z57264035 [0,2,0,0,0,0|1,0,1]=4 1114 B12R1.125 O=C(O)/C=C/C1=C(C=CC=C1)F Z2573655240 [0,2,0,0,0,0|1,0,1]=4 1115 B12R1.125 O=C(O)CCC1=C(C=CC=C1)Br Z406704244 [0,2,0,0,0,0|1,0,1]=4 1116 B12R1.125 O=C(O)CCC1=C(C=CC=C1)Cl Z56943366 [0,2,0,0,0,0|1,0,1]=4 1117 B12R1.125 O=C(O)CCC1=C(C=CC=C1)F Z57991059 [0,2,0,0,0,0|1,0,1]=4 1118 B12R1.125 O=C(O)CCC1=C(C=CC=C1)O Z56347225 [0,2,0,0,0,0|0,0,1]=3 1119 B12R1.125 O=C(O)CNC1=C(C=CC=C1)Cl Z274534698 [0,2,0,0,0,0|2,0,0]=4 1120 B12R1.125 O=C(O)COC1=C(C=CC=C1)Br Z111834298 [0,2,0,0,0,0|2,0,0]=4 1121 B12R1.125 O=C(O)COC1=C(C=CC=C1)Cl Z57042068 [0,2,0,0,0,0|2,0,0]=4 1122 B12R1.125 O=C(O)COC1=C(C=CC=C1)F Z56823442 [0,2,0,0,0,0|2,0,0]=4 1123 B12R1.125 O=C(O)COC1=C(C=CC=C1)O Z56869464 [0,2,0,0,0,0|1,0,0]=3 1124 B12R1.125 O=C(O)CSC1=C(C=CC=C1)Br Z56827233 [0,2,0,0,0,0|2,0,0]=4 1125 B12R1.125 O=C(O)CSC1=C(C=CC=C1)Cl Z55903470 [0,2,0,0,0,0|2,0,0]=4 1126 B12R1.125 O=C(O)CSC1=C(C=CC=C1)F Z55903942 [0,2,0,0,0,0|2,0,0]=4 1127 B12R1.125 O=C(O)CSC1=C(C=CC=C1)O Z905204160 [0,2,0,0,0,0|1,0,0]=3 1128 B12R1.267 C=CCNCC1=C(C=CC=C1)F Z744843672 [0,2,0,0,0,0|1,0,0]=3 1129 B12R1.267 CCCNCC1=C(C=CC=C1)O Z316257178 [0,2,0,0,0,0|0,0,2]=4 1130 B12R1.267 O=CCCCC1=C(C=CC=C1)Br Z1233207918 [0,2,0,0,0,0|1,0,1]=4 1131 B12R1.267 O=CCCCC1=C(C=CC=C1)F Z1233207919 [0,2,0,0,0,0|1,0,1]=4 1132 B12R1.308 C=CCC(=O)C1=C(C=CC=C1)F Z1082405332 [0,2,0,0,0,0|1,0,0]=3 1133 B12R1.371 C=CC(=O)NC1=C(C=CC=C1)C Z440633758 [0,2,0,0,0,0|1,0,1]=4 1134 B12R1.371 C=CC(=O)NC1=C(C=CC=C1)Cl Z440633680 [0,2,0,0,0,0|1,0,1]=4 1135 B12R1.371 C=CC(=O)NC1=C(C=CC=C1)F Z295390598 [0,2,0,0,0,0|1,0,1]=4 1136 B12R1.371 CCC(=O)CC1=C(C=CC=C1)Br Z513735296 [0,2,0,0,0,0|1,0,1]=4 1137 B12R1.371 CCC(=O)NC1=C(C=CC=C1)O Z68195027 [0,2,0,0,0,0|1,0,1]=4 1138 B12R1.371 CNC(=O)CC1=C(C=CC=C1)N Z234895127 [0,2,0,0,0,0|1,0,1]=4 1139 B12R1.371 COC(=O)CC1=C(C=CC=C1)Cl Z24820310 [0,2,0,0,0,0|1,0,1]=4 1140 B12R1.371 COC(=O)CC1=C(C=CC=C1)I Z1269173309 [0,2,0,0,0,0|1,0,1]=4 1141 B12R1.371 COC(=O)CC1=C(C=CC=C1)N Z1333043515 [0,2,0,0,0,0|1,0,1]=4 1142 B12R1.371 COC(=O)CC1=C(C=CC=C1)O Z1010319062 [0,2,0,0,0,0|0,0,1]=3 1143 B12R1.371 COC(=O)NC1=C(C=CC=C1)O Z425822036 [0,2,0,0,0,0|1,0,1]=4 1144 B12R1.371 N/C(=N\O)/CC1=C(C=CC=C1)Cl Z451350216 [0,2,0,0,0,0|2,0,0]=4 1145 B12R1.371 O=C(CC1=C(C=CC=C1)Cl)NO Z59182782 [0,2,0,0,0,0|2,0,0]=4 1146 B12R1.371 O=C(CCl)CC1=C(C=CC=C1)Br Z408178456 [0,2,0,0,0,0|1,0,1]=4 1147 B12R1.371 O=C(CCl)CC1=C(C=CC=C1)Cl Z408178450 [0,2,0,0,0,0|1,0,1]=4 1148 B12R1.371 O=C(CCl)CC1=C(C=CC=C1)F Z316174764 [0,2,0,0,0,0|1,0,1]=4 1149 B12R1.371 O=C(CCl)NC1=C(C=CC=C1)O Z57764509 [0,2,0,0,0,0|1,0,1]=4 1150 B12R1.371 O=CC(Cl)CC1=C(C=CC=C1)Cl Z982126354 [0,2,0,0,0,0|1,0,1]=4 1151 B12R1.374 C=CCOC1=C(C=CC(=C1)C)C Z54338240 [0,2,0,0,0,0|1,0,0]=3 1152 B12R1.374 CCNCC1=C(C=CC(=C1)Br)O Z944939986 [0,2,0,0,0,0|0,0,2]=4 1153 B12R1.1631 O=CCCC1=C(C=CC=C1Cl)Cl Z993017858 [0,2,0,0,0,0|1,0,1]=4 1154 B12R1.1631 O=CCCC1=C(C=CC=C1Cl)F Z993017832 [0,2,0,0,0,0|1,0,1]=4 1155 B12R1.75 C#CC1=C(C=CC=C1)CC(=O)N Z1262691146 [0,2,0,0,0,0|2,0,0]=4 1156 B12R1.75 CCC1=C(C=CC=C1)CC(=O)O Z1198264425 [0,2,0,0,0,0|2,0,0]=4 1157 B12R1.75 CN(C)CC1=C(C=CC=C1)CO Z336081038 [0,2,0,0,0,0|1,0,1]=4 1158 B12R1.75 COC1=C(C=CC=C1)CC(=O)N Z33545381 [0,2,0,0,0,0|1,0,0]=3 1159 B12R1.75 COC1=C(C=CC=C1)CC(=O)O Z104485032 [0,2,0,0,0,0|1,0,0]=3 1160 B12R1.75 COC1=C(C=CC=C1)CC(C)O Z445987128 [0,2,0,0,0,0|0,0,2]=4 1161 B12R1.75 COC1=C(C=CC=C1)NC(=O)C Z27797377 [0,2,0,0,0,0|1,0,1]=4 1162 B12R1.75 COC1=C(C=CC=C1)NC(=O)N Z56754689 [0,2,0,0,0,0|2,0,0]=4 1163 B12R1.75 COC1=C(C=NC=C1)CC(=O)O Z2609473538 [0,2,0,0,0,0|2,0,0]=4 1164 B12R1.75 CSC1=C(C=CC=C1)CC(=O)C Z1641983304 [0,2,0,0,0,0|0,1,1]=4 1165 B12R1.75 CSC1=C(C=CC=C1)CC(=O)O Z1255403889 [0,2,0,0,0,0|1,1,0]=4 1166 B12R1.75 NCC1=C(C=CC=C1)CC(=O)O Z1198163910 [0,2,0,0,0,0|2,0,0]=4 1167 B12R1.75 O=C([O-])CC1=C(C=CC=C1)CO Z1762997367 [0,2,0,0,0,0|1,0,0]=3 1168 B12R1.77 CCC(N)C1=C(C=CC=C1)OC Z234894889 [0,2,0,0,0,0|0,0,2]=4 1169 B12R1.77 CNC(C)C1=C(C=CC=C1)OC Z140561750 [0,2,0,0,0,0|1,0,1]=4 1170 B12R1.77 COC1=C(C=CC=C1)C(C)C=O Z1255384224 [0,2,0,0,0,0|1,0,0]=3 1171 B12R1.77 COC1=C(C=CC=C1)C(C)CN Z415655038 [0,2,0,0,0,0|1,0,1]=4 1172 B12R1.77 