0 B10R1.17 BrCCOC1=CC=CC=C1 Z56950513 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.17 CCCCC1=CC=CC=C1 Z104492496 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.17 CCCNC1=CN=CC=C1 Z334882412 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.17 CCNCC1=CC=CC=C1 Z57327176 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.17 CCNCC1=CC=NC=C1 Z57327181 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.17 CCNCC1=NC=CC=C1 Z90513146 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.17 CCSCC1=NC=CC=C1 Z1607601848 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.17 CNCCC1=CC=CC=C1 Z445226260 [0,0,0,0,0,0|1,0,0]=1 8 B10R1.17 CNCCC1=CC=NC=C1 Z235580560 [0,0,0,0,0,0|2,0,0]=2 9 B10R1.17 CNCCC1=CN=CC=C1 Z2418466818 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.17 CNCCC1=NC=CC=C1 Z2238930991 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.17 CNCCC1=NC=CC=N1 Z3023337072 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.17 COCCC1=CC=CC=C1 Z104494216 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.17 N#CCCC1=CC=CC=C1 Z104507980 [0,0,0,0,0,0|1,0,1]=2 14 B10R1.17 N#CCNC1=CC=CC=C1 Z56347332 [0,0,0,0,0,0|2,0,1]=3 15 B10R1.17 N#CCNC1=NC=CC=C1 Z1203732480 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.17 N#CCOC1=CC=CC=C1 Z53792061 [0,0,0,0,0,0|2,0,1]=3 17 B10R1.17 N#CCSC1=CC=CC=C1 Z19751391 [0,0,0,0,0,0|2,0,1]=3 18 B10R1.17 N#CCSC1=NC=CC=C1 Z54336898 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.17 NC/C=C/C1=CC=CC=C1 Z2953771905 [0,0,0,0,0,0|1,0,2]=3 20 B10R1.17 NC/C=C/C1=CN=CC=C1 Z2216303151 [0,0,0,0,0,0|2,0,2]=4 21 B10R1.17 NCC#CC1=CC=CC=C1 Z227964210 [0,0,0,0,0,0|1,0,2]=3 22 B10R1.17 NCC#CC1=NC=CC=C1 Z1456201642 [0,0,0,0,0,0|2,0,2]=4 23 B10R1.17 NCCCC1=CC=CC=C1 Z104478312 [0,0,0,0,0,0|1,0,0]=1 24 B10R1.17 NCCCC1=CN=CC=C1 Z3058301115 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.17 NCCCC1=CN=NC=C1 Z3270187722 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.17 NCCCC1=NC=CC=C1 Z600381818 [0,0,0,0,0,0|2,0,0]=2 27 B10R1.17 NCCCC1=NC=CN=C1 Z1474025943 [0,0,0,0,0,0|3,0,0]=3 28 B10R1.17 NCCNC1=CC=NC=C1 Z317257862 [0,0,0,0,0,0|3,0,0]=3 29 B10R1.17 NCCNC1=NC=CC=C1 Z85923460 [0,0,0,0,0,0|3,0,0]=3 30 B10R1.17 NCCNC1=NC=CC=N1 Z381428982 [0,0,0,0,0,0|4,0,0]=4 31 B10R1.17 NCCNC1=NN=CC=C1 Z991530796 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.17 NCCOC1=CC=CC=C1 Z355423232 [0,0,0,0,0,0|2,0,0]=2 33 B10R1.17 NCCOC1=CC=NC=C1 Z3243651499 [0,0,0,0,0,0|3,0,0]=3 34 B10R1.17 NCCOC1=CN=CC=C1 Z429662874 [0,0,0,0,0,0|3,0,0]=3 35 B10R1.17 NCCOC1=NC=CC=N1 Z4381809298 [0,0,0,0,0,0|4,0,0]=4 36 B10R1.17 NCCSC1=CC=CC=C1 Z57970213 [0,0,0,0,0,0|2,0,0]=2 37 B10R1.17 NNCCC1=CC=CC=C1 Z927192062 [0,0,0,0,0,0|0,0,0]=0 38 B10R1.17 O=C/C=C/C1=CC=CC=C1 Z3219847383 [0,0,0,0,0,0|2,0,2]=4 39 B10R1.17 O=CC#CC1=CC=CC=C1 Z1255485337 [0,0,0,0,0,0|2,0,2]=4 40 B10R1.17 O=CCCC1=CC=CC=C1 Z87002472 [0,0,0,0,0,0|2,0,0]=2 41 B10R1.17 O=CCCC1=CC=NC=C1 Z1070006438 [0,0,0,0,0,0|3,0,0]=3 42 B10R1.17 O=CCCC1=CN=CC=C1 Z1198276578 [0,0,0,0,0,0|3,0,0]=3 43 B10R1.17 O=CCCC1=NC=CC=C1 Z1079158816 [0,0,0,0,0,0|3,0,0]=3 44 B10R1.17 O=CCOC1=CC=CC=C1 Z854102570 [0,0,0,0,0,0|3,0,0]=3 45 B10R1.17 O=CCOC1=NC=CC=C1 Z1255434510 [0,0,0,0,0,0|4,0,0]=4 46 B10R1.17 O=CNCC1=CC=CC=C1 Z1203730748 [0,0,0,0,0,0|3,0,0]=3 47 B10R1.17 O=CNNC1=CC=CC=C1 Z1198148433 [0,0,0,0,0,0|4,0,0]=4 48 B10R1.17 OC/C=C/C1=CC=CC=C1 Z104473562 [0,0,0,0,0,0|2,0,2]=4 49 B10R1.17 OCCCC1=CC=CC=C1 Z104476660 [0,0,0,0,0,0|2,0,0]=2 50 B10R1.17 OCCCC1=CC=NC=C1 Z104475752 [0,0,0,0,0,0|3,0,0]=3 51 B10R1.17 OCCCC1=CN=CC=C1 Z104479004 [0,0,0,0,0,0|3,0,0]=3 52 B10R1.17 OCCCC1=NC=NC=C1 Z2044799287 [0,0,0,0,0,0|4,0,0]=4 53 B10R1.17 OCCNC1=CC=NC=C1 Z359301874 [0,0,0,0,0,0|4,0,0]=4 54 B10R1.17 OCCNC1=NC=CC=C1 Z31212159 [0,0,0,0,0,0|4,0,0]=4 55 B10R1.17 OCCOC1=CC=CC=C1 Z104473570 [0,0,0,0,0,0|3,0,0]=3 56 B10R1.17 OCCOC1=CN=CC=C1 Z1180078238 [0,0,0,0,0,0|4,0,0]=4 57 B10R1.17 OCCSC1=CC=CC=C1 Z149157348 [0,0,0,0,0,0|3,0,0]=3 58 B10R1.17 S=C=NCC1=CC=CC=C1 Z56869309 [0,0,0,0,0,0|3,0,0]=3 59 B9R1.8 CCCC1=CC=CC=C1 Z104479154 [1,0,0,0,0,0|1,0,0]=2 60 B9R1.8 CCCC1=NC=CC=C1 Z1255434741 [1,0,0,0,0,0|2,0,0]=3 61 B9R1.8 CCCC1=NN=CC=C1 Z1486025396 [1,0,0,0,0,0|3,0,0]=4 62 B9R1.8 CCNC1=CC=CC=C1 Z104472482 [1,0,0,0,0,0|2,0,0]=3 63 B9R1.8 CCNC1=CC=NC=C1 Z359297730 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.8 CCNC1=CN=CC=C1 Z334882416 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.8 CCSC1=CC=NC=C1 Z1376454759 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.8 CNCC1=CC=NC=C1 Z57390007 [1,0,0,0,0,0|2,0,0]=3 67 B9R1.8 CNCC1=CN=CC=C1 Z56963341 [1,0,0,0,0,0|2,0,0]=3 68 B9R1.8 CNCC1=NC=CC=N1 Z2310727788 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.8 CNCC1=NC=CN=C1 Z385447136 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.8 CNCC1=NC=NC=C1 Z2871313713 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.8 CSCC1=CN=CC=C1 Z599631354 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.8 N#CCC1=CN=CC=C1 Z239871646 [1,0,0,0,0,0|1,0,2]=4 73 B9R1.8 N#CCC1=NC=CC=C1 Z104476888 [1,0,0,0,0,0|1,0,2]=4 74 B9R1.8 N#COC1=CC=CC=C1 Z1198165353 [1,0,0,0,0,0|1,0,2]=4 75 B9R1.8 NCCC1=CC=NC=C1 Z241056520 [1,0,0,0,0,0|1,0,0]=2 76 B9R1.8 NCCC1=CN=CC=C1 Z241056524 [1,0,0,0,0,0|1,0,0]=2 77 B9R1.8 NCCC1=CN=NC=C1 Z3070743015 [1,0,0,0,0,0|2,0,0]=3 78 B9R1.8 NCCC1=NC=CC=C1 Z104478200 [1,0,0,0,0,0|1,0,0]=2 79 B9R1.8 NCCC1=NC=CN=C1 Z1925930460 [1,0,0,0,0,0|2,0,0]=3 80 B9R1.8 NCCC1=NC=NC=C1 Z2935002210 [1,0,0,0,0,0|2,0,0]=3 81 B9R1.8 NNCC1=CC=CC=C1 Z56969306 [1,0,0,0,0,0|0,0,0]=1 82 B9R1.8 NNCC1=CN=CC=C1 Z370706826 [1,0,0,0,0,0|1,0,0]=2 83 B9R1.8 NOCC1=CC=CC=C1 Z90668722 [1,0,0,0,0,0|1,0,0]=2 84 B9R1.8 O=CCC1=CC=CC=C1 Z104472146 [1,0,0,0,0,0|1,0,1]=3 85 B9R1.8 OCCC1=CC=CC=C1 Z104473586 [1,0,0,0,0,0|1,0,0]=2 86 B9R1.8 OCCC1=CN=CC=C1 Z992949518 [1,0,0,0,0,0|2,0,0]=3 87 B9R1.8 OCCC1=NC=CC=C1 Z104473592 [1,0,0,0,0,0|2,0,0]=3 88 B9R1.8 OCCC1=NC=CN=C1 Z234895105 [1,0,0,0,0,0|3,0,0]=4 89 B9R1.8 OCCC1=NC=NC=C1 Z1250886882 [1,0,0,0,0,0|3,0,0]=4 90 B9R1.8 S=C=NC1=CC=CC=C1 Z56904678 [1,0,0,0,0,0|2,0,1]=4 91 B11R1.1 BrCCOC1=CC=C(C=C1)Br Z56887702 [0,1,0,0,0,0|3,0,0]=4 92 B11R1.1 C#CCNC1=CC=C(C=C1)C Z266486858 [0,1,0,0,0,0|3,0,0]=4 93 B11R1.1 C#CCNC1=CC=C(C=C1)Cl Z3210379676 [0,1,0,0,0,0|3,0,0]=4 94 B11R1.1 C#CCNC1=CC=C(C=C1)F Z3210380008 [0,1,0,0,0,0|3,0,0]=4 95 B11R1.1 C#CCOC1=CC=C(C=C1)Br Z54475590 [0,1,0,0,0,0|3,0,0]=4 96 B11R1.1 C#CCOC1=CC=C(C=C1)C Z54775509 [0,1,0,0,0,0|3,0,0]=4 97 B11R1.1 C#CCOC1=CC=C(C=C1)Cl Z54472184 [0,1,0,0,0,0|3,0,0]=4 98 B11R1.1 C#CCOC1=CC=C(C=C1)F Z54473259 [0,1,0,0,0,0|3,0,0]=4 99 B11R1.1 C#CCOC1=CC=C(C=C1)N Z730512948 [0,1,0,0,0,0|3,0,0]=4 100 B11R1.1 C=CCOC1=CC=C(C=C1)O Z381414818 [0,1,0,0,0,0|3,0,0]=4 101 B11R1.1 CC1=CC=C(C=C1)CCCN Z4639316723 [0,1,0,0,0,0|1,0,0]=2 102 B11R1.1 CC1=CC=C(C=C1)NCC#N Z56855172 [0,1,0,0,0,0|2,0,1]=4 103 B11R1.1 CC1=CC=C(C=C1)OCCBr Z56886357 [0,1,0,0,0,0|3,0,0]=4 104 B11R1.1 CC1=CC=C(C=C1)OCCN Z54747869 [0,1,0,0,0,0|2,0,0]=3 105 B11R1.1 CC1=CC=C(C=C1)SCC#N Z54591058 [0,1,0,0,0,0|2,0,1]=4 106 B11R1.1 CC1=CC=C(C=C1)SCCCl Z90122598 [0,1,0,0,0,0|3,0,0]=4 107 B11R1.1 CC1=CC=C(C=C1)SCCO Z149178580 [0,1,0,0,0,0|3,0,0]=4 108 B11R1.1 CC1=CN=C(C=C1)NCCN Z1695797833 [0,1,0,0,0,0|3,0,0]=4 109 B11R1.1 CC1=NC=C(C=C1)CCC=O Z1233208116 [0,1,0,0,0,0|3,0,0]=4 110 B11R1.1 CCCCC1=CC=C(C=C1)N Z104475500 [0,1,0,0,0,0|2,0,0]=3 111 B11R1.1 CCCNC1=CC=C(C=C1)Cl Z1266933829 [0,1,0,0,0,0|3,0,0]=4 112 B11R1.1 CCCOC1=CC=C(C=C1)N Z239604724 [0,1,0,0,0,0|3,0,0]=4 113 B11R1.1 CCNCC1=CC=C(C=C1)F Z3244655509 [0,1,0,0,0,0|3,0,0]=4 114 B11R1.1 CCOCC1=CC=C(C=C1)Br Z823854370 [0,1,0,0,0,0|3,0,0]=4 115 B11R1.1 CCOCC1=CC=C(C=C1)N Z240084570 [0,1,0,0,0,0|3,0,0]=4 116 B11R1.1 CCSCC1=CC=C(C=C1)N Z332378208 [0,1,0,0,0,0|3,0,0]=4 117 B11R1.1 CNCCC1=CC=C(C=C1)Br Z385447024 [0,1,0,0,0,0|1,0,0]=2 118 B11R1.1 CNCCC1=CC=C(C=C1)C Z5115849578 [0,1,0,0,0,0|1,0,0]=2 119 B11R1.1 CNCCC1=CC=C(C=C1)Cl Z1623872266 [0,1,0,0,0,0|1,0,0]=2 120 B11R1.1 CNCCC1=CC=C(C=C1)F Z138454998 [0,1,0,0,0,0|1,0,0]=2 121 B11R1.1 CNCCC1=NC=C(C=N1)Br Z3023504208 [0,1,0,0,0,0|3,0,0]=4 122 B11R1.1 COCCC1=CC=C(C=C1)Br Z299596190 [0,1,0,0,0,0|2,0,0]=3 123 B11R1.1 COCCC1=CC=C(C=C1)Cl Z1470894103 [0,1,0,0,0,0|2,0,0]=3 124 B11R1.1 COCCC1=CC=C(C=C1)O Z104485614 [0,1,0,0,0,0|2,0,0]=3 125 B11R1.1 COCOC1=CC=C(C=C1)N Z1259226853 [0,1,0,0,0,0|3,0,0]=4 126 B11R1.1 CSCCC1=CC=C(C=C1)N Z732207426 [0,1,0,0,0,0|2,0,0]=3 127 B11R1.1 ClC1=CC=C(C=C1)OCCBr Z56926557 [0,1,0,0,0,0|3,0,0]=4 128 B11R1.1 ClCCSC1=CC=C(C=C1)Cl Z55993025 [0,1,0,0,0,0|3,0,0]=4 129 B11R1.1 FC1=CC=C(C=C1)CN=C=S Z57358375 [0,1,0,0,0,0|3,0,0]=4 130 B11R1.1 FCCOC1=CC=C(C=C1)Br Z1269166672 [0,1,0,0,0,0|3,0,0]=4 131 B11R1.1 N#CCCC1=CC=C(C=C1)N Z4750298565 [0,1,0,0,0,0|1,0,1]=3 132 B11R1.1 N#CCNC1=CC=C(C=C1)Br Z266466556 [0,1,0,0,0,0|2,0,1]=4 133 B11R1.1 N#CCOC1=CC=C(C=C1)Cl Z54608574 [0,1,0,0,0,0|2,0,1]=4 134 B11R1.1 N#CCOC1=CC=C(C=C1)F Z53791434 [0,1,0,0,0,0|2,0,1]=4 135 B11R1.1 N#CCOC1=CC=C(C=C1)N Z57052858 [0,1,0,0,0,0|2,0,1]=4 136 B11R1.1 N#CCSC1=CC=C(C=C1)Br Z18744575 [0,1,0,0,0,0|2,0,1]=4 137 B11R1.1 N#CCSC1=CC=C(C=C1)Cl Z19728982 [0,1,0,0,0,0|2,0,1]=4 138 B11R1.1 N#CCSC1=CC=C(C=C1)F Z16034822 [0,1,0,0,0,0|2,0,1]=4 139 B11R1.1 NC/C=C/C1=CC=C(C=C1)Br Z2235681463 [0,1,0,0,0,0|1,0,2]=4 140 B11R1.1 NC1=CC=C(C=C1)OCCF Z1262631146 [0,1,0,0,0,0|3,0,0]=4 141 B11R1.1 NC1=CC=C(C=C1)OCCO Z332379386 [0,1,0,0,0,0|3,0,0]=4 142 B11R1.1 NCC#CC1=CC=C(C=C1)I Z4775597113 [0,1,0,0,0,0|1,0,2]=4 143 B11R1.1 NCCCC1=CC=C(C=C1)Br Z3980240042 [0,1,0,0,0,0|1,0,0]=2 144 B11R1.1 NCCCC1=CC=C(C=C1)Cl Z992716848 [0,1,0,0,0,0|1,0,0]=2 145 B11R1.1 NCCCC1=CC=C(C=C1)F Z3244753845 [0,1,0,0,0,0|1,0,0]=2 146 B11R1.1 NCCCC1=CC=C(C=C1)N Z5453008768 [0,1,0,0,0,0|1,0,0]=2 147 B11R1.1 NCCCC1=CC=C(C=C1)O Z1270210797 [0,1,0,0,0,0|1,0,0]=2 148 B11R1.1 NCCNC1=CC=C(C=C1)O Z3386315806 [0,1,0,0,0,0|2,0,0]=3 149 B11R1.1 NCCOC1=CC=C(C=C1)Br Z1262237188 [0,1,0,0,0,0|2,0,0]=3 150 B11R1.1 NCCOC1=CC=C(C=C1)Cl Z85957193 [0,1,0,0,0,0|2,0,0]=3 151 B11R1.1 NCCOC1=CC=C(C=C1)F Z87000937 [0,1,0,0,0,0|2,0,0]=3 152 B11R1.1 NCCOC1=CC=C(C=C1)I Z381428104 [0,1,0,0,0,0|2,0,0]=3 153 B11R1.1 NCCOC1=NC=C(C=C1)Cl Z1421528823 [0,1,0,0,0,0|3,0,0]=4 154 B11R1.1 NCCSC1=CC=C(C=C1)Br Z262221984 [0,1,0,0,0,0|2,0,0]=3 155 B11R1.1 NCCSC1=CC=C(C=C1)Cl Z54751093 [0,1,0,0,0,0|2,0,0]=3 156 B11R1.1 NCCSC1=CC=C(C=C1)F Z1267773811 [0,1,0,0,0,0|2,0,0]=3 157 B11R1.1 O=CCCC1=CC=C(C=C1)Br Z993017756 [0,1,0,0,0,0|2,0,0]=3 158 B11R1.1 O=CCCC1=CC=C(C=C1)Cl Z993017742 [0,1,0,0,0,0|2,0,0]=3 159 B11R1.1 O=CCCC1=CC=C(C=C1)F Z993017748 [0,1,0,0,0,0|2,0,0]=3 160 B11R1.1 O=CCOC1=CC=C(C=C1)F Z854102568 [0,1,0,0,0,0|3,0,0]=4 161 B11R1.1 O=CCSC1=CC=C(C=C1)F Z854102782 [0,1,0,0,0,0|3,0,0]=4 162 B11R1.1 OCCCC1=CC=C(C=C1)F Z992949550 [0,1,0,0,0,0|2,0,0]=3 163 B11R1.1 OCCNC1=CC=C(C=C1)Br Z335275406 [0,1,0,0,0,0|3,0,0]=4 164 B11R1.1 OCCOC1=CC=C(C=C1)Br Z335092354 [0,1,0,0,0,0|3,0,0]=4 165 B11R1.1 OCCOC1=CC=C(C=C1)O Z381414946 [0,1,0,0,0,0|3,0,0]=4 166 B11R1.1 OCCSC1=CC=C(C=C1)Br Z149190682 [0,1,0,0,0,0|3,0,0]=4 167 B11R1.1 OCCSC1=CC=C(C=C1)Cl Z149162370 [0,1,0,0,0,0|3,0,0]=4 168 B11R1.16 C#CCC(O)C1=CC=CC=C1 Z932373338 [0,1,0,0,0,0|2,0,0]=3 169 B11R1.16 C#CCN(C)C1=CC=CC=C1 Z103708484 [0,1,0,0,0,0|3,0,0]=4 170 B11R1.16 C=CCC(N)C1=CC=NC=C1 Z1268152401 [0,1,0,0,0,0|3,0,0]=4 171 B11R1.16 CC(CC#N)C1=CC=CC=C1 Z1251357056 [0,1,0,0,0,0|1,0,1]=3 172 B11R1.16 CC(CC=O)C1=CC=CC=C1 Z57921394 [0,1,0,0,0,0|2,0,0]=3 173 B11R1.16 CC(N=C=S)C1=CC=CC=C1 Z57358351 [0,1,0,0,0,0|3,0,0]=4 174 B11R1.16 CCCC(=O)C1=CC=CC=C1 Z104477742 [0,1,0,0,0,0|2,0,1]=4 175 B11R1.16 CCCC(N)C1=NC=CC=C1 Z513795928 [0,1,0,0,0,0|3,0,0]=4 176 B11R1.16 CCCC(O)C1=CC=CC=C1 Z335244704 [0,1,0,0,0,0|2,0,0]=3 177 B11R1.16 CN(CCN)C1=CC=CC=C1 Z154669318 [0,1,0,0,0,0|2,0,0]=3 178 B11R1.16 CN(CCN)C1=NC=CC=C1 Z3026268353 [0,1,0,0,0,0|3,0,0]=4 179 B11R1.16 CN(CCO)C1=CC=CC=C1 Z138702688 [0,1,0,0,0,0|3,0,0]=4 180 B11R1.16 CNCC(C)C1=CC=CC=C1 Z57797325 [0,1,0,0,0,0|1,0,0]=2 181 B11R1.16 COCC(N)C1=CC=CC=C1 Z271013088 [0,1,0,0,0,0|2,0,0]=3 182 B11R1.16 CSCC(=O)C1=CC=CC=C1 Z732208586 [0,1,0,0,0,0|2,0,1]=4 183 B11R1.16 CSCC(N)C1=CC=CC=C1 Z995116260 [0,1,0,0,0,0|2,0,0]=3 184 B11R1.16 N#CCC(=O)C1=CC=CC=C1 Z56899088 [0,1,0,0,0,0|1,0,2]=4 185 B11R1.16 N#CCC(N)C1=CC=CC=C1 Z1415893991 [0,1,0,0,0,0|1,0,1]=3 186 B11R1.16 NC(CCO)C1=CC=CC=C1 Z382816560 [0,1,0,0,0,0|2,0,0]=3 187 B11R1.16 NCCC(O)C1=CC=CC=C1 Z1020673398 [0,1,0,0,0,0|1,0,0]=2 188 B11R1.16 NCCS(=O)C1=CC=CC=C1 Z1266854955 [0,1,0,0,0,0|2,0,0]=3 189 B11R1.16 O=C(CCCl)C1=CC=CC=C1 Z1065610596 [0,1,0,0,0,0|2,0,1]=4 190 B11R1.16 O=S(CCCl)C1=CC=CC=C1 Z421771494 [0,1,0,0,0,0|3,0,0]=4 191 B11R1.16 O[C@@H](CCCl)C1=CC=CC=C1 Z1255427232 [0,1,0,0,0,0|2,0,0]=3 192 B11R1.16 O[C@H](CCCl)C1=CC=CC=C1 Z1255356297 [0,1,0,0,0,0|2,0,0]=3 193 B11R1.17 C#CCNC1=C(C=CC=C1)F Z267213460 [0,1,0,0,0,0|3,0,0]=4 194 B11R1.17 C#CCOC1=C(C=CC=C1)Cl Z54471915 [0,1,0,0,0,0|3,0,0]=4 195 B11R1.17 C#CCOC1=C(C=CC=C1)F Z54554294 [0,1,0,0,0,0|3,0,0]=4 196 B11R1.17 C#CCOC1=C(C=CC=C1)N Z730514548 [0,1,0,0,0,0|3,0,0]=4 197 B11R1.17 C#CCOC1=C(C=CC=C1)O Z381415368 [0,1,0,0,0,0|3,0,0]=4 198 B11R1.17 C=CCSC1=C(C=CC=C1)N Z89272864 [0,1,0,0,0,0|3,0,0]=4 199 B11R1.17 CC1=C(C=CC=C1)CCCN Z424782962 [0,1,0,0,0,0|1,0,0]=2 200 B11R1.17 CC1=C(C=CC=C1)CCCO Z979436644 [0,1,0,0,0,0|2,0,0]=3 201 B11R1.17 CC1=C(C=CC=C1)OCC#N Z53791706 [0,1,0,0,0,0|2,0,1]=4 202 B11R1.17 CC1=C(C=CC=C1)OCCN Z223656356 [0,1,0,0,0,0|2,0,0]=3 203 B11R1.17 CC1=C(C=NC=C1)CCC=O Z1270653786 [0,1,0,0,0,0|3,0,0]=4 204 B11R1.17 CC1=C(N=CC=C1)CCC#N Z1862003349 [0,1,0,0,0,0|2,0,1]=4 205 B11R1.17 CC1=C(N=CC=C1)CCCN Z1198262715 [0,1,0,0,0,0|2,0,0]=3 206 B11R1.17 CCCNC1=C(C=CC=C1)F Z334942896 [0,1,0,0,0,0|3,0,0]=4 207 B11R1.17 CCCNC1=C(C=CC=C1)N Z94601320 [0,1,0,0,0,0|3,0,0]=4 208 