0 B11R2.1 BrC1=CCc2ccccc21 Amb26318514 [0,0,0,0,0,0|3,0,0]=3 1 B11R2.1 BrC1CCc2ccccc21 Amb33528718 [0,0,0,0,0,0|3,0,1]=4 2 B11R2.1 Brc1ccc2ccccn12 Amb18061677 [0,0,0,0,0,0|4,0,0]=4 3 B11R2.1 Brc1cnc2ccccn12 Amb2389876 [0,0,0,0,0,0|4,0,0]=4 4 B11R2.1 Brc1cnn2ccccc12 Amb2389879 [0,0,0,0,0,0|4,0,0]=4 5 B11R2.1 Brc1coc2ccccc12 Amb6344810 [0,0,0,0,0,0|2,0,0]=2 6 B11R2.1 Brc1coc2cccnc12 Amb18187782 [0,0,0,0,0,0|3,0,0]=3 7 B11R2.1 Brc1coc2ccncc12 Amb18187801 [0,0,0,0,0,0|3,0,0]=3 8 B11R2.1 Brc1coc2cnccc12 Amb26912398 [0,0,0,0,0,0|3,0,0]=3 9 B11R2.1 Brc1coc2ncccc12 Amb18811362 [0,0,0,0,0,0|3,0,0]=3 10 B11R2.1 Brc1csc2ccccc12 Amb2720075 [0,0,0,0,0,0|2,1,0]=3 11 B11R2.1 Brc1csc2cccnc12 Amb10070411 [0,0,0,0,0,0|3,1,0]=4 12 B11R2.1 Brc1csc2ccncc12 Amb10070410 [0,0,0,0,0,0|3,1,0]=4 13 B11R2.1 Brc1csc2cnccc12 Amb10070409 [0,0,0,0,0,0|3,1,0]=4 14 B11R2.1 Brc1csc2ncccc12 Amb10070408 [0,0,0,0,0,0|3,1,0]=4 15 B11R2.1 Brc1ncc2ccccn12 Amb21926789 [0,0,0,0,0,0|3,0,0]=3 16 B11R2.1 Brc1ncc2cccnn12 Amb18811239 [0,0,0,0,0,0|4,0,0]=4 17 B11R2.1 Brc1ncc2cnccn12 Amb27243098 [0,0,0,0,0,0|4,0,0]=4 18 B11R2.1 Brc1ncn2ccccc12 Amb20669228 [0,0,0,0,0,0|3,0,0]=3 19 B11R2.1 Brc1nnc2ccccn12 Amb19517088 [0,0,0,0,0,0|3,0,0]=3 20 B11R2.1 Brc1nnc2cccnn12 Amb18187562 [0,0,0,0,0,0|4,0,0]=4 21 B11R2.1 Brc1nnc2ccncn12 Amb32721143 [0,0,0,0,0,0|4,0,0]=4 22 B11R2.1 Brc1nnc2cnccn12 Amb21963559 [0,0,0,0,0,0|4,0,0]=4 23 B11R2.1 Brc1nnc2ncccn12 Amb22585933 [0,0,0,0,0,0|4,0,0]=4 24 B11R2.1 Brc1noc2ccccc12 Amb18187786 [0,0,0,0,0,0|1,0,0]=1 25 B11R2.1 Brc1noc2cnccc12 Amb27229155 [0,0,0,0,0,0|2,0,0]=2 26 B11R2.1 Brc1noc2ncccc12 Amb2390009 [0,0,0,0,0,0|2,0,0]=2 27 B11R2.1 Brc1noc2nccnc12 Amb18187386 [0,0,0,0,0,0|3,0,0]=3 28 B11R2.1 Brc1noc2nncnc12 Amb18810386 [0,0,0,0,0,0|4,0,0]=4 29 B11R2.1 Brc1nsc2ccccc12 Amb18769624 [0,0,0,0,0,0|1,1,0]=2 30 B11R2.1 Brc1nsc2ccncc12 Amb23452758 [0,0,0,0,0,0|2,1,0]=3 31 B11R2.1 Brc1nsc2nccnc12 Amb19957743 [0,0,0,0,0,0|3,1,0]=4 32 B11R2.1 Brc1nsc2ncncc12 Amb18770634 [0,0,0,0,0,0|3,1,0]=4 33 B11R2.1 Brc1snc2ccccc12 Amb22496211 [0,0,0,0,0,0|3,0,0]=3 34 B11R2.1 Brn1nnc2ccccc21 Amb28050260 [0,0,0,0,0,0|3,0,0]=3 35 B11R2.1 C=C1CCc2ccccc21 Amb24458532 [0,0,0,0,0,0|3,0,0]=3 36 B11R2.1 C=C1CCc2cccnc21 Amb28289851 [0,0,0,0,0,0|4,0,0]=4 37 B11R2.1 C=C1CNc2ccccc21 Amb27203251 [0,0,0,0,0,0|3,0,0]=3 38 B11R2.1 CC1=CCc2ccccc21 Amb17778909 [0,0,0,0,0,0|3,0,0]=3 39 B11R2.1 CC1=CCc2cccnc21 Amb27838911 [0,0,0,0,0,0|4,0,0]=4 40 B11R2.1 CC1C=Cc2ccccc21 Amb17844052 [0,0,0,0,0,0|3,0,1]=4 41 B11R2.1 CC1CCc2ccccc21 Amb28050187 [0,0,0,0,0,0|3,0,1]=4 42 B11R2.1 CC1CNc2ccccc21 Amb20241016 [0,0,0,0,0,0|3,0,1]=4 43 B11R2.1 CC1CNc2ccccc21 Amb9197981 [0,0,0,0,0,0|3,0,1]=4 44 B11R2.1 CC1COc2ccccc21 Amb27617216 [0,0,0,0,0,0|2,0,1]=3 45 B11R2.1 CC1NCc2ccccc21 Amb20623497 [0,0,0,0,0,0|2,0,2]=4 46 B11R2.1 CC1NCc2ccccc21 Amb32751285 [0,0,0,0,0,0|2,0,2]=4 47 B11R2.1 CC1OCc2ccccc21 Amb25913589 [0,0,0,0,0,0|3,0,1]=4 48 B11R2.1 CN1CCc2ccccc21 Amb15691717 [0,0,0,0,0,0|4,0,0]=4 49 B11R2.1 C[C@@H]1NCc2ccccc21 Amb25353679 [0,0,0,0,0,0|2,0,2]=4 50 B11R2.1 C[C@@H]1NCc2ccccc21 Amb32668091 [0,0,0,0,0,0|2,0,2]=4 51 B11R2.1 C[C@H]1CNc2ccccc21 Amb27222357 [0,0,0,0,0,0|3,0,1]=4 52 B11R2.1 C[C@H]1NCc2ccccc21 Amb28206726 [0,0,0,0,0,0|2,0,2]=4 53 B11R2.1 C[C@H]1NCc2ccccc21 Amb32667894 [0,0,0,0,0,0|2,0,2]=4 54 B11R2.1 C[n+]1coc2ccccc21 Amb27961147 [0,0,0,0,0,0|3,0,0]=3 55 B11R2.1 Cc1ccc2ccccn12 Amb28126713 [0,0,0,0,0,0|4,0,0]=4 56 B11R2.1 Cc1cnc2ccccn12 Amb21960684 [0,0,0,0,0,0|4,0,0]=4 57 B11R2.1 Cc1coc2ccccc12 Amb2684177 [0,0,0,0,0,0|2,0,0]=2 58 B11R2.1 Cc1csc2ccccc12 Amb2689330 [0,0,0,0,0,0|2,1,0]=3 59 B11R2.1 Cc1ncc2ccccn12 Amb1153642 [0,0,0,0,0,0|3,0,0]=3 60 B11R2.1 Cc1ncn2ccccc12 Amb10070139 [0,0,0,0,0,0|3,0,0]=3 61 B11R2.1 Cc1nnc2ccccn12 Amb21962429 [0,0,0,0,0,0|3,0,0]=3 62 B11R2.1 Cc1nnc2ccccn12 Amb22276084 [0,0,0,0,0,0|3,0,0]=3 63 B11R2.1 Cc1nnc2cccnn12 Amb25187294 [0,0,0,0,0,0|4,0,0]=4 64 B11R2.1 Cc1nnc2cnccn12 Amb22497634 [0,0,0,0,0,0|4,0,0]=4 65 B11R2.1 Cc1noc2ccccc12 Amb445022 [0,0,0,0,0,0|1,0,0]=1 66 B11R2.1 Cc1noc2cccnc12 Amb28385491 [0,0,0,0,0,0|2,0,0]=2 67 B11R2.1 Cc1noc2ccncc12 Amb25760745 [0,0,0,0,0,0|2,0,0]=2 68 B11R2.1 Cc1noc2cnccc12 Amb22741026 [0,0,0,0,0,0|2,0,0]=2 69 B11R2.1 Cc1nsc2ccccc12 Amb26599921 [0,0,0,0,0,0|1,1,0]=2 70 B11R2.1 Cc1nsc2ncccc12 Amb22494028 [0,0,0,0,0,0|2,1,0]=3 71 B11R2.1 Cc1onc2ccccc12 Amb4120114 [0,0,0,0,0,0|3,0,0]=3 72 B11R2.1 ClC1=NN=C2C=CC=CC12 Amb2389874 [0,0,0,0,0,0|2,0,1]=3 73 B11R2.1 ClC1CCc2ccccc21 Amb8630739 [0,0,0,0,0,0|3,0,1]=4 74 B11R2.1 ClC1COc2ccccc21 Amb27233528 [0,0,0,0,0,0|2,0,1]=3 75 B11R2.1 Clc1ccc2ccccn12 Amb27618437 [0,0,0,0,0,0|4,0,0]=4 76 B11R2.1 Clc1cnn2ccccc12 Amb22899794 [0,0,0,0,0,0|4,0,0]=4 77 B11R2.1 Clc1coc2ccccc12 Amb21963868 [0,0,0,0,0,0|2,0,0]=2 78 B11R2.1 Clc1csc2ccccc12 Amb5494165 [0,0,0,0,0,0|2,1,0]=3 79 B11R2.1 Clc1csc2cccnc12 Amb25721818 [0,0,0,0,0,0|3,1,0]=4 80 B11R2.1 Clc1ncc2cnccn12 Amb28049365 [0,0,0,0,0,0|4,0,0]=4 81 B11R2.1 Clc1nnc2ccccn12 Amb5751343 [0,0,0,0,0,0|3,0,0]=3 82 B11R2.1 Clc1nnc2cccnn12 Amb2421403 [0,0,0,0,0,0|4,0,0]=4 83 B11R2.1 Clc1nnc2ccncn12 Amb32721131 [0,0,0,0,0,0|4,0,0]=4 84 B11R2.1 Clc1nnc2cnccn12 Amb23400181 [0,0,0,0,0,0|4,0,0]=4 85 B11R2.1 Clc1nnc2ncccn12 Amb27199261 [0,0,0,0,0,0|4,0,0]=4 86 B11R2.1 Clc1noc2ccccc12 Amb2724801 [0,0,0,0,0,0|1,0,0]=1 87 B11R2.1 Clc1noc2cccnc12 Amb25194814 [0,0,0,0,0,0|2,0,0]=2 88 B11R2.1 Clc1noc2ncccc12 Amb2389843 [0,0,0,0,0,0|2,0,0]=2 89 B11R2.1 Clc1nsc2ccccc12 Amb1105427 [0,0,0,0,0,0|1,1,0]=2 90 B11R2.1 Clc1nsc2cccnc12 Amb35789699 [0,0,0,0,0,0|2,1,0]=3 91 B11R2.1 Clc1nsc2cnccc12 Amb35789173 [0,0,0,0,0,0|2,1,0]=3 92 B11R2.1 Clc1nsc2ncccc12 Amb24099964 [0,0,0,0,0,0|2,1,0]=3 93 B11R2.1 Clc1snc2ccccc12 Amb13952486 [0,0,0,0,0,0|3,0,0]=3 94 B11R2.1 Clc1snc2ncccc12 Amb23401170 [0,0,0,0,0,0|4,0,0]=4 95 B11R2.1 Cln1ccc2ccccc21 Amb28050191 [0,0,0,0,0,0|4,0,0]=4 96 B11R2.1 Cln1cnc2ccccc21 Amb24351571 [0,0,0,0,0,0|4,0,0]=4 97 B11R2.1 Cln1nnc2ccccc21 Amb10067847 [0,0,0,0,0,0|3,0,0]=3 98 B11R2.1 Cn1ccc2ccccc21 Amb6297777 [0,0,0,0,0,0|4,0,0]=4 99 B11R2.1 Cn1cnc2ccccc21 Amb6364694 [0,0,0,0,0,0|4,0,0]=4 100 B11R2.1 Cn1ncc2ccccc21 Amb4009871 [0,0,0,0,0,0|3,0,0]=3 101 B11R2.1 Cn1ncc2cccnc21 Amb2390015 [0,0,0,0,0,0|4,0,0]=4 102 B11R2.1 Cn1ncc2cnccc21 Amb27482157 [0,0,0,0,0,0|4,0,0]=4 103 B11R2.1 Cn1ncc2ncccc21 Amb20248089 [0,0,0,0,0,0|4,0,0]=4 104 B11R2.1 Cn1nnc2ccccc21 Amb4009873 [0,0,0,0,0,0|3,0,0]=3 105 B11R2.1 Cn1nnc2cnccc21 Amb6363643 [0,0,0,0,0,0|4,0,0]=4 106 B11R2.1 FC1NCc2ccccc21 Amb28197417 [0,0,0,0,0,0|2,0,2]=4 107 B11R2.1 Fc1csc2ccccc12 Amb27667159 [0,0,0,0,0,0|2,1,0]=3 108 B11R2.1 Fc1noc2ccccc12 Amb35642438 [0,0,0,0,0,0|1,0,0]=1 109 B11R2.1 Fc1snc2ccccc12 Amb30034029 [0,0,0,0,0,0|3,0,0]=3 110 B11R2.1 IC1N=Nc2ccccc21 Amb26516914 [0,0,0,0,0,0|2,0,1]=3 111 B11R2.1 Ic1cnc2ccccn12 Amb8467865 [0,0,0,0,0,0|4,0,0]=4 112 B11R2.1 Ic1cnn2ccccc12 Amb22585935 [0,0,0,0,0,0|4,0,0]=4 113 B11R2.1 Ic1coc2ccccc12 Amb24622374 [0,0,0,0,0,0|2,0,0]=2 114 B11R2.1 Ic1csc2ccccc12 Amb22002561 [0,0,0,0,0,0|2,1,0]=3 115 B11R2.1 Ic1csc2cccnc12 Amb27613200 [0,0,0,0,0,0|3,1,0]=4 116 B11R2.1 Ic1ncc2ccccn12 Amb25204219 [0,0,0,0,0,0|3,0,0]=3 117 B11R2.1 Ic1ncn2ccccc12 Amb24481085 [0,0,0,0,0,0|3,0,0]=3 118 B11R2.1 Ic1nnn2ccccc12 Amb26568390 [0,0,0,0,0,0|3,0,0]=3 119 B11R2.1 Ic1snc2ccccc12 Amb27406455 [0,0,0,0,0,0|3,0,0]=3 120 B11R2.1 In1nnc2ccccc21 Amb28315637 [0,0,0,0,0,0|3,0,0]=3 121 B11R2.1 N=C1NCc2ccccc21 Amb7174277 [0,0,0,0,0,0|2,0,1]=3 122 B11R2.1 NC1=NCc2ccccc21 Amb534105 [0,0,0,0,0,0|2,0,0]=2 123 B11R2.1 NC1=NCc2ncccc21 Amb28397871 [0,0,0,0,0,0|3,0,0]=3 124 B11R2.1 NC1=NNC2C=CC=CN12 Amb23559154 [0,0,0,0,0,0|3,0,1]=4 125 B11R2.1 NC1C=Cc2ccccc21 Amb17470367 [0,0,0,0,0,0|3,0,1]=4 126 B11R2.1 NC1CCc2ccccc21 Amb1158023 [0,0,0,0,0,0|3,0,1]=4 127 B11R2.1 NC1CCc2ccccc21 Amb16233857 [0,0,0,0,0,0|3,0,1]=4 128 B11R2.1 NC1CCc2ccccc21 Amb24078253 [0,0,0,0,0,0|3,0,1]=4 129 B11R2.1 NC1CCc2ccccc21 Amb9677422 [0,0,0,0,0,0|3,0,1]=4 130 B11R2.1 NC1COc2ccccc21 Amb13951643 [0,0,0,0,0,0|2,0,1]=3 131 B11R2.1 NC1COc2ccccc21 Amb2383232 [0,0,0,0,0,0|2,0,1]=3 132 B11R2.1 NC1COc2cccnc21 Amb27628441 [0,0,0,0,0,0|3,0,1]=4 133 B11R2.1 NC1COc2ccncc21 Amb27839161 [0,0,0,0,0,0|3,0,1]=4 134 B11R2.1 NC1COc2cnccc21 Amb27251376 [0,0,0,0,0,0|3,0,1]=4 135 B11R2.1 NC1COc2ncccc21 Amb25324317 [0,0,0,0,0,0|3,0,1]=4 136 B11R2.1 NC1CSc2ccccc21 Amb33531788 [0,0,0,0,0,0|2,1,1]=4 137 B11R2.1 NC1N=Nc2cccnc21 Amb24062018 [0,0,0,0,0,0|3,0,1]=4 138 B11R2.1 NN1CCc2ccccc21 Amb2691266 [0,0,0,0,0,0|4,0,0]=4 139 B11R2.1 NN1CCc2ccccc21 Amb836793 [0,0,0,0,0,0|4,0,0]=4 140 B11R2.1 N[C@@H]1CCc2ccccc21 Amb16233854 [0,0,0,0,0,0|3,0,1]=4 141 B11R2.1 N[C@@H]1CCc2ccccc21 Amb3940189 [0,0,0,0,0,0|3,0,1]=4 142 B11R2.1 N[C@@H]1COc2ccccc21 Amb23440344 [0,0,0,0,0,0|2,0,1]=3 143 B11R2.1 N[C@@H]1COc2ccccc21 Amb24426876 [0,0,0,0,0,0|2,0,1]=3 144 B11R2.1 N[C@@H]1COc2ncccc21 Amb28411341 [0,0,0,0,0,0|3,0,1]=4 145 B11R2.1 N[C@@H]1CSc2ccccc21 Amb27192844 [0,0,0,0,0,0|2,1,1]=4 146 B11R2.1 N[C@H]1CCc2ccccc21 Amb20242239 [0,0,0,0,0,0|3,0,1]=4 147 B11R2.1 N[C@H]1CCc2ccccc21 Amb3940190 [0,0,0,0,0,0|3,0,1]=4 148 B11R2.1 N[C@H]1COc2ccccc21 Amb25147252 [0,0,0,0,0,0|2,0,1]=3 149 B11R2.1 N[C@H]1COc2ccccc21 Amb33813746 [0,0,0,0,0,0|2,0,1]=3 150 B11R2.1 N[C@H]1COc2ccccc21 Amb33872471 [0,0,0,0,0,0|2,0,1]=3 151 B11R2.1 N[C@H]1CSc2ccccc21 Amb27487071 [0,0,0,0,0,0|2,1,1]=4 152 B11R2.1 Nc1ccc2ccccn12 Amb18061678 [0,0,0,0,0,0|4,0,0]=4 153 B11R2.1 Nc1ccn2ccccc12 Amb28119363 [0,0,0,0,0,0|4,0,0]=4 154 B11R2.1 Nc1cnc2ccccn12 Amb22276158 [0,0,0,0,0,0|4,0,0]=4 155 B11R2.1 Nc1cnc2ccccn12 Amb33544829 [0,0,0,0,0,0|4,0,0]=4 156 B11R2.1 Nc1cnn2ccccc12 Amb18203165 [0,0,0,0,0,0|4,0,0]=4 157 B11R2.1 Nc1cnn2ccccc12 Amb21964646 [0,0,0,0,0,0|4,0,0]=4 158 B11R2.1 Nc1cnn2ccccc12 Amb22755063 [0,0,0,0,0,0|4,0,0]=4 159 B11R2.1 Nc1coc2ccccc12 Amb24371464 [0,0,0,0,0,0|2,0,0]=2 160 B11R2.1 Nc1coc2cccnc12 Amb24742644 [0,0,0,0,0,0|3,0,0]=3 161 B11R2.1 Nc1coc2ccncc12 Amb27813427 [0,0,0,0,0,0|3,0,0]=3 162 B11R2.1 Nc1coc2cnccc12 Amb27633514 [0,0,0,0,0,0|3,0,0]=3 163 B11R2.1 Nc1coc2ncccc12 Amb18522246 [0,0,0,0,0,0|3,0,0]=3 164 B11R2.1 Nc1coc2ncncc12 Amb18680554 [0,0,0,0,0,0|4,0,0]=4 165 B11R2.1 Nc1csc2ccccc12 Amb13890519 [0,0,0,0,0,0|2,1,0]=3 166 B11R2.1 Nc1csc2ccccc12 Amb19957699 [0,0,0,0,0,0|2,1,0]=3 167 B11R2.1 Nc1csc2cccnc12 Amb10070407 [0,0,0,0,0,0|3,1,0]=4 168 B11R2.1 Nc1csc2ccncc12 Amb10070406 [0,0,0,0,0,0|3,1,0]=4 169 B11R2.1 Nc1csc2cnccc12 Amb10067625 [0,0,0,0,0,0|3,1,0]=4 170 B11R2.1 Nc1csc2ncccc12 Amb10070405 [0,0,0,0,0,0|3,1,0]=4 171 B11R2.1 Nc1ncc2ccccn12 Amb22740154 [0,0,0,0,0,0|3,0,0]=3 172 B11R2.1 Nc1ncn2ccccc12 Amb23560066 [0,0,0,0,0,0|3,0,0]=3 173 B11R2.1 Nc1ncn2ccncc12 Amb24480819 [0,0,0,0,0,0|4,0,0]=4 174 B11R2.1 Nc1nnc2ccccn12 Amb19891300 [0,0,0,0,0,0|3,0,0]=3 175 B11R2.1 Nc1nnc2ccccn12 Amb6316209 [0,0,0,0,0,0|3,0,0]=3 176 B11R2.1 Nc1nnc2cccnn12 Amb18203115 [0,0,0,0,0,0|4,0,0]=4 177 B11R2.1 Nc1nnc2cnccn12 Amb23401334 [0,0,0,0,0,0|4,0,0]=4 178 B11R2.1 Nc1nnc2ncccn12 Amb25147444 [0,0,0,0,0,0|4,0,0]=4 179 B11R2.1 Nc1nnn2cnccc12 Amb18203113 [0,0,0,0,0,0|4,0,0]=4 180 B11R2.1 Nc1noc2ccccc12 Amb1323334 [0,0,0,0,0,0|1,0,0]=1 181 B11R2.1 Nc1noc2cccnc12 Amb18124445 [0,0,0,0,0,0|2,0,0]=2 182 B11R2.1 Nc1noc2ccncc12 Amb18203127 [0,0,0,0,0,0|2,0,0]=2 183 B11R2.1 Nc1noc2cnccc12 Amb18642986 [0,0,0,0,0,0|2,0,0]=2 184 B11R2.1 Nc1noc2ncccc12 Amb3593292 [0,0,0,0,0,0|2,0,0]=2 185 B11R2.1 Nc1noc2nccnc12 Amb18643047 [0,0,0,0,0,0|3,0,0]=3 186 B11R2.1 Nc1noc2nnccc12 Amb23402299 [0,0,0,0,0,0|3,0,0]=3 187 B11R2.1 Nc1noc2nncnc12 Amb18832410 [0,0,0,0,0,0|4,0,0]=4 188 B11R2.1 Nc1nsc2ccccc12 Amb1147286 [0,0,0,0,0,0|1,1,0]=2 189 B11R2.1 Nc1nsc2ccccc12 Amb32665266 [0,0,0,0,0,0|1,1,0]=2 190 B11R2.1 Nc1nsc2ccncc12 Amb18201622 [0,0,0,0,0,0|2,1,0]=3 191 B11R2.1 Nc1nsc2ncccc12 Amb18201396 [0,0,0,0,0,0|2,1,0]=3 192 B11R2.1 Nc1nsc2nccnc12 Amb18644508 [0,0,0,0,0,0|3,1,0]=4 193 B11R2.1 Nc1nsc2ncncc12 Amb18201386 [0,0,0,0,0,0|3,1,0]=4 194 B11R2.1 Nc1onc2ccccc12 Amb21857107 [0,0,0,0,0,0|3,0,0]=3 195 B11R2.1 Nc1onc2ccncc12 Amb28245657 [0,0,0,0,0,0|4,0,0]=4 196 B11R2.1 Nc1onc2cnccc12 Amb27186474 [0,0,0,0,0,0|4,0,0]=4 197 B11R2.1 Nc1snc2ccccc12 Amb33542957 [0,0,0,0,0,0|3,0,0]=3 198 B11R2.1 Nc1snc2cccnc12 Amb20670991 [0,0,0,0,0,0|4,0,0]=4 199 B11R2.1 Nc1snc2cnccc12 Amb23401171 [0,0,0,0,0,0|4,0,0]=4 200 B11R2.1 Nc1snc2ncccc12 Amb10975921 [0,0,0,0,0,0|4,0,0]=4 201 B11R2.1 Nn1ccc2ccccc21 Amb16233739 [0,0,0,0,0,0|4,0,0]=4 202 B11R2.1 Nn1cnc2ccccc21 Amb443894 [0,0,0,0,0,0|4,0,0]=4 203 B11R2.1 Nn1ncc2ccccc21 Amb8630394 [0,0,0,0,0,0|3,0,0]=3 204 B11R2.1 Nn1ncc2ccncc21 Amb27490127 [0,0,0,0,0,0|4,0,0]=4 205 B11R2.1 O=C1C=Cc2ccccc21 Amb10603436 [0,0,0,0,0,0|2,0,1]=3 206 B11R2.1 O=C1CCc2ccccc21 Amb6458950 [0,0,0,0,0,0|2,0,1]=3 207 B11R2.1 O=C1CCc2cccnc21 Amb10602809 [0,0,0,0,0,0|3,0,1]=4 208 B11R2.1 O=C1CCc2ccncc21 Amb22491415 [0,0,0,0,0,0|3,0,1]=4 209 B11R2.1 O=C1CCc2ccncc21 Amb5719663 [0,0,0,0,0,0|3,0,1]=4 210 B11R2.1 O=C1CCc2cnccc21 Amb22235532 [0,0,0,0,0,0|3,0,1]=4 211 B11R2.1 O=C1CCc2cnccc21 Amb5719882 [0,0,0,0,0,0|3,0,1]=4 212 B11R2.1 O=C1CCc2ncccc21 Amb22275948 [0,0,0,0,0,0|3,0,1]=4 213 B11R2.1 O=C1CCc2ncccc21 Amb2695094 [0,0,0,0,0,0|3,0,1]=4 214 B11R2.1 O=C1CN=C2NC=CC=C12 Amb22491902 [0,0,0,0,0,0|3,0,1]=4 215 B11R2.1 O=C1CNc2cccc[n+]21 Amb32664845 [0,0,0,0,0,0|3,0,1]=4 216 B11R2.1 O=C1CNc2ccccc21 Amb17593399 [0,0,0,0,0,0|2,0,1]=3 217 B11R2.1 O=C1COc2ccccc21 Amb33534383 [0,0,0,0,0,0|1,0,1]=2 218 B11R2.1 O=C1COc2cccnc21 Amb22372216 [0,0,0,0,0,0|2,0,1]=3 219 B11R2.1 O=C1COc2cnccc21 Amb20242099 [0,0,0,0,0,0|2,0,1]=3 220 B11R2.1 O=C1COc2cnccc21 Amb22728783 [0,0,0,0,0,0|2,0,1]=3 221 B11R2.1 O=C1COc2ncccc21 Amb20242022 [0,0,0,0,0,0|2,0,1]=3 222 B11R2.1 O=C1CSc2ccccc21 Amb4062421 [0,0,0,0,0,0|1,1,1]=3 223 B11R2.1 O=C1CSc2cnccc21 Amb27265724 [0,0,0,0,0,0|2,1,1]=4 224 B11R2.1 O=C1CSc2ncccc21 Amb27153117 [0,0,0,0,0,0|2,1,1]=4 225 B11R2.1 O=C1N=Cc2ccccc21 Amb25265062 [0,0,0,0,0,0|1,0,1]=2 226 B11R2.1 O=C1N=Cc2ccncc21 Amb28252569 [0,0,0,0,0,0|2,0,1]=3 227 B11R2.1 O=C1N=NC2=CC=CCN12 Amb26849349 [0,0,0,0,0,0|2,0,2]=4 228 B11R2.1 O=C1N=Nc2ccncc21 Amb28399448 [0,0,0,0,0,0|2,0,1]=3 229 B11R2.1 O=C1NC=C2C=CC=CN12 Amb26008108 [0,0,0,0,0,0|2,0,2]=4 230 B11R2.1 O=C1NCc2ccccc21 Amb773532 [0,0,0,0,0,0|1,0,2]=3 231 B11R2.1 O=C1NCc2cccnc21 Amb22276754 [0,0,0,0,0,0|2,0,2]=4 232 B11R2.1 O=C1NCc2ccncc21 Amb22388464 [0,0,0,0,0,0|2,0,2]=4 233 B11R2.1 O=C1NCc2ccncc21 Amb32675690 [0,0,0,0,0,0|2,0,2]=4 234 B11R2.1 O=C1NCc2cnccc21 Amb23455305 [0,0,0,0,0,0|2,0,2]=4 235 B11R2.1 O=C1NCc2ncccc21 Amb33530547 [0,0,0,0,0,0|2,0,2]=4 236 B11R2.1 O=C1NN=C2C=CC=CN12 Amb18012675 [0,0,0,0,0,0|2,0,2]=4 237 B11R2.1 O=C1NNc2ccccc21 Amb19514505 [0,0,0,0,0,0|1,0,2]=3 238 B11R2.1 O=C1NNc2cccnc21 Amb21857168 [0,0,0,0,0,0|2,0,2]=4 239 B11R2.1 O=C1NNc2cnccc21 Amb21857177 [0,0,0,0,0,0|2,0,2]=4 240 B11R2.1 O=C1NNc2ncccc21 Amb33528585 [0,0,0,0,0,0|2,0,2]=4 241 B11R2.1 O=C1NOc2cnccc21 Amb22494128 [0,0,0,0,0,0|1,0,2]=3 242 B11R2.1 O=C1NSc2ccccc21 Amb17933279 [0,0,0,0,0,0|0,1,2]=3 243 B11R2.1 O=C1OCc2ccccc21 Amb2610613 [0,0,0,0,0,0|2,0,1]=3 244 B11R2.1 O=C1OCc2cccnc21 Amb24081817 [0,0,0,0,0,0|3,0,1]=4 245 B11R2.1 O=C1OCc2ccncc21 Amb22732365 [0,0,0,0,0,0|3,0,1]=4 246 B11R2.1 O=C1OCc2ncccc21 Amb2612059 [0,0,0,0,0,0|3,0,1]=4 247 B11R2.1 O=C1ONc2ccccc21 Amb26994489 [0,0,0,0,0,0|2,0,1]=3 248 B11R2.1 O=C1SCc2ccccc21 Amb2421358 [0,0,0,0,0,0|2,0,1]=3 249 B11R2.1 O=C1SNc2ccccc21 Amb19416440 [0,0,0,0,0,0|2,0,1]=3 250 B11R2.1 O=c1nsc2ncccc12 Amb2759329 [0,0,0,0,0,0|1,1,2]=4 251 B11R2.1 O=s1ccc2ccccc21 Amb24078341 [0,0,0,0,0,0|3,0,1]=4 252 B11R2.1 OB1OCc2ccccc21 Amb1027843 [0,0,0,0,0,0|3,0,0]=3 253 B11R2.1 OB1OCc2ccncc21 Amb26317440 [0,0,0,0,0,0|4,0,0]=4 254 B11R2.1 OC1=NN=C2CCCC=C12 Amb28422737 [0,0,0,0,0,0|1,0,3]=4 255 B11R2.1 OC1C=Cc2ccccc21 Amb24479258 [0,0,0,0,0,0|2,0,1]=3 256 B11R2.1 OC1CCc2ccccc21 Amb9703194 [0,0,0,0,0,0|2,0,1]=3 257 B11R2.1 OC1CCc2cccnc21 Amb19958431 [0,0,0,0,0,0|3,0,1]=4 258 B11R2.1 OC1CCc2ncccc21 Amb16231393 [0,0,0,0,0,0|3,0,1]=4 259 B11R2.1 OC1COc2ccccc21 Amb33548779 [0,0,0,0,0,0|1,0,1]=2 260 B11R2.1 OC1COc2ccncc21 Amb27598583 [0,0,0,0,0,0|2,0,1]=3 261 B11R2.1 OC1CSc2ccccc21 Amb27174921 [0,0,0,0,0,0|1,1,1]=3 262 B11R2.1 OC1N=Cc2ccccc21 Amb27631731 [0,0,0,0,0,0|1,0,1]=2 263 B11R2.1 OC1OCc2ccccc21 Amb21858794 [0,0,0,0,0,0|2,0,1]=3 264 B11R2.1 OC1OCc2ncccc21 Amb27853463 [0,0,0,0,0,0|3,0,1]=4 265 B11R2.1 ON1NNc2cccnc21 Amb27242890 [0,0,0,0,0,0|3,0,1]=4 266 B11R2.1 O[C@@H]1CCc2ccccc21 Amb13953023 [0,0,0,0,0,0|2,0,1]=3 267 B11R2.1 O[C@@H]1CCc2cnccc21 Amb33715207 [0,0,0,0,0,0|3,0,1]=4 268 B11R2.1 O[C@@H]1CCc2ncccc21 Amb24511690 [0,0,0,0,0,0|3,0,1]=4 269 B11R2.1 O[C@@H]1COc2ccccc21 Amb27191568 [0,0,0,0,0,0|1,0,1]=2 270 B11R2.1 O[C@@H]1CSc2ccccc21 Amb28315859 [0,0,0,0,0,0|1,1,1]=3 271 B11R2.1 O[C@H]1CCc2ccccc21 Amb13953022 [0,0,0,0,0,0|2,0,1]=3 272 B11R2.1 O[C@H]1CCc2cccnc21 Amb26350485 [0,0,0,0,0,0|3,0,1]=4 273 B11R2.1 O[C@H]1CCc2ncccc21 Amb26530510 [0,0,0,0,0,0|3,0,1]=4 274 B11R2.1 O[C@H]1COc2ccccc21 Amb27946875 [0,0,0,0,0,0|1,0,1]=2 275 B11R2.1 Oc1ccc2cnccn12 Amb28201971 [0,0,0,0,0,0|4,0,0]=4 276 B11R2.1 Oc1cnc2ccccn12 Amb24074110 [0,0,0,0,0,0|3,0,0]=3 277 B11R2.1 Oc1cnc2cnccn12 Amb24081829 [0,0,0,0,0,0|4,0,0]=4 278 B11R2.1 Oc1cnn2ccccc12 Amb25359066 [0,0,0,0,0,0|3,0,0]=3 279 B11R2.1 Oc1coc2ccccc12 Amb24097480 [0,0,0,0,0,0|1,0,0]=1 280 B11R2.1 Oc1coc2cccnc12 Amb21963453 [0,0,0,0,0,0|2,0,0]=2 281 B11R2.1 Oc1coc2cccnc12 Amb33996728 [0,0,0,0,0,0|2,0,0]=2 282 B11R2.1 Oc1csc2ccccc12 Amb4009443 [0,0,0,0,0,0|1,1,0]=2 283 B11R2.1 Oc1csc2cnccc12 Amb32669775 [0,0,0,0,0,0|2,1,0]=3 284 B11R2.1 Oc1csc2ncccc12 Amb26464103 [0,0,0,0,0,0|2,1,0]=3 285 B11R2.1 Oc1nnc2ccccn12 Amb2389927 [0,0,0,0,0,0|2,0,0]=2 286 B11R2.1 Oc1noc2c1CCCC2 Amb22755865 [0,0,0,0,0,0|0,0,4]=4 287 B11R2.1 Oc1noc2c1CCOC2 Amb27230168 [0,0,0,0,0,0|1,0,3]=4 288 B11R2.1 Oc1noc2c1CNCC2 Amb18831940 [0,0,0,0,0,0|1,0,3]=4 289 B11R2.1 Oc1noc2c1CNCC2 Amb32667573 [0,0,0,0,0,0|1,0,3]=4 290 B11R2.1 Oc1noc2ccccc12 Amb2725155 [0,0,0,0,0,0|0,0,0]=0 291 B11R2.1 Oc1noc2ccncc12 Amb28458158 [0,0,0,0,0,0|1,0,0]=1 292 B11R2.1 Oc1noc2cnccc12 Amb10975477 [0,0,0,0,0,0|1,0,0]=1 293 B11R2.1 Oc1noc2ncccc12 Amb2611982 [0,0,0,0,0,0|1,0,0]=1 294 B11R2.1 Oc1noc2ncncc12 Amb33471808 [0,0,0,0,0,0|2,0,0]=2 295 B11R2.1 Oc1nsc2ccccc12 Amb22166851 [0,0,0,0,0,0|0,1,0]=1 296 B11R2.1 On1ccc2ccccc21 Amb27243885 [0,0,0,0,0,0|3,0,0]=3 297 B11R2.1 On1ccc2cccnc21 Amb25858298 [0,0,0,0,0,0|4,0,0]=4 298 B11R2.1 On1cnc2ccccc21 Amb28318444 [0,0,0,0,0,0|3,0,0]=3 299 B11R2.1 On1cnc2ncccc21 Amb22751042 [0,0,0,0,0,0|4,0,0]=4 300 B11R2.1 On1ncc2cccnc21 Amb27392629 [0,0,0,0,0,0|3,0,0]=3 301 B11R2.1 On1nnc2ccccc21 Amb1151367 [0,0,0,0,0,0|2,0,0]=2 302 B11R2.1 On1nnc2ccccc21 Amb2719788 [0,0,0,0,0,0|2,0,0]=2 303 B11R2.1 On1nnc2cccnc21 Amb4451248 [0,0,0,0,0,0|3,0,0]=3 304 B11R2.1 On1nnc2cnccc21 Amb27767995 [0,0,0,0,0,0|3,0,0]=3 305 B11R2.1 S=C1CNc2ccccc21 Amb27791107 [0,0,0,0,0,0|2,1,0]=3 306 B11R2.1 S=C1NC=C2C=CC=CN12 Amb18042920 [0,0,0,0,0,0|2,1,1]=4 307 B11R2.1 S=C1NN=C2C=CC=CN12 Amb19113815 [0,0,0,0,0,0|2,1,1]=4 308 B11R2.1 S=C1SSc2ncccc21 Amb19650658 [0,0,0,0,0,0|2,2,0]=4 309 B11R2.1 S=c1nnc2ccccc12 Amb24082861 [0,0,0,0,0,0|1,1,0]=2 310 B11R2.1 SC1CCc2ccccc21 Amb9208023 [0,0,0,0,0,0|2,1,1]=4 311 B11R2.1 SC1CSc2ccccc21 Amb32788664 [0,0,0,0,0,0|1,2,1]=4 312 B11R2.1 Sc1cnn2ccccc12 Amb33147196 [0,0,0,0,0,0|3,1,0]=4 313 B11R2.1 Sc1coc2ccccc12 Amb24061893 [0,0,0,0,0,0|1,1,0]=2 314 B11R2.1 Sc1csc2ccccc12 Amb24396652 [0,0,0,0,0,0|1,2,0]=3 315 B11R2.1 Sc1ncn2ccccc12 Amb23560018 [0,0,0,0,0,0|2,1,0]=3 316 B11R2.1 Sc1nnc2ccccn12 Amb1104122 [0,0,0,0,0,0|2,1,0]=3 317 B11R2.1 Sc1nnc2cccnn12 Amb25074024 [0,0,0,0,0,0|3,1,0]=4 318 B11R2.1 Sc1nnc2cnccn12 Amb23590633 [0,0,0,0,0,0|3,1,0]=4 319 B11R2.1 Sc1nnc2ncccn12 Amb2785111 [0,0,0,0,0,0|3,1,0]=4 320 B11R2.1 Sc1nsc2ccccc12 Amb1136898 [0,0,0,0,0,0|0,2,0]=2 321 B11R2.1 [N-]=[N+]1ONc2ccccc21 Amb21953654 [0,0,0,0,0,0|4,0,0]=4 322 B11R2.1 [NH3+]C1=NCc2ccccc21 Amb4239931 [0,0,0,0,0,0|2,0,0]=2 323 B11R2.1 [O-][n+]1csc2ccccc21 Amb27767988 [0,0,0,0,0,0|2,1,1]=4 324 B11R2.1 [O-][n+]1onc2ccccc21 Amb656681 [0,0,0,0,0,0|3,0,1]=4 325 B11R2.1 [O-]c1csc2cccc[n+]12 Amb24309273 [0,0,0,0,0,0|2,1,1]=4 326 B11R2.1 [O-]c1noc2ncccc12 Amb2611978 [0,0,0,0,0,0|1,0,1]=2 327 B10R2.7 C1=CC2=CCN=C2C=N1 Amb27423395 [1,0,0,0,0,0|3,0,0]=4 328 B10R2.7 C1=CC2=NCC=C2C=N1 Amb27423430 [1,0,0,0,0,0|3,0,0]=4 329 B10R2.7 C1=CNC2=CCSC2=C1 Amb28318140 [1,0,0,0,0,0|2,1,0]=4 330 B10R2.7 C1=Cc2ccccc2C1 Amb2383760 [1,0,0,0,0,0|2,0,0]=3 331 B10R2.7 C1=Cc2cnccc2C1 Amb27945600 [1,0,0,0,0,0|3,0,0]=4 332 B10R2.7 C1=NC=C2ON=CN2C1 Amb28255014 [1,0,0,0,0,0|2,0,1]=4 333 B10R2.7 C1=NCN2C=NOC2=C1 Amb27949192 [1,0,0,0,0,0|2,0,1]=4 334 B10R2.7 C1=NCc2cccnc21 Amb27250387 [1,0,0,0,0,0|2,0,0]=3 335 B10R2.7 [c+]1sc2ccccc2s1 Amb17760631 [1,0,0,0,0,0|2,1,0]=4 336 B10R2.7 b1oc2ccccc2o1 Amb22731069 [1,0,0,0,0,0|2,0,0]=3 337 B10R2.7 b1oc2cccnc2o1 Amb27848527 [1,0,0,0,0,0|3,0,0]=4 338 B10R2.7 c1cc2c(cn1)CCO2 Amb24101562 [1,0,0,0,0,0|2,0,1]=4 339 B10R2.7 c1cc2c(cn1)N=NC2 Amb28254527 [1,0,0,0,0,0|2,0,1]=4 340 B10R2.7 c1cc2ccoc2cn1 Amb10067356 [1,0,0,0,0,0|2,0,0]=3 341 B10R2.7 c1cc2ccsc2cn1 Amb10067355 [1,0,0,0,0,0|2,1,0]=4 342 B10R2.7 c1cc2ccsc2cn1 Amb24066968 [1,0,0,0,0,0|2,1,0]=4 343 B10R2.7 c1cc2cncn2cn1 Amb27240757 [1,0,0,0,0,0|3,0,0]=4 344 B10R2.7 c1cc2cnncc2o1 Amb23560299 [1,0,0,0,0,0|3,0,0]=4 345 B10R2.7 