COC1=C(C=CC=C1)C(N)C#N Z1263602439 [0,2,0,0,0,0|1,0,1]=4 1173 B12R1.77 COC1=C(C=CC=C1)C(N)CN Z425861114 [0,2,0,0,0,0|1,0,1]=4 1174 B12R1.77 COC1=C(C=CC=C1)C(O)CN Z336086524 [0,2,0,0,0,0|1,0,1]=4 1175 B12R1.112 CNCC1=C(C=C(C=C1)F)OC Z5451130516 [0,2,0,0,0,0|1,0,1]=4 1176 B12R1.112 COC1=C(C=CC(=C1)Br)CCN Z1551924124 [0,2,0,0,0,0|1,0,1]=4 1177 B12R1.112 COC1=C(C=CC(=C1)Cl)CC#N Z1198263822 [0,2,0,0,0,0|1,0,1]=4 1178 B12R1.112 COC1=C(C=CC(=C1)F)CCN Z5577629908 [0,2,0,0,0,0|1,0,1]=4 1179 B12R1.112 COCC1=C(C=C(C=C1)N)OC Z1551924555 [0,2,0,0,0,0|1,0,1]=4 1180 B12R1.169 CCOC1=C(C=CC=C1)CCN Z1263529598 [0,2,0,0,0,0|1,0,1]=4 1181 B12R1.169 CCOC1=C(C=CC=C1)CNC Z600428330 [0,2,0,0,0,0|1,0,1]=4 1182 B12R1.268 CNCC1=C(C=CC(=C1)Br)OC Z56957556 [0,2,0,0,0,0|1,0,1]=4 1183 B12R1.268 CNCC1=C(C=CC(=C1)C)OC Z94598686 [0,2,0,0,0,0|1,0,1]=4 1184 B12R1.268 CNCC1=C(C=CC(=C1)Cl)OC Z104346732 [0,2,0,0,0,0|1,0,1]=4 1185 B12R1.268 COC1=C(C=C(C=C1)Br)CCN Z1682072470 [0,2,0,0,0,0|1,0,1]=4 1186 B12R1.268 COC1=C(C=C(C=C1)C)CC#N Z94597857 [0,2,0,0,0,0|1,0,1]=4 1187 B12R1.268 COC1=C(C=C(C=C1)C)CCN Z96092050 [0,2,0,0,0,0|1,0,1]=4 1188 B12R1.268 COC1=C(C=C(C=C1)Cl)CCN Z1267773768 [0,2,0,0,0,0|1,0,1]=4 1189 B12R1.268 COC1=C(C=C(C=C1)F)CC#N Z1198154540 [0,2,0,0,0,0|1,0,1]=4 1190 B12R1.268 COC1=C(C=C(C=C1)F)CCN Z2805877171 [0,2,0,0,0,0|1,0,1]=4 1191 B12R1.283 CCCC1=C(C=CC=C1)B(O)O Z821158624 [0,2,0,0,0,0|0,0,2]=4 1192 B12R1.283 CCCC1=C(C=CC=C1)C(=O)O Z1255462246 [0,2,0,0,0,0|0,0,2]=4 1193 B12R1.283 COCC1=C(C=CC=C1)B(O)O Z821093346 [0,2,0,0,0,0|1,0,1]=4 1194 B12R1.283 COCC1=C(C=CC=C1)C(=O)O Z359517772 [0,2,0,0,0,0|1,0,1]=4 1195 B12R1.283 N#CCC1=C(C=CC=C1)C(=O)O Z56946849 [0,2,0,0,0,0|1,0,1]=4 1196 B12R1.283 NCCC1=C(C=CC=C1)C(=O)O Z1431905053 [0,2,0,0,0,0|1,0,1]=4 1197 B12R1.1112 CNCC1=C(C=CC=C1F)OC Z5453478944 [0,2,0,0,0,0|1,0,1]=4 1198 B12R1.114 COC1=CC(=C(C=C1)CC=O)C Z1198313230 [0,2,0,0,0,0|2,0,0]=4 1199 B12R1.233 CC(=O)CC1=C(C=C(C=C1)Br)F Z992965764 [0,2,0,0,0,0|1,0,1]=4 1200 B12R1.233 CC(=O)CC1=C(C=C(C=C1)Cl)F Z1198331241 [0,2,0,0,0,0|1,0,1]=4 1201 B12R1.233 CC(=O)CC1=C(C=C(C=C1)F)Br Z992965738 [0,2,0,0,0,0|1,0,1]=4 1202 B12R1.233 CC(=O)NC1=C(C=C(C=C1)C)O Z33451994 [0,2,0,0,0,0|1,0,1]=4 1203 B12R1.233 CC(C)CC1=C(C=C(C=C1)O)O Z1513805538 [0,2,0,0,0,0|0,0,2]=4 1204 B12R1.233 CC1=C(C=CC(=C1)Br)CC(=O)N Z1617965385 [0,2,0,0,0,0|2,0,0]=4 1205 B12R1.233 CC1=C(C=CC(=C1)Br)CC(=O)O Z1269213926 [0,2,0,0,0,0|2,0,0]=4 1206 B12R1.233 CC1=C(C=CC(=C1)F)CC(=O)O Z982130478 [0,2,0,0,0,0|2,0,0]=4 1207 B12R1.233 CC1=CC(=C(C=C1)CC(=O)O)Br Z1269232519 [0,2,0,0,0,0|2,0,0]=4 1208 B12R1.233 N=C(N)CC1=C(C=C(C=C1)F)F Z1642389901 [0,2,0,0,0,0|2,0,0]=4 1209 B12R1.233 NC(=O)CC1=C(C=C(C=C1)Br)Cl Z2692246846 [0,2,0,0,0,0|2,0,0]=4 1210 B12R1.233 NC1=CC(=C(C=C1)CC(=O)O)F Z1198183551 [0,2,0,0,0,0|2,0,0]=4 1211 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Br)Cl Z1269137680 [0,2,0,0,0,0|2,0,0]=4 1212 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Br)I Z1269231484 [0,2,0,0,0,0|2,0,0]=4 1213 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Br)O Z1269204929 [0,2,0,0,0,0|1,0,0]=3 1214 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Cl)Br Z1187934893 [0,2,0,0,0,0|2,0,0]=4 1215 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Cl)Cl Z104477206 [0,2,0,0,0,0|2,0,0]=4 1216 B12R1.233 O=C(O)CC1=C(C=C(C=C1)F)Br Z285184632 [0,2,0,0,0,0|2,0,0]=4 1217 B12R1.233 O=C(O)CC1=C(C=C(C=C1)F)Cl Z285184620 [0,2,0,0,0,0|2,0,0]=4 1218 B12R1.233 O=C(O)CC1=C(C=C(C=C1)F)F Z362118706 [0,2,0,0,0,0|2,0,0]=4 1219 B12R1.233 O=C(O)CC1=C(C=C(C=C1)O)Cl Z1198307592 [0,2,0,0,0,0|2,0,0]=4 1220 B12R1.1095 CC1=CC(=C(C(=C1)C)CC=O)C Z1183459086 [0,2,0,0,0,0|2,0,0]=4 1221 B12R1.1703 CC(C=O)C1=C(C=C(C=C1)F)F Z1268606334 [0,2,0,0,0,0|2,0,0]=4 1222 B12R1.124 CC(=O)C(N)C1=C(C=CC=C1)F Z2312540924 [0,2,0,0,0,0|1,0,1]=4 1223 B12R1.124 CC(C(=O)O)C1=C(C=CC=C1)Cl Z982130746 [0,2,0,0,0,0|2,0,0]=4 1224 B12R1.124 CC(C(=O)O)C1=C(C=CC=C1)F Z792377276 [0,2,0,0,0,0|2,0,0]=4 1225 B12R1.124 CC1=C(C=CC=C1)C(C)C(=O)O Z792377258 [0,2,0,0,0,0|2,0,0]=4 1226 B12R1.124 CC1=C(C=CC=C1)C(N)C(=O)O Z317024660 [0,2,0,0,0,0|2,0,0]=4 1227 B12R1.124 NC(C(=O)O)C1=C(C=CC=C1)Br Z317024716 [0,2,0,0,0,0|2,0,0]=4 1228 B12R1.124 