B11R1.17 CCCOC1=C(C=CC=C1)Br Z54722000 [0,1,0,0,0,0|3,0,0]=4 209 B11R1.17 CCCOC1=C(C=CC=C1)N Z56968930 [0,1,0,0,0,0|3,0,0]=4 210 B11R1.17 CCCOC1=C(C=CC=C1)O Z55993120 [0,1,0,0,0,0|3,0,0]=4 211 B11R1.17 CCNCC1=C(C=CC=C1)Br Z1982494002 [0,1,0,0,0,0|3,0,0]=4 212 B11R1.17 CCNCC1=C(C=CC=C1)C Z90513218 [0,1,0,0,0,0|3,0,0]=4 213 B11R1.17 CCNCC1=C(C=CC=C1)Cl Z90513164 [0,1,0,0,0,0|3,0,0]=4 214 B11R1.17 CCNCC1=C(C=CC=C1)F Z286282968 [0,1,0,0,0,0|3,0,0]=4 215 B11R1.17 CCNCC1=C(C=CC=C1)N Z2351947311 [0,1,0,0,0,0|3,0,0]=4 216 B11R1.17 CCOCC1=C(C=CC=C1)N Z285163822 [0,1,0,0,0,0|3,0,0]=4 217 B11R1.17 CNCCC1=C(C=CC=C1)C Z2234185664 [0,1,0,0,0,0|1,0,0]=2 218 B11R1.17 CNCCC1=C(C=CC=C1)Cl Z4935566656 [0,1,0,0,0,0|1,0,0]=2 219 B11R1.17 CNCCC1=C(C=CC=C1)F Z163192604 [0,1,0,0,0,0|1,0,0]=2 220 B11R1.17 CNCCC1=C(C=CC=C1)O Z1665033474 [0,1,0,0,0,0|1,0,0]=2 221 B11R1.17 COCCC1=C(C=CC=C1)N Z992259832 [0,1,0,0,0,0|2,0,0]=3 222 B11R1.17 COCCN1C=CC=CC1=O Z285935542 [0,1,0,0,0,0|3,0,0]=4 223 B11R1.17 ClC1=C(C=CC=C1)OCCBr Z56886267 [0,1,0,0,0,0|3,0,0]=4 224 B11R1.17 N#CCCC1=C(C=CC=C1)Br Z815260584 [0,1,0,0,0,0|1,0,1]=3 225 B11R1.17 N#CCCN1C=CC=CC1=O Z91643979 [0,1,0,0,0,0|2,0,1]=4 226 B11R1.17 N#CCOC1=C(C=CC=C1)Br Z54684411 [0,1,0,0,0,0|2,0,1]=4 227 B11R1.17 N#CCSC1=C(C=CC=C1)Br Z149386606 [0,1,0,0,0,0|2,0,1]=4 228 B11R1.17 N#CCSC1=C(C=CC=C1)Cl Z18459623 [0,1,0,0,0,0|2,0,1]=4 229 B11R1.17 N#CCSC1=C(C=CC=C1)F Z18098612 [0,1,0,0,0,0|2,0,1]=4 230 B11R1.17 NC1=C(C=CC=C1)CCCO Z1198265858 [0,1,0,0,0,0|2,0,0]=3 231 B11R1.17 NC1=C(C=CC=C1)NCCO Z55928991 [0,1,0,0,0,0|3,0,0]=4 232 B11R1.17 NC1=C(C=CC=C1)OCCO Z3445703033 [0,1,0,0,0,0|3,0,0]=4 233 B11R1.17 NCCCC1=C(C=CC=C1)Cl Z1695729033 [0,1,0,0,0,0|1,0,0]=2 234 B11R1.17 NCCCC1=C(C=CC=C1)F Z424783030 [0,1,0,0,0,0|1,0,0]=2 235 B11R1.17 NCCCN1C=CC=CC1=O Z271005712 [0,1,0,0,0,0|2,0,0]=3 236 B11R1.17 NCCCN1C=CC=NC1=O Z1956828657 [0,1,0,0,0,0|3,0,0]=4 237 B11R1.17 NCCNC1=C(C=CC=C1)N Z991530054 [0,1,0,0,0,0|2,0,0]=3 238 B11R1.17 NCCNC1=C(C=CC=N1)Br Z808603224 [0,1,0,0,0,0|3,0,0]=4 239 B11R1.17 NCCOC1=C(C=CC=C1)Br Z803145324 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.17 NCCOC1=C(C=CC=C1)Cl Z54747867 [0,1,0,0,0,0|2,0,0]=3 241 B11R1.17 NCCOC1=C(C=CC=C1)F Z1272739857 [0,1,0,0,0,0|2,0,0]=3 242 B11R1.17 NCCOC1=C(C=CC=C1)O Z3217405430 [0,1,0,0,0,0|2,0,0]=3 243 B11R1.17 NCCOC1=C(C=CC=N1)Cl Z1421528240 [0,1,0,0,0,0|3,0,0]=4 244 B11R1.17 NCCSC1=C(C=CC=C1)F Z57971449 [0,1,0,0,0,0|2,0,0]=3 245 B11R1.17 NNCCC1=C(C=CC=C1)F Z285144176 [0,1,0,0,0,0|0,0,0]=1 246 B11R1.17 O=C1C=CC=CN1CCCO Z425794816 [0,1,0,0,0,0|3,0,0]=4 247 B11R1.17 O=CCCC1=C(C=CC=C1)F Z993017602 [0,1,0,0,0,0|2,0,0]=3 248 B11R1.17 OCCCC1=C(C=CC=C1)Br Z992949552 [0,1,0,0,0,0|2,0,0]=3 249 B11R1.17 OCCOC1=C(C=CC=C1)Br Z149303034 [0,1,0,0,0,0|3,0,0]=4 250 B11R1.17 OCCOC1=C(C=CC=C1)F Z425795714 [0,1,0,0,0,0|3,0,0]=4 251 B11R1.17 OCCOC1=C(C=CC=C1)O Z56755902 [0,1,0,0,0,0|3,0,0]=4 252 B11R1.17 OCCSC1=C(C=CC=C1)Br Z149386602 [0,1,0,0,0,0|3,0,0]=4 253 B11R1.17 OCCSC1=C(C=CC=C1)Cl Z149174540 [0,1,0,0,0,0|3,0,0]=4 254 B11R1.24 BrCCOC1=CC(=CC=C1)Br Z56886268 [0,1,0,0,0,0|3,0,0]=4 255 B11R1.24 C#CCNC1=CC=CC(=C1)F Z3210379881 [0,1,0,0,0,0|3,0,0]=4 256 B11R1.24 C#CCOC1=CC=CC(=C1)Br Z54473729 [0,1,0,0,0,0|3,0,0]=4 257 B11R1.24 C#CCOC1=CC=CC(=C1)C Z54472997 [0,1,0,0,0,0|3,0,0]=4 258 B11R1.24 C#CCOC1=CC=CC(=C1)Cl Z54474446 [0,1,0,0,0,0|3,0,0]=4 259 B11R1.24 C#CCOC1=CC=CC(=C1)F Z54472195 [0,1,0,0,0,0|3,0,0]=4 260 B11R1.24 C#CCOC1=CC=CC(=C1)N Z730509748 [0,1,0,0,0,0|3,0,0]=4 261 B11R1.24 C#CCOC1=CC=CC(=C1)O Z381415784 [0,1,0,0,0,0|3,0,0]=4 262 B11R1.24 C=CCCC1=CC=CC(=C1)Br Z1269162615 [0,1,0,0,0,0|2,0,0]=3 263 B11R1.24 C=CCOC1=CC=CC(=C1)N Z274779170 [0,1,0,0,0,0|3,0,0]=4 264 B11R1.24 CC1=CC(=CC=C1)CCCN Z4993130622 [0,1,0,0,0,0|1,0,0]=2 265 B11R1.24 CC1=CC(=CC=C1)CCCO Z979436642 [0,1,0,0,0,0|2,0,0]=3 266 B11R1.24 CC1=CC(=CC=C1)OCCBr Z56886266 [0,1,0,0,0,0|3,0,0]=4 267 B11R1.24 CC1=CC(=CC=C1)OCCN Z85926240 [0,1,0,0,0,0|2,0,0]=3 268 B11R1.24 CC1=CC(=CN=C1)CCC=O Z1492427371 [0,1,0,0,0,0|3,0,0]=4 269 B11R1.24 CC1=CC(=CN=C1)CCCO Z1216820424 [0,1,0,0,0,0|3,0,0]=4 270 B11R1.24 CC1=NC(=CC=C1)CCCO Z104479712 [0,1,0,0,0,0|3,0,0]=4 271 B11R1.24 CC1=NC(=CC=C1)NCCN Z1267773738 [0,1,0,0,0,0|3,0,0]=4 272 B11R1.24 CCCOC1=CC(=CC=C1)Br Z54848718 [0,1,0,0,0,0|3,0,0]=4 273 B11R1.24 CCCOC1=CC(=CC=C1)N Z239604770 [0,1,0,0,0,0|3,0,0]=4 274 B11R1.24 CCCOC1=CC(=CC=C1)O Z381415572 [0,1,0,0,0,0|3,0,0]=4 275 B11R1.24 CCNCC1=CC(=CC=C1)Br Z1138763375 [0,1,0,0,0,0|3,0,0]=4 276 B11R1.24 CCNCC1=CC(=CC=C1)C Z90513252 [0,1,0,0,0,0|3,0,0]=4 277 B11R1.24 CCNCC1=CC(=CC=C1)Cl Z90513201 [0,1,0,0,0,0|3,0,0]=4 278 B11R1.24 CCNCC1=CC(=CC=C1)F Z85935746 [0,1,0,0,0,0|3,0,0]=4 279 B11R1.24 CCOCC1=CC(=CC=C1)N Z285163820 [0,1,0,0,0,0|3,0,0]=4 280 B11R1.24 CCSCC1=CC(=CC=C1)N Z332378038 [0,1,0,0,0,0|3,0,0]=4 281 B11R1.24 CNCCC1=CC(=CC=C1)Br Z2168282744 [0,1,0,0,0,0|1,0,0]=2 282 B11R1.24 CNCCC1=CC(=CC=C1)O Z4924737523 [0,1,0,0,0,0|1,0,0]=2 283 B11R1.24 CNCCC1=NC(=CC=N1)O Z3023572741 [0,1,0,0,0,0|3,0,0]=4 284 B11R1.24 COCCC1=CC(=CC=C1)O Z1513911027 [0,1,0,0,0,0|2,0,0]=3 285 B11R1.24 COCCC1=CC(=NC=C1)N Z1333211037 [0,1,0,0,0,0|3,0,0]=4 286 B11R1.24 N#CCNC1=CC=CC(=C1)Cl Z266494142 [0,1,0,0,0,0|2,0,1]=4 287 B11R1.24 N#CCNC1=CC=CC(=C1)F Z266497222 [0,1,0,0,0,0|2,0,1]=4 288 B11R1.24 N#CCOC1=CC=CC(=C1)N Z285182504 [0,1,0,0,0,0|2,0,1]=4 289 B11R1.24 N#CCOC1=CC=CC(=C1)O Z381415714 [0,1,0,0,0,0|2,0,1]=4 290 B11R1.24 N#CCSC1=CC=CC(=C1)Br Z1020820468 [0,1,0,0,0,0|2,0,1]=4 291 B11R1.24 NC1=CC(=CC=C1)CCCO Z1198265859 [0,1,0,0,0,0|2,0,0]=3 292 B11R1.24 NC1=CC(=CC=C1)OCCF Z1262657442 [0,1,0,0,0,0|3,0,0]=4 293 B11R1.24 NCC#CC1=CC(=CC=C1)F Z2004547701 [0,1,0,0,0,0|1,0,2]=4 294 B11R1.24 NCCCC1=CC(=CC=C1)Br Z1266823414 [0,1,0,0,0,0|1,0,0]=2 295 B11R1.24 NCCCC1=CC(=CC=C1)Cl Z1262246154 [0,1,0,0,0,0|1,0,0]=2 296 B11R1.24 NCCCC1=CC(=CC=C1)F Z424782946 [0,1,0,0,0,0|1,0,0]=2 297 B11R1.24 NCCCC1=CC(=CC=C1)O Z1895582955 [0,1,0,0,0,0|1,0,0]=2 298 B11R1.24 NCCCC1=CC(=CN=C1)F Z4446765955 [0,1,0,0,0,0|2,0,0]=3 299 B11R1.24 NCCOC1=CC(=CC=C1)Br Z744843646 [0,1,0,0,0,0|2,0,0]=3 300 B11R1.24 NCCOC1=CC(=CC=C1)Cl Z425484860 [0,1,0,0,0,0|2,0,0]=3 301 B11R1.24 NCCOC1=CC(=CC=C1)F Z381785786 [0,1,0,0,0,0|2,0,0]=3 302 B11R1.24 O=CCCC1=CC=CC(=C1)Cl Z993017744 [0,1,0,0,0,0|2,0,0]=3 303 B11R1.24 O=CCCC1=CC=CC(=C1)F Z993017622 [0,1,0,0,0,0|2,0,0]=3 304 B11R1.24 O=CCCC1=CN=CC(=C1)F Z1233207916 [0,1,0,0,0,0|3,0,0]=4 305 B11R1.24 OCCNC1=CC(=CC=C1)F Z335274246 [0,1,0,0,0,0|3,0,0]=4 306 B11R1.24 OCCOC1=CC(=CC=C1)Br Z335092356 [0,1,0,0,0,0|3,0,0]=4 307 B11R1.24 OCCOC1=CC(=CC=C1)Cl Z149166432 [0,1,0,0,0,0|3,0,0]=4 308 B11R1.28 BrCCCOC1=CC=CC=C1 Z90122132 [0,1,0,0,0,0|2,0,0]=3 309 B11R1.28 C#CCCOC1=CC=CC=C1 Z1143222703 [0,1,0,0,0,0|2,0,0]=3 310 B11R1.28 C#CCNCC1=CC=CC=C1 Z2082999436 [0,1,0,0,0,0|2,0,0]=3 311 B11R1.28 C#CCNCC1=CN=CC=C1 Z90560634 [0,1,0,0,0,0|3,0,0]=4 312 B11R1.28 C=CCNCC1=CC=CC=C1 Z86135577 [0,1,0,0,0,0|2,0,0]=3 313 B11R1.28 CCCCCC1=CC=CC=C1 Z199507042 [0,1,0,0,0,0|2,0,0]=3 314 B11R1.28 CCCCNC1=CC=NC=C1 Z359299136 [0,1,0,0,0,0|3,0,0]=4 315 B11R1.28 CCCNCC1=CC=CC=C1 Z56946091 [0,1,0,0,0,0|2,0,0]=3 316 B11R1.28 CCCNCC1=CC=NC=C1 Z3247723488 [0,1,0,0,0,0|3,0,0]=4 317 B11R1.28 CCCNCC1=CN=CC=C1 Z3247723489 [0,1,0,0,0,0|3,0,0]=4 318 B11R1.28 CCCNCC1=NC=CC=C1 Z4401052052 [0,1,0,0,0,0|3,0,0]=4 319 B11R1.28 CCNCCC1=CC=CC=C1 Z444350074 [0,1,0,0,0,0|1,0,0]=2 320 B11R1.28 CCNCCC1=NC=CC=C1 Z138534138 [0,1,0,0,0,0|2,0,0]=3 321 B11R1.28 CCOCCC1=CC=CC=C1 Z1198150519 [0,1,0,0,0,0|2,0,0]=3 322 B11R1.28 CNCCCC1=CC=CC=C1 Z102767020 [0,1,0,0,0,0|1,0,0]=2 323 B11R1.28 CNCCNC1=NC=CC=C1 Z3033960688 [0,1,0,0,0,0|2,0,0]=3 324 B11R1.28 CNCCOC1=CC=CC=C1 Z56945505 [0,1,0,0,0,0|1,0,0]=2 325 B11R1.28 COCCNC1=CC=CC=C1 Z266463556 [0,1,0,0,0,0|2,0,0]=3 326 B11R1.28 COCCNC1=CC=NC=C1 Z359297138 [0,1,0,0,0,0|3,0,0]=4 327 B11R1.28 ClCCCOC1=CC=CC=C1 Z275020186 [0,1,0,0,0,0|2,0,0]=3 328 B11R1.28 ClCCNCC1=CC=CC=C1 Z57158447 [0,1,0,0,0,0|2,0,0]=3 329 B11R1.28 N#CCCNC1=CC=CC=C1 Z56915949 [0,1,0,0,0,0|1,0,1]=3 330 B11R1.28 N#CCCOC1=CC=CC=C1 Z54337114 [0,1,0,0,0,0|1,0,1]=3 331 B11R1.28 N#CCNCC1=CC=CC=C1 Z266079624 [0,1,0,0,0,0|1,0,1]=3 332 B11R1.28 N#CCNCC1=NC=CC=C1 Z111725574 [0,1,0,0,0,0|2,0,1]=4 333 B11R1.28 N#CCOCC1=CC=CC=C1 Z295205356 [0,1,0,0,0,0|1,0,1]=3 334 B11R1.28 N#CCSCC1=CC=CC=C1 Z54337756 [0,1,0,0,0,0|1,0,1]=3 335 B11R1.28 NCCCCC1=CC=CC=C1 Z2574929438 [0,1,0,0,0,0|1,0,0]=2 336 B11R1.28 NCCCCC1=CC=NC=C1 Z3234944907 [0,1,0,0,0,0|2,0,0]=3 337 B11R1.28 NCCCNC1=CC=CC=C1 Z756919512 [0,1,0,0,0,0|1,0,0]=2 338 B11R1.28 NCCCNC1=CC=NC=C1 Z317257864 [0,1,0,0,0,0|2,0,0]=3 339 B11R1.28 NCCCNC1=NC=CC=C1 Z234895141 [0,1,0,0,0,0|2,0,0]=3 340 B11R1.28 NCCCNC1=NC=CC=N1 Z444311056 [0,1,0,0,0,0|3,0,0]=4 341 B11R1.28 NCCCOC1=CC=CC=C1 Z234895129 [0,1,0,0,0,0|1,0,0]=2 342 B11R1.28 NCCCOC1=CC=NC=C1 Z976694292 [0,1,0,0,0,0|2,0,0]=3 343 B11R1.28 NCCCOC1=NC=CC=N1 Z2467687631 [0,1,0,0,0,0|3,0,0]=4 344 B11R1.28 NCCCSC1=CC=CC=C1 Z262222134 [0,1,0,0,0,0|1,0,0]=2 345 B11R1.28 NCCCSC1=NC=CC=C1 Z2028214397 [0,1,0,0,0,0|2,0,0]=3 346 B11R1.28 NCCNCC1=NC=CC=C1 Z600492946 [0,1,0,0,0,0|2,0,0]=3 347 B11R1.28 NCCOCC1=CC=CC=C1 Z271005946 [0,1,0,0,0,0|1,0,0]=2 348 B11R1.28 O=CCCCC1=CC=CC=C1 Z993017616 [0,1,0,0,0,0|2,0,0]=3 349 B11R1.28 O=CCOCC1=CC=CC=C1 Z906195396 [0,1,0,0,0,0|2,0,0]=3 350 B11R1.28 O=CCSCC1=CC=CC=C1 Z854102762 [0,1,0,0,0,0|2,0,0]=3 351 B11R1.28 OCCCNC1=CC=CC=C1 Z104584292 [0,1,0,0,0,0|2,0,0]=3 352 B11R1.28 OCCCNC1=CC=NC=C1 Z359301948 [0,1,0,0,0,0|3,0,0]=4 353 B11R1.28 OCCCNC1=NC=CC=C1 Z31220937 [0,1,0,0,0,0|3,0,0]=4 354 B11R1.28 OCCCSC1=CC=CC=C1 Z104650330 [0,1,0,0,0,0|2,0,0]=3 355 B11R1.28 OCCNCC1=CN=CC=C1 Z90504502 [0,1,0,0,0,0|3,0,0]=4 356 B11R1.28 OCCOCC1=CC=CC=C1 Z854223062 [0,1,0,0,0,0|2,0,0]=3 357 B11R1.28 S=C=NCCC1=CC=CC=C1 Z56924472 [0,1,0,0,0,0|1,0,1]=3 358 B11R1.40 C#CC(=O)CC1=CC=CC=C1 Z1266856334 [0,1,0,0,0,0|2,0,1]=4 359 B11R1.40 C#CC(N)CC1=CC=CC=C1 Z4167757719 [0,1,0,0,0,0|2,0,0]=3 360 B11R1.40 CC(C#N)OC1=CC=CC=C1 Z54191740 [0,1,0,0,0,0|2,0,1]=4 361 B11R1.40 CC(C=O)CC1=CC=CC=C1 Z1198150055 [0,1,0,0,0,0|2,0,0]=3 362 B11R1.40 CC(CC1=CC=CC=C1)NN Z3033545382 [0,1,0,0,0,0|0,0,0]=1 363 B11R1.40 CC(CN)NC1=CC=CC=C1 Z1198235985 [0,1,0,0,0,0|2,0,0]=3 364 B11R1.40 CC(CN)OC1=CC=CC=C1 Z1245635737 [0,1,0,0,0,0|2,0,0]=3 365 B11R1.40 CC(CN)SC1=CC=CC=C1 Z844632804 [0,1,0,0,0,0|2,0,0]=3 366 B11R1.40 CCC(N)CC1=CC=CC=C1 Z431980016 [0,1,0,0,0,0|2,0,0]=3 367 B11R1.40 CCC(O)CC1=CC=CC=C1 Z513749284 [0,1,0,0,0,0|2,0,0]=3 368 B11R1.40 CCC(O)CC1=CC=NC=C1 Z992409862 [0,1,0,0,0,0|3,0,0]=4 369 B11R1.40 CC[C@@H](O)CC1=CC=CC=C1 Z1262397064 [0,1,0,0,0,0|2,0,0]=3 370 B11R1.40 CC[C@H](O)CC1=CC=CC=C1 Z1262397065 [0,1,0,0,0,0|2,0,0]=3 371 B11R1.40 CN(C#N)CC1=CC=CC=C1 Z1255506511 [0,1,0,0,0,0|2,0,1]=4 372 B11R1.40 CN(CC1=CC=CC=C1)N=O Z1198147495 [0,1,0,0,0,0|2,0,1]=4 373 B11R1.40 CNC(=O)NC1=CC=CC=C1 Z55293754 [0,1,0,0,0,0|2,0,1]=4 374 B11R1.40 CNC(=S)NC1=CC=CC=C1 Z45796176 [0,1,0,0,0,0|2,0,1]=4 375 B11R1.40 N=C(NN)NC1=CC=CC=C1 Z2768171754 [0,1,0,0,0,0|1,0,1]=3 376 B11R1.40 NC(CO)CC1=CC=CC=C1 Z234898263 [0,1,0,0,0,0|2,0,0]=3 377 B11R1.40 NC(CO)CC1=CC=NC=C1 Z1824511267 [0,1,0,0,0,0|3,0,0]=4 378 B11R1.40 NCC(=O)CC1=CC=CC=C1 Z1569708978 [0,1,0,0,0,0|1,0,1]=3 379 B11R1.40 NCC(=O)NC1=CC=CC=C1 Z594413794 [0,1,0,0,0,0|2,0,1]=4 380 B11R1.40 NCC(F)CC1=CC=CC=C1 Z2740416678 [0,1,0,0,0,0|1,0,0]=2 381 B11R1.40 NCC(N)CC1=CC=CC=C1 Z425861056 [0,1,0,0,0,0|1,0,0]=2 382 B11R1.40 NCC(O)CC1=CC=CC=C1 Z419084966 [0,1,0,0,0,0|1,0,0]=2 383 B11R1.40 NNC(=O)CC1=CC=CC=C1 Z56867310 [0,1,0,0,0,0|0,0,1]=2 384 B11R1.40 NNC(=O)C[N+]1=CC=CC=C1 Z90123523 [0,1,0,0,0,0|1,0,1]=3 385 B11R1.40 NNC(=O)NC1=CC=CC=C1 Z56855648 [0,1,0,0,0,0|1,0,1]=3 386 B11R1.40 NNC(=O)NC1=NC=CC=C1 Z1171220858 [0,1,0,0,0,0|2,0,1]=4 387 B11R1.40 NNC(=S)NC1=CC=CC=C1 Z56836896 [0,1,0,0,0,0|1,0,1]=3 388 B11R1.40 NNC(=S)NC1=CN=CC=C1 Z56887664 [0,1,0,0,0,0|2,0,1]=4 389 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 Z1157651018 [0,1,0,0,0,0|2,0,0]=3 390 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 Z1741982891 [0,1,0,0,0,0|2,0,0]=3 391 B11R1.40 O=C(CCl)CC1=CC=CC=C1 Z164706024 [0,1,0,0,0,0|2,0,1]=4 392 B11R1.91 CC(=O)CSC1=CC=CC=C1 Z19751394 [0,1,0,0,0,0|3,0,0]=4 393 B11R1.91 CC(=O)NCC1=CC=CC=C1 Z27749489 [0,1,0,0,0,0|3,0,0]=4 394 B11R1.91 CC(=O)OCC1=CC=CC=C1 Z19628364 [0,1,0,0,0,0|3,0,0]=4 395 B11R1.91 CC(C)CNC1=CC=CC=C1 Z2092369729 [0,1,0,0,0,0|3,0,0]=4 396 B11R1.91 CC(N)CCC1=CC=CC=C1 Z104476462 [0,1,0,0,0,0|1,0,0]=2 397 B11R1.91 CC(N)COC1=CC=CC=C1 Z600397650 [0,1,0,0,0,0|2,0,0]=3 398 B11R1.91 CC(O)CNC1=CC=CC=C1 Z234898271 [0,1,0,0,0,0|3,0,0]=4 399 B11R1.91 CN(C)CCC1=CC=CC=C1 Z168912026 [0,1,0,0,0,0|1,0,0]=2 400 B11R1.91 C[C@H](N)CCC1=CC=CC=C1 Z5044990030 [0,1,0,0,0,0|1,0,0]=2 401 B11R1.91 FC(F)SCC1=CC=CC=C1 Z55626056 [0,1,0,0,0,0|3,0,0]=4 402 B11R1.91 N=C(N)CCC1=CC=CC=C1 Z2092176896 [0,1,0,0,0,0|1,0,0]=2 403 B11R1.91 N=C(N)COC1=CC=CC=C1 Z1532540938 [0,1,0,0,0,0|2,0,0]=3 404 B11R1.91 N=C(N)CSC1=CC=CC=C1 Z1532718998 [0,1,0,0,0,0|2,0,0]=3 405 B11R1.91 N=C(N)NCC1=CC=NC=C1 Z2723680409 [0,1,0,0,0,0|3,0,0]=4 406 B11R1.91 N=C(N)NCC1=NC=CC=C1 Z911465258 [0,1,0,0,0,0|3,0,0]=4 407 B11R1.91 N=C(N)SCC1=CC=CC=C1 Z89242849 [0,1,0,0,0,0|2,0,0]=3 408 B11R1.91 NC(=O)CCC1=CC=CC=C1 Z33546514 [0,1,0,0,0,0|1,0,0]=2 409 B11R1.91 NC(=O)CCC1=CC=NC=C1 Z1095213378 [0,1,0,0,0,0|2,0,0]=3 410 B11R1.91 NC(=O)CNC1=CC=CC=C1 Z104583968 [0,1,0,0,0,0|2,0,0]=3 411 B11R1.91 NC(=O)COC1=CC=CC=C1 Z19735702 [0,1,0,0,0,0|2,0,0]=3 412 B11R1.91 NC(=O)COC1=CN=CC=C1 Z336080090 [0,1,0,0,0,0|3,0,0]=4 413 B11R1.91 NC(=O)CSC1=CC=CC=C1 Z19751390 [0,1,0,0,0,0|2,0,0]=3 414 B11R1.91 NC(=O)CSC1=CC=NC=C1 Z33546963 [0,1,0,0,0,0|3,0,0]=4 415 B11R1.91 NC(=O)NCC1=CC=CC=C1 Z104476310 [0,1,0,0,0,0|2,0,0]=3 416 B11R1.91 NC(=O)NCC1=CC=NC=C1 Z198194796 [0,1,0,0,0,0|3,0,0]=4 417 B11R1.91 NC(=O)NCC1=CN=CC=C1 Z57664442 [0,1,0,0,0,0|3,0,0]=4 418 B11R1.91 NC(=O)NCC1=NC=CC=C1 Z198194794 [0,1,0,0,0,0|3,0,0]=4 419 B11R1.91 NC(=O)OCC1=CC=CC=C1 Z33547079 [0,1,0,0,0,0|2,0,0]=3 420 B11R1.91 NC(=S)CCC1=CC=CC=C1 Z56824950 [0,1,0,0,0,0|1,0,0]=2 421 B11R1.91 NC(=S)COC1=CC=CC=C1 Z108595128 [0,1,0,0,0,0|2,0,0]=3 422 B11R1.91 NC(=S)NCC1=CC=CC=C1 Z56900892 [0,1,0,0,0,0|2,0,0]=3 423 B11R1.91 NC(=S)NNC1=CC=CC=C1 Z104483868 [0,1,0,0,0,0|3,0,0]=4 424 B11R1.91 O=C(O)CCC1=CC=CC=C1 Z57127332 [0,1,0,0,0,0|2,0,0]=3 425 B11R1.91 O=C(O)CCC1=CC=NC=C1 Z317037982 [0,1,0,0,0,0|3,0,0]=4 426 B11R1.91 O=C(O)CCC1=CN=CC=C1 Z89264892 [0,1,0,0,0,0|3,0,0]=4 427 B11R1.91 O=C(O)CCC1=NC=CC=C1 Z317037998 [0,1,0,0,0,0|3,0,0]=4 428 B11R1.91 O=C(O)CNC1=CC=CC=C1 Z104496210 [0,1,0,0,0,0|3,0,0]=4 429 B11R1.91 O=C(O)COC1=CC=CC=C1 Z57182011 [0,1,0,0,0,0|3,0,0]=4 430 B11R1.91 O=C(O)CSC1=CC=CC=C1 Z104484982 [0,1,0,0,0,0|3,0,0]=4 431 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 Z995234780 [0,1,0,0,0,0|1,0,1]=3 432 B11R1.91 O=[N+]([O-])CSC1=CC=CC=C1 Z1255375331 [0,1,0,0,0,0|2,0,1]=4 433 B11R1.91 OB(O)CCC1=CC=CC=C1 Z1147227790 [0,1,0,0,0,0|2,0,0]=3 434 B11R2.1 CC1CNC2=C1C=CC=C2 Z415739264 [0,0,0,1,0,0|3,0,0]=4 435 B11R2.1 CC1NCC2=C1C=CC=C2 Z1203731964 [0,0,0,1,0,0|3,0,0]=4 436 B11R2.1 CN1C=NC2=C1C=CC=C2 Z53833303 [0,0,0,1,0,0|2,0,1]=4 437 B11R2.1 NC1=C2C=CC=CC2=NS1 Z1198161072 [0,0,0,1,0,0|3,0,0]=4 438 B11R2.1 NC1=NNC2=C1C=CC=C2 Z56820416 [0,0,0,1,0,0|3,0,0]=4 439 B11R2.1 NC1=NOC2=C1C=CC=C2 Z218760918 [0,0,0,1,0,0|3,0,0]=4 440 B11R2.1 NC1=NSC2=C1C=CC=C2 Z56774438 [0,0,0,1,0,0|3,0,0]=4 441 B11R2.1 NC1CCC2=C1C=CC=C2 Z168884748 [0,0,0,1,0,0|1,0,0]=2 442 B11R2.1 NC1CSC2=C1C=CC=C2 Z431544668 [0,0,0,1,0,0|2,0,0]=3 443 B11R2.1 NN1C=NC2=C1C=CC=C2 Z99599676 [0,0,0,1,0,0|1,0,1]=3 444 B11R2.1 NN1N=NC2=C1C=CC=C2 Z56788890 [0,0,0,1,0,0|2,0,0]=3 445 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 Z1741972748 [0,0,0,1,0,0|1,0,0]=2 446 B11R2.1 O=C1CCC2=C1C=CC=C2 Z104495974 [0,0,0,1,0,0|2,0,0]=3 447 B11R2.1 O=C1CCC2=C1C=NC=C2 Z1198181243 [0,0,0,1,0,0|3,0,0]=4 448 B11R2.1 O=C1COC2=C1C=CC=C2 Z57101103 [0,0,0,1,0,0|3,0,0]=4 449 B11R2.1 O=C1CSC2=C1C=CC=C2 Z1117911699 [0,0,0,1,0,0|3,0,0]=4 450 B11R2.1 O=C1NCC2=C1C=CC=C2 Z362519344 [0,0,0,1,0,0|3,0,0]=4 451 B11R2.1 O=C1OCC2=C1C=CC=C2 Z211309000 [0,0,0,1,0,0|3,0,0]=4 452 B11R2.1 OB1OCC2=C1C=CC=C2 Z1255356609 [0,0,0,1,0,0|3,0,0]=4 453 B11R2.1 OC1COC2=C1C=CC=C2 Z1267884639 [0,0,0,1,0,0|3,0,0]=4 454 B11R2.1 ON1N=NC2=C1C=CC=C2 Z56900935 [0,0,0,1,0,0|3,0,0]=4 455 B11R2.1 O[C@@H]1CSC2=C1C=CC=C2 Z1438326029 [0,0,0,1,0,0|3,0,0]=4 456 B11R2.4 N[C@@H]1C[C@@H]1C2=CC=CC=C2 Z2309888982 [0,0,0,1,0,0|1,0,0]=2 457 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 Z2296167800 [0,0,0,1,0,0|1,0,0]=2 458 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 Z2517097696 [0,0,0,1,0,0|1,0,0]=2 459 B11R2.20 C1=CC2=C(C=C1)CCC=C2 Z237493310 [0,0,0,1,0,0|2,0,0]=3 460 B11R2.20 C1=CC2=C(C=C1)CNCC2 Z57834231 [0,0,0,1,0,0|1,0,0]=2 461 B11R2.20 C1=CC2=C(C=C1)COCC2 Z756090080 [0,0,0,1,0,0|2,0,0]=3 462 B11R2.20 C1=CC2=C(C=C1)CONC2 Z2096086829 [0,0,0,1,0,0|2,0,0]=3 463 B11R2.20 C1=CC2=C(C=C1)OCCC2 Z728136016 [0,0,0,1,0,0|2,0,0]=3 464 B11R2.20 C1=CC2=C(C=C1)OCCN2 Z228584850 [0,0,0,1,0,0|2,0,0]=3 465 B11R2.20 C1=CC2=C(C=C1)SCCN2 Z56943460 [0,0,0,1,0,0|2,0,0]=3 466 B11R2.20 C1=CC2=C(C=N1)CCCC2 Z104492180 [0,0,0,1,0,0|3,0,0]=4 467 B11R2.20 C1=CC2=C(C=N1)CCNC2 Z3243651255 [0,0,0,1,0,0|2,0,0]=3 468 B11R2.20 C1=CC2=C(C=N1)CNCC2 Z3058791291 [0,0,0,1,0,0|2,0,0]=3 469 B11R2.20 C1=CC2=C(C=N1)COCC2 Z4394915129 [0,0,0,1,0,0|3,0,0]=4 470 B11R2.20 C1=CC2=C(C=N1)NCCC2 Z3243651200 [0,0,0,1,0,0|2,0,0]=3 471 B11R2.20 C1=CC2=C(C=N1)NCCN2 Z1203732990 [0,0,0,1,0,0|3,0,0]=4 472 B11R2.20 C1=CC2=C(C=N1)NCCO2 Z2217033032 [0,0,0,1,0,0|3,0,0]=4 473 B11R2.20 C1=CC2=C(CCCC2)N=C1 Z1201617100 [0,0,0,1,0,0|3,0,0]=4 474 B11R2.20 C1=CC2=C(CCCN2)N=C1 Z212053854 [0,0,0,1,0,0|2,0,0]=3 475 B11R2.20 C1=CC2=C(CCNC2)N=C1 Z2142036515 [0,0,0,1,0,0|2,0,0]=3 476 B11R2.20 C1=CC2=C(CCNC2)N=N1 Z3487941028 [0,0,0,1,0,0|3,0,0]=4 477 B11R2.20 C1=CC2=C(CCSC2)N=C1 Z3492694447 [0,0,0,1,0,0|3,0,0]=4 478 B11R2.20 C1=CC2=C(N=C1)NCCC2 Z1198176448 [0,0,0,1,0,0|2,0,0]=3 479 B11R2.20 C1=CC2=C(N=C1)NCCN2 Z1198175971 [0,0,0,1,0,0|3,0,0]=4 480 B11R2.20 C1=CC2=C(N=C1)OCCN2 Z1201624799 [0,0,0,1,0,0|3,0,0]=4 481 B11R2.20 C1=NC2=C(CNCC2)N=C1 Z5626910804 [0,0,0,1,0,0|3,0,0]=4 482 B11R2.20 C1=NC=NC2=C1CCNC2 Z2724335023 [0,0,0,1,0,0|3,0,0]=4 483 B11R2.238 C1=CC=C(C=C1)CC2CO2 Z1020680006 [0,0,0,1,0,0|2,0,0]=3 484 B11R2.238 C1=CC=C(C=C1)C[C@@H]2CO2 Z1617991494 [0,0,0,1,0,0|2,0,0]=3 485 B11R2.238 C1=CC=C(C=C1)C[C@H]2CO2 Z2216712384 [0,0,0,1,0,0|2,0,0]=3 486 B11R2.238 C1=CC=C(C=C1)NC2CC2 Z1203731288 [0,0,0,1,0,0|3,0,0]=4 487 B11R2.239 C1=CC(=NC=N1)C2CNC2 Z3244818217 [0,0,0,1,0,0|3,0,0]=4 488 B11R2.239 C1=CC=C(C=C1)C2CCN2 Z359510120 [0,0,0,1,0,0|1,0,0]=2 489 B11R2.988 NCC1CC2=C1C=CC=C2 Z234895091 [0,0,0,1,0,0|1,0,0]=2 490 B9R1.12 CNCCC1=CC=CS1 Z162416950 [0,0,0,0,1,0|2,0,0]=3 491 B9R1.12 CNCCC1=NNC=C1 Z2686452658 [0,0,0,0,1,0|3,0,0]=4 492 B9R1.12 N#CCCC1=CC=CO1 Z1079179114 [0,0,0,0,1,0|2,0,1]=4 493 B9R1.12 NCCCC1=CC=NN1 Z2895332060 [0,0,0,0,1,0|3,0,0]=4 494 B9R1.12 NCCCC1=CNC=N1 Z2574933947 [0,0,0,0,1,0|3,0,0]=4 495 B9R1.12 NCCCC1=CNN=C1 Z2106603664 [0,0,0,0,1,0|3,0,0]=4 496 B9R1.12 NCCCC1=CON=C1 Z3022047352 [0,0,0,0,1,0|3,0,0]=4 497 B9R1.12 NCCCC1=NC=CN1 Z3244743443 [0,0,0,0,1,0|3,0,0]=4 498 B9R1.12 NCCCC1=NC=CO1 Z4966451613 [0,0,0,0,1,0|3,0,0]=4 499 B9R1.12 NCCCC1=NC=CS1 Z1263529635 [0,0,0,0,1,0|3,0,0]=4 500 B9R1.12 NCCCN1C=CC=C1 Z600497510 [0,0,0,0,1,0|2,0,0]=3 501 B9R1.12 NCCCN1C=CC=N1 Z271005716 [0,0,0,0,1,0|3,0,0]=4 502 B9R1.12 O=CCCC1=CSC=C1 Z993017658 [0,0,0,0,1,0|3,0,0]=4 503 B9R1.12 OCCCC1=COC=C1 Z1198265634 [0,0,0,0,1,0|3,0,0]=4 504 B9R1.12 OCCCC1=CSC=C1 Z993012564 [0,0,0,0,1,0|3,0,0]=4 505 B8R1.2 C=CC1=CC=CC=C1 Z104474664 [2,0,0,0,0,0|0,0,2]=4 506 B8R1.2 CCC1=CC=CC=C1 Z104473632 [2,0,0,0,0,0|0,0,0]=2 507 B8R1.2 CCC1=CC=NC=C1 Z1251171246 [2,0,0,0,0,0|1,0,0]=3 508 B8R1.2 CCC1=CN=CC=C1 Z104476778 [2,0,0,0,0,0|1,0,0]=3 509 B8R1.2 CCC1=NC=CC=C1 Z113558650 [2,0,0,0,0,0|1,0,0]=3 510 B8R1.2 CCC1=NC=CC=N1 Z1198725952 [2,0,0,0,0,0|2,0,0]=4 511 B8R1.2 CCC1=NC=NC=C1 Z1198725956 [2,0,0,0,0,0|2,0,0]=4 512 B8R1.2 CCC1=NN=CC=C1 Z1222425026 [2,0,0,0,0,0|2,0,0]=4 513 B8R1.2 CNC1=CC=CC=C1 Z104472478 [2,0,0,0,0,0|1,0,0]=3 514 B8R1.2 CNC1=CN=CC=C1 Z1082871080 [2,0,0,0,0,0|2,0,0]=4 515 B8R1.2 COC1=CC=CC=C1 Z53833865 [2,0,0,0,0,0|1,0,0]=3 516 B8R1.2 CSC1=CC=NC=C1 Z1376456468 [2,0,0,0,0,0|2,0,0]=4 517 B8R1.2 Cl[Se]C1=CC=CC=C1 Z1255485131 [2,0,0,0,0,0|2,0,0]=4 518 B8R1.2 N#CC1=CC=CC=C1 Z104473628 [2,0,0,0,0,0|0,0,2]=4 519 B8R1.2 NCC1=CC=CC=C1 Z54748260 [2,0,0,0,0,0|0,0,0]=2 520 B8R1.2 NCC1=CC=NC=C1 Z104474354 [2,0,0,0,0,0|1,0,0]=3 521 B8R1.2 NCC1=CN=CC=C1 Z104474366 [2,0,0,0,0,0|1,0,0]=3 522 B8R1.2 NCC1=CN=CN=C1 Z3244401628 [2,0,0,0,0,0|2,0,0]=4 523 B8R1.2 NCC1=NC=CC=C1 Z104474352 [2,0,0,0,0,0|1,0,0]=3 524 B8R1.2 NCC1=NC=CC=N1 Z1463350843 [2,0,0,0,0,0|2,0,0]=4 525 B8R1.2 NCC1=NC=CN=C1 Z241059702 [2,0,0,0,0,0|2,0,0]=4 526 B8R1.2 NCC1=NC=NC=C1 Z254526552 [2,0,0,0,0,0|2,0,0]=4 527 B8R1.2 NCC1=NN=CC=C1 Z1198165902 [2,0,0,0,0,0|2,0,0]=4 528 B8R1.2 NNC1=CC=CC=C1 Z104472442 [2,0,0,0,0,0|0,0,0]=2 529 B8R1.2 NNC1=NC=CC=C1 Z56887722 [2,0,0,0,0,0|1,0,0]=3 530 B8R1.2 OCC1=CC=CC=C1 Z104476418 [2,0,0,0,0,0|1,0,0]=3 531 B8R1.2 OCC1=CC=NC=C1 Z335244866 [2,0,0,0,0,0|2,0,0]=4 532 B8R1.2 OCC1=CN=CC=C1 Z104495622 [2,0,0,0,0,0|2,0,0]=4 533 B8R1.2 OCC1=NC=CC=C1 Z57921252 [2,0,0,0,0,0|2,0,0]=4 534 B10R1.1 CC1=CC=C(C=C1)CC#N Z285131444 [1,1,0,0,0,0|0,0,2]=4 535 B10R1.1 CC1=CC=C(C=C1)CC=O Z993017610 [1,1,0,0,0,0|1,0,1]=4 536 B10R1.1 CC1=CC=C(C=C1)CCN Z1268153218 [1,1,0,0,0,0|0,0,0]=2 537 B10R1.1 CC1=CC=C(C=C1)CCO Z397587076 [1,1,0,0,0,0|1,0,0]=3 538 B10R1.1 CC1=NC=C(C=C1)CCN Z600584220 [1,1,0,0,0,0|1,0,0]=3 539 B10R1.1 CCCC1=CC=C(C=C1)Br Z299596168 [1,1,0,0,0,0|1,0,0]=3 540 B10R1.1 CCCC1=CC=C(C=C1)N Z104492166 [1,1,0,0,0,0|1,0,0]=3 541 B10R1.1 CCNC1=CC=C(C=C1)Br Z286365048 [1,1,0,0,0,0|2,0,0]=4 542 B10R1.1 CCNC1=CC=C(C=C1)Cl Z2902298062 [1,1,0,0,0,0|2,0,0]=4 543 B10R1.1 CCNC1=CC=C(C=C1)F Z89270849 [1,1,0,0,0,0|2,0,0]=4 544 B10R1.1 CCNC1=CC=C(C=C1)N Z359511474 [1,1,0,0,0,0|2,0,0]=4 545 B10R1.1 CCNC1=CC=C(C=C1)O Z1823256830 [1,1,0,0,0,0|2,0,0]=4 546 B10R1.1 CCOC1=CC=C(C=C1)C Z53834228 [1,1,0,0,0,0|2,0,0]=4 547 B10R1.1 CCOC1=CC=C(C=C1)N Z57127438 [1,1,0,0,0,0|2,0,0]=4 548 B10R1.1 CCOC1=CC=C(C=C1)S Z166646982 [1,1,0,0,0,0|2,0,0]=4 549 B10R1.1 CNCC1=CC=C(C=C1)Br Z56175269 [1,1,0,0,0,0|1,0,0]=3 550 B10R1.1 CNCC1=CC=C(C=C1)C Z56944115 [1,1,0,0,0,0|1,0,0]=3 551 B10R1.1 CNCC1=CC=C(C=C1)Cl Z56956070 [1,1,0,0,0,0|1,0,0]=3 552 B10R1.1 CNCC1=CC=C(C=C1)F Z56963340 [1,1,0,0,0,0|1,0,0]=3 553 B10R1.1 CNCC1=CC=C(C=C1)I Z4242747560 [1,1,0,0,0,0|1,0,0]=3 554 B10R1.1 CNCC1=CN=C(C=C1)Cl Z265498862 [1,1,0,0,0,0|2,0,0]=4 555 B10R1.1 CNCC1=CN=C(C=C1)F Z1745074466 [1,1,0,0,0,0|2,0,0]=4 556 B10R1.1 CNCC1=CN=C(C=C1)N Z1255388567 [1,1,0,0,0,0|2,0,0]=4 557 B10R1.1 CNCC1=NC=C(C=C1)Br Z5436471179 [1,1,0,0,0,0|2,0,0]=4 558 B10R1.1 CNCC1=NC=C(C=C1)C Z1255425232 [1,1,0,0,0,0|2,0,0]=4 559 B10R1.1 COCC1=CC=C(C=C1)N Z240084568 [1,1,0,0,0,0|2,0,0]=4 560 B10R1.1 CSCC1=CC=C(C=C1)Br Z19854469 [1,1,0,0,0,0|2,0,0]=4 561 B10R1.1 CSCC1=CC=C(C=C1)N Z732207336 [1,1,0,0,0,0|2,0,0]=4 562 B10R1.1 N#CCC1=CC=C(C=C1)F Z89283961 [1,1,0,0,0,0|0,0,2]=4 563 B10R1.1 N#CCC1=CC=C(C=C1)N Z90122117 [1,1,0,0,0,0|0,0,2]=4 564 B10R1.1 N#CCC1=CC=C(C=C1)O Z90120144 [1,1,0,0,0,0|0,0,2]=4 565 B10R1.1 NC1=CC=C(C=C1)CCO Z276600190 [1,1,0,0,0,0|1,0,0]=3 566 B10R1.1 NC1=CN=C(C=C1)CCO Z1898597735 [1,1,0,0,0,0|2,0,0]=4 567 B10R1.1 NCCC1=CC=C(C=C1)Br Z285143750 [1,1,0,0,0,0|0,0,0]=2 568 B10R1.1 NCCC1=CC=C(C=C1)Cl Z57051065 [1,1,0,0,0,0|0,0,0]=2 569 B10R1.1 NCCC1=CC=C(C=C1)F Z90122126 [1,1,0,0,0,0|0,0,0]=2 570 B10R1.1 NCCC1=CC=C(C=C1)I Z2515133713 [1,1,0,0,0,0|0,0,0]=2 571 B10R1.1 NCCC1=CC=C(C=C1)O Z744729058 [1,1,0,0,0,0|0,0,0]=2 572 B10R1.1 NCCC1=CN=C(C=C1)Cl Z1198178633 [1,1,0,0,0,0|1,0,0]=3 573 B10R1.1 NCCC1=CN=C(N=C1)O Z2725055726 [1,1,0,0,0,0|2,0,0]=4 574 B10R1.1 NCCC1=NC=C(C=C1)F Z2238508662 [1,1,0,0,0,0|1,0,0]=3 575 B10R1.1 NCCC1=NC=C(C=C1)O Z2350909287 [1,1,0,0,0,0|1,0,0]=3 576 B10R1.1 NCCC1=NC=C(C=N1)Br Z4752114140 [1,1,0,0,0,0|2,0,0]=4 577 B10R1.1 NOCC1=CC=C(C=C1)Cl Z1198164677 [1,1,0,0,0,0|1,0,0]=3 578 B10R1.1 O=CCC1=CC=C(C=C1)Br Z1079442512 [1,1,0,0,0,0|1,0,1]=4 579 B10R1.1 O=CCC1=CC=C(C=C1)Cl Z993017718 [1,1,0,0,0,0|1,0,1]=4 580 B10R1.1 O=CCC1=CC=C(C=C1)F Z993017752 [1,1,0,0,0,0|1,0,1]=4 581 B10R1.1 OCCC1=CC=C(C=C1)Br Z397587340 [1,1,0,0,0,0|1,0,0]=3 582 B10R1.1 OCCC1=CC=C(C=C1)F Z397587326 [1,1,0,0,0,0|1,0,0]=3 583 B10R1.1 OCCC1=CC=C(C=C1)O Z1250886919 [1,1,0,0,0,0|1,0,0]=3 584 B10R1.4 C=CCC1=C(C=CC=C1)O Z104493210 [1,1,0,0,0,0|1,0,1]=4 585 B10R1.4 CC1=C(C=CC=C1)CC#N Z57039593 [1,1,0,0,0,0|0,0,2]=4 586 B10R1.4 CC1=C(C=CC=C1)CC=O Z993017618 [1,1,0,0,0,0|1,0,1]=4 587 B10R1.4 CC1=C(C=CC=C1)CNN Z336481586 [1,1,0,0,0,0|0,0,0]=2 588 B10R1.4 CC1=C(C=NC=C1)CCN Z1198264124 [1,1,0,0,0,0|1,0,0]=3 589 B10R1.4 CC1=C(N=CC=C1)CCN Z1098234132 [1,1,0,0,0,0|1,0,0]=3 590 B10R1.4 CC1=C(N=CC=C1)CCO Z1198169041 [1,1,0,0,0,0|2,0,0]=4 591 B10R1.4 CCCC1=C(C=CC=C1)Br Z1479686725 [1,1,0,0,0,0|1,0,0]=3 592 B10R1.4 CCCC1=C(C=CC=C1)I Z821158622 [1,1,0,0,0,0|1,0,0]=3 593 B10R1.4 CCCC1=C(C=CC=C1)N Z336087926 [1,1,0,0,0,0|1,0,0]=3 594 B10R1.4 CCNC1=C(C=CC=C1)C Z104477886 [1,1,0,0,0,0|2,0,0]=4 595 B10R1.4 CCNC1=C(C=CC=C1)F Z286518592 [1,1,0,0,0,0|2,0,0]=4 596 B10R1.4 CCNC1=C(C=CC=C1)I Z4405452872 [1,1,0,0,0,0|2,0,0]=4 597 B10R1.4 CCNC1=C(C=CC=C1)N Z359511482 [1,1,0,0,0,0|2,0,0]=4 598 B10R1.4 CCNC1=C(C=CC=C1)O Z5185414820 [1,1,0,0,0,0|2,0,0]=4 599 B10R1.4 CCOC1=C(C=CC=C1)Br Z153728256 [1,1,0,0,0,0|2,0,0]=4 600 B10R1.4 CCOC1=C(C=CC=C1)I Z406416174 [1,1,0,0,0,0|2,0,0]=4 601 B10R1.4 CCOC1=C(C=CC=C1)N Z104478442 [1,1,0,0,0,0|2,0,0]=4 602 B10R1.4 CCOC1=C(C=CC=C1)O Z104480244 [1,1,0,0,0,0|2,0,0]=4 603 B10R1.4 CCSC1=C(C=CC=C1)Br Z149386616 [1,1,0,0,0,0|2,0,0]=4 604 B10R1.4 CCSC1=C(C=CC=C1)N Z316174690 [1,1,0,0,0,0|2,0,0]=4 605 B10R1.4 CCSC1=C(C=CC=C1)O Z905204460 [1,1,0,0,0,0|2,0,0]=4 606 B10R1.4 CNCC1=C(C=CC=C1)C Z56948272 [1,1,0,0,0,0|1,0,0]=3 607 B10R1.4 CNCC1=C(C=CC=C1)Cl Z56955956 [1,1,0,0,0,0|1,0,0]=3 608 B10R1.4 CNCC1=C(C=CC=C1)F Z56953087 [1,1,0,0,0,0|1,0,0]=3 609 B10R1.4 CNCC1=C(C=CC=C1)N Z764242576 [1,1,0,0,0,0|1,0,0]=3 610 B10R1.4 CNCC1=C(C=CC=C1)O Z398513608 [1,1,0,0,0,0|1,0,0]=3 611 B10R1.4 CNCC1=C(C=CC=N1)Cl Z5392638231 [1,1,0,0,0,0|2,0,0]=4 612 B10R1.4 CNCC1=C(C=NC=C1)F Z4545616296 [1,1,0,0,0,0|2,0,0]=4 613 B10R1.4 COCC1=C(C=CC=C1)I Z821093342 [1,1,0,0,0,0|2,0,0]=4 614 B10R1.4 COCC1=C(C=CC=C1)O Z821093528 [1,1,0,0,0,0|2,0,0]=4 615 B10R1.4 CSCC1=C(C=CC=C1)N Z732207148 [1,1,0,0,0,0|2,0,0]=4 616 B10R1.4 N#CCC1=C(C=CC=C1)Cl Z56904744 [1,1,0,0,0,0|0,0,2]=4 617 B10R1.4 N#CCC1=C(C=CC=C1)F Z104477228 [1,1,0,0,0,0|0,0,2]=4 618 B10R1.4 NC1=C(C=CC=C1)CCO Z3417485770 [1,1,0,0,0,0|1,0,0]=3 619 B10R1.4 NCCC1=C(C=CC=C1)Br Z295382782 [1,1,0,0,0,0|0,0,0]=2 620 B10R1.4 NCCC1=C(C=CC=C1)Cl Z285143744 [1,1,0,0,0,0|0,0,0]=2 621 B10R1.4 NCCC1=C(C=CC=C1)F Z57051087 [1,1,0,0,0,0|0,0,0]=2 622 B10R1.4 NCCC1=C(C=CC=C1)O Z594038184 [1,1,0,0,0,0|0,0,0]=2 623 B10R1.4 NCCC1=C(N=CC=C1)O Z5862214540 [1,1,0,0,0,0|1,0,0]=3 624 B10R1.4 NCCN1C=CC=CC1=O Z1891776659 [1,1,0,0,0,0|1,0,0]=3 625 B10R1.4 NCCN1C=CC=NC1=O Z3038857671 [1,1,0,0,0,0|2,0,0]=4 626 B10R1.4 NCCN1C=NC=CC1=O Z2379084242 [1,1,0,0,0,0|2,0,0]=4 627 B10R1.4 NCCN1N=CC=CC1=O Z1021422614 [1,1,0,0,0,0|2,0,0]=4 628 B10R1.4 O=C1C=CC=CN1CCO Z234898059 [1,1,0,0,0,0|2,0,0]=4 629 B10R1.4 O=CCC1=C(C=CC=C1)Br Z1183459130 [1,1,0,0,0,0|1,0,1]=4 630 B10R1.4 O=CCC1=C(C=CC=C1)F Z993017796 [1,1,0,0,0,0|1,0,1]=4 