c1cc2nnsc2cn1 Amb24649760 [1,0,0,0,0,0|2,1,0]=4 346 B10R2.7 c1cc2occc2cn1 Amb19895064 [1,0,0,0,0,0|2,0,0]=3 347 B10R2.7 c1cc2ocnc2cn1 Amb24478645 [1,0,0,0,0,0|3,0,0]=4 348 B10R2.7 c1cc2oncc2cn1 Amb27764807 [1,0,0,0,0,0|1,0,0]=2 349 B10R2.7 c1cc2sccc2cn1 Amb32664779 [1,0,0,0,0,0|2,1,0]=4 350 B10R2.7 c1cc2sccc2cn1 Amb8383970 [1,0,0,0,0,0|2,1,0]=4 351 B10R2.7 c1cc2sncc2cn1 Amb27763388 [1,0,0,0,0,0|1,1,0]=3 352 B10R2.7 c1cc[n+]2c(c1)OCC2 Amb22364467 [1,0,0,0,0,0|2,0,1]=4 353 B10R2.7 c1ccc2[se]ccc2c1 Amb8515166 [1,0,0,0,0,0|1,1,0]=3 354 B10R2.7 c1ccc2c(c1)CCC2 Amb6608915 [1,0,0,0,0,0|2,0,1]=4 355 B10R2.7 c1ccc2c(c1)CCN2 Amb1869493 [1,0,0,0,0,0|2,0,1]=4 356 B10R2.7 c1ccc2c(c1)CCO2 Amb2687295 [1,0,0,0,0,0|1,0,1]=3 357 B10R2.7 c1ccc2c(c1)CNC2 Amb33527370 [1,0,0,0,0,0|1,0,2]=4 358 B10R2.7 c1ccc2c(c1)CNC2 Amb33544332 [1,0,0,0,0,0|1,0,2]=4 359 B10R2.7 c1ccc2c(c1)CNN2 Amb8386538 [1,0,0,0,0,0|1,0,2]=4 360 B10R2.7 c1ccc2c(c1)COC2 Amb2780010 [1,0,0,0,0,0|2,0,1]=4 361 B10R2.7 c1ccc2c(c1)CPC2 Amb27217940 [1,0,0,0,0,0|1,1,1]=4 362 B10R2.7 c1ccc2c(c1)CSC2 Amb21962922 [1,0,0,0,0,0|2,0,1]=4 363 B10R2.7 c1ccc2c(c1)N=S=N2 Amb17755407 [1,0,0,0,0,0|3,0,0]=4 364 B10R2.7 c1ccc2c(c1)N=[Se]=N2 Amb17683892 [1,0,0,0,0,0|3,0,0]=4 365 B10R2.7 c1ccc2c(c1)NCO2 Amb28050014 [1,0,0,0,0,0|2,0,0]=3 366 B10R2.7 c1ccc2c(c1)OCO2 Amb2684576 [1,0,0,0,0,0|2,0,0]=3 367 B10R2.7 c1ccc2c(c1)OSO2 Amb28050023 [1,0,0,0,0,0|2,0,0]=3 368 B10R2.7 c1ccc2c(c1)SCS2 Amb26548649 [1,0,0,0,0,0|2,1,0]=4 369 B10R2.7 c1ccc2cscc2c1 Amb24066379 [1,0,0,0,0,0|2,0,0]=3 370 B10R2.7 c1ccc2n[se]nc2c1 Amb534261 [1,0,0,0,0,0|3,0,0]=4 371 B10R2.7 c1ccc2nonc2c1 Amb2724589 [1,0,0,0,0,0|3,0,0]=4 372 B10R2.7 c1ccc2nscc2c1 Amb25336989 [1,0,0,0,0,0|2,0,0]=3 373 B10R2.7 c1ccc2nsnc2c1 Amb1395747 [1,0,0,0,0,0|3,0,0]=4 374 B10R2.7 c1ccc2occc2c1 Amb2725466 [1,0,0,0,0,0|1,0,0]=2 375 B10R2.7 c1ccc2ocnc2c1 Amb6608831 [1,0,0,0,0,0|2,0,0]=3 376 B10R2.7 c1ccc2oncc2c1 Amb1233398 [1,0,0,0,0,0|0,0,0]=1 377 B10R2.7 c1ccc2sccc2c1 Amb2782006 [1,0,0,0,0,0|1,1,0]=3 378 B10R2.7 c1ccc2scnc2c1 Amb2609954 [1,0,0,0,0,0|2,1,0]=4 379 B10R2.7 c1ccc2snnc2c1 Amb2612181 [1,0,0,0,0,0|1,1,0]=3 380 B10R2.7 c1ccn2cccc2c1 Amb10605601 [1,0,0,0,0,0|3,0,0]=4 381 B10R2.7 c1ccn2ccnc2c1 Amb2235938 [1,0,0,0,0,0|3,0,0]=4 382 B10R2.7 c1ccn2ccnc2c1 Amb8629968 [1,0,0,0,0,0|3,0,0]=4 383 B10R2.7 c1ccn2cncc2c1 Amb10070943 [1,0,0,0,0,0|2,0,0]=3 384 B10R2.7 c1ccn2cnnc2c1 Amb17597649 [1,0,0,0,0,0|2,0,0]=3 385 B10R2.7 c1ccn2cnnc2c1 Amb22042412 [1,0,0,0,0,0|2,0,0]=3 386 B10R2.7 c1ccn2nccc2c1 Amb10604230 [1,0,0,0,0,0|3,0,0]=4 387 B10R2.7 c1ccn2nncc2c1 Amb4011283 [1,0,0,0,0,0|2,0,0]=3 388 B10R2.7 c1ccn2nnnc2c1 Amb2792704 [1,0,0,0,0,0|3,0,0]=4 389 B10R2.7 c1cn2cncc2cn1 Amb8629882 [1,0,0,0,0,0|3,0,0]=4 390 B10R2.7 c1cn2cnnc2cn1 Amb22049756 [1,0,0,0,0,0|3,0,0]=4 391 B10R2.7 c1cnc2c(c1)CCO2 Amb25337454 [1,0,0,0,0,0|2,0,1]=4 392 B10R2.7 c1cnc2c(c1)OCC2 Amb23455396 [1,0,0,0,0,0|2,0,1]=4 393 B10R2.7 c1cnc2cc[se]c2c1 Amb2611539 [1,0,0,0,0,0|2,1,0]=4 394 B10R2.7 c1cnc2ccoc2c1 Amb16185654 [1,0,0,0,0,0|2,0,0]=3 395 B10R2.7 c1cnc2ccoc2c1 Amb30585174 [1,0,0,0,0,0|2,0,0]=3 396 B10R2.7 c1cnc2ccsc2c1 Amb10070404 [1,0,0,0,0,0|2,1,0]=4 397 B10R2.7 c1cnc2cncn2c1 Amb24098139 [1,0,0,0,0,0|3,0,0]=4 398 B10R2.7 c1cnc2cnsc2c1 Amb27185797 [1,0,0,0,0,0|1,1,0]=3 399 B10R2.7 c1cnc2conc2c1 Amb26001309 [1,0,0,0,0,0|3,0,0]=4 400 B10R2.7 c1cnc2cscc2c1 Amb27955126 [1,0,0,0,0,0|3,0,0]=4 401 B10R2.7 c1cnc2ncoc2c1 Amb17194206 [1,0,0,0,0,0|3,0,0]=4 402 B10R2.7 c1cnc2nncn2c1 Amb24472738 [1,0,0,0,0,0|3,0,0]=4 403 B10R2.7 c1cnc2occc2c1 Amb21963452 [1,0,0,0,0,0|2,0,0]=3 404 B10R2.7 c1cnc2ocnc2c1 Amb18100438 [1,0,0,0,0,0|3,0,0]=4 405 B10R2.7 c1cnc2oncc2c1 Amb27954714 [1,0,0,0,0,0|1,0,0]=2 406 B10R2.7 c1cnc2sccc2c1 Amb10070403 [1,0,0,0,0,0|2,1,0]=4 407 B10R2.7 c1cnc2sncc2n1 Amb27750213 [1,0,0,0,0,0|2,1,0]=4 408 B10R2.7 c1cnn2cncc2c1 Amb25921156 [1,0,0,0,0,0|3,0,0]=4 409 B10R2.7 c1ncc2cnoc2n1 Amb24546053 [1,0,0,0,0,0|2,0,0]=3 410 B10R2.7 c1ncc2nnoc2n1 Amb27434455 [1,0,0,0,0,0|3,0,0]=4 411 B12R2.1 BrCC1COc2ccccc21 Amb25063018 [0,1,0,0,0,0|2,0,1]=4 412 B12R2.1 BrCc1coc2ccccc12 Amb23401826 [0,1,0,0,0,0|2,0,0]=3 413 B12R2.1 BrCc1csc2ccccc12 Amb10609548 [0,1,0,0,0,0|2,1,0]=4 414 B12R2.1 BrCc1ncc2ccccn12 Amb23559978 [0,1,0,0,0,0|3,0,0]=4 415 B12R2.1 BrCc1noc2ccccc12 Amb8390314 [0,1,0,0,0,0|1,0,0]=2 416 B12R2.1 BrCc1noc2ncccc12 Amb20241865 [0,1,0,0,0,0|2,0,0]=3 417 B12R2.1 BrCc1nsc2ccccc12 Amb26026453 [0,1,0,0,0,0|1,1,0]=3 418 B12R2.1 BrCc1onc2ccccc12 Amb28182496 [0,1,0,0,0,0|3,0,0]=4 419 B12R2.1 C#CC1=CCc2ccccc21 Amb25921455 [0,1,0,0,0,0|3,0,0]=4 420 B12R2.1 C#Cc1coc2ccccc12 Amb27468515 [0,1,0,0,0,0|2,0,0]=3 421 B12R2.1 C=Cc1csc2ccccc12 Amb27409855 [0,1,0,0,0,0|2,1,0]=4 422 B12R2.1 C=Cc1onc2ccccc12 Amb27208307 [0,1,0,0,0,0|3,0,0]=4 423 B12R2.1 C=Cn1nnc2ccccc21 Amb10559409 [0,1,0,0,0,0|3,0,0]=4 424 B12R2.1 CCC1=CCc2ccccc21 Amb27227340 [0,1,0,0,0,0|3,0,0]=4 425 B12R2.1 CCc1coc2ccccc12 Amb27792683 [0,1,0,0,0,0|2,0,0]=3 426 B12R2.1 CCc1ncc2ccccn12 Amb2852264 [0,1,0,0,0,0|3,0,0]=4 427 B12R2.1 CNc1coc2ccccc12 Amb26039834 [0,1,0,0,0,0|2,0,0]=3 428 B12R2.1 CNc1csc2ccccc12 Amb23403655 [0,1,0,0,0,0|2,1,0]=4 429 B12R2.1 CNc1ncc2ccccn12 Amb27422888 [0,1,0,0,0,0|3,0,0]=4 430 B12R2.1 CNc1nnc2ccccn12 Amb27493158 [0,1,0,0,0,0|3,0,0]=4 431 B12R2.1 CNc1noc2ccccc12 Amb28346874 [0,1,0,0,0,0|1,0,0]=2 432 B12R2.1 CNc1nsc2ccccc12 Amb26975049 [0,1,0,0,0,0|1,1,0]=3 433 B12R2.1 CNc1nsc2ccccc12 Amb32666797 [0,1,0,0,0,0|1,1,0]=3 434 B12R2.1 COC1=CCc2ccccc21 Amb17778910 [0,1,0,0,0,0|2,0,0]=3 435 B12R2.1 COC1CCc2ccccc21 Amb25880282 [0,1,0,0,0,0|2,0,1]=4 436 B12R2.1 COC1CNc2ccccc21 Amb27863100 [0,1,0,0,0,0|2,0,1]=4 437 B12R2.1 COC1OCc2ccccc21 Amb24323529 [0,1,0,0,0,0|2,0,1]=4 438 B12R2.1 COc1ccn2ccccc12 Amb28282776 [0,1,0,0,0,0|3,0,0]=4 439 B12R2.1 COc1csc2ccccc12 Amb28320302 [0,1,0,0,0,0|1,1,0]=3 440 B12R2.1 COc1noc2ccccc12 Amb23571257 [0,1,0,0,0,0|0,0,0]=1 441 B12R2.1 CSc1nsc2ccccc12 Amb28323593 [0,1,0,0,0,0|0,2,0]=3 442 B12R2.1 C\C=C1\C=Cc2ccccc21 Amb25322411 [0,1,0,0,0,0|3,0,0]=4 443 B12R2.1 C\C=C1\CNc2ccccc21 Amb27967275 [0,1,0,0,0,0|3,0,0]=4 444 B12R2.1 ClCc1coc2ccccc12 Amb5716310 [0,1,0,0,0,0|2,0,0]=3 445 B12R2.1 ClCc1coc2ncccc12 Amb26544377 [0,1,0,0,0,0|3,0,0]=4 446 B12R2.1 ClCc1csc2ccccc12 Amb7808742 [0,1,0,0,0,0|2,1,0]=4 447 B12R2.1 ClCc1ncn2ccccc12 Amb23560033 [0,1,0,0,0,0|3,0,0]=4 448 B12R2.1 ClCc1noc2ccccc12 Amb28141425 [0,1,0,0,0,0|1,0,0]=2 449 B12R2.1 ClCc1onc2ccccc12 Amb35781905 [0,1,0,0,0,0|3,0,0]=4 450 B12R2.1 ClCn1nnc2ccccc21 Amb9826006 [0,1,0,0,0,0|3,0,0]=4 451 B12R2.1 FCc1coc2ccccc12 Amb27186252 [0,1,0,0,0,0|2,0,0]=3 452 B12R2.1 FCn1nnc2ccccc21 Amb10559935 [0,1,0,0,0,0|3,0,0]=4 453 B12R2.1 N#CC1=CCc2ccccc21 Amb17231929 [0,1,0,0,0,0|3,0,0]=4 454 B12R2.1 N#CC1COc2ccccc21 Amb23586274 [0,1,0,0,0,0|2,0,1]=4 455 B12R2.1 N#CC1N=Cc2ccccc21 Amb28051693 [0,1,0,0,0,0|2,0,1]=4 456 B12R2.1 N#Cc1coc2ccccc12 Amb10808759 [0,1,0,0,0,0|2,0,0]=3 457 B12R2.1 N#Cc1csc2ccccc12 Amb18182421 [0,1,0,0,0,0|2,1,0]=4 458 B12R2.1 N#Cc1ncn2ccccc12 Amb23454456 [0,1,0,0,0,0|3,0,0]=4 459 B12R2.1 N#Cc1nsc2ccccc12 Amb18126255 [0,1,0,0,0,0|1,1,0]=3 460 B12R2.1 N#Cn1nnc2ccccc21 Amb4004555 [0,1,0,0,0,0|3,0,0]=4 461 B12R2.1 NCC1=CCc2ccccc21 Amb18560208 [0,1,0,0,0,0|3,0,0]=4 462 B12R2.1 NCC1COc2ccccc21 Amb33545318 [0,1,0,0,0,0|2,0,1]=4 463 B12R2.1 NCC1COc2ccccc21 Amb33549495 [0,1,0,0,0,0|2,0,1]=4 464 B12R2.1 NC[C@H]1COc2ccccc21 Amb28289255 [0,1,0,0,0,0|2,0,1]=4 465 B12R2.1 NCc1coc2ccccc12 Amb19373967 [0,1,0,0,0,0|2,0,0]=3 466 B12R2.1 NCc1coc2ccccc12 Amb19649824 [0,1,0,0,0,0|2,0,0]=3 467 B12R2.1 NCc1csc2ccccc12 Amb2723184 [0,1,0,0,0,0|2,1,0]=4 468 B12R2.1 NCc1csc2ccccc12 Amb3941423 [0,1,0,0,0,0|2,1,0]=4 469 B12R2.1 NCc1ncc2ccccn12 Amb17058863 [0,1,0,0,0,0|3,0,0]=4 470 B12R2.1 NCc1nnc2ccccn12 Amb22551836 [0,1,0,0,0,0|3,0,0]=4 471 B12R2.1 NCc1nnc2ccccn12 Amb2371067 [0,1,0,0,0,0|3,0,0]=4 472 B12R2.1 NCc1nnc2ccccn12 Amb35309 [0,1,0,0,0,0|3,0,0]=4 473 B12R2.1 NCc1noc2ccccc12 Amb33531498 [0,1,0,0,0,0|1,0,0]=2 474 B12R2.1 NCc1noc2ccccc12 Amb33536485 [0,1,0,0,0,0|1,0,0]=2 475 B12R2.1 NCc1noc2cnccc12 Amb27186370 [0,1,0,0,0,0|2,0,0]=3 476 B12R2.1 NCc1noc2ncccc12 Amb22737761 [0,1,0,0,0,0|2,0,0]=3 477 B12R2.1 NCc1nsc2ccccc12 Amb18646122 [0,1,0,0,0,0|1,1,0]=3 478 B12R2.1 NCc1nsc2ccccc12 Amb28872324 [0,1,0,0,0,0|1,1,0]=3 479 B12R2.1 NCc1nsc2cccnc12 Amb27777010 [0,1,0,0,0,0|2,1,0]=4 480 B12R2.1 NNc1coc2ccccc12 Amb35704215 [0,1,0,0,0,0|2,0,0]=3 481 B12R2.1 NNc1nsc2ccccc12 Amb1115216 [0,1,0,0,0,0|1,1,0]=3 482 B12R2.1 NNc1snc2ccccc12 Amb27664497 [0,1,0,0,0,0|3,0,0]=4 483 B12R2.1 N\N=C1/CCc2ccccc21 Amb33734274 [0,1,0,0,0,0|3,0,0]=4 484 B12R2.1 N\N=C1/COc2ccccc21 Amb27862558 [0,1,0,0,0,0|2,0,0]=3 485 B12R2.1 N\N=C1\CCc2ccccc21 Amb2384463 [0,1,0,0,0,0|3,0,0]=4 486 B12R2.1 N\N=C1\CSc2ccccc21 Amb27395953 [0,1,0,0,0,0|2,1,0]=4 487 B12R2.1 O=Cc1coc2ccccc12 Amb10844786 [0,1,0,0,0,0|1,0,1]=3 488 B12R2.1 O=Cc1coc2cccnc12 Amb22495093 [0,1,0,0,0,0|2,0,1]=4 489 B12R2.1 O=Cc1coc2ccncc12 Amb18202345 [0,1,0,0,0,0|2,0,1]=4 490 B12R2.1 O=Cc1coc2cnccc12 Amb22495092 [0,1,0,0,0,0|2,0,1]=4 491 B12R2.1 O=Cc1coc2ncccc12 Amb18202347 [0,1,0,0,0,0|2,0,1]=4 492 B12R2.1 O=Cc1csc2ccccc12 Amb1157901 [0,1,0,0,0,0|1,1,1]=4 493 B12R2.1 O=Cc1ncc2ccccn12 Amb18124774 [0,1,0,0,0,0|2,0,1]=4 494 B12R2.1 O=Cc1ncn2ccccc12 Amb18559503 [0,1,0,0,0,0|2,0,1]=4 495 B12R2.1 O=Cc1nnc2ccccn12 Amb23450391 [0,1,0,0,0,0|2,0,1]=4 496 B12R2.1 O=Cc1nnn2ccccc12 Amb18202317 [0,1,0,0,0,0|2,0,1]=4 497 B12R2.1 O=Cc1noc2cccnc12 Amb27633323 [0,1,0,0,0,0|1,0,1]=3 498 B12R2.1 O=Cc1noc2ccncc12 Amb27963151 [0,1,0,0,0,0|1,0,1]=3 499 B12R2.1 O=Cc1noc2ncccc12 Amb18202280 [0,1,0,0,0,0|1,0,1]=3 500 B12R2.1 O=Cc1nsc2ccncc12 Amb18199776 [0,1,0,0,0,0|1,1,1]=4 501 B12R2.1 O=Cc1nsc2ncccc12 Amb18199775 [0,1,0,0,0,0|1,1,1]=4 502 B12R2.1 O=Cc1occ2ccccc12 Amb27793276 [0,1,0,0,0,0|2,0,1]=4 503 B12R2.1 O=Cc1onc2ccccc12 Amb18831437 [0,1,0,0,0,0|2,0,1]=4 504 B12R2.1 O=Cc1snc2ccccc12 Amb26948515 [0,1,0,0,0,0|2,0,1]=4 505 B12R2.1 O=Cn1nnc2ccccc21 Amb3374289 [0,1,0,0,0,0|2,0,1]=4 506 B12R2.1 O=Nc1noc2ncncc12 Amb25144108 [0,1,0,0,0,0|2,0,1]=4 507 B12R2.1 OCC1CCc2ccccc21 Amb19329220 [0,1,0,0,0,0|2,0,1]=4 508 B12R2.1 OCC1CNc2ccccc21 Amb18063448 [0,1,0,0,0,0|2,0,1]=4 509 B12R2.1 OCC1CNc2ccccc21 Amb28652884 [0,1,0,0,0,0|2,0,1]=4 510 B12R2.1 OCC1COc2ccccc21 Amb22224879 [0,1,0,0,0,0|1,0,1]=3 511 B12R2.1 OCC1COc2cnccc21 Amb26498941 [0,1,0,0,0,0|2,0,1]=4 512 B12R2.1 OCC1CSc2ccccc21 Amb24615579 [0,1,0,0,0,0|1,1,1]=4 513 B12R2.1 OCC1NCc2ccccc21 Amb25736151 [0,1,0,0,0,0|1,0,2]=4 514 B12R2.1 OCc1cnc2ccccn12 Amb10067471 [0,1,0,0,0,0|3,0,0]=4 515 B12R2.1 OCc1cnc2ccccn12 Amb21927957 [0,1,0,0,0,0|3,0,0]=4 516 B12R2.1 OCc1cnn2ccccc12 Amb33541364 [0,1,0,0,0,0|3,0,0]=4 517 B12R2.1 OCc1coc2ccccc12 Amb10572402 [0,1,0,0,0,0|1,0,0]=2 518 B12R2.1 OCc1coc2cccnc12 Amb27811027 [0,1,0,0,0,0|2,0,0]=3 519 B12R2.1 OCc1coc2ccncc12 Amb24514107 [0,1,0,0,0,0|2,0,0]=3 520 B12R2.1 OCc1csc2ccccc12 Amb2723182 [0,1,0,0,0,0|1,1,0]=3 521 B12R2.1 OCc1csc2ccncc12 Amb27265576 [0,1,0,0,0,0|2,1,0]=4 522 B12R2.1 OCc1csc2cnccc12 Amb27486701 [0,1,0,0,0,0|2,1,0]=4 523 B12R2.1 OCc1ncn2ccccc12 Amb22493894 [0,1,0,0,0,0|2,0,0]=3 524 B12R2.1 OCc1nnc2cccnn12 Amb23449898 [0,1,0,0,0,0|3,0,0]=4 525 B12R2.1 OCc1noc2ccccc12 Amb22498744 [0,1,0,0,0,0|0,0,0]=1 526 B12R2.1 OCc1noc2cnccc12 Amb28436318 [0,1,0,0,0,0|1,0,0]=2 527 B12R2.1 OCc1noc2ncccc12 Amb27450932 [0,1,0,0,0,0|1,0,0]=2 528 B12R2.1 OCc1occ2ccccc12 Amb28345290 [0,1,0,0,0,0|2,0,0]=3 529 B12R2.1 OCc1onc2ccccc12 Amb35781902 [0,1,0,0,0,0|2,0,0]=3 530 B12R2.1 OCc1snc2ccccc12 Amb27839871 [0,1,0,0,0,0|2,0,0]=3 531 B12R2.1 OCn1cnc2ccccc21 Amb1151978 [0,1,0,0,0,0|3,0,0]=4 532 B12R2.1 OCn1ncc2ccccc21 Amb23441644 [0,1,0,0,0,0|2,0,0]=3 533 B12R2.1 OCn1nnc2ccccc21 Amb1350546 [0,1,0,0,0,0|2,0,0]=3 534 B12R2.1 ONC1CSc2ccccc21 Amb27223274 [0,1,0,0,0,0|1,1,1]=4 535 B12R2.1 ONc1csc2ccccc12 Amb27638522 [0,1,0,0,0,0|1,1,0]=3 536 B12R2.1 ONc1snc2ccccc12 Amb28365603 [0,1,0,0,0,0|2,0,0]=3 537 B12R2.1 O\N=C1/CCc2ccccc21 Amb4016236 [0,1,0,0,0,0|2,0,0]=3 538 B12R2.1 O\N=C1/COc2ccccc21 Amb19650724 [0,1,0,0,0,0|1,0,0]=2 539 B12R2.1 O\N=C1/NCc2ccccc21 Amb24746464 [0,1,0,0,0,0|1,0,1]=3 540 B12R2.1 O\N=C1\COc2ccccc21 Amb27840218 [0,1,0,0,0,0|1,0,0]=2 541 B12R2.1 SCC1COc2ccccc21 Amb27397263 [0,1,0,0,0,0|1,1,1]=4 542 B12R2.1 SCc1coc2ccccc12 Amb24405838 [0,1,0,0,0,0|1,1,0]=3 543 B12R2.1 SCc1csc2ccccc12 Amb3429654 [0,1,0,0,0,0|1,2,0]=4 544 B12R2.1 SCc1ncn2ccccc12 Amb23560063 [0,1,0,0,0,0|2,1,0]=4 545 B12R2.1 [C-]#[N+]c1csc2ccccc12 Amb33313010 [0,1,0,0,0,0|2,1,0]=4 546 B12R2.1 [N-]=[N+]=C1N=Nc2ccccc21 Amb27441838 [0,1,0,0,0,0|2,0,0]=3 547 B12R2.18 Brc1sc2ccccc2c1Br Amb21858144 [0,1,0,0,0,0|2,1,0]=4 548 B12R2.18 C=C1C(=O)Nc2ccccc21 Amb17779246 [0,1,0,0,0,0|3,0,0]=4 549 B12R2.18 C=C1Cc2ccccc2C1=O Amb18062660 [0,1,0,0,0,0|2,0,1]=4 550 B12R2.18 C=C1c2ccccc2OC1O Amb27197539 [0,1,0,0,0,0|2,0,0]=3 551 B12R2.18 C=C1c2ccccc2SC1O Amb27775969 [0,1,0,0,0,0|2,1,0]=4 552 B12R2.18 CC1=C(C)c2ccccc2C1 Amb21948330 [0,1,0,0,0,0|3,0,0]=4 553 B12R2.18 CC1=C2C=CNC=C2OC1=O Amb27413033 [0,1,0,0,0,0|3,0,0]=4 554 B12R2.18 CC1=C2C=COC=C2OC1=O Amb19133147 [0,1,0,0,0,0|3,0,0]=4 555 B12R2.18 CC1=Cc2ccccc2C1O Amb17778950 [0,1,0,0,0,0|2,0,1]=4 556 B12R2.18 CC1=Cc2ccccc2[C@H]1O Amb28319957 [0,1,0,0,0,0|2,0,1]=4 557 B12R2.18 CC1C(=O)Oc2ccccc21 Amb25150504 [0,1,0,0,0,0|2,0,1]=4 558 B12R2.18 CC1Cc2ccccc2C1=O Amb2724364 [0,1,0,0,0,0|2,0,1]=4 559 B12R2.18 CC1Cc2ccccc2C1O Amb27228534 [0,1,0,0,0,0|2,0,1]=4 560 B12R2.18 CC1Nc2ccccc2C1=O Amb17593674 [0,1,0,0,0,0|2,0,1]=4 561 B12R2.18 CC1Nc2ccccc2C1O Amb28076897 [0,1,0,0,0,0|2,0,1]=4 562 B12R2.18 CC1Oc2ccccc2C1=O Amb25956002 [0,1,0,0,0,0|1,0,1]=3 563 B12R2.18 CC1Oc2ccccc2C1N Amb18943788 [0,1,0,0,0,0|2,0,1]=4 564 B12R2.18 CC1Oc2ccccc2C1N Amb28974067 [0,1,0,0,0,0|2,0,1]=4 565 B12R2.18 CC1Oc2cccnc2C1O Amb28141839 [0,1,0,0,0,0|2,0,1]=4 566 B12R2.18 CC1Oc2cnccc2C1O Amb27764814 [0,1,0,0,0,0|2,0,1]=4 567 B12R2.18 CC1Oc2ncccc2C1O Amb22372218 [0,1,0,0,0,0|2,0,1]=4 568 B12R2.18 CN1C(=O)Oc2ccccc21 Amb18043105 [0,1,0,0,0,0|3,0,0]=4 569 B12R2.18 CN1Cc2ccccc2C1=O Amb4006345 [0,1,0,0,0,0|1,0,2]=4 570 B12R2.18 CN1Nc2ccccc2C1=N Amb27646089 [0,1,0,0,0,0|2,0,1]=4 571 B12R2.18 CN1Oc2ccccc2C1=O Amb27760365 [0,1,0,0,0,0|0,0,2]=3 572 B12R2.18 CN1Sc2ccccc2C1=O Amb27218159 [0,1,0,0,0,0|0,1,2]=4 573 B12R2.18 CN1Sc2ccccc2C1=S Amb22347590 [0,1,0,0,0,0|0,2,1]=4 574 B12R2.18 C[C@@H]1Cc2ccccc2[C@@H]1O Amb27663152 [0,1,0,0,0,0|2,0,1]=4 575 B12R2.18 C[C@@H]1Oc2ccccc2[C@@H]1N Amb28325929 [0,1,0,0,0,0|2,0,1]=4 576 B12R2.18 C[C@@H]1Oc2cccnc2[C@@H]1O Amb28401114 [0,1,0,0,0,0|2,0,1]=4 577 B12R2.18 C[C@H]1Oc2cccnc2[C@@H]1O Amb28064079 [0,1,0,0,0,0|2,0,1]=4 578 B12R2.18 C[C@H]1Oc2cnccc2[C@@H]1O Amb27430760 [0,1,0,0,0,0|2,0,1]=4 579 B12R2.18 Cc1c(Br)oc2ccccc12 Amb24451202 [0,1,0,0,0,0|2,0,0]=3 580 B12R2.18 Cc1c(I)sc2ccccc12 Amb26042872 [0,1,0,0,0,0|2,1,0]=4 581 B12R2.18 Cc1c(N)oc2ccccc12 Amb18202306 [0,1,0,0,0,0|2,0,0]=3 582 B12R2.18 Cc1c(O)oc2ccccc12 Amb33310521 [0,1,0,0,0,0|2,0,0]=3 583 B12R2.18 Cc1c2ccccc2nn1C Amb23437154 [0,1,0,0,0,0|2,0,1]=4 584 B12R2.18 Cc1c2ccccc2nn1N Amb2612189 [0,1,0,0,0,0|2,0,1]=4 585 B12R2.18 Cc1c2ncccc2o[n+]1[O-] Amb25963844 [0,1,0,0,0,0|2,0,1]=4 586 B12R2.18 Cc1oc2ccccc2c1Br Amb18773210 [0,1,0,0,0,0|2,0,0]=3 587 B12R2.18 Cc1oc2ccccc2c1C Amb8516959 [0,1,0,0,0,0|2,0,0]=3 588 B12R2.18 Cc1oc2ccncc2c1Br Amb23591026 [0,1,0,0,0,0|3,0,0]=4 589 B12R2.18 Cc1sc2ccccc2c1Br Amb10975969 [0,1,0,0,0,0|2,1,0]=4 590 B12R2.18 Cc1sc2ccccc2c1I Amb25247275 [0,1,0,0,0,0|2,1,0]=4 591 B12R2.18 Clc1c(Br)oc2ccccc12 Amb28284723 [0,1,0,0,0,0|2,0,0]=3 592 B12R2.18 Clc1oc2ccccc2c1Br Amb33433284 [0,1,0,0,0,0|2,0,0]=3 593 B12R2.18 Clc1sc2ccccc2c1Br Amb27792393 [0,1,0,0,0,0|2,1,0]=4 594 B12R2.18 Clc1sc2ccccc2c1Cl Amb20669291 [0,1,0,0,0,0|2,1,0]=4 595 B12R2.18 Cn1nc2ccccc2c1Br Amb25909805 [0,1,0,0,0,0|2,0,1]=4 596 B12R2.18 Cn1nc2ccccc2c1Cl Amb28434884 [0,1,0,0,0,0|2,0,1]=4 597 B12R2.18 Cn1nc2ccccc2c1I Amb22494609 [0,1,0,0,0,0|2,0,1]=4 598 B12R2.18 Cn1nc2ccccc2c1N Amb24084319 [0,1,0,0,0,0|2,0,1]=4 599 B12R2.18 Cn1nc2ccccc2c1S Amb33310612 [0,1,0,0,0,0|1,1,1]=4 600 B12R2.18 F[C@H]1Oc2ccccc2[C@@H]1Cl Amb28385762 [0,1,0,0,0,0|2,0,1]=4 601 B12R2.18 Fc1sc2ccccc2c1Br Amb28323565 [0,1,0,0,0,0|2,1,0]=4 602 B12R2.18 N=C1C(=O)Nc2ccccc21 Amb26318567 [0,1,0,0,0,0|3,0,0]=4 603 B12R2.18 NC1C(=O)Oc2ccccc21 Amb28240356 [0,1,0,0,0,0|2,0,1]=4 604 B12R2.18 NC1Cc2ccccc2C1=O Amb17470380 [0,1,0,0,0,0|2,0,1]=4 605 B12R2.18 NC1Cc2ccccc2C1=O Amb33548490 [0,1,0,0,0,0|2,0,1]=4 606 B12R2.18 NC1Cc2ccccc2C1O Amb20623676 [0,1,0,0,0,0|2,0,1]=4 607 B12R2.18 NC1Cc2ccccc2C1O Amb2383051 [0,1,0,0,0,0|2,0,1]=4 608 B12R2.18 NN1C(=O)Oc2ccccc21 Amb18644412 [0,1,0,0,0,0|3,0,0]=4 609 B12R2.18 NN1Cc2ccccc2C1=O Amb28652918 [0,1,0,0,0,0|1,0,2]=4 610 B12R2.18 N[C@@H]1Cc2ccccc2[C@@H]1O Amb24501357 [0,1,0,0,0,0|2,0,1]=4 611 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb22388538 [0,1,0,0,0,0|2,0,1]=4 612 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb25379044 [0,1,0,0,0,0|2,0,1]=4 613 B12R2.18 N[C@H]1Cc2ccccc2[C@H]1O Amb24540566 [0,1,0,0,0,0|2,0,1]=4 614 B12R2.18 Nc1c(Br)sc2ccccc12 Amb18135010 [0,1,0,0,0,0|2,1,0]=4 615 B12R2.18 Nc1sc2ccccc2c1Br Amb18135037 [0,1,0,0,0,0|2,1,0]=4 616 B12R2.18 Nc1sc2ccccc2c1N Amb27823311 [0,1,0,0,0,0|2,1,0]=4 617 B12R2.18 O=C1C(=S)Nc2ccccc21 Amb17594053 [0,1,0,0,0,0|2,0,1]=4 618 B12R2.18 O=C1C(Cl)=Cc2ccccc21 Amb24736271 [0,1,0,0,0,0|2,0,1]=4 619 B12R2.18 O=C1C(Cl)=Nc2ccccc21 Amb17594117 [0,1,0,0,0,0|2,0,1]=4 620 B12R2.18 O=C1Cc2ccccc2C1=O Amb2694764 [0,1,0,0,0,0|2,0,1]=4 621 B12R2.18 O=C1Cc2ccccc2N1O Amb17940424 [0,1,0,0,0,0|3,0,0]=4 622 B12R2.18 O=C1Nc2ccccc2C1=O Amb2721711 [0,1,0,0,0,0|2,0,1]=4 623 B12R2.18 O=C1Nc2ccccc2C1=S Amb9803339 [0,1,0,0,0,0|2,1,0]=4 624 B12R2.18 O=C1Nc2ccccc2C1O Amb9748239 [0,1,0,0,0,0|2,0,1]=4 625 B12R2.18 O=C1Nc2ccccc2N1O Amb26332921 [0,1,0,0,0,0|3,0,0]=4 626 B12R2.18 O=C1Oc2ccccc2C1=O Amb9783305 [0,1,0,0,0,0|1,0,1]=3 627 B12R2.18 O=C1Oc2ccccc2C1Br Amb3939721 [0,1,0,0,0,0|2,0,1]=4 628 B12R2.18 O=C1Sc2ccccc2C1=O Amb2608884 [0,1,0,0,0,0|1,1,1]=4 629 B12R2.18 O=C1Sc2ccccc2C1O Amb27636570 [0,1,0,0,0,0|1,1,1]=4 630 B12R2.18 O=C1c2ccccc2CC1Br Amb2724122 [0,1,0,0,0,0|2,0,1]=4 631 B12R2.18 O=C1c2ccccc2CC1Cl Amb4402396 [0,1,0,0,0,0|2,0,1]=4 632 B12R2.18 O=C1c2ccccc2CC1F Amb17593723 [0,1,0,0,0,0|2,0,1]=4 633 B12R2.18 O=C1c2ccccc2CC1O Amb25342077 [0,1,0,0,0,0|2,0,1]=4 634 B12R2.18 OC1Cc2ccccc2C1O Amb24323306 [0,1,0,0,0,0|2,0,1]=4 635 B12R2.18 OC1Oc2ccccc2C1O Amb27945780 [0,1,0,0,0,0|1,0,1]=3 636 B12R2.18 OC1Sc2ccccc2C1O Amb27853727 [0,1,0,0,0,0|1,1,1]=4 637 B12R2.18 OC1c2ccccc2CC1Br Amb1159074 [0,1,0,0,0,0|2,0,1]=4 638 B12R2.18 OC1c2ccccc2CC1F Amb24423988 [0,1,0,0,0,0|2,0,1]=4 639 B12R2.18 OC1c2ccccc2CC1S Amb27397064 [0,1,0,0,0,0|2,0,1]=4 640 B12R2.18 O[C@@H]1Cc2ccccc2[C@H]1O Amb10982589 [0,1,0,0,0,0|2,0,1]=4 641 B12R2.18 O[C@@H]1Sc2ccccc2[C@H]1O Amb28344973 [0,1,0,0,0,0|1,1,1]=4 642 B12R2.18 O[C@@H]1c2ccccc2CC1Br Amb27176336 [0,1,0,0,0,0|2,0,1]=4 643 B12R2.18 O[C@@H]1c2ccccc2C[C@@H]1Cl Amb8394042 [0,1,0,0,0,0|2,0,1]=4 644 B12R2.18 O[C@@H]1c2ccccc2C[C@H]1Br Amb28053369 [0,1,0,0,0,0|2,0,1]=4 645 B12R2.18 O[C@@H]1c2ccccc2C[C@H]1Cl Amb24519428 [0,1,0,0,0,0|2,0,1]=4 646 B12R2.18 O[C@@H]1c2ccccc2C[C@H]1F Amb27228144 [0,1,0,0,0,0|2,0,1]=4 647 B12R2.18 O[C@H]1Cc2ccccc2[C@@H]1O Amb27427979 [0,1,0,0,0,0|2,0,1]=4 648 B12R2.18 O[C@H]1Oc2ccccc2[C@H]1O Amb27782441 [0,1,0,0,0,0|1,0,1]=3 649 B12R2.18 O[C@H]1c2ccccc2CC1Br Amb25061997 [0,1,0,0,0,0|2,0,1]=4 650 B12R2.18 O[C@H]1c2ccccc2C[C@@H]1Br Amb8629277 [0,1,0,0,0,0|2,0,1]=4 651 B12R2.18 O[C@H]1c2ccccc2C[C@@H]1Cl Amb26565760 [0,1,0,0,0,0|2,0,1]=4 652 B12R2.18 O[C@H]1c2ccccc2C[C@H]1Br Amb27446678 [0,1,0,0,0,0|2,0,1]=4 653 B12R2.18 O[C@H]1c2ccccc2C[C@H]1Cl Amb2609427 [0,1,0,0,0,0|2,0,1]=4 654 B12R2.18 O[C@H]1c2ccccc2C[C@H]1F Amb25176954 [0,1,0,0,0,0|2,0,1]=4 655 B12R2.18 Oc1sc2ccccc2c1O Amb27966224 [0,1,0,0,0,0|1,1,0]=3 656 B12R2.132 Brc1ccc2cnc(Br)n2c1 Amb27867467 [0,1,0,0,0,0|3,0,0]=4 657 B12R2.132 Brc1ccc2nnc(Br)n2c1 Amb32721149 [0,1,0,0,0,0|3,0,0]=4 658 B12R2.132 Brc1ccc2nnc(I)n2c1 Amb27426993 [0,1,0,0,0,0|3,0,0]=4 659 B12R2.132 Brc1ccc2nsc(I)c2c1 Amb32758835 [0,1,0,0,0,0|3,0,0]=4 660 B12R2.132 Brc1ccc2occ(Br)c2c1 Amb2723640 [0,1,0,0,0,0|2,0,0]=3 661 B12R2.132 CC1=CCc2ccc(C)cc21 Amb27949310 [0,1,0,0,0,0|3,0,0]=4 662 B12R2.132 CN1COc2ccc(O)cc21 Amb27806103 [0,1,0,0,0,0|3,0,0]=4 663 B12R2.132 Cc1cc2c(cn1)OCC2=O Amb22728381 [0,1,0,0,0,0|2,0,1]=4 664 B12R2.132 Cc1ccc2c(c1)B(O)OC2 Amb25777120 [0,1,0,0,0,0|3,0,0]=4 665 B12R2.132 Cc1ccc2c(c1)C(=O)CC2 Amb2781670 [0,1,0,0,0,0|2,0,1]=4 666 B12R2.132 Cc1ccc2c(c1)C(=O)CN2 Amb18202305 [0,1,0,0,0,0|2,0,1]=4 667 B12R2.132 Cc1ccc2c(c1)C(=O)CO2 Amb6683471 [0,1,0,0,0,0|1,0,1]=3 668 B12R2.132 Cc1ccc2c(c1)C(=O)CS2 Amb18199752 [0,1,0,0,0,0|1,1,1]=4 669 B12R2.132 Cc1ccc2c(c1)C(=O)NC2 Amb19517084 [0,1,0,0,0,0|1,0,2]=4 670 B12R2.132 Cc1ccc2c(c1)C(=O)NN2 Amb19748512 [0,1,0,0,0,0|1,0,2]=4 671 B12R2.132 Cc1ccc2c(c1)C(=O)OC2 Amb24060123 [0,1,0,0,0,0|2,0,1]=4 672 B12R2.132 Cc1ccc2c(c1)C(=O)SN2 Amb32673864 [0,1,0,0,0,0|2,0,1]=4 673 B12R2.132 Cc1ccc2c(c1)C(N)CO2 Amb20626372 [0,1,0,0,0,0|2,0,1]=4 674 B12R2.132 Cc1ccc2c(c1)C(N)CO2 Amb9735883 [0,1,0,0,0,0|2,0,1]=4 675 B12R2.132 Cc1ccc2c(c1)C(O)CC2 Amb17087924 [0,1,0,0,0,0|2,0,1]=4 676 B12R2.132 Cc1ccc2c(c1)C(O)CO2 Amb28383453 [0,1,0,0,0,0|1,0,1]=3 677 B12R2.132 Cc1ccc2cnc(Br)n2c1 