NC(C(=O)O)C1=C(C=CC=C1)F Z317024726 [0,2,0,0,0,0|2,0,0]=4 1229 B12R1.124 NC(C(=O)O)C1=C(C=CC=C1)I Z2941400819 [0,2,0,0,0,0|2,0,0]=4 1230 B12R1.124 O=C(O)C(O)C1=C(C=CC=C1)Br Z788000812 [0,2,0,0,0,0|2,0,0]=4 1231 B12R1.124 O=C(O)C(O)C1=C(C=CC=C1)I Z1269111466 [0,2,0,0,0,0|2,0,0]=4 1232 B12R1.124 O=C(O)[C@H](O)C1=C(C=CC=C1)Cl Z1255488133 [0,2,0,0,0,0|2,0,0]=4 1233 B12R1.127 CC(=O)CC1=C(C=CC(=C1)F)Br Z992965748 [0,2,0,0,0,0|1,0,1]=4 1234 B12R1.127 CC(=O)NC1=C(C=CC(=C1)N)O Z1198342725 [0,2,0,0,0,0|1,0,1]=4 1235 B12R1.127 CC1=C(C=C(C=C1)Br)CC(=O)O Z1269235842 [0,2,0,0,0,0|2,0,0]=4 1236 B12R1.127 CC1=CC(=C(C=C1)Br)CC(=O)O Z1269198963 [0,2,0,0,0,0|2,0,0]=4 1237 B12R1.127 CC1=CC(=C(C=C1)C)CC(=O)O Z234894443 [0,2,0,0,0,0|2,0,0]=4 1238 B12R1.127 CC1=CC(=C(C=C1)F)CC(=O)O Z982130030 [0,2,0,0,0,0|2,0,0]=4 1239 B12R1.127 O=C(O)CC1=C(C=CC(=C1)Br)Br Z1269185355 [0,2,0,0,0,0|2,0,0]=4 1240 B12R1.127 O=C(O)CC1=C(C=CC(=C1)Br)Cl Z1269155132 [0,2,0,0,0,0|2,0,0]=4 1241 B12R1.127 O=C(O)CC1=C(C=CC(=C1)Br)F Z285225836 [0,2,0,0,0,0|2,0,0]=4 1242 B12R1.127 O=C(O)CC1=C(C=CC(=C1)Cl)Br Z1269132555 [0,2,0,0,0,0|2,0,0]=4 1243 B12R1.127 O=C(O)CC1=C(C=CC(=C1)F)Br Z285131566 [0,2,0,0,0,0|2,0,0]=4 1244 B12R1.127 O=C(O)CC1=C(C=CC(=C1)F)F Z362118692 [0,2,0,0,0,0|2,0,0]=4 1245 B12R1.127 O=C(O)CC1=C(C=CC(=C1)F)O Z1255403749 [0,2,0,0,0,0|1,0,0]=3 1246 B12R1.127 O=C(O)CC1=C(C=CC(=C1)I)Br Z1269158801 [0,2,0,0,0,0|2,0,0]=4 1247 B12R1.127 O=C(O)CC1=C(C=CC(=C1)O)Br Z1269121921 [0,2,0,0,0,0|2,0,0]=4 1248 B12R1.151 CS(=O)(=O)CC1=C(C=CC=C1)O Z1513868900 [0,2,0,0,0,0|1,0,1]=4 1249 B12R1.1009 CC(=O)CC1=C(C=CC=C1Cl)Cl Z858029228 [0,2,0,0,0,0|1,0,1]=4 1250 B12R1.1009 CC1=C(C(=CC=C1)Cl)CC(=O)O Z1255430731 [0,2,0,0,0,0|2,0,0]=4 1251 B12R1.1009 CC1=C(C(=CC=C1)F)CC(=O)O Z1255489762 [0,2,0,0,0,0|2,0,0]=4 1252 B12R1.1009 CC1=CC=CC(=C1CC(=O)O)C Z1198167156 [0,2,0,0,0,0|2,0,0]=4 1253 B12R1.1009 N=C(N)CC1=C(C=CC=C1Cl)Cl Z1708089988 [0,2,0,0,0,0|2,0,0]=4 1254 B12R1.1009 N=C(N)CC1=C(C=CC=C1F)Cl Z1695906722 [0,2,0,0,0,0|2,0,0]=4 1255 B12R1.1009 NC(=O)CC1=C(C=CC=C1Cl)Cl Z33546774 [0,2,0,0,0,0|2,0,0]=4 1256 B12R1.1009 NC(=O)CC1=C(C=CC=C1F)Cl Z33546661 [0,2,0,0,0,0|2,0,0]=4 1257 B12R1.1009 NC(=O)CC1=C(C=CC=C1F)F Z1389112660 [0,2,0,0,0,0|2,0,0]=4 1258 B12R1.1009 O=C(O)CC1=C(C=CC=C1Cl)Br Z1551916621 [0,2,0,0,0,0|2,0,0]=4 1259 B12R1.1009 O=C(O)CC1=C(C=CC=C1Cl)Cl Z104478552 [0,2,0,0,0,0|2,0,0]=4 1260 B12R1.1009 O=C(O)CC1=C(C=CC=C1F)Cl Z57044264 [0,2,0,0,0,0|2,0,0]=4 1261 B12R1.1009 O=C(O)CC1=C(C=CC=C1F)F Z362118786 [0,2,0,0,0,0|2,0,0]=4 1262 B12R1.270 C=CCC1=C(C=CC(=C1)C=O)O Z57842085 [0,2,0,0,0,0|0,0,0]=2 1263 B12R1.270 C=CCC1=C(C=CC(=C1)OC)O Z57046211 [0,2,0,0,0,0|0,0,0]=2 1264 B10R2.6 C1=CC=C(C=C1)C2CO2 Z104486008 [1,0,0,1,0,0|1,0,1]=4 1265 B10R2.6 C1=CC=C(C=C1)[C@@H]2CO2 Z1255356265 [1,0,0,1,0,0|1,0,1]=4 1266 B10R2.6 C1=CC=C(C=C1)[C@H]2CO2 Z1255390768 [1,0,0,1,0,0|1,0,1]=4 1267 B10R2.7 C1=CC2=C(C=C1)CC=C2 Z104476162 [1,0,0,1,0,0|0,0,0]=2 1268 B10R2.7 C1=CC2=C(C=C1)CNC2 Z1263820391 [1,0,0,1,0,0|1,0,1]=4 1269 B10R2.7 C1=CC2=C(C=C1)COC2 Z839134770 [1,0,0,1,0,0|1,0,1]=4 1270 B10R2.7 C1=CC2=C(C=C1)NC=C2 Z57833933 [1,0,0,1,0,0|1,0,0]=3 1271 B10R2.7 C1=CC2=C(C=C1)NC=N2 Z57069879 [1,0,0,1,0,0|2,0,0]=4 1272 B10R2.7 C1=CC2=C(C=C1)NCC2 Z104475582 [1,0,0,1,0,0|1,0,1]=4 1273 B10R2.7 C1=CC2=C(C=C1)NN=C2 Z276614452 [1,0,0,1,0,0|2,0,0]=4 1274 B10R2.7 C1=CC2=C(C=C1)OC=C2 Z56347207 [1,0,0,1,0,0|1,0,0]=3 1275 B10R2.7 C1=CC2=C(C=C1)OCC2 Z104505448 [1,0,0,1,0,0|1,0,1]=4 1276 B10R2.7 C1=CC2=C(C=C1)ON=C2 Z220335556 [1,0,0,1,0,0|2,0,0]=4 1277 B10R2.7 C1=CC2=C(C=C1)SC=C2 Z370711590 [1,0,0,1,0,0|1,0,0]=3 1278 B10R2.7 C1=CC2=C(C=C1)SC=N2 Z104472964 [1,0,0,1,0,0|2,0,0]=4 1279 B10R2.7 C1=CC2=C(C=CN2)C=N1 Z1079456082 [1,0,0,1,0,0|2,0,0]=4 1280 B10R2.7 C1=CC2=C(C=CO2)N=C1 Z2831987589 [1,0,0,1,0,0|2,0,0]=4 1281 B10R2.7 C1=CC2=C(C=CS2)C=N1 Z810507710 [1,0,0,1,0,0|2,0,0]=4 1282 B10R2.7 C1=CC2=C(C=N1)NC=C2 Z871773918 [1,0,0,1,0,0|2,0,0]=4 1283 B10R2.7 C1=CC2=C(N=C1)NC=C2 Z271099378 [1,0,0,1,0,0|2,0,0]=4 1284 B10R2.7 C1=CC2=NC=CN2C=C1 Z838912682 [1,0,0,1,0,0|2,0,0]=4 1285 B10R2.7 C1=CNC2=CC=NC2=C1 Z1925930568 [1,0,0,1,0,0|2,0,0]=4 1286 B10R2.320 NC1CC2=C1C=CC=C2 Z1918018858 [1,0,0,1,0,0|1,0,1]=4 1287 