631 B10R1.4 OCCC1=C(C=CC=C1)Br Z1183459188 [1,1,0,0,0,0|1,0,0]=3 632 B10R1.4 OCCC1=C(C=CC=C1)F Z397587382 [1,1,0,0,0,0|1,0,0]=3 633 B10R1.10 CC1=CC(=CC=C1)CC#N Z285131450 [1,1,0,0,0,0|0,0,2]=4 634 B10R1.10 CC1=CC(=CC=C1)CCN Z241056516 [1,1,0,0,0,0|0,0,0]=2 635 B10R1.10 CC1=NC(=CC=C1)CCN Z1098234194 [1,1,0,0,0,0|1,0,0]=3 636 B10R1.10 CCCC1=CC(=CC=C1)Br Z1541586975 [1,1,0,0,0,0|1,0,0]=3 637 B10R1.10 CCNC1=CC(=CC=C1)Br Z1217910559 [1,1,0,0,0,0|2,0,0]=4 638 B10R1.10 CCNC1=CC(=CC=C1)C Z56785946 [1,1,0,0,0,0|2,0,0]=4 639 B10R1.10 CCNC1=CC(=CC=C1)Cl Z286371690 [1,1,0,0,0,0|2,0,0]=4 640 B10R1.10 CCOC1=CC(=CC=C1)Br Z53833934 [1,1,0,0,0,0|2,0,0]=4 641 B10R1.10 CCOC1=CC(=CC=C1)I Z54181578 [1,1,0,0,0,0|2,0,0]=4 642 B10R1.10 CCSC1=CC(=CC=C1)Br Z1090207966 [1,1,0,0,0,0|2,0,0]=4 643 B10R1.10 CCSC1=CC(=CC=C1)N Z600393424 [1,1,0,0,0,0|2,0,0]=4 644 B10R1.10 CNCC1=CC(=CC=C1)C Z102766992 [1,1,0,0,0,0|1,0,0]=3 645 B10R1.10 CNCC1=CC(=CC=C1)Cl Z56963343 [1,1,0,0,0,0|1,0,0]=3 646 B10R1.10 CNCC1=CC(=CC=C1)F Z56946085 [1,1,0,0,0,0|1,0,0]=3 647 B10R1.10 CNCC1=CC(=CC=C1)I Z3302798080 [1,1,0,0,0,0|1,0,0]=3 648 B10R1.10 CNCC1=CC(=CC=C1)O Z102766970 [1,1,0,0,0,0|1,0,0]=3 649 B10R1.10 CNCC1=CC(=CN=C1)Br Z5095377359 [1,1,0,0,0,0|2,0,0]=4 650 B10R1.10 CNCC1=CC=CC(=O)N1 Z2895739022 [1,1,0,0,0,0|2,0,0]=4 651 B10R1.10 CNCC1=NC(=CC=C1)C Z1255523287 [1,1,0,0,0,0|2,0,0]=4 652 B10R1.10 CNCC1=NC=CC(=C1)C Z5443664854 [1,1,0,0,0,0|2,0,0]=4 653 B10R1.10 CNCC1=NC=CC(=C1)Cl Z3214695745 [1,1,0,0,0,0|2,0,0]=4 654 B10R1.10 COCC1=CC(=CC=C1)N Z285163816 [1,1,0,0,0,0|2,0,0]=4 655 B10R1.10 COCC1=CC(=CC=C1)O Z821093526 [1,1,0,0,0,0|2,0,0]=4 656 B10R1.10 CSCC1=CC(=CC=C1)Br Z17129082 [1,1,0,0,0,0|2,0,0]=4 657 B10R1.10 CSCC1=CC(=CC=C1)N Z732207152 [1,1,0,0,0,0|2,0,0]=4 658 B10R1.10 N#CCC1=CC=CC(=C1)Cl Z57039594 [1,1,0,0,0,0|0,0,2]=4 659 B10R1.10 N#CCC1=CC=CC(=C1)F Z104477994 [1,1,0,0,0,0|0,0,2]=4 660 B10R1.10 N#CCC1=CC=CC(=C1)N Z90120426 [1,1,0,0,0,0|0,0,2]=4 661 B10R1.10 N#CCC1=CC=CC(=C1)O Z1198161712 [1,1,0,0,0,0|0,0,2]=4 662 B10R1.10 NC1=CC(=CC=C1)CCO Z1198160776 [1,1,0,0,0,0|1,0,0]=3 663 B10R1.10 NC1=NC=CC(=C1)CCO Z1197888440 [1,1,0,0,0,0|2,0,0]=4 664 B10R1.10 NCCC1=CC(=CC=C1)Br Z285143760 [1,1,0,0,0,0|0,0,0]=2 665 B10R1.10 NCCC1=CC(=CC=C1)Cl Z57051063 [1,1,0,0,0,0|0,0,0]=2 666 B10R1.10 NCCC1=CC(=CC=C1)F Z96092963 [1,1,0,0,0,0|0,0,0]=2 667 B10R1.10 NCCC1=CC(=CC=C1)I Z4874662549 [1,1,0,0,0,0|0,0,0]=2 668 B10R1.10 NCCC1=CC(=CC=C1)O Z935140764 [1,1,0,0,0,0|0,0,0]=2 669 B10R1.10 NCCC1=CC(=CN=C1)O Z1504671788 [1,1,0,0,0,0|1,0,0]=3 670 B10R1.10 NCCC1=CC(=NC=C1)N Z2310698980 [1,1,0,0,0,0|1,0,0]=3 671 B10R1.10 NCCC1=NC(=NC=C1)N Z5619121124 [1,1,0,0,0,0|2,0,0]=4 672 B10R1.10 NCCC1=NC=NC(=C1)Br Z4513781102 [1,1,0,0,0,0|2,0,0]=4 673 B10R1.10 NCCC1=NC=NC(=C1)O Z2310716008 [1,1,0,0,0,0|2,0,0]=4 674 B10R1.10 NOCC1=CC(=CC=C1)Cl Z1198339567 [1,1,0,0,0,0|1,0,0]=3 675 B10R1.10 O=CCC1=CC=CC(=C1)Br Z1079442816 [1,1,0,0,0,0|1,0,1]=4 676 B10R1.10 O=CCC1=CC=CC(=C1)Cl Z993017836 [1,1,0,0,0,0|1,0,1]=4 677 B10R1.10 OCCC1=CC(=CC=C1)Cl Z992289382 [1,1,0,0,0,0|1,0,0]=3 678 B10R1.10 OCCC1=CC(=CC=C1)F Z397587224 [1,1,0,0,0,0|1,0,0]=3 679 B10R1.15 C=C(CN)C1=CC=CC=C1 Z2065464323 [1,1,0,0,0,0|0,0,1]=3 680 B10R1.15 C=CC(O)C1=CC=CC=C1 Z1255438717 [1,1,0,0,0,0|1,0,1]=4 681 B10R1.15 CC(C=O)C1=CC=CC=C1 Z104495674 [1,1,0,0,0,0|1,0,1]=4 682 B10R1.15 CC(CBr)C1=CC=CC=C1 Z756118300 [1,1,0,0,0,0|1,0,0]=3 683 B10R1.15 CC(CN)C1=CC=NC=C1 Z415654978 [1,1,0,0,0,0|1,0,0]=3 684 B10R1.15 CCC(=O)C1=CC=CC=C1 Z104473068 [1,1,0,0,0,0|1,0,1]=4 685 B10R1.15 CCC(N)C1=CC=CC=C1 Z1262252904 [1,1,0,0,0,0|1,0,0]=3 686 B10R1.15 CCC(N)C1=CC=NC=C1 Z228583312 [1,1,0,0,0,0|2,0,0]=4 687 B10R1.15 CCC(O)C1=CC=CC=C1 Z335245178 [1,1,0,0,0,0|1,0,0]=3 688 B10R1.15 CCC(O)C1=CC=NC=C1 Z513749638 [1,1,0,0,0,0|2,0,0]=4 689 B10R1.15 CNC(=N)C1=CC=CC=C1 Z2096088186 [1,1,0,0,0,0|1,0,1]=4 690 B10R1.15 CNC(=O)C1=CC=CC=C1 Z32016410 [1,1,0,0,0,0|1,0,1]=4 691 B10R1.15 CNC(C)C1=CC=CC=C1 Z85917524 [1,1,0,0,0,0|1,0,0]=3 692 B10R1.15 CNC(C)C1=CN=CC=C1 Z451350188 [1,1,0,0,0,0|2,0,0]=4 693 B10R1.15 CNC(C)C1=NC=CC=C1 Z451350194 [1,1,0,0,0,0|2,0,0]=4 694 B10R1.15 C[C@H](CN)C1=CC=CC=C1 Z1203578128 [1,1,0,0,0,0|0,0,0]=2 695 B10R1.15 N#CC(Br)C1=CC=CC=C1 Z1198157485 [1,1,0,0,0,0|0,0,2]=4 696 B10R1.15 NC(CO)C1=CC=CC=C1 Z381674942 [1,1,0,0,0,0|1,0,0]=3 697 B10R1.15 NC(CO)C1=CN=CC=C1 Z2350903961 [1,1,0,0,0,0|2,0,0]=4 698 B10R1.15 NCC(=O)C1=CC=CC=C1 Z600428568 [1,1,0,0,0,0|0,0,1]=3 699 B10R1.15 NCC(=O)C1=CC=NC=C1 Z2677521709 [1,1,0,0,0,0|1,0,1]=4 700 B10R1.15 NCC(N)C1=CC=CC=C1 Z425861034 [1,1,0,0,0,0|0,0,0]=2 701 B10R1.15 NCC(O)C1=CC=CC=C1 Z104476088 [1,1,0,0,0,0|0,0,0]=2 702 B10R1.15 NCC(O)C1=CN=CC=C1 Z336086578 [1,1,0,0,0,0|1,0,0]=3 703 B10R1.15 NCC(O)C1=NC=CC=C1 Z802671456 [1,1,0,0,0,0|1,0,0]=3 704 B10R1.15 NNC(=O)C1=CC=CC=C1 Z56926669 [1,1,0,0,0,0|0,0,1]=3 705 B10R1.15 NNC(=O)C1=CC=NC=C1 Z58981801 [1,1,0,0,0,0|1,0,1]=4 706 B10R1.15 NNC(=O)C1=CN=CC=C1 Z58981809 [1,1,0,0,0,0|1,0,1]=4 707 B10R1.15 NNC(=O)C1=NC=CC=C1 Z56922131 [1,1,0,0,0,0|1,0,1]=4 708 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 Z1201618614 [1,1,0,0,0,0|1,0,0]=3 709 B10R1.15 N[C@H](CO)C1=CC=CC=C1 Z1101444224 [1,1,0,0,0,0|1,0,0]=3 710 B10R1.15 O=C(CCl)C1=CC=CC=C1 Z57834468 [1,1,0,0,0,0|1,0,1]=4 711 B10R1.15 O=C(CO)C1=CC=CC=C1 Z906206792 [1,1,0,0,0,0|1,0,1]=4 712 B10R1.15 O=C(NO)C1=CC=CC=C1 Z56912029 [1,1,0,0,0,0|1,0,1]=4 713 B10R1.15 OCC(O)C1=CC=NC=C1 Z2736474279 [1,1,0,0,0,0|2,0,0]=4 714 B10R1.15 OCC(O)C1=NC=CC=C1 Z4985119178 [1,1,0,0,0,0|2,0,0]=4 715 B10R1.18 CC(C)CC1=CC=CC=C1 Z104486386 [1,1,0,0,0,0|1,0,0]=3 716 B10R1.18 CC(C)CC1=NC=CC=C1 Z1201621742 [1,1,0,0,0,0|2,0,0]=4 717 B10R1.18 CC(C)NC1=CC=CC=C1 Z104475020 [1,1,0,0,0,0|2,0,0]=4 718 B10R1.18 CC(C)OC1=CC=CC=C1 Z53833867 [1,1,0,0,0,0|2,0,0]=4 719 B10R1.18 CC(N)CC1=CC=NC=C1 Z285143992 [1,1,0,0,0,0|1,0,0]=3 720 B10R1.18 CC(O)CC1=CC=CC=C1 Z513749298 [1,1,0,0,0,0|1,0,0]=3 721 B10R1.18 CC(O)CC1=CC=NC=C1 Z992409872 [1,1,0,0,0,0|2,0,0]=4 722 B10R1.18 CC(O)CC1=NC=CC=C1 Z513750714 [1,1,0,0,0,0|2,0,0]=4 723 B10R1.18 CN(C)CC1=CN=CC=C1 Z140563088 [1,1,0,0,0,0|2,0,0]=4 724 B10R1.18 CN(C)CC1=NC=CC=C1 Z4614651190 [1,1,0,0,0,0|2,0,0]=4 725 B10R1.18 N=C(N)CC1=CC=CC=C1 Z600428462 [1,1,0,0,0,0|0,0,1]=3 726 B10R1.18 N=C(N)CC1=CC=NC=C1 Z2441004470 [1,1,0,0,0,0|1,0,1]=4 727 B10R1.18 N=C(N)CC1=CN=CC=C1 Z2350941593 [1,1,0,0,0,0|1,0,1]=4 728 B10R1.18 NC(=O)CC1=CC=CC=C1 Z33546508 [1,1,0,0,0,0|0,0,1]=3 729 B10R1.18 NC(=O)CC1=CC=NC=C1 Z234895093 [1,1,0,0,0,0|1,0,1]=4 730 B10R1.18 NC(=O)OC1=CC=CC=C1 Z33547080 [1,1,0,0,0,0|1,0,1]=4 731 B10R1.18 NC(=S)CC1=CC=CC=C1 Z56928578 [1,1,0,0,0,0|0,0,1]=3 732 B10R1.18 NC(=S)NC1=CC=CC=C1 Z57474172 [1,1,0,0,0,0|1,0,1]=4 733 B10R1.18 O=S(O)CC1=CC=CC=C1 Z3211806022 [1,1,0,0,0,0|2,0,0]=4 734 B10R1.18 O=[N+]([O-])CC1=CC=CC=C1 Z995236210 [1,1,0,0,0,0|1,0,1]=4 735 B10R1.18 OB(O)CC1=CC=CC=C1 Z1147227831 [1,1,0,0,0,0|2,0,0]=4 736 B10R1.21 CCNCCC1=CC=CS1 Z162417018 [0,1,0,0,1,0|2,0,0]=4 737 B10R1.21 NCCSCC1=CSC=C1 Z111412082 [0,1,0,0,1,0|2,0,0]=4 738 B10R1.27 CC(CN)CC1=CC=CS1 Z992308868 [0,1,0,0,1,0|2,0,0]=4 739 B10R1.27 CNC(C)CC1=CSC=C1 Z1333043374 [0,1,0,0,1,0|2,0,0]=4 740 B10R1.27 NNC(=O)CC1=CC=CS1 Z58981810 [0,1,0,0,1,0|1,0,1]=4 741 B12R1.1 C#CCNCC1=CC=C(C=C1)C Z857666950 [0,2,0,0,0,0|2,0,0]=4 742 B12R1.1 C#CCNCC1=CC=C(C=C1)F Z951367660 [0,2,0,0,0,0|2,0,0]=4 743 B12R1.1 CC1=CC=C(C=C1)CNCCO Z57328136 [0,2,0,0,0,0|2,0,0]=4 744 B12R1.1 CC1=CC=C(C=C1)NCCC#N Z56887629 [0,2,0,0,0,0|1,0,1]=4 745 B12R1.1 CC1=CC=C(C=C1)OCCC#N Z54337098 [0,2,0,0,0,0|1,0,1]=4 746 B12R1.1 CC1=CC=C(C=C1)OCCCN Z285166764 [0,2,0,0,0,0|1,0,0]=3 747 B12R1.1 CC1=CC=C(C=C1)SCCC#N Z54555980 [0,2,0,0,0,0|1,0,1]=4 748 B12R1.1 CC1=CN=C(C=C1)NCCCN Z1267881688 [0,2,0,0,0,0|2,0,0]=4 749 B12R1.1 CCCCOC1=CC=C(C=C1)O Z381414690 [0,2,0,0,0,0|2,0,0]=4 750 B12R1.1 CCCNCC1=CC=C(C=C1)F Z57065603 [0,2,0,0,0,0|2,0,0]=4 751 B12R1.1 CNC/C=C/C1=CC=C(C=C1)Br Z1834223589 [0,2,0,0,0,0|1,0,1]=4 752 B12R1.1 CNCCOC1=CC=C(C=C1)Br Z55993065 [0,2,0,0,0,0|1,0,0]=3 753 B12R1.1 CNCCOC1=CC=C(C=C1)C Z138105388 [0,2,0,0,0,0|1,0,0]=3 754 B12R1.1 CNCCOC1=CC=C(C=C1)Cl Z56963344 [0,2,0,0,0,0|1,0,0]=3 755 B12R1.1 CNCCOC1=CC=C(C=C1)F Z138105420 [0,2,0,0,0,0|1,0,0]=3 756 B12R1.1 CNCCOC1=CC=C(C=C1)O Z1209979801 [0,2,0,0,0,0|1,0,0]=3 757 B12R1.1 COCCNC1=CC=C(C=C1)N Z812516870 [0,2,0,0,0,0|2,0,0]=4 758 B12R1.1 COCCOC1=CC=C(C=C1)Br Z167838728 [0,2,0,0,0,0|2,0,0]=4 759 B12R1.1 COCCOC1=CC=C(C=C1)F Z285938284 [0,2,0,0,0,0|2,0,0]=4 760 B12R1.1 COCCOC1=CC=C(C=C1)O Z381414750 [0,2,0,0,0,0|2,0,0]=4 761 B12R1.1 COCCOC1=CC=C(C=C1)S Z1689885585 [0,2,0,0,0,0|2,0,0]=4 762 B12R1.1 COCCSC1=CC=C(C=C1)N Z412014166 [0,2,0,0,0,0|2,0,0]=4 763 B12R1.1 CSCCOC1=CC=C(C=C1)I Z54518503 [0,2,0,0,0,0|2,0,0]=4 764 B12R1.1 ClC1=CC=C(C=C1)OCCCBr Z90122426 [0,2,0,0,0,0|2,0,0]=4 765 B12R1.1 FC1=CC=C(C=C1)OCCCBr Z90122147 [0,2,0,0,0,0|2,0,0]=4 766 B12R1.1 FC1=CC=C(C=C1)OCCCCl Z56347250 [0,2,0,0,0,0|2,0,0]=4 767 B12R1.1 N#CCCNC1=CC=C(C=C1)Br Z56855204 [0,2,0,0,0,0|1,0,1]=4 768 B12R1.1 N#CCCNC1=CC=C(C=C1)Cl Z56938006 [0,2,0,0,0,0|1,0,1]=4 769 B12R1.1 N#CCCNC1=CC=C(C=C1)F Z56813500 [0,2,0,0,0,0|1,0,1]=4 770 B12R1.1 N#CCCOC1=CC=C(C=C1)Br Z54336945 [0,2,0,0,0,0|1,0,1]=4 771 B12R1.1 N#CCCOC1=CC=C(C=C1)F Z54337110 [0,2,0,0,0,0|1,0,1]=4 772 B12R1.1 N#CCCSC1=CC=C(C=C1)F Z54340130 [0,2,0,0,0,0|1,0,1]=4 773 B12R1.1 N#CCSCC1=CC=C(C=C1)Cl Z18433100 [0,2,0,0,0,0|1,0,1]=4 774 B12R1.1 NC1=CC=C(C=C1)CCCCO Z1262622677 [0,2,0,0,0,0|2,0,0]=4 775 B12R1.1 NC1=CC=C(C=C1)COCCO Z332379572 [0,2,0,0,0,0|2,0,0]=4 776 B12R1.1 NC1=CC=C(C=C1)OCCCO Z382707186 [0,2,0,0,0,0|2,0,0]=4 777 B12R1.1 NC1=CC=C(C=C1)SCCCO Z412012390 [0,2,0,0,0,0|2,0,0]=4 778 B12R1.1 NCC/C=C/C1=CC=C(C=C1)Br Z2651620817 [0,2,0,0,0,0|1,0,1]=4 779 B12R1.1 NCCCCC1=CC=C(C=C1)Br Z5880376049 [0,2,0,0,0,0|1,0,0]=3 780 B12R1.1 NCCCCC1=CC=C(C=C1)Cl Z3234944947 [0,2,0,0,0,0|1,0,0]=3 781 B12R1.1 NCCCOC1=CC=C(C=C1)F Z271006096 [0,2,0,0,0,0|1,0,0]=3 782 B12R1.1 NCCCSC1=CC=C(C=C1)F Z56988241 [0,2,0,0,0,0|1,0,0]=3 783 B12R1.1 NCCOCC1=CC=C(C=C1)Cl Z1511495255 [0,2,0,0,0,0|1,0,0]=3 784 B12R1.1 NCCSCC1=CC=C(C=C1)Cl Z1891773800 [0,2,0,0,0,0|1,0,0]=3 785 B12R1.1 NCCSCC1=CN=C(C=C1)Cl Z406685558 [0,2,0,0,0,0|2,0,0]=4 786 B12R1.1 NNCCOC1=CC=C(C=C1)Cl Z94597880 [0,2,0,0,0,0|0,0,0]=2 787 B12R1.1 OCCCNC1=CC=C(C=C1)Cl Z104647680 [0,2,0,0,0,0|2,0,0]=4 788 B12R1.1 OCCCOC1=CC=C(C=C1)Br Z425795726 [0,2,0,0,0,0|2,0,0]=4 789 B12R1.1 OCCCOC1=CC=C(C=C1)F Z228585902 [0,2,0,0,0,0|2,0,0]=4 790 B12R1.1 OCCNCC1=CC=C(C=C1)F Z3225797537 [0,2,0,0,0,0|2,0,0]=4 791 B12R1.16 CCCC(N)C1=CC=C(C=C1)Cl Z1416203204 [0,2,0,0,0,0|2,0,0]=4 792 B12R1.16 CNCC(O)C1=CC=C(C=C1)F Z1263820285 [0,2,0,0,0,0|1,0,0]=3 793 B12R1.16 COCC(N)C1=CC=C(C=C1)F Z1297772361 [0,2,0,0,0,0|2,0,0]=4 794 B12R1.16 NC(CCO)C1=CC=C(C=C1)Br Z979743656 [0,2,0,0,0,0|2,0,0]=4 795 B12R1.16 NC(CCO)C1=CC=C(C=C1)F Z979743658 [0,2,0,0,0,0|2,0,0]=4 796 B12R1.21 CC(=O)CCC1=CC=C(C=C1)C Z406376788 [0,2,0,0,0,0|2,0,0]=4 797 B12R1.21 CC(=O)CCC1=CC=C(C=C1)F Z406376784 [0,2,0,0,0,0|2,0,0]=4 798 B12R1.21 CC(=O)CCC1=CC=C(C=C1)I Z1263632422 [0,2,0,0,0,0|2,0,0]=4 799 B12R1.21 CC(C)CCC1=CC=C(C=C1)N Z424736042 [0,2,0,0,0,0|2,0,0]=4 800 B12R1.21 CC(N)CCC1=CC=C(C=C1)Br Z235361851 [0,2,0,0,0,0|1,0,0]=3 801 B12R1.21 CC(N)CCC1=CC=C(C=C1)I Z1947443961 [0,2,0,0,0,0|1,0,0]=3 802 B12R1.21 CC(N)CCC1=CC=C(C=C1)O Z220327456 [0,2,0,0,0,0|1,0,0]=3 803 B12R1.21 CC(N)COC1=CC=C(C=C1)F Z271017038 [0,2,0,0,0,0|2,0,0]=4 804 B12R1.21 CC(O)CCC1=CC=C(C=C1)O Z57921369 [0,2,0,0,0,0|2,0,0]=4 805 B12R1.21 CC1=CC=C(C=C1)CCC(=O)N Z194976512 [0,2,0,0,0,0|1,0,0]=3 806 B12R1.21 CC1=CC=C(C=C1)CCC(=O)O Z169855336 [0,2,0,0,0,0|2,0,0]=4 807 B12R1.21 CC1=CC=C(C=C1)CNC(=N)N Z911465430 [0,2,0,0,0,0|2,0,0]=4 808 B12R1.21 CC1=CC=C(C=C1)CNC(=O)N Z198194838 [0,2,0,0,0,0|2,0,0]=4 809 B12R1.21 CC1=CC=C(C=C1)CNC(=S)N Z56915894 [0,2,0,0,0,0|2,0,0]=4 810 B12R1.21 CC1=CC=C(C=C1)OCC(=O)N Z19732046 [0,2,0,0,0,0|2,0,0]=4 811 B12R1.21 CC1=CC=C(C=C1)OCC(=S)N Z295396970 [0,2,0,0,0,0|2,0,0]=4 812 B12R1.21 CC1=CC=C(C=C1)OCC(C)N Z285166960 [0,2,0,0,0,0|2,0,0]=4 813 B12R1.21 CC1=CC=C(C=C1)SCC(=O)N Z18770000 [0,2,0,0,0,0|2,0,0]=4 814 B12R1.21 CC1=CC=C(C=C1)SCC(C)N Z1238717325 [0,2,0,0,0,0|2,0,0]=4 815 B12R1.21 CN(C)CCC1=CC=C(C=C1)Br Z2335774813 [0,2,0,0,0,0|1,0,0]=3 816 B12R1.21 CN(C)CCC1=CC=C(C=C1)N Z335289246 [0,2,0,0,0,0|1,0,0]=3 817 B12R1.21 N=C(N)SCC1=CC=C(C=C1)Br Z48820389 [0,2,0,0,0,0|2,0,0]=4 818 B12R1.21 N=C(N)SCC1=CC=C(C=C1)Cl Z48820386 [0,2,0,0,0,0|2,0,0]=4 819 B12R1.21 NC(=O)CCC1=CC=C(C=C1)F Z87614992 [0,2,0,0,0,0|1,0,0]=3 820 B12R1.21 NC(=O)CCC1=CC=C(C=C1)N Z414316852 [0,2,0,0,0,0|1,0,0]=3 821 B12R1.21 NC(=O)CNC1=CC=C(C=C1)Br Z104586672 [0,2,0,0,0,0|2,0,0]=4 822 B12R1.21 NC(=O)CNC1=CC=C(C=C1)Cl Z104647358 [0,2,0,0,0,0|2,0,0]=4 823 B12R1.21 NC(=O)CNC1=CC=C(C=C1)I Z104728120 [0,2,0,0,0,0|2,0,0]=4 824 B12R1.21 NC(=O)COC1=CC=C(C=C1)Br Z19725712 [0,2,0,0,0,0|2,0,0]=4 825 B12R1.21 NC(=O)COC1=CC=C(C=C1)F Z19734788 [0,2,0,0,0,0|2,0,0]=4 826 B12R1.21 NC(=O)COC1=CC=C(C=C1)I Z25086979 [0,2,0,0,0,0|2,0,0]=4 827 B12R1.21 NC(=O)COC1=CC=C(C=C1)N Z239127428 [0,2,0,0,0,0|2,0,0]=4 828 B12R1.21 NC(=O)COC1=CC=C(C=C1)O Z381414726 [0,2,0,0,0,0|2,0,0]=4 829 B12R1.21 NC(=O)CSC1=CC=C(C=C1)Br Z18744574 [0,2,0,0,0,0|2,0,0]=4 830 B12R1.21 NC(=O)CSC1=CC=C(C=C1)F Z16034821 [0,2,0,0,0,0|2,0,0]=4 831 B12R1.21 NC(=O)NCC1=CC=C(C=C1)F Z198194834 [0,2,0,0,0,0|2,0,0]=4 832 B12R1.21 NC(=O)NCC1=CC=C(C=C1)N Z600391988 [0,2,0,0,0,0|2,0,0]=4 833 B12R1.21 NC(=S)COC1=CC=C(C=C1)Cl Z295395122 [0,2,0,0,0,0|2,0,0]=4 834 B12R1.21 NC(=S)NCC1=CC=C(C=C1)F Z111411726 [0,2,0,0,0,0|2,0,0]=4 835 B12R1.21 NC1=CC=C(C=C1)CCC(=O)O Z336079452 [0,2,0,0,0,0|2,0,0]=4 836 B12R1.21 O=C(O)CCC1=CC=C(C=C1)Br Z118438622 [0,2,0,0,0,0|2,0,0]=4 837 B12R1.21 O=C(O)CCC1=CC=C(C=C1)Cl Z178961272 [0,2,0,0,0,0|2,0,0]=4 838 B12R1.21 