Amb27162112 [0,1,0,0,0,0|3,0,0]=4 678 B12R2.132 Cc1ccc2cnc(C)n2c1 Amb25354737 [0,1,0,0,0,0|3,0,0]=4 679 B12R2.132 Cc1ccc2cnc(N)n2c1 Amb28252897 [0,1,0,0,0,0|3,0,0]=4 680 B12R2.132 Cc1ccc2cnn(C)c2c1 Amb27195580 [0,1,0,0,0,0|3,0,0]=4 681 B12R2.132 Cc1ccc2cnn(N)c2c1 Amb27956202 [0,1,0,0,0,0|3,0,0]=4 682 B12R2.132 Cc1ccc2nnc(Cl)n2c1 Amb27875666 [0,1,0,0,0,0|3,0,0]=4 683 B12R2.132 Cc1ccc2nnc(O)n2c1 Amb22886918 [0,1,0,0,0,0|2,0,0]=3 684 B12R2.132 Cc1ccc2nnc(S)n2c1 Amb17210574 [0,1,0,0,0,0|2,1,0]=4 685 B12R2.132 Cc1ccc2nnn(C)c2c1 Amb23402464 [0,1,0,0,0,0|3,0,0]=4 686 B12R2.132 Cc1ccc2nsc(N)c2c1 Amb27646636 [0,1,0,0,0,0|3,0,0]=4 687 B12R2.132 Cc1ccc2occ(Br)c2c1 Amb26345721 [0,1,0,0,0,0|2,0,0]=3 688 B12R2.132 Cc1ccc2occ(C)c2c1 Amb23440813 [0,1,0,0,0,0|2,0,0]=3 689 B12R2.132 Cc1ccc2occ(Cl)c2n1 Amb26940800 [0,1,0,0,0,0|3,0,0]=4 690 B12R2.132 Cc1ccc2occ(O)c2c1 Amb33299851 [0,1,0,0,0,0|1,0,0]=2 691 B12R2.132 Cc1ccc2onc(C)c2c1 Amb9792959 [0,1,0,0,0,0|1,0,0]=2 692 B12R2.132 Cc1ccc2onc(Cl)c2c1 Amb21857028 [0,1,0,0,0,0|1,0,0]=2 693 B12R2.132 Cc1ccc2onc(N)c2c1 Amb21857108 [0,1,0,0,0,0|1,0,0]=2 694 B12R2.132 Cc1ccc2scc(N)c2c1 Amb23402527 [0,1,0,0,0,0|2,1,0]=4 695 B12R2.132 Cc1ccc2snc(C)c2c1 Amb28130078 [0,1,0,0,0,0|1,1,0]=3 696 B12R2.132 Cc1ccc2snc(Cl)c2c1 Amb25377318 [0,1,0,0,0,0|1,1,0]=3 697 B12R2.132 Cc1ccn2cnc(Br)c2c1 Amb32665237 [0,1,0,0,0,0|3,0,0]=4 698 B12R2.132 Cc1cnc2nnc(O)n2c1 Amb26045927 [0,1,0,0,0,0|3,0,0]=4 699 B12R2.132 Cc1cnc2onc(C)c2c1 Amb25916486 [0,1,0,0,0,0|2,0,0]=3 700 B12R2.132 Cc1coc2ccc(Br)cc12 Amb5722044 [0,1,0,0,0,0|2,0,0]=3 701 B12R2.132 Cc1coc2ccc(Cl)cc12 Amb20622396 [0,1,0,0,0,0|2,0,0]=3 702 B12R2.132 Cc1coc2ccc(F)cc12 Amb20622399 [0,1,0,0,0,0|2,0,0]=3 703 B12R2.132 Cc1coc2ccc(N)cc12 Amb28383907 [0,1,0,0,0,0|2,0,0]=3 704 B12R2.132 Cc1coc2ccc(O)cc12 Amb18124872 [0,1,0,0,0,0|2,0,0]=3 705 B12R2.132 Cc1csc2ccc(Br)cc12 Amb10068740 [0,1,0,0,0,0|2,1,0]=4 706 B12R2.132 Cc1csc2ccc(Cl)cc12 Amb2686206 [0,1,0,0,0,0|2,1,0]=4 707 B12R2.132 Cc1csc2ccc(F)cc12 Amb2688192 [0,1,0,0,0,0|2,1,0]=4 708 B12R2.132 Cc1csc2ccc(I)cc12 Amb27612912 [0,1,0,0,0,0|2,1,0]=4 709 B12R2.132 Cc1csc2ccc(N)cc12 Amb25151209 [0,1,0,0,0,0|2,1,0]=4 710 B12R2.132 Cc1csc2ccc(O)cc12 Amb18126407 [0,1,0,0,0,0|2,1,0]=4 711 B12R2.132 Cc1ncc2ccc(F)cn12 Amb26373306 [0,1,0,0,0,0|3,0,0]=4 712 B12R2.132 Cc1ncc2ccc(N)cn12 Amb27147588 [0,1,0,0,0,0|3,0,0]=4 713 B12R2.132 Cc1ncn2ccc(Br)cc12 Amb25797812 [0,1,0,0,0,0|3,0,0]=4 714 B12R2.132 Cc1nnc2ccc(Br)cn12 Amb10976002 [0,1,0,0,0,0|3,0,0]=4 715 B12R2.132 Cc1nnc2ccc(F)cn12 Amb27623564 [0,1,0,0,0,0|3,0,0]=4 716 B12R2.132 Cc1nnc2ccc(I)cn12 Amb22752372 [0,1,0,0,0,0|3,0,0]=4 717 B12R2.132 Cc1nnc2ccc(N)cn12 Amb17093579 [0,1,0,0,0,0|3,0,0]=4 718 B12R2.132 Cc1nnc2ccc(O)cn12 Amb33039268 [0,1,0,0,0,0|3,0,0]=4 719 B12R2.132 Cc1nnn2ccc(Br)cc12 Amb25769494 [0,1,0,0,0,0|3,0,0]=4 720 B12R2.132 Cc1noc2ccc(Br)cc12 Amb22751636 [0,1,0,0,0,0|1,0,0]=2 721 B12R2.132 Cc1noc2ccc(Br)nc12 Amb18172244 [0,1,0,0,0,0|2,0,0]=3 722 B12R2.132 Cc1noc2ccc(Cl)cc12 Amb25887102 [0,1,0,0,0,0|1,0,0]=2 723 B12R2.132 Cc1noc2ccc(I)cc12 Amb28255880 [0,1,0,0,0,0|1,0,0]=2 724 B12R2.132 Cc1noc2ccc(N)cc12 Amb6674808 [0,1,0,0,0,0|1,0,0]=2 725 B12R2.132 Cc1noc2ccc(O)cc12 Amb22497507 [0,1,0,0,0,0|1,0,0]=2 726 B12R2.132 Cc1noc2cnc(Br)nc12 Amb18770505 [0,1,0,0,0,0|3,0,0]=4 727 B12R2.132 Cc1noc2cnc(Cl)cc12 Amb27209654 [0,1,0,0,0,0|2,0,0]=3 728 B12R2.132 Cc1noc2cnc(Cl)nc12 Amb27225103 [0,1,0,0,0,0|3,0,0]=4 729 B12R2.132 Cc1noc2ncc(Br)cc12 Amb18172156 [0,1,0,0,0,0|2,0,0]=3 730 B12R2.132 Cc1noc2ncc(N)cc12 Amb6890630 [0,1,0,0,0,0|2,0,0]=3 731 B12R2.132 Cc1nsc2ccc(Br)cc12 Amb25893499 [0,1,0,0,0,0|1,1,0]=3 732 B12R2.132 Cc1nsc2ccc(Cl)cc12 Amb2614503 [0,1,0,0,0,0|1,1,0]=3 733 B12R2.132 Cc1nsc2ccc(O)cc12 Amb18126421 [0,1,0,0,0,0|1,1,0]=3 734 B12R2.132 Cc1nsc2ncc(Br)cc12 Amb18755333 [0,1,0,0,0,0|2,1,0]=4 735 B12R2.132 Cc1nsc2ncc(N)cc12 Amb18199680 [0,1,0,0,0,0|2,1,0]=4 736 B12R2.132 Cc1onc2ccc(Cl)cc12 Amb22751074 [0,1,0,0,0,0|3,0,0]=4 737 B12R2.132 Clc1ccc2cnc(Br)n2c1 Amb24509632 [0,1,0,0,0,0|3,0,0]=4 738 B12R2.132 Clc1ccc2nnc(Br)n2c1 Amb28246127 [0,1,0,0,0,0|3,0,0]=4 739 B12R2.132 Clc1ccc2nnc(Cl)n2c1 Amb25921442 [0,1,0,0,0,0|3,0,0]=4 740 B12R2.132 Clc1ccc2occ(Br)c2c1 Amb25742477 [0,1,0,0,0,0|2,0,0]=3 741 B12R2.132 Clc1ccc2occ(Br)c2n1 Amb22755862 [0,1,0,0,0,0|3,0,0]=4 742 B12R2.132 Clc1ccc2onc(Cl)c2c1 Amb20171048 [0,1,0,0,0,0|1,0,0]=2 743 B12R2.132 Clc1ccc2scc(Cl)c2c1 Amb28436176 [0,1,0,0,0,0|2,1,0]=4 744 B12R2.132 Clc1ccc2snc(Cl)c2c1 Amb26929022 [0,1,0,0,0,0|1,1,0]=3 745 B12R2.132 Clc1coc2ccc(Br)cc12 Amb18159965 [0,1,0,0,0,0|2,0,0]=3 746 B12R2.132 Clc1csc2ccc(Br)cc12 Amb28204991 [0,1,0,0,0,0|2,1,0]=4 747 B12R2.132 Clc1nnc2ccc(Br)cn12 Amb26372329 [0,1,0,0,0,0|3,0,0]=4 748 B12R2.132 Clc1noc2ccc(Br)cc12 Amb10603816 [0,1,0,0,0,0|1,0,0]=2 749 B12R2.132 Clc1noc2ccc(I)cc12 Amb24488103 [0,1,0,0,0,0|1,0,0]=2 750 B12R2.132 Clc1nsc2ccc(Br)cc12 Amb25237269 [0,1,0,0,0,0|1,1,0]=3 751 B12R2.132 Cn1ncc2ccc(Br)cc21 Amb10067310 [0,1,0,0,0,0|3,0,0]=4 752 B12R2.132 Cn1ncc2ccc(Cl)cc21 Amb21864870 [0,1,0,0,0,0|3,0,0]=4 753 B12R2.132 Cn1ncc2ccc(N)cc21 Amb6384374 [0,1,0,0,0,0|3,0,0]=4 754 B12R2.132 Cn1ncc2ccc(O)cc21 Amb10070485 [0,1,0,0,0,0|3,0,0]=4 755 B12R2.132 Cn1nnc2ccc(Br)cc21 Amb22000926 [0,1,0,0,0,0|3,0,0]=4 756 B12R2.132 Cn1nnc2ccc(Cl)cc21 Amb23541015 [0,1,0,0,0,0|3,0,0]=4 757 B12R2.132 Cn1nnc2ccc(F)cc21 Amb25142101 [0,1,0,0,0,0|3,0,0]=4 758 B12R2.132 Cn1nnc2ccc(I)cc21 Amb34160506 [0,1,0,0,0,0|3,0,0]=4 759 B12R2.132 Cn1nnc2ccc(N)cc21 Amb18831375 [0,1,0,0,0,0|3,0,0]=4 760 B12R2.132 Cn1nnc2ccc(O)cc21 Amb24514471 [0,1,0,0,0,0|3,0,0]=4 761 B12R2.132 Fc1ccc2nnc(Cl)n2c1 Amb26854680 [0,1,0,0,0,0|3,0,0]=4 762 B12R2.132 Fc1ccc2nnc(S)n2c1 Amb17210576 [0,1,0,0,0,0|2,1,0]=4 763 B12R2.132 Fc1ccc2occ(Br)c2c1 Amb28044734 [0,1,0,0,0,0|2,0,0]=3 764 B12R2.132 Fc1ccc2onc(Cl)c2c1 Amb19959271 [0,1,0,0,0,0|1,0,0]=2 765 B12R2.132 Fc1ccc2scc(Br)c2c1 Amb27754561 [0,1,0,0,0,0|2,1,0]=4 766 B12R2.132 Fc1ccc2scc(Cl)c2c1 Amb27878551 [0,1,0,0,0,0|2,1,0]=4 767 B12R2.132 Fc1ccc2snc(Cl)c2c1 Amb32710025 [0,1,0,0,0,0|1,1,0]=3 768 B12R2.132 Fc1ccn2cnc(Br)c2c1 Amb32863188 [0,1,0,0,0,0|3,0,0]=4 769 B12R2.132 N=C1OCc2ccc(F)cc21 Amb32992879 [0,1,0,0,0,0|3,0,0]=4 770 B12R2.132 NC1=NCc2ccc(F)cc21 Amb19374948 [0,1,0,0,0,0|2,0,0]=3 771 B12R2.132 NC1=NCc2ccc(F)cc21 Amb28285357 [0,1,0,0,0,0|2,0,0]=3 772 B12R2.132 NC1COc2ccc(Br)cc21 Amb22751415 [0,1,0,0,0,0|2,0,1]=4 773 B12R2.132 NC1COc2ccc(Br)cc21 Amb9735886 [0,1,0,0,0,0|2,0,1]=4 774 B12R2.132 NC1COc2ccc(Cl)cc21 Amb20626373 [0,1,0,0,0,0|2,0,1]=4 775 B12R2.132 NC1COc2ccc(Cl)cc21 Amb9735885 [0,1,0,0,0,0|2,0,1]=4 776 B12R2.132 NC1COc2ccc(F)cc21 Amb33548698 [0,1,0,0,0,0|2,0,1]=4 777 B12R2.132 NC1COc2ccc(F)cc21 Amb9735884 [0,1,0,0,0,0|2,0,1]=4 778 B12R2.132 N[C@@H]1COc2ccc(Br)cc21 Amb24756687 [0,1,0,0,0,0|2,0,1]=4 779 B12R2.132 N[C@@H]1COc2ccc(F)cc21 Amb26978831 [0,1,0,0,0,0|2,0,1]=4 780 B12R2.132 N[C@H]1COc2ccc(Br)cc21 Amb26056285 [0,1,0,0,0,0|2,0,1]=4 781 B12R2.132 N[C@H]1COc2ccc(F)cc21 Amb26944792 [0,1,0,0,0,0|2,0,1]=4 782 B12R2.132 N[C@H]1COc2ccc(F)cc21 Amb31291288 [0,1,0,0,0,0|2,0,1]=4 783 B12R2.132 Nc1ccc2c(c1)B(O)OC2 Amb10068944 [0,1,0,0,0,0|3,0,0]=4 784 B12R2.132 Nc1ccc2c(c1)B(O)OC2 Amb21963523 [0,1,0,0,0,0|3,0,0]=4 785 B12R2.132 Nc1ccc2c(c1)C(=O)CC2 Amb10067747 [0,1,0,0,0,0|2,0,1]=4 786 B12R2.132 Nc1ccc2c(c1)C(=O)CN2 Amb27963196 [0,1,0,0,0,0|2,0,1]=4 787 B12R2.132 Nc1ccc2c(c1)C(=O)CO2 Amb15772360 [0,1,0,0,0,0|1,0,1]=3 788 B12R2.132 Nc1ccc2c(c1)C(=O)CS2 Amb18199702 [0,1,0,0,0,0|1,1,1]=4 789 B12R2.132 Nc1ccc2c(c1)C(=O)NC2 Amb9490509 [0,1,0,0,0,0|1,0,2]=4 790 B12R2.132 Nc1ccc2c(c1)C(=O)NN2 Amb21959377 [0,1,0,0,0,0|1,0,2]=4 791 B12R2.132 Nc1ccc2c(c1)C(=O)NO2 Amb21963754 [0,1,0,0,0,0|0,0,2]=3 792 B12R2.132 Nc1ccc2c(c1)C(=O)OC2 Amb1042312 [0,1,0,0,0,0|2,0,1]=4 793 B12R2.132 Nc1ccc2c(c1)C(=O)OC2 Amb32653314 [0,1,0,0,0,0|2,0,1]=4 794 B12R2.132 Nc1ccc2c(c1)C(O)CC2 Amb22490266 [0,1,0,0,0,0|2,0,1]=4 795 B12R2.132 Nc1ccc2nnc(Br)n2c1 Amb22499955 [0,1,0,0,0,0|3,0,0]=4 796 B12R2.132 Nc1ccc2nnn(O)c2c1 Amb26601011 [0,1,0,0,0,0|2,0,0]=3 797 B12R2.132 Nc1ccc2scc(Br)c2c1 Amb27762421 [0,1,0,0,0,0|2,1,0]=4 798 B12R2.132 Nc1ccc2scc(O)c2c1 Amb27965442 [0,1,0,0,0,0|1,1,0]=3 799 B12R2.132 Nc1ccc2snc(Cl)c2c1 Amb27791464 [0,1,0,0,0,0|1,1,0]=3 800 B12R2.132 Nc1ccc2snc(N)c2c1 Amb24519100 [0,1,0,0,0,0|1,1,0]=3 801 B12R2.132 Nc1ccn2cnc(Cl)c2c1 Amb25239529 [0,1,0,0,0,0|3,0,0]=4 802 B12R2.132 Nc1cnc2onc(Cl)c2c1 Amb27795273 [0,1,0,0,0,0|2,0,0]=3 803 B12R2.132 Nc1cnc2snc(Br)c2c1 Amb28292825 [0,1,0,0,0,0|2,1,0]=4 804 B12R2.132 Nc1coc2ccc(O)cc12 Amb18831353 [0,1,0,0,0,0|2,0,0]=3 805 B12R2.132 Nc1csc2ccc(Br)cc12 Amb23403633 [0,1,0,0,0,0|2,1,0]=4 806 B12R2.132 Nc1csc2ccc(Cl)cc12 Amb23403647 [0,1,0,0,0,0|2,1,0]=4 807 B12R2.132 Nc1csc2ccc(F)cc12 Amb23403639 [0,1,0,0,0,0|2,1,0]=4 808 B12R2.132 Nc1csc2ccc(O)cc12 Amb32708792 [0,1,0,0,0,0|2,1,0]=4 809 B12R2.132 Nc1ncc2ccc(Br)cn12 Amb28293046 [0,1,0,0,0,0|3,0,0]=4 810 B12R2.132 Nc1ncc2ccc(F)cn12 Amb27224222 [0,1,0,0,0,0|3,0,0]=4 811 B12R2.132 Nc1nnc2ccc(Br)cn12 Amb25189320 [0,1,0,0,0,0|3,0,0]=4 812 B12R2.132 Nc1nnc2ccc(Cl)cn12 Amb24665705 [0,1,0,0,0,0|3,0,0]=4 813 B12R2.132 Nc1noc2ccc(Br)cc12 Amb7990124 [0,1,0,0,0,0|1,0,0]=2 814 B12R2.132 Nc1noc2ccc(Cl)cc12 Amb23437119 [0,1,0,0,0,0|1,0,0]=2 815 B12R2.132 Nc1noc2ccc(Cl)nc12 Amb18198957 [0,1,0,0,0,0|2,0,0]=3 816 B12R2.132 Nc1noc2ccc(F)cc12 Amb17739833 [0,1,0,0,0,0|1,0,0]=2 817 B12R2.132 Nc1noc2ccc(I)cc12 Amb23437123 [0,1,0,0,0,0|1,0,0]=2 818 B12R2.132 Nc1noc2ccc(O)cc12 Amb23402948 [0,1,0,0,0,0|1,0,0]=2 819 B12R2.132 Nc1noc2cnc(Cl)cc12 Amb27200444 [0,1,0,0,0,0|2,0,0]=3 820 B12R2.132 Nc1noc2ncc(Br)cc12 Amb22496187 [0,1,0,0,0,0|2,0,0]=3 821 B12R2.132 Nc1noc2ncc(Br)nc12 Amb23402297 [0,1,0,0,0,0|3,0,0]=4 822 B12R2.132 Nc1noc2ncc(Cl)nc12 Amb23402298 [0,1,0,0,0,0|3,0,0]=4 823 B12R2.132 Nc1nsc2ccc(Br)cc12 Amb19957749 [0,1,0,0,0,0|1,1,0]=3 824 B12R2.132 Nc1nsc2ccc(Cl)cc12 Amb18649045 [0,1,0,0,0,0|1,1,0]=3 825 B12R2.132 Nc1nsc2ccc(F)cc12 Amb27843689 [0,1,0,0,0,0|1,1,0]=3 826 B12R2.132 Nc1nsc2ccc(I)cc12 Amb26015003 [0,1,0,0,0,0|1,1,0]=3 827 B12R2.132 Nc1nsc2ccc(O)cc12 Amb28129921 [0,1,0,0,0,0|1,1,0]=3 828 B12R2.132 Nc1nsc2ncc(Br)cc12 Amb27840215 [0,1,0,0,0,0|2,1,0]=4 829 B12R2.132 Nc1onc2ccc(Cl)cc12 Amb28125853 [0,1,0,0,0,0|3,0,0]=4 830 B12R2.132 Nc1snc2ccc(Br)cc12 Amb22496210 [0,1,0,0,0,0|3,0,0]=4 831 B12R2.132 Nc1snc2ccc(Cl)cc12 Amb4301561 [0,1,0,0,0,0|3,0,0]=4 832 B12R2.132 Nn1ncc2ccc(F)cc21 Amb27172342 [0,1,0,0,0,0|3,0,0]=4 833 B12R2.132 O=C1C=CC2=NN=C(Br)C2=N1 Amb27208207 [0,1,0,0,0,0|3,0,0]=4 834 B12R2.132 O=C1C=Cc2ccc(O)cc21 Amb25237100 [0,1,0,0,0,0|2,0,1]=4 835 B12R2.132 O=C1CCc2ccc(Br)cc21 Amb2383532 [0,1,0,0,0,0|2,0,1]=4 836 B12R2.132 O=C1CCc2ccc(Cl)cc21 Amb2383530 [0,1,0,0,0,0|2,0,1]=4 837 B12R2.132 O=C1CCc2ccc(F)cc21 Amb2383531 [0,1,0,0,0,0|2,0,1]=4 838 B12R2.132 O=C1CCc2ccc(I)cc21 Amb10603865 [0,1,0,0,0,0|2,0,1]=4 839 B12R2.132 O=C1CCc2ccc(O)cc21 Amb2612891 [0,1,0,0,0,0|2,0,1]=4 840 B12R2.132 O=C1CNc2ccc(Br)cc21 Amb18772113 [0,1,0,0,0,0|2,0,1]=4 841 B12R2.132 O=C1CNc2ccc(F)cc21 Amb18831267 [0,1,0,0,0,0|2,0,1]=4 842 B12R2.132 O=C1COc2ccc(Br)cc21 Amb33534386 [0,1,0,0,0,0|1,0,1]=3 843 B12R2.132 O=C1COc2ccc(Cl)cc21 Amb2383540 [0,1,0,0,0,0|1,0,1]=3 844 B12R2.132 O=C1COc2ccc(Cl)nc21 Amb28322790 [0,1,0,0,0,0|2,0,1]=4 845 B12R2.132 O=C1COc2ccc(F)cc21 Amb33534384 [0,1,0,0,0,0|1,0,1]=3 846 B12R2.132 O=C1COc2ccc(O)cc21 Amb24061522 [0,1,0,0,0,0|1,0,1]=3 847 B12R2.132 O=C1COc2cnc(Cl)cc21 Amb25189287 [0,1,0,0,0,0|2,0,1]=4 848 B12R2.132 O=C1COc2ncc(Br)cc21 Amb25678464 [0,1,0,0,0,0|2,0,1]=4 849 B12R2.132 O=C1COc2ncc(F)cc21 Amb26463984 [0,1,0,0,0,0|2,0,1]=4 850 B12R2.132 O=C1CSc2ccc(Br)cc21 Amb18159426 [0,1,0,0,0,0|1,1,1]=4 851 B12R2.132 O=C1CSc2ccc(Cl)cc21 Amb18822608 [0,1,0,0,0,0|1,1,1]=4 852 B12R2.132 O=C1CSc2ccc(I)cc21 Amb27246724 [0,1,0,0,0,0|1,1,1]=4 853 B12R2.132 O=C1N=Cc2ccc(I)cc21 Amb22015255 [0,1,0,0,0,0|1,0,1]=3 854 B12R2.132 O=C1N=Cc2ccc(O)cc21 Amb22015254 [0,1,0,0,0,0|1,0,1]=3 855 B12R2.132 O=C1NCc2ccc(Br)cc21 Amb19516102 [0,1,0,0,0,0|1,0,2]=4 856 B12R2.132 O=C1NCc2ccc(Cl)cc21 Amb20241173 [0,1,0,0,0,0|1,0,2]=4 857 B12R2.132 O=C1NCc2ccc(F)cc21 Amb20171614 [0,1,0,0,0,0|1,0,2]=4 858 B12R2.132 O=C1NCc2ccc(I)cc21 Amb21963095 [0,1,0,0,0,0|1,0,2]=4 859 B12R2.132 O=C1NCc2ccc(O)cc21 Amb15690702 [0,1,0,0,0,0|1,0,2]=4 860 B12R2.132 O=C1NNc2ccc(Br)cc21 Amb22008691 [0,1,0,0,0,0|1,0,2]=4 861 B12R2.132 O=C1NNc2ccc(Cl)cc21 Amb20460273 [0,1,0,0,0,0|1,0,2]=4 862 B12R2.132 O=C1NOc2ccc(Br)cc21 Amb21858197 [0,1,0,0,0,0|0,0,2]=3 863 B12R2.132 O=C1NOc2ccc(F)cc21 Amb21857209 [0,1,0,0,0,0|0,0,2]=3 864 B12R2.132 O=C1NOc2ccc(O)cc21 Amb24440443 [0,1,0,0,0,0|0,0,2]=3 865 B12R2.132 O=C1NSc2ccc(Br)cc21 Amb24628235 [0,1,0,0,0,0|0,1,2]=4 866 B12R2.132 O=C1NSc2ccc(Cl)cc21 Amb19131194 [0,1,0,0,0,0|0,1,2]=4 867 B12R2.132 O=C1NSc2ccc(F)cc21 Amb24372116 [0,1,0,0,0,0|0,1,2]=4 868 B12R2.132 O=C1OCc2ccc(Br)cc21 Amb2692670 [0,1,0,0,0,0|2,0,1]=4 869 B12R2.132 O=C1OCc2ccc(F)cc21 Amb16232663 [0,1,0,0,0,0|2,0,1]=4 870 B12R2.132 O=C1OCc2ccc(I)cc21 Amb2692671 [0,1,0,0,0,0|2,0,1]=4 871 B12R2.132 O=C1OCc2ccc(O)cc21 Amb5718516 [0,1,0,0,0,0|2,0,1]=4 872 B12R2.132 O=C1ONc2ccc(Br)cc21 Amb28119155 [0,1,0,0,0,0|2,0,1]=4 873 B12R2.132 O=C1ONc2ccc(Cl)cc21 Amb22263320 [0,1,0,0,0,0|2,0,1]=4 874 B12R2.132 O=C1ONc2ccc(F)cc21 Amb26974015 [0,1,0,0,0,0|2,0,1]=4 875 B12R2.132 O=C1SNc2ccc(F)cc21 Amb32673853 [0,1,0,0,0,0|2,0,1]=4 876 B12R2.132 OB1OCc2ccc(Cl)cc21 Amb25330321 [0,1,0,0,0,0|3,0,0]=4 877 B12R2.132 OB1OCc2ccc(F)cc21 Amb22497413 [0,1,0,0,0,0|3,0,0]=4 878 B12R2.132 OB1OCc2ccc(O)cc21 Amb21964578 [0,1,0,0,0,0|3,0,0]=4 879 B12R2.132 OB1OCc2ccc(S)cc21 Amb33715325 [0,1,0,0,0,0|3,0,0]=4 880 B12R2.132 OC1CCc2ccc(Br)cc21 Amb17779324 [0,1,0,0,0,0|2,0,1]=4 881 B12R2.132 OC1CCc2ccc(Cl)cc21 Amb8630738 [0,1,0,0,0,0|2,0,1]=4 882 B12R2.132 OC1CCc2ccc(F)cc21 Amb17087925 [0,1,0,0,0,0|2,0,1]=4 883 B12R2.132 OC1COc2ccc(Br)cc21 Amb22059757 [0,1,0,0,0,0|1,0,1]=3 884 B12R2.132 OC1OCc2ccc(Br)cc21 Amb22751581 [0,1,0,0,0,0|2,0,1]=4 885 B12R2.132 O[C@@H]1CCc2ccc(I)cc21 Amb28369043 [0,1,0,0,0,0|2,0,1]=4 886 B12R2.132 Oc1ccc2c(c1)C(O)CO2 Amb27262935 [0,1,0,0,0,0|1,0,1]=3 887 B12R2.132 Oc1ccc2c(c1)[C@H](O)CC2 Amb35615861 [0,1,0,0,0,0|2,0,1]=4 888 B12R2.132 Oc1ccc2c(c1)[C@H](O)CO2 Amb27750231 [0,1,0,0,0,0|1,0,1]=3 889 B12R2.132 Oc1ccc2cnn(O)c2c1 Amb27803811 [0,1,0,0,0,0|2,0,0]=3 890 B12R2.132 Oc1ccc2ncc(O)n2c1 Amb27856957 [0,1,0,0,0,0|3,0,0]=4 891 B12R2.132 Oc1ccc2occ(Cl)c2c1 Amb27445869 [0,1,0,0,0,0|2,0,0]=3 892 B12R2.132 Oc1ccc2occ(O)c2c1 Amb27974579 [0,1,0,0,0,0|1,0,0]=2 893 B12R2.132 Oc1ccc2onc(I)c2c1 Amb27432705 [0,1,0,0,0,0|1,0,0]=2 894 B12R2.132 Oc1ccc2scc(Br)c2c1 Amb25114462 [0,1,0,0,0,0|2,1,0]=4 895 B12R2.132 Oc1ncc2ccc(Br)cn12 Amb35748321 [0,1,0,0,0,0|2,0,0]=3 896 B12R2.132 Oc1nnc2ccc(Cl)nn12 Amb22059310 [0,1,0,0,0,0|3,0,0]=4 897 B12R2.132 Oc1nnc2ccc(F)cn12 Amb24504893 [0,1,0,0,0,0|2,0,0]=3 898 B12R2.132 Oc1nnc2ncc(Cl)cn12 Amb24652248 [0,1,0,0,0,0|3,0,0]=4 899 B12R2.132 Oc1noc2ccc(Cl)cc12 Amb3430957 [0,1,0,0,0,0|0,0,0]=1 900 B12R2.132 Oc1noc2ccc(I)cc12 Amb26022475 [0,1,0,0,0,0|0,0,0]=1 901 B12R2.132 On1ccc2ccc(F)cc21 Amb27241747 [0,1,0,0,0,0|3,0,0]=4 902 B12R2.132 On1nnc2ccc(Cl)cc21 Amb1151732 [0,1,0,0,0,0|2,0,0]=3 903 B12R2.132 Sc1csc2ccc(Br)cc12 Amb27795186 [0,1,0,0,0,0|1,2,0]=4 904 B12R2.132 Sc1nnc2ccc(Br)cn12 Amb10067892 [0,1,0,0,0,0|2,1,0]=4 905 B12R2.132 Sc1nnc2ccc(Cl)cn12 Amb17210575 [0,1,0,0,0,0|2,1,0]=4 906 B12R2.132 Sc1noc2ccc(Br)cc12 Amb22047670 [0,1,0,0,0,0|0,1,0]=2 907 B12R2.196 Brc1cccn2c(Br)ncc12 Amb27775159 [0,1,0,0,0,0|3,0,0]=4 908 B12R2.196 Brc1csc2c(Br)cccc12 Amb28052826 [0,1,0,0,0,0|2,1,0]=4 909 B12R2.196 C=C1COc2c1ccnc2Cl Amb25983153 [0,1,0,0,0,0|3,0,0]=4 910 B12R2.196 CC1=CCc2c(F)cccc21 Amb25114614 [0,1,0,0,0,0|3,0,0]=4 911 B12R2.196 CC1COc2c(F)cccc21 Amb27410107 [0,1,0,0,0,0|2,0,1]=4 912 B12R2.196 Cc1cccc2c(Br)coc12 Amb27868647 [0,1,0,0,0,0|2,0,0]=3 913 B12R2.196 Cc1cccc2c(Br)csc12 Amb26965893 [0,1,0,0,0,0|2,1,0]=4 914 B12R2.196 Cc1cccc2c(Cl)nsc12 Amb28368750 [0,1,0,0,0,0|1,1,0]=3 915 B12R2.196 Cc1cccc2c(N)csc12 Amb23402529 [0,1,0,0,0,0|2,1,0]=4 916 B12R2.196 Cc1cccc2c(N)noc12 Amb23402947 [0,1,0,0,0,0|1,0,0]=2 917 B12R2.196 Cc1cccc2c(N)onc12 Amb27223997 [0,1,0,0,0,0|3,0,0]=4 918 B12R2.196 Cc1cccc2c(O)noc12 Amb2725209 [0,1,0,0,0,0|0,0,0]=1 919 B12R2.196 Cc1cccc2c1CCC2=O Amb4605923 [0,1,0,0,0,0|2,0,1]=4 920 B12R2.196 Cc1cccc2c1CCC2O Amb17087931 [0,1,0,0,0,0|2,0,1]=4 921 B12R2.196 Cc1cccc2c1CNC2=O Amb22229850 [0,1,0,0,0,0|1,0,2]=4 922 B12R2.196 Cc1cccc2c1COB2O Amb24591278 [0,1,0,0,0,0|3,0,0]=4 923 B12R2.196 Cc1cccc2c1COC2=O Amb16231379 [0,1,0,0,0,0|2,0,1]=4 924 B12R2.196 Cc1cccc2c1NCC2=O Amb18831418 [0,1,0,0,0,0|2,0,1]=4 925 B12R2.196 Cc1cccc2c1NSC2=O Amb32673862 [0,1,0,0,0,0|2,0,1]=4 926 B12R2.196 Cc1cccc2c1OCC2=O Amb33534388 [0,1,0,0,0,0|1,0,1]=3 927 B12R2.196 Cc1cccc2c1OCC2N Amb9735888 [0,1,0,0,0,0|2,0,1]=4 928 B12R2.196 Cc1cccc2c1OC[C@@H]2N Amb24589207 [0,1,0,0,0,0|2,0,1]=4 929 B12R2.196 Cc1cccc2c1ONC2=O Amb21857149 [0,1,0,0,0,0|0,0,2]=3 930 B12R2.196 Cc1cccc2c1SCC2=O Amb18199753 [0,1,0,0,0,0|1,1,1]=4 931 B12R2.196 Cc1cccc2c1SNC2=O Amb27966170 [0,1,0,0,0,0|0,1,2]=4 932 B12R2.196 Cc1cccc2c1nnn2C Amb23402462 [0,1,0,0,0,0|3,0,0]=4 933 B12R2.196 Cc1cccn2c(N)ncc12 Amb27469873 [0,1,0,0,0,0|3,0,0]=4 934 B12R2.196 Cc1cccn2c(S)nnc12 Amb17210571 [0,1,0,0,0,0|2,1,0]=4 935 B12R2.196 Cc1coc2c(Br)cccc12 Amb28245157 [0,1,0,0,0,0|2,0,0]=3 936 B12R2.196 Cc1coc2c(I)cccc12 Amb27823712 [0,1,0,0,0,0|2,0,0]=3 937 B12R2.196 Cc1coc2c(O)cccc12 Amb27948727 [0,1,0,0,0,0|2,0,0]=3 938 B12R2.196 Cc1csc2c(Br)cccc12 Amb22500032 [0,1,0,0,0,0|2,1,0]=4 939 B12R2.196 Cc1csc2c(N)cccc12 Amb18645930 [0,1,0,0,0,0|2,1,0]=4 940 B12R2.196 Cc1csc2c(O)cccc12 Amb24097251 [0,1,0,0,0,0|2,1,0]=4 941 B12R2.196 Cc1nccc2c1OCC2=O Amb27228818 [0,1,0,0,0,0|2,0,1]=4 942 B12R2.196 Cc1nnc2c(Br)cccn12 Amb23439224 [0,1,0,0,0,0|3,0,0]=4 943 B12R2.196 Cc1nnc2c(Cl)cccn12 Amb10067449 [0,1,0,0,0,0|3,0,0]=4 944 B12R2.196 Cc1nnc2c(F)cccn12 Amb28072647 [0,1,0,0,0,0|3,0,0]=4 945 B12R2.196 Cc1nnc2c(N)cccn12 Amb15701573 [0,1,0,0,0,0|3,0,0]=4 946 B12R2.196 Cc1nnn2c(Br)cccc12 Amb18175466 [0,1,0,0,0,0|3,0,0]=4 947 B12R2.196 Cc1nnn2c(I)cccc12 Amb27592828 [0,1,0,0,0,0|3,0,0]=4 948 B12R2.196 Cc1noc2c(Br)cccc12 Amb26373010 [0,1,0,0,0,0|1,0,0]=2 949 B12R2.196 Cc1noc2c(Br)ccnc12 Amb18770215 [0,1,0,0,0,0|2,0,0]=3 950 B12R2.196 Cc1noc2c(Br)cncc12 Amb18172243 [0,1,0,0,0,0|2,0,0]=3 951 B12R2.196 Cc1noc2c(C)cccc12 Amb27618942 [0,1,0,0,0,0|1,0,0]=2 952 B12R2.196 Cc1noc2c(Cl)cccc12 Amb26421958 [0,1,0,0,0,0|1,0,0]=2 953 B12R2.196 Cc1noc2c(Cl)ncnc12 Amb27860462 [0,1,0,0,0,0|3,0,0]=4 954 B12R2.196 Cc1noc2c(Cl)nncc12 Amb27803861 [0,1,0,0,0,0|3,0,0]=4 955 B12R2.196 Cc1noc2c(N)ccnc12 Amb28202652 [0,1,0,0,0,0|2,0,0]=3 956 B12R2.196 Cc1noc2c1C=NNC2=O Amb25081624 [0,1,0,0,0,0|3,0,0]=4 957 B12R2.196 Cc1nsc2c(Br)cccc12 Amb24432090 [0,1,0,0,0,0|1,1,0]=3 958 B12R2.196 Cc1nsc2c(Br)ccnc12 Amb18159416 [0,1,0,0,0,0|2,1,0]=4 959 B12R2.196 Cc1nsc2c(C)cccc12 Amb24549331 [0,1,0,0,0,0|1,1,0]=3 960 B12R2.196 Clc1cccc2c(Br)noc12 Amb26887681 [0,1,0,0,0,0|1,0,0]=2 961 B12R2.196 Clc1cccn2c(Br)nnc12 Amb32721156 [0,1,0,0,0,0|3,0,0]=4 962 B12R2.196 Clc1cccn2c(Cl)nnc12 Amb26381665 [0,1,0,0,0,0|3,0,0]=4 963 B12R2.196 Clc1coc2c(Br)cccc12 Amb18745466 [0,1,0,0,0,0|2,0,0]=3 964 B12R2.196 Clc1nnc2c(Br)cccn12 Amb23439783 [0,1,0,0,0,0|3,0,0]=4 965 B12R2.196 Clc1noc2c(Br)cccc12 Amb22233561 [0,1,0,0,0,0|1,0,0]=2 966 B12R2.196 Clc1nsc2c(Br)cccc12 Amb32710062 [0,1,0,0,0,0|1,1,0]=3 967 B12R2.196 Clc1nsc2c(Cl)cccc12 Amb24517140 [0,1,0,0,0,0|1,1,0]=3 968 B12R2.196 Cn1ncc2c(Br)cccc21 Amb10067306 [0,1,0,0,0,0|3,0,0]=4 969 B12R2.196 Cn1ncc2c(Cl)cccc21 Amb10069418 [0,1,0,0,0,0|3,0,0]=4 970 B12R2.196 Cn1ncc2c(F)cccc21 Amb21864867 [0,1,0,0,0,0|3,0,0]=4 971 B12R2.196 Cn1ncc2c(I)cccc21 Amb19958177 [0,1,0,0,0,0|3,0,0]=4 972 B12R2.196 Cn1ncc2c(N)cccc21 Amb8630405 [0,1,0,0,0,0|3,0,0]=4 973 B12R2.196 Cn1ncc2c(O)cccc21 Amb10070481 [0,1,0,0,0,0|3,0,0]=4 974 B12R2.196 Cn1nnc2c(Br)cccc21 Amb23580646 [0,1,0,0,0,0|3,0,0]=4 975 B12R2.196 Cn1nnc2c(I)cccc21 Amb32685586 [0,1,0,0,0,0|3,0,0]=4 976 B12R2.196 Cn1nnc2c(N)cccc21 Amb19516892 [0,1,0,0,0,0|3,0,0]=4 977 B12R2.196 Cn1nnc2c(O)cccc21 Amb27836781 [0,1,0,0,0,0|3,0,0]=4 978 B12R2.196 Fc1cccc2c(Br)coc12 Amb28364458 [0,1,0,0,0,0|2,0,0]=3 979 B12R2.196 Fc1cccc2c(Br)csc12 Amb25973316 [0,1,0,0,0,0|2,1,0]=4 980 B12R2.196 Fc1cccc2c(Br)noc12 Amb25147906 [0,1,0,0,0,0|1,0,0]=2 981 B12R2.196 Fc1cccc2c(Cl)nsc12 Amb32710043 [0,1,0,0,0,0|1,1,0]=3 982 B12R2.196 Fc1cccn2c(Cl)nnc12 Amb27444536 [0,1,0,0,0,0|3,0,0]=4 983 B12R2.196 NC1COc2c(Br)cccc21 Amb31028992 [0,1,0,0,0,0|2,0,1]=4 984 B12R2.196 NC1COc2c(Br)cccc21 Amb6683475 [0,1,0,0,0,0|2,0,1]=4 985 B12R2.196 NC1COc2c(Cl)cccc21 Amb20626374 [0,1,0,0,0,0|2,0,1]=4 986 B12R2.196 NC1COc2c(Cl)cccc21 Amb2383238 [0,1,0,0,0,0|2,0,1]=4 987 B12R2.196 NC1COc2c(O)cccc21 Amb27873968 [0,1,0,0,0,0|2,0,1]=4 988 B12R2.196 N[C@@H]1COc2c(Br)cccc21 Amb31028978 [0,1,0,0,0,0|2,0,1]=4 989 B12R2.196 N[C@@H]1COc2c(Cl)cccc21 Amb30633907 [0,1,0,0,0,0|2,0,1]=4 990 B12R2.196 N[C@@H]1COc2c(F)cccc21 Amb25060202 [0,1,0,0,0,0|2,0,1]=4 991 B12R2.196 N[C@H]1COc2c(Br)cccc21 Amb26395931 [0,1,0,0,0,0|2,0,1]=4 992 B12R2.196 N[C@H]1COc2c(Cl)cccc21 Amb26433495 [0,1,0,0,0,0|2,0,1]=4 993 B12R2.196 N[C@H]1COc2c(Cl)cccc21 Amb33872075 [0,1,0,0,0,0|2,0,1]=4 994 B12R2.196 