B12R2.82 CC1=C(C2=C(C=C1)CCC2)O Z1255490620 [0,1,0,1,0,0|0,0,2]=4 1288 B12R2.82 CC1=C(C2=C(C=CN2)C=C1)Br Z1551923928 [0,1,0,1,0,0|2,0,0]=4 1289 B12R2.82 CC1=C(C2=C(C=CN2)C=C1)F Z1486007518 [0,1,0,1,0,0|2,0,0]=4 1290 B12R2.82 CC1=C2NC=CC2=CC=C1Br Z1269148523 [0,1,0,1,0,0|2,0,0]=4 1291 B12R2.82 CC1=C2NC=CC2=CC=C1F Z1198182497 [0,1,0,1,0,0|2,0,0]=4 1292 B12R2.82 ClC1=C(C2=C(C=CO2)C=C1)Br Z1681348708 [0,1,0,1,0,0|2,0,0]=4 1293 B12R2.82 FC1=C2NC=CC2=CC=C1Cl Z1255416961 [0,1,0,1,0,0|2,0,0]=4 1294 B12R2.82 NC1=C(C2=C(C=CS2)N=C1)O Z5766618507 [0,1,0,1,0,0|2,0,0]=4 1295 B12R2.82 OC1=C2C=CSC2=CC=C1Br Z1269129531 [0,1,0,1,0,0|1,0,1]=4 1296 B12R2.202 CC1=C2NC(=O)CC2=CC=C1 Z1198159857 [0,1,0,1,0,0|2,0,0]=4 1297 B12R2.202 CC1=C2OC(=NC2=CC=C1)N Z1251362841 [0,1,0,1,0,0|2,0,0]=4 1298 B12R2.202 CC1=C2OC(=O)NC2=CC=C1 Z1255416550 [0,1,0,1,0,0|2,0,0]=4 1299 B12R2.202 CC1=CC2=C(N1)C(=CC=C2)C Z1198147838 [0,1,0,1,0,0|2,0,0]=4 1300 B12R2.202 CC1=CC2=C(N1)C(=CC=C2)Cl Z1198221008 [0,1,0,1,0,0|2,0,0]=4 1301 B12R2.202 CC1=CC2=C(N1)C(=CC=C2)F Z1255418917 [0,1,0,1,0,0|2,0,0]=4 1302 B12R2.202 CC1=CC2=C(O1)C(=CC=C2)Br Z1269204422 [0,1,0,1,0,0|0,0,2]=4 1303 B12R2.202 CC1=CC2=C(S1)C(=CC=C2)Br Z1269210790 [0,1,0,1,0,0|2,0,0]=4 1304 B12R2.202 CC1=NC2=C(O1)C=CC=C2N Z1201624543 [0,1,0,1,0,0|1,0,1]=4 1305 B12R2.202 CC1CC2=C(O1)C(=CC=C2)Cl Z803153168 [0,1,0,1,0,0|0,0,2]=4 1306 B12R2.202 FC1=C2N=C(OC2=CC=C1)S Z1869902596 [0,1,0,1,0,0|2,0,0]=4 1307 B12R2.202 NC1=C2NC(=O)CC2=CC=C1 Z1203579747 [0,1,0,1,0,0|2,0,0]=4 1308 B12R2.202 NC1=C2OC(=O)NC2=CC=C1 Z1198223473 [0,1,0,1,0,0|2,0,0]=4 1309 B12R2.202 NC1=CC2=C(N1)C(=CC=C2)Br Z4503522928 [0,1,0,1,0,0|2,0,0]=4 1310 B12R2.202 NC1=NC2=C(O1)C(=CC=C2)Br Z1269218339 [0,1,0,1,0,0|2,0,0]=4 1311 B12R2.202 NC1=NC2=C(O1)C=CC=C2O Z1258981820 [0,1,0,1,0,0|2,0,0]=4 1312 B12R2.202 O=C1CC2=C(C=CC=C2N1)Br Z1269158294 [0,1,0,1,0,0|2,0,0]=4 1313 B12R2.202 O=C1CC2=C(C=CC=C2N1)O Z1198161564 [0,1,0,1,0,0|1,0,0]=3 1314 B12R2.202 O=C1CC2=CC=CC(=C2N1)Br Z1269179204 [0,1,0,1,0,0|2,0,0]=4 1315 B12R2.202 O=C1CC2=CC=CC(=C2O1)Br Z2489234207 [0,1,0,1,0,0|1,0,0]=3 1316 B12R2.202 O=C1NC2=C(C=CC=C2O1)Br Z1509211819 [0,1,0,1,0,0|2,0,0]=4 1317 B12R2.202 O=C1NC2=CC=CC(=C2N1)O Z1504677969 [0,1,0,1,0,0|2,0,0]=4 1318 B12R2.202 O=C1NC2=CC=CC(=C2O1)Br Z1269211846 [0,1,0,1,0,0|2,0,0]=4 1319 B12R2.202 O=C1NC2=CC=CC(=C2O1)F Z1255387806 [0,1,0,1,0,0|2,0,0]=4 1320 B12R2.202 OC1=C2C=C(SC2=CC=C1)Br Z2582394723 [0,1,0,1,0,0|1,0,1]=4 1321 B12R2.202 OC1=C2N=C(OC2=CC=C1)S Z3235037659 [0,1,0,1,0,0|2,0,0]=4 1322 B12R2.202 OC1=C2SC(=CC2=CC=N1)Br Z3241734462 [0,1,0,1,0,0|2,0,0]=4 1323 B12R2.202 OC1=CC=CC2=C1N=C(O2)O Z1322795564 [0,1,0,1,0,0|2,0,0]=4 1324 B12R2.202 SC1=NC2=C(O1)C(=CC=C2)Cl Z1720684812 [0,1,0,1,0,0|2,0,0]=4 1325 B12R2.1081 BrC1=C2C=CN=CC2=CC=C1 Z57204608 [0,1,0,1,0,0|1,0,1]=4 1326 B12R2.1081 BrC1=C2C=NC=CC2=CC=C1 Z1269224644 [0,1,0,1,0,0|1,0,1]=4 1327 B12R2.1081 BrC1=C2N=CC=CC2=CC=C1 Z839152792 [0,1,0,1,0,0|1,0,1]=4 1328 B12R2.1081 BrC1=C2N=CC=NC2=CC=C1 Z1269202681 [0,1,0,1,0,0|2,0,0]=4 1329 B12R2.1081 BrC1=C2OCCCC2=CC=C1 Z1269242001 [0,1,0,1,0,0|0,0,2]=4 1330 B12R2.1081 CC1=C2C=CC=CC2=CC=C1 Z104475342 [0,1,0,1,0,0|1,0,1]=4 1331 B12R2.1081 CC1=C2C=CC=CC2=NC=C1 Z104472668 [0,1,0,1,0,0|1,0,1]=4 1332 B12R2.1081 ClC1=C2C=CC=CC2=CC=C1 Z104504716 [0,1,0,1,0,0|1,0,1]=4 1333 B12R2.1081 ClC1=C2C=CC=CC2=NC=C1 Z431511604 [0,1,0,1,0,0|1,0,1]=4 1334 B12R2.1081 ClC1=C2C=CN=CC2=CC=C1 Z1255446597 [0,1,0,1,0,0|1,0,1]=4 1335 B12R2.1081 ClC1=C2C=NC=CC2=CC=C1 Z1201624136 [0,1,0,1,0,0|1,0,1]=4 1336 B12R2.1081 ClC1=C2N=CC=CC2=CC=C1 Z362567890 [0,1,0,1,0,0|1,0,1]=4 1337 B12R2.1081 FC1=C2C=CC=CC2=CC=C1 Z1162445957 [0,1,0,1,0,0|1,0,1]=4 1338 B12R2.1081 FC1=C2C=NC=CC2=CC=C1 Z916812496 [0,1,0,1,0,0|1,0,1]=4 1339 B12R2.1081 FC1=C2N=CC=CC2=CC=C1 Z243277338 [0,1,0,1,0,0|1,0,1]=4 1340 B12R2.1081 FC1=C2N=CC=NC2=CC=C1 Z1198266668 [0,1,0,1,0,0|2,0,0]=4 1341 B12R2.1081 IC1=C2C=CC=NC2=CC=C1 Z381540734 [0,1,0,1,0,0|1,0,1]=4 1342 B12R2.1081 NC1=C2C=CC=CC2=CC=C1 Z57127984 [0,1,0,1,0,0|1,0,1]=4 1343 B12R2.1081 NC1=C2C=CC=CC2=NC=C1 Z381037214 [0,1,0,1,0,0|1,0,1]=4 1344 B12R2.1081 NC1=C2C=CC=NC2=CC=C1 Z56919160 [0,1,0,1,0,0|1,0,1]=4 1345 B12R2.1081 NC1=C2C=CN=CC2=CC=C1 