O=C(O)CCC1=CC=C(C=C1)F Z89264973 [0,2,0,0,0,0|2,0,0]=4 839 B12R1.21 O=C(O)CCC1=CC=C(C=C1)O Z317038012 [0,2,0,0,0,0|2,0,0]=4 840 B12R1.49 CC(CN)OC1=CC=C(C=C1)Br Z844632490 [0,2,0,0,0,0|2,0,0]=4 841 B12R1.49 CC(CN)OC1=CC=C(C=C1)Cl Z844632498 [0,2,0,0,0,0|2,0,0]=4 842 B12R1.49 CC(CN)OC1=CC=C(C=C1)F Z274779140 [0,2,0,0,0,0|2,0,0]=4 843 B12R1.49 CC(CN)SC1=CC=C(C=C1)Br Z1266854950 [0,2,0,0,0,0|2,0,0]=4 844 B12R1.49 CC1=CC=C(C=C1)CC(=O)NO Z90728587 [0,2,0,0,0,0|1,0,1]=4 845 B12R1.49 CC1=CC=C(C=C1)CC(Br)C#N Z85923462 [0,2,0,0,0,0|1,0,1]=4 846 B12R1.49 CC1=CC=C(C=C1)CC(Cl)C=O Z982126370 [0,2,0,0,0,0|2,0,0]=4 847 B12R1.49 CC1=CC=C(C=C1)CC(N)CO Z1800620539 [0,2,0,0,0,0|2,0,0]=4 848 B12R1.49 CC1=CC=C(C=C1)NC(=S)NN Z56813496 [0,2,0,0,0,0|1,0,1]=4 849 B12R1.49 CC1=CC=C(C=C1)OC(C)CN Z844632044 [0,2,0,0,0,0|2,0,0]=4 850 B12R1.49 CCC(N)CC1=CC=C(C=C1)Br Z2582143601 [0,2,0,0,0,0|2,0,0]=4 851 B12R1.49 CCC(N)CC1=CC=C(C=C1)C Z431980102 [0,2,0,0,0,0|2,0,0]=4 852 B12R1.49 CCC(N)CC1=CC=C(C=C1)Cl Z2044769785 [0,2,0,0,0,0|2,0,0]=4 853 B12R1.49 CCC(N)CC1=CC=C(C=C1)F Z2492774579 [0,2,0,0,0,0|2,0,0]=4 854 B12R1.49 CCC(N)CC1=CC=C(C=C1)O Z1815149210 [0,2,0,0,0,0|2,0,0]=4 855 B12R1.49 CCC(O)CC1=CC=C(C=C1)C Z513751166 [0,2,0,0,0,0|2,0,0]=4 856 B12R1.49 CNC(=O)CC1=CC=C(C=C1)Br Z30272406 [0,2,0,0,0,0|1,0,1]=4 857 B12R1.49 CNC(=O)CC1=CC=C(C=C1)N Z239124750 [0,2,0,0,0,0|1,0,1]=4 858 B12R1.49 CNC(=O)CC1=CC=C(C=C1)O Z135505392 [0,2,0,0,0,0|1,0,1]=4 859 B12R1.49 C[C@@H](CN)OC1=CC=C(C=C1)Cl Z1860991587 [0,2,0,0,0,0|2,0,0]=4 860 B12R1.49 NC(CO)CC1=CC=C(C=C1)Cl Z3244488892 [0,2,0,0,0,0|2,0,0]=4 861 B12R1.49 NC(CO)CC1=CC=C(C=C1)F Z1849004242 [0,2,0,0,0,0|2,0,0]=4 862 B12R1.49 NC(CO)CC1=CC=C(C=C1)I Z1263636488 [0,2,0,0,0,0|2,0,0]=4 863 B12R1.49 NC1=CC=C(C=C1)CC(F)CO Z4580450313 [0,2,0,0,0,0|2,0,0]=4 864 B12R1.49 NCC(=O)CC1=CC=C(C=C1)F Z1889902528 [0,2,0,0,0,0|1,0,1]=4 865 B12R1.49 NCC(O)CC1=CC=C(C=C1)Br Z4990293859 [0,2,0,0,0,0|1,0,0]=3 866 B12R1.49 NNC(=O)CC1=CC=C(C=C1)Cl Z56346881 [0,2,0,0,0,0|0,0,1]=3 867 B12R1.49 NNC(=O)CC1=CC=C(C=C1)F Z56347387 [0,2,0,0,0,0|0,0,1]=3 868 B12R1.49 NNC(=S)NC1=CC=C(C=C1)Cl Z56828393 [0,2,0,0,0,0|1,0,1]=4 869 B12R1.49 NNC(=S)NC1=CC=C(C=C1)F Z56828392 [0,2,0,0,0,0|1,0,1]=4 870 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)O Z295456854 [0,2,0,0,0,0|2,0,0]=4 871 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)O Z203038576 [0,2,0,0,0,0|2,0,0]=4 872 B12R1.49 O=C(CC1=CC=C(C=C1)Br)NO Z59182179 [0,2,0,0,0,0|1,0,1]=4 873 B12R1.49 O=C(CC1=CC=C(C=C1)Cl)NO Z59182084 [0,2,0,0,0,0|1,0,1]=4 874 B12R1.49 O=C(CC1=CC=C(C=C1)F)NO Z59182031 [0,2,0,0,0,0|1,0,1]=4 875 B12R1.49 O=C(CC1=CC=C(C=C1)O)NO Z135512374 [0,2,0,0,0,0|1,0,1]=4 876 B12R1.69 CC1=CC(=C(C=C1)CCCN)C Z90666959 [0,2,0,0,0,0|1,0,0]=3 877 B12R1.69 CNCCC1=C(C=C(C=C1)F)F Z3302963389 [0,2,0,0,0,0|1,0,0]=3 878 B12R1.69 NCCCC1=C(C=C(C=C1)Br)F Z424783082 [0,2,0,0,0,0|1,0,0]=3 879 B12R1.69 NCCCC1=C(C=C(C=C1)Cl)Cl Z424783018 [0,2,0,0,0,0|1,0,0]=3 880 B12R1.69 NCCOC1=C(C=C(C=C1)Cl)Cl Z5435727950 [0,2,0,0,0,0|2,0,0]=4 881 B12R1.69 NCCOC1=C(C=C(C=C1)F)F Z1263820293 [0,2,0,0,0,0|2,0,0]=4 882 B12R1.69 O=CCCC1=C(C=C(C=C1)Cl)Cl Z993017674 [0,2,0,0,0,0|2,0,0]=4 883 B12R1.69 O=CCCC1=C(C=C(C=C1)F)F Z993017790 [0,2,0,0,0,0|2,0,0]=4 884 B12R1.71 CCC1=CC=C(C=C1)CCC=O Z993017820 [0,2,0,0,0,0|2,0,0]=4 885 B12R1.71 CCCCC1=CC=C(C=C1)C=O Z385369906 [0,2,0,0,0,0|2,0,0]=4 886 B12R1.71 CCCCC1=CC=C(C=C1)NC Z1331041631 [0,2,0,0,0,0|2,0,0]=4 887 B12R1.71 COC1=CC=C(C=C1)CCC=O Z1079442590 [0,2,0,0,0,0|2,0,0]=4 888 B12R1.71 COC1=CC=C(C=C1)CCCN Z291234224 [0,2,0,0,0,0|1,0,0]=3 889 B12R1.71 COC1=CC=C(C=C1)CCNN Z2327071096 [0,2,0,0,0,0|0,0,0]=2 890 B12R1.71 COC1=CC=C(C=C1)OCCN Z54845983 [0,2,0,0,0,0|2,0,0]=4 891 B12R1.71 COCCC1=CC=C(C=C1)CO Z385370424 [0,2,0,0,0,0|2,0,0]=4 892 B12R1.71 N#CC1=CC=C(C=C1)CCC=O Z1198182710 [0,2,0,0,0,0|2,0,0]=4 893 B12R1.71 N#CC1=CC=C(C=C1)OCCN Z1262398529 [0,2,0,0,0,0|2,0,0]=4 894 B12R1.385 CC1=C(C=C(C=C1)SCCN)C Z56347318 [0,2,0,0,0,0|2,0,0]=4 895 B12R1.385 CCCCC1=CC(=C(C=C1)C)N Z1262626215 [0,2,0,0,0,0|2,0,0]=4 896 B12R1.385 CCCCC1=CC(=C(C=C1)O)C Z1416171318 [0,2,0,0,0,0|2,0,0]=4 897 B12R1.385 CNCCC1=CC(=C(C=C1)O)Br Z3710478807 [0,2,0,0,0,0|1,0,0]=3 898 B12R1.385 COCCC1=CC(=C(C=C1)O)Cl Z1513901493 [0,2,0,0,0,0|2,0,0]=4 899 B12R1.385 NCCOC1=CC(=C(C=C1)Cl)F Z2235790693 [0,2,0,0,0,0|2,0,0]=4 900 B12R1.385 NCCOC1=CC(=C(C=C1)F)F Z1263820280 [0,2,0,0,0,0|2,0,0]=4 901 B12R1.385 O=CCCC1=CC(=C(C=C1)Cl)Cl Z993017630 [0,2,0,0,0,0|2,0,0]=4 902 B12R1.385 O=CCCC1=CC(=C(C=C1)Cl)F Z1198182696 [0,2,0,0,0,0|2,0,0]=4 903 B12R1.385 O=CCCC1=CC(=C(C=C1)F)F Z1198182685 [0,2,0,0,0,0|2,0,0]=4 904 B12R1.385 OCCCC1=CC(=C(C=C1)Cl)Cl Z993012522 [0,2,0,0,0,0|2,0,0]=4 905 B12R1.3 C#CCC(NC)C1=CC=CC=C1 Z1815149215 [0,2,0,0,0,0|2,0,0]=4 906 B12R1.3 C=CCC(C=O)C1=CC=CC=C1 Z1416169093 [0,2,0,0,0,0|2,0,0]=4 907 B12R1.3 CCCC(C=O)C1=CC=CC=C1 Z1251357295 [0,2,0,0,0,0|2,0,0]=4 908 B12R1.3 CNC(CCO)C1=CC=CC=C1 Z1198162180 [0,2,0,0,0,0|2,0,0]=4 909 B12R1.3 NCC(CCO)C1=CC=CC=C1 Z1198177199 [0,2,0,0,0,0|2,0,0]=4 910 B12R1.17 CNC[C@H](O)C1=CC(=CC=C1)O Z1198723489 [0,2,0,0,0,0|1,0,0]=3 911 B12R1.17 COCC(O)C1=CC(=CC=C1)N Z970071366 [0,2,0,0,0,0|2,0,0]=4 912 B12R1.17 N#CCC(O)C1=CC(=CC=C1)Cl Z1255429594 [0,2,0,0,0,0|1,0,1]=4 913 B12R1.30 C#CCCC(=O)C1=CC=CC=C1 Z406376668 [0,2,0,0,0,0|2,0,0]=4 914 B12R1.30 C=CCCC(=O)C1=CC=CC=C1 Z406376458 [0,2,0,0,0,0|2,0,0]=4 915 B12R1.30 C=CCCC(N)C1=CC=CC=C1 Z1219748388 [0,2,0,0,0,0|2,0,0]=4 916 B12R1.30 CCCCC(O)C1=CC=CC=C1 Z445987132 [0,2,0,0,0,0|2,0,0]=4 917 B12R1.30 CCCC[C@@H](N)C1=CC=CC=C1 Z1642061107 [0,2,0,0,0,0|2,0,0]=4 918 B12R1.30 CCCC[C@@H](O)C1=CC=CC=C1 Z1127664488 [0,2,0,0,0,0|2,0,0]=4 919 B12R1.30 CCCC[C@H](N)C1=CC=CC=C1 Z1649893428 [0,2,0,0,0,0|2,0,0]=4 920 B12R1.30 CCCC[C@H](O)C1=CC=CC=C1 Z1127664374 [0,2,0,0,0,0|2,0,0]=4 921 B12R1.30 CCCNC(C)C1=CC=CC=C1 Z57397067 [0,2,0,0,0,0|2,0,0]=4 922 B12R1.30 CCNCC(N)C1=CC=CC=C1 Z756920572 [0,2,0,0,0,0|1,0,0]=3 923 B12R1.30 CN(CCCN)C1=NC=CC=C1 Z319975464 [0,2,0,0,0,0|2,0,0]=4 924 B12R1.30 CN(CCCO)C1=CC=CC=C1 Z104585644 [0,2,0,0,0,0|2,0,0]=4 925 B12R1.30 CNCCN(C)C1=CC=CC=C1 Z335286914 [0,2,0,0,0,0|1,0,0]=3 926 B12R1.30 COCCC(O)C1=CC=CC=C1 Z818738046 [0,2,0,0,0,0|2,0,0]=4 927 B12R1.30 CSCCC(=O)C1=CC=CC=C1 Z1201679033 [0,2,0,0,0,0|2,0,0]=4 928 B12R1.30 C[C@H](NCCO)C1=CC=CC=C1 Z1079131628 [0,2,0,0,0,0|2,0,0]=4 929 B12R1.30 N#CCCC(=O)C1=CC=CC=C1 Z168884010 [0,2,0,0,0,0|1,0,1]=4 930 B12R1.30 N#CCCC(N)C1=CC=CC=C1 Z1492796961 [0,2,0,0,0,0|1,0,1]=4 931 B12R1.30 NC(CCCO)C1=CC=CC=C1 Z1245735325 [0,2,0,0,0,0|2,0,0]=4 932 B12R1.30 NCCNC(=O)C1=CC=CC=C1 Z235363051 [0,2,0,0,0,0|1,0,1]=4 933 B12R1.30 O=C(CCCCl)C1=CC=CC=C1 Z104477558 [0,2,0,0,0,0|2,0,0]=4 934 B12R1.34 CC(C1=CC=CC=C1)C(N)CO Z1262398547 [0,2,0,0,0,0|2,0,0]=4 935 B12R1.34 CC(CN)N(C)C1=CC=CC=C1 Z228572562 [0,2,0,0,0,0|2,0,0]=4 936 B12R1.34 CCC(N)C(C)C1=CC=CC=C1 Z1318372590 [0,2,0,0,0,0|2,0,0]=4 937 B12R1.34 CCC(N)C(O)C1=CC=CC=C1 Z1695783907 [0,2,0,0,0,0|2,0,0]=4 938 B12R1.34 CNC(=O)C(N)C1=CC=CC=C1 Z594038166 [0,2,0,0,0,0|1,0,1]=4 939 B12R1.34 CNC(=O)C(O)C1=CC=CC=C1 Z1203869997 [0,2,0,0,0,0|1,0,1]=4 940 B12R1.39 CC(C)(CCN)C1=CC=CC=C1 Z336081086 [0,2,0,0,0,0|1,0,0]=3 941 B12R1.39 CC(C)(CCO)C1=CC=CC=C1 Z1255440195 [0,2,0,0,0,0|2,0,0]=4 942 B12R1.39 CC(O)(CCN)C1=CC=CC=C1 Z1182310345 [0,2,0,0,0,0|1,0,0]=3 943 B12R1.39 CNCC(F)(F)C1=CC=CC=C1 Z5719431865 [0,2,0,0,0,0|1,0,0]=3 944 B12R1.39 COCC(C)(N)C1=CC=CC=C1 Z992444342 [0,2,0,0,0,0|2,0,0]=4 945 B12R1.39 COCC(C)(O)C1=CC=CC=C1 Z992444182 [0,2,0,0,0,0|2,0,0]=4 946 B12R1.39 NCCS(=O)(=O)C1=CC=CC=C1 Z426041548 [0,2,0,0,0,0|2,0,0]=4 947 B12R1.107 C=C(C)CC(N)C1=CC=CC=C1 Z4497189696 [0,2,0,0,0,0|2,0,0]=4 948 B12R1.107 CC(C)CC(N)C1=CC=CC=C1 Z85929891 [0,2,0,0,0,0|2,0,0]=4 949 B12R1.107 CC(CC(=O)N)C1=CC=CC=C1 Z33546734 [0,2,0,0,0,0|1,0,0]=3 950 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 Z56899204 [0,2,0,0,0,0|2,0,0]=4 951 B12R1.107 CC(N)CC(=O)C1=CC=CC=C1 Z1413780437 [0,2,0,0,0,0|1,0,1]=4 952 B12R1.107 CC(N)CC(O)C1=CC=CC=C1 Z1262623600 [0,2,0,0,0,0|1,0,0]=3 953 B12R1.107 CC(N)CN(C)C1=CC=CC=C1 Z815264124 [0,2,0,0,0,0|2,0,0]=4 954 B12R1.107 CC(NC(=N)N)C1=CC=CC=C1 Z1089996260 [0,2,0,0,0,0|2,0,0]=4 955 B12R1.107 CC(NC(=O)N)C1=CC=CC=C1 Z198194342 [0,2,0,0,0,0|2,0,0]=4 956 B12R1.107 CC(NC(=S)N)C1=CC=CC=C1 Z56913099 [0,2,0,0,0,0|2,0,0]=4 957 B12R1.107 CN(C)CC(N)C1=CN=CC=C1 Z5022208875 [0,2,0,0,0,0|2,0,0]=4 958 B12R1.107 CN(CC(=O)N)C1=CC=CC=C1 Z54747686 [0,2,0,0,0,0|2,0,0]=4 959 B12R1.107 CS(=O)CC(N)C1=CC=CC=C1 Z1238793494 [0,2,0,0,0,0|2,0,0]=4 960 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 Z94601171 [0,2,0,0,0,0|2,0,0]=4 961 B12R1.107 NC(CC(F)F)C1=CC=CC=C1 Z2327568967 [0,2,0,0,0,0|2,0,0]=4 962 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 Z756925772 [0,2,0,0,0,0|2,0,0]=4 963 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 Z1696091779 [0,2,0,0,0,0|2,0,0]=4 964 B12R1.107 O=C(O)CC(O)C1=CC=CC=C1 Z982132010 [0,2,0,0,0,0|2,0,0]=4 965 B12R1.308 CCCC(O)C1=C(C=CC=C1)Cl Z733415366 [0,2,0,0,0,0|2,0,0]=4 966 B12R1.308 NC(CCO)C1=C(C=CC=C1)Br Z979743696 [0,2,0,0,0,0|2,0,0]=4 967 B12R1.308 NCCC(=O)C1=C(C=CC=C1)N Z2037273395 [0,2,0,0,0,0|1,0,1]=4 968 B12R1.308 NCCS(=O)C1=C(C=CC=C1)F Z1267881675 [0,2,0,0,0,0|2,0,0]=4 969 B12R1.25 NCCOC1=C(C(=CC=C1)Cl)Cl Z763367894 [0,2,0,0,0,0|2,0,0]=4 970 B12R1.25 OCCCC1=C(C(=CC=C1)F)F Z3230115688 [0,2,0,0,0,0|2,0,0]=4 971 B12R1.121 C=CCCC1=C(C=CC=C1)C=O Z1511744014 [0,2,0,0,0,0|2,0,0]=4 972 B12R1.121 CNCCC1=C(C=CC=C1)C#N Z3719314609 [0,2,0,0,0,0|1,0,0]=3 973 B12R1.121 CNCCC1=C(C=CC=C1)OC Z159528470 [0,2,0,0,0,0|1,0,0]=3 974 B12R1.121 COC1=C(C=CC=C1)CCC=O Z993017838 [0,2,0,0,0,0|2,0,0]=4 975 B12R1.121 COC1=C(C=CC=C1)OCCN Z56968779 [0,2,0,0,0,0|2,0,0]=4 976 B12R1.125 CC(=O)CCC1=C(C=CC=C1)F Z406376954 [0,2,0,0,0,0|2,0,0]=4 977 B12R1.125 CC(N)COC1=C(C=CC=C1)F Z271016180 [0,2,0,0,0,0|2,0,0]=4 978 B12R1.125 CC1=C(C=CC=C1)CCC(=O)O Z317037960 [0,2,0,0,0,0|2,0,0]=4 979 B12R1.125 CC1=C(C=CC=C1)NCC(=O)N Z104590676 [0,2,0,0,0,0|2,0,0]=4 980 B12R1.125 CC1=C(C=CC=C1)OCC(=N)N Z823287452 [0,2,0,0,0,0|2,0,0]=4 981 B12R1.125 CC1=C(C=CC=C1)OCC(=O)N Z19733874 [0,2,0,0,0,0|2,0,0]=4 982 B12R1.125 CC1=C(C=CC=C1)OCC(C)N Z271016914 [0,2,0,0,0,0|2,0,0]=4 983 B12R1.125 CN(C)CCC1=C(C=CC=C1)N Z608073162 [0,2,0,0,0,0|1,0,0]=3 984 B12R1.125 N=C(N)NCC1=C(C=CC=C1)F Z3034959360 [0,2,0,0,0,0|2,0,0]=4 985 B12R1.125 N=C(N)SCC1=C(C=CC=C1)Cl Z48820396 [0,2,0,0,0,0|2,0,0]=4 986 B12R1.125 NC(=O)CCC1=C(C=CC=C1)Br Z741559968 [0,2,0,0,0,0|1,0,0]=3 987 B12R1.125 NC(=O)CCC1=C(C=CC=C1)N Z414316848 [0,2,0,0,0,0|1,0,0]=3 988 B12R1.125 NC(=O)CCC1=C(C=CC=C1)O Z371352778 [0,2,0,0,0,0|1,0,0]=3 989 B12R1.125 NC(=O)CNC1=C(C=CC=C1)Br Z137588472 [0,2,0,0,0,0|2,0,0]=4 990 B12R1.125 NC(=O)CNC1=C(C=CC=C1)Cl Z104528166 [0,2,0,0,0,0|2,0,0]=4 991 B12R1.125 NC(=O)CNC1=C(C=CC=C1)I Z133437412 [0,2,0,0,0,0|2,0,0]=4 992 B12R1.125 NC(=O)COC1=C(C=CC=C1)Br Z17829253 [0,2,0,0,0,0|2,0,0]=4 993 B12R1.125 NC(=O)COC1=C(C=CC=C1)Cl Z19726626 [0,2,0,0,0,0|2,0,0]=4 994 B12R1.125 NC(=O)COC1=C(C=CC=C1)F Z19724798 [0,2,0,0,0,0|2,0,0]=4 995 B12R1.125 NC(=O)COC1=C(C=CC=C1)I Z406416164 [0,2,0,0,0,0|2,0,0]=4 996 B12R1.125 NC(=O)CSC1=C(C=CC=C1)Br Z149386624 [0,2,0,0,0,0|2,0,0]=4 997 B12R1.125 NC(=O)CSC1=C(C=CC=C1)Cl Z18459622 [0,2,0,0,0,0|2,0,0]=4 998 B12R1.125 NC(=O)CSC1=C(C=CC=C1)N Z57332466 [0,2,0,0,0,0|2,0,0]=4 999 B12R1.125 NC(=O)NCC1=C(C=CC=C1)Cl Z198194806 [0,2,0,0,0,0|2,0,0]=4 1000 B12R1.125 NC(=O)NCC1=C(C=CC=C1)F Z198194842 [0,2,0,0,0,0|2,0,0]=4 1001 B12R1.125 O=C(O)CCC1=C(C=CC=C1)Br Z406704244 [0,2,0,0,0,0|2,0,0]=4 1002 B12R1.125 O=C(O)CCC1=C(C=CC=C1)Cl Z56943366 [0,2,0,0,0,0|2,0,0]=4 1003 B12R1.125 O=C(O)CCC1=C(C=CC=C1)F Z57991059 [0,2,0,0,0,0|2,0,0]=4 1004 B12R1.125 O=C(O)CCC1=C(C=CC=C1)O Z56347225 [0,2,0,0,0,0|2,0,0]=4 1005 B12R1.267 C#CCNCC1=C(C=CC=C1)Cl Z1705787112 [0,2,0,0,0,0|2,0,0]=4 1006 B12R1.267 C=CCNCC1=C(C=CC=C1)F Z744843672 [0,2,0,0,0,0|2,0,0]=4 1007 B12R1.267 CC1=C(C=CC=C1)CSCC#N Z17108796 [0,2,0,0,0,0|1,0,1]=4 1008 B12R1.267 CC1=C(C=CC=C1)OCCC#N Z54337106 [0,2,0,0,0,0|1,0,1]=4 1009 B12R1.267 CC1=C(C=CC=C1)OCCCN Z271006092 [0,2,0,0,0,0|1,0,0]=3 1010 B12R1.267 CC1=C(C=CC=C1)OCCNN Z56978182 [0,2,0,0,0,0|0,0,0]=2 1011 B12R1.267 CCCCOC1=C(C=CC=C1)Br Z149303058 [0,2,0,0,0,0|2,0,0]=4 1012 B12R1.267 CCCCOC1=C(C=CC=C1)N Z239604730 [0,2,0,0,0,0|2,0,0]=4 1013 B12R1.267 CCCNCC1=C(C=CC=C1)F Z2524454856 [0,2,0,0,0,0|2,0,0]=4 1014 B12R1.267 CCCNCC1=C(C=CC=C1)O Z316257178 [0,2,0,0,0,0|2,0,0]=4 1015 B12R1.267 CNCCOC1=C(C=CC=C1)C Z138105348 [0,2,0,0,0,0|1,0,0]=3 1016 B12R1.267 CNCCOC1=C(C=CC=C1)Cl Z138105384 [0,2,0,0,0,0|1,0,0]=3 1017 B12R1.267 CNCCOC1=C(C=CC=C1)F Z138104722 [0,2,0,0,0,0|1,0,0]=3 1018 B12R1.267 COCCNC1=C(C=CC=C1)N Z359511242 [0,2,0,0,0,0|2,0,0]=4 1019 B12R1.267 COCCOC1=C(C=CC=C1)N Z274541842 [0,2,0,0,0,0|2,0,0]=4 1020 B12R1.267 N#CCCCC1=C(C=CC=C1)Br Z1269161079 [0,2,0,0,0,0|1,0,1]=4 1021 B12R1.267 N#CCCCC1=C(C=CC=C1)Cl Z1198169265 [0,2,0,0,0,0|1,0,1]=4 1022 B12R1.267 N#CCCNC1=C(C=CC=C1)F Z56813548 [0,2,0,0,0,0|1,0,1]=4 1023 B12R1.267 N#CCCOC1=C(C=CC=C1)Cl Z54336949 [0,2,0,0,0,0|1,0,1]=4 1024 B12R1.267 N#CCCOC1=C(C=CC=C1)F Z54556757 [0,2,0,0,0,0|1,0,1]=4 1025 B12R1.267 N#CCCSC1=C(C=CC=C1)F Z54463198 [0,2,0,0,0,0|1,0,1]=4 1026 B12R1.267 N#CCCSC1=C(C=CC=C1)N Z316174712 [0,2,0,0,0,0|1,0,1]=4 1027 B12R1.267 NC1=C(C=CC=C1)NCCCO Z390185384 [0,2,0,0,0,0|2,0,0]=4 1028 B12R1.267 NCCCCN1C=CC=CC1=O Z285163694 [0,2,0,0,0,0|2,0,0]=4 1029 B12R1.267 NCCCOC1=C(C=CC=C1)F Z126954254 [0,2,0,0,0,0|1,0,0]=3 1030 B12R1.267 NCCOCC1=C(C=CC=C1)Cl Z1259340990 [0,2,0,0,0,0|1,0,0]=3 1031 B12R1.267 NCCSCC1=C(C=CC=C1)F Z89265003 [0,2,0,0,0,0|1,0,0]=3 1032 B12R1.267 O=CCCCC1=C(C=CC=C1)Br Z1233207918 [0,2,0,0,0,0|2,0,0]=4 1033 B12R1.267 O=CCCCC1=C(C=CC=C1)F Z1233207919 [0,2,0,0,0,0|2,0,0]=4 1034 B12R1.267 