N[C@H]1COc2c(F)cccc21 Amb26478564 [0,1,0,0,0,0|2,0,1]=4 995 B12R2.196 N[C@H]1COc2c(F)cccc21 Amb33872073 [0,1,0,0,0,0|2,0,1]=4 996 B12R2.196 N[C@H]1COc2c(O)cccc21 Amb28145808 [0,1,0,0,0,0|2,0,1]=4 997 B12R2.196 Nc1cccc2c(=O)nnc12 Amb24082852 [0,1,0,0,0,0|1,0,1]=3 998 B12R2.196 Nc1cccc2c(Br)coc12 Amb17571389 [0,1,0,0,0,0|2,0,0]=3 999 B12R2.196 Nc1cccc2c(Br)csc12 Amb25893328 [0,1,0,0,0,0|2,1,0]=4 1000 B12R2.196 Nc1cccc2c(Cl)ncn12 Amb27445967 [0,1,0,0,0,0|3,0,0]=4 1001 B12R2.196 Nc1cccc2c(Cl)noc12 Amb27224270 [0,1,0,0,0,0|1,0,0]=2 1002 B12R2.196 Nc1cccc2c1C=NC2=O Amb28456561 [0,1,0,0,0,0|1,0,1]=3 1003 B12R2.196 Nc1cccc2c1CCC2=O Amb10067615 [0,1,0,0,0,0|2,0,1]=4 1004 B12R2.196 Nc1cccc2c1CNC2=O Amb9677786 [0,1,0,0,0,0|1,0,2]=4 1005 B12R2.196 Nc1cccc2c1COB2O Amb27176247 [0,1,0,0,0,0|3,0,0]=4 1006 B12R2.196 Nc1cccc2c1COC2=O Amb5718521 [0,1,0,0,0,0|2,0,1]=4 1007 B12R2.196 Nc1cccc2c1CSC2=O Amb28055839 [0,1,0,0,0,0|2,0,1]=4 1008 B12R2.196 Nc1cccc2c1OCC2=O Amb18202194 [0,1,0,0,0,0|1,0,1]=3 1009 B12R2.196 Nc1cccc2c1OC[C@@H]2N Amb27786360 [0,1,0,0,0,0|2,0,1]=4 1010 B12R2.196 Nc1cccc2c1SCC2=O Amb18199701 [0,1,0,0,0,0|1,1,1]=4 1011 B12R2.196 Nc1cccc2c1cnn2N Amb27639020 [0,1,0,0,0,0|3,0,0]=4 1012 B12R2.196 Nc1cccc2c1cnn2O Amb27967639 [0,1,0,0,0,0|2,0,0]=3 1013 B12R2.196 Nc1csc2c(Br)cccc12 Amb23402524 [0,1,0,0,0,0|2,1,0]=4 1014 B12R2.196 Nc1csc2c(Cl)cccc12 Amb23403636 [0,1,0,0,0,0|2,1,0]=4 1015 B12R2.196 Nc1csc2c(F)cccc12 Amb23402525 [0,1,0,0,0,0|2,1,0]=4 1016 B12R2.196 Nc1csc2c(N)cccc12 Amb32708791 [0,1,0,0,0,0|2,1,0]=4 1017 B12R2.196 Nc1noc2c(Br)cccc12 Amb22495985 [0,1,0,0,0,0|1,0,0]=2 1018 B12R2.196 Nc1noc2c(Br)nccc12 Amb27621177 [0,1,0,0,0,0|2,0,0]=3 1019 B12R2.196 Nc1noc2c(F)cccc12 Amb22057523 [0,1,0,0,0,0|1,0,0]=2 1020 B12R2.196 Nc1noc2c(I)cccc12 Amb23402958 [0,1,0,0,0,0|1,0,0]=2 1021 B12R2.196 Nc1noc2c(O)cccc12 Amb23402969 [0,1,0,0,0,0|1,0,0]=2 1022 B12R2.196 Nc1nsc2c(Cl)cccc12 Amb24366043 [0,1,0,0,0,0|1,1,0]=3 1023 B12R2.196 Nc1nsc2c(F)cccc12 Amb26507952 [0,1,0,0,0,0|1,1,0]=3 1024 B12R2.196 Nn1ncc2c(Cl)cccc21 Amb26853083 [0,1,0,0,0,0|3,0,0]=4 1025 B12R2.196 Nn1ncc2c(O)cccc21 Amb27642764 [0,1,0,0,0,0|3,0,0]=4 1026 B12R2.196 O=C1CCc2c(Br)cccc21 Amb6683468 [0,1,0,0,0,0|2,0,1]=4 1027 B12R2.196 O=C1CCc2c(Cl)cccc21 Amb2383535 [0,1,0,0,0,0|2,0,1]=4 1028 B12R2.196 O=C1CCc2c(F)cccc21 Amb2383536 [0,1,0,0,0,0|2,0,1]=4 1029 B12R2.196 O=C1CCc2c(O)cccc21 Amb1158068 [0,1,0,0,0,0|2,0,1]=4 1030 B12R2.196 O=C1CNc2c(F)cccc21 Amb18201774 [0,1,0,0,0,0|2,0,1]=4 1031 B12R2.196 O=C1COc2c(Br)cccc21 Amb33534390 [0,1,0,0,0,0|1,0,1]=3 1032 B12R2.196 O=C1COc2c(Cl)cccc21 Amb33534389 [0,1,0,0,0,0|1,0,1]=3 1033 B12R2.196 O=C1COc2c(F)cccc21 Amb2383546 [0,1,0,0,0,0|1,0,1]=3 1034 B12R2.196 O=C1COc2c(O)cccc21 Amb22490978 [0,1,0,0,0,0|1,0,1]=3 1035 B12R2.196 O=C1CSc2c(Br)cccc21 Amb18159421 [0,1,0,0,0,0|1,1,1]=4 1036 B12R2.196 O=C1CSc2c(Cl)cccc21 Amb18822582 [0,1,0,0,0,0|1,1,1]=4 1037 B12R2.196 O=C1CSc2c(F)cccc21 Amb23597480 [0,1,0,0,0,0|1,1,1]=4 1038 B12R2.196 O=C1NCCc2c(O)noc21 Amb24484894 [0,1,0,0,0,0|1,0,2]=4 1039 B12R2.196 O=C1NCc2c(Br)cccc21 Amb15693064 [0,1,0,0,0,0|1,0,2]=4 1040 B12R2.196 O=C1NCc2c(Cl)cccc21 Amb21858351 [0,1,0,0,0,0|1,0,2]=4 1041 B12R2.196 O=C1NCc2c(F)cccc21 Amb22008629 [0,1,0,0,0,0|1,0,2]=4 1042 B12R2.196 O=C1NCc2c(O)cccc21 Amb21858279 [0,1,0,0,0,0|1,0,2]=4 1043 B12R2.196 O=C1NNc2c(Br)cccc21 Amb22170435 [0,1,0,0,0,0|1,0,2]=4 1044 B12R2.196 O=C1NNc2c(F)cccc21 Amb22738649 [0,1,0,0,0,0|1,0,2]=4 1045 B12R2.196 O=C1NOc2c(Cl)cccc21 Amb22489850 [0,1,0,0,0,0|0,0,2]=3 1046 B12R2.196 O=C1NOc2c(F)cccc21 Amb21857207 [0,1,0,0,0,0|0,0,2]=3 1047 B12R2.196 O=C1NOc2c(I)cccc21 Amb27813751 [0,1,0,0,0,0|0,0,2]=3 1048 B12R2.196 O=C1NSc2c(Br)cccc21 Amb32710021 [0,1,0,0,0,0|0,1,2]=4 1049 B12R2.196 O=C1NSc2c(Cl)cccc21 Amb26570552 [0,1,0,0,0,0|0,1,2]=4 1050 B12R2.196 O=C1NSc2c(F)cccc21 Amb27670276 [0,1,0,0,0,0|0,1,2]=4 1051 B12R2.196 O=C1OCc2c(Br)cccc21 Amb6296519 [0,1,0,0,0,0|2,0,1]=4 1052 B12R2.196 O=C1OCc2c(Cl)cccc21 Amb16232645 [0,1,0,0,0,0|2,0,1]=4 1053 B12R2.196 O=C1OCc2c(F)cccc21 Amb22756851 [0,1,0,0,0,0|2,0,1]=4 1054 B12R2.196 O=C1SNc2c(F)cccc21 Amb32673867 [0,1,0,0,0,0|2,0,1]=4 1055 B12R2.196 OB1OCc2c(Br)cccc21 Amb27153180 [0,1,0,0,0,0|3,0,0]=4 1056 B12R2.196 OB1OCc2c(Cl)cccc21 Amb26322413 [0,1,0,0,0,0|3,0,0]=4 1057 B12R2.196 OB1OCc2c(F)cccc21 Amb28200971 [0,1,0,0,0,0|3,0,0]=4 1058 B12R2.196 OB1OCc2c(O)cccc21 Amb25319915 [0,1,0,0,0,0|3,0,0]=4 1059 B12R2.196 OC1CCc2c(Br)cccc21 Amb20171517 [0,1,0,0,0,0|2,0,1]=4 1060 B12R2.196 OC1CCc2c(Cl)cccc21 Amb17087934 [0,1,0,0,0,0|2,0,1]=4 1061 B12R2.196 OC1CCc2c(F)cccc21 Amb17087933 [0,1,0,0,0,0|2,0,1]=4 1062 B12R2.196 OC1COc2c(Br)cccc21 Amb22751583 [0,1,0,0,0,0|1,0,1]=3 1063 B12R2.196 O[C@@H]1CCc2c(Br)cccc21 Amb22756414 [0,1,0,0,0,0|2,0,1]=4 1064 B12R2.196 O[C@@H]1CCc2c(Cl)cccc21 Amb13953026 [0,1,0,0,0,0|2,0,1]=4 1065 B12R2.196 O[C@@H]1CCc2c(F)cccc21 Amb24432762 [0,1,0,0,0,0|2,0,1]=4 1066 B12R2.196 O[C@H]1CCc2c(Br)cccc21 Amb27596691 [0,1,0,0,0,0|2,0,1]=4 1067 B12R2.196 O[C@H]1CCc2c(Cl)cccc21 Amb13953025 [0,1,0,0,0,0|2,0,1]=4 1068 B12R2.196 O[C@H]1CCc2c(F)cccc21 Amb27664626 [0,1,0,0,0,0|2,0,1]=4 1069 B12R2.196 Oc1cccc2c(Cl)coc12 Amb28368780 [0,1,0,0,0,0|2,0,0]=3 1070 B12R2.196 Oc1cccc2c1CCN2O Amb27971133 [0,1,0,0,0,0|3,0,0]=4 1071 B12R2.196 Oc1cccc2c1ccn2O Amb28051708 [0,1,0,0,0,0|3,0,0]=4 1072 B12R2.196 Oc1cccc2c1cnn2O Amb26512100 [0,1,0,0,0,0|2,0,0]=3 1073 B12R2.196 Oc1nnc2c(Cl)cccn12 Amb20669219 [0,1,0,0,0,0|2,0,0]=3 1074 B12R2.196 On1nnc2c(Cl)cccc21 Amb1098986 [0,1,0,0,0,0|2,0,0]=3 1075 B12R2.196 Sc1csc2c(Br)cccc12 Amb27174387 [0,1,0,0,0,0|1,2,0]=4 1076 B12R2.196 Sc1csc2c(Cl)cccc12 Amb27847193 [0,1,0,0,0,0|1,2,0]=4 1077 B12R2.196 Sc1nnc2c(Cl)cccn12 Amb29879509 [0,1,0,0,0,0|2,1,0]=4 1078 B12R2.196 [O-]n1nnc2c(Cl)cccc21 Amb32409879 [0,1,0,0,0,0|2,0,1]=4 1079 B12R2.203 Brc1cccc2occ(Br)c12 Amb27953022 [0,1,0,0,0,0|2,0,0]=3 1080 B12R2.203 Brc1cccc2onc(Br)c12 Amb28423953 [0,1,0,0,0,0|1,0,0]=2 1081 B12R2.203 Brc1cccc2scc(Br)c12 Amb28287812 [0,1,0,0,0,0|2,1,0]=4 1082 B12R2.203 Brc1cccc2scc(I)c12 Amb28255791 [0,1,0,0,0,0|2,1,0]=4 1083 B12R2.203 CC1=C2C(=O)N=CC=C2ON1 Amb25322836 [0,1,0,0,0,0|2,0,1]=4 1084 B12R2.203 CC1=CCc2cccc(C)c21 Amb27951780 [0,1,0,0,0,0|3,0,0]=4 1085 B12R2.203 Cc1cccc2c1B(O)OC2 Amb25726432 [0,1,0,0,0,0|3,0,0]=4 1086 B12R2.203 Cc1cccc2c1C(=N)NN2 Amb24413143 [0,1,0,0,0,0|2,0,1]=4 1087 B12R2.203 Cc1cccc2c1C(=O)CC2 Amb16232631 [0,1,0,0,0,0|2,0,1]=4 1088 B12R2.203 Cc1cccc2c1C(=O)CO2 Amb18202264 [0,1,0,0,0,0|1,0,1]=3 1089 B12R2.203 Cc1cccc2c1C(=O)CS2 Amb18199755 [0,1,0,0,0,0|1,1,1]=4 1090 B12R2.203 Cc1cccc2c1C(=O)NC2 Amb22230158 [0,1,0,0,0,0|1,0,2]=4 1091 B12R2.203 Cc1cccc2c1C(=O)OC2 Amb2608975 [0,1,0,0,0,0|2,0,1]=4 1092 B12R2.203 Cc1cccc2c1C(=O)SN2 Amb32673870 [0,1,0,0,0,0|2,0,1]=4 1093 B12R2.203 Cc1cccc2c1C(O)CC2 Amb22886909 [0,1,0,0,0,0|2,0,1]=4 1094 B12R2.203 Cc1cccc2cnn(C)c12 Amb23402127 [0,1,0,0,0,0|3,0,0]=4 1095 B12R2.203 Cc1cccc2cnn(N)c12 Amb27975384 [0,1,0,0,0,0|3,0,0]=4 1096 B12R2.203 Cc1cccc2nnc(Br)n12 Amb32721159 [0,1,0,0,0,0|3,0,0]=4 1097 B12R2.203 Cc1cccc2nnc(Cl)n12 Amb27210989 [0,1,0,0,0,0|3,0,0]=4 1098 B12R2.203 Cc1cccc2nnc(N)n12 Amb28340503 [0,1,0,0,0,0|3,0,0]=4 1099 B12R2.203 Cc1cccc2nnc(O)n12 Amb27972303 [0,1,0,0,0,0|2,0,0]=3 1100 B12R2.203 Cc1cccc2nnc(S)n12 Amb17210573 [0,1,0,0,0,0|2,1,0]=4 1101 B12R2.203 Cc1cccc2nnn(C)c12 Amb23402465 [0,1,0,0,0,0|3,0,0]=4 1102 B12R2.203 Cc1cccc2noc(N)c12 Amb28436541 [0,1,0,0,0,0|3,0,0]=4 1103 B12R2.203 Cc1cccc2occ(Br)c12 Amb18176125 [0,1,0,0,0,0|2,0,0]=3 1104 B12R2.203 Cc1cccc2onc(N)c12 Amb21857265 [0,1,0,0,0,0|1,0,0]=2 1105 B12R2.203 Cc1cccc2onc(O)c12 Amb21857266 [0,1,0,0,0,0|0,0,0]=1 1106 B12R2.203 Cc1cccc2scc(Br)c12 Amb28368810 [0,1,0,0,0,0|2,1,0]=4 1107 B12R2.203 Cc1cccc2scc(Cl)c12 Amb22498045 [0,1,0,0,0,0|2,1,0]=4 1108 B12R2.203 Cc1cccc2scc(N)c12 Amb23402526 [0,1,0,0,0,0|2,1,0]=4 1109 B12R2.203 Cc1cccc2snc(Br)c12 Amb24334877 [0,1,0,0,0,0|1,1,0]=3 1110 B12R2.203 Cc1cccn2cnc(N)c12 Amb27851575 [0,1,0,0,0,0|3,0,0]=4 1111 B12R2.203 Cc1ccnc2nnc(O)n12 Amb28046023 [0,1,0,0,0,0|3,0,0]=4 1112 B12R2.203 Cc1ccnc2onc(N)c12 Amb17232052 [0,1,0,0,0,0|2,0,0]=3 1113 B12R2.203 Cc1ccnc2snc(Br)c12 Amb23452761 [0,1,0,0,0,0|2,1,0]=4 1114 B12R2.203 Cc1coc2cccc(Br)c12 Amb18773208 [0,1,0,0,0,0|2,0,0]=3 1115 B12R2.203 Cc1coc2cccc(N)c12 Amb18202307 [0,1,0,0,0,0|2,0,0]=3 1116 B12R2.203 Cc1csc2cccc(Br)c12 Amb28128399 [0,1,0,0,0,0|2,1,0]=4 1117 B12R2.203 Cc1csc2cccc(Cl)c12 Amb27273547 [0,1,0,0,0,0|2,1,0]=4 1118 B12R2.203 Cc1csc2cccc(O)c12 Amb18126406 [0,1,0,0,0,0|2,1,0]=4 1119 B12R2.203 Cc1ncc2cccc(N)n12 Amb27209637 [0,1,0,0,0,0|3,0,0]=4 1120 B12R2.203 Cc1ncn2cccc(N)c12 Amb27246736 [0,1,0,0,0,0|3,0,0]=4 1121 B12R2.203 Cc1nnc2cccc(Br)n12 Amb22261495 [0,1,0,0,0,0|3,0,0]=4 1122 B12R2.203 Cc1nnc2cccc(Cl)n12 Amb22752360 [0,1,0,0,0,0|3,0,0]=4 1123 B12R2.203 Cc1nnc2cccc(N)n12 Amb25942246 [0,1,0,0,0,0|3,0,0]=4 1124 B12R2.203 Cc1nnn2cccc(Br)c12 Amb18175461 [0,1,0,0,0,0|3,0,0]=4 1125 B12R2.203 Cc1noc2c1C(=O)NC=C2 Amb25360807 [0,1,0,0,0,0|2,0,0]=3 1126 B12R2.203 Cc1noc2c1C(=O)NC=N2 Amb19516909 [0,1,0,0,0,0|3,0,0]=4 1127 B12R2.203 Cc1noc2c1C(=O)NN=C2 Amb22641046 [0,1,0,0,0,0|3,0,0]=4 1128 B12R2.203 Cc1noc2c1C(=S)NC=N2 Amb19668729 [0,1,0,0,0,0|3,0,0]=4 1129 B12R2.203 Cc1noc2c1C(O)=CCC2 Amb4478519 [0,1,0,0,0,0|1,0,2]=4 1130 B12R2.203 Cc1noc2cccc(Br)c12 Amb18772114 [0,1,0,0,0,0|1,0,0]=2 1131 B12R2.203 Cc1noc2cccc(O)c12 Amb18124945 [0,1,0,0,0,0|1,0,0]=2 1132 B12R2.203 Cc1noc2ccnc(Cl)c12 Amb27960888 [0,1,0,0,0,0|2,0,0]=3 1133 B12R2.203 Cc1noc2nccc(Br)c12 Amb27631736 [0,1,0,0,0,0|2,0,0]=3 1134 B12R2.203 Cc1noc2ncnc(Br)c12 Amb18770515 [0,1,0,0,0,0|3,0,0]=4 1135 B12R2.203 Cc1noc2ncnc(Cl)c12 Amb17622044 [0,1,0,0,0,0|3,0,0]=4 1136 B12R2.203 Cc1noc2ncnc(N)c12 Amb9781852 [0,1,0,0,0,0|3,0,0]=4 1137 B12R2.203 Cc1nsc2cccc(Br)c12 Amb18747251 [0,1,0,0,0,0|1,1,0]=3 1138 B12R2.203 Cc1nsc2cccc(O)c12 Amb27861019 [0,1,0,0,0,0|1,1,0]=3 1139 B12R2.203 Cc1nsc2nccc(N)c12 Amb27851697 [0,1,0,0,0,0|2,1,0]=4 1140 B12R2.203 Clc1cccc2nnc(Br)n12 Amb22752365 [0,1,0,0,0,0|3,0,0]=4 1141 B12R2.203 Clc1cccc2occ(Br)c12 Amb18745540 [0,1,0,0,0,0|2,0,0]=3 1142 B12R2.203 Clc1cccc2onc(Br)c12 Amb26420905 [0,1,0,0,0,0|1,0,0]=2 1143 B12R2.203 Clc1cccc2onc(Cl)c12 Amb22276075 [0,1,0,0,0,0|1,0,0]=2 1144 B12R2.203 Clc1cccc2snc(Cl)c12 Amb22468735 [0,1,0,0,0,0|1,1,0]=3 1145 B12R2.203 Clc1coc2cccc(Br)c12 Amb18745475 [0,1,0,0,0,0|2,0,0]=3 1146 B12R2.203 Clc1nccc2occ(Br)c12 Amb19958326 [0,1,0,0,0,0|3,0,0]=4 1147 B12R2.203 Clc1noc2cccc(Br)c12 Amb22496080 [0,1,0,0,0,0|1,0,0]=2 1148 B12R2.203 Clc1nsc2cccc(Br)c12 Amb32710058 [0,1,0,0,0,0|1,1,0]=3 1149 B12R2.203 Cn1ncc2cccc(Br)c21 Amb10067311 [0,1,0,0,0,0|3,0,0]=4 1150 B12R2.203 Cn1ncc2cccc(F)c21 Amb21857965 [0,1,0,0,0,0|3,0,0]=4 1151 B12R2.203 Cn1ncc2cccc(I)c21 Amb23402125 [0,1,0,0,0,0|3,0,0]=4 1152 B12R2.203 Cn1ncc2cccc(N)c21 Amb10067307 [0,1,0,0,0,0|3,0,0]=4 1153 B12R2.203 Cn1ncc2cccc(O)c21 Amb10070492 [0,1,0,0,0,0|3,0,0]=4 1154 B12R2.203 Cn1nnc2cccc(Br)c21 Amb23540945 [0,1,0,0,0,0|3,0,0]=4 1155 B12R2.203 Cn1nnc2cccc(Cl)c21 Amb35749456 [0,1,0,0,0,0|3,0,0]=4 1156 B12R2.203 Cn1nnc2cccc(N)c21 Amb20619644 [0,1,0,0,0,0|3,0,0]=4 1157 B12R2.203 Fc1cccc2cnc(Br)n12 Amb27623512 [0,1,0,0,0,0|3,0,0]=4 1158 B12R2.203 Fc1cccc2onc(Cl)c12 Amb21857206 [0,1,0,0,0,0|1,0,0]=2 1159 B12R2.203 Fc1cccc2scc(Br)c12 Amb24679290 [0,1,0,0,0,0|2,1,0]=4 1160 B12R2.203 Fc1cccc2snc(Cl)c12 Amb32710041 [0,1,0,0,0,0|1,1,0]=3 1161 B12R2.203 NC1COc2cccc(Br)c21 Amb24428244 [0,1,0,0,0,0|2,0,1]=4 1162 B12R2.203 NC1COc2cccc(Cl)c21 Amb26033515 [0,1,0,0,0,0|2,0,1]=4 1163 B12R2.203 NC1COc2cccc(Cl)c21 Amb28872333 [0,1,0,0,0,0|2,0,1]=4 1164 B12R2.203 NC1COc2cccc(F)c21 Amb27657791 [0,1,0,0,0,0|2,0,1]=4 1165 B12R2.203 NC1COc2cccc(F)c21 Amb31291603 [0,1,0,0,0,0|2,0,1]=4 1166 B12R2.203 NC1COc2cccc(I)c21 Amb27202715 [0,1,0,0,0,0|2,0,1]=4 1167 B12R2.203 NC1COc2cccc(O)c21 Amb27426677 [0,1,0,0,0,0|2,0,1]=4 1168 B12R2.203 N[C@@H]1COc2cccc(Br)c21 Amb27259296 [0,1,0,0,0,0|2,0,1]=4 1169 B12R2.203 N[C@@H]1COc2cccc(Cl)c21 Amb25335511 [0,1,0,0,0,0|2,0,1]=4 1170 B12R2.203 N[C@@H]1COc2cccc(F)c21 Amb24377677 [0,1,0,0,0,0|2,0,1]=4 1171 B12R2.203 N[C@@H]1COc2cccc(O)c21 Amb27860300 [0,1,0,0,0,0|2,0,1]=4 1172 B12R2.203 N[C@H]1COc2cccc(Br)c21 Amb25322414 [0,1,0,0,0,0|2,0,1]=4 1173 B12R2.203 N[C@H]1COc2cccc(Cl)c21 Amb25923232 [0,1,0,0,0,0|2,0,1]=4 1174 B12R2.203 N[C@H]1COc2cccc(Cl)c21 Amb33872074 [0,1,0,0,0,0|2,0,1]=4 1175 B12R2.203 N[C@H]1COc2cccc(F)c21 Amb28291445 [0,1,0,0,0,0|2,0,1]=4 1176 B12R2.203 N[C@H]1COc2cccc(F)c21 Amb33872072 [0,1,0,0,0,0|2,0,1]=4 1177 B12R2.203 Nc1cccc2c1B(O)OC2 Amb26326569 [0,1,0,0,0,0|3,0,0]=4 1178 B12R2.203 Nc1cccc2c1C(=O)CC2 Amb10603890 [0,1,0,0,0,0|2,0,1]=4 1179 B12R2.203 Nc1cccc2c1C(=O)CO2 Amb27969163 [0,1,0,0,0,0|1,0,1]=3 1180 B12R2.203 Nc1cccc2c1C(=O)NC2 Amb2372743 [0,1,0,0,0,0|1,0,2]=4 1181 B12R2.203 Nc1cccc2c1C(=O)OC2 Amb16232974 [0,1,0,0,0,0|2,0,1]=4 1182 B12R2.203 Nc1cccc2c1C(O)CC2 Amb28364281 [0,1,0,0,0,0|2,0,1]=4 1183 B12R2.203 Nc1cccc2c1[C@@H](N)CO2 Amb27644692 [0,1,0,0,0,0|2,0,1]=4 1184 B12R2.203 Nc1cccc2ncn(O)c12 Amb24391185 [0,1,0,0,0,0|3,0,0]=4 1185 B12R2.203 Nc1cccc2nnc(Cl)n12 Amb27962686 [0,1,0,0,0,0|3,0,0]=4 1186 B12R2.203 Nc1cccc2nnn(I)c12 Amb26553018 [0,1,0,0,0,0|3,0,0]=4 1187 B12R2.203 Nc1cccc2onc(Cl)c12 Amb28053226 [0,1,0,0,0,0|1,0,0]=2 1188 B12R2.203 Nc1cccc2onc(N)c12 Amb27796374 [0,1,0,0,0,0|1,0,0]=2 1189 B12R2.203 Nc1cccc2scc(Br)c12 Amb26391250 [0,1,0,0,0,0|2,1,0]=4 1190 B12R2.203 Nc1cccn2cnc(Cl)c12 Amb25911395 [0,1,0,0,0,0|3,0,0]=4 1191 B12R2.203 Nc1ccnc2onc(Br)c12 Amb27646715 [0,1,0,0,0,0|2,0,0]=3 1192 B12R2.203 Nc1csc2cccc(Cl)c12 Amb23403646 [0,1,0,0,0,0|2,1,0]=4 1193 B12R2.203 Nc1csc2cccc(F)c12 Amb23403637 [0,1,0,0,0,0|2,1,0]=4 1194 B12R2.203 Nc1csc2cccc(O)c12 Amb28321077 [0,1,0,0,0,0|2,1,0]=4 1195 B12R2.203 Nc1ncc2cccc(F)n12 Amb27638845 [0,1,0,0,0,0|3,0,0]=4 1196 B12R2.203 Nc1nccc2occ(Br)c12 Amb21963847 [0,1,0,0,0,0|3,0,0]=4 1197 B12R2.203 Nc1nnc2cccc(Cl)n12 Amb12805601 [0,1,0,0,0,0|3,0,0]=4 1198 B12R2.203 Nc1noc2cccc(Br)c12 Amb10975859 [0,1,0,0,0,0|1,0,0]=2 1199 B12R2.203 Nc1noc2cccc(Cl)c12 Amb8840665 [0,1,0,0,0,0|1,0,0]=2 1200 B12R2.203 Nc1noc2cccc(F)c12 Amb2606144 [0,1,0,0,0,0|1,0,0]=2 1201 B12R2.203 Nc1noc2cccc(I)c12 Amb8630007 [0,1,0,0,0,0|1,0,0]=2 1202 B12R2.203 Nc1noc2cccc(O)c12 Amb23402967 [0,1,0,0,0,0|1,0,0]=2 1203 B12R2.203 Nc1noc2ccnc(Cl)c12 Amb23402295 [0,1,0,0,0,0|2,0,0]=3 1204 B12R2.203 Nc1noc2nccc(I)c12 Amb23402293 [0,1,0,0,0,0|2,0,0]=3 1205 B12R2.203 Nc1nsc2cccc(Br)c12 Amb27492963 [0,1,0,0,0,0|1,1,0]=3 1206 B12R2.203 Nc1nsc2cccc(Cl)c12 Amb25689849 [0,1,0,0,0,0|1,1,0]=3 1207 B12R2.203 Nc1nsc2cccc(F)c12 Amb24551862 [0,1,0,0,0,0|1,1,0]=3 1208 B12R2.203 Nc1nsc2cccc(I)c12 Amb27866290 [0,1,0,0,0,0|1,1,0]=3 1209 B12R2.203 Nc1nsc2nccc(I)c12 Amb23402300 [0,1,0,0,0,0|2,1,0]=4 1210 B12R2.203 Nc1onc2cccc(Br)c12 Amb27399642 [0,1,0,0,0,0|3,0,0]=4 1211 B12R2.203 O=C1C=Cc2cccc(O)c21 Amb25232216 [0,1,0,0,0,0|2,0,1]=4 1212 B12R2.203 O=C1CC=Cc2nnn(O)c21 Amb27951223 [0,1,0,0,0,0|2,0,1]=4 1213 B12R2.203 O=C1CCCc2onc(O)c21 Amb27164111 [0,1,0,0,0,0|0,0,3]=4 1214 B12R2.203 O=C1CCc2cccc(Br)c21 Amb16232616 [0,1,0,0,0,0|2,0,1]=4 1215 B12R2.203 O=C1CCc2cccc(Cl)c21 Amb6296539 [0,1,0,0,0,0|2,0,1]=4 1216 B12R2.203 O=C1CCc2cccc(F)c21 Amb10603926 [0,1,0,0,0,0|2,0,1]=4 1217 B12R2.203 O=C1CCc2cccc(O)c21 Amb6296368 [0,1,0,0,0,0|2,0,1]=4 1218 B12R2.203 O=C1CCc2cccc(S)c21 Amb27949135 [0,1,0,0,0,0|2,0,1]=4 1219 B12R2.203 O=C1CNCc2onc(O)c21 Amb28050849 [0,1,0,0,0,0|1,0,2]=4 1220 B12R2.203 O=C1COc2cccc(Br)c21 Amb16233082 [0,1,0,0,0,0|1,0,1]=3 1221 B12R2.203 O=C1COc2cccc(Cl)c21 Amb18199151 [0,1,0,0,0,0|1,0,1]=3 1222 B12R2.203 O=C1COc2cccc(F)c21 Amb10840768 [0,1,0,0,0,0|1,0,1]=3 1223 B12R2.203 O=C1COc2cccc(O)c21 Amb18125055 [0,1,0,0,0,0|1,0,1]=3 1224 B12R2.203 O=C1COc2cncc(Cl)c21 Amb28059960 [0,1,0,0,0,0|2,0,1]=4 1225 B12R2.203 O=C1CSc2cccc(Cl)c21 Amb18822610 [0,1,0,0,0,0|1,1,1]=4 1226 B12R2.203 O=C1CSc2cccc(I)c21 Amb27239169 [0,1,0,0,0,0|1,1,1]=4 1227 B12R2.203 O=C1CSc2cccc(O)c21 Amb28436434 [0,1,0,0,0,0|1,1,1]=4 1228 B12R2.203 O=C1N=Cc2cccc(Cl)c21 Amb22015253 [0,1,0,0,0,0|1,0,1]=3 1229 B12R2.203 O=C1N=Cc2cccc(I)c21 Amb22015271 [0,1,0,0,0,0|1,0,1]=3 1230 B12R2.203 O=C1NCc2cccc(Br)c21 Amb21858350 [0,1,0,0,0,0|1,0,2]=4 1231 B12R2.203 O=C1NCc2cccc(Cl)c21 Amb21963125 [0,1,0,0,0,0|1,0,2]=4 1232 B12R2.203 O=C1NCc2cccc(F)c21 Amb23401773 [0,1,0,0,0,0|1,0,2]=4 1233 B12R2.203 O=C1NCc2cccc(I)c21 Amb21963325 [0,1,0,0,0,0|1,0,2]=4 1234 B12R2.203 O=C1NCc2cccc(O)c21 Amb22008617 [0,1,0,0,0,0|1,0,2]=4 1235 B12R2.203 O=C1NNc2cccc(Br)c21 Amb22497381 [0,1,0,0,0,0|1,0,2]=4 1236 B12R2.203 O=C1NNc2cccc(Cl)c21 Amb19373186 [0,1,0,0,0,0|1,0,2]=4 1237 B12R2.203 O=C1NOc2cccc(Br)c21 Amb22494926 [0,1,0,0,0,0|0,0,2]=3 1238 B12R2.203 O=C1NOc2cccc(F)c21 Amb21857210 [0,1,0,0,0,0|0,0,2]=3 1239 B12R2.203 O=C1NSc2cccc(Br)c21 Amb32710018 [0,1,0,0,0,0|0,1,2]=4 1240 B12R2.203 O=C1NSc2cccc(Cl)c21 Amb27445101 [0,1,0,0,0,0|0,1,2]=4 1241 B12R2.203 O=C1NSc2cccc(F)c21 Amb24756929 [0,1,0,0,0,0|0,1,2]=4 1242 B12R2.203 O=C1OCc2cccc(F)c21 Amb4016876 [0,1,0,0,0,0|2,0,1]=4 1243 B12R2.203 O=C1OCc2cccc(I)c21 Amb28124350 [0,1,0,0,0,0|2,0,1]=4 1244 B12R2.203 O=C1OCc2cccc(O)c21 Amb25152698 [0,1,0,0,0,0|2,0,1]=4 1245 B12R2.203 O=C1ONc2cccc(F)c21 Amb27840267 [0,1,0,0,0,0|2,0,1]=4 1246 B12R2.203 OB1OCc2cccc(F)c21 Amb26858878 [0,1,0,0,0,0|3,0,0]=4 1247 B12R2.203 OB1OCc2cccc(O)c21 Amb24396270 [0,1,0,0,0,0|3,0,0]=4 1248 B12R2.203 OC1CCc2cccc(Br)c21 Amb24439435 [0,1,0,0,0,0|2,0,1]=4 1249 B12R2.203 OC1CCc2cccc(Cl)c21 Amb27243919 [0,1,0,0,0,0|2,0,1]=4 1250 B12R2.203 OC1CCc2cccc(F)c21 Amb27953673 [0,1,0,0,0,0|2,0,1]=4 1251 B12R2.203 OC1CSc2cccc(Br)c21 Amb27977724 [0,1,0,0,0,0|1,1,1]=4 1252 B12R2.203 OC1OCc2cccc(F)c21 Amb27766595 [0,1,0,0,0,0|2,0,1]=4 1253 B12R2.203 Oc1cccc2cnn(O)c12 Amb26576055 [0,1,0,0,0,0|2,0,0]=3 1254 B12R2.203 Oc1cccc2onc(Cl)c12 Amb18647236 [0,1,0,0,0,0|1,0,0]=2 1255 B12R2.203 Oc1cccc2scc(Br)c12 Amb25051256 [0,1,0,0,0,0|2,1,0]=4 1256 B12R2.203 Oc1cccc2scc(Cl)c12 Amb24606514 [0,1,0,0,0,0|2,1,0]=4 1257 B12R2.203 Oc1nccc2occ(Br)c12 Amb18770562 [0,1,0,0,0,0|3,0,0]=4 1258 B12R2.203 Oc1nnc2nccc(Cl)n12 Amb24680982 [0,1,0,0,0,0|3,0,0]=4 1259 B12R2.203 Oc1nnc2nccc(F)n12 Amb25084584 [0,1,0,0,0,0|3,0,0]=4 1260 B12R2.612 Brc1ccc2c(Br)csc2c1 Amb27162342 [0,1,0,0,0,0|2,1,0]=4 1261 B12R2.612 Brc1ccn2c(Br)ncc2c1 Amb26327242 [0,1,0,0,0,0|3,0,0]=4 1262 B12R2.612 C=C1CCc2cc(Br)ccc21 Amb22229945 [0,1,0,0,0,0|3,0,0]=4 1263 B12R2.612 C=C1CCc2cc(Cl)ccc21 Amb24369315 [0,1,0,0,0,0|3,0,0]=4 1264 B12R2.612 C=C1CCc2cc(O)ccc21 Amb26965176 [0,1,0,0,0,0|3,0,0]=4 1265 B12R2.612 CC1=CCc2cc(Br)ccc21 Amb27231603 [0,1,0,0,0,0|3,0,0]=4 1266 B12R2.612 CC1=CCc2cc(Cl)ccc21 Amb27849462 [0,1,0,0,0,0|3,0,0]=4 1267 B12R2.612 Cc1ccc2c(Br)noc2c1 Amb27623612 [0,1,0,0,0,0|1,0,0]=2 1268 B12R2.612 Cc1ccc2c(C)csc2c1 Amb26552219 [0,1,0,0,0,0|2,1,0]=4 1269 B12R2.612 Cc1ccc2c(C)noc2c1 Amb22802464 [0,1,0,0,0,0|1,0,0]=2 1270 B12R2.612 Cc1ccc2c(C)noc2n1 Amb26512103 [0,1,0,0,0,0|2,0,0]=3 1271 B12R2.612 Cc1ccc2c(C)nsc2c1 Amb27642675 [0,1,0,0,0,0|1,1,0]=3 1272 B12R2.612 Cc1ccc2c(Cl)noc2c1 Amb21857009 [0,1,0,0,0,0|1,0,0]=2 1273 B12R2.612 Cc1ccc2c(Cl)nsc2c1 Amb28135895 [0,1,0,0,0,0|1,1,0]=3 1274 B12R2.612 Cc1ccc2c(I)ncn2c1 Amb27481424 [0,1,0,0,0,0|3,0,0]=4 1275 B12R2.612 Cc1ccc2c(N)csc2c1 Amb23402528 [0,1,0,0,0,0|2,1,0]=4 1276 B12R2.612 Cc1ccc2c(N)noc2c1 Amb23437117 [0,1,0,0,0,0|1,0,0]=2 1277 B12R2.612 Cc1ccc2c(N)noc2n1 Amb8041940 [0,1,0,0,0,0|2,0,0]=3 1278 B12R2.612 Cc1ccc2c(N)nsc2c1 Amb27843690 [0,1,0,0,0,0|1,1,0]=3 1279 B12R2.612 Cc1ccc2c(N)onc2c1 Amb27613141 [0,1,0,0,0,0|3,0,0]=4 1280 B12R2.612 Cc1ccc2c(O)noc2c1 Amb22015153 [0,1,0,0,0,0|0,0,0]=1 1281 B12R2.612 Cc1ccc2c(O)noc2n1 Amb25873297 [0,1,0,0,0,0|1,0,0]=2 1282 B12R2.612 Cc1ccc2c(c1)CCC2=O Amb6667023 [0,1,0,0,0,0|2,0,1]=4 1283 B12R2.612 Cc1ccc2c(c1)CCC2O Amb21964865 [0,1,0,0,0,0|2,0,1]=4 1284 B12R2.612 Cc1ccc2c(c1)CC[C@@H]2O Amb25892517 [0,1,0,0,0,0|2,0,1]=4 1285 B12R2.612 Cc1ccc2c(c1)CC[C@H]2O Amb27668855 [0,1,0,0,0,0|2,0,1]=4 1286 B12R2.612 Cc1ccc2c(c1)CNC2=O Amb20248676 [0,1,0,0,0,0|1,0,2]=4 1287 B12R2.612 Cc1ccc2c(c1)COB2O Amb25771094 [0,1,0,0,0,0|3,0,0]=4 1288 B12R2.612 Cc1ccc2c(c1)COC2=O Amb16232630 [0,1,0,0,0,0|2,0,1]=4 1289 B12R2.612 Cc1ccc2c(c1)OCC2=O Amb18202265 [0,1,0,0,0,0|1,0,1]=3 1290 B12R2.612 Cc1ccc2c(c1)OCC2N Amb27630034 [0,1,0,0,0,0|2,0,1]=4 1291 B12R2.612 Cc1ccc2c(c1)OC[C@@H]2N Amb25335510 [0,1,0,0,0,0|2,0,1]=4 1292 B12R2.612 Cc1ccc2c(c1)SCC2=O Amb18199754 [0,1,0,0,0,0|1,1,1]=4 1293 B12R2.612 Cc1ccc2c(c1)SNC2=O Amb26942754 [0,1,0,0,0,0|0,1,2]=4 1294 B12R2.612 Cc1ccc2c(c1)nnn2C Amb23402463 [0,1,0,0,0,0|3,0,0]=4 1295 B12R2.612 Cc1ccc2c(c1)nnn2N Amb24359101 [0,1,0,0,0,0|3,0,0]=4 1296 B12R2.612 Cc1ccc2c(c1)oc[n+]2[O-] Amb9814223 [0,1,0,0,0,0|2,0,1]=4 1297 B12R2.612 Cc1ccc2c(cnn2C)c1 Amb27459836 [0,1,0,0,0,0|3,0,0]=4 1298 B12R2.612 Cc1ccc2c(cnn2O)c1 Amb27794449 [0,1,0,0,0,0|2,0,0]=3 1299 B12R2.612 Cc1ccc2c(n1)OCC2O Amb27607216 [0,1,0,0,0,0|2,0,1]=4 1300 B12R2.612 Cc1ccn2c(Br)ncc2c1 Amb26656385 [0,1,0,0,0,0|3,0,0]=4 1301 B12R2.612 Cc1ccn2c(Br)nnc2c1 Amb32721146 [0,1,0,0,0,0|3,0,0]=4 1302 B12R2.612 Cc1ccn2c(Cl)nnc2c1 Amb25145736 [0,1,0,0,0,0|3,0,0]=4 1303 B12R2.612 Cc1ccn2c(N)nnc2c1 Amb20667816 [0,1,0,0,0,0|3,0,0]=4 1304 B12R2.612 Cc1ccn2c(O)nnc2c1 Amb22886937 [0,1,0,0,0,0|2,0,0]=3 1305 B12R2.612 Cc1ccn2c(S)nnc2c1 Amb17210572 [0,1,0,0,0,0|2,1,0]=4 