Z104472972 [0,1,0,1,0,0|1,0,1]=4 1346 B12R2.1081 NC1=C2C=NC=CC2=CC=C1 Z1201619572 [0,1,0,1,0,0|1,0,1]=4 1347 B12R2.1081 NC1=C2N=CC=CC2=CC=C1 Z57032752 [0,1,0,1,0,0|1,0,1]=4 1348 B12R2.1081 NC1=C2N=CC=NC2=CC=C1 Z1198157683 [0,1,0,1,0,0|2,0,0]=4 1349 B12R2.1081 NC1=C2OCCCC2=CC=C1 Z1723491871 [0,1,0,1,0,0|0,0,2]=4 1350 B12R2.1081 NC1CCOC2=C1C=CC=C2 Z85923435 [0,1,0,1,0,0|0,0,2]=4 1351 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 Z1442208747 [0,1,0,1,0,0|0,0,2]=4 1352 B12R2.1081 N[N+]1=C2C=CC=CC2=CC=C1 Z56760714 [0,1,0,1,0,0|1,0,1]=4 1353 B12R2.1081 O=C1C=COC2=C1C=CC=C2 Z1218937140 [0,1,0,1,0,0|0,0,1]=3 1354 B12R2.1081 OB1OCCC2=C1C=CC=C2 Z1201624582 [0,1,0,1,0,0|1,0,1]=4 1355 B12R2.1081 OC1=C2C=CC=CC2=CC=C1 Z104474036 [0,1,0,1,0,0|0,0,1]=3 1356 B12R2.1081 OC1=C2C=CC=CC2=CN=C1 Z1198152661 [0,1,0,1,0,0|1,0,1]=4 1357 B12R2.1081 OC1=C2C=CC=CC2=NC=C1 Z818727120 [0,1,0,1,0,0|1,0,0]=3 1358 B12R2.1081 OC1=C2C=CC=CC2=NN=C1 Z104495104 [0,1,0,1,0,0|2,0,0]=4 1359 B12R2.1081 OC1=C2C=CC=NC2=NC=C1 Z1198181777 [0,1,0,1,0,0|1,0,1]=4 1360 B12R2.1081 OC1=C2C=NC=CC2=CC=C1 Z5141131098 [0,1,0,1,0,0|0,0,1]=3 1361 B12R2.1081 OC1=C2C=NC=CC2=NC=C1 Z1335657679 [0,1,0,1,0,0|1,0,1]=4 1362 B12R2.1081 OC1=C2C=NC=NC2=CC=C1 Z1198155756 [0,1,0,1,0,0|1,0,1]=4 1363 B12R2.1081 OC1=C2CCCCC2=CC=C1 Z274762958 [0,1,0,1,0,0|0,0,2]=4 1364 B12R2.1081 OC1=C2CCCNC2=CC=C1 Z1203731295 [0,1,0,1,0,0|0,0,2]=4 1365 B12R2.1081 OC1=C2CCNCC2=CC=C1 Z2313108218 [0,1,0,1,0,0|0,0,2]=4 1366 B12R2.1081 OC1=C2CCOCC2=CC=C1 Z1255506128 [0,1,0,1,0,0|0,0,2]=4 1367 B12R2.1081 OC1=C2CNCCC2=CC=C1 Z3243654680 [0,1,0,1,0,0|0,0,2]=4 1368 B12R2.1081 OC1=C2N=CC=CC2=CC=C1 Z56926518 [0,1,0,1,0,0|0,0,1]=3 1369 B12R2.1081 OC1=C2N=CC=CC2=CC=N1 Z1201626988 [0,1,0,1,0,0|1,0,1]=4 1370 B12R2.1081 OC1=C2N=CC=CC2=NC=C1 Z1198152632 [0,1,0,1,0,0|1,0,1]=4 1371 B12R2.1081 OC1=C2NCCCC2=CC=C1 Z57001601 [0,1,0,1,0,0|0,0,2]=4 1372 B12R2.1081 OC1=C2OCCCC2=CC=C1 Z1198726643 [0,1,0,1,0,0|0,0,2]=4 1373 B12R2.1081 OC1=C2OCCOC2=CC=C1 Z1069599524 [0,1,0,1,0,0|1,0,1]=4 1374 B12R2.1081 OC1CCCC2=C1C=CC=C2 Z56899171 [0,1,0,1,0,0|0,0,2]=4 1375 B12R2.1081 OC1CCOC2=C1C=CC=C2 Z335244980 [0,1,0,1,0,0|0,0,2]=4 1376 B12R2.1081 OC1COCC2=C1C=CC=C2 Z1255366473 [0,1,0,1,0,0|1,0,1]=4 1377 B12R2.1081 OC1CSCC2=C1C=CC=C2 Z445987402 [0,1,0,1,0,0|1,0,1]=4 1378 B12R2.1081 O[C@@H]1CCOC2=C1C=CC=C2 Z959151866 [0,1,0,1,0,0|0,0,2]=4 1379 B12R2.1081 O[C@H]1CCOC2=C1C=CC=C2 Z959151868 [0,1,0,1,0,0|0,0,2]=4 1380 B12R2.1081 S=C1C=CNC2=C1C=CC=C2 Z1258992692 [0,1,0,1,0,0|1,0,1]=4 1381 B12R2.24 BrC1=CC2=C(C=C1)N=CC=C2 Z732220500 [0,1,0,1,0,0|1,0,1]=4 1382 B12R2.24 BrC1=CC2=C(C=C1)N=CC=N2 Z1262255201 [0,1,0,1,0,0|2,0,0]=4 1383 B12R2.24 BrC1=CC2=C(C=CC=C2)C=C1 Z166622678 [0,1,0,1,0,0|1,0,1]=4 1384 B12R2.24 BrC1=CC2=C(C=CC=C2)N=C1 Z337707764 [0,1,0,1,0,0|1,0,1]=4 1385 B12R2.24 BrC1=NC2=C(C=CC=C2)N=C1 Z979455958 [0,1,0,1,0,0|2,0,0]=4 1386 B12R2.24 CC1=CC2=C(C=C1)N=CC=C2 Z277960616 [0,1,0,1,0,0|1,0,1]=4 1387 B12R2.24 CC1=CC2=C(C=C1)OCCC2 Z939648534 [0,1,0,1,0,0|0,0,2]=4 1388 B12R2.24 CC1=CC2=C(C=CC=C2)C=C1 Z104476894 [0,1,0,1,0,0|1,0,1]=4 1389 B12R2.24 CC1=CC2=C(C=CC=C2)N=C1 Z1217215047 [0,1,0,1,0,0|1,0,1]=4 1390 B12R2.24 CC1=NC2=C(C=CC=C2)C=C1 Z56926563 [0,1,0,1,0,0|1,0,1]=4 1391 B12R2.24 CC1=NC2=C(C=CC=C2)N=C1 Z1255423472 [0,1,0,1,0,0|2,0,0]=4 1392 B12R2.24 CC1=NC2=C(C=CC=C2)SC1 Z2895174345 [0,1,0,1,0,0|1,0,1]=4 1393 B12R2.24 CC1CNC2=C(O1)C=CC=C2 Z1165160777 [0,1,0,1,0,0|0,0,2]=4 1394 B12R2.24 ClC1=CC2=C(C=C1)N=CC=C2 Z425469218 [0,1,0,1,0,0|1,0,1]=4 1395 B12R2.24 ClC1=CC2=C(C=CC=C2)C=C1 Z1255485910 [0,1,0,1,0,0|1,0,1]=4 1396 B12R2.24 ClC1=NC2=C(C=CC=C2)N=C1 Z240126804 [0,1,0,1,0,0|2,0,0]=4 1397 B12R2.24 FC1=CC2=C(C=C1)N=CC=C2 Z361878560 [0,1,0,1,0,0|1,0,1]=4 1398 B12R2.24 FC1=NC2=C(C=CC=C2)N=C1 Z1255428916 [0,1,0,1,0,0|2,0,0]=4 1399 B12R2.24 IC1=CC2=C(C=C1)N=CC=C2 Z993990690 [0,1,0,1,0,0|1,0,1]=4 1400 B12R2.24 IC1=CC2=C(C=CC=C2)N=C1 Z1172379319 [0,1,0,1,0,0|1,0,1]=4 1401 B12R2.24 NC1=CC2=C(C=C1)N=CC=C2 Z255114686 [0,1,0,1,0,0|1,0,1]=4 1402 B12R2.24 NC1=CC2=C(C=C1)N=CC=N2 Z445162266 [0,1,0,1,0,0|2,0,0]=4 1403 B12R2.24 NC1=CC2=C(C=C1)OCCC2 Z728136682 [0,1,0,1,0,0|0,0,2]=4 1404 B12R2.24 NC1=CC2=C(C=CC=C2)C=C1 Z104494980 [0,1,0,1,0,0|1,0,1]=4 1405 B12R2.24 NC1=CC2=C(C=CC=C2)N=C1 Z234895085 [0,1,0,1,0,0|1,0,1]=4 1406 B12R2.24 NC1=CC2=C(C=CC=N2)C=C1 Z3069264308 [0,1,0,1,0,0|1,0,1]=4 1407 B12R2.24 NC1=NC2=C(C=CC=C2)C=C1 Z56347237 [0,1,0,1,0,0|1,0,1]=4 1408 B12R2.24 NC1=NC2=C(C=CC=C2)CS1 Z1198725303 [0,1,0,1,0,0|2,0,0]=4 1409 B12R2.24 NC1=NC2=C(C=CC=C2)N=C1 Z979455432 [0,1,0,1,0,0|2,0,0]=4 1410 B12R2.24 NC1COC2=C(C1)C=CC=C2 Z415636540 [0,1,0,1,0,0|0,0,2]=4 1411 B12R2.24 O=C1C=CC2=C(N1)C=CC=C2 Z57473020 [0,1,0,1,0,0|1,0,1]=4 1412 B12R2.24 O=C1C=CC2=C(O1)C=CC=C2 Z57169486 [0,1,0,1,0,0|0,0,1]=3 1413 B12R2.24 O=C1C=NC2=C(N1)C=CC=C2 Z56824051 [0,1,0,1,0,0|2,0,0]=4 1414 B12R2.24 O=C1CC2=C(C=CC=C2)CN1 Z1201622353 [0,1,0,1,0,0|2,0,0]=4 1415 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 Z1255486033 [0,1,0,1,0,0|1,0,0]=3 1416 B12R2.24 O=C1CCC2=C(C1)C=CC=C2 Z104495562 [0,1,0,1,0,0|1,0,1]=4 1417 B12R2.24 O=C1CCC2=C(N1)C=CC=C2 Z85917566 [0,1,0,1,0,0|1,0,1]=4 1418 B12R2.24 O=C1CCC2=C(O1)C=CC=C2 Z586249466 [0,1,0,1,0,0|0,0,1]=3 1419 B12R2.24 O=C1CNC2=C(N1)C=CC=C2 Z56990723 [0,1,0,1,0,0|2,0,0]=4 1420 B12R2.24 O=C1COC2=C(N1)C=CC=C2 Z56989567 [0,1,0,1,0,0|1,0,1]=4 1421 B12R2.24 O=C1CSC2=C(N1)C=CC=C2 Z55120717 [0,1,0,1,0,0|2,0,0]=4 1422 B12R2.24 O=C1NC2=C(C=CC=C2)CO1 Z1198157416 [0,1,0,1,0,0|2,0,0]=4 1423 B12R2.24 O=C1NCC2=C(O1)C=CC=C2 Z1198723657 [0,1,0,1,0,0|1,0,0]=3 1424 B12R2.24 OC1=CC2=C(C=C1)N=CC=C2 Z759294450 [0,1,0,1,0,0|1,0,1]=4 1425 B12R2.24 OC1=CC2=C(C=C1)N=CC=N2 Z636018680 [0,1,0,1,0,0|2,0,0]=4 1426 B12R2.24 OC1=CC2=C(C=C1)OCCC2 Z1201627010 [0,1,0,1,0,0|0,0,2]=4 1427 B12R2.24 OC1=CC2=C(C=CC=C2)C=C1 Z57127515 [0,1,0,1,0,0|1,0,1]=4 1428 B12R2.24 OC1=CC2=C(C=CC=C2)N=C1 Z1255419538 [0,1,0,1,0,0|1,0,1]=4 1429 B12R2.24 S=C1NC2=C(C=CC=C2)CS1 Z367678726 [0,1,0,1,0,0|2,0,0]=4 1430 B12R2.24 SC1=NC2=C(C=CC=C2)C=C1 Z203045038 [0,1,0,1,0,0|1,0,1]=4 1431 B12R2.24 SC1=NC2=C(C=CC=C2)N=C1 Z119989150 [0,1,0,1,0,0|2,0,0]=4 1432 B12R2.32 CNC1=NC2=C(O1)C=CC=C2 Z235341203 [0,1,0,1,0,0|1,0,1]=4 1433 B12R2.32 ClCC1CC2=C(O1)C=CC=C2 Z397587656 [0,1,0,1,0,0|0,0,2]=4 1434 B12R2.32 N#CC1=CC2=C(O1)C=CC=C2 Z381355152 [0,1,0,1,0,0|0,0,2]=4 1435 B12R2.32 N#CC1=NC2=C(O1)C=CC=C2 Z1198309541 [0,1,0,1,0,0|1,0,1]=4 1436 B12R2.32 NCC1=NC2=C(O1)C=CC=C2 Z2106602610 [0,1,0,1,0,0|1,0,1]=4 1437 B12R2.32 NCC1CC2=C(O1)C=CC=C2 Z291234246 [0,1,0,1,0,0|0,0,2]=4 1438 B12R2.32 NNC1=NC2=C(O1)C=CC=C2 Z56801289 [0,1,0,1,0,0|2,0,0]=4 1439 B12R2.32 O=CC1=CC2=C(N1)C=CC=C2 Z1203160203 [0,1,0,1,0,0|1,0,1]=4 1440 B12R2.32 O=CC1=CC2=C(O1)C=CC=C2 Z147641868 [0,1,0,1,0,0|0,0,1]=3 1441 B12R2.32 O=CC1=CC2=C(O1)C=CC=N2 Z1198330026 [0,1,0,1,0,0|1,0,1]=4 1442 B12R2.32 O=CC1=CC2=C(O1)C=CN=C2 Z1255417643 [0,1,0,1,0,0|1,0,1]=4 1443 B12R2.32 O=CC1=CC2=C(O1)N=CC=C2 Z1255505540 [0,1,0,1,0,0|1,0,1]=4 1444 B12R2.32 O=CC1=CC2=C(S1)C=CC=C2 Z1741961424 [0,1,0,1,0,0|0,1,1]=4 1445 B12R2.32 O=CC1=NC2=C(N1)C=CC=C2 Z57114985 [0,1,0,1,0,0|2,0,0]=4 1446 B12R2.32 O=CC1=NC2=C(O1)C=CC=C2 Z1198162173 [0,1,0,1,0,0|1,0,0]=3 1447 B12R2.32 O=CC1=NC2=C(S1)C=CC=C2 Z276151160 [0,1,0,1,0,0|1,1,0]=4 1448 B12R2.32 O=CC1CC2=C(C1)C=CC=C2 Z1255436588 [0,1,0,1,0,0|1,0,1]=4 1449 B12R2.32 O=CN1CC2=C(C1)C=CC=C2 Z1216818057 [0,1,0,1,0,0|2,0,0]=4 1450 B12R2.32 OCC1=CC2=C(O1)C=CC=C2 Z164677912 [0,1,0,1,0,0|0,0,2]=4 1451 B12R2.32 OCC1=NC2=C(O1)C=CC=C2 Z431953250 [0,1,0,1,0,0|1,0,1]=4 1452 B12R2.32 OCC1CC2=C(O1)C=CC=C2 Z397587206 [0,1,0,1,0,0|0,0,2]=4 1453 B12R2.196 CC1=C2CCC(=O)C2=CC=C1 Z334686316 [0,1,0,1,0,0|1,0,1]=4 1454 B12R2.196 CC1=CSC2=C1C=CC=C2Br Z1269175775 [0,1,0,1,0,0|2,0,0]=4 1455 B12R2.196 CC1=CSC2=C1C=CC=C2N Z4952832526 [0,1,0,1,0,0|2,0,0]=4 1456 B12R2.196 CN1C=NC2=C1C=CC=C2O Z1824511324 [0,1,0,1,0,0|1,0,1]=4 1457 B12R2.196 ClC1=C2NC=C(C2=CC=C1)Br Z1269127355 [0,1,0,1,0,0|2,0,0]=4 1458 B12R2.196 FC1=C2SC=C(C2=CC=C1)Br Z3244825551 [0,1,0,1,0,0|2,0,0]=4 1459 B12R2.196 NC1=C2CCC(=O)C2=CC=C1 Z5097408049 [0,1,0,1,0,0|1,0,1]=4 1460 B12R2.196 NC1=C2CNC(=O)C2=CC=C1 Z1198176565 [0,1,0,1,0,0|2,0,0]=4 1461 B12R2.196 NC1=C2COC(=O)C2=CC=C1 Z1198164599 [0,1,0,1,0,0|2,0,0]=4 1462 B12R2.196 NC1CCC2=C(C=CC=C12)O Z317054124 [0,1,0,1,0,0|0,0,2]=4 1463 B12R2.196 O=C1CCC2=C(C=CC=C12)Br Z334686326 [0,1,0,1,0,0|1,0,1]=4 1464 B12R2.196 