OCCCOC1=C(C=CC=C1)Br Z149303380 [0,2,0,0,0,0|2,0,0]=4 1035 B12R1.267 OCCCOC1=C(C=CC=C1)Cl Z149161814 [0,2,0,0,0,0|2,0,0]=4 1036 B12R1.267 OCCNCC1=C(C=CC=C1)Br Z90504623 [0,2,0,0,0,0|2,0,0]=4 1037 B12R1.371 CC(CN)OC1=C(C=CC=C1)Br Z844632454 [0,2,0,0,0,0|2,0,0]=4 1038 B12R1.371 CC(CN)OC1=C(C=CC=C1)Cl Z1263602349 [0,2,0,0,0,0|2,0,0]=4 1039 B12R1.371 CC(CN)OC1=C(C=CC=C1)F Z844631932 [0,2,0,0,0,0|2,0,0]=4 1040 B12R1.371 CC1=C(C=CC=C1)CC(N)CO Z1198274419 [0,2,0,0,0,0|2,0,0]=4 1041 B12R1.371 CC1=C(C=CC=C1)NC(=O)NN Z381337818 [0,2,0,0,0,0|1,0,1]=4 1042 B12R1.371 CC1=C(C=CC=C1)NC(=S)NN Z56813493 [0,2,0,0,0,0|1,0,1]=4 1043 B12R1.371 CC1=C(C=CC=C1)OC(C)CN Z844631964 [0,2,0,0,0,0|2,0,0]=4 1044 B12R1.371 CCC(N)CC1=C(C=CC=C1)Br Z1416200896 [0,2,0,0,0,0|2,0,0]=4 1045 B12R1.371 CNC(=O)CC1=C(C=CC=C1)N Z234895127 [0,2,0,0,0,0|1,0,1]=4 1046 B12R1.371 CNC(C)CC1=C(C=CC=C1)C Z1875110273 [0,2,0,0,0,0|1,0,0]=3 1047 B12R1.371 NNC(=O)CN1C=CC=CC1=O Z58983346 [0,2,0,0,0,0|1,0,1]=4 1048 B12R1.371 NNC(=S)NC1=C(C=CC=C1)Cl Z56828391 [0,2,0,0,0,0|1,0,1]=4 1049 B12R1.371 NNC(=S)NC1=C(C=CC=C1)F Z56813485 [0,2,0,0,0,0|1,0,1]=4 1050 B12R1.371 O=C(CC1=C(C=CC=C1)Cl)NO Z59182782 [0,2,0,0,0,0|1,0,1]=4 1051 B12R1.371 O=CC(Cl)CC1=C(C=CC=C1)Cl Z982126354 [0,2,0,0,0,0|2,0,0]=4 1052 B12R1.374 CC1=CC(=C(C=C1)Cl)OCCN Z2941520842 [0,2,0,0,0,0|2,0,0]=4 1053 B12R1.374 NCCCN1C=C(C=CC1=O)Br Z1222283877 [0,2,0,0,0,0|2,0,0]=4 1054 B12R1.1631 CC1=C(C(=CC=C1)Cl)CCCN Z1741785883 [0,2,0,0,0,0|1,0,0]=3 1055 B12R1.1631 CC1=CC=CC(=C1OCCN)C Z425449774 [0,2,0,0,0,0|2,0,0]=4 1056 B12R1.1631 N#CCCC1=C(C=CC=C1Cl)Cl Z815260510 [0,2,0,0,0,0|1,0,1]=4 1057 B12R1.1631 NCCCC1=C(C=CC=C1Cl)Cl Z424783074 [0,2,0,0,0,0|1,0,0]=3 1058 B12R1.1631 NCCOC1=C(C=CC=C1F)Cl Z1416178788 [0,2,0,0,0,0|2,0,0]=4 1059 B12R1.1631 O=CCCC1=C(C=CC=C1Cl)Cl Z993017858 [0,2,0,0,0,0|2,0,0]=4 1060 B12R1.1631 O=CCCC1=C(C=CC=C1Cl)F Z993017832 [0,2,0,0,0,0|2,0,0]=4 1061 B12R1.1631 OCCCC1=C(C=CC=C1F)Cl Z992949636 [0,2,0,0,0,0|2,0,0]=4 1062 B12R1.28 BrCCCOC1=CC(=CC=C1)I Z381428588 [0,2,0,0,0,0|2,0,0]=4 1063 B12R1.28 C=CCCOC1=CC=CC(=C1)N Z1219749397 [0,2,0,0,0,0|2,0,0]=4 1064 B12R1.28 CC1=CC(=CC=C1)CNCCO Z1836652697 [0,2,0,0,0,0|2,0,0]=4 1065 B12R1.28 CC1=CC(=CC=C1)NCCC#N Z56939180 [0,2,0,0,0,0|1,0,1]=4 1066 B12R1.28 CC1=CC(=CC=C1)OCCCN Z137642328 [0,2,0,0,0,0|1,0,0]=3 1067 B12R1.28 CCCCNC1=CC(=CC=C1)I Z1266854879 [0,2,0,0,0,0|2,0,0]=4 1068 B12R1.28 CCCCOC1=CC(=CC=C1)N Z802665964 [0,2,0,0,0,0|2,0,0]=4 1069 B12R1.28 CNCCOC1=CC(=CC=C1)C Z147652434 [0,2,0,0,0,0|1,0,0]=3 1070 B12R1.28 CNCCOC1=CC(=CC=C1)Cl Z138105424 [0,2,0,0,0,0|1,0,0]=3 1071 B12R1.28 COCCOC1=CC(=CC=C1)Br Z285938612 [0,2,0,0,0,0|2,0,0]=4 1072 B12R1.28 COCCOC1=CC(=CC=C1)N Z285182536 [0,2,0,0,0,0|2,0,0]=4 1073 B12R1.28 COCCOC1=CC(=CC=C1)O Z381415582 [0,2,0,0,0,0|2,0,0]=4 1074 B12R1.28 N#CCCNC1=CC=CC(=C1)Cl Z56931866 [0,2,0,0,0,0|1,0,1]=4 1075 B12R1.28 NCCCCC1=CC(=NC=C1)N Z2895541303 [0,2,0,0,0,0|2,0,0]=4 1076 B12R1.28 NCCCOC1=CC(=CC=C1)F Z2940631631 [0,2,0,0,0,0|1,0,0]=3 1077 B12R1.28 NCCOCC1=CC(=CC=C1)Cl Z1891776830 [0,2,0,0,0,0|1,0,0]=3 1078 B12R1.28 OCCCCC1=CC(=CC=C1)Br Z1233226242 [0,2,0,0,0,0|2,0,0]=4 1079 B12R1.28 OCCCOC1=CC(=CC=C1)Br Z425795856 [0,2,0,0,0,0|2,0,0]=4 1080 B12R1.28 OCCNCC1=CC(=CC=C1)Cl Z1839480752 [0,2,0,0,0,0|2,0,0]=4 1081 B12R1.28 OCCNCC1=CC(=CC=C1)F Z1840356205 [0,2,0,0,0,0|2,0,0]=4 1082 B12R1.50 C#CC(N)CC1=CC(=CC=C1)F Z3178895122 [0,2,0,0,0,0|2,0,0]=4 1083 B12R1.50 CC(CN)OC1=CC(=CC=C1)Br Z844632504 [0,2,0,0,0,0|2,0,0]=4 1084 B12R1.50 CC(CN)OC1=CC(=CC=C1)Cl Z1263820268 [0,2,0,0,0,0|2,0,0]=4 1085 B12R1.50 CC(CN)OC1=CC(=CC=C1)F Z844631990 [0,2,0,0,0,0|2,0,0]=4 1086 B12R1.50 CC1=CC(=CC=C1)CC(N)CO Z1801307645 [0,2,0,0,0,0|2,0,0]=4 1087 B12R1.50 CC1=CC(=CC=C1)NC(=S)NN Z56837059 [0,2,0,0,0,0|1,0,1]=4 1088 B12R1.50 CC1=CC=CC(=C1)OC(C)CN Z844631960 [0,2,0,0,0,0|2,0,0]=4 1089 B12R1.50 CNC(=O)CC1=CC(=CC=C1)O Z816010790 [0,2,0,0,0,0|1,0,1]=4 1090 B12R1.50 CNC(C)CC1=CC(=CC=C1)C Z2311236342 [0,2,0,0,0,0|1,0,0]=3 1091 B12R1.50 NC(CO)CC1=CC(=CC=C1)F Z1198222234 [0,2,0,0,0,0|2,0,0]=4 1092 B12R1.50 NCC(=O)CC1=CC(=CC=C1)Br Z1981870420 [0,2,0,0,0,0|1,0,1]=4 1093 B12R1.50 NCC(O)CC1=CC(=CC=C1)Br Z4981222469 [0,2,0,0,0,0|1,0,0]=3 1094 B12R1.50 NNC(=S)NC1=CC(=CC=C1)Br Z111871260 [0,2,0,0,0,0|1,0,1]=4 1095 B12R1.50 NNC(=S)NC1=CC(=CC=C1)Cl Z56862329 [0,2,0,0,0,0|1,0,1]=4 1096 B12R1.50 O=C(CC1=CC(=CC=C1)F)NO Z59182830 [0,2,0,0,0,0|1,0,1]=4 1097 B12R1.50 O=C(CC1=CC(=CC=C1)O)NO Z816010210 [0,2,0,0,0,0|1,0,1]=4 1098 B12R1.100 CC1=CC(=CC(=C1)OCCN)C Z763366274 [0,2,0,0,0,0|2,0,0]=4 1099 B12R1.100 CCCCC1=CC(=CC(=C1)O)O Z1513806573 [0,2,0,0,0,0|2,0,0]=4 1100 B12R1.100 NCCOC1=CC(=CC(=C1)Cl)Cl Z3235197431 [0,2,0,0,0,0|2,0,0]=4 1101 B12R1.100 NCCOC1=CC(=CC(=C1)F)F Z1509466755 [0,2,0,0,0,0|2,0,0]=4 1102 B12R1.226 CC(=O)CCC1=CC(=CC=C1)C Z406376778 [0,2,0,0,0,0|2,0,0]=4 1103 B12R1.226 CC(=O)CCC1=CC(=CC=C1)F Z406376716 [0,2,0,0,0,0|2,0,0]=4 1104 B12R1.226 CC(N)CCC1=CC(=CC=C1)F Z406452418 [0,2,0,0,0,0|1,0,0]=3 1105 B12R1.226 CC(N)COC1=CC(=CC=C1)F Z271017410 [0,2,0,0,0,0|2,0,0]=4 1106 B12R1.226 CC1=CC(=CC=C1)CCC(=O)N Z194976514 [0,2,0,0,0,0|1,0,0]=3 1107 B12R1.226 CC1=CC(=CC=C1)CCC(=O)O Z169993866 [0,2,0,0,0,0|2,0,0]=4 1108 B12R1.226 CC1=CC(=CC=C1)CNC(=S)N Z847147370 [0,2,0,0,0,0|2,0,0]=4 1109 B12R1.226 CC1=CC(=CC=C1)CSC(=N)N Z57992123 [0,2,0,0,0,0|2,0,0]=4 1110 B12R1.226 CC1=CC(=CC=C1)NCC(=O)N Z104589324 [0,2,0,0,0,0|2,0,0]=4 1111 B12R1.226 CC1=CC(=CC=C1)OCC(=O)N Z19732960 [0,2,0,0,0,0|2,0,0]=4 1112 B12R1.226 CC1=CC=CC(=C1)OCC(C)N Z271016790 [0,2,0,0,0,0|2,0,0]=4 1113 B12R1.226 N=C(N)SCC1=CC(=CC=C1)F Z48820172 [0,2,0,0,0,0|2,0,0]=4 1114 B12R1.226 NC(=O)CCC1=CC(=CC=C1)N Z414316850 [0,2,0,0,0,0|1,0,0]=3 1115 B12R1.226 NC(=O)CNC1=CC(=CC=C1)Br Z104587998 [0,2,0,0,0,0|2,0,0]=4 1116 B12R1.226 NC(=O)CNC1=CC(=CC=C1)F Z104640682 [0,2,0,0,0,0|2,0,0]=4 1117 B12R1.226 NC(=O)COC1=CC(=CC=C1)F Z19755608 [0,2,0,0,0,0|2,0,0]=4 1118 B12R1.226 NC(=O)COC1=CC(=CC=C1)I Z25076202 [0,2,0,0,0,0|2,0,0]=4 1119 B12R1.226 NC(=O)COC1=CC(=CC=C1)N Z235344273 [0,2,0,0,0,0|2,0,0]=4 1120 B12R1.226 NC(=O)COC1=CC(=CC=C1)O Z381415558 [0,2,0,0,0,0|2,0,0]=4 1121 B12R1.226 NC(=O)NCC1=CC(=CC=C1)F Z362629554 [0,2,0,0,0,0|2,0,0]=4 1122 B12R1.226 O=C(O)CCC1=CC(=CC=C1)Br Z56943439 [0,2,0,0,0,0|2,0,0]=4 1123 B12R1.226 O=C(O)CCC1=CC(=CC=C1)F Z185153196 [0,2,0,0,0,0|2,0,0]=4 1124 B12R1.226 O=C(O)CCC1=CC(=CC=C1)O Z317038038 [0,2,0,0,0,0|2,0,0]=4 1125 B12R1.382 C=CCCC1=CC(=CC=C1)C=O Z1511874801 [0,2,0,0,0,0|2,0,0]=4 1126 B12R1.382 CCC1=CC(=CC=C1)CCCN Z5176470303 [0,2,0,0,0,0|1,0,0]=3 1127 B12R1.382 CNCCC1=CC(=CC=C1)C#N Z2734594341 [0,2,0,0,0,0|1,0,0]=3 1128 B12R1.382 COC1=CC(=CC=C1)CCC=O Z993017768 [0,2,0,0,0,0|2,0,0]=4 1129 B12R1.382 COC1=CC(=CC=C1)CCCN Z1262398467 [0,2,0,0,0,0|1,0,0]=3 1130 B12R1.382 COC1=CC(=CC=C1)CCCO Z993012490 [0,2,0,0,0,0|2,0,0]=4 1131 B12R1.382 COC1=CC(=CC=C1)OCCN Z335452802 [0,2,0,0,0,0|2,0,0]=4 1132 B12R1.382 N#CC1=CC=CC(=C1)OCCN Z4105362361 [0,2,0,0,0,0|2,0,0]=4 1133 B12R1.8 C#CCNOCC1=CC=CC=C1 Z1251328742 [0,2,0,0,0,0|2,0,0]=4 1134 B12R1.8 C=CCNCCC1=CC=CC=C1 Z90513756 [0,2,0,0,0,0|1,0,0]=3 1135 B12R1.8 CCCCCOC1=CC=CC=C1 Z239095428 [0,2,0,0,0,0|2,0,0]=4 1136 B12R1.8 CCCNCCC1=CC=CC=C1 Z90518163 [0,2,0,0,0,0|1,0,0]=3 1137 B12R1.8 CCCNCCC1=NC=CC=C1 Z53110779 [0,2,0,0,0,0|2,0,0]=4 1138 B12R1.8 CCOCCNC1=CC=CC=C1 Z5256735719 [0,2,0,0,0,0|2,0,0]=4 1139 B12R1.8 CNCCCCC1=CC=CC=C1 Z385446848 [0,2,0,0,0,0|1,0,0]=3 1140 B12R1.8 CNCCCNC1=CC=CC=C1 Z852438504 [0,2,0,0,0,0|1,0,0]=3 1141 B12R1.8 CNCCCOC1=CC=CC=C1 Z163881564 [0,2,0,0,0,0|1,0,0]=3 1142 B12R1.8 CNCCNCC1=CC=CC=C1 Z425484772 [0,2,0,0,0,0|1,0,0]=3 1143 B12R1.8 COCCNCC1=CC=CC=C1 Z56945503 [0,2,0,0,0,0|2,0,0]=4 1144 B12R1.8 N#CCC/C=C/C1=CC=CC=C1 Z3300796892 [0,2,0,0,0,0|1,0,1]=4 1145 B12R1.8 N#CCCOCC1=CC=CC=C1 Z317037710 [0,2,0,0,0,0|1,0,1]=4 1146 B12R1.8 NCCCCCC1=CC=CC=C1 Z820118542 [0,2,0,0,0,0|1,0,0]=3 1147 B12R1.8 NCCCCNC1=NC=CC=C1 Z600500000 [0,2,0,0,0,0|2,0,0]=4 1148 B12R1.8 NCCCOCC1=CC=CC=C1 Z104377938 [0,2,0,0,0,0|1,0,0]=3 1149 B12R1.8 NCCOCCC1=CC=CC=C1 Z1270210787 [0,2,0,0,0,0|1,0,0]=3 1150 B12R1.8 O=CCCCOC1=CC=CC=C1 Z993017686 [0,2,0,0,0,0|2,0,0]=4 1151 B12R1.8 OCCCCOC1=CC=CC=C1 Z425795850 [0,2,0,0,0,0|2,0,0]=4 1152 B12R1.8 OCCCNCC1=CC=CC=C1 Z57079457 [0,2,0,0,0,0|2,0,0]=4 1153 B12R1.8 OCCCOCC1=CC=CC=C1 Z1080358454 [0,2,0,0,0,0|2,0,0]=4 1154 B12R1.8 OCCCSCC1=CC=CC=C1 Z104944808 [0,2,0,0,0,0|2,0,0]=4 1155 B12R1.8 OCCNCCC1=CC=CC=C1 Z90504498 [0,2,0,0,0,0|1,0,0]=3 1156 B12R1.27 C#CC(=O)CCC1=CC=CC=C1 Z1266856412 [0,2,0,0,0,0|2,0,0]=4 1157 B12R1.27 CC(C=O)CCC1=CC=CC=C1 Z1238838034 [0,2,0,0,0,0|2,0,0]=4 1158 B12R1.27 CC(CO)COC1=CC=CC=C1 Z1255385347 [0,2,0,0,0,0|2,0,0]=4 1159 B12R1.27 CC(CO)OCC1=CC=CC=C1 Z1492906786 [0,2,0,0,0,0|2,0,0]=4 1160 B12R1.27 CC(COC1=CC=CC=C1)NN Z2286637842 [0,2,0,0,0,0|0,0,0]=2 1161 B12R1.27 CCC(C)NCC1=CC=CC=C1 Z57981002 [0,2,0,0,0,0|2,0,0]=4 1162 B12R1.27 CCC(N)CCC1=CC=CC=C1 Z406453862 [0,2,0,0,0,0|1,0,0]=3 1163 B12R1.27 CCC(N)CNC1=CC=CC=C1 Z756919558 [0,2,0,0,0,0|2,0,0]=4 1164 B12R1.27 CCC(N)CSC1=CC=CC=C1 Z1238715197 [0,2,0,0,0,0|2,0,0]=4 1165 B12R1.27 CCC(O)CNC1=CC=CC=C1 Z600449702 [0,2,0,0,0,0|2,0,0]=4 1166 B12R1.27 CN(CCC1=CC=CC=C1)N=O Z3965372830 [0,2,0,0,0,0|0,0,1]=3 1167 B12R1.27 CNC(=O)CCC1=CC=CC=C1 Z32016418 [0,2,0,0,0,0|1,0,0]=3 1168 B12R1.27 CNC(=O)COC1=CC=CC=C1 Z19735428 [0,2,0,0,0,0|1,0,1]=4 1169 B12R1.27 CNC(=O)CSC1=CC=CC=C1 Z19750829 [0,2,0,0,0,0|1,0,1]=4 1170 B12R1.27 CNC(=O)OCC1=CC=CC=C1 Z32016983 [0,2,0,0,0,0|1,0,1]=4 1171 B12R1.27 COC(=O)CCC1=CC=CC=C1 Z18264384 [0,2,0,0,0,0|2,0,0]=4 1172 B12R1.27 C[C@H](CO)NCC1=CC=CC=C1 Z823499606 [0,2,0,0,0,0|2,0,0]=4 1173 B12R1.27 N/C(=N\O)/CCC1=CC=CC=C1 Z285132818 [0,2,0,0,0,0|1,0,0]=3 1174 B12R1.27 N/C(=N\O)/COC1=CC=CC=C1 Z104341168 [0,2,0,0,0,0|2,0,0]=4 1175 B12R1.27 NCC(=O)CCC1=CC=CC=C1 Z3719299469 [0,2,0,0,0,0|1,0,0]=3 1176 B12R1.27 NCC(=O)NCC1=CC=CC=C1 Z398557160 [0,2,0,0,0,0|1,0,1]=4 1177 B12R1.27 NCC(=O)OCC1=CC=CC=C1 Z56904671 [0,2,0,0,0,0|1,0,1]=4 1178 B12R1.27 NCC(O)COC1=CC=CC=C1 Z271072310 [0,2,0,0,0,0|1,0,0]=3 1179 B12R1.27 NNC(=O)CNC1=CC=CC=C1 Z56886393 [0,2,0,0,0,0|0,0,1]=3 1180 B12R1.27 NNC(=S)NCC1=CC=CC=C1 Z56828396 [0,2,0,0,0,0|0,0,1]=3 1181 B12R1.27 NNC(=S)NCC1=CN=CC=C1 Z56887673 [0,2,0,0,0,0|1,0,1]=4 1182 B12R1.27 O=C(CCl)CCC1=CC=CC=C1 Z1255432257 [0,2,0,0,0,0|2,0,0]=4 1183 B12R1.27 OC[C@H](O)COC1=CC=CC=C1 Z1201626370 [0,2,0,0,0,0|2,0,0]=4 1184 B12R1.32 C#CCN(C)CC1=CC=CC=C1 Z103710848 [0,2,0,0,0,0|2,0,0]=4 1185 B12R1.32 CCCC(=O)CC1=CC=CC=C1 Z513733628 [0,2,0,0,0,0|2,0,0]=4 1186 B12R1.32 CCCC(C)NC1=CC=CC=C1 Z334878280 [0,2,0,0,0,0|2,0,0]=4 1187 B12R1.32 CCCC(N)CC1=CC=CC=C1 Z513795750 [0,2,0,0,0,0|2,0,0]=4 1188 B12R1.32 CN(CCN)CC1=CC=CC=C1 Z285207092 [0,2,0,0,0,0|1,0,0]=3 1189 B12R1.32 CN(CCO)CC1=CC=CC=C1 Z137706074 [0,2,0,0,0,0|2,0,0]=4 1190 B12R1.32 CNC/C(=C/C1=CC=CC=C1)/C Z1137726270 [0,2,0,0,0,0|1,0,1]=4 1191 B12R1.32 CNCC(=O)NC1=CC=CC=C1 Z380844554 [0,2,0,0,0,0|1,0,1]=4 1192 B12R1.32 CNCC(N)CC1=CC=CC=C1 Z756920442 [0,2,0,0,0,0|1,0,0]=3 1193 B12R1.32 COCC(=O)CC1=CC=CC=C1 Z447897954 [0,2,0,0,0,0|2,0,0]=4 1194 B12R1.32 COCC(N)CC1=CC=CC=C1 Z825742276 [0,2,0,0,0,0|2,0,0]=4 1195 B12R1.32 NC(CCO)CC1=CC=CC=C1 Z1992316427 [0,2,0,0,0,0|2,0,0]=4 1196 B12R1.32 NCCC(=O)NC1=CC=CC=C1 Z241054028 [0,2,0,0,0,0|1,0,1]=4 1197 B12R1.32 NCCS(=O)CC1=CC=CC=C1 Z802568488 [0,2,0,0,0,0|1,0,0]=3 1198 B12R1.252 CC(=O)NCCC1=CC=CC=C1 Z27761567 [0,2,0,0,0,0|1,0,0]=3 1199 B12R1.252 CC(=O)NCCC1=CC=NC=C1 Z1198165525 [0,2,0,0,0,0|2,0,0]=4 1200 B12R1.252 CC(=O)NCCC1=NC=CC=C1 Z32445986 [0,2,0,0,0,0|2,0,0]=4 1201 B12R1.252 CC(=O)NNCC1=CC=CC=C1 Z1726022904 [0,2,0,0,0,0|2,0,0]=4 1202 B12R1.252 CC(N)CCCC1=CN=CC=C1 Z1255362761 [0,2,0,0,0,0|2,0,0]=4 1203 B12R1.252 CC(N)COCC1=CC=CC=C1 Z271012730 [0,2,0,0,0,0|1,0,0]=3 1204 B12R1.252 CC(O)CNCC1=CC=CC=C1 Z57326978 [0,2,0,0,0,0|2,0,0]=4 1205 B12R1.252 CN(C)CCCC1=CC=CC=C1 Z204698992 [0,2,0,0,0,0|1,0,0]=3 1206 B12R1.252 CN(C)CCNC1=CC=CC=C1 Z335250304 [0,2,0,0,0,0|1,0,0]=3 1207 B12R1.252 FC(F)CNCC1=CC=CC=C1 Z608352166 [0,2,0,0,0,0|2,0,0]=4 1208 B12R1.252 N=C(N)COCC1=CC=CC=C1 Z2574925846 [0,2,0,0,0,0|1,0,0]=3 1209 B12R1.252 N=C(N)CSCC1=CC=CC=C1 Z1795818268 [0,2,0,0,0,0|1,0,0]=3 1210 B12R1.252 N=C(N)N/N=C/C1=CC=CC=C1 Z56791605 [0,2,0,0,0,0|1,0,1]=4 1211 B12R1.252 N=C(N)NCCC1=NC=CC=C1 Z1089995406 [0,2,0,0,0,0|1,0,0]=3 1212 B12R1.252 NC(=O)CCNC1=CC=CC=C1 Z154666194 [0,2,0,0,0,0|1,0,0]=3 1213 B12R1.252 NC(=O)CCOC1=CC=CC=C1 Z33545291 [0,2,0,0,0,0|1,0,0]=3 1214 B12R1.252 NC(=O)CCSC1=CC=CC=C1 Z33547211 [0,2,0,0,0,0|1,0,0]=3 1215 B12R1.252 NC(=O)CNCC1=CC=CC=C1 Z90608463 [0,2,0,0,0,0|1,0,0]=3 1216 B12R1.252 NC(=O)CNCC1=CN=CC=C1 Z1695669950 [0,2,0,0,0,0|2,0,0]=4 1217 B12R1.252 NC(=O)COCC1=CC=CC=C1 Z52214418 [0,2,0,0,0,0|1,0,0]=3 1218 B12R1.252 NC(=O)NCCC1=CC=CC=C1 Z198194788 [0,2,0,0,0,0|0,0,0]=2 1219 B12R1.252 NC(=O)NCCC1=CN=CC=C1 Z432778234 [0,2,0,0,0,0|1,0,0]=3 1220 B12R1.252 NC(=O)NCCC1=NC=CC=C1 Z198194814 [0,2,0,0,0,0|1,0,0]=3 1221 B12R1.252 NC(=O)NOCC1=CC=CC=C1 Z56787772 [0,2,0,0,0,0|1,0,0]=3 1222 B12R1.252 NC(=S)N/N=C/C1=CC=CC=C1 Z49561493 [0,2,0,0,0,0|1,0,1]=4 1223 B12R1.252 NC(=S)NCCC1=CC=CC=C1 Z56933803 [0,2,0,0,0,0|0,0,0]=2 1224 B12R1.252 O=C(O)CCCC1=CC=CC=C1 Z234895119 [0,2,0,0,0,0|2,0,0]=4 1225 B12R1.252 O=C(O)CCNC1=CC=CC=C1 Z56899128 [0,2,0,0,0,0|2,0,0]=4 1226 B12R1.252 O=C(O)CCOC1=CC=CC=C1 Z56854475 [0,2,0,0,0,0|2,0,0]=4 1227 B12R1.252 O=C(O)CCSC1=CC=CC=C1 Z56821538 [0,2,0,0,0,0|2,0,0]=4 1228 B12R1.252 O=C(O)CSCC1=CC=CC=C1 Z19691777 [0,2,0,0,0,0|2,0,0]=4 1229 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 Z90124995 [0,2,0,0,0,0|2,0,0]=4 1230 B12R1.43 CC(CC1=CC=CC=C1)C(=O)O Z513624710 [0,2,0,0,0,0|2,0,0]=4 1231 B12R1.43 CC(N)C(=O)CC1=CC=CC=C1 Z1262640515 [0,2,0,0,0,0|1,0,1]=4 1232 B12R1.43 CC(N)C(C)OC1=CC=CC=C1 Z803066446 [0,2,0,0,0,0|2,0,0]=4 1233 