1306 B12R2.612 Cc1coc2cc(Br)ccc12 Amb28074278 [0,1,0,0,0,0|2,0,0]=3 1307 B12R2.612 Cc1coc2cc(N)ncc12 Amb18202258 [0,1,0,0,0,0|3,0,0]=4 1308 B12R2.612 Cc1csc2cc(Br)ccc12 Amb25133721 [0,1,0,0,0,0|2,1,0]=4 1309 B12R2.612 Cc1csc2cc(Cl)ccc12 Amb20620743 [0,1,0,0,0,0|2,1,0]=4 1310 B12R2.612 Cc1csc2cc(F)ccc12 Amb27965848 [0,1,0,0,0,0|2,1,0]=4 1311 B12R2.612 Cc1csc2cc(O)ccc12 Amb28202170 [0,1,0,0,0,0|2,1,0]=4 1312 B12R2.612 Cc1ncc2c(N)noc2n1 Amb22011504 [0,1,0,0,0,0|3,0,0]=4 1313 B12R2.612 Cc1ncc2cc(Br)ccn12 Amb22490297 [0,1,0,0,0,0|3,0,0]=4 1314 B12R2.612 Cc1ncc2cc(N)ccn12 Amb27761693 [0,1,0,0,0,0|3,0,0]=4 1315 B12R2.612 Cc1ncn2cc(Br)ccc12 Amb25274219 [0,1,0,0,0,0|3,0,0]=4 1316 B12R2.612 Cc1ncn2cc(N)ccc12 Amb27241126 [0,1,0,0,0,0|3,0,0]=4 1317 B12R2.612 Cc1nnc2cc(Br)ccn12 Amb19958182 [0,1,0,0,0,0|3,0,0]=4 1318 B12R2.612 Cc1nnc2cc(N)ccn12 Amb21857031 [0,1,0,0,0,0|3,0,0]=4 1319 B12R2.612 Cc1nnc2cc(O)ccn12 Amb28052770 [0,1,0,0,0,0|3,0,0]=4 1320 B12R2.612 Cc1nnn2cc(Br)ccc12 Amb24740144 [0,1,0,0,0,0|3,0,0]=4 1321 B12R2.612 Cc1noc2c1C=CC(C)N2 Amb26655890 [0,1,0,0,0,0|2,0,1]=4 1322 B12R2.612 Cc1noc2cc(Br)ccc12 Amb20241143 [0,1,0,0,0,0|1,0,0]=2 1323 B12R2.612 Cc1noc2cc(Cl)ccc12 Amb24611798 [0,1,0,0,0,0|1,0,0]=2 1324 B12R2.612 Cc1noc2cc(N)ccc12 Amb18202255 [0,1,0,0,0,0|1,0,0]=2 1325 B12R2.612 Cc1noc2cc(N)ccc12 Amb32666739 [0,1,0,0,0,0|1,0,0]=2 1326 B12R2.612 Cc1noc2cc(O)ccc12 Amb18124943 [0,1,0,0,0,0|1,0,0]=2 1327 B12R2.612 Cc1noc2nc(Br)ccc12 Amb18172157 [0,1,0,0,0,0|2,0,0]=3 1328 B12R2.612 Cc1noc2nc(Cl)cnc12 Amb27258050 [0,1,0,0,0,0|3,0,0]=4 1329 B12R2.612 Cc1noc2nc(N)ncc12 Amb18201994 [0,1,0,0,0,0|3,0,0]=4 1330 B12R2.612 Cc1nsc2cc(Cl)ccc12 Amb20252165 [0,1,0,0,0,0|1,1,0]=3 1331 B12R2.612 Cc1nsc2cc(F)ccc12 Amb26919037 [0,1,0,0,0,0|1,1,0]=3 1332 B12R2.612 Cc1nsc2cc(O)ccc12 Amb27802547 [0,1,0,0,0,0|1,1,0]=3 1333 B12R2.612 Clc1ccc2c(Br)coc2c1 Amb18160080 [0,1,0,0,0,0|2,0,0]=3 1334 B12R2.612 Clc1ccc2c(Br)ncn2c1 Amb27628688 [0,1,0,0,0,0|3,0,0]=4 1335 B12R2.612 Clc1ccc2c(Br)noc2c1 Amb28187169 [0,1,0,0,0,0|1,0,0]=2 1336 B12R2.612 Clc1ccc2c(Cl)csc2c1 Amb27751229 [0,1,0,0,0,0|2,1,0]=4 1337 B12R2.612 Clc1ccc2c(Cl)noc2c1 Amb21963464 [0,1,0,0,0,0|1,0,0]=2 1338 B12R2.612 Clc1ccc2c(Cl)nsc2c1 Amb24463597 [0,1,0,0,0,0|1,1,0]=3 1339 B12R2.612 Clc1ccc2c(I)ncn2c1 Amb25135094 [0,1,0,0,0,0|3,0,0]=4 1340 B12R2.612 Clc1ccn2c(Br)nnc2c1 Amb27794946 [0,1,0,0,0,0|3,0,0]=4 1341 B12R2.612 Clc1ccn2c(Cl)nnc2c1 Amb26552718 [0,1,0,0,0,0|3,0,0]=4 1342 B12R2.612 Clc1coc2cc(Br)ccc12 Amb18745541 [0,1,0,0,0,0|2,0,0]=3 1343 B12R2.612 Clc1csc2cc(Br)ccc12 Amb27815801 [0,1,0,0,0,0|2,1,0]=4 1344 B12R2.612 Clc1csc2cc(I)ccc12 Amb28048641 [0,1,0,0,0,0|2,1,0]=4 1345 B12R2.612 Clc1nnc2cc(Br)ccn12 Amb28366905 [0,1,0,0,0,0|3,0,0]=4 1346 B12R2.612 Clc1noc2cc(Br)ccc12 Amb22235402 [0,1,0,0,0,0|1,0,0]=2 1347 B12R2.612 Clc1noc2cc(I)ccc12 Amb27653374 [0,1,0,0,0,0|1,0,0]=2 1348 B12R2.612 Clc1nsc2cc(Br)ccc12 Amb26622369 [0,1,0,0,0,0|1,1,0]=3 1349 B12R2.612 Cn1ncc2cc(Br)ccc21 Amb10067309 [0,1,0,0,0,0|3,0,0]=4 1350 B12R2.612 Cn1ncc2cc(F)ccc21 Amb10602923 [0,1,0,0,0,0|3,0,0]=4 1351 B12R2.612 Cn1ncc2cc(I)ccc21 Amb21962056 [0,1,0,0,0,0|3,0,0]=4 1352 B12R2.612 Cn1ncc2cc(N)ccc21 Amb2383036 [0,1,0,0,0,0|3,0,0]=4 1353 B12R2.612 Cn1ncc2cc(O)ccc21 Amb10070483 [0,1,0,0,0,0|3,0,0]=4 1354 B12R2.612 Cn1nnc2cc(Br)ccc21 Amb22751764 [0,1,0,0,0,0|3,0,0]=4 1355 B12R2.612 Cn1nnc2cc(Cl)ccc21 Amb23541009 [0,1,0,0,0,0|3,0,0]=4 1356 B12R2.612 Cn1nnc2cc(I)ccc21 Amb35749446 [0,1,0,0,0,0|3,0,0]=4 1357 B12R2.612 Cn1nnc2cc(N)ccc21 Amb19516696 [0,1,0,0,0,0|3,0,0]=4 1358 B12R2.612 Cn1nnc2cc(N)ccc21 Amb32664290 [0,1,0,0,0,0|3,0,0]=4 1359 B12R2.612 Cn1nnc2cc(O)ccc21 Amb25735137 [0,1,0,0,0,0|3,0,0]=4 1360 B12R2.612 Fc1ccc2c(Br)ncn2c1 Amb32863187 [0,1,0,0,0,0|3,0,0]=4 1361 B12R2.612 Fc1ccc2c(Br)noc2c1 Amb26331474 [0,1,0,0,0,0|1,0,0]=2 1362 B12R2.612 Fc1ccc2c(Cl)noc2c1 Amb19959270 [0,1,0,0,0,0|1,0,0]=2 1363 B12R2.612 Fc1ccc2c(Cl)nsc2c1 Amb24586607 [0,1,0,0,0,0|1,1,0]=3 1364 B12R2.612 Fc1ccc2c(I)ncn2c1 Amb27164104 [0,1,0,0,0,0|3,0,0]=4 1365 B12R2.612 N=C1C=CC2=C(N)NNC2=C1 Amb24392472 [0,1,0,0,0,0|2,0,1]=4 1366 B12R2.612 NC1=NCc2cc(Cl)ccc21 Amb25724500 [0,1,0,0,0,0|2,0,0]=3 1367 B12R2.612 NC1=NCc2cc(Cl)ccc21 Amb32653438 [0,1,0,0,0,0|2,0,0]=3 1368 B12R2.612 NC1COc2cc(Br)ccc21 Amb19516088 [0,1,0,0,0,0|2,0,1]=4 1369 B12R2.612 NC1COc2cc(Br)ccc21 Amb21962144 [0,1,0,0,0,0|2,0,1]=4 1370 B12R2.612 NC1COc2cc(Cl)ccc21 Amb27812386 [0,1,0,0,0,0|2,0,1]=4 1371 B12R2.612 NC1COc2cc(Cl)ccc21 Amb31291604 [0,1,0,0,0,0|2,0,1]=4 1372 B12R2.612 NC1COc2cc(F)ccc21 Amb26356952 [0,1,0,0,0,0|2,0,1]=4 1373 B12R2.612 NC1COc2cc(F)ccc21 Amb30584660 [0,1,0,0,0,0|2,0,1]=4 1374 B12R2.612 NC1COc2cc(O)ccc21 Amb1131908 [0,1,0,0,0,0|2,0,1]=4 1375 B12R2.612 N[C@@H]1COc2cc(Br)ccc21 Amb24462735 [0,1,0,0,0,0|2,0,1]=4 1376 B12R2.612 N[C@@H]1COc2cc(F)ccc21 Amb26888783 [0,1,0,0,0,0|2,0,1]=4 1377 B12R2.612 N[C@H]1COc2cc(Br)ccc21 Amb26020084 [0,1,0,0,0,0|2,0,1]=4 1378 B12R2.612 N[C@H]1COc2cc(Cl)ccc21 Amb28043128 [0,1,0,0,0,0|2,0,1]=4 1379 B12R2.612 N[C@H]1COc2cc(Cl)ccc21 Amb33872209 [0,1,0,0,0,0|2,0,1]=4 1380 B12R2.612 N[C@H]1COc2cc(F)ccc21 Amb26912168 [0,1,0,0,0,0|2,0,1]=4 1381 B12R2.612 N[C@H]1COc2cc(F)ccc21 Amb33872210 [0,1,0,0,0,0|2,0,1]=4 1382 B12R2.612 Nc1cc2occ(Br)c2cn1 Amb18172261 [0,1,0,0,0,0|3,0,0]=4 1383 B12R2.612 Nc1ccc2c(Br)noc2c1 Amb27959055 [0,1,0,0,0,0|1,0,0]=2 1384 B12R2.612 Nc1ccc2c(Br)nsc2n1 Amb27199193 [0,1,0,0,0,0|2,1,0]=4 1385 B12R2.612 Nc1ccc2c(Cl)coc2c1 Amb27446794 [0,1,0,0,0,0|2,0,0]=3 1386 B12R2.612 Nc1ccc2c(Cl)noc2c1 Amb27755390 [0,1,0,0,0,0|1,0,0]=2 1387 B12R2.612 Nc1ccc2c(c1)CCC2=O Amb1348304 [0,1,0,0,0,0|2,0,1]=4 1388 B12R2.612 Nc1ccc2c(c1)CNC2=O Amb16233788 [0,1,0,0,0,0|1,0,2]=4 1389 B12R2.612 Nc1ccc2c(c1)COB2O Amb26860830 [0,1,0,0,0,0|3,0,0]=4 1390 B12R2.612 Nc1ccc2c(c1)COC2=O Amb1101070 [0,1,0,0,0,0|2,0,1]=4 1391 B12R2.612 Nc1ccc2c(c1)NNC2=O Amb21964765 [0,1,0,0,0,0|1,0,2]=4 1392 B12R2.612 Nc1ccc2c(c1)NNC2=O Amb22008653 [0,1,0,0,0,0|1,0,2]=4 1393 B12R2.612 Nc1ccc2c(c1)NOC2=O Amb27404538 [0,1,0,0,0,0|2,0,1]=4 1394 B12R2.612 Nc1ccc2c(c1)OCC2=O Amb26332312 [0,1,0,0,0,0|1,0,1]=3 1395 B12R2.612 Nc1ccc2c(c1)ONC2=O Amb28399452 [0,1,0,0,0,0|0,0,2]=3 1396 B12R2.612 Nc1ccc2c(c1)SNC2=O Amb33548429 [0,1,0,0,0,0|0,1,2]=4 1397 B12R2.612 Nc1ccc2c(c1)nnn2O Amb27862449 [0,1,0,0,0,0|2,0,0]=3 1398 B12R2.612 Nc1csc2cc(Cl)ccc12 Amb23403635 [0,1,0,0,0,0|2,1,0]=4 1399 B12R2.612 Nc1csc2cc(O)ccc12 Amb25825529 [0,1,0,0,0,0|2,1,0]=4 1400 B12R2.612 Nc1ncn2cc(Cl)ccc12 Amb27441989 [0,1,0,0,0,0|3,0,0]=4 1401 B12R2.612 Nc1nnc2cc(Br)ccn12 Amb26512334 [0,1,0,0,0,0|3,0,0]=4 1402 B12R2.612 Nc1nnc2cc(Cl)ccn12 Amb28141459 [0,1,0,0,0,0|3,0,0]=4 1403 B12R2.612 Nc1noc2cc(Br)ccc12 Amb9677652 [0,1,0,0,0,0|1,0,0]=2 1404 B12R2.612 Nc1noc2cc(Cl)ccc12 Amb21965135 [0,1,0,0,0,0|1,0,0]=2 1405 B12R2.612 Nc1noc2cc(F)ccc12 Amb19957543 [0,1,0,0,0,0|1,0,0]=2 1406 B12R2.612 Nc1noc2cc(I)ccc12 Amb22754620 [0,1,0,0,0,0|1,0,0]=2 1407 B12R2.612 Nc1nsc2cc(Br)ccc12 Amb22496226 [0,1,0,0,0,0|1,1,0]=3 1408 B12R2.612 Nc1nsc2cc(Cl)ccc12 Amb18649046 [0,1,0,0,0,0|1,1,0]=3 1409 B12R2.612 Nc1nsc2cc(I)ccc12 Amb27617319 [0,1,0,0,0,0|1,1,0]=3 1410 B12R2.612 Nc1nsc2cc(O)ccc12 Amb27240205 [0,1,0,0,0,0|1,1,0]=3 1411 B12R2.612 Nc1snc2cc(Br)ccc12 Amb28126557 [0,1,0,0,0,0|3,0,0]=4 1412 B12R2.612 Nc1snc2cc(Cl)ccc12 Amb27776777 [0,1,0,0,0,0|3,0,0]=4 1413 B12R2.612 Nn1ncc2cc(F)ccc21 Amb28061875 [0,1,0,0,0,0|3,0,0]=4 1414 B12R2.612 Nn1nnc2cc(Cl)ccc21 Amb2612182 [0,1,0,0,0,0|3,0,0]=4 1415 B12R2.612 O=C1CCc2cc(Br)ccc21 Amb2685276 [0,1,0,0,0,0|2,0,1]=4 1416 B12R2.612 O=C1CCc2cc(Cl)ccc21 Amb2686124 [0,1,0,0,0,0|2,0,1]=4 1417 B12R2.612 O=C1CCc2cc(F)ccc21 Amb2688113 [0,1,0,0,0,0|2,0,1]=4 1418 B12R2.612 O=C1CCc2cc(I)ccc21 Amb10602519 [0,1,0,0,0,0|2,0,1]=4 1419 B12R2.612 O=C1CCc2cc(O)ccc21 Amb2610677 [0,1,0,0,0,0|2,0,1]=4 1420 B12R2.612 O=C1CCc2cc(S)ccc21 Amb24458838 [0,1,0,0,0,0|2,0,1]=4 1421 B12R2.612 O=C1CNc2cc(Br)ccc21 Amb27623314 [0,1,0,0,0,0|2,0,1]=4 1422 B12R2.612 O=C1COc2cc(Br)ccc21 Amb10070946 [0,1,0,0,0,0|1,0,1]=3 1423 B12R2.612 O=C1COc2cc(Br)cnc21 Amb24575031 [0,1,0,0,0,0|2,0,1]=4 1424 B12R2.612 O=C1COc2cc(Br)cnc21 Amb32652703 [0,1,0,0,0,0|2,0,1]=4 1425 B12R2.612 O=C1COc2cc(Cl)ccc21 Amb10070947 [0,1,0,0,0,0|1,0,1]=3 1426 B12R2.612 O=C1COc2cc(F)ccc21 Amb10840769 [0,1,0,0,0,0|1,0,1]=3 1427 B12R2.612 O=C1COc2cc(I)ccc21 Amb16233079 [0,1,0,0,0,0|1,0,1]=3 1428 B12R2.612 O=C1COc2cc(O)ccc21 Amb1155533 [0,1,0,0,0,0|1,0,1]=3 1429 B12R2.612 O=C1CSc2cc(Br)ccc21 Amb26632914 [0,1,0,0,0,0|1,1,1]=4 1430 B12R2.612 O=C1CSc2cc(Cl)ccc21 Amb4062420 [0,1,0,0,0,0|1,1,1]=4 1431 B12R2.612 O=C1CSc2cc(I)ccc21 Amb27441580 [0,1,0,0,0,0|1,1,1]=4 1432 B12R2.612 O=C1N=Cc2cc(F)ccc21 Amb22001920 [0,1,0,0,0,0|1,0,1]=3 1433 B12R2.612 O=C1N=Cc2cc(I)ccc21 Amb22015264 [0,1,0,0,0,0|1,0,1]=3 1434 B12R2.612 O=C1N=Cc2cc(O)ccc21 Amb22015151 [0,1,0,0,0,0|1,0,1]=3 1435 B12R2.612 O=C1NCc2cc(Br)ccc21 Amb10602848 [0,1,0,0,0,0|1,0,2]=4 1436 B12R2.612 O=C1NCc2cc(Cl)ccc21 Amb13883708 [0,1,0,0,0,0|1,0,2]=4 1437 B12R2.612 O=C1NCc2cc(F)ccc21 Amb22371476 [0,1,0,0,0,0|1,0,2]=4 1438 B12R2.612 O=C1NCc2cc(F)ccc21 Amb33716954 [0,1,0,0,0,0|1,0,2]=4 1439 B12R2.612 O=C1NCc2cc(I)ccc21 Amb21963157 [0,1,0,0,0,0|1,0,2]=4 1440 B12R2.612 O=C1NCc2cc(O)ccc21 Amb21857015 [0,1,0,0,0,0|1,0,2]=4 1441 B12R2.612 O=C1NNc2cc(Cl)ccc21 Amb22491677 [0,1,0,0,0,0|1,0,2]=4 1442 B12R2.612 O=C1NNc2cc(F)ccc21 Amb21864861 [0,1,0,0,0,0|1,0,2]=4 1443 B12R2.612 O=C1NOc2cc(Br)ccc21 Amb21856452 [0,1,0,0,0,0|0,0,2]=3 1444 B12R2.612 O=C1NOc2cc(Cl)ccc21 Amb22015207 [0,1,0,0,0,0|0,0,2]=3 1445 B12R2.612 O=C1NOc2cc(O)ccc21 Amb24427281 [0,1,0,0,0,0|0,0,2]=3 1446 B12R2.612 O=C1NSc2cc(Br)ccc21 Amb25863424 [0,1,0,0,0,0|0,1,2]=4 1447 B12R2.612 O=C1NSc2cc(Cl)ccc21 Amb19131195 [0,1,0,0,0,0|0,1,2]=4 1448 B12R2.612 O=C1NSc2cc(F)ccc21 Amb17933791 [0,1,0,0,0,0|0,1,2]=4 1449 B12R2.612 O=C1OCc2cc(Br)ccc21 Amb2617435 [0,1,0,0,0,0|2,0,1]=4 1450 B12R2.612 O=C1OCc2cc(Cl)ccc21 Amb16232644 [0,1,0,0,0,0|2,0,1]=4 1451 B12R2.612 O=C1OCc2cc(F)ccc21 Amb16232978 [0,1,0,0,0,0|2,0,1]=4 1452 B12R2.612 O=C1OCc2cc(I)ccc21 Amb16232979 [0,1,0,0,0,0|2,0,1]=4 1453 B12R2.612 O=C1OCc2cc(O)ccc21 Amb5718517 [0,1,0,0,0,0|2,0,1]=4 1454 B12R2.612 O=C1ONc2cc(Cl)ccc21 Amb26858350 [0,1,0,0,0,0|2,0,1]=4 1455 B12R2.612 O=C1ONc2cc(F)ccc21 Amb27488717 [0,1,0,0,0,0|2,0,1]=4 1456 B12R2.612 O=C1SNc2cc(F)ccc21 Amb32673866 [0,1,0,0,0,0|2,0,1]=4 1457 B12R2.612 OB1OCc2cc(Cl)ccc21 Amb24271171 [0,1,0,0,0,0|3,0,0]=4 1458 B12R2.612 OB1OCc2cc(F)ccc21 Amb33544070 [0,1,0,0,0,0|3,0,0]=4 1459 B12R2.612 OB1OCc2cc(O)ccc21 Amb24665939 [0,1,0,0,0,0|3,0,0]=4 1460 B12R2.612 OC1CCc2cc(Br)ccc21 Amb7990025 [0,1,0,0,0,0|2,0,1]=4 1461 B12R2.612 OC1CCc2cc(Cl)ccc21 Amb22001631 [0,1,0,0,0,0|2,0,1]=4 1462 B12R2.612 OC1CCc2cc(F)ccc21 Amb22756387 [0,1,0,0,0,0|2,0,1]=4 1463 B12R2.612 OC1COc2cc(Br)ccc21 Amb22751582 [0,1,0,0,0,0|1,0,1]=3 1464 B12R2.612 OC1COc2cc(Cl)ccc21 Amb33550780 [0,1,0,0,0,0|1,0,1]=3 1465 B12R2.612 OC1COc2cc(F)ccc21 Amb26371144 [0,1,0,0,0,0|1,0,1]=3 1466 B12R2.612 OC1OCc2cc(Cl)ccc21 Amb22751579 [0,1,0,0,0,0|2,0,1]=4 1467 B12R2.612 O[C@@H]1CCc2cc(Br)ccc21 Amb22886733 [0,1,0,0,0,0|2,0,1]=4 1468 B12R2.612 O[C@@H]1CCc2cc(Cl)ccc21 Amb13953029 [0,1,0,0,0,0|2,0,1]=4 1469 B12R2.612 O[C@@H]1CCc2cc(F)ccc21 Amb13953035 [0,1,0,0,0,0|2,0,1]=4 1470 B12R2.612 O[C@@H]1CCc2cc(I)ccc21 Amb25969174 [0,1,0,0,0,0|2,0,1]=4 1471 B12R2.612 O[C@H]1CCc2cc(Br)ccc21 Amb24420879 [0,1,0,0,0,0|2,0,1]=4 1472 B12R2.612 O[C@H]1CCc2cc(Cl)ccc21 Amb13953030 [0,1,0,0,0,0|2,0,1]=4 1473 B12R2.612 O[C@H]1CCc2cc(F)ccc21 Amb13953033 [0,1,0,0,0,0|2,0,1]=4 1474 B12R2.612 O[C@H]1CCc2cc(I)ccc21 Amb27649441 [0,1,0,0,0,0|2,0,1]=4 1475 B12R2.612 Oc1ccc2c(Br)csc2c1 Amb32708787 [0,1,0,0,0,0|2,1,0]=4 1476 B12R2.612 Oc1ccc2c(Cl)noc2c1 Amb27663451 [0,1,0,0,0,0|1,0,0]=2 1477 B12R2.612 Oc1ccc2c(O)coc2c1 Amb24061705 [0,1,0,0,0,0|1,0,0]=2 1478 B12R2.612 Oc1ccc2c(c1)CC[C@@H]2O Amb28045712 [0,1,0,0,0,0|2,0,1]=4 1479 B12R2.612 Oc1ccc2c(c1)CC[C@H]2O Amb28292539 [0,1,0,0,0,0|2,0,1]=4 1480 B12R2.612 Oc1ccc2c(c1)OCC2O Amb9748288 [0,1,0,0,0,0|1,0,1]=3 1481 B12R2.612 Oc1ccc2c(c1)OCC2S Amb7784688 [0,1,0,0,0,0|1,1,1]=4 1482 B12R2.612 Oc1csc2cc(Br)ccc12 Amb28199014 [0,1,0,0,0,0|1,1,0]=3 1483 B12R2.612 Oc1csc2cc(F)ccc12 Amb27799987 [0,1,0,0,0,0|1,1,0]=3 1484 B12R2.612 Oc1nnc2cc(Cl)ccn12 Amb27156117 [0,1,0,0,0,0|2,0,0]=3 1485 B12R2.612 Oc1nnc2nc(Cl)ccn12 Amb25772616 [0,1,0,0,0,0|3,0,0]=4 1486 B12R2.612 Oc1noc2cc(Br)ccc12 Amb10975705 [0,1,0,0,0,0|0,0,0]=1 1487 B12R2.612 Oc1noc2cc(I)ccc12 Amb26622191 [0,1,0,0,0,0|0,0,0]=1 1488 B12R2.612 Oc1noc2nc(Cl)ccc12 Amb24538126 [0,1,0,0,0,0|1,0,0]=2 1489 B12R2.612 On1ccc2cc(F)ccc21 Amb28072848 [0,1,0,0,0,0|3,0,0]=4 1490 B12R2.612 S=C1NOc2cc(Cl)ccc21 Amb28135755 [0,1,0,0,0,0|0,1,1]=3 1491 B12R2.612 [O-][n+]1ccc2c(Br)coc2c1 Amb27218506 [0,1,0,0,0,0|3,0,0]=4 1492 B12R2.2028 Brc1nc(Br)n2ccccc12 Amb10607037 [0,1,0,0,0,0|3,0,0]=4 1493 B12R2.2028 C=C1NC(=O)c2ccccc21 Amb27487451 [0,1,0,0,0,0|1,0,2]=4 1494 B12R2.2028 C=C1OC(=O)c2ccccc21 Amb22229358 [0,1,0,0,0,0|2,0,1]=4 1495 B12R2.2028 CC1=CC(=O)c2ccccc21 Amb9783432 [0,1,0,0,0,0|2,0,1]=4 1496 B12R2.2028 CC1=CC(O)c2ccccc21 Amb17778893 [0,1,0,0,0,0|2,0,1]=4 1497 B12R2.2028 CC1C=C(Cl)c2ccccc21 Amb17778911 [0,1,0,0,0,0|3,0,0]=4 1498 B12R2.2028 CC1CC(=O)c2ccccc21 Amb9747864 [0,1,0,0,0,0|2,0,1]=4 1499 B12R2.2028 CC1NC(=O)c2ccccc21 Amb24104648 [0,1,0,0,0,0|1,0,2]=4 1500 B12R2.2028 CC1NC(=S)c2ccccc21 Amb27962483 [0,1,0,0,0,0|1,1,1]=4 1501 B12R2.2028 CC1OB(O)c2ccccc21 Amb25893330 [0,1,0,0,0,0|3,0,0]=4 1502 B12R2.2028 CN1NC(=O)c2ccccc21 Amb22372319 [0,1,0,0,0,0|1,0,2]=4 1503 B12R2.2028 CN1NC(=S)c2ccccc21 Amb26952885 [0,1,0,0,0,0|1,1,1]=4 1504 B12R2.2028 CN1SC(=O)c2ccccc21 Amb19664923 [0,1,0,0,0,0|2,0,1]=4 1505 B12R2.2028 C[C@@H]1CC(=O)c2ccccc21 Amb24467053 [0,1,0,0,0,0|2,0,1]=4 1506 B12R2.2028 C[C@@H]1C[C@@H](O)c2ccccc21 Amb27623223 [0,1,0,0,0,0|2,0,1]=4 1507 B12R2.2028 C[C@@H]1OC(=O)c2ccccc21 Amb25892505 [0,1,0,0,0,0|2,0,1]=4 1508 B12R2.2028 C[C@@H]1OC(O)c2ccccc21 Amb26648832 [0,1,0,0,0,0|2,0,1]=4 1509 B12R2.2028 C[C@H]1CC(=O)c2ccccc21 Amb25768595 [0,1,0,0,0,0|2,0,1]=4 1510 B12R2.2028 C[C@H]1O[C@@H](O)c2ccccc21 Amb28142292 [0,1,0,0,0,0|2,0,1]=4 1511 B12R2.2028 C[n+]1nc(N)n2ccccc21 Amb27255358 [0,1,0,0,0,0|3,0,0]=4 1512 B12R2.2028 Cc1cn(Br)c2ccccc12 Amb28286948 [0,1,0,0,0,0|3,0,0]=4 1513 B12R2.2028 Cc1cn(C)c2ccccc12 Amb842585 [0,1,0,0,0,0|3,0,0]=4 1514 B12R2.2028 Cc1nc(Br)c2ccccn12 Amb2795540 [0,1,0,0,0,0|3,0,0]=4 1515 B12R2.2028 Cc1nc(I)c2ccccn12 Amb19515353 [0,1,0,0,0,0|3,0,0]=4 1516 B12R2.2028 Cc1nc(N)n2ccccc12 Amb23454463 [0,1,0,0,0,0|3,0,0]=4 1517 B12R2.2028 Cc1nc(S)n2ccccc12 Amb23560055 [0,1,0,0,0,0|2,1,0]=4 1518 B12R2.2028 Cc1nn(C)c2ccccc12 Amb22491231 [0,1,0,0,0,0|2,0,0]=3 1519 B12R2.2028 Cc1nn(C)c2cnccc12 Amb22741024 [0,1,0,0,0,0|3,0,0]=4 1520 B12R2.2028 Cc1nn(C)c2ncccc12 Amb9677687 [0,1,0,0,0,0|3,0,0]=4 1521 B12R2.2028 Cc1nn(N)c2ccccc12 Amb27859143 [0,1,0,0,0,0|2,0,0]=3 1522 B12R2.2028 Clc1sc(Cl)c2ccccc12 Amb26355866 [0,1,0,0,0,0|3,0,0]=4 1523 B12R2.2028 Cn1cc(Br)c2ccccc21 Amb9210485 [0,1,0,0,0,0|3,0,0]=4 1524 B12R2.2028 Cn1cc(Cl)c2ccccc21 Amb28066534 [0,1,0,0,0,0|3,0,0]=4 1525 B12R2.2028 Cn1cc(N)c2ccccc21 Amb18064415 [0,1,0,0,0,0|3,0,0]=4 1526 B12R2.2028 Cn1cc(N)c2ccccc21 Amb33620933 [0,1,0,0,0,0|3,0,0]=4 1527 B12R2.2028 Cn1cc(O)c2ccccc21 Amb24069283 [0,1,0,0,0,0|2,0,0]=3 1528 B12R2.2028 Cn1cc(O)c2cccnc21 Amb32879790 [0,1,0,0,0,0|3,0,0]=4 1529 B12R2.2028 Cn1cc(S)c2ccccc21 Amb25721189 [0,1,0,0,0,0|2,1,0]=4 1530 B12R2.2028 Cn1nc(Br)c2ccccc21 Amb10604243 [0,1,0,0,0,0|2,0,0]=3 1531 B12R2.2028 Cn1nc(Br)c2cccnc21 Amb9677591 [0,1,0,0,0,0|3,0,0]=4 1532 B12R2.2028 Cn1nc(Br)c2ncccc21 Amb23597174 [0,1,0,0,0,0|3,0,0]=4 1533 B12R2.2028 Cn1nc(Cl)c2cccnc21 Amb9677740 [0,1,0,0,0,0|3,0,0]=4 1534 B12R2.2028 Cn1nc(Cl)c2ncccc21 Amb27210911 [0,1,0,0,0,0|3,0,0]=4 1535 B12R2.2028 Cn1nc(I)c2ccccc21 Amb10608014 [0,1,0,0,0,0|2,0,0]=3 1536 B12R2.2028 Cn1nc(I)c2cccnc21 Amb22500449 [0,1,0,0,0,0|3,0,0]=4 1537 B12R2.2028 Cn1nc(I)c2ncccc21 Amb19148333 [0,1,0,0,0,0|3,0,0]=4 1538 B12R2.2028 Cn1nc(N)c2ccccc21 Amb9677805 [0,1,0,0,0,0|2,0,0]=3 1539 B12R2.2028 Cn1nc(N)c2cccnc21 Amb3593291 [0,1,0,0,0,0|3,0,0]=4 1540 B12R2.2028 Cn1nc(N)c2ccncc21 Amb26416478 [0,1,0,0,0,0|3,0,0]=4 1541 B12R2.2028 Cn1nc(N)c2cnccc21 Amb25866153 [0,1,0,0,0,0|3,0,0]=4 1542 B12R2.2028 Cn1nc(N)c2cnccc21 Amb32664900 [0,1,0,0,0,0|3,0,0]=4 1543 B12R2.2028 Cn1nc(O)c2ccncc21 Amb25217262 [0,1,0,0,0,0|2,0,0]=3 1544 B12R2.2028 Cn1nc(O)c2cncnc21 Amb26928737 [0,1,0,0,0,0|3,0,0]=4 1545 B12R2.2028 N=C1NC(=N)c2ccccc21 Amb4410671 [0,1,0,0,0,0|2,0,1]=4 1546 B12R2.2028 N=C1NC(=O)c2ccccc21 Amb21811514 [0,1,0,0,0,0|1,0,2]=4 1547 B12R2.2028 N=C1NC(=S)c2ccccc21 Amb27268465 [0,1,0,0,0,0|1,1,1]=4 1548 B12R2.2028 NC1=NC(=O)c2ccccc21 Amb6252622 [0,1,0,0,0,0|1,0,1]=3 1549 B12R2.2028 NC1CC(=O)c2ccccc21 Amb17470381 [0,1,0,0,0,0|2,0,1]=4 1550 B12R2.2028 NC1CC(=O)c2ccccc21 Amb21955324 [0,1,0,0,0,0|2,0,1]=4 1551 B12R2.2028 NC1CC(O)c2ccccc21 Amb17470387 [0,1,0,0,0,0|2,0,1]=4 1552 B12R2.2028 NC1NC(=O)c2ccccc21 Amb22372261 [0,1,0,0,0,0|1,0,2]=4 1553 B12R2.2028 N[C@@H]1CC(=O)c2ccccc21 Amb27655630 [0,1,0,0,0,0|2,0,1]=4 1554 B12R2.2028 N[C@@H]1C[C@@H](O)c2ccccc21 Amb25213011 [0,1,0,0,0,0|2,0,1]=4 1555 B12R2.2028 N[C@@H]1C[C@H](O)c2ccccc21 Amb24657326 [0,1,0,0,0,0|2,0,1]=4 1556 B12R2.2028 N[C@H]1C[C@@H](O)c2ccccc21 Amb27810799 [0,1,0,0,0,0|2,0,1]=4 1557 B12R2.2028 Nc1nc(Cl)n2ccccc12 Amb23559977 [0,1,0,0,0,0|3,0,0]=4 1558 B12R2.2028 O=C1C=[N+]([O-])c2ccccc21 Amb17843025 [0,1,0,0,0,0|2,0,1]=4 1559 B12R2.2028 O=C1CC(=O)c2ccccc21 Amb1883008 [0,1,0,0,0,0|2,0,1]=4 1560 B12R2.2028 O=C1CC(Br)c2ccccc21 Amb10068269 [0,1,0,0,0,0|2,0,1]=4 1561 B12R2.2028 O=C1CC(Cl)c2ccccc21 Amb26945025 [0,1,0,0,0,0|2,0,1]=4 1562 B12R2.2028 O=C1CC(F)c2ccccc21 Amb26621970 [0,1,0,0,0,0|2,0,1]=4 1563 B12R2.2028 O=C1CC(I)c2ccccc21 Amb28289407 [0,1,0,0,0,0|2,0,1]=4 1564 B12R2.2028 O=C1CC(O)c2ccccc21 Amb27872121 [0,1,0,0,0,0|2,0,1]=4 1565 B12R2.2028 O=C1NC(=O)c2ccccc21 Amb1934252 [0,1,0,0,0,0|1,0,2]=4 1566 B12R2.2028 O=C1NC(=O)c2ccccc21 Amb33868500 [0,1,0,0,0,0|1,0,2]=4 1567 B12R2.2028 O=C1NC(F)c2ccccc21 Amb27165216 [0,1,0,0,0,0|1,0,2]=4 1568 B12R2.2028 O=C1NC(O)c2ccccc21 Amb17593710 [0,1,0,0,0,0|1,0,2]=4 1569 B12R2.2028 O=C1OC(=O)c2ccccc21 Amb17748796 [0,1,0,0,0,0|2,0,1]=4 1570 B12R2.2028 O=C1OC(Br)c2ccccc21 Amb2685476 [0,1,0,0,0,0|2,0,1]=4 1571 B12R2.2028 O=C1OC(Cl)c2ccccc21 Amb6297233 [0,1,0,0,0,0|2,0,1]=4 1572 B12R2.2028 O=C1OC(O)c2ccccc21 Amb10552913 [0,1,0,0,0,0|2,0,1]=4 1573 B12R2.2028 O=C1OC(O)c2ccccc21 Amb16226896 [0,1,0,0,0,0|2,0,1]=4 1574 B12R2.2028 O=C1OS(=O)c2ccccc21 Amb27755534 [0,1,0,0,0,0|1,1,1]=4 1575 B12R2.2028 O=C1O[IH2](Cl)c2ccccc21 Amb26012976 [0,1,0,0,0,0|2,0,1]=4 1576 B12R2.2028 O=C1O[IH2](O)c2ccccc21 Amb33548934 [0,1,0,0,0,0|2,0,1]=4 1577 B12R2.2028 O=C1SC(=O)c2ccccc21 Amb2610321 [0,1,0,0,0,0|2,0,1]=4 1578 B12R2.2028 O=C1SC(O)c2ccccc21 Amb28207229 [0,1,0,0,0,0|2,0,1]=4 1579 B12R2.2028 O=C1[N-]C(=O)c2ccccc21 Amb28990952 [0,1,0,0,0,0|1,0,2]=4 1580 B12R2.2028 O=C1[N-]C(=O)c2ccccc21 Amb6365847 [0,1,0,0,0,0|1,0,2]=4 1581 B12R2.2028 O=c1ns(=O)c2ccccc12 Amb4138643 [0,1,0,0,0,0|0,1,2]=4 1582 B12R2.2028 OB1OC(O)c2ccccc21 Amb27425186 [0,1,0,0,0,0|2,0,1]=4 1583 B12R2.2028 OC1CC(O)c2ccccc21 Amb1110942 [0,1,0,0,0,0|2,0,1]=4 1584 B12R2.2028 OC1NC(=S)c2ccccc21 Amb28198939 [0,1,0,0,0,0|1,0,2]=4 1585 B12R2.2028 OC1NC(O)c2ccccc21 Amb24441685 [0,1,0,0,0,0|1,0,2]=4 1586 B12R2.2028 OC1OC(O)c2ccccc21 Amb27455100 [0,1,0,0,0,0|2,0,1]=4 1587 B12R2.2028 O[C@H]1C[C@@H](O)c2ccccc21 Amb17938072 [0,1,0,0,0,0|2,0,1]=4 1588 B12R2.2028 O[C@H]1C[C@H](O)c2ccccc21 Amb10068281 [0,1,0,0,0,0|2,0,1]=4 1589 B12R2.2028 S=C1NC(=S)c2ccccc21 Amb28241299 [0,1,0,0,0,0|1,1,1]=4 1590 B12R2.2028 [N-]=[N+]1N=[N+]([O-])c2ccccc21 Amb21953656 [0,1,0,0,0,0|2,0,1]=4 1591 B12R2.2403 CC1(C)COc2ccccc21 Amb26005281 [0,1,0,0,0,0|2,0,1]=4 1592 B12R2.2403 CC1(O)CCc2ccccc21 Amb9676017 [0,1,0,0,0,0|2,0,1]=4 1593 B12R2.2403 CC1(O)COc2ncccc21 Amb27803802 [0,1,0,0,0,0|2,0,1]=4 1594 B12R2.2403 NC1(O)CCc2ccccc21 Amb2699122 [0,1,0,0,0,0|2,0,1]=4 1595 B12R2.2403 N[C@@]1(O)CCc2ccccc21 Amb28072855 [0,1,0,0,0,0|2,0,1]=4 1596 B12R2.2403 O=S1(=O)N=Nc2ccccc21 Amb25191174 [0,1,0,0,0,0|2,0,1]=4 1597 B10R1.15 BP(CO)c1ccccc1 Amb27652937 [0,0,1,0,0,0|3,0,0]=4 1598 B10R1.15 B[PH](CO)c1ccccc1 Amb27826578 [0,0,1,0,0,0|3,0,0]=4 1599 B10R1.15 Br\C=C(\Br)c1ccccc1 Amb8394126 [0,0,1,0,0,0|3,0,0]=4 1600 B10R1.15 C#CC(=O)c1ccccc1 Amb1088846 [0,0,1,0,0,0|2,0,1]=4 1601 B10R1.15 C#CC(O)c1ccccc1 Amb2721623 [0,0,1,0,0,0|2,0,1]=4 1602 B10R1.15 C#C[C@@H](O)c1ccccc1 Amb10844978 [0,0,1,0,0,0|2,0,1]=4 1603 B10R1.15 C#C[C@H](O)c1ccccc1 Amb22360907 [0,0,1,0,0,0|2,0,1]=4 1604 B10R1.15 C=C(C#N)c1ccccc1 Amb17231856 [0,0,1,0,0,0|3,0,0]=4 1605 B10R1.15 C=C(C=O)c1ccccc1 Amb16233227 [0,0,1,0,0,0|2,0,1]=4 1606 B10R1.15 C=C(CBr)c1ccccc1 Amb8391739 [0,0,1,0,0,0|3,0,0]=4 1607 B10R1.15 C=C(CCl)c1ccccc1 Amb26968652 [0,0,1,0,0,0|3,0,0]=4 1608 B10R1.15 C=C(CN)c1ccccc1 Amb10609068 [0,0,1,0,0,0|3,0,0]=4 1609 B10R1.15 C=C(CN)c1ccccc1 Amb9421165 [0,0,1,0,0,0|3,0,0]=4 1610 B10R1.15 C=C(CO)c1ccccc1 Amb27839071 [0,0,1,0,0,0|2,0,0]=3 1611 B10R1.15 C=C(CO)c1ccncc1 Amb25887623 [0,0,1,0,0,0|3,0,0]=4 1612 B10R1.15 C=C(NC)c1ccccc1 Amb27975699 [0,0,1,0,0,0|2,0,1]=4 1613 B10R1.15 C=CC(=C)c1ccccc1 Amb26348162 [0,0,1,0,0,0|3,0,0]=4 1614 B10R1.15 C=CC(=O)c1ccccc1 Amb33542643 [0,0,1,0,0,0|2,0,1]=4 