O=C1CCC2=C(C=CC=C12)Cl Z234895081 [0,1,0,1,0,0|1,0,1]=4 1465 B12R2.196 O=C1CCC2=C(C=CC=C12)F Z334686322 [0,1,0,1,0,0|1,0,1]=4 1466 B12R2.196 O=C1CCC2=C(C=CC=C12)O Z203881856 [0,1,0,1,0,0|0,0,1]=3 1467 B12R2.196 O=C1COC2=C(C=CC=C12)Br Z334863098 [0,1,0,1,0,0|2,0,0]=4 1468 B12R2.196 O=C1COC2=C(C=CC=C12)Cl Z334863094 [0,1,0,1,0,0|2,0,0]=4 1469 B12R2.196 O=C1NCC2=C(C=CC=C12)Br Z1258930120 [0,1,0,1,0,0|2,0,0]=4 1470 B12R2.196 O=C1NCC2=C(C=CC=C12)Cl Z1198221042 [0,1,0,1,0,0|2,0,0]=4 1471 B12R2.196 O=C1NCC2=C(C=CC=C12)F Z1255380598 [0,1,0,1,0,0|2,0,0]=4 1472 B12R2.196 O=C1NCC2=C(C=CC=C12)O Z1741980680 [0,1,0,1,0,0|1,0,0]=3 1473 B12R2.196 OB1OCC2=C(C=CC=C12)O Z1513908647 [0,1,0,1,0,0|2,0,0]=4 1474 B12R2.196 OC1=C2SC=C(C2=CC=N1)Br Z2719319246 [0,1,0,1,0,0|2,0,0]=4 1475 B12R2.1 C=CN1C=NC2=C1C=CC=C2 Z87001578 [0,1,0,1,0,0|2,0,0]=4 1476 B12R2.1 NCC1COC2=C1C=CC=C2 Z1197877490 [0,1,0,1,0,0|1,0,1]=4 1477 B12R2.1 NCC1OCC2=C1C=CC=C2 Z2310708138 [0,1,0,1,0,0|1,0,1]=4 1478 B12R2.1 O=CC1=COC2=C1C=CC=C2 Z1197879644 [0,1,0,1,0,0|1,0,1]=4 1479 B12R2.1 O=CC1CCC2=C1C=CC=C2 Z1070003774 [0,1,0,1,0,0|2,0,0]=4 1480 B12R2.18 CC1C(=O)NC2=C1C=CC=C2 Z425452744 [0,1,0,1,0,0|2,0,0]=4 1481 B12R2.18 CC1OC2=C(C1N)C=CC=C2 Z2160887371 [0,1,0,1,0,0|0,0,2]=4 1482 B12R2.18 CN1C(=O)CC2=C1C=CC=C2 Z56899025 [0,1,0,1,0,0|2,0,0]=4 1483 B12R2.18 NC1CC2=C(C1O)C=CC=C2 Z1431905060 [0,1,0,1,0,0|1,0,1]=4 1484 B12R2.18 N[C@@H]1CC2=C([C@H]1O)C=CC=C2 Z2307327484 [0,1,0,1,0,0|1,0,1]=4 1485 B12R2.18 O=C1NC2=C(C1O)C=CC=C2 Z335244966 [0,1,0,1,0,0|2,0,0]=4 1486 B12R2.18 O=C1NC2=C(N1O)C=CC=C2 Z1416184382 [0,1,0,1,0,0|2,0,0]=4 1487 B12R2.18 OC1C2=C(C=CC=C2)CC1Br Z104485720 [0,1,0,1,0,0|1,0,1]=4 1488 B12R2.18 OC1C2=C(C=CC=C2)CC1F Z1509011291 [0,1,0,1,0,0|1,0,1]=4 1489 B12R2.315 CNC1=C2NC=CC2=CC=C1 Z2690350437 [0,1,0,1,0,0|2,0,0]=4 1490 B12R2.315 COC1=C2C=CNC2=CC=C1 Z1203730757 [0,1,0,1,0,0|1,0,1]=4 1491 B12R2.315 COC1=C2CNCC2=CC=C1 Z1198279844 [0,1,0,1,0,0|1,0,1]=4 1492 B12R2.315 COC1=C2N=CNC2=CC=C1 Z1198182091 [0,1,0,1,0,0|2,0,0]=4 1493 B12R2.315 COC1=C2NC=CC2=CC=C1 Z1192378717 [0,1,0,1,0,0|1,0,0]=3 1494 B12R2.315 COC1=C2NC=CC2=CC=N1 Z1203734686 [0,1,0,1,0,0|2,0,0]=4 1495 B12R2.315 COC1=C2NN=CC2=CC=C1 Z1198182195 [0,1,0,1,0,0|2,0,0]=4 1496 B12R2.315 COC1=CC=CN2C1=NC=C2 Z4991178671 [0,1,0,1,0,0|2,0,0]=4 1497 B12R2.315 N#CC1=C2NC=CC2=CC=C1 Z1198155196 [0,1,0,1,0,0|2,0,0]=4 1498 B12R2.315 NCC1=C2NC=CC2=CC=C1 Z1801307851 [0,1,0,1,0,0|2,0,0]=4 1499 B12R2.315 NCC1=C2SC=CC2=CC=C1 Z2429425576 [0,1,0,1,0,0|2,0,0]=4 1500 B12R2.315 O=CC1=C2NC=CC2=CC=C1 Z1065768468 [0,1,0,1,0,0|1,0,1]=4 1501 B12R2.315 O=CC1=C2OC=CC2=CC=C1 Z1198176767 [0,1,0,1,0,0|1,0,1]=4 1502 B12R2.315 O=CC1=C2SC=CC2=CC=C1 Z1201624702 [0,1,0,1,0,0|1,0,1]=4 1503 B12R2.315 OCC1=C2C=CSC2=CC=C1 Z1255453706 [0,1,0,1,0,0|1,0,1]=4 1504 B12R2.315 OCC1=C2CCNC2=CC=C1 Z1255489218 [0,1,0,1,0,0|1,0,1]=4 1505 B12R2.315 OCC1=C2N=CNC2=CC=C1 Z1203733033 [0,1,0,1,0,0|2,0,0]=4 1506 B12R2.315 OCC1=C2NN=CC2=CC=C1 Z1198309335 [0,1,0,1,0,0|2,0,0]=4 1507 B12R2.2048 COC1=C(C=CC=C1)[C@@H]2CO2 Z1574937225 [0,1,0,1,0,0|1,0,1]=4 1508 B12R2.246 CC1=C2NC=CC2=CC(=C1)F Z1198280275 [0,1,0,1,0,0|2,0,0]=4 1509 B12R2.246 CC1=C2NC=CC2=CC(=C1)O Z1203832444 [0,1,0,1,0,0|2,0,0]=4 1510 B12R2.246 CC1=C2OC=CC2=CC(=C1)N Z5411283142 [0,1,0,1,0,0|2,0,0]=4 1511 B12R2.246 CC1=C2SC=CC2=CC(=C1)N Z4956162368 [0,1,0,1,0,0|2,0,0]=4 1512 B12R2.246 CC1=CC2=C(NC=C2)C(=C1)F Z1203748018 [0,1,0,1,0,0|2,0,0]=4 1513 B12R2.246 CC1=CC2=C(OC=C2)C(=C1)Br Z1269228041 [0,1,0,1,0,0|2,0,0]=4 1514 B12R2.246 FC1=CC2=C(NC=C2)C(=C1)F Z1201620809 [0,1,0,1,0,0|2,0,0]=4 1515 B12R2.246 FC1=CC2=C(OC=C2)C(=C1)Br Z1269233160 [0,1,0,1,0,0|2,0,0]=4 1516 B12R2.606 CC1=CC2=C(C=C1)N=C(O2)N Z979487656 [0,1,0,1,0,0|2,0,0]=4 1517 B12R2.606 CC1=CC2=C(C=C1)NC(=N)C2 Z4603464626 [0,1,0,1,0,0|2,0,0]=4 1518 B12R2.606 CC1=CC2=C(C=C1)OC(=N2)S Z56864608 [0,1,0,1,0,0|2,0,0]=4 1519 B12R2.606 CC1=CC2=C(C=C1)OC(=O)N2 Z274568258 [0,1,0,1,0,0|2,0,0]=4 1520 B12R2.606 CC1=CC2=C(O1)C=CC(=C2)Br Z1269240413 [0,1,0,1,0,0|0,0,2]=4 1521 B12R2.606 CC1=CC2=C(O1)C=CC(=C2)I Z1269130980 [0,1,0,1,0,0|0,0,2]=4 1522 B12R2.606 CC1=CC2=C(O1)C=CC(=C2)N Z2106607528 [0,1,0,1,0,0|0,0,2]=4 1523 B12R2.606 CC1=NC2=C(O1)C=C(C=C2)N