B12R1.43 CC(N)C(O)CC1=CC=CC=C1 Z1483956878 [0,2,0,0,0,0|1,0,0]=3 1234 B12R1.43 CC(SC1=CC=CC=C1)C(=O)N Z19751098 [0,2,0,0,0,0|2,0,0]=4 1235 B12R1.43 CN(CC1=CC=CC=C1)C(=O)N Z198194348 [0,2,0,0,0,0|2,0,0]=4 1236 B12R1.43 CN(CC1=CC=CC=C1)C(=S)N Z228582754 [0,2,0,0,0,0|2,0,0]=4 1237 B12R1.43 CN(N)C(=O)NC1=CC=CC=C1 Z56855649 [0,2,0,0,0,0|1,0,1]=4 1238 B12R1.43 CN(N)C(=S)NC1=CC=CC=C1 Z56844976 [0,2,0,0,0,0|1,0,1]=4 1239 B12R1.43 C[C@@H](CC1=CC=CC=C1)C(=O)O Z1262510261 [0,2,0,0,0,0|2,0,0]=4 1240 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 Z317075516 [0,2,0,0,0,0|1,0,0]=3 1241 B12R1.43 NC(=O)C(N)CC1=NC=CC=C1 Z4981909244 [0,2,0,0,0,0|2,0,0]=4 1242 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 Z760046820 [0,2,0,0,0,0|1,0,0]=3 1243 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 Z933616656 [0,2,0,0,0,0|1,0,0]=3 1244 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O Z57127433 [0,2,0,0,0,0|2,0,0]=4 1245 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O Z756430566 [0,2,0,0,0,0|2,0,0]=4 1246 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O Z933646062 [0,2,0,0,0,0|2,0,0]=4 1247 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 Z788000648 [0,2,0,0,0,0|2,0,0]=4 1248 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 Z1255386695 [0,2,0,0,0,0|2,0,0]=4 1249 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 Z1255364914 [0,2,0,0,0,0|2,0,0]=4 1250 B12R1.118 CCC(CC1=CC=CC=C1)NC Z513799420 [0,2,0,0,0,0|1,0,0]=3 1251 B12R1.118 CCC(CN)OC1=CC=CC=C1 Z851004988 [0,2,0,0,0,0|2,0,0]=4 1252 B12R1.118 COC(C=O)CC1=CC=CC=C1 Z1511872212 [0,2,0,0,0,0|2,0,0]=4 1253 B12R1.118 COC(CO)CC1=CC=CC=C1 Z1896500221 [0,2,0,0,0,0|2,0,0]=4 1254 B12R1.118 N#CC(CO)CC1=CC=CC=C1 Z1098915220 [0,2,0,0,0,0|1,0,1]=4 1255 B12R1.118 NCC(CO)CC1=CC=CC=C1 Z234896807 [0,2,0,0,0,0|1,0,0]=3 1256 B12R1.118 NCC(CO)CC1=CN=CC=C1 Z1860991485 [0,2,0,0,0,0|2,0,0]=4 1257 B12R1.118 NCC(CO)CC1=NC=CC=C1 Z285228948 [0,2,0,0,0,0|2,0,0]=4 1258 B12R1.118 OCC(CO)CC1=CC=CC=C1 Z1255372888 [0,2,0,0,0,0|2,0,0]=4 1259 B12R1.194 CC(C)(C#N)CC1=CC=CC=C1 Z1259281880 [0,2,0,0,0,0|1,0,1]=4 1260 B12R1.194 CC(C)(C=O)CC1=CC=CC=C1 Z1188488760 [0,2,0,0,0,0|2,0,0]=4 1261 B12R1.194 CC(C)(CN)CC1=CC=CC=C1 Z1269638453 [0,2,0,0,0,0|1,0,0]=3 1262 B12R1.194 CNS(=O)(=O)CC1=CC=CC=C1 Z133621020 [0,2,0,0,0,0|2,0,0]=4 1263 B12R1.194 NCC(F)(F)OC1=CC=CC=C1 Z4201275590 [0,2,0,0,0,0|2,0,0]=4 1264 B12R1.891 CC(C)(N)CCC1=CC=CC=C1 Z1263529573 [0,2,0,0,0,0|1,0,0]=3 1265 B12R1.891 CC(C)(N)CNC1=CC=CC=C1 Z801831906 [0,2,0,0,0,0|2,0,0]=4 1266 B12R1.891 CC(C)(N)COC1=CC=CC=C1 Z4824791821 [0,2,0,0,0,0|2,0,0]=4 1267 B12R1.891 CC(C)(O)CCC1=CC=CC=C1 Z513713254 [0,2,0,0,0,0|2,0,0]=4 1268 B12R1.891 NS(=O)(=O)CCC1=CC=CC=C1 Z57965898 [0,2,0,0,0,0|1,0,0]=3 1269 B12R1.891 NS(=O)(=O)NCC1=CC=CC=C1 Z300098430 [0,2,0,0,0,0|2,0,0]=4 1270 B12R1.891 O=S(=O)(F)CCC1=CC=CC=C1 Z1258763618 [0,2,0,0,0,0|2,0,0]=4 1271 B10R2.6 C1=CC(=CC=N1)C2CC2 Z3042074264 [1,0,0,1,0,0|2,0,0]=4 1272 B10R2.6 C1=CC(=CC=N1)C2CO2 Z1187818726 [1,0,0,1,0,0|2,0,0]=4 1273 B10R2.6 C1=CC(=CN=C1)C2CO2 Z1187818722 [1,0,0,1,0,0|2,0,0]=4 1274 B10R2.6 C1=CC=C(C=C1)C2CO2 Z104486008 [1,0,0,1,0,0|1,0,0]=3 1275 B10R2.6 C1=CC=C(C=C1)[C@@H]2CO2 Z1255356265 [1,0,0,1,0,0|1,0,0]=3 1276 B10R2.6 C1=CC=C(C=C1)[C@H]2CO2 Z1255390768 [1,0,0,1,0,0|1,0,0]=3 1277 B10R2.6 C1=CN=C(C=C1)C2CO2 Z1187818707 [1,0,0,1,0,0|2,0,0]=4 1278 B10R2.7 C1=CC2=C(C=C1)CC=C2 Z104476162 [1,0,0,1,0,0|1,0,1]=4 1279 B10R2.7 C1=CC2=C(C=C1)CNC2 Z1263820391 [1,0,0,1,0,0|1,0,0]=3 1280 B10R2.7 C1=CC2=C(C=C1)COC2 Z839134770 [1,0,0,1,0,0|2,0,0]=4 1281 B10R2.7 C1=CC2=C(C=C1)NC=C2 Z57833933 [1,0,0,1,0,0|0,0,2]=4 1282 B10R2.7 C1=CC2=C(C=C1)NC=N2 Z57069879 [1,0,0,1,0,0|1,0,1]=4 1283 B10R2.7 C1=CC2=C(C=C1)NCC2 Z104475582 [1,0,0,1,0,0|0,0,0]=2 1284 B10R2.7 C1=CC2=C(C=C1)NN=C2 Z276614452 [1,0,0,1,0,0|0,0,2]=4 1285 B10R2.7 C1=CC2=C(C=C1)NN=N2 Z57127352 [1,0,0,1,0,0|1,0,1]=4 1286 B10R2.7 C1=CC2=C(C=C1)OCC2 Z104505448 [1,0,0,1,0,0|1,0,0]=3 1287 B10R2.7 C1=CC2=C(C=N1)CCN2 Z1650168304 [1,0,0,1,0,0|1,0,0]=3 1288 B10R2.7 C1=CC2=C(C=N1)CCO2 Z1681336163 [1,0,0,1,0,0|2,0,0]=4 1289 B10R2.7 C1=CC2=C(C=N1)NCC2 Z1603826893 [1,0,0,1,0,0|1,0,0]=3 1290 B10R2.7 C1=CC2=C(CCN2)N=C1 Z1203748137 [1,0,0,1,0,0|1,0,0]=3 1291 B10R2.7 C1=CC2=C(CNC2)N=C1 Z1741974952 [1,0,0,1,0,0|2,0,0]=4 1292 B10R2.7 C1=CC2=C(N=C1)NCC2 Z979438826 [1,0,0,1,0,0|1,0,0]=3 1293 B10R2.320 NC1CC2=C1C=CC=C2 Z1918018858 [1,0,0,1,0,0|0,0,0]=2 1294 B10R2.5 N[C@@H]1C[C@H]1C2=CSC=C2 Z2683264163 [0,0,0,1,1,0|2,0,0]=4 1295 B12R2.24 BrC1=CC2=C(C=C1)CCCC2 Z299596180 [0,1,0,1,0,0|2,0,0]=4 1296 B12R2.24 BrC1=CC2=C(C=C1)CCNC2 Z1117899488 [0,1,0,1,0,0|1,0,0]=3 1297 B12R2.24 BrC1=CC2=C(C=C1)CNCC2 Z1224524500 [0,1,0,1,0,0|1,0,0]=3 1298 B12R2.24 BrC1=CC2=C(C=C1)NCCC2 Z283683538 [0,1,0,1,0,0|1,0,0]=3 1299 B12R2.24 BrC1=CC2=C(C=C1)NCCN2 Z1269212086 [0,1,0,1,0,0|2,0,0]=4 1300 B12R2.24 BrC1=CC2=C(C=C1)NCCO2 Z1741976975 [0,1,0,1,0,0|2,0,0]=4 1301 B12R2.24 BrC1=CC2=C(N=C1)NCCC2 Z1269123899 [0,1,0,1,0,0|2,0,0]=4 1302 B12R2.24 CC1=CC2=C(C=C1)CCCN2 Z1166113428 [0,1,0,1,0,0|1,0,0]=3 1303 B12R2.24 CC1=CC2=C(C=C1)CNCC2 Z1839475447 [0,1,0,1,0,0|1,0,0]=3 1304 B12R2.24 CC1=CC2=C(C=C1)NCCC2 Z104494706 [0,1,0,1,0,0|1,0,0]=3 1305 B12R2.24 CC1=CC2=C(C=C1)NCCO2 Z1203731551 [0,1,0,1,0,0|2,0,0]=4 1306 B12R2.24 CC1=CC2=C(C=C1)OCCC2 Z939648534 [0,1,0,1,0,0|2,0,0]=4 1307 B12R2.24 CC1=NC2=C(C=C1)CCCN2 Z1198169981 [0,1,0,1,0,0|2,0,0]=4 1308 B12R2.24 CC1=NC2=C(C=C1)NCCC2 Z1203748441 [0,1,0,1,0,0|2,0,0]=4 1309 B12R2.24 CC1CC2=C(C=CC=C2)CN1 Z979717380 [0,1,0,1,0,0|1,0,0]=3 1310 B12R2.24 CC1CCC2=C(N1)C=CC=N2 Z4269599049 [0,1,0,1,0,0|2,0,0]=4 1311 B12R2.24 CC1CNC2=C(C1)C=CC=C2 Z1118526687 [0,1,0,1,0,0|1,0,0]=3 1312 B12R2.24 CC1CNC2=C(N1)C=CC=C2 Z1203731025 [0,1,0,1,0,0|2,0,0]=4 1313 B12R2.24 CC1CNC2=C(O1)C=CC=C2 Z1165160777 [0,1,0,1,0,0|2,0,0]=4 1314 B12R2.24 CC1CNC2=C(S1)C=CC=C2 Z1198343217 [0,1,0,1,0,0|2,0,0]=4 1315 B12R2.24 CC1COC2=C(N1)C=CC=C2 Z1201621516 [0,1,0,1,0,0|2,0,0]=4 1316 B12R2.24 CC1CSC2=C(N1)C=CC=C2 Z1262564902 [0,1,0,1,0,0|2,0,0]=4 1317 B12R2.24 CN1CC2=C(C=CC=C2)CN1 Z415677430 [0,1,0,1,0,0|2,0,0]=4 1318 B12R2.24 C[C@@H]1CC2=C(C=CC=C2)CN1 Z1203733478 [0,1,0,1,0,0|1,0,0]=3 1319 B12R2.24 ClC1=CC2=C(C=C1)CCCN2 Z3244460786 [0,1,0,1,0,0|1,0,0]=3 1320 B12R2.24 ClC1=CC2=C(C=C1)CCNC2 Z1716481593 [0,1,0,1,0,0|1,0,0]=3 1321 B12R2.24 ClC1=CC2=C(C=C1)NCCC2 Z259727454 [0,1,0,1,0,0|1,0,0]=3 1322 B12R2.24 ClC1=CC2=C(C=C1)OCCN2 Z1198179941 [0,1,0,1,0,0|2,0,0]=4 1323 B12R2.24 ClC1=CC2=C(C=C1)SCCN2 Z361994002 [0,1,0,1,0,0|2,0,0]=4 1324 B12R2.24 ClC1=CC2=C(N=C1)NCCC2 Z1862012742 [0,1,0,1,0,0|2,0,0]=4 1325 B12R2.24 FC1=CC2=C(C=C1)CCNC2 Z979717316 [0,1,0,1,0,0|1,0,0]=3 1326 B12R2.24 FC1=CC2=C(C=C1)CNCC2 Z1198169933 [0,1,0,1,0,0|1,0,0]=3 1327 B12R2.24 FC1=CC2=C(CCCN2)N=C1 Z1255375849 [0,1,0,1,0,0|2,0,0]=4 1328 B12R2.24 NC1=CC2=C(C=C1)CCCC2 Z278204684 [0,1,0,1,0,0|2,0,0]=4 1329 B12R2.24 NC1=CC2=C(C=C1)OCCC2 Z728136682 [0,1,0,1,0,0|2,0,0]=4 1330 B12R2.24 NC1=NC2=C(C=CC=C2)CS1 Z1198725303 [0,1,0,1,0,0|2,0,0]=4 1331 B12R2.24 NC1CCC2=C(C1)C=CC=C2 Z992716772 [0,1,0,1,0,0|1,0,0]=3 1332 B12R2.24 NC1CCC2=C(C1)C=CC=N2 Z1270312108 [0,1,0,1,0,0|2,0,0]=4 1333 B12R2.24 NC1COC2=C(C1)C=CC=C2 Z415636540 [0,1,0,1,0,0|2,0,0]=4 1334 B12R2.24 O=C1C=CC2=C(N1)CCNC2 Z3234963668 [0,1,0,1,0,0|2,0,0]=4 1335 B12R2.24 O=C1CC2=C(C=CC=C2)CN1 Z1201622353 [0,1,0,1,0,0|1,0,1]=4 1336 B12R2.24 O=C1CCC2=C(C1)C=CC=C2 Z104495562 [0,1,0,1,0,0|2,0,0]=4 1337 B12R2.24 O=C1CCC2=C(N1)C=CC=C2 Z85917566 [0,1,0,1,0,0|1,0,0]=3 1338 B12R2.24 O=C1CCC2=C(O1)C=CC=C2 Z586249466 [0,1,0,1,0,0|2,0,0]=4 1339 B12R2.24 O=C1CNC2=C(N1)C=CC=C2 Z56990723 [0,1,0,1,0,0|2,0,0]=4 1340 B12R2.24 O=C1COC2=C(N1)C=CC=C2 Z56989567 [0,1,0,1,0,0|2,0,0]=4 1341 B12R2.24 O=C1CSC2=C(N1)C=CC=C2 Z55120717 [0,1,0,1,0,0|2,0,0]=4 1342 B12R2.24 O=C1NC2=C(C=CC=C2)CO1 Z1198157416 [0,1,0,1,0,0|2,0,0]=4 1343 B12R2.24 OC1=CC2=C(C=C1)CCCC2 Z57182387 [0,1,0,1,0,0|2,0,0]=4 1344 B12R2.24 OC1=CC2=C(C=C1)CCCN2 Z1198176201 [0,1,0,1,0,0|1,0,0]=3 1345 B12R2.24 OC1=CC2=C(C=C1)CCNC2 Z382690838 [0,1,0,1,0,0|1,0,0]=3 1346 B12R2.24 OC1=CC2=C(C=C1)CCOC2 Z1551961557 [0,1,0,1,0,0|2,0,0]=4 1347 B12R2.24 OC1=CC2=C(C=C1)CNCC2 Z3018438111 [0,1,0,1,0,0|1,0,0]=3 1348 B12R2.24 OC1=CC2=C(C=C1)COCC2 Z1255359696 [0,1,0,1,0,0|2,0,0]=4 1349 B12R2.24 OC1=CC2=C(C=C1)NCCO2 Z4967332209 [0,1,0,1,0,0|2,0,0]=4 1350 B12R2.24 OC1=CC2=C(C=C1)OCCC2 Z1201627010 [0,1,0,1,0,0|2,0,0]=4 1351 B12R2.24 OC1=CC2=C(C=C1)OCCN2 Z3234815231 [0,1,0,1,0,0|2,0,0]=4 1352 B12R2.24 OC1=NC2=C(C=C1)NCCC2 Z1618113980 [0,1,0,1,0,0|2,0,0]=4 1353 B12R2.24 OC1CCC2=C(C1)C=CC=C2 Z445987178 [0,1,0,1,0,0|2,0,0]=4 1354 B12R2.24 OC1CNC2=C(C1)C=CC=C2 Z1198341064 [0,1,0,1,0,0|1,0,0]=3 1355 B12R2.24 S=C1NC2=C(C=CC=C2)CS1 Z367678726 [0,1,0,1,0,0|2,0,0]=4 1356 B12R2.79 CC1=CC=C(C=C1)[C@@H]2C[C@H]2N Z2380468351 [0,1,0,1,0,0|1,0,0]=3 1357 B12R2.79 NC1CC1C2=CC=C(C=C2)F Z1266823169 [0,1,0,1,0,0|1,0,0]=3 1358 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(C=C2)Br Z2298098036 [0,1,0,1,0,0|1,0,0]=3 1359 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(C=C2)Cl Z2298098012 [0,1,0,1,0,0|1,0,0]=3 1360 B12R2.132 CC1=CC2=C(C=C1)CCC2=O Z814904824 [0,1,0,1,0,0|2,0,0]=4 1361 B12R2.132 CC1=CC2=C(C=C1)CCC2N Z1259339087 [0,1,0,1,0,0|1,0,0]=3 1362 B12R2.132 CC1=CC2=C(C=C1)OCC2N Z1431002725 [0,1,0,1,0,0|2,0,0]=4 1363 B12R2.132 CN1CCC2=C1C=C(C=C2)N Z334596086 [0,1,0,1,0,0|1,0,0]=3 1364 B12R2.132 NC1=CC2=C(C=C1)CCC2=O Z1201619096 [0,1,0,1,0,0|2,0,0]=4 1365 B12R2.132 NC1=CC2=C(C=C1)CCC2O Z1203584428 [0,1,0,1,0,0|2,0,0]=4 1366 B12R2.132 NC1CCC2=C1C=C(C=C2)Cl Z2692095081 [0,1,0,1,0,0|1,0,0]=3 1367 B12R2.132 NC1CCC2=C1C=C(C=C2)F Z1263820321 [0,1,0,1,0,0|1,0,0]=3 1368 B12R2.132 NC1CCC2=C1C=C(C=C2)O Z1198165276 [0,1,0,1,0,0|1,0,0]=3 1369 B12R2.132 NC1COC2=C1C=C(C=C2)Br Z3241275758 [0,1,0,1,0,0|2,0,0]=4 1370 B12R2.132 NC1COC2=C1C=C(C=C2)Cl Z1431002566 [0,1,0,1,0,0|2,0,0]=4 1371 B12R2.132 NC1COC2=C1C=C(C=C2)F Z1698549696 [0,1,0,1,0,0|2,0,0]=4 1372 B12R2.132 NC1CSC2=C1C=C(C=C2)Br Z431545436 [0,1,0,1,0,0|2,0,0]=4 1373 B12R2.132 O=C1CCC2=C1C=C(C=C2)F Z814904728 [0,1,0,1,0,0|2,0,0]=4 1374 B12R2.132 O=C1CCC2=C1C=C(C=C2)I Z1269230336 [0,1,0,1,0,0|2,0,0]=4 1375 B12R2.132 OC1CCC2=C1C=C(C=C2)F Z815114600 [0,1,0,1,0,0|2,0,0]=4 1376 B12R2.294 BrC1=CC=C(C=C1)CC2CO2 Z2523466484 [0,1,0,1,0,0|2,0,0]=4 1377 B12R2.294 FC1=CC=C(C=C1)CC2CO2 Z1495386285 [0,1,0,1,0,0|2,0,0]=4 1378 B12R2.1728 N#CC1CC2=C1C=C(C=C2)F Z1216846090 [0,1,0,1,0,0|1,0,1]=4 1379 B12R2.2302 ClC1=CC=C(C=C1)C2CCN2 Z1267773691 [0,1,0,1,0,0|1,0,0]=3 1380 B12R2.2302 ClC1=CC=C(C=C1)C2CNC2 Z3244745362 [0,1,0,1,0,0|1,0,0]=3 1381 B12R2.2302 ClC1=CN=C(C=C1)C2CNC2 Z3069013257 [0,1,0,1,0,0|2,0,0]=4 1382 B12R2.2302 NC1=CC=C(C=C1)C2CCC2 Z1203579606 [0,1,0,1,0,0|2,0,0]=4 1383 B12R2.2302 OC1=CC=C(C=C1)C2CCC2 Z1486032779 [0,1,0,1,0,0|2,0,0]=4 1384 B12R2.2 C1=CC(=CC=N1)C2CCCN2 Z238920298 [0,1,0,1,0,0|2,0,0]=4 1385 B12R2.2 C1=CC(=CC=N1)C2CCNC2 Z2492414323 [0,1,0,1,0,0|2,0,0]=4 1386 B12R2.2 C1=CC(=CN=C1)C2CCCN2 Z164706372 [0,1,0,1,0,0|2,0,0]=4 1387 B12R2.2 C1=CC=C(C=C1)C2=CCNC2 Z1574940564 [0,1,0,1,0,0|1,0,1]=4 1388 B12R2.2 C1=CC=C(C=C1)C2=NCCC2 Z235344923 [0,1,0,1,0,0|1,0,1]=4 1389 B12R2.2 C1=CC=C(C=C1)C2=NCCN2 Z283858536 [0,1,0,1,0,0|1,0,1]=4 1390 B12R2.2 C1=CC=C(C=C1)C2CCCN2 Z223138744 [0,1,0,1,0,0|1,0,0]=3 1391 B12R2.2 C1=CC=C(C=C1)C2CCNC2 Z926900322 [0,1,0,1,0,0|1,0,0]=3 1392 B12R2.2 C1=CN=C(C=C1)C2CCNC2 Z940902744 [0,1,0,1,0,0|2,0,0]=4 1393 B12R2.22 N[C@H]1C[C@@H](C1)C2=CC=CC=C2 Z2301685436 [0,1,0,1,0,0|1,0,0]=3 1394 B12R2.22 O=C1CC(C1)C2=CC=CC=C2 Z336080338 [0,1,0,1,0,0|2,0,0]=4 1395 B12R2.22 O=C1CC(N1)C2=CC=CC=C2 Z367677412 [0,1,0,1,0,0|1,0,0]=3 1396 B12R2.22 OC1CC(C1)C2=CC=CC=C2 Z501748204 [0,1,0,1,0,0|2,0,0]=4 1397 B12R2.22 O[C@H]1C[C@H](C1)C2=CC=CC=C2 Z1504675336 [0,1,0,1,0,0|2,0,0]=4 1398 B12R2.27 CNC1CC1C2=CC=CC=C2 Z1443588579 [0,1,0,1,0,0|1,0,0]=3 1399 B12R2.27 CN[C@@H]1C[C@H]1C2=CC=CC=C2 Z3024312938 [0,1,0,1,0,0|1,0,0]=3 1400 B12R2.27 N#C[C@@H]1C[C@H]1C2=CC=CC=C2 Z1198147613 [0,1,0,1,0,0|1,0,1]=4 1401 B12R2.27 NCC1CC1C2=CC=CC=C2 Z1276751392 [0,1,0,1,0,0|1,0,0]=3 1402 B12R2.27 O=C[C@@H]1C[C@H]1C2=CC=CC=C2 Z2298064271 [0,1,0,1,0,0|2,0,0]=4 1403 B12R2.27 OCC1OC1C2=CC=CC=C2 Z1509054538 [0,1,0,1,0,0|2,0,0]=4 1404 B12R2.116 CC1(CNC1)C2=CC=CC=C2 Z2143576561 [0,1,0,1,0,0|1,0,0]=3 1405 B12R2.116 FC1(CNC1)C2=CC=NC=C2 Z5526531607 [0,1,0,1,0,0|2,0,0]=4 1406 B12R2.116 FC1(CNC1)C2=NC=CC=C2 Z5386622085 [0,1,0,1,0,0|2,0,0]=4 1407 B12R2.116 OC1(CCC1)C2=CC=CC=C2 Z1198315122 [0,1,0,1,0,0|2,0,0]=4 1408 B12R2.116 OC1(CNC1)C2=CN=CC=C2 Z3492926719 [0,1,0,1,0,0|2,0,0]=4 1409 B12R2.116 OC1(CNC1)C2=NC=CC=C2 Z3921967489 [0,1,0,1,0,0|2,0,0]=4 1410 B12R2.235 CC1(CC1N)C2=CC=CC=C2 Z1259335890 [0,1,0,1,0,0|1,0,0]=3 1411 B12R2.1081 BrC1=C2CCCNC2=CC=C1 Z1269174223 [0,1,0,1,0,0|1,0,0]=3 1412 B12R2.1081 BrC1=C2CCNCC2=CC=C1 Z368591556 [0,1,0,1,0,0|1,0,0]=3 1413 B12R2.1081 BrC1=C2CNCCC2=CC=C1 Z1695923042 [0,1,0,1,0,0|1,0,0]=3 1414 B12R2.1081 BrC1=C2NCCCC2=CC=C1 Z992717150 [0,1,0,1,0,0|1,0,0]=3 1415 B12R2.1081 BrC1=C2NCCNC2=CC=C1 Z5857372668 [0,1,0,1,0,0|2,0,0]=4 1416 B12R2.1081 BrC1=C2NCCOC2=CC=C1 Z2943434775 [0,1,0,1,0,0|2,0,0]=4 1417 B12R2.1081 BrC1=C2NCCSC2=CC=C1 Z1269123510 [0,1,0,1,0,0|2,0,0]=4 1418 B12R2.1081 BrC1=C2OCCCC2=CC=C1 Z1269242001 [0,1,0,1,0,0|2,0,0]=4 1419 B12R2.1081 BrC1=C2OCCNC2=CC=C1 Z1983132695 [0,1,0,1,0,0|2,0,0]=4 1420 B12R2.1081 CC1=C2CCCNC2=CC=C1 Z1192360094 [0,1,0,1,0,0|1,0,0]=3 1421 B12R2.1081 CC1=C2CCNCC2=CC=C1 Z1891775029 [0,1,0,1,0,0|1,0,0]=3 1422 B12R2.1081 CC1=C2NCCCC2=CC=C1 Z199537268 [0,1,0,1,0,0|1,0,0]=3 1423 B12R2.1081 CC1CCNC2=C1C=CC=C2 Z382691338 [0,1,0,1,0,0|1,0,0]=3 1424 B12R2.1081 CC1CNCC2=C1C=CC=C2 Z1741982189 [0,1,0,1,0,0|1,0,0]=3 1425 B12R2.1081 CN1CCNC2=C1C=CC=C2 Z558641952 [0,1,0,1,0,0|1,0,0]=3 1426 B12R2.1081 CN1CCNC2=C1C=CN=C2 Z1365408676 [0,1,0,1,0,0|2,0,0]=4 1427 B12R2.1081 CN1CCNC2=C1N=CC=C2 Z1198175997 [0,1,0,1,0,0|2,0,0]=4 1428 B12R2.1081 ClC1=C2CCNCC2=CC=C1 Z368591478 [0,1,0,1,0,0|1,0,0]=3 1429 B12R2.1081 ClC1=C2NCCCC2=CC=C1 Z259727508 [0,1,0,1,0,0|1,0,0]=3 1430 B12R2.1081 ClC1=C2OCCNC2=CC=C1 Z1255446801 [0,1,0,1,0,0|2,0,0]=4 1431 B12R2.1081 FC1=C2CCCNC2=CC=C1 Z1333761719 [0,1,0,1,0,0|1,0,0]=3 1432 B12R2.1081 FC1=C2CCNCC2=CC=C1 Z368591508 [0,1,0,1,0,0|1,0,0]=3 1433 B12R2.1081 FC1=C2CNCCC2=CC=C1 Z1198179884 [0,1,0,1,0,0|1,0,0]=3 1434 B12R2.1081 FC1=C2NCCCC2=CC=C1 Z247615872 [0,1,0,1,0,0|1,0,0]=3 1435 B12R2.1081 FC1=C2NCCOC2=CC=C1 Z1255361602 [0,1,0,1,0,0|2,0,0]=4 1436 B12R2.1081 IC1=C2CCCCC2=CC=C1 Z381540728 [0,1,0,1,0,0|2,0,0]=4 1437 B12R2.1081 NC1=C2CCCCC2=CC=C1 Z104502914 [0,1,0,1,0,0|2,0,0]=4 1438 B12R2.1081 NC1=C2CCCNC2=CC=C1 Z1198176445 [0,1,0,1,0,0|1,0,0]=3 1439 B12R2.1081 NC1=C2CCOCC2=CC=C1 Z3398761712 [0,1,0,1,0,0|2,0,0]=4 1440 B12R2.1081 NC1=C2CNCCC2=CC=N1 Z1763544280 [0,1,0,1,0,0|2,0,0]=4 1441 B12R2.1081 NC1=C2CNCCC2=NC=C1 Z2461246351 [0,1,0,1,0,0|2,0,0]=4 1442 B12R2.1081 NC1=C2OCCCC2=CC=C1 Z1723491871 [0,1,0,1,0,0|2,0,0]=4 1443 B12R2.1081 NC1=C2SCCCC2=CC=C1 Z5584894309 [0,1,0,1,0,0|2,0,0]=4 1444 B12R2.1081 NC1CCCC2=C1C=CC=C2 Z316170348 [0,1,0,1,0,0|1,0,0]=3 1445 B12R2.1081 NC1CCCC2=C1C=CN=C2 Z3244922506 [0,1,0,1,0,0|2,0,0]=4 1446 B12R2.1081 NC1CCOC2=C1C=CC=C2 Z85923435 [0,1,0,1,0,0|1,0,0]=3 1447 B12R2.1081 NC1CCSC2=C1C=CC=C2 Z57066684 [0,1,0,1,0,0|1,0,0]=3 1448 B12R2.1081 NC1COCC2=C1C=CC=C2 Z1198178449 [0,1,0,1,0,0|1,0,0]=3 1449 B12R2.1081 NC1CSCC2=C1C=CC=C2 Z1695783215 [0,1,0,1,0,0|1,0,0]=3 1450 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 Z1442208747 [0,1,0,1,0,0|1,0,0]=3 1451 B12R2.1081 O=C1CCCC2=C1C=CC=C2 Z104477014 [0,1,0,1,0,0|2,0,0]=4 1452 B12R2.1081 O=C1CCNC2=C1C=CC=C2 Z1492781321 [0,1,0,1,0,0|1,0,1]=4 1453 B12R2.1081 O=C1CCOC2=C1C=CC=C2 Z85920466 [0,1,0,1,0,0|2,0,0]=4 1454 B12R2.1081 O=C1CCSC2=C1C=CC=C2 Z56914832 [0,1,0,1,0,0|2,0,0]=4 1455 B12R2.1081 O=C1COCC2=C1C=CC=C2 Z1201625145 [0,1,0,1,0,0|2,0,0]=4 1456 B12R2.1081 O=C1NC=CC2=C1CNCC2 Z1860991849 [0,1,0,1,0,0|2,0,0]=4 1457 B12R2.1081 O=C1NCCC2=C1C=CC=C2 Z56801375 [0,1,0,1,0,0|1,0,0]=3 1458 B12R2.1081 O=C1NCCC2=C1C=NC=C2 Z3513877919 [0,1,0,1,0,0|2,0,0]=4 1459 B12R2.1081 O=S1CCNC2=C1C=CC=C2 Z217166136 [0,1,0,1,0,0|2,0,0]=4 1460 B12R2.1081 OB1OCCC2=C1C=CC=C2 Z1201624582 [0,1,0,1,0,0|2,0,0]=4 1461 B12R2.1081 OC1=C2CCCCC2=CC=C1 Z274762958 [0,1,0,1,0,0|2,0,0]=4 1462 B12R2.1081 OC1=C2CCCNC2=CC=C1 Z1203731295 [0,1,0,1,0,0|1,0,0]=3 1463 B12R2.1081 OC1=C2CCNCC2=CC=C1 Z2313108218 [0,1,0,1,0,0|1,0,0]=3 1464 B12R2.1081 OC1=C2CCOCC2=CC=C1 Z1255506128 [0,1,0,1,0,0|2,0,0]=4 1465 B12R2.1081 OC1=C2CNCCC2=CC=C1 Z3243654680 [0,1,0,1,0,0|1,0,0]=3 1466 B12R2.1081 OC1=C2CNCCC2=NC=C1 Z2953972929 [0,1,0,1,0,0|2,0,0]=4 1467 B12R2.1081 OC1=C2NCCCC2=CC=C1 Z57001601 [0,1,0,1,0,0|1,0,0]=3 1468 B12R2.1081 OC1=C2OCCCC2=CC=C1 Z1198726643 [0,1,0,1,0,0|2,0,0]=4 1469 B12R2.1081 OC1CCCC2=C1C=CC=C2 Z56899171 [0,1,0,1,0,0|2,0,0]=4 1470 B12R2.1081 OC1CCNC2=C1C=CC=C2 Z1198723522 [0,1,0,1,0,0|1,0,0]=3 1471 B12R2.1081 OC1CCOC2=C1C=CC=C2 Z335244980 [0,1,0,1,0,0|2,0,0]=4 1472 B12R2.1081 OC1CCSC2=C1C=CC=C2 Z57085790 [0,1,0,1,0,0|2,0,0]=4 1473 B12R2.1081 OC1COCC2=C1C=CC=C2 Z1255366473 [0,1,0,1,0,0|2,0,0]=4 1474 B12R2.1081 OC1CSCC2=C1C=CC=C2 Z445987402 [0,1,0,1,0,0|2,0,0]=4 1475 B12R2.1081 O[C@@H]1CCOC2=C1C=CC=C2 Z959151866 [0,1,0,1,0,0|2,0,0]=4 1476 B12R2.1081 O[C@@H]1CCSC2=C1C=CC=C2 Z959151622 [0,1,0,1,0,0|2,0,0]=4 1477 B12R2.1081 O[C@H]1CCOC2=C1C=CC=C2 Z959151868 [0,1,0,1,0,0|2,0,0]=4 1478 B12R2.1081 O[C@H]1CCSC2=C1C=CC=C2 Z959151626 [0,1,0,1,0,0|2,0,0]=4 1479 B12R2.2028 CC1CC(=O)C2=C1C=CC=C2 Z335243948 [0,1,0,1,0,0|2,0,0]=4 1480 B12R2.2028 CC1CC(C2=C1C=CC=C2)N Z1263529672 [0,1,0,1,0,0|1,0,0]=3 1481 B12R2.2028 N[C@@H]1C[C@@H](C2=C1C=CC=C2)O Z4591105168 [0,1,0,1,0,0|1,0,0]=3 1482 B12R2.2075 CC(C1=CC=CC=C1)C2CO2 Z1020679814 [0,1,0,1,0,0|2,0,0]=4 1483 B12R2.2075 NC(C1=CC=CC=C1)C2CC2 Z203239488 [0,1,0,1,0,0|2,0,0]=4 1484 B12R2.32 ClCC1CC2=C(O1)C=CC=C2 Z397587656 [0,1,0,1,0,0|2,0,0]=4 1485 B12R2.32 N#CC1CC2=C(C1)C=CC=C2 Z449368682 [0,1,0,1,0,0|1,0,1]=4 1486 B12R2.32 NCC1CC2=C(C1)C=CC=C2 Z1269638468 [0,1,0,1,0,0|1,0,0]=3 1487 B12R2.32 NCC1CC2=C(O1)C=CC=C2 Z291234246 [0,1,0,1,0,0|1,0,0]=3 1488 B12R2.32 NNC1=NC2=C(N1)C=CC=C2 Z57087494 [0,1,0,1,0,0|1,0,1]=4 1489 B12R2.32 NNC1=NC2=C(O1)C=CC=C2 Z56801289 [0,1,0,1,0,0|1,0,1]=4 1490 B12R2.32 NNC1=NC2=C(S1)C=CC=C2 Z56756340 [0,1,0,1,0,0|1,0,1]=4 1491 B12R2.32 O=CC1CC2=C(C1)C=CC=C2 Z1255436588 [0,1,0,1,0,0|2,0,0]=4 1492 B12R2.32 OCC1CC2=C(C1)C=CC=C2 Z1198176601 [0,1,0,1,0,0|2,0,0]=4 1493 B12R2.32 OCC1CC2=C(O1)C=CC=C2 Z397587206 [0,1,0,1,0,0|2,0,0]=4 1494 B12R2.115 CC1=C(C=CC=C1)[C@@H]2C[C@H]2N Z2286637165 [0,1,0,1,0,0|1,0,0]=3 1495 B12R2.115 NC1CC1C2=C(C=CC=C2)Br Z1269638533 [0,1,0,1,0,0|1,0,0]=3 1496 B12R2.115 N[C@@H]1C[C@H]1C2=C(C=CC=C2)Cl Z2298098040 [0,1,0,1,0,0|1,0,0]=3 1497 B12R2.196 CC1=C2CCC(=O)C2=CC=C1 Z334686316 [0,1,0,1,0,0|2,0,0]=4 1498 B12R2.196 CN1CCC2=C(C=CC=C12)N Z5342302022 [0,1,0,1,0,0|1,0,0]=3 1499 B12R2.196 NC1=C2CCC(=O)C2=CC=C1 Z5097408049 [0,1,0,1,0,0|2,0,0]=4 1500 B12R2.196 NC1=C2CCC(C2=CC=C1)N Z4404079635 [0,1,0,1,0,0|1,0,0]=3 1501 B12R2.196 NC1CCC2=C(C=CC=C12)Br Z1263529547 [0,1,0,1,0,0|1,0,0]=3 1502 B12R2.196 NC1CCC2=C(C=CC=C12)Cl Z802671646 [0,1,0,1,0,0|1,0,0]=3 1503 B12R2.196 NC1CCC2=C(C=CC=C12)F Z802665924 [0,1,0,1,0,0|1,0,0]=3 1504 B12R2.196 NC1CCC2=C(C=CC=C12)O Z317054124 [0,1,0,1,0,0|1,0,0]=3 1505 B12R2.196 NC1COC2=C(C=CC=C12)Cl Z1416282556 [0,1,0,1,0,0|2,0,0]=4 1506 B12R2.196 NC1COC2=C(C=CC=C12)F Z4574897577 [0,1,0,1,0,0|2,0,0]=4 1507 B12R2.196 O=C1CCC2=C(C=CC=C12)Br Z334686326 [0,1,0,1,0,0|2,0,0]=4 1508 B12R2.196 O=C1CCC2=C(C=CC=C12)Cl Z234895081 [0,1,0,1,0,0|2,0,0]=4 1509 B12R2.196 O=C1CCC2=C(C=CC=C12)F Z334686322 [0,1,0,1,0,0|2,0,0]=4 1510 B12R2.196 O=C1CCC2=C(C=CC=C12)O Z203881856 [0,1,0,1,0,0|2,0,0]=4 1511 B12R2.196 OC1CCC2=C(C=CC=C12)Cl Z815114596 [0,1,0,1,0,0|2,0,0]=4 1512 B12R2.225 BrC1=C(C=CC=C1)CC2CO2 Z1269241605 [0,1,0,1,0,0|2,0,0]=4 1513 B12R2.517 FC1=C(C=CC=C1)C2CCN2 Z1281078840 [0,1,0,1,0,0|1,0,0]=3 1514 B12R2.517 NC1=C(C=CC=C1)C2CCC2 Z3025871756 [0,1,0,1,0,0|2,0,0]=4 1515 B12R2.80 NC1CC1C2=CC(=CC=C2)Br Z1266823142 [0,1,0,1,0,0|1,0,0]=3 1516 B12R2.80 N[C@@H]1C[C@H]1C2=CC(=CC=C2)Cl Z2298098009 [0,1,0,1,0,0|1,0,0]=3 1517 B12R2.203 CC1=C2C(=O)CCC2=CC=C1 Z1255399735 [0,1,0,1,0,0|2,0,0]=4 1518 B12R2.203 NC1CCC2=C1C(=CC=C2)Cl Z5376597718 [0,1,0,1,0,0|1,0,0]=3 1519 B12R2.203 NC1COC2=C1C(=CC=C2)Cl Z2111525790 [0,1,0,1,0,0|2,0,0]=4 1520 B12R2.203 O=C1CCC2=CC=CC(=C12)F Z1201624056 [0,1,0,1,0,0|2,0,0]=4 1521 B12R2.203 O=C1CCC2=CC=CC(=C12)O Z1255416018 [0,1,0,1,0,0|2,0,0]=4 1522 B12R2.612 CC1=CC2=C(C=C1)C(=O)CC2 Z318770612 [0,1,0,1,0,0|2,0,0]=4 1523 B12R2.612 CC1=CC2=C(C=C1)C(CC2)N Z802665938 [0,1,0,1,0,0|1,0,0]=3 1524 B12R2.612 CN1CCC2=C1C=CC(=C2)N Z992717374 [0,1,0,1,0,0|1,0,0]=3 1525 B12R2.612 CN1CCC2=C1C=CC(=C2)O Z2238129691 [0,1,0,1,0,0|1,0,0]=3 1526 B12R2.612 NC1=CC2=C(C=C1)C(=O)CC2 Z57109500 [0,1,0,1,0,0|2,0,0]=4 1527 B12R2.612 NC1=CC2=C(C=C1)C(CC2)N Z2526714445 [0,1,0,1,0,0|1,0,0]=3 1528 B12R2.612 NC1CCC2=C1C=CC(=C2)Br Z802671682 [0,1,0,1,0,0|1,0,0]=3 1529 B12R2.612 NC1CCC2=C1C=CC(=C2)Cl Z802665886 [0,1,0,1,0,0|1,0,0]=3 1530 B12R2.612 NC1CCC2=C1C=CC(=C2)F Z802671620 [0,1,0,1,0,0|1,0,0]=3 1531 B12R2.612 NC1COC2=C1C=CC(=C2)Br Z1269171640 [0,1,0,1,0,0|2,0,0]=4 1532 B12R2.612 NC1COC2=C1C=CC(=C2)Cl Z3244818242 [0,1,0,1,0,0|2,0,0]=4 1533 B12R2.612 NC1COC2=C1C=CC(=C2)F Z3014279399 [0,1,0,1,0,0|2,0,0]=4 1534 B12R2.612 O=C1CCC2=C1C=CC(=C2)Br Z318770638 [0,1,0,1,0,0|2,0,0]=4 1535 B12R2.612 O=C1CCC2=C1C=CC(=C2)Cl Z318770634 [0,1,0,1,0,0|2,0,0]=4 1536 B12R2.612 O=C1CCC2=C1C=CC(=C2)F Z318770630 [0,1,0,1,0,0|2,0,0]=4 1537 B12R2.612 O=C1CCC2=C1C=CC(=C2)O Z1255457932 [0,1,0,1,0,0|2,0,0]=4 1538 B12R2.612 OC1CCC2=C1C=CC(=C2)Br Z756050350 [0,1,0,1,0,0|2,0,0]=4 1539 B12R2.612 OC1CCC2=C1C=CC(=C2)F Z1198318486 [0,1,0,1,0,0|2,0,0]=4 1540 B12R2.612 O[C@@H]1CCC2=C1C=CC(=C2)Br Z1269146008 [0,1,0,1,0,0|2,0,0]=4 1541 B12R2.612 O[C@@H]1CCC2=C1C=CC(=C2)Cl Z959151848 [0,1,0,1,0,0|2,0,0]=4 1542 B12R2.612 O[C@@H]1CCC2=C1C=CC(=C2)F Z959151860 [0,1,0,1,0,0|2,0,0]=4 1543 B12R2.612 O[C@H]1CCC2=C1C=CC(=C2)Cl Z959151850 [0,1,0,1,0,0|2,0,0]=4 1544 B12R2.612 O[C@H]1CCC2=C1C=CC(=C2)F Z959151856 [0,1,0,1,0,0|2,0,0]=4 1545 B12R2.1286 ClC1=CC(=CC=C1)CC2CO2 Z1495386153 [0,1,0,1,0,0|2,0,0]=4 1546 B12R2.1286 FC1=CC(=CC=C1)CC2CO2 Z1495386186 [0,1,0,1,0,0|2,0,0]=4 1547 B12R2.2313 FC1=CC(=CC=C1)C2CCN2 Z1696844460 [0,1,0,1,0,0|1,0,0]=3 1548 B12R2.2313 FC1=CC(=CC=C1)C2CNC2 Z1436185316 [0,1,0,1,0,0|1,0,0]=3 1549 B12R2.2313 NC1=CC(=CC=C1)C2CCC2 Z1486032780 [0,1,0,1,0,0|2,0,0]=4 1550 B12R2.1 CCC1NCC2=C1C=CC=C2 Z2937794220 [0,1,0,1,0,0|2,0,0]=4 1551 B12R2.1 CNC1CCC2=C1C=CC=C2 Z239628830 [0,1,0,1,0,0|1,0,0]=3 1552 B12R2.1 N#CC1CCC2=C1C=CC=C2 Z415654704 [0,1,0,1,0,0|1,0,1]=4 1553 B12R2.1 N#CC1CSC2=C1C=CC=C2 Z1316762142 [0,1,0,1,0,0|1,0,1]=4 1554 B12R2.1 NCC1CCC2=C1C=CC=C2 Z415654944 [0,1,0,1,0,0|1,0,0]=3 1555 B12R2.1 NCC1CCC2=C1N=CC=C2 Z2489361097 [0,1,0,1,0,0|2,0,0]=4 1556 B12R2.1 NCC1COC2=C1C=CC=C2 Z1197877490 [0,1,0,1,0,0|1,0,0]=3 1557 B12R2.1 NCC1CSC2=C1C=CC=C2 Z1316760731 [0,1,0,1,0,0|1,0,0]=3 1558 B12R2.1 NCC1OCC2=C1C=CC=C2 Z2310708138 [0,1,0,1,0,0|1,0,0]=3 1559 B12R2.1 O=CC1CCC2=C1C=CC=C2 Z1070003774 [0,1,0,1,0,0|2,0,0]=4 1560 B12R2.1 O=NN1CCC2=C1C=CC=C2 Z1198156346 [0,1,0,1,0,0|0,0,1]=3 1561 B12R2.1 OCC1CCC2=C1C=CC=C2 Z1148209594 [0,1,0,1,0,0|2,0,0]=4 1562 B12R2.1 OCC1CNC2=C1C=CC=C2 Z2213893407 [0,1,0,1,0,0|2,0,0]=4 1563 B12R2.1 OCC1CSC2=C1C=CC=C2 Z1316761281 [0,1,0,1,0,0|2,0,0]=4 1564 B12R2.11 N[C@@H]1C[C@H]1SC2=CC=CC=C2 Z4598403773 [0,1,0,1,0,0|1,0,0]=3 1565 B12R2.23 CC1CNC1C2=CC=CC=C2 Z1268458216 [0,1,0,1,0,0|1,0,0]=3 1566 B12R2.23 NC1CCC1C2=CC=CC=C2 Z1203589614 [0,1,0,1,0,0|1,0,0]=3 1567 B12R2.23 N[C@@H]1CC[C@@H]1C2=CC=CC=C2 Z2489138864 [0,1,0,1,0,0|1,0,0]=3 1568 B12R2.23 O=C1CCN1C2=CC=CC=C2 Z1198221109 [0,1,0,1,0,0|2,0,0]=4 1569 B12R2.2057 C1=CC=C(C=C1)CCC2CO2 Z1033258586 [0,1,0,1,0,0|2,0,0]=4 1570 B12R2.2057 C1=CC=C(C=C1)NCC2CC2 Z431957604 [0,1,0,1,0,0|2,0,0]=4 1571 B12R2.2057 C1=CC=C(C=C1)OCC2CO2 Z57358969 [0,1,0,1,0,0|2,0,0]=4 1572 B12R2.2057 C1=CC=C(C=C1)SCC2CO2 Z330820010 [0,1,0,1,0,0|2,0,0]=4 1573 B12R2.2058 C1=CC(=CN=C1)OC2CNC2 Z3234812406 [0,1,0,1,0,0|2,0,0]=4 1574 B12R2.2058 C1=CC=C(C=C1)CC2CCN2 Z1324054892 [0,1,0,1,0,0|1,0,0]=3 1575 B12R2.2058 C1=CC=C(C=C1)CC2CNC2 Z234895271 [0,1,0,1,0,0|1,0,0]=3 1576 B12R2.18 CC1=NC2=C(N1N)C=CC=C2 Z119919218 [0,1,0,1,0,0|1,0,1]=4 1577 B12R2.18 CC1C2=C(C=CC=C2)CC1N Z1203580431 [0,1,0,1,0,0|2,0,0]=4 1578 B12R2.18 CC1C2=C(C=CC=C2)CC1O Z1349231024 [0,1,0,1,0,0|2,0,0]=4 1579 B12R2.18 CC1CC2=C(C1=O)C=CC=C2 Z854042930 [0,1,0,1,0,0|2,0,0]=4 1580 B12R2.18 CC1CC2=C(C1N)C=CC=C2 Z1182328130 [0,1,0,1,0,0|1,0,0]=3 1581 B12R2.18 CC1OC2=C(C1N)C=CC=C2 Z2160887371 [0,1,0,1,0,0|2,0,0]=4 1582 B12R2.18 CN1C(=O)CC2=C1C=CC=C2 Z56899025 [0,1,0,1,0,0|1,0,1]=4 1583 B12R2.18 C[C@@H]1CC2=C([C@H]1N)C=CC=C2 Z4993149521 [0,1,0,1,0,0|1,0,0]=3 1584 B12R2.18 C[C@H]1C2=C(C=CC=C2)C[C@H]1N Z2514551594 [0,1,0,1,0,0|2,0,0]=4 1585 B12R2.18 NC1=NC2=C(N1N)C=CC=C2 Z56788891 [0,1,0,1,0,0|1,0,1]=4 1586 B12R2.18 NC1CC2=C(C1=O)C=CC=C2 Z1551475987 [0,1,0,1,0,0|2,0,0]=4 1587 B12R2.18 NC1CC2=C(C1O)C=CC=C2 Z1431905060 [0,1,0,1,0,0|2,0,0]=4 1588 B12R2.18 N[C@@H]1C2=C(C=CC=C2)C[C@@H]1O Z784894996 [0,1,0,1,0,0|1,0,0]=3 1589 B12R2.18 N[C@@H]1CC2=C([C@H]1O)C=CC=C2 Z2307327484 [0,1,0,1,0,0|2,0,0]=4 1590 B12R2.18 N[C@H]1C2=C(C=CC=C2)C[C@@H]1O Z4663003875 [0,1,0,1,0,0|1,0,0]=3 1591 B12R2.18 N[C@H]1C2=C(C=CC=C2)C[C@H]1N Z4749736623 [0,1,0,1,0,0|1,0,0]=3 1592 B12R2.18 N[C@H]1C2=C(C=CC=C2)C[C@H]1O Z803127638 [0,1,0,1,0,0|1,0,0]=3 1593 B12R2.18 O=C1C2=C(C=CC=C2)CC1Cl Z854067258 [0,1,0,1,0,0|2,0,0]=4 1594 B12R2.18 OC1C2=C(C=CC=C2)CC1Br Z104485720 [0,1,0,1,0,0|2,0,0]=4 1595 B12R2.18 OC1C2=C(C=CC=C2)CC1F Z1509011291 [0,1,0,1,0,0|2,0,0]=4 1596 B12R2.37 CC1C(C1C2=CC=CC=C2)N Z3596843396 [0,1,0,1,0,0|1,0,0]=3 1597 B12R2.94 NC1(CC1)CC2=CC=CC=C2 Z1723549343 [0,1,0,1,0,0|2,0,0]=4 1598 B12R2.2403 CC1(CCC2=C1C=CC=C2)N Z449371306 [0,1,0,1,0,0|1,0,0]=3 1599 B12R2.2403 CC1(CCC2=C1C=CC=C2)O Z449370928 [0,1,0,1,0,0|2,0,0]=4 1600 B12R2.2403 CC1(COC2=C1C=CC=C2)N Z5094222723 [0,1,0,1,0,0|2,0,0]=4 1601 B12R2.2403 N=S1(=O)CCC2=C1C=CC=C2 Z2514148544 [0,1,0,1,0,0|1,0,1]=4 1602 B12R2.3190 N=C(N)C1CC2=C1C=CC=C2 Z1613477992 [0,1,0,1,0,0|1,0,0]=3 1603 B12R3.12 C1=CC2=C(C=C1)C3OC3C2 Z278165226 [0,0,0,2,0,0|2,0,0]=4 1604 B8R1.8 CNCC1=CC=CN1 Z102767010 [1,0,0,0,1,0|2,0,0]=4 1605 B8R1.8 CNCC1=CC=CO1 Z57051072 [1,0,0,0,1,0|2,0,0]=4 1606 B8R1.8 CNCC1=CC=CS1 Z56948283 [1,0,0,0,1,0|2,0,0]=4 1607 B8R1.8 CNCC1=COC=C1 Z385447092 [1,0,0,0,1,0|2,0,0]=4 1608 B8R1.8 CNCC1=CSC=C1 Z57206125 [1,0,0,0,1,0|2,0,0]=4 1609 B8R1.8 NCCC1=CC=CN1 Z810507730 [1,0,0,0,1,0|1,0,0]=3 1610 B8R1.8 NCCC1=CC=CO1 Z1694636467 [1,0,0,0,1,0|1,0,0]=3 1611 B8R1.8 NCCC1=CC=CS1 Z90662945 [1,0,0,0,1,0|1,0,0]=3 1612 B8R1.8 NCCC1=CC=NS1 Z2768432862 [1,0,0,0,1,0|2,0,0]=4 1613 B8R1.8 NCCC1=CNC=N1 Z1267773750 [1,0,0,0,1,0|2,0,0]=4 1614 B8R1.8 NCCC1=CNN=C1 Z336080532 [1,0,0,0,1,0|2,0,0]=4 1615 B8R1.8 NCCC1=COC=C1 Z2310701825 [1,0,0,0,1,0|1,0,0]=3 1616 B8R1.8 NCCC1=NC=CO1 Z4925106850 [1,0,0,0,1,0|2,0,0]=4 1617 B8R1.8 NCCC1=NC=CS1 Z2724334997 [1,0,0,0,1,0|2,0,0]=4 1618 B8R1.8 NCCC1=NNC=C1 Z2867120994 [1,0,0,0,1,0|2,0,0]=4 1619 B8R1.8 NCCN1C=CC=N1 Z271005714 [1,0,0,0,1,0|2,0,0]=4 1620 B8R1.8 NCCN1C=CN=C1 Z147642864 [1,0,0,0,1,0|2,0,0]=4 1621 B8R1.8 OCCC1=CC=CO1 Z1179944660 [1,0,0,0,1,0|2,0,0]=4 1622 B8R1.8 OCCC1=CC=CS1 Z397587354 [1,0,0,0,1,0|2,0,0]=4 1623 B8R1.8 OCCC1=COC=C1 Z1179944659 [1,0,0,0,1,0|2,0,0]=4 1624 B8R1.8 OCCC1=CSC=C1 Z397587098 [1,0,0,0,1,0|2,0,0]=4