1615 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [0,0,1,0,0,0|2,0,1]=4 1616 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [0,0,1,0,0,0|2,0,1]=4 1617 B10R1.15 CC(CO)c1ccccc1 Amb2720837 [0,0,1,0,0,0|2,0,1]=4 1618 B10R1.15 CC(NO)c1ccccc1 Amb10605006 [0,0,1,0,0,0|1,0,2]=4 1619 B10R1.15 CCC(=O)c1ccccc1 Amb4037285 [0,0,1,0,0,0|2,0,1]=4 1620 B10R1.15 CCC(O)c1ccccc1 Amb6705776 [0,0,1,0,0,0|2,0,1]=4 1621 B10R1.15 CC[C@@H](O)c1ccccc1 Amb8517168 [0,0,1,0,0,0|2,0,1]=4 1622 B10R1.15 CC[C@H](O)c1ccccc1 Amb8517167 [0,0,1,0,0,0|2,0,1]=4 1623 B10R1.15 CN(N=O)c1ccccc1 Amb6308537 [0,0,1,0,0,0|2,0,1]=4 1624 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [0,0,1,0,0,0|2,0,1]=4 1625 B10R1.15 CNC(=N)c1ccccc1 Amb28775800 [0,0,1,0,0,0|2,0,1]=4 1626 B10R1.15 CNC(=O)c1ccccc1 Amb2591685 [0,0,1,0,0,0|1,0,2]=4 1627 B10R1.15 CNC(=S)c1ccccc1 Amb10552988 [0,0,1,0,0,0|1,1,1]=4 1628 B10R1.15 COC(=N)c1ccccc1 Amb4009954 [0,0,1,0,0,0|3,0,0]=4 1629 B10R1.15 COC(=N)c1ccccc1 Amb6366188 [0,0,1,0,0,0|3,0,0]=4 1630 B10R1.15 COC(=O)c1ccccc1 Amb4302710 [0,0,1,0,0,0|2,0,1]=4 1631 B10R1.15 COC(=S)c1ccccc1 Amb10569749 [0,0,1,0,0,0|2,1,0]=4 1632 B10R1.15 CP(CO)c1ccccc1 Amb27410449 [0,0,1,0,0,0|3,0,0]=4 1633 B10R1.15 CSC(=N)c1ccccc1 Amb22488568 [0,0,1,0,0,0|3,0,0]=4 1634 B10R1.15 CSC(=S)c1ccccc1 Amb24395059 [0,0,1,0,0,0|2,1,0]=4 1635 B10R1.15 C[C@@H](CO)c1ccccc1 Amb3939247 [0,0,1,0,0,0|2,0,1]=4 1636 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [0,0,1,0,0,0|1,0,2]=4 1637 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [0,0,1,0,0,0|1,0,2]=4 1638 B10R1.15 C[C@H](CO)c1ccccc1 Amb3939248 [0,0,1,0,0,0|2,0,1]=4 1639 B10R1.15 C\C(=C/Br)c1ccccc1 Amb25066105 [0,0,1,0,0,0|3,0,0]=4 1640 B10R1.15 C\C(=C/Cl)c1ccccc1 Amb30621745 [0,0,1,0,0,0|3,0,0]=4 1641 B10R1.15 C\C(=C\Br)c1ccccc1 Amb4035454 [0,0,1,0,0,0|3,0,0]=4 1642 B10R1.15 C\C(=C\Cl)c1ccccc1 Amb26652006 [0,0,1,0,0,0|3,0,0]=4 1643 B10R1.15 C\C(=N/N)c1ccccc1 Amb4016930 [0,0,1,0,0,0|2,0,0]=3 1644 B10R1.15 C\C(=N/N)c1ccccn1 Amb22552431 [0,0,1,0,0,0|3,0,0]=4 1645 B10R1.15 C\C(=N/O)c1ccccc1 Amb2387477 [0,0,1,0,0,0|1,0,0]=2 1646 B10R1.15 C\C(=N/O)c1ccccn1 Amb2780070 [0,0,1,0,0,0|2,0,0]=3 1647 B10R1.15 C\C(=N/O)c1cccnc1 Amb598353 [0,0,1,0,0,0|2,0,0]=3 1648 B10R1.15 C\C(=N/O)c1ccncc1 Amb6336368 [0,0,1,0,0,0|2,0,0]=3 1649 B10R1.15 C\C(=N/O)c1cnccn1 Amb31295276 [0,0,1,0,0,0|3,0,0]=4 1650 B10R1.15 C\C(=N\O)c1ccccc1 Amb3428046 [0,0,1,0,0,0|1,0,0]=2 1651 B10R1.15 C\C(=N\O)c1ccccn1 Amb598336 [0,0,1,0,0,0|2,0,0]=3 1652 B10R1.15 C\C(=N\O)c1cccnc1 Amb10606945 [0,0,1,0,0,0|2,0,0]=3 1653 B10R1.15 C\C(=N\O)c1ccncc1 Amb2780071 [0,0,1,0,0,0|2,0,0]=3 1654 B10R1.15 C\C(=N\O)c1ccnnc1 Amb27654291 [0,0,1,0,0,0|3,0,0]=4 1655 B10R1.15 C\C(=N\O)c1cnccn1 Amb2420090 [0,0,1,0,0,0|3,0,0]=4 1656 B10R1.15 C\C=C(/C)c1ccccc1 Amb29628341 [0,0,1,0,0,0|3,0,0]=4 1657 B10R1.15 C\C=C(/F)c1ccccc1 Amb25881627 [0,0,1,0,0,0|3,0,0]=4 1658 B10R1.15 C\C=C(/N)c1ccccc1 Amb27787637 [0,0,1,0,0,0|3,0,0]=4 1659 B10R1.15 C\C=C(\C)c1ccccc1 Amb26360165 [0,0,1,0,0,0|3,0,0]=4 1660 B10R1.15 C\N=C(/N)c1cccnc1 Amb21970335 [0,0,1,0,0,0|3,0,0]=4 1661 B10R1.15 C\N=C(\C)c1ccccn1 Amb24433259 [0,0,1,0,0,0|3,0,0]=4 1662 B10R1.15 C\N=C(\N)c1cccnc1 Amb28555473 [0,0,1,0,0,0|3,0,0]=4 1663 B10R1.15 Cl\C=C(\Cl)c1ccccc1 Amb25849275 [0,0,1,0,0,0|3,0,0]=4 1664 B10R1.15 N#CC(=O)c1ccccc1 Amb6893027 [0,0,1,0,0,0|2,0,1]=4 1665 B10R1.15 N#CC(O)c1ccccc1 Amb3997186 [0,0,1,0,0,0|2,0,1]=4 1666 B10R1.15 N#C[C@H](O)c1ccccc1 Amb21618705 [0,0,1,0,0,0|2,0,1]=4 1667 B10R1.15 N=C(NN)c1ccccc1 Amb22234855 [0,0,1,0,0,0|2,0,1]=4 1668 B10R1.15 N=C(NO)c1ccncc1 Amb8559047 [0,0,1,0,0,0|2,0,1]=4 1669 B10R1.15 N=CC(=O)c1ccccc1 Amb27783553 [0,0,1,0,0,0|2,0,1]=4 1670 B10R1.15 NC(CO)c1ccccc1 Amb8513829 [0,0,1,0,0,0|2,0,1]=4 1671 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [0,0,1,0,0,0|2,0,1]=4 1672 B10R1.15 NCC(=O)c1ccccc1 Amb33531112 [0,0,1,0,0,0|2,0,1]=4 1673 B10R1.15 NCC(O)c1ccccc1 Amb33542602 [0,0,1,0,0,0|2,0,1]=4 1674 B10R1.15 NCC(O)c1ccccc1 Amb33544420 [0,0,1,0,0,0|2,0,1]=4 1675 B10R1.15 NC[C@@H](O)c1ccccc1 Amb24107154 [0,0,1,0,0,0|2,0,1]=4 1676 B10R1.15 NC[C@@H](O)c1ccccc1 Amb8630286 [0,0,1,0,0,0|2,0,1]=4 1677 B10R1.15 NC[C@H](O)c1ccccc1 Amb10070626 [0,0,1,0,0,0|2,0,1]=4 1678 B10R1.15 NC[C@H](O)c1ccccc1 Amb8631408 [0,0,1,0,0,0|2,0,1]=4 1679 B10R1.15 NNC(=O)c1ccccc1 Amb1208583 [0,0,1,0,0,0|1,0,2]=4 1680 B10R1.15 NNC(=S)c1ccccc1 Amb23513674 [0,0,1,0,0,0|1,1,1]=4 1681 B10R1.15 N[C@@H](CO)c1ccccc1 Amb3939344 [0,0,1,0,0,0|2,0,1]=4 1682 B10R1.15 N[C@H](CO)c1ccccc1 Amb2720557 [0,0,1,0,0,0|2,0,1]=4 1683 B10R1.15 N\C(=N/O)c1ccccc1 Amb1149046 [0,0,1,0,0,0|1,0,0]=2 1684 B10R1.15 N\C(=N/O)c1ccccc1 Amb6298734 [0,0,1,0,0,0|1,0,0]=2 1685 B10R1.15 N\C(=N/O)c1ccccn1 Amb1161253 [0,0,1,0,0,0|2,0,0]=3 1686 B10R1.15 N\C(=N/O)c1cccnc1 Amb1159396 [0,0,1,0,0,0|2,0,0]=3 1687 B10R1.15 N\C(=N/O)c1ccncc1 Amb1159214 [0,0,1,0,0,0|2,0,0]=3 1688 B10R1.15 N\C(=N/O)c1cnccn1 Amb2436112 [0,0,1,0,0,0|3,0,0]=4 1689 B10R1.15 N\C(=N/O)c1ncccn1 Amb9486560 [0,0,1,0,0,0|3,0,0]=4 1690 B10R1.15 N\C(=N\O)c1ccccc1 Amb2226909 [0,0,1,0,0,0|1,0,0]=2 1691 B10R1.15 N\C(=N\O)c1ccccn1 Amb578792 [0,0,1,0,0,0|2,0,0]=3 1692 B10R1.15 N\C(=N\O)c1cccnc1 Amb10075270 [0,0,1,0,0,0|2,0,0]=3 1693 B10R1.15 N\C(=N\O)c1ccncc1 Amb2371661 [0,0,1,0,0,0|2,0,0]=3 1694 B10R1.15 N\C(=N\O)c1cnccn1 Amb2696199 [0,0,1,0,0,0|3,0,0]=4 1695 B10R1.15 N\N=C(/Cl)c1ccccc1 Amb27951117 [0,0,1,0,0,0|2,0,0]=3 1696 B10R1.15 N\N=C(/N)c1ccccc1 Amb20407822 [0,0,1,0,0,0|2,0,0]=3 1697 B10R1.15 N\N=C(/N)c1cccnc1 Amb2695042 [0,0,1,0,0,0|3,0,0]=4 1698 B10R1.15 N\N=C(/N)c1ccncc1 Amb8395125 [0,0,1,0,0,0|3,0,0]=4 1699 B10R1.15 N\N=C(\Cl)c1ccccc1 Amb27210015 [0,0,1,0,0,0|2,0,0]=3 1700 B10R1.15 O=C(CBr)c1ccccc1 Amb33533065 [0,0,1,0,0,0|2,0,1]=4 1701 B10R1.15 O=C(CCl)c1ccccc1 Amb3940253 [0,0,1,0,0,0|2,0,1]=4 1702 B10R1.15 O=C(CF)c1ccccc1 Amb10603600 [0,0,1,0,0,0|2,0,1]=4 1703 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [0,0,1,0,0,0|2,0,1]=4 1704 B10R1.15 O=C(CO)c1ccccc1 Amb3940718 [0,0,1,0,0,0|1,0,1]=3 1705 B10R1.15 O=C(CO)c1ccccn1 Amb18063640 [0,0,1,0,0,0|2,0,1]=4 1706 B10R1.15 O=C(CO)c1cccnc1 Amb18063681 [0,0,1,0,0,0|2,0,1]=4 1707 B10R1.15 O=C(CO)c1ccncc1 Amb18063686 [0,0,1,0,0,0|2,0,1]=4 1708 B10R1.15 O=C(CS)c1ccccc1 Amb16192503 [0,0,1,0,0,0|1,1,1]=4 1709 B10R1.15 O=C(NI)c1ccccc1 Amb27787732 [0,0,1,0,0,0|1,0,2]=4 1710 B10R1.15 O=C(NO)c1ccccc1 Amb1645521 [0,0,1,0,0,0|0,0,2]=3 1711 B10R1.15 O=C(NO)c1ccccn1 Amb6268699 [0,0,1,0,0,0|1,0,2]=4 1712 B10R1.15 O=C(NO)c1cccnc1 Amb33532633 [0,0,1,0,0,0|1,0,2]=4 1713 B10R1.15 O=C(NO)c1ccncc1 Amb6270440 [0,0,1,0,0,0|1,0,2]=4 1714 B10R1.15 O=C(N[O-])c1ccccc1 Amb18800075 [0,0,1,0,0,0|0,0,3]=4 1715 B10R1.15 O=C(N[O-])c1ccccc1 Amb4035742 [0,0,1,0,0,0|0,0,3]=4 1716 B10R1.15 O=C(OO)c1cccnc1 Amb24094187 [0,0,1,0,0,0|2,0,1]=4 1717 B10R1.15 O=C(OO)c1ccncc1 Amb24066209 [0,0,1,0,0,0|2,0,1]=4 1718 B10R1.15 O=CC(=O)c1ccccc1 Amb4338217 [0,0,1,0,0,0|1,0,2]=4 1719 B10R1.15 O=CC(=O)c1ccccc1 Amb8513585 [0,0,1,0,0,0|1,0,2]=4 1720 B10R1.15 O=CC(O)c1ccccc1 Amb17593446 [0,0,1,0,0,0|1,0,2]=4 1721 B10R1.15 O=C[C@H](O)c1ccccc1 Amb28388660 [0,0,1,0,0,0|1,0,2]=4 1722 B10R1.15 O=NN(O)c1ccccc1 Amb17666641 [0,0,1,0,0,0|1,0,1]=3 1723 B10R1.15 O=NN([O-])c1ccccc1 Amb34915564 [0,0,1,0,0,0|1,0,2]=4 1724 B10R1.15 O=NN([O-])c1ccccc1 Amb8514053 [0,0,1,0,0,0|1,0,2]=4 1725 B10R1.15 O=S(CO)c1ccccc1 Amb27617047 [0,0,1,0,0,0|2,0,1]=4 1726 B10R1.15 OC(CBr)c1ccccc1 Amb17206105 [0,0,1,0,0,0|2,0,1]=4 1727 B10R1.15 OC(CCl)c1ccccc1 Amb9826903 [0,0,1,0,0,0|2,0,1]=4 1728 B10R1.15 OC(CF)c1ccccc1 Amb22731897 [0,0,1,0,0,0|2,0,1]=4 1729 B10R1.15 OC(CI)c1ccccc1 Amb28073875 [0,0,1,0,0,0|2,0,1]=4 1730 B10R1.15 OC(CS)c1ccccc1 Amb10608997 [0,0,1,0,0,0|1,1,1]=4 1731 B10R1.15 OCC(Br)c1ccccc1 Amb27971765 [0,0,1,0,0,0|2,0,1]=4 1732 B10R1.15 OCC(Cl)c1ccccc1 Amb27165767 [0,0,1,0,0,0|2,0,1]=4 1733 B10R1.15 OCC(F)c1ccccc1 Amb24105399 [0,0,1,0,0,0|2,0,1]=4 1734 B10R1.15 OCC(O)c1ccccc1 Amb4350706 [0,0,1,0,0,0|1,0,1]=3 1735 B10R1.15 OCC(O)c1ccccn1 Amb4017599 [0,0,1,0,0,0|2,0,1]=4 1736 B10R1.15 OCC(O)c1cccnc1 Amb23538717 [0,0,1,0,0,0|2,0,1]=4 1737 B10R1.15 OCC(O)c1ccncc1 Amb23538718 [0,0,1,0,0,0|2,0,1]=4 1738 B10R1.15 OCC(O)c1ccncc1 Amb32656243 [0,0,1,0,0,0|2,0,1]=4 1739 B10R1.15 OCC(S)c1ccccc1 Amb25333535 [0,0,1,0,0,0|1,1,1]=4 1740 B10R1.15 OC[C@@H](O)c1ccccc1 Amb8514912 [0,0,1,0,0,0|1,0,1]=3 1741 B10R1.15 OC[C@@H](O)c1ccccn1 Amb26554033 [0,0,1,0,0,0|2,0,1]=4 1742 B10R1.15 OC[C@@H](O)c1ccncc1 Amb28291407 [0,0,1,0,0,0|2,0,1]=4 1743 B10R1.15 OC[C@H](Br)c1ccccc1 Amb27798351 [0,0,1,0,0,0|2,0,1]=4 1744 B10R1.15 OC[C@H](Cl)c1ccccc1 Amb27659257 [0,0,1,0,0,0|2,0,1]=4 1745 B10R1.15 OC[C@H](O)c1ccccc1 Amb8389336 [0,0,1,0,0,0|1,0,1]=3 1746 B10R1.15 OC[C@H](O)c1ccccn1 Amb27838863 [0,0,1,0,0,0|2,0,1]=4 1747 B10R1.15 OC[C@H](S)c1ccccc1 Amb28207325 [0,0,1,0,0,0|1,1,1]=4 1748 B10R1.15 O[C@@H](CBr)c1ccccc1 Amb19929326 [0,0,1,0,0,0|2,0,1]=4 1749 B10R1.15 O[C@@H](CCl)c1ccccc1 Amb16231709 [0,0,1,0,0,0|2,0,1]=4 1750 B10R1.15 O[C@@H](CF)c1ccccc1 Amb24389146 [0,0,1,0,0,0|2,0,1]=4 1751 B10R1.15 O[C@@H](CS)c1ccccc1 Amb27604413 [0,0,1,0,0,0|1,1,1]=4 1752 B10R1.15 O[C@H](CBr)c1ccccc1 Amb19929329 [0,0,1,0,0,0|2,0,1]=4 1753 B10R1.15 O[C@H](CCl)c1ccccc1 Amb8394082 [0,0,1,0,0,0|2,0,1]=4 1754 B10R1.15 O[C@H](CF)c1ccccc1 Amb24437736 [0,0,1,0,0,0|2,0,1]=4 1755 B10R1.15 O[C@H](CS)c1ccccc1 Amb27494941 [0,0,1,0,0,0|1,1,1]=4 1756 B10R1.15 O\N=C(/Cl)c1ccccc1 Amb32411906 [0,0,1,0,0,0|1,0,0]=2 1757 B10R1.15 O\N=C(/Cl)c1ccccn1 Amb21857890 [0,0,1,0,0,0|2,0,0]=3 1758 B10R1.15 O\N=C(/Cl)c1cccnc1 Amb32729389 [0,0,1,0,0,0|2,0,0]=3 1759 B10R1.15 O\N=C(/Cl)c1ccncc1 Amb22446639 [0,0,1,0,0,0|2,0,0]=3 1760 B10R1.15 O\N=C(/Cl)c1ccncc1 Amb32729387 [0,0,1,0,0,0|2,0,0]=3 1761 B10R1.15 O\N=C(\Cl)c1ccccc1 Amb2684308 [0,0,1,0,0,0|1,0,0]=2 1762 B10R1.15 O\N=C(\Cl)c1ccccn1 Amb27839529 [0,0,1,0,0,0|2,0,0]=3 1763 B10R1.15 O\N=C(\Cl)c1cccnc1 Amb27669492 [0,0,1,0,0,0|2,0,0]=3 1764 B10R1.15 O\N=C(\Cl)c1ccncn1 Amb27202056 [0,0,1,0,0,0|3,0,0]=4 1765 B10R1.15 O\N=C(\Cl)c1cnccn1 Amb27263888 [0,0,1,0,0,0|3,0,0]=4 1766 B10R1.15 O\N=C(\O)c1ccccc1 Amb17843421 [0,0,1,0,0,0|0,0,0]=1 1767 B10R1.15 S=C(CBr)c1ccccc1 Amb27755078 [0,0,1,0,0,0|2,1,0]=4 1768 B10R1.15 [NH3+]CC(=O)c1ccccc1 Amb9787668 [0,0,1,0,0,0|2,0,1]=4 1769 B10R1.16 CC\C=C\c1cc(N)no1 Amb33272618 [0,0,1,0,0,0|1,0,2]=4 1770 B10R1.16 Cc1cc(\C=C\C=O)on1 Amb33429946 [0,0,1,0,0,0|2,0,0]=3 1771 B10R1.16 Cc1cc(\C=C\C=O)sn1 Amb35719815 [0,0,1,0,0,0|2,1,0]=4 1772 B10R1.16 Cc1cc(\C=C\CCl)on1 Amb27812542 [0,0,1,0,0,0|2,0,1]=4 1773 B10R1.16 Cc1cc(\C=C\CN)on1 Amb33359080 [0,0,1,0,0,0|2,0,1]=4 1774 B10R1.16 Cc1cc(\C=C\CO)on1 Amb33474385 [0,0,1,0,0,0|2,0,1]=4 1775 B10R1.16 O=C\C=C\c1cc(Br)co1 Amb33431864 [0,0,1,0,0,0|3,0,0]=4 1776 B10R1.17 BrCCOc1ccccc1 Amb1152333 [0,0,1,0,0,0|2,0,1]=4 1777 B10R1.17 Br\C=C\Cc1ccccc1 Amb33134791 [0,0,1,0,0,0|3,0,0]=4 1778 B10R1.17 Br\C=C\Oc1ccccc1 Amb28145099 [0,0,1,0,0,0|2,0,0]=3 1779 B10R1.17 Br\C=C\Sc1ccccc1 Amb26993510 [0,0,1,0,0,0|2,1,0]=4 1780 B10R1.17 C#CCOc1ccccc1 Amb839455 [0,0,1,0,0,0|2,0,1]=4 1781 B10R1.17 C=C=COc1ccccc1 Amb17673264 [0,0,1,0,0,0|2,0,1]=4 1782 B10R1.17 C=CC#Cc1ccccc1 Amb25696607 [0,0,1,0,0,0|3,0,0]=4 1783 B10R1.17 C=CCCc1ccccc1 Amb2721241 [0,0,1,0,0,0|3,0,0]=4 1784 B10R1.17 C=CCNc1ccccc1 Amb2720315 [0,0,1,0,0,0|3,0,0]=4 1785 B10R1.17 C=CCOc1ccccc1 Amb2842273 [0,0,1,0,0,0|2,0,0]=3 1786 B10R1.17 C=CCOc1cccnc1 Amb26643102 [0,0,1,0,0,0|3,0,0]=4 1787 B10R1.17 C=CCOc1ccncc1 Amb25234559 [0,0,1,0,0,0|3,0,0]=4 1788 B10R1.17 C=CCSc1ccccc1 Amb3836099 [0,0,1,0,0,0|2,1,0]=4 1789 B10R1.17 C=COCc1ccccc1 Amb17940722 [0,0,1,0,0,0|3,0,0]=4 1790 B10R1.17 C=C\C=C\c1ccccc1 Amb17938988 [0,0,1,0,0,0|3,0,0]=4 1791 B10R1.17 CC=C=Cc1ccccc1 Amb27435633 [0,0,1,0,0,0|3,0,0]=4 1792 B10R1.17 CCCOc1ccccc1 Amb2842271 [0,0,1,0,0,0|2,0,1]=4 1793 B10R1.17 CC\N=C\c1ccccc1 Amb10558476 [0,0,1,0,0,0|2,0,1]=4 1794 B10R1.17 CN\N=C\c1ccccc1 Amb17867553 [0,0,1,0,0,0|3,0,0]=4 1795 B10R1.17 CN\N=N\c1ccccc1 Amb25720206 [0,0,1,0,0,0|3,0,0]=4 1796 B10R1.17 COCOc1ccccc1 Amb2608594 [0,0,1,0,0,0|3,0,0]=4 1797 B10R1.17 CSCOc1ccccc1 Amb22231357 [0,0,1,0,0,0|3,0,0]=4 1798 B10R1.17 C\C=C\Cc1ccccc1 Amb4035140 [0,0,1,0,0,0|3,0,0]=4 1799 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [0,0,1,0,0,0|2,1,0]=4 1800 B10R1.17 C\C=N\Nc1ccccc1 Amb27788878 [0,0,1,0,0,0|2,0,0]=3 1801 B10R1.17 ClCCOc1ccccc1 Amb3940573 [0,0,1,0,0,0|2,0,1]=4 1802 B10R1.17 Cl\C=C/Oc1ccccc1 Amb27865618 [0,0,1,0,0,0|2,0,0]=3 1803 B10R1.17 Cl\C=N\Oc1ccccn1 Amb27430268 [0,0,1,0,0,0|2,0,0]=3 1804 B10R1.17 ICCOc1ccccc1 Amb10608588 [0,0,1,0,0,0|2,0,1]=4 1805 B10R1.17 N#CCOc1ccccc1 Amb2725206 [0,0,1,0,0,0|2,0,1]=4 1806 B10R1.17 N=CC#Cc1ccccc1 Amb27848552 [0,0,1,0,0,0|3,0,0]=4 1807 B10R1.17 NCCOc1ccccc1 Amb1214559 [0,0,1,0,0,0|2,0,1]=4 1808 B10R1.17 NCCOc1ccccc1 Amb2099529 [0,0,1,0,0,0|2,0,1]=4 1809 B10R1.17 O=C=NCc1ccccc1 Amb3939117 [0,0,1,0,0,0|1,0,2]=4 1810 B10R1.17 O=CC#Cc1ccccc1 Amb3778943 [0,0,1,0,0,0|2,0,1]=4 1811 B10R1.17 O=CCCc1ccccc1 Amb2720576 [0,0,1,0,0,0|2,0,1]=4 1812 B10R1.17 O=CCOc1ccccc1 Amb3465095 [0,0,1,0,0,0|1,0,1]=3 1813 B10R1.17 O=CCOc1ccccn1 Amb27823582 [0,0,1,0,0,0|2,0,1]=4 1814 B10R1.17 O=CCSc1ccccc1 Amb17082903 [0,0,1,0,0,0|1,1,1]=4 1815 B10R1.17 O=CNCc1ccccc1 Amb1916036 [0,0,1,0,0,0|1,0,2]=4 1816 B10R1.17 O=CNNc1ccccc1 Amb2721099 [0,0,1,0,0,0|1,0,2]=4 1817 B10R1.17 O=COCc1ccccc1 Amb4605893 [0,0,1,0,0,0|2,0,1]=4 1818 B10R1.17 O=C[CH]Cc1ccccc1 Amb34916523 [0,0,1,0,0,0|2,0,1]=4 1819 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [0,0,1,0,0,0|2,0,1]=4 1820 B10R1.17 O=C\C=C\c1ccccc1 Amb2792758 [0,0,1,0,0,0|2,0,1]=4 1821 B10R1.17 OCC#Cc1ccccc1 Amb534712 [0,0,1,0,0,0|2,0,1]=4 1822 B10R1.17 OCCCc1ccccc1 Amb3939054 [0,0,1,0,0,0|2,0,1]=4 1823 B10R1.17 OCCNc1ccccc1 Amb3940335 [0,0,1,0,0,0|2,0,1]=4 1824 B10R1.17 OCCOc1ccccc1 Amb2209344 [0,0,1,0,0,0|1,0,1]=3 1825 B10R1.17 OCCOc1ccccn1 Amb23598433 [0,0,1,0,0,0|2,0,1]=4 1826 B10R1.17 OCCOc1cccnc1 Amb19333986 [0,0,1,0,0,0|2,0,1]=4 1827 B10R1.17 OCOCc1ccccc1 Amb25727798 [0,0,1,0,0,0|2,0,1]=4 1828 B10R1.17 OCSCc1ccccc1 Amb27839241 [0,0,1,0,0,0|2,0,1]=4 1829 B10R1.17 OC\C=C\c1ccccc1 Amb7809230 [0,0,1,0,0,0|2,0,1]=4 1830 B10R1.17 ONCCc1ccccc1 Amb33544180 [0,0,1,0,0,0|3,0,0]=4 1831 B10R1.17 O\N=C\Cc1ccccc1 Amb31275669 [0,0,1,0,0,0|3,0,0]=4 1832 B10R1.17 O\N=C\Nc1ccccc1 Amb27449667 [0,0,1,0,0,0|3,0,0]=4 1833 B10R1.17 S=C=NCc1ccccc1 Amb1102095 [0,0,1,0,0,0|1,1,1]=4 1834 B10R1.17 SCCOc1ccccc1 Amb2794986 [0,0,1,0,0,0|1,1,1]=4 1835 B10R1.17 [N-]=[N+]=NCc1ccccc1 Amb2721052 [0,0,1,0,0,0|3,0,0]=4 1836 B10R1.20 C#Cc1ccccc1C=C Amb24589634 [0,0,1,0,0,0|3,0,0]=4 1837 B10R1.20 C#Cc1ccccc1C=O Amb10070109 [0,0,1,0,0,0|2,0,1]=4 1838 B10R1.20 C#Cc1ccccc1CO Amb22337205 [0,0,1,0,0,0|2,0,1]=4 1839 B10R1.20 C#Cc1ccccc1OC Amb8390523 [0,0,1,0,0,0|2,0,1]=4 1840 B10R1.20 C=C=C1C=CC=C\C1=C\O Amb24480633 [0,0,1,0,0,0|2,0,0]=3 1841 B10R1.20 C=Cc1ccccc1C#N Amb17593361 [0,0,1,0,0,0|2,0,1]=4 1842 B10R1.20 C=Cc1ccccc1C=C Amb17689476 [0,0,1,0,0,0|3,0,0]=4 1843 B10R1.20 C=Cc1ccccc1C=O Amb18124354 [0,0,1,0,0,0|2,0,1]=4 1844 B10R1.20 C=Cc1ccccc1CBr Amb17674261 [0,0,1,0,0,0|3,0,0]=4 1845 B10R1.20 C=Cc1ccccc1CC Amb8394031 [0,0,1,0,0,0|3,0,0]=4 1846 B10R1.20 C=Cc1ccccc1CN Amb27798696 [0,0,1,0,0,0|2,0,1]=4 1847 B10R1.20 C=Cc1ccccc1CO Amb22899778 [0,0,1,0,0,0|2,0,1]=4 1848 B10R1.20 C=Cc1ccccc1NC Amb22751065 [0,0,1,0,0,0|3,0,0]=4 1849 B10R1.20 C=Cc1ccccc1SC Amb24667723 [0,0,1,0,0,0|2,1,0]=4 1850 B10R1.20 C=Cc1ccncc1OC Amb20247860 [0,0,1,0,0,0|3,0,0]=4 1851 B10R1.20 C=Cc1cnccc1OC Amb28325048 [0,0,1,0,0,0|3,0,0]=4 1852 B10R1.20 C=Cc1ncccc1OC Amb27632296 [0,0,1,0,0,0|3,0,0]=4 1853 B10R1.20 CCc1ccccc1C=O Amb3941572 [0,0,1,0,0,0|2,0,1]=4 1854 B10R1.20 CCc1ccccc1CO Amb9826072 [0,0,1,0,0,0|2,0,1]=4 1855 B10R1.20 CCc1ccccc1OC Amb6296210 [0,0,1,0,0,0|2,0,1]=4 1856 B10R1.20 CCc1ccccc1ON Amb24480929 [0,0,1,0,0,0|1,0,2]=4 1857 B10R1.20 CNc1ccccc1C=O Amb18124457 [0,0,1,0,0,0|2,0,1]=4 1858 B10R1.20 CNc1ccccc1CO Amb8389944 [0,0,1,0,0,0|2,0,1]=4 1859 B10R1.20 CNc1ccccc1OC Amb2689132 [0,0,1,0,0,0|3,0,0]=4 1860 B10R1.20 CNc1ccccc1OC Amb31163697 [0,0,1,0,0,0|3,0,0]=4 1861 B10R1.20 COc1ccccc1C#N Amb3940293 [0,0,1,0,0,0|2,0,1]=4 1862 B10R1.20 COc1ccccc1C=O Amb1880863 [0,0,1,0,0,0|1,0,1]=3 1863 B10R1.20 COc1ccccc1CBr Amb8835463 [0,0,1,0,0,0|2,0,1]=4 1864 B10R1.20 COc1ccccc1CCl Amb3939729 [0,0,1,0,0,0|2,0,1]=4 1865 B10R1.20 COc1ccccc1CN Amb19958154 [0,0,1,0,0,0|2,0,1]=4 1866 B10R1.20 COc1ccccc1CN Amb932836 [0,0,1,0,0,0|2,0,1]=4 1867 B10R1.20 COc1ccccc1CO Amb2793149 [0,0,1,0,0,0|1,0,1]=3 1868 B10R1.20 COc1ccccc1CS Amb17399984 [0,0,1,0,0,0|1,1,1]=4 1869 B10R1.20 COc1ccccc1NN Amb1033060 [0,0,1,0,0,0|3,0,0]=4 1870 B10R1.20 COc1ccccc1NN Amb19373109 [0,0,1,0,0,0|3,0,0]=4 1871 B10R1.20 COc1ccccc1NN Amb2234492 [0,0,1,0,0,0|3,0,0]=4 1872 B10R1.20 COc1ccccc1OC Amb6608845 [0,0,1,0,0,0|3,0,0]=4 1873 B10R1.20 COc1ccccc1ON Amb24480997 [0,0,1,0,0,0|2,0,1]=4 1874 B10R1.20 COc1ccccc1SC Amb2689157 [0,0,1,0,0,0|3,0,0]=4 1875 B10R1.20 COc1ccccc1[Mg]Br Amb22000523 [0,0,1,0,0,0|3,0,0]=4 1876 B10R1.20 COc1ccccc1[Zn]I Amb22000439 [0,0,1,0,0,0|3,0,0]=4 1877 B10R1.20 COc1cccnc1C=O Amb8010840 [0,0,1,0,0,0|2,0,1]=4 1878 B10R1.20 COc1cccnc1CO Amb10603147 [0,0,1,0,0,0|2,0,1]=4 1879 B10R1.20 COc1cccnc1NO Amb27630579 [0,0,1,0,0,0|3,0,0]=4 1880 B10R1.20 COc1ccncc1C=O Amb8010905 [0,0,1,0,0,0|2,0,1]=4 1881 B10R1.20 COc1ccncc1CO Amb23401172 [0,0,1,0,0,0|2,0,1]=4 1882 B10R1.20 COc1cnccc1C=O Amb21964576 [0,0,1,0,0,0|2,0,1]=4 1883 B10R1.20 COc1cnccc1CO Amb23401173 [0,0,1,0,0,0|2,0,1]=4 1884 B10R1.20 COc1ncccc1C=O Amb4561135 [0,0,1,0,0,0|2,0,1]=4 1885 B10R1.20 COc1ncccc1CO Amb10975545 [0,0,1,0,0,0|2,0,1]=4 1886 B10R1.20 CSc1ccccc1C=O Amb4007735 [0,0,1,0,0,0|1,1,1]=4 1887 B10R1.20 CSc1ccccc1CO Amb1398891 [0,0,1,0,0,0|1,1,1]=4 1888 B10R1.20 N#Cc1ccccc1C=O Amb3939853 [0,0,1,0,0,0|1,0,2]=4 1889 B10R1.20 N#Cc1ccccc1CO Amb8855280 [0,0,1,0,0,0|1,0,2]=4 1890 B10R1.20 N#Cc1ccccc1N=N Amb27640668 [0,0,1,0,0,0|2,0,1]=4 1891 B10R1.20 NCc1ccccc1C=O Amb6298662 [0,0,1,0,0,0|1,0,2]=4 1892 B10R1.20 NCc1ccccc1CO Amb22494785 [0,0,1,0,0,0|1,0,2]=4 1893 B10R1.20 NCc1ccccc1CO Amb6739960 [0,0,1,0,0,0|1,0,2]=4 1894 B10R1.20 NNc1ccccc1C=O Amb18643074 [0,0,1,0,0,0|1,0,2]=4 1895 B10R1.20 NNc1ccccc1CO Amb27469533 [0,0,1,0,0,0|1,0,2]=4 1896 B10R1.20 O=C=C1C=CC=C\C1=C\O Amb28322716 [0,0,1,0,0,0|2,0,0]=3 1897 B10R1.20 O=Cc1ccccc1C=O Amb535689 [0,0,1,0,0,0|2,0,1]=4 1898 B10R1.20 O=Cc1ccccc1CBr Amb26405182 [0,0,1,0,0,0|2,0,1]=4 1899 B10R1.20 O=Cc1ccccc1CF Amb27770451 [0,0,1,0,0,0|2,0,1]=4 1900 B10R1.20 O=Cc1ccccc1CO Amb18643059 [0,0,1,0,0,0|2,0,1]=4 1901 B10R1.20 O=Cc1ccccc1N=O Amb17593428 [0,0,1,0,0,0|2,0,1]=4 1902 B10R1.20 O=Nc1ccccc1CO Amb17593472 [0,0,1,0,0,0|2,0,1]=4 1903 B10R1.20 OCc1ccccc1CBr Amb22235289 [0,0,1,0,0,0|2,0,1]=4 1904 B10R1.20 OCc1ccccc1CO Amb8387731 [0,0,1,0,0,0|2,0,1]=4 1905 B10R1.20 OCc1ccccc1NO Amb27836150 [0,0,1,0,0,0|2,0,1]=4 1906 B10R1.20 OCc1ccccc1SO Amb27839336 [0,0,1,0,0,0|1,1,1]=4 1907 B10R1.20 [C-]#[N+]c1ccccc1C=O Amb28074653 [0,0,1,0,0,0|2,0,1]=4 1908 B10R1.20 [C-]#[N+]c1ccccc1OC Amb2235419 [0,0,1,0,0,0|3,0,0]=4 1909 B10R1.20 [SiH3]Oc1ccccc1CBr Amb27597062 [0,0,1,0,0,0|2,0,1]=4 1910 B10R1.61 C=C(Br)c1ccccc1C Amb27449132 [0,0,1,0,0,0|3,0,0]=4 1911 B10R1.61 C=C(C)c1ccccc1Br Amb25797043 [0,0,1,0,0,0|3,0,0]=4 1912 B10R1.61 C=C(C)c1ccccc1C Amb22043466 [0,0,1,0,0,0|3,0,0]=4 1913 B10R1.61 C=C(C)c1ccccc1Cl Amb24720539 [0,0,1,0,0,0|3,0,0]=4 1914 B10R1.61 C=C(C)c1ccccc1F Amb27838932 [0,0,1,0,0,0|3,0,0]=4 1915 B10R1.61 C=C(C)c1ccccc1N Amb3940451 [0,0,1,0,0,0|3,0,0]=4 1916 B10R1.61 C=C(C)c1ccccc1O Amb18124426 [0,0,1,0,0,0|2,0,0]=3 1917 B10R1.61 CC(=O)c1ccccc1Br Amb1232838 [0,0,1,0,0,0|2,0,1]=4 1918 B10R1.61 CC(=O)c1ccccc1C Amb2792441 [0,0,1,0,0,0|2,0,1]=4 1919 B10R1.61 CC(=O)c1ccccc1Cl Amb2685746 [0,0,1,0,0,0|2,0,1]=4 1920 B10R1.61 CC(=O)c1ccccc1F Amb2688005 [0,0,1,0,0,0|2,0,1]=4 1921 B10R1.61 CC(=O)c1ccccc1I Amb8517635 [0,0,1,0,0,0|2,0,1]=4 1922 B10R1.61 CC(=O)c1ccccc1N Amb2725478 [0,0,1,0,0,0|2,0,1]=4 1923 B10R1.61 CC(=O)c1ccccc1N Amb6296708 [0,0,1,0,0,0|2,0,1]=4 1924 B10R1.61 CC(=O)c1ccccc1O Amb2792764 [0,0,1,0,0,0|1,0,1]=3 1925 B10R1.61 CC(=O)c1ccccc1S Amb22396354 [0,0,1,0,0,0|1,1,1]=4 1926 B10R1.61 CC(=O)c1cccnc1O Amb18832396 [0,0,1,0,0,0|2,0,1]=4 1927 B10R1.61 CC(=O)c1ccncc1O Amb18643112 [0,0,1,0,0,0|2,0,1]=4 1928 B10R1.61 CC(=O)c1ncccc1O Amb16233269 [0,0,1,0,0,0|2,0,1]=4 1929 B10R1.61 CC(=S)c1ccccc1I Amb28315750 [0,0,1,0,0,0|2,1,0]=4 1930 B10R1.61 CC(C)c1ccccc1O Amb3939541 [0,0,1,0,0,0|2,0,1]=4 1931 B10R1.61 CC(N)c1ccccc1O Amb1120555 [0,0,1,0,0,0|1,0,2]=4 1932 B10R1.61 CC(N)c1ccccc1O Amb6892529 [0,0,1,0,0,0|1,0,2]=4 1933 B10R1.61 CC(O)c1ccccc1Br Amb4020060 [0,0,1,0,0,0|2,0,1]=4 1934 B10R1.61 CC(O)c1ccccc1Cl Amb6296141 [0,0,1,0,0,0|2,0,1]=4 1935 B10R1.61 CC(O)c1ccccc1F Amb9748272 [0,0,1,0,0,0|2,0,1]=4 1936 B10R1.61 CC(O)c1ccccc1N Amb10609794 [0,0,1,0,0,0|2,0,1]=4 1937 B10R1.61 CC(O)c1ccccc1O Amb6705780 [0,0,1,0,0,0|1,0,1]=3 1938 B10R1.61 CC(S)c1ccccc1O Amb7784683 [0,0,1,0,0,0|1,1,1]=4 1939 B10R1.61 CN(C)c1ccccc1O Amb8439130 [0,0,1,0,0,0|3,0,0]=4 1940 B10R1.61 CS(=O)c1ccccc1O Amb2420338 [0,0,1,0,0,0|2,0,1]=4 1941 B10R1.61 C[C@@H](N)c1ccccc1O Amb22748922 [0,0,1,0,0,0|1,0,2]=4 1942 B10R1.61 C[C@@H](N)c1ccccc1O Amb2699152 [0,0,1,0,0,0|1,0,2]=4 1943 B10R1.61 C[C@@H](O)c1ccccc1Br Amb8517146 [0,0,1,0,0,0|2,0,1]=4 1944 B10R1.61 C[C@@H](O)c1ccccc1Cl Amb6893448 [0,0,1,0,0,0|2,0,1]=4 1945 B10R1.61 