Z235353833 [0,1,0,1,0,0|1,0,1]=4 1524 B12R2.606 CC1=NC2=C(O1)C=C(C=C2)O Z1201620245 [0,1,0,1,0,0|1,0,1]=4 1525 B12R2.606 CC1=NC2=C(O1)C=CC(=C2)Br Z1203159513 [0,1,0,1,0,0|1,0,1]=4 1526 B12R2.606 CC1=NC2=C(O1)C=CC(=C2)Cl Z104486454 [0,1,0,1,0,0|1,0,1]=4 1527 B12R2.606 CC1CC2=C(O1)C=CC(=C2)Br Z409451514 [0,1,0,1,0,0|0,0,2]=4 1528 B12R2.606 CC1CC2=C(O1)C=CC(=C2)N Z2888802910 [0,1,0,1,0,0|0,0,2]=4 1529 B12R2.606 CC1CC2=C(O1)C=CC(=C2)O Z1513815985 [0,1,0,1,0,0|0,0,2]=4 1530 B12R2.606 FC1=CC2=C(C=C1)N=C(O2)S Z1147226283 [0,1,0,1,0,0|2,0,0]=4 1531 B12R2.606 N=C1OC2=C(S1)C=C(C=C2)O Z1513863695 [0,1,0,1,0,0|2,0,0]=4 1532 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 Z2805701617 [0,1,0,1,0,0|2,0,0]=4 1533 B12R2.606 NC1=CC2=C(C=C1)N=C(O2)S Z1198180819 [0,1,0,1,0,0|2,0,0]=4 1534 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 Z2768165443 [0,1,0,1,0,0|2,0,0]=4 1535 B12R2.606 NC1=CC2=C(C=C1)OC(=O)N2 Z56944506 [0,1,0,1,0,0|2,0,0]=4 1536 B12R2.606 NC1=NC2=C(O1)C=C(C=C2)Br Z1269173847 [0,1,0,1,0,0|2,0,0]=4 1537 B12R2.606 NC1=NC2=C(O1)C=C(C=C2)F Z1147226282 [0,1,0,1,0,0|2,0,0]=4 1538 B12R2.606 NC1=NC2=C(O1)C=CC(=C2)Br Z359373114 [0,1,0,1,0,0|2,0,0]=4 1539 B12R2.606 NC1=NC2=C(O1)C=CC(=C2)Cl Z89267039 [0,1,0,1,0,0|2,0,0]=4 1540 B12R2.606 NC1=NC2=C(O1)C=CC(=C2)F Z979487600 [0,1,0,1,0,0|2,0,0]=4 1541 B12R2.606 O=C1CC2=C(N1)C=C(C=C2)Cl Z56922083 [0,1,0,1,0,0|2,0,0]=4 1542 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)Br Z299596076 [0,1,0,1,0,0|2,0,0]=4 1543 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)Cl Z104477028 [0,1,0,1,0,0|2,0,0]=4 1544 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)F Z1255450667 [0,1,0,1,0,0|2,0,0]=4 1545 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)O Z1198147431 [0,1,0,1,0,0|2,0,0]=4 1546 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)Br Z381351238 [0,1,0,1,0,0|2,0,0]=4 1547 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)Cl Z99599674 [0,1,0,1,0,0|2,0,0]=4 1548 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)I Z1269166325 [0,1,0,1,0,0|2,0,0]=4 1549 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)Br Z979488024 [0,1,0,1,0,0|2,0,0]=4 1550 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)Cl Z57183224 [0,1,0,1,0,0|2,0,0]=4 1551 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)F Z979487984 [0,1,0,1,0,0|2,0,0]=4 1552 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)O Z1198314975 [0,1,0,1,0,0|2,0,0]=4 1553 B12R2.606 O=C1OC2=C(O1)C=C(C=C2)Br Z1269212344 [0,1,0,1,0,0|2,0,0]=4 1554 B12R2.606 O=C1OC2=C(O1)C=C(C=C2)O Z1198726972 [0,1,0,1,0,0|2,0,0]=4 1555 B12R2.606 O=C1OC2=C(S1)C=C(C=C2)O Z56801267 [0,1,0,1,0,0|2,0,0]=4 1556 B12R2.606 O=C1OC2=C(S1)C=CC(=C2)O Z104483034 [0,1,0,1,0,0|2,0,0]=4 1557 B12R2.606 SC1=NC2=C(O1)C=C(C=C2)Cl Z56969312 [0,1,0,1,0,0|2,0,0]=4 1558 B12R2.606 SC1=NC2=C(O1)C=CC(=C2)Cl Z56824483 [0,1,0,1,0,0|2,0,0]=4 1559 B12R2.3190 N=C(N)C1CC2=C1C=CC=C2 Z1613477992 [0,1,0,1,0,0|2,0,0]=4 1560 B12R2.221 BrC1=C2C=COC2=C(C=C1)Br Z1551943559 [0,1,0,1,0,0|2,0,0]=4 1561 B12R2.221 CC1=C2C=CNC2=C(C=C1)Br Z1269146528 [0,1,0,1,0,0|2,0,0]=4 1562 B12R2.221 CC1=C2C=CNC2=C(C=C1)C Z1198149116 [0,1,0,1,0,0|2,0,0]=4 1563 B12R2.221 CC1=C2C=CNC2=C(C=C1)Cl Z1201625087 [0,1,0,1,0,0|2,0,0]=4 1564 B12R2.221 CC1=C2C=CNC2=C(C=C1)F Z1509337854 [0,1,0,1,0,0|2,0,0]=4 1565 B12R2.221 CC1=C2NC=CC2=C(C=C1)Cl Z1198182500 [0,1,0,1,0,0|2,0,0]=4 1566 B12R2.221 CC1=C2NC=CC2=C(C=C1)F Z1198182495 [0,1,0,1,0,0|2,0,0]=4 1567 B12R2.221 ClC1=C2C=CNC2=C(C=C1)Br Z1269149090 [0,1,0,1,0,0|2,0,0]=4 1568 B12R2.221 ClC1=C2C=COC2=C(C=C1)Br Z1681376172 [0,1,0,1,0,0|2,0,0]=4 1569 B12R2.221 ClC1=C2OC=CC2=C(C=C1)Br Z1269195555 [0,1,0,1,0,0|2,0,0]=4 1570 B12R2.221 FC1=C2C=CNC2=C(C=C1)F Z1201620808 [0,1,0,1,0,0|2,0,0]=4 1571 B12R2.221 OC1=C2CCOC2=C(C=C1)F Z1255367770 [0,1,0,1,0,0|1,0,1]=4 1572 B12R2.203 CN1C=CC2=C1C(=CC=C2)N Z1203585452 [0,1,0,1,0,0|2,0,0]=4 1573 B12R2.203 OC1=C2C(=CSC2=CC=C1)Br Z1862026502 [0,1,0,1,0,0|1,0,1]=4 1574 B8R1.8 C=CCN1C=CN=C1 Z104477560 [1,0,0,0,1,0|2,0,0]=4 1575 B8R1.8 O=CCC1=CC=CO1 Z1179944709 [1,0,0,0,1,0|2,0,0]=4 1576 B8R1.8 O=CCC1=CC=CS1 Z993017816 [1,0,0,0,1,0|2,0,0]=4 1577 B8R1.8 O=CCC1=CSC=C1 Z1079442684 [1,0,0,0,1,0|2,0,0]=4