C[C@@H](O)c1ccccc1F Amb10838298 [0,0,1,0,0,0|2,0,1]=4 1946 B10R1.61 C[C@@H](O)c1ccccc1O Amb27664097 [0,0,1,0,0,0|1,0,1]=3 1947 B10R1.61 C[C@H](N)c1ccccc1O Amb2699153 [0,0,1,0,0,0|1,0,2]=4 1948 B10R1.61 C[C@H](N)c1ccccc1O Amb32671097 [0,0,1,0,0,0|1,0,2]=4 1949 B10R1.61 C[C@H](O)c1ccccc1Br Amb4605835 [0,0,1,0,0,0|2,0,1]=4 1950 B10R1.61 C[C@H](O)c1ccccc1Cl Amb6893447 [0,0,1,0,0,0|2,0,1]=4 1951 B10R1.61 C[C@H](O)c1ccccc1F Amb10838300 [0,0,1,0,0,0|2,0,1]=4 1952 B10R1.61 C[C@H](O)c1ccccc1N Amb26350508 [0,0,1,0,0,0|2,0,1]=4 1953 B10R1.61 C[C@H](O)c1ccccc1O Amb24476869 [0,0,1,0,0,0|1,0,1]=3 1954 B10R1.61 C[C@H](O)c1ncccc1O Amb27778171 [0,0,1,0,0,0|2,0,1]=4 1955 B10R1.61 C[n+]1ccccc1C(=O)O Amb22450577 [0,0,1,0,0,0|3,0,0]=4 1956 B10R1.61 C\C(O)=C1\N=CC=CC1=O Amb27956145 [0,0,1,0,0,0|2,0,1]=4 1957 B10R1.61 Cc1ccccc1B(O)O Amb2447081 [0,0,1,0,0,0|3,0,0]=4 1958 B10R1.61 Cc1ccccc1C(=N)N Amb10607001 [0,0,1,0,0,0|2,0,0]=3 1959 B10R1.61 Cc1ccccc1C(=N)N Amb2696284 [0,0,1,0,0,0|2,0,0]=3 1960 B10R1.61 Cc1ccccc1C(=O)Br Amb17844075 [0,0,1,0,0,0|2,0,1]=4 1961 B10R1.61 Cc1ccccc1C(=O)Cl Amb3939039 [0,0,1,0,0,0|2,0,1]=4 1962 B10R1.61 Cc1ccccc1C(=O)O Amb2609023 [0,0,1,0,0,0|2,0,0]=3 1963 B10R1.61 Cc1ccccc1C(C)O Amb6705766 [0,0,1,0,0,0|2,0,1]=4 1964 B10R1.61 Cc1ccccc1C(N)=O Amb2720842 [0,0,1,0,0,0|1,0,2]=4 1965 B10R1.61 Cc1ccccc1C(N)=S Amb6550210 [0,0,1,0,0,0|1,1,1]=4 1966 B10R1.61 Cc1ccccc1C(O)=S Amb20242952 [0,0,1,0,0,0|2,0,0]=3 1967 B10R1.61 Cc1ccccc1C(O)O Amb26909320 [0,0,1,0,0,0|2,0,1]=4 1968 B10R1.61 Cc1ccccc1S(=O)O Amb24093011 [0,0,1,0,0,0|3,0,0]=4 1969 B10R1.61 Cc1ccccc1S(=O)O Amb27431820 [0,0,1,0,0,0|3,0,0]=4 1970 B10R1.61 Cc1ccccc1[C@@H](C)O Amb6893585 [0,0,1,0,0,0|2,0,1]=4 1971 B10R1.61 Cc1ccccc1[C@H](C)O Amb6893584 [0,0,1,0,0,0|2,0,1]=4 1972 B10R1.61 Cc1ccccc1[SiH](O)O Amb27959519 [0,0,1,0,0,0|2,1,0]=4 1973 B10R1.61 Cc1cccnc1C(=N)N Amb22235898 [0,0,1,0,0,0|3,0,0]=4 1974 B10R1.61 Cc1cccnc1C(=N)N Amb24182047 [0,0,1,0,0,0|3,0,0]=4 1975 B10R1.61 Cc1cccnc1C(=O)O Amb21964439 [0,0,1,0,0,0|3,0,0]=4 1976 B10R1.61 Cc1cccnc1C(=O)O Amb2689642 [0,0,1,0,0,0|3,0,0]=4 1977 B10R1.61 Cc1ccncc1C(=N)N Amb16231235 [0,0,1,0,0,0|3,0,0]=4 1978 B10R1.61 Cc1ccncc1C(=N)N Amb28282724 [0,0,1,0,0,0|3,0,0]=4 1979 B10R1.61 Cc1ccncc1C(=O)O Amb1102435 [0,0,1,0,0,0|3,0,0]=4 1980 B10R1.61 Cc1ccncc1C(=O)O Amb2725643 [0,0,1,0,0,0|3,0,0]=4 1981 B10R1.61 Cc1cnccc1C(=N)N Amb27823577 [0,0,1,0,0,0|3,0,0]=4 1982 B10R1.61 Cc1cnccc1C(=N)N Amb32409434 [0,0,1,0,0,0|3,0,0]=4 1983 B10R1.61 Cc1cnccc1C(=O)O Amb1950722 [0,0,1,0,0,0|3,0,0]=4 1984 B10R1.61 Cc1cnccc1C(=O)O Amb22490345 [0,0,1,0,0,0|3,0,0]=4 1985 B10R1.61 Cc1ncccc1C(=N)N Amb18851710 [0,0,1,0,0,0|3,0,0]=4 1986 B10R1.61 Cc1ncccc1C(=O)O Amb19514954 [0,0,1,0,0,0|3,0,0]=4 1987 B10R1.61 Cc1ncccc1C(=O)O Amb2613015 [0,0,1,0,0,0|3,0,0]=4 1988 B10R1.61 N=C(N)C1=CC=CNC1=O Amb18261915 [0,0,1,0,0,0|2,0,1]=4 1989 B10R1.61 N=C(N)c1cccc[n+]1[O-] Amb26531933 [0,0,1,0,0,0|2,0,1]=4 1990 B10R1.61 N=C(N)c1cccc[n+]1[O-] Amb3429113 [0,0,1,0,0,0|2,0,1]=4 1991 B10R1.61 N=C(N)c1ccccc1Br Amb2695923 [0,0,1,0,0,0|2,0,0]=3 1992 B10R1.61 N=C(N)c1ccccc1Br Amb33552522 [0,0,1,0,0,0|2,0,0]=3 1993 B10R1.61 N=C(N)c1ccccc1Cl Amb2696044 [0,0,1,0,0,0|2,0,0]=3 1994 B10R1.61 N=C(N)c1ccccc1Cl Amb2783778 [0,0,1,0,0,0|2,0,0]=3 1995 B10R1.61 N=C(N)c1ccccc1F Amb2696613 [0,0,1,0,0,0|2,0,0]=3 1996 B10R1.61 N=C(N)c1ccccc1F Amb2699659 [0,0,1,0,0,0|2,0,0]=3 1997 B10R1.61 N=C(N)c1ccccc1F Amb28555477 [0,0,1,0,0,0|2,0,0]=3 1998 B10R1.61 N=C(N)c1ccccc1I Amb2700569 [0,0,1,0,0,0|2,0,0]=3 1999 B10R1.61 N=C(N)c1ccccc1N Amb24559098 [0,0,1,0,0,0|2,0,0]=3 2000 B10R1.61 N=C(N)c1ccccc1O Amb2696249 [0,0,1,0,0,0|1,0,0]=2 2001 B10R1.61 N=C(N)c1ccccc1O Amb8630174 [0,0,1,0,0,0|1,0,0]=2 2002 B10R1.61 N=C(N)c1ccccc1S Amb27465157 [0,0,1,0,0,0|1,1,0]=3 2003 B10R1.61 N=C(N)c1cccnc1Br Amb33388149 [0,0,1,0,0,0|3,0,0]=4 2004 B10R1.61 N=C(N)c1cccnc1F Amb28193263 [0,0,1,0,0,0|3,0,0]=4 2005 B10R1.61 N=C(N)c1cccnc1O Amb19890164 [0,0,1,0,0,0|2,0,0]=3 2006 B10R1.61 N=C(N)c1cccnc1O Amb9215005 [0,0,1,0,0,0|2,0,0]=3 2007 B10R1.61 N=C(N)c1ccncc1Br Amb27259514 [0,0,1,0,0,0|3,0,0]=4 2008 B10R1.61 N=C(N)c1ccncc1Cl Amb28066565 [0,0,1,0,0,0|3,0,0]=4 2009 B10R1.61 N=C(N)c1ccncc1F Amb33316478 [0,0,1,0,0,0|3,0,0]=4 2010 B10R1.61 N=C(N)c1ccncc1N Amb28049445 [0,0,1,0,0,0|3,0,0]=4 2011 B10R1.61 N=C(N)c1ccnnc1O Amb28244599 [0,0,1,0,0,0|3,0,0]=4 2012 B10R1.61 N=C(N)c1ncccc1Br Amb22235917 [0,0,1,0,0,0|3,0,0]=4 2013 B10R1.61 N=C(N)c1ncccc1Br Amb25142076 [0,0,1,0,0,0|3,0,0]=4 2014 B10R1.61 N=C(N)c1ncccc1Cl Amb22235907 [0,0,1,0,0,0|3,0,0]=4 2015 B10R1.61 N=C(N)c1ncccc1Cl Amb28050250 [0,0,1,0,0,0|3,0,0]=4 2016 B10R1.61 N=C(N)c1ncccc1F Amb22235900 [0,0,1,0,0,0|3,0,0]=4 2017 B10R1.61 N=C(N)c1ncccc1F Amb24183649 [0,0,1,0,0,0|3,0,0]=4 2018 B10R1.61 N=C(N)c1ncccc1I Amb22289547 [0,0,1,0,0,0|3,0,0]=4 2019 B10R1.61 N=C(N)c1ncccc1I Amb28429636 [0,0,1,0,0,0|3,0,0]=4 2020 B10R1.61 NC(=O)c1ccccc1Br Amb2684949 [0,0,1,0,0,0|1,0,2]=4 2021 B10R1.61 NC(=O)c1ccccc1Cl Amb2611996 [0,0,1,0,0,0|1,0,2]=4 2022 B10R1.61 NC(=O)c1ccccc1F Amb1221270 [0,0,1,0,0,0|1,0,2]=4 2023 B10R1.61 NC(=O)c1ccccc1I Amb2384520 [0,0,1,0,0,0|1,0,2]=4 2024 B10R1.61 NC(=O)c1ccccc1N Amb1212111 [0,0,1,0,0,0|1,0,2]=4 2025 B10R1.61 NC(=O)c1ccccc1O Amb1935248 [0,0,1,0,0,0|0,0,2]=3 2026 B10R1.61 NC(=O)c1ccccc1S Amb6256729 [0,0,1,0,0,0|0,1,2]=4 2027 B10R1.61 NC(=O)c1cccnc1O Amb18643213 [0,0,1,0,0,0|1,0,2]=4 2028 B10R1.61 NC(=O)c1ccncc1O Amb23401565 [0,0,1,0,0,0|1,0,2]=4 2029 B10R1.61 NC(=O)c1cnccc1O Amb5493990 [0,0,1,0,0,0|1,0,2]=4 2030 B10R1.61 NC(=O)c1ncccc1O Amb6600564 [0,0,1,0,0,0|1,0,2]=4 2031 B10R1.61 NC(=S)c1ccccc1Br Amb2685503 [0,0,1,0,0,0|1,1,1]=4 2032 B10R1.61 NC(=S)c1ccccc1Cl Amb2686480 [0,0,1,0,0,0|1,1,1]=4 2033 B10R1.61 NC(=S)c1ccccc1F Amb1264600 [0,0,1,0,0,0|1,1,1]=4 2034 B10R1.61 NC(=S)c1ccccc1I Amb19889459 [0,0,1,0,0,0|1,1,1]=4 2035 B10R1.61 NC(=S)c1ccccc1N Amb1217775 [0,0,1,0,0,0|1,1,1]=4 2036 B10R1.61 NC(=S)c1ccccc1O Amb33538948 [0,0,1,0,0,0|0,1,1]=3 2037 B10R1.61 NC(=S)c1cnccc1O Amb27620608 [0,0,1,0,0,0|1,1,1]=4 2038 B10R1.61 NC(O)c1ccccc1O Amb27596246 [0,0,1,0,0,0|0,0,2]=3 2039 B10R1.61 N\C(S)=C1\C=CC=CC1=O Amb33512975 [0,0,1,0,0,0|0,1,2]=4 2040 B10R1.61 Nc1ccccc1B(O)O Amb2455634 [0,0,1,0,0,0|3,0,0]=4 2041 B10R1.61 Nc1ccccc1B(O)O Amb2455781 [0,0,1,0,0,0|3,0,0]=4 2042 B10R1.61 Nc1ccccc1C(=O)O Amb1933714 [0,0,1,0,0,0|2,0,0]=3 2043 B10R1.61 Nc1ccccc1C(=S)[S-] Amb28285398 [0,0,1,0,0,0|2,1,0]=4 2044 B10R1.61 Nc1cccnc1C(=O)O Amb22276123 [0,0,1,0,0,0|3,0,0]=4 2045 B10R1.61 Nc1cccnc1C(=O)O Amb2609539 [0,0,1,0,0,0|3,0,0]=4 2046 B10R1.61 Nc1ccncc1C(=O)O Amb10982498 [0,0,1,0,0,0|3,0,0]=4 2047 B10R1.61 Nc1ccncc1C(=O)O Amb2404894 [0,0,1,0,0,0|3,0,0]=4 2048 B10R1.61 Nc1cnccc1C(=O)O Amb1058763 [0,0,1,0,0,0|3,0,0]=4 2049 B10R1.61 Nc1ncccc1C(=O)O Amb535151 [0,0,1,0,0,0|3,0,0]=4 2050 B10R1.61 O=C(Cl)c1ccccc1Br Amb2684955 [0,0,1,0,0,0|2,0,1]=4 2051 B10R1.61 O=C(Cl)c1ccccc1Cl Amb3939030 [0,0,1,0,0,0|2,0,1]=4 2052 B10R1.61 O=C(Cl)c1ccccc1F Amb2688032 [0,0,1,0,0,0|2,0,1]=4 2053 B10R1.61 O=C(Cl)c1ccccc1I Amb3939135 [0,0,1,0,0,0|2,0,1]=4 2054 B10R1.61 O=C(Cl)c1ccccc1O Amb6743363 [0,0,1,0,0,0|1,0,1]=3 2055 B10R1.61 O=C(Cl)c1ccccc1S Amb25770152 [0,0,1,0,0,0|1,1,1]=4 2056 B10R1.61 O=C(Cl)c1cccnc1O Amb24371117 [0,0,1,0,0,0|2,0,1]=4 2057 B10R1.61 O=C(Cl)c1cnccc1O Amb27778038 [0,0,1,0,0,0|2,0,1]=4 2058 B10R1.61 O=C(Cl)c1ncccc1O Amb25939920 [0,0,1,0,0,0|2,0,1]=4 2059 B10R1.61 O=C(O)C1=CC=CNC1=O Amb18832138 [0,0,1,0,0,0|2,0,1]=4 2060 B10R1.61 O=C(O)C1=CC=CNC1=S Amb18799572 [0,0,1,0,0,0|2,1,0]=4 2061 B10R1.61 O=C(O)C1=CC=COC1=O Amb19894956 [0,0,1,0,0,0|2,0,1]=4 2062 B10R1.61 O=C(O)C1=CNC=CC1=O Amb22489507 [0,0,1,0,0,0|2,0,1]=4 2063 B10R1.61 O=C(O)c1cccc[n+]1[O-] Amb2609997 [0,0,1,0,0,0|2,0,1]=4 2064 B10R1.61 O=C(O)c1ccccc1Br Amb6365362 [0,0,1,0,0,0|2,0,0]=3 2065 B10R1.61 O=C(O)c1ccccc1Cl Amb1935156 [0,0,1,0,0,0|2,0,0]=3 2066 B10R1.61 O=C(O)c1ccccc1F Amb2688022 [0,0,1,0,0,0|2,0,0]=3 2067 B10R1.61 O=C(O)c1ccccc1I Amb6446255 [0,0,1,0,0,0|2,0,0]=3 2068 B10R1.61 O=C(O)c1ccccc1O Amb1912504 [0,0,1,0,0,0|1,0,0]=2 2069 B10R1.61 O=C(O)c1ccccc1S Amb901970 [0,0,1,0,0,0|1,1,0]=3 2070 B10R1.61 O=C(O)c1cccnc1Br Amb2447561 [0,0,1,0,0,0|3,0,0]=4 2071 B10R1.61 O=C(O)c1cccnc1Cl Amb745876 [0,0,1,0,0,0|3,0,0]=4 2072 B10R1.61 O=C(O)c1cccnc1F Amb2447268 [0,0,1,0,0,0|3,0,0]=4 2073 B10R1.61 O=C(O)c1cccnc1I Amb33529189 [0,0,1,0,0,0|3,0,0]=4 2074 B10R1.61 O=C(O)c1cccnc1O Amb1950661 [0,0,1,0,0,0|2,0,0]=3 2075 B10R1.61 O=C(O)c1cccnc1S Amb1210101 [0,0,1,0,0,0|2,1,0]=4 2076 B10R1.61 O=C(O)c1ccncc1Br Amb1094019 [0,0,1,0,0,0|3,0,0]=4 2077 B10R1.61 O=C(O)c1ccncc1Cl Amb2447292 [0,0,1,0,0,0|3,0,0]=4 2078 B10R1.61 O=C(O)c1ccncc1F Amb10840476 [0,0,1,0,0,0|3,0,0]=4 2079 B10R1.61 O=C(O)c1ccncc1F Amb2447421 [0,0,1,0,0,0|3,0,0]=4 2080 B10R1.61 O=C(O)c1ccncc1I Amb2610033 [0,0,1,0,0,0|3,0,0]=4 2081 B10R1.61 O=C(O)c1ccncc1O Amb2609529 [0,0,1,0,0,0|2,0,0]=3 2082 B10R1.61 O=C(O)c1ccncc1S Amb18644719 [0,0,1,0,0,0|2,1,0]=4 2083 B10R1.61 O=C(O)c1cnccc1Br Amb21927781 [0,0,1,0,0,0|3,0,0]=4 2084 B10R1.61 O=C(O)c1cnccc1Br Amb30647471 [0,0,1,0,0,0|3,0,0]=4 2085 B10R1.61 O=C(O)c1cnccc1Br Amb6297661 [0,0,1,0,0,0|3,0,0]=4 2086 B10R1.61 O=C(O)c1cnccc1Cl Amb2610789 [0,0,1,0,0,0|3,0,0]=4 2087 B10R1.61 O=C(O)c1cnccc1F Amb17942817 [0,0,1,0,0,0|3,0,0]=4 2088 B10R1.61 O=C(O)c1cnccc1I Amb2610811 [0,0,1,0,0,0|3,0,0]=4 2089 B10R1.61 O=C(O)c1cnccc1I Amb33457296 [0,0,1,0,0,0|3,0,0]=4 2090 B10R1.61 O=C(O)c1cnccc1O Amb1420333 [0,0,1,0,0,0|2,0,0]=3 2091 B10R1.61 O=C(O)c1cnccc1S Amb2612001 [0,0,1,0,0,0|2,1,0]=4 2092 B10R1.61 O=C(O)c1cncnc1O Amb16735285 [0,0,1,0,0,0|3,0,0]=4 2093 B10R1.61 O=C(O)c1ncccc1Br Amb2447560 [0,0,1,0,0,0|3,0,0]=4 2094 B10R1.61 O=C(O)c1ncccc1Br Amb33379069 [0,0,1,0,0,0|3,0,0]=4 2095 B10R1.61 O=C(O)c1ncccc1Cl Amb2610115 [0,0,1,0,0,0|3,0,0]=4 2096 B10R1.61 O=C(O)c1ncccc1F Amb2447510 [0,0,1,0,0,0|3,0,0]=4 2097 B10R1.61 O=C(O)c1ncccc1I Amb10602322 [0,0,1,0,0,0|3,0,0]=4 2098 B10R1.61 O=C(O)c1ncccc1O Amb2610788 [0,0,1,0,0,0|2,0,0]=3 2099 B10R1.61 O=C(O)c1ncccc1S Amb18644720 [0,0,1,0,0,0|2,1,0]=4 2100 B10R1.61 O=C(O)c1nccnc1O Amb2695554 [0,0,1,0,0,0|3,0,0]=4 2101 B10R1.61 O=C(O)c1nnccc1O Amb26479954 [0,0,1,0,0,0|3,0,0]=4 2102 B10R1.61 O=C([O-])c1ccccc1Cl Amb2610308 [0,0,1,0,0,0|2,0,1]=4 2103 B10R1.61 O=C([O-])c1ccccc1F Amb8397063 [0,0,1,0,0,0|2,0,1]=4 2104 B10R1.61 O=C([O-])c1ccccc1O Amb20246478 [0,0,1,0,0,0|1,0,1]=3 2105 B10R1.61 O=C([O-])c1ccccc1O Amb22338523 [0,0,1,0,0,0|1,0,1]=3 2106 B10R1.61 O=C([O-])c1ccccc1O Amb22732059 [0,0,1,0,0,0|1,0,1]=3 2107 B10R1.61 O=C([O-])c1ccccc1O Amb6383226 [0,0,1,0,0,0|1,0,1]=3 2108 B10R1.61 O=C([O-])c1ccccc1O Amb8485790 [0,0,1,0,0,0|1,0,1]=3 2109 B10R1.61 O=C([O-])c1cccnc1O Amb2609528 [0,0,1,0,0,0|2,0,1]=4 2110 B10R1.61 O=C([O-])c1cnccc1O Amb2609530 [0,0,1,0,0,0|2,0,1]=4 2111 B10R1.61 O=N(=O)c1ccccc1O Amb8396530 [0,0,1,0,0,0|2,0,1]=4 2112 B10R1.61 O=S(O)c1ccccc1F Amb26866329 [0,0,1,0,0,0|3,0,0]=4 2113 B10R1.61 O=S([O-])c1ccccc1O Amb32755496 [0,0,1,0,0,0|2,0,1]=4 2114 B10R1.61 O=[N+]([O-])c1ccccc1O Amb6387467 [0,0,1,0,0,0|2,0,1]=4 2115 B10R1.61 OB(O)c1ccccc1Br Amb6366157 [0,0,1,0,0,0|3,0,0]=4 2116 B10R1.61 OB(O)c1ccccc1Cl Amb2383486 [0,0,1,0,0,0|3,0,0]=4 2117 B10R1.61 OB(O)c1ccccc1F Amb2447092 [0,0,1,0,0,0|3,0,0]=4 2118 B10R1.61 OB(O)c1ccccc1I Amb16234273 [0,0,1,0,0,0|3,0,0]=4 2119 B10R1.61 OB(O)c1ccccc1O Amb2447024 [0,0,1,0,0,0|2,0,0]=3 2120 B10R1.61 OB(O)c1ccccc1S Amb19958291 [0,0,1,0,0,0|2,1,0]=4 2121 B10R1.61 OB(O)c1ccncc1O Amb13887195 [0,0,1,0,0,0|3,0,0]=4 2122 B10R1.61 OC(=S)c1ccccc1O Amb22734424 [0,0,1,0,0,0|1,0,0]=2 2123 B10R1.61 OC(O)c1ccccc1Cl Amb28050633 [0,0,1,0,0,0|2,0,1]=4 2124 B10R1.61 Oc1ccccc1C(=S)S Amb4021959 [0,0,1,0,0,0|1,1,0]=3 2125 B10R1.61 Oc1ccccc1C(F)F Amb22896722 [0,0,1,0,0,0|2,0,1]=4 2126 B10R1.187 Cc1noc(C)c1\C=C\Br Amb33134937 [0,0,1,0,0,0|2,0,1]=4 2127 B12R3.12 c1ccc2c(c1)CC3OC23 Amb1131588 [0,0,0,1,0,0|2,0,1]=4 2128 B12R3.12 c1ccc2c(c1)C[C@@H]3O[C@H]23 Amb6893758 [0,0,0,1,0,0|2,0,1]=4 2129 B12R3.12 c1ccc2c(c1)nc3nc32 Amb27774849 [0,0,0,1,0,0|3,0,0]=4 2130 B12R3.12 c1ccc2c3n(cc2c1)C3 Amb27781391 [0,0,0,1,0,0|2,0,1]=4 2131 B12R3.12 c1ccc2c3n(cc2c1)N3 Amb28282754 [0,0,0,1,0,0|2,0,1]=4 2132 B12R3.1604 C1=CN2C=C3OCC(=C13)C2 Amb24100739 [0,0,0,1,0,0|3,0,0]=4 2133 B10R2.32 Nc1nsc2ccsc12 Amb18200139 [0,0,0,0,1,0|2,1,0]=4 2134 B10R2.32 O=C1COc2cscc21 Amb18202878 [0,0,0,0,1,0|2,0,1]=4 2135 B10R2.32 Oc1noc2c1CCC2 Amb32653802 [0,0,0,0,1,0|0,0,3]=4 2136 B10R2.32 Oc1noc2c1CNC2 Amb18832778 [0,0,0,0,1,0|1,0,2]=4 2137 B10R2.320 BrC1Cc2ccccc21 Amb8395938 [0,0,0,0,1,0|2,0,1]=4 2138 B10R2.320 CC1=Cc2ccccc21 Amb27838637 [0,0,0,0,1,0|2,0,0]=3 2139 B10R2.320 CC1Cc2ccccc21 Amb17778870 [0,0,0,0,1,0|2,0,1]=4 2140 B10R2.320 ClC1=Cc2ccccc21 Amb24402931 [0,0,0,0,1,0|2,0,0]=3 2141 B10R2.320 ClC1Cc2ccccc21 Amb17778800 [0,0,0,0,1,0|2,0,1]=4 2142 B10R2.320 FC1=Cc2ccccc21 Amb28053263 [0,0,0,0,1,0|2,0,0]=3 2143 B10R2.320 FC1Cc2ccccc21 Amb26861975 [0,0,0,0,1,0|2,0,1]=4 2144 B10R2.320 IC1=Cc2ccccc21 Amb28041016 [0,0,0,0,1,0|2,0,0]=3 2145 B10R2.320 IC1Cc2ccccc21 Amb27465878 [0,0,0,0,1,0|2,0,1]=4 2146 B10R2.320 NC1=Cc2ccccc21 Amb26390616 [0,0,0,0,1,0|2,0,0]=3 2147 B10R2.320 NC1Cc2ccccc21 Amb26866193 [0,0,0,0,1,0|2,0,1]=4 2148 B10R2.320 NC1Cc2ccccc21 Amb33552087 [0,0,0,0,1,0|2,0,1]=4 2149 B10R2.320 O=C1Cc2ccccc21 Amb8395940 [0,0,0,0,1,0|1,0,1]=3 2150 B10R2.320 O=C1Nc2ccccc21 Amb28436763 [0,0,0,0,1,0|0,0,2]=3 2151 B10R2.320 O=C1Sc2ncccc21 Amb28342602 [0,0,0,0,1,0|1,1,1]=4 2152 B10R2.320 OC1Cc2ccccc21 Amb17778676 [0,0,0,0,1,0|1,0,1]=3 2153 B10R2.320 [NH3+]C1Cc2ccccc21 Amb17778877 [0,0,0,0,1,0|2,0,1]=4 2154 B12R2.24 BrC1=Cc2ccccc2CC1 Amb25726468 [0,0,0,0,0,1|3,0,0]=4 2155 B12R2.24 BrC1=Cc2ccccc2OC1 Amb27841536 [0,0,0,0,0,1|2,0,0]=3 2156 B12R2.24 BrC1COc2ccccc2C1 Amb28202605 [0,0,0,0,0,1|2,0,1]=4 2157 B12R2.24 Brc1cc2ccccc2cn1 Amb8438943 [0,0,0,0,0,1|2,0,0]=3 2158 B12R2.24 Brc1cc2cccnc2cn1 Amb35745025 [0,0,0,0,0,1|3,0,0]=4 2159 B12R2.24 Brc1cc2ccncc2cn1 Amb35745026 [0,0,0,0,0,1|3,0,0]=4 2160 B12R2.24 Brc1ccc2ccccc2c1 Amb1159157 [0,0,0,0,0,1|3,0,0]=4 2161 B12R2.24 Brc1ccc2ccccc2n1 Amb8397285 [0,0,0,0,0,1|3,0,0]=4 2162 B12R2.24 Brc1cnc2ccccc2c1 Amb2722485 [0,0,0,0,0,1|3,0,0]=4 2163 B12R2.24 Brc1cnc2ccccc2n1 Amb33538649 [0,0,0,0,0,1|3,0,0]=4 2164 B12R2.24 Brc1ncc2ccccc2n1 Amb23399840 [0,0,0,0,0,1|2,0,0]=3 2165 B12R2.24 Brc1nnc2ccccc2n1 Amb18773542 [0,0,0,0,0,1|2,0,0]=3 2166 B12R2.24 C=C1CCc2ccccc2O1 Amb27210216 [0,0,0,0,0,1|3,0,0]=4 2167 B12R2.24 CC1=Cc2ccccc2CC1 Amb31292543 [0,0,0,0,0,1|3,0,0]=4 2168 B12R2.24 CC1=Cc2ccccc2CN1 Amb28322961 [0,0,0,0,0,1|2,0,1]=4 2169 B12R2.24 CC1=Cc2ccccc2NC1 Amb18559652 [0,0,0,0,0,1|3,0,0]=4 2170 B12R2.24 CC1=NNc2ccncc2N1 Amb27635347 [0,0,0,0,0,1|3,0,0]=4 2171 B12R2.24 CC1=Nc2ccccc2CN1 Amb6892861 [0,0,0,0,0,1|2,0,1]=4 2172 B12R2.24 CC1=Nc2ccccc2CO1 Amb27391671 [0,0,0,0,0,1|3,0,0]=4 2173 B12R2.24 CC1=Nc2ccccc2NC1 Amb27244163 [0,0,0,0,0,1|3,0,0]=4 2174 B12R2.24 CC1=Nc2ccccc2SC1 Amb10976510 [0,0,0,0,0,1|2,1,0]=4 2175 B12R2.24 CC1COc2ccccc2N1 Amb3427952 [0,0,0,0,0,1|2,0,1]=4 2176 B12R2.24 CC1COc2ccccc2O1 Amb27762394 [0,0,0,0,0,1|2,0,1]=4 2177 B12R2.24 CC1Cc2ccccc2C=N1 Amb27481551 [0,0,0,0,0,1|2,0,1]=4 2178 B12R2.24 CN1Cc2ccccc2C=N1 Amb8391965 [0,0,0,0,0,1|3,0,0]=4 2179 B12R2.24 C[C@@H]1Cc2ccccc2C=N1 Amb8388240 [0,0,0,0,0,1|2,0,1]=4 2180 B12R2.24 C[C@H]1COc2ccccc2N1 Amb28340950 [0,0,0,0,0,1|2,0,1]=4 2181 B12R2.24 Cc1cc2ccccc2cn1 Amb8395994 [0,0,0,0,0,1|2,0,0]=3 2182 B12R2.24 Cc1cc2ccncc2cn1 Amb28250070 [0,0,0,0,0,1|3,0,0]=4 2183 B12R2.24 Cc1ccc2ccccc2c1 Amb6608830 [0,0,0,0,0,1|3,0,0]=4 2184 B12R2.24 Cc1ccc2ccccc2n1 Amb1151967 [0,0,0,0,0,1|3,0,0]=4 2185 B12R2.24 Cc1ccc2ccccc2n1 Amb33249592 [0,0,0,0,0,1|3,0,0]=4 2186 B12R2.24 Cc1cnc2ccccc2c1 Amb2447051 [0,0,0,0,0,1|3,0,0]=4 2187 B12R2.24 Cc1cnc2ccccc2n1 Amb4026338 [0,0,0,0,0,1|3,0,0]=4 2188 B12R2.24 Cc1nnc2ccccc2n1 Amb9824915 [0,0,0,0,0,1|2,0,0]=3 2189 B12R2.24 Cc1nnc2ccncc2n1 Amb26940870 [0,0,0,0,0,1|3,0,0]=4 2190 B12R2.24 ClC1=Nc2ccccc2SC1 Amb6761149 [0,0,0,0,0,1|2,1,0]=4 2191 B12R2.24 Clc1cc2ccccc2cn1 Amb10071462 [0,0,0,0,0,1|2,0,0]=3 2192 B12R2.24 Clc1cc2cccnc2cn1 Amb25284449 [0,0,0,0,0,1|3,0,0]=4 2193 B12R2.24 Clc1cc2cnccc2cn1 Amb25680123 [0,0,0,0,0,1|3,0,0]=4 2194 B12R2.24 Clc1ccc2ccccc2c1 Amb6365655 [0,0,0,0,0,1|3,0,0]=4 2195 B12R2.24 Clc1ccc2ccccc2n1 Amb2611299 [0,0,0,0,0,1|3,0,0]=4 2196 B12R2.24 Clc1cnc2ccccc2c1 Amb19515997 [0,0,0,0,0,1|3,0,0]=4 2197 B12R2.24 Clc1cnc2ccccc2n1 Amb2371875 [0,0,0,0,0,1|3,0,0]=4 2198 B12R2.24 Clc1ncc2ccccc2n1 Amb6316147 [0,0,0,0,0,1|2,0,0]=3 2199 B12R2.24 Clc1ncc2cccnc2n1 Amb21962152 [0,0,0,0,0,1|3,0,0]=4 2200 B12R2.24 Clc1ncc2ccncc2n1 Amb25152801 [0,0,0,0,0,1|3,0,0]=4 2201 B12R2.24 Clc1ncc2cnccc2n1 Amb5754389 [0,0,0,0,0,1|3,0,0]=4 2202 B12R2.24 Clc1ncc2ncccc2n1 Amb25821843 [0,0,0,0,0,1|3,0,0]=4 2203 B12R2.24 Clc1nnc2ccccc2n1 Amb25824203 [0,0,0,0,0,1|2,0,0]=3 2204 B12R2.24 FC1=Cc2ccccc2CC1 Amb26441264 [0,0,0,0,0,1|3,0,0]=4 2205 B12R2.24 FC1COc2ccccc2C1 Amb28291388 [0,0,0,0,0,1|2,0,1]=4 2206 B12R2.24 Fc1ccc2ccccc2c1 Amb5544291 [0,0,0,0,0,1|3,0,0]=4 2207 B12R2.24 Fc1ccc2ccccc2n1 Amb20171185 [0,0,0,0,0,1|3,0,0]=4 2208 B12R2.24 Fc1cnc2ccccc2c1 Amb22234447 [0,0,0,0,0,1|3,0,0]=4 2209 B12R2.24 Fc1nnc2ccccc2n1 Amb35653818 [0,0,0,0,0,1|2,0,0]=3 2210 B12R2.24 Ic1cc2ccccc2cn1 Amb22170100 [0,0,0,0,0,1|2,0,0]=3 2211 B12R2.24 Ic1ccc2ccccc2c1 Amb4013025 [0,0,0,0,0,1|3,0,0]=4 2212 B12R2.24 Ic1ccc2ccccc2n1 Amb10604284 [0,0,0,0,0,1|3,0,0]=4 2213 B12R2.24 Ic1cnc2ccccc2c1 Amb19373724 [0,0,0,0,0,1|3,0,0]=4 2214 B12R2.24 Ic1cnc2ccccc2n1 Amb24084425 [0,0,0,0,0,1|3,0,0]=4 2215 B12R2.24 Ic1ncc2ccccc2n1 Amb27229523 [0,0,0,0,0,1|2,0,0]=3 2216 B12R2.24 N=C1C=c2ccccc2=NC1 Amb24061571 [0,0,0,0,0,1|3,0,0]=4 2217 B12R2.24 NC1=Cc2ccccc2NC1 Amb25079184 [0,0,0,0,0,1|3,0,0]=4 2218 B12R2.24 NC1=Nc2ccccc2CC1 Amb2373583 [0,0,0,0,0,1|3,0,0]=4 2219 B12R2.24 NC1=Nc2ccccc2CN1 Amb18644339 [0,0,0,0,0,1|2,0,1]=4 2220 B12R2.24 NC1=Nc2ccccc2CS1 Amb28057142 [0,0,0,0,0,1|3,0,0]=4 2221 B12R2.24 NC1=Nc2ccccc2NN1 Amb27846252 [0,0,0,0,0,1|2,0,1]=4 2222 B12R2.24 NC1=Nc2ccccc2NS1 Amb27632409 [0,0,0,0,0,1|3,0,0]=4 2223 B12R2.24 NC1=Nc2ccccc2OC1 Amb18124903 [0,0,0,0,0,1|2,0,0]=3 2224 B12R2.24 NC1=Nc2ccccc2SC1 Amb19136101 [0,0,0,0,0,1|2,1,0]=4 2225 B12R2.24 NC1=Nc2ccccc2SC1 Amb1918677 [0,0,0,0,0,1|2,1,0]=4 2226 B12R2.24 NC1COc2ccccc2C1 Amb7969877 [0,0,0,0,0,1|2,0,1]=4 2227 B12R2.24 NC1COc2ccccc2C1 Amb9725226 [0,0,0,0,0,1|2,0,1]=4 2228 B12R2.24 N[C@@H]1COc2ccccc2C1 Amb23385337 [0,0,0,0,0,1|2,0,1]=4 2229 B12R2.24 N[C@@H]1COc2ccccc2C1 Amb24485980 [0,0,0,0,0,1|2,0,1]=4 2230 B12R2.24 N[C@H]1COc2ccccc2C1 Amb22756584 [0,0,0,0,0,1|2,0,1]=4 2231 B12R2.24 N[C@H]1COc2ccccc2C1 Amb28313694 [0,0,0,0,0,1|2,0,1]=4 2232 B12R2.24 Nc1cc2ccccc2cn1 Amb2722858 [0,0,0,0,0,1|2,0,0]=3 2233 B12R2.24 Nc1cc2ccccc2nn1 Amb8438995 [0,0,0,0,0,1|2,0,0]=3 2234 B12R2.24 Nc1cc2cccnc2cn1 Amb22495695 [0,0,0,0,0,1|3,0,0]=4 2235 B12R2.24 Nc1cc2cccnc2cn1 Amb32668902 [0,0,0,0,0,1|3,0,0]=4 2236 B12R2.24 Nc1ccc2ccccc2c1 Amb22057457 [0,0,0,0,0,1|3,0,0]=4 2237 B12R2.24 Nc1ccc2ccccc2c1 Amb3940108 [0,0,0,0,0,1|3,0,0]=4 2238 B12R2.24 Nc1ccc2ccccc2n1 Amb1152993 [0,0,0,0,0,1|3,0,0]=4 2239 B12R2.24 Nc1cnc2ccccc2c1 Amb534917 [0,0,0,0,0,1|3,0,0]=4 2240 B12R2.24 Nc1cnc2ccccc2n1 Amb4135072 [0,0,0,0,0,1|3,0,0]=4 2241 B12R2.24 Nc1ncc2ccccc2n1 Amb8631314 [0,0,0,0,0,1|2,0,0]=3 2242 B12R2.24 Nc1ncc2cccnc2n1 Amb33544085 [0,0,0,0,0,1|3,0,0]=4 2243 B12R2.24 Nc1ncc2ccncc2n1 Amb25239392 [0,0,0,0,0,1|3,0,0]=4 2244 B12R2.24 Nc1ncc2ncccc2n1 Amb27467697 [0,0,0,0,0,1|3,0,0]=4 2245 B12R2.24 Nc1nnc2ccccc2n1 Amb8630454 [0,0,0,0,0,1|2,0,0]=3 2246 B12R2.24 Nc1nnc2cnccc2n1 Amb18644312 [0,0,0,0,0,1|3,0,0]=4 2247 B12R2.24 O=C1C=C2C=CC=CC2=CN1 Amb19958596 [0,0,0,0,0,1|1,0,2]=4 2248 B12R2.24 O=C1C=C2C=CC=CC2=NN1 Amb21864850 [0,0,0,0,0,1|1,0,2]=4 2249 B12R2.24 O=C1C=Cc2ccccc2N1 Amb18546039 [0,0,0,0,0,1|2,0,1]=4 2250 B12R2.24 O=C1C=Cc2ccccc2O1 Amb18511466 [0,0,0,0,0,1|2,0,1]=4 2251 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb21940629 [0,0,0,0,0,1|2,0,1]=4 2252 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb28991227 [0,0,0,0,0,1|2,0,1]=4 2253 B12R2.24 O=C1C=Nc2ccccc2N1 Amb18372452 [0,0,0,0,0,1|2,0,1]=4 2254 B12R2.24 O=C1CCc2ccccc2C1 Amb2383557 [0,0,0,0,0,1|2,0,1]=4 2255 B12R2.24 O=C1CCc2ccccc2N1 Amb6358187 [0,0,0,0,0,1|2,0,1]=4 2256 B12R2.24 O=C1CCc2ccccc2O1 Amb533490 [0,0,0,0,0,1|2,0,1]=4 2257 B12R2.24 O=C1CNc2ccccc2C1 Amb18202302 [0,0,0,0,0,1|2,0,1]=4 2258 B12R2.24 O=C1CNc2ccccc2N1 Amb6355388 [0,0,0,0,0,1|2,0,1]=4 2259 B12R2.24 O=C1CNc2ccccc2O1 Amb22166855 [0,0,0,0,0,1|2,0,1]=4 2260 B12R2.24 O=C1COc2ccccc2C1 Amb15692703 [0,0,0,0,0,1|1,0,1]=3 2261 B12R2.24 O=C1COc2ccccc2N1 Amb1011836 [0,0,0,0,0,1|1,0,1]=3 2262 B12R2.24 O=C1COc2ccccc2O1 Amb2759474 [0,0,0,0,0,1|1,0,1]=3 2263 B12R2.24 O=C1COc2cccnc2N1 Amb592999 [0,0,0,0,0,1|2,0,1]=4 2264 B12R2.24 O=C1COc2ccncc2N1 Amb13890254 [0,0,0,0,0,1|2,0,1]=4 2265 B12R2.24 O=C1COc2cnccc2N1 Amb22899221 [0,0,0,0,0,1|2,0,1]=4 2266 B12R2.24 O=C1COc2ncccc2N1 Amb9824130 [0,0,0,0,0,1|2,0,1]=4 2267 B12R2.24 O=C1CSc2ccccc2C1 Amb22231635 [0,0,0,0,0,1|1,1,1]=4 2268 B12R2.24 O=C1CSc2ccccc2N1 Amb1007458 [0,0,0,0,0,1|1,1,1]=4 2269 B12R2.24 O=C1Cc2ccccc2CN1 Amb33544470 [0,0,0,0,0,1|1,0,2]=4 2270 B12R2.24 O=C1Cc2ccccc2CO1 Amb17750259 [0,0,0,0,0,1|2,0,1]=4 2271 B12R2.24 O=C1N=Cc2ccccc2N1 Amb20653982 [0,0,0,0,0,1|1,0,1]=3 2272 B12R2.24 O=C1N=Cc2ccccc2O1 Amb22054765 [0,0,0,0,0,1|1,0,1]=3 2273 B12R2.24 O=C1NCc2ccccc2O1 Amb27468708 [0,0,0,0,0,1|1,0,2]=4 2274 B12R2.24 O=C1Nc2ccccc2CO1 Amb19516356 [0,0,0,0,0,1|2,0,1]=4 2275 B12R2.24 OC1=CC=C2C=CC=CN2C1 Amb17835334 [0,0,0,0,0,1|3,0,0]=4 2276 B12R2.24 OC1=COc2ncccc2N1 Amb19516358 [0,0,0,0,0,1|2,0,0]=3 2277 B12R2.24 OC1=Nc2ccccc2OC1 Amb22330533 [0,0,0,0,0,1|1,0,0]=2 2278 B12R2.24 OC1C=Cc2ccccc2S1 Amb27394776 [0,0,0,0,0,1|2,0,1]=4 2279 B12R2.24 OC1CCc2ccccc2C1 Amb2721268 [0,0,0,0,0,1|2,0,1]=4 2280 B12R2.24 OC1CCc2ccccc2N1 Amb27209313 [0,0,0,0,0,1|2,0,1]=4 2281 B12R2.24 OC1CCc2ccccc2O1 Amb22230405 [0,0,0,0,0,1|2,0,1]=4 2282 B12R2.24 OC1CNc2ccccc2C1 Amb33313463 [0,0,0,0,0,1|2,0,1]=4 2283 B12R2.24 OC1CNc2ccccc2C1 Amb33544228 [0,0,0,0,0,1|2,0,1]=4 2284 B12R2.24 OC1CNc2ccccc2O1 Amb24485948 [0,0,0,0,0,1|2,0,1]=4 2285 B12R2.24 OC1COc2ccccc2C1 Amb22498287 [0,0,0,0,0,1|1,0,1]=3 2286 B12R2.24 OC1COc2ccccc2O1 Amb10552971 [0,0,0,0,0,1|1,0,1]=3 2287 B12R2.24 OC1Cc2ccccc2CO1 Amb17593730 [0,0,0,0,0,1|2,0,1]=4 2288 B12R2.24 O[C@@H]1CCc2ccccc2C1 Amb25043599 [0,0,0,0,0,1|2,0,1]=4 2289 B12R2.24 O[C@@H]1CNc2ccccc2C1 Amb24426871 [0,0,0,0,0,1|2,0,1]=4 2290 B12R2.24 O[C@@H]1COc2ccccc2C1 Amb28321438 [0,0,0,0,0,1|1,0,1]=3 2291 B12R2.24 O[C@H]1CCc2ccccc2C1 Amb25149682 [0,0,0,0,0,1|2,0,1]=4 2292 B12R2.24 O[C@H]1CNc2ccccc2C1 Amb27617395 [0,0,0,0,0,1|2,0,1]=4 2293 B12R2.24 Oc1cc2ccccc2cn1 Amb10068513 [0,0,0,0,0,1|1,0,0]=2 2294 B12R2.24 Oc1cc2cnccc2cn1 Amb25051663 [0,0,0,0,0,1|2,0,0]=3 2295 B12R2.24 Oc1cc[n+]2ccccc2c1 Amb24309279 [0,0,0,0,0,1|3,0,0]=4 2296 B12R2.24 Oc1ccc2ccccc2c1 Amb2609036 [0,0,0,0,0,1|2,0,0]=3 2297 B12R2.24 Oc1ccc2cccnc2c1 Amb33204453 [0,0,0,0,0,1|3,0,0]=4 2298 B12R2.24 Oc1ccc2cccnc2c1 Amb535010 [0,0,0,0,0,1|3,0,0]=4 2299 B12R2.24 Oc1ccc2cccnc2n1 Amb9806398 [0,0,0,0,0,1|3,0,0]=4 2300 B12R2.24 Oc1ccc2ccncc2c1 Amb1152014 [0,0,0,0,0,1|3,0,0]=4 2301 B12R2.24 Oc1ccc2ccncc2c1 Amb19373209 [0,0,0,0,0,1|3,0,0]=4 2302 B12R2.24 Oc1ccc2cnccc2c1 Amb10067627 [0,0,0,0,0,1|3,0,0]=4 2303 B12R2.24 Oc1ccc2cnccc2c1 Amb30325887 [0,0,0,0,0,1|3,0,0]=4 2304 B12R2.24 Oc1ccc2ncccc2c1 Amb2609971 [0,0,0,0,0,1|3,0,0]=4 2305 B12R2.24 Oc1cnc2ccccc2c1 Amb2610757 [0,0,0,0,0,1|2,0,0]=3 2306 B12R2.24 Oc1cnc2ccccc2n1 Amb2603786 [0,0,0,0,0,1|2,0,0]=3 2307 B12R2.24 Oc1cnc2cccnc2c1 Amb13890072 [0,0,0,0,0,1|3,0,0]=4 2308 B12R2.24 Oc1cnc2ccncc2c1 Amb27265400 [0,0,0,0,0,1|3,0,0]=4 2309 B12R2.24 Oc1cnc2ncccc2c1 Amb26616876 [0,0,0,0,0,1|3,0,0]=4 2310 B12R2.24 Oc1cnc2ncccc2c1 Amb32653317 [0,0,0,0,0,1|3,0,0]=4 2311 B12R2.24 Oc1ncc2nccnc2n1 Amb24428731 [0,0,0,0,0,1|3,0,0]=4 2312 B12R2.24 Oc1nnc2ccccc2n1 Amb27445418 [0,0,0,0,0,1|1,0,0]=2 2313 B12R2.24 Oc1nnc2ncncc2n1 Amb26863296 [0,0,0,0,0,1|3,0,0]=4 2314 B12R2.24 S=C1C=Cc2ccccc2N1 Amb18526983 [0,0,0,0,0,1|2,1,0]=4 2315 B12R2.24 S=C1C=Nc2ccccc2N1 Amb18043605 [0,0,0,0,0,1|2,1,0]=4 2316 B12R2.24 S=C1CCc2ccccc2N1 Amb25700408 [0,0,0,0,0,1|2,1,0]=4 2317 B12R2.24 S=C1COc2ccccc2N1 Amb10070958 [0,0,0,0,0,1|1,1,0]=3 2318 B12R2.24 S=C1CSc2ccccc2N1 Amb1147064 [0,0,0,0,0,1|1,2,0]=4 2319 B12R2.24 S=C1NCc2ccccc2N1 Amb9810735 [0,0,0,0,0,1|1,1,1]=4 2320 B12R2.24 S=C1Nc2ccccc2CO1 Amb27782447 [0,0,0,0,0,1|2,1,0]=4 2321 B12R2.24 S=C1Nc2ccccc2CS1 Amb19221474 [0,0,0,0,0,1|2,1,0]=4 2322 B12R2.24 S=C1OCc2ccccc2O1 Amb28060956 [0,0,0,0,0,1|2,1,0]=4 2323 B12R2.24 SC1=COc2ccccc2N1 Amb28204091 [0,0,0,0,0,1|1,1,0]=3 2324 B12R2.24 SC1=Nc2ccccc2CS1 Amb444027 [0,0,0,0,0,1|2,1,0]=4 2325 B12R2.24 SC1COc2ccccc2C1 Amb25949570 [0,0,0,0,0,1|1,1,1]=4 2326 B12R2.24 Sc1ccc2ccccc2c1 Amb1152959 [0,0,0,0,0,1|2,1,0]=4 2327 B12R2.24 Sc1ccc2ccccc2n1 Amb1151737 [0,0,0,0,0,1|2,1,0]=4 2328 B12R2.24 Sc1cnc2ccccc2c1 Amb23440777 [0,0,0,0,0,1|2,1,0]=4 2329 B12R2.24 Sc1cnc2ccccc2n1 Amb837074 [0,0,0,0,0,1|2,1,0]=4 2330 B12R2.24 Sc1ncc2ccccc2n1 Amb27229522 [0,0,0,0,0,1|1,1,0]=3 2331 B12R2.24 [Mg+]c1ccc2ccccc2c1 Amb22044011 [0,0,0,0,0,1|3,0,0]=4 2332 B12R2.24 [O-][n+]1cc2ccccc2cn1 Amb10573276 [0,0,0,0,0,1|2,0,1]=4 2333 B12R2.586 Fc1ccc2cccccc12 Amb25111096 [0,0,0,0,0,1|3,0,0]=4 2334 B12R2.586 O=C1CCC2=C1CC=CC=C2 Amb27599449 [0,0,0,0,0,1|2,0,1]=4 2335 B12R2.586 O=C1CCC2=CC=CCC=C12 Amb28074670 [0,0,0,0,0,1|2,0,1]=4 2336 B12R2.586 O=C1CCC2=CCC=CC=C12 Amb28386613 [0,0,0,0,0,1|2,0,1]=4 2337 B12R2.1081 BrC1=CCOc2ccccc21 Amb28385954 [0,0,0,0,0,1|2,0,0]=3 2338 B12R2.1081 BrC1CCOc2ccccc21 Amb9210662 [0,0,0,0,0,1|2,0,1]=4 2339 B12R2.1081 Brc1cccc2ccccc12 Amb2795757 [0,0,0,0,0,1|3,0,0]=4 2340 B12R2.1081 Brc1ccnc2ccccc12 Amb2447564 [0,0,0,0,0,1|3,0,0]=4 2341 B12R2.1081 Brc1cncc2ccccc12 Amb6364997 [0,0,0,0,0,1|2,0,0]=3 2342 B12R2.1081 Brc1cncc2cccnc12 Amb2609625 [0,0,0,0,0,1|3,0,0]=4 2343 B12R2.1081 Brc1cncc2ncccc12 Amb7101479 [0,0,0,0,0,1|3,0,0]=4 2344 B12R2.1081 Brc1cnnc2ccccc12 Amb33548752 [0,0,0,0,0,1|2,0,0]=3 2345 B12R2.1081 Brc1nccc2ccccc12 Amb2609661 [0,0,0,0,0,1|2,0,0]=3 2346 B12R2.1081 Brc1nccc2cccnc12 Amb21857688 [0,0,0,0,0,1|3,0,0]=4 2347 B12R2.1081 Brc1nccc2ccncc12 Amb21856965 [0,0,0,0,0,1|3,0,0]=4 2348 B12R2.1081 Brc1nccc2cnccc12 Amb21857687 [0,0,0,0,0,1|3,0,0]=4 2349 B12R2.1081 Brc1nccc2ncccc12 Amb21857110 [0,0,0,0,0,1|3,0,0]=4 2350 B12R2.1081 Brc1ncnc2ccccc12 Amb10602647 [0,0,0,0,0,1|2,0,0]=3 2351 B12R2.1081 Brc1ncnc2cccnc12 Amb27172123 [0,0,0,0,0,1|3,0,0]=4 2352 B12R2.1081 Brc1nncc2ccccc12 Amb33531650 [0,0,0,0,0,1|2,0,0]=3 2353 B12R2.1081 C=C1C=CNc2ccccc21 Amb24070554 [0,0,0,0,0,1|3,0,0]=4 2354 B12R2.1081 C=C1CCCc2ccccc21 Amb25736652 [0,0,0,0,0,1|3,0,0]=4 2355 B12R2.1081 C=C1CCNc2ccccc21 Amb27596012 [0,0,0,0,0,1|3,0,0]=4 2356 B12R2.1081 C=C1CCOc2ccccc21 Amb26360090 [0,0,0,0,0,1|2,0,0]=3 2357 B12R2.1081 C=C1NC=Cc2ccccc21 Amb27186378 [0,0,0,0,0,1|2,0,1]=4 2358 B12R2.1081 CC1=CCCc2ccccc21 Amb2439915 [0,0,0,0,0,1|3,0,0]=4 2359 B12R2.1081 CC1=CCOc2ccccc21 Amb25694360 [0,0,0,0,0,1|2,0,0]=3 2360 B12R2.1081 CC1=NCCc2ccccc21 Amb17940779 [0,0,0,0,0,1|2,0,0]=3 2361 B12R2.1081 CC1=NCCc2ccccc21 Amb33446974 [0,0,0,0,0,1|2,0,0]=3 2362 B12R2.1081 CC1=NCCc2ccccc21 Amb8517423 [0,0,0,0,0,1|2,0,0]=3 2363 B12R2.1081 CC1=NCCc2ncccc21 Amb22751775 [0,0,0,0,0,1|3,0,0]=4 2364 B12R2.1081 CC1CCOc2ccccc21 Amb28194294 [0,0,0,0,0,1|2,0,1]=4 2365 B12R2.1081 CC1COCc2ccccc21 Amb23580749 [0,0,0,0,0,1|2,0,1]=4 2366 B12R2.1081 CN1CCOc2ccccc21 Amb10569245 [0,0,0,0,0,1|3,0,0]=4 2367 B12R2.1081 Cc1cccc2ccccc12 Amb6608819 [0,0,0,0,0,1|3,0,0]=4 2368 B12R2.1081 Cc1ccnc2ccccc12 Amb6608646 [0,0,0,0,0,1|3,0,0]=4 2369 B12R2.1081 Cc1cncc2ccccc12 Amb15691609 [0,0,0,0,0,1|2,0,0]=3 2370 B12R2.1081 Cc1cnnc2ccccc12 Amb21964128 [0,0,0,0,0,1|2,0,0]=3 2371 B12R2.1081 Cc1nccc2ccccc12 Amb17672018 [0,0,0,0,0,1|2,0,0]=3 2372 B12R2.1081 Cc1nccc2cccnc12 Amb27849252 [0,0,0,0,0,1|3,0,0]=4 2373 B12R2.1081 Cc1ncnc2ccccc12 Amb10573340 [0,0,0,0,0,1|2,0,0]=3 2374 B12R2.1081 Cc1nncc2ccccc12 Amb22499677 [0,0,0,0,0,1|2,0,0]=3 2375 B12R2.1081 Cc1nncc2ncccc12 Amb26594446 [0,0,0,0,0,1|3,0,0]=4 2376 B12R2.1081 ClC1=CCOc2ccccc21 Amb27194523 [0,0,0,0,0,1|2,0,0]=3 2377 B12R2.1081 ClC1CCOc2ccccc21 Amb33529009 [0,0,0,0,0,1|2,0,1]=4 2378 B12R2.1081 ClC1COCc2ccccc21 Amb22490656 [0,0,0,0,0,1|2,0,1]=4 2379 B12R2.1081 ClC1NN=Cc2ccccc21 Amb27659021 [0,0,0,0,0,1|2,0,1]=4 2380 B12R2.1081 Clc1ccnc2ccccc12 Amb1033000 [0,0,0,0,0,1|3,0,0]=4 2381 B12R2.1081 Clc1cncc2ccccc12 Amb8438946 [0,0,0,0,0,1|2,0,0]=3 2382 B12R2.1081 Clc1cncc2ncccc12 Amb21963428 [0,0,0,0,0,1|3,0,0]=4 2383 B12R2.1081 Clc1cnnc2ccccc12 Amb28990887 [0,0,0,0,0,1|2,0,0]=3 2384 B12R2.1081 Clc1cnnc2ccccc12 Amb8394534 [0,0,0,0,0,1|2,0,0]=3 2385 B12R2.1081 Clc1cnnc2cccnc12 Amb27469625 [0,0,0,0,0,1|3,0,0]=4 2386 B12R2.1081 Clc1cnnc2ncccc12 Amb24485934 [0,0,0,0,0,1|3,0,0]=4 2387 B12R2.1081 Clc1nccc2ccccc12 Amb2196515 [0,0,0,0,0,1|2,0,0]=3 2388 B12R2.1081 Clc1nccc2cccnc12 Amb2700583 [0,0,0,0,0,1|3,0,0]=4 2389 B12R2.1081 Clc1nccc2ccncc12 Amb19958084 [0,0,0,0,0,1|3,0,0]=4 2390 B12R2.1081 Clc1nccc2cnccc12 Amb10603407 [0,0,0,0,0,1|3,0,0]=4 2391 B12R2.1081 Clc1nccc2ncccc12 Amb8467898 [0,0,0,0,0,1|3,0,0]=4 2392 B12R2.1081 Clc1ncnc2ccccc12 Amb1107717 [0,0,0,0,0,1|2,0,0]=3 2393 B12R2.1081 Clc1ncnc2cccnc12 Amb10602710 [0,0,0,0,0,1|3,0,0]=4 2394 B12R2.1081 Clc1ncnc2cccnc12 Amb30639831 [0,0,0,0,0,1|3,0,0]=4 2395 B12R2.1081 Clc1ncnc2ccncc12 Amb10602712 [0,0,0,0,0,1|3,0,0]=4 2396 B12R2.1081 Clc1ncnc2cnccc12 Amb10602711 [0,0,0,0,0,1|3,0,0]=4 2397 B12R2.1081 Clc1ncnc2cnccc12 Amb22492465 [0,0,0,0,0,1|3,0,0]=4 2398 B12R2.1081 Clc1ncnc2ncccc12 Amb2372559 [0,0,0,0,0,1|3,0,0]=4 2399 B12R2.1081 Clc1nncc2ccccc12 Amb22723369 [0,0,0,0,0,1|2,0,0]=3 2400 B12R2.1081 Clc1nncc2ccccc12 Amb415171 [0,0,0,0,0,1|2,0,0]=3 2401 B12R2.1081 Clc1nncc2cccnc12 Amb26418480 [0,0,0,0,0,1|3,0,0]=4 2402 B12R2.1081 Clc1nncc2cnccc12 Amb22737742 [0,0,0,0,0,1|3,0,0]=4 2403 B12R2.1081 Clc1nncc2ncccc12 Amb24081487 [0,0,0,0,0,1|3,0,0]=4 2404 B12R2.1081 FC1=CCCc2ccccc21 Amb27482090 [0,0,0,0,0,1|3,0,0]=4 2405 B12R2.1081 Fc1cccc2ccccc12 Amb2688247 [0,0,0,0,0,1|3,0,0]=4 2406 B12R2.1081 Fc1ccnc2ccccc12 Amb10067580 [0,0,0,0,0,1|3,0,0]=4 2407 B12R2.1081 Fc1cncc2ccccc12 Amb22396493 [0,0,0,0,0,1|2,0,0]=3 2408 B12R2.1081 Fc1cncc2ccccc12 Amb6296546 [0,0,0,0,0,1|2,0,0]=3 2409 B12R2.1081 Fc1cncc2cccnc12 Amb27225198 [0,0,0,0,0,1|3,0,0]=4 2410 B12R2.1081 Fc1cncc2ncccc12 Amb27877615 [0,0,0,0,0,1|3,0,0]=4 2411 B12R2.1081 Fc1nccc2ccccc12 Amb24673352 [0,0,0,0,0,1|2,0,0]=3 2412 B12R2.1081 Fc1ncnc2ccccc12 Amb20669977 [0,0,0,0,0,1|2,0,0]=3 2413 B12R2.1081 IC1CCOc2ccccc21 Amb28060969 [0,0,0,0,0,1|2,0,1]=4 2414 B12R2.1081 Ic1cccc2ccccc12 Amb4605973 [0,0,0,0,0,1|3,0,0]=4 2415 B12R2.1081 Ic1ccnc2ccccc12 Amb5492738 [0,0,0,0,0,1|3,0,0]=4 2416 B12R2.1081 Ic1cncc2ccccc12 Amb2609665 [0,0,0,0,0,1|2,0,0]=3 2417 B12R2.1081 Ic1nccc2ccccc12 Amb2609664 [0,0,0,0,0,1|2,0,0]=3 2418 B12R2.1081 Ic1ncnc2ccccc12 Amb2795821 [0,0,0,0,0,1|2,0,0]=3 2419 B12R2.1081 NC1CCOc2ccccc21 Amb5717381 [0,0,0,0,0,1|2,0,1]=4 2420 B12R2.1081 NC1CCOc2ccccc21 Amb8333718 [0,0,0,0,0,1|2,0,1]=4 2421 B12R2.1081 NC1COCc2ccccc21 Amb10067658 [0,0,0,0,0,1|2,0,1]=4 2422 B12R2.1081 NC1COCc2ccccc21 Amb18202067 [0,0,0,0,0,1|2,0,1]=4 2423 B12R2.1081 NN1CCOc2ccccc21 Amb18125145 [0,0,0,0,0,1|3,0,0]=4 2424 B12R2.1081 N[C@@H]1CCOc2ccccc21 Amb13953038 [0,0,0,0,0,1|2,0,1]=4 2425 B12R2.1081 N[C@@H]1CCOc2ccccc21 Amb19515762 [0,0,0,0,0,1|2,0,1]=4 2426 B12R2.1081 N[C@H]1CCOc2ccccc21 Amb13953039 [0,0,0,0,0,1|2,0,1]=4 2427 B12R2.1081 N[C@H]1CCOc2ccccc21 Amb24052964 [0,0,0,0,0,1|2,0,1]=4 2428 B12R2.1081 N[C@H]1COCc2ccccc21 Amb27839884 [0,0,0,0,0,1|2,0,1]=4 2429 B12R2.1081 Nc1cccc2ccccc12 Amb1935098 [0,0,0,0,0,1|3,0,0]=4 2430 B12R2.1081 Nc1ccnc2ccccc12 Amb1102727 [0,0,0,0,0,1|3,0,0]=4 2431 B12R2.1081 Nc1ccnc2ccccc12 Amb7969523 [0,0,0,0,0,1|3,0,0]=4 2432 B12R2.1081 Nc1cncc2ccccc12 Amb22276925 [0,0,0,0,0,1|2,0,0]=3 2433 B12R2.1081 Nc1cncc2ccccc12 Amb2610662 [0,0,0,0,0,1|2,0,0]=3 2434 B12R2.1081 Nc1cncc2cccnc12 Amb22642050 [0,0,0,0,0,1|3,0,0]=4 2435 B12R2.1081 Nc1cncc2ccncc12 Amb28132921 [0,0,0,0,0,1|3,0,0]=4 2436 B12R2.1081 Nc1cnnc2ccccc12 Amb4408462 [0,0,0,0,0,1|2,0,0]=3 2437 B12R2.1081 Nc1nccc2ccccc12 Amb2609973 [0,0,0,0,0,1|2,0,0]=3 2438 B12R2.1081 Nc1nccc2ccccc12 Amb32663180 [0,0,0,0,0,1|2,0,0]=3 2439 B12R2.1081 Nc1nccc2cccnc12 Amb2691520 [0,0,0,0,0,1|3,0,0]=4 2440 B12R2.1081 Nc1nccc2ccncc12 Amb18124737 [0,0,0,0,0,1|3,0,0]=4 2441 B12R2.1081 Nc1nccc2ncccc12 Amb21857689 [0,0,0,0,0,1|3,0,0]=4 2442 B12R2.1081 Nc1ncnc2ccccc12 Amb1154616 [0,0,0,0,0,1|2,0,0]=3 2443 B12R2.1081 Nc1ncnc2cccnc12 Amb24351649 [0,0,0,0,0,1|3,0,0]=4 2444 B12R2.1081 Nc1ncnc2ccncc12 Amb18831454 [0,0,0,0,0,1|3,0,0]=4 2445 B12R2.1081 Nc1ncnc2ncccc12 Amb18124777 [0,0,0,0,0,1|3,0,0]=4 2446 B12R2.1081 Nc1nncc2ccccc12 Amb9378095 [0,0,0,0,0,1|2,0,0]=3 2447 B12R2.1081 Nc1nncc2cccnc12 Amb25369925 [0,0,0,0,0,1|3,0,0]=4 2448 B12R2.1081 Nc1nnnc2ccccc12 Amb23592273 [0,0,0,0,0,1|2,0,0]=3 2449 B12R2.1081 O=C1C=CCc2ccccc21 Amb2388336 [0,0,0,0,0,1|2,0,1]=4 2450 B12R2.1081 O=C1C=CNc2ccccc21 Amb18369085 [0,0,0,0,0,1|2,0,1]=4 2451 B12R2.1081 O=C1C=COc2ccccc21 Amb19894749 [0,0,0,0,0,1|1,0,1]=3 2452 B12R2.1081 O=C1C=COc2cccnc21 Amb32671309 [0,0,0,0,0,1|2,0,1]=4 2453 B12R2.1081 O=C1C=COc2cnccc21 Amb33484174 [0,0,0,0,0,1|2,0,1]=4 2454 B12R2.1081 O=C1C=CSc2ccccc21 Amb22347337 [0,0,0,0,0,1|1,1,1]=4 2455 B12R2.1081 O=C1C=NNc2ccccc21 Amb18528334 [0,0,0,0,0,1|1,0,1]=3 2456 B12R2.1081 O=C1CC=Nc2ccccc21 Amb24062843 [0,0,0,0,0,1|2,0,1]=4 2457 B12R2.1081 O=C1CCCc2ccccc21 Amb534638 [0,0,0,0,0,1|2,0,1]=4 2458 B12R2.1081 O=C1CCNc2ccccc21 Amb2699611 [0,0,0,0,0,1|2,0,1]=4 2459 B12R2.1081 O=C1CCNc2ccccc21 Amb33542509 [0,0,0,0,0,1|2,0,1]=4 2460 B12R2.1081 O=C1CCOc2ccccc21 Amb1153759 [0,0,0,0,0,1|1,0,1]=3 2461 B12R2.1081 O=C1CCOc2cccnc21 Amb33544080 [0,0,0,0,0,1|2,0,1]=4 2462 B12R2.1081 O=C1CCOc2cnccc21 Amb33742663 [0,0,0,0,0,1|2,0,1]=4 2463 B12R2.1081 O=C1CCOc2ncccc21 Amb24061183 [0,0,0,0,0,1|2,0,1]=4 2464 B12R2.1081 O=C1CCSc2ccccc21 Amb1151631 [0,0,0,0,0,1|1,1,1]=4 2465 B12R2.1081 O=C1CNCc2ccccc21 Amb22494722 [0,0,0,0,0,1|1,0,2]=4 2466 B12R2.1081 O=C1CNCc2ccccc21 Amb9783330 [0,0,0,0,0,1|1,0,2]=4 2467 B12R2.1081 O=C1CNNc2ccccc21 Amb22057606 [0,0,0,0,0,1|1,0,2]=4 2468 B12R2.1081 O=C1CNNc2ccccc21 Amb22494235 [0,0,0,0,0,1|1,0,2]=4 2469 B12R2.1081 O=C1COCc2ccccc21 Amb10067824 [0,0,0,0,0,1|1,0,1]=3 2470 B12R2.1081 O=C1COCc2cccnc21 Amb27964992 [0,0,0,0,0,1|2,0,1]=4 2471 B12R2.1081 O=C1COCc2ncccc21 Amb25152848 [0,0,0,0,0,1|2,0,1]=4 2472 B12R2.1081 O=C1CSCc2ccccc21 Amb2733969 [0,0,0,0,0,1|1,1,1]=4 2473 B12R2.1081 O=C1N=CN=C2C=CC=CN12 Amb27843723 [0,0,0,0,0,1|2,0,1]=4 2474 B12R2.1081 O=C1N=CNc2ncccc21 Amb19957598 [0,0,0,0,0,1|2,0,1]=4 2475 B12R2.1081 O=C1N=NC=C2NC=CC=C12 Amb19515546 [0,0,0,0,0,1|2,0,1]=4 2476 B12R2.1081 O=C1N=NNc2ccccc21 Amb19653630 [0,0,0,0,0,1|1,0,1]=3 2477 B12R2.1081 O=C1NC=Cc2ccccc21 Amb18364338 [0,0,0,0,0,1|1,0,2]=4 2478 B12R2.1081 O=C1NC=Nc2ccccc21 Amb18012662 [0,0,0,0,0,1|1,0,2]=4 2479 B12R2.1081 O=C1NCCc2ccccc21 Amb2502473 [0,0,0,0,0,1|1,0,2]=4 2480 B12R2.1081 O=C1NCSc2ccccc21 Amb27646438 [0,0,0,0,0,1|0,1,2]=4 2481 B12R2.1081 O=C1NN=Cc2ccccc21 Amb19338634 [0,0,0,0,0,1|1,0,1]=3 2482 B12R2.1081 O=C1NN=Cc2cccnc21 Amb19336036 [0,0,0,0,0,1|2,0,1]=4 2483 B12R2.1081 O=C1NN=Cc2cnccc21 Amb23557709 [0,0,0,0,0,1|2,0,1]=4 2484 B12R2.1081 O=C1NN=Cc2ncccc21 Amb19278034 [0,0,0,0,0,1|2,0,1]=4 2485 B12R2.1081 O=C1NN=Nc2ccccc21 Amb17933278 [0,0,0,0,0,1|1,0,1]=3 2486 B12R2.1081 O=C1NN=Nc2cccnc21 Amb25787175 [0,0,0,0,0,1|2,0,1]=4 2487 B12R2.1081 O=C1NNCc2ccccc21 Amb27215032 [0,0,0,0,0,1|1,0,2]=4 2488 B12R2.1081 O=C1NNCc2ccccc21 Amb33482996 [0,0,0,0,0,1|1,0,2]=4 2489 B12R2.1081 O=C1NOCc2ccccc21 Amb26878656 [0,0,0,0,0,1|0,0,2]=3 2490 B12R2.1081 O=C1OC=Cc2ccccc21 Amb25189261 [0,0,0,0,0,1|2,0,1]=4 2491 B12R2.1081 O=C1OC=Nc2ccccc21 Amb26019177 [0,0,0,0,0,1|2,0,1]=4 2492 B12R2.1081 O=C1OCCc2ccccc21 Amb16232507 [0,0,0,0,0,1|2,0,1]=4 2493 B12R2.1081 O=C1ON=Cc2ccccc21 Amb27628760 [0,0,0,0,0,1|1,0,1]=3 2494 B12R2.1081 O=C1SCCc2ccccc21 Amb24484481 [0,0,0,0,0,1|2,0,1]=4 2495 B12R2.1081 O=S1CCOc2ccccc21 Amb33189180 [0,0,0,0,0,1|2,0,1]=4 2496 B12R2.1081 OB1OCCc2ccccc21 Amb10070693 [0,0,0,0,0,1|3,0,0]=4 2497 B12R2.1081 OC1=C2C=CC=CN2CC=C1 Amb17835332 [0,0,0,0,0,1|3,0,0]=4 2498 B12R2.1081 OC1=CNNc2ccccc21 Amb22057612 [0,0,0,0,0,1|1,0,1]=3 2499 B12R2.1081 OC1=COCc2ccccc21 Amb10603427 [0,0,0,0,0,1|1,0,0]=2 2500 B12R2.1081 OC1C=CSc2ccccc21 Amb27980705 [0,0,0,0,0,1|1,1,1]=4 2501 B12R2.1081 OC1CCCc2ccccc21 Amb9702810 [0,0,0,0,0,1|2,0,1]=4 2502 B12R2.1081 OC1CCNc2ccccc21 Amb10553386 [0,0,0,0,0,1|2,0,1]=4 2503 B12R2.1081 OC1CCNc2ccccc21 Amb22276045 [0,0,0,0,0,1|2,0,1]=4 2504 B12R2.1081 OC1CCOc2ccccc21 Amb2719725 [0,0,0,0,0,1|1,0,1]=3 2505 B12R2.1081 OC1CCOc2cccnc21 Amb16233154 [0,0,0,0,0,1|2,0,1]=4 2506 B12R2.1081 OC1CCOc2cnccc21 Amb33733614 [0,0,0,0,0,1|2,0,1]=4 2507 B12R2.1081 OC1CCOc2ncccc21 Amb26071627 [0,0,0,0,0,1|2,0,1]=4 2508 B12R2.1081 OC1CCSc2ccccc21 Amb9748233 [0,0,0,0,0,1|1,1,1]=4 2509 B12R2.1081 OC1CNCc2ccccc21 Amb16233378 [0,0,0,0,0,1|1,0,2]=4 2510 B12R2.1081 OC1CNCc2ccccc21 Amb22587041 [0,0,0,0,0,1|1,0,2]=4 2511 B12R2.1081 OC1COCc2ccccc21 Amb20171360 [0,0,0,0,0,1|1,0,1]=3 2512 B12R2.1081 OC1CSCc2ccccc21 Amb9619601 [0,0,0,0,0,1|1,1,1]=4 2513 B12R2.1081 OC1OCCc2ccccc21 Amb27860258 [0,0,0,0,0,1|2,0,1]=4 2514 B12R2.1081 ON1CC=Cc2ccccc21 Amb26600953 [0,0,0,0,0,1|3,0,0]=4 2515 B12R2.1081 O[C@@H]1C=COc2ccccc21 Amb25108504 [0,0,0,0,0,1|1,0,1]=3 2516 B12R2.1081 O[C@@H]1CC=Cc2ccccc21 Amb8384066 [0,0,0,0,0,1|2,0,1]=4 2517 B12R2.1081 O[C@@H]1CCCc2ccccc21 Amb22337827 [0,0,0,0,0,1|2,0,1]=4 2518 B12R2.1081 O[C@@H]1CCOc2ccccc21 Amb561634 [0,0,0,0,0,1|1,0,1]=3 2519 B12R2.1081 O[C@@H]1CCSc2ccccc21 Amb13952924 [0,0,0,0,0,1|1,1,1]=4 2520 B12R2.1081 O[C@@H]1COCc2ccccc21 Amb22748516 [0,0,0,0,0,1|1,0,1]=3 2521 B12R2.1081 O[C@@H]1CSCc2ccccc21 Amb27836959 [0,0,0,0,0,1|1,1,1]=4 2522 B12R2.1081 O[C@H]1C=CCc2ccccc21 Amb28249097 [0,0,0,0,0,1|2,0,1]=4 2523 B12R2.1081 O[C@H]1C=COc2ccccc21 Amb27589685 [0,0,0,0,0,1|1,0,1]=3 2524 B12R2.1081 O[C@H]1CC=Cc2ccccc21 Amb27804916 [0,0,0,0,0,1|2,0,1]=4 2525 B12R2.1081 O[C@H]1CCCc2ccccc21 Amb22336192 [0,0,0,0,0,1|2,0,1]=4 2526 B12R2.1081 O[C@H]1CCOc2ccccc21 Amb2609035 [0,0,0,0,0,1|1,0,1]=3 2527 B12R2.1081 O[C@H]1CCSc2ccccc21 Amb13952926 [0,0,0,0,0,1|1,1,1]=4 2528 B12R2.1081 O[C@H]1CNCc2ccccc21 Amb24533225 [0,0,0,0,0,1|1,0,2]=4 2529 B12R2.1081 Oc1cccc2ccccc12 Amb2609031 [0,0,0,0,0,1|2,0,0]=3 2530 B12R2.1081 Oc1cccc2cccnc12 Amb10843705 [0,0,0,0,0,1|3,0,0]=4 2531 B12R2.1081 Oc1cccc2cccnc12 Amb1151957 [0,0,0,0,0,1|3,0,0]=4 2532 B12R2.1081 Oc1cccc2cccnc12 Amb22167517 [0,0,0,0,0,1|3,0,0]=4 2533 B12R2.1081 Oc1cccc2cccnc12 Amb8386462 [0,0,0,0,0,1|3,0,0]=4 2534 B12R2.1081 Oc1cccc2ccncc12 Amb8439357 [0,0,0,0,0,1|3,0,0]=4 2535 B12R2.1081 Oc1cccc2cnccc12 Amb534916 [0,0,0,0,0,1|3,0,0]=4 2536 B12R2.1081 Oc1cccc2ncccc12 Amb2613004 [0,0,0,0,0,1|3,0,0]=4 2537 B12R2.1081 Oc1ccnc2ccccc12 Amb2719646 [0,0,0,0,0,1|2,0,0]=3 2538 B12R2.1081 Oc1ccnc2cccnc12 Amb2610875 [0,0,0,0,0,1|3,0,0]=4 2539 B12R2.1081 Oc1cncc2ccccc12 Amb10553148 [0,0,0,0,0,1|1,0,0]=2 2540 B12R2.1081 Oc1cncc2ccccc12 Amb21964404 [0,0,0,0,0,1|1,0,0]=2 2541 B12R2.1081 Oc1cncc2cccnc12 Amb28282595 [0,0,0,0,0,1|2,0,0]=3 2542 B12R2.1081 Oc1cncc2ccncc12 Amb27438150 [0,0,0,0,0,1|2,0,0]=3 2543 B12R2.1081 Oc1cnnc2ccccc12 Amb2371264 [0,0,0,0,0,1|1,0,0]=2 2544 B12R2.1081 Oc1cnnc2ccccc12 Amb482495 [0,0,0,0,0,1|1,0,0]=2 2545 B12R2.1081 Oc1nccc2ccccc12 Amb2610663 [0,0,0,0,0,1|1,0,0]=2 2546 B12R2.1081 Oc1ncnc2ccccc12 Amb6335374 [0,0,0,0,0,1|1,0,0]=2 2547 B12R2.1081 Oc1ncnc2cccnc12 Amb22727893 [0,0,0,0,0,1|2,0,0]=3 2548 B12R2.1081 Oc1ncnc2cnccc12 Amb22274464 [0,0,0,0,0,1|2,0,0]=3 2549 B12R2.1081 Oc1ncnc2nnccc12 Amb533669 [0,0,0,0,0,1|3,0,0]=4 2550 B12R2.1081 Oc1nncc2ccccc12 Amb4138464 [0,0,0,0,0,1|1,0,0]=2 2551 B12R2.1081 S=C1C=CNc2ccccc21 Amb19414493 [0,0,0,0,0,1|2,1,0]=4 2552 B12R2.1081 S=C1C=NNc2ccccc21 Amb18043628 [0,0,0,0,0,1|1,1,0]=3 2553 B12R2.1081 S=C1NC=Nc2ccccc21 Amb18015575 [0,0,0,0,0,1|1,1,1]=4 2554 B12R2.1081 S=C1NCCc2ccccc21 Amb2725056 [0,0,0,0,0,1|1,1,1]=4 2555 B12R2.1081 S=C1NN=Cc2ccccc21 Amb18043134 [0,0,0,0,0,1|1,1,0]=3 2556 B12R2.1081 S=C1NN=Cc2cccnc21 Amb25943195 [0,0,0,0,0,1|2,1,0]=4 2557 B12R2.1081 S=C1NN=Cc2ncccc21 Amb28368895 [0,0,0,0,0,1|2,1,0]=4 2558 B12R2.1081 SC1CCOc2ccccc21 Amb9208037 [0,0,0,0,0,1|1,1,1]=4 2559 B12R2.1081 SC1COCc2ccccc21 Amb28349489 [0,0,0,0,0,1|1,1,1]=4 2560 B12R2.1081 Sc1cccc2ccccc12 Amb8516722 [0,0,0,0,0,1|2,1,0]=4 2561 B12R2.1081 Sc1ccnc2ccccc12 Amb10603792 [0,0,0,0,0,1|2,1,0]=4 2562 B12R2.1081 Sc1cnnc2ccccc12 Amb2371342 [0,0,0,0,0,1|1,1,0]=3 2563 B12R2.1081 Sc1nccc2ccccc12 Amb5716285 [0,0,0,0,0,1|1,1,0]=3 2564 B12R2.1081 Sc1nccc2ncccc12 Amb24406587 [0,0,0,0,0,1|2,1,0]=4 2565 B12R2.1081 Sc1ncnc2ccccc12 Amb1104189 [0,0,0,0,0,1|1,1,0]=3 2566 B12R2.1081 Sc1ncnc2ccncc12 Amb24598241 [0,0,0,0,0,1|2,1,0]=4 2567 B12R2.1081 Sc1ncnc2cnccc12 Amb24595927 [0,0,0,0,0,1|2,1,0]=4 2568 B12R2.1081 Sc1ncnc2ncccc12 Amb25201398 [0,0,0,0,0,1|2,1,0]=4 2569 B12R2.1081 Sc1nncc2ccccc12 Amb1149056 [0,0,0,0,0,1|1,1,0]=3 2570 B12R2.1081 Sc1nnnc2ccccc12 Amb2606147 [0,0,0,0,0,1|1,1,0]=3 2571 B12R2.1081 [Mg+]c1cccc2ccccc12 Amb22044005 [0,0,0,0,0,1|3,0,0]=4 2572 B12R2.1081 [O-][n+]1nccc2ccccc21 Amb28312887 [0,0,0,0,0,1|2,0,1]=4 2573 B12R2.1081 [O-][n+]1ncnc2ccccc21 Amb28251306 [0,0,0,0,0,1|2,0,1]=4 2574 B12R2.1081 [S-]c1cccc2ccccc12 Amb33513016 [0,0,0,0,0,1|2,1,0]=4 2575 B9R1.6 C=C(Br)c1ccccc1 Amb8516473 [1,0,1,0,0,0|2,0,0]=4 2576 B9R1.6 C=C(C)c1ccccc1 Amb8394996 [1,0,1,0,0,0|2,0,0]=4 2577 B9R1.6 C=C(Cl)c1ccccc1 Amb27775278 [1,0,1,0,0,0|2,0,0]=4 2578 B9R1.6 C=C(F)c1ccccc1 Amb22738583 [1,0,1,0,0,0|2,0,0]=4 2579 B9R1.6 CC(=N)c1cccnc1 Amb22170296 [1,0,1,0,0,0|2,0,0]=4 2580 B9R1.6 CC(=O)c1ccccc1 Amb2792761 [1,0,1,0,0,0|1,0,1]=4 2581 B9R1.6 CC(O)c1ccccc1 Amb3940114 [1,0,1,0,0,0|1,0,1]=4 2582 B9R1.6 CN(O)c1ccccc1 Amb28245898 [1,0,1,0,0,0|2,0,0]=4 2583 B9R1.6 C[C@@H](O)c1ccccc1 Amb6366772 [1,0,1,0,0,0|1,0,1]=4 2584 B9R1.6 C[C@H](O)c1ccccc1 Amb4021849 [1,0,1,0,0,0|1,0,1]=4 2585 B9R1.6 N=C(/N)c1ccncc1 Amb20243353 [1,0,1,0,0,0|2,0,0]=4 2586 B9R1.6 N=C(Cl)c1ccccc1 Amb28285285 [1,0,1,0,0,0|1,0,0]=3 2587 B9R1.6 N=C(N)c1cc[nH+]cc1 Amb22734887 [1,0,1,0,0,0|2,0,0]=4 2588 B9R1.6 N=C(N)c1ccc[nH+]c1 Amb22166890 [1,0,1,0,0,0|2,0,0]=4 2589 B9R1.6 N=C(N)c1cccc[nH+]1 Amb4004574 [1,0,1,0,0,0|2,0,0]=4 2590 B9R1.6 N=C(N)c1ccccc1 Amb10068704 [1,0,1,0,0,0|1,0,0]=3 2591 B9R1.6 N=C(N)c1ccccc1 Amb2371546 [1,0,1,0,0,0|1,0,0]=3 2592 B9R1.6 N=C(N)c1ccccc1 Amb6337518 [1,0,1,0,0,0|1,0,0]=3 2593 B9R1.6 N=C(N)c1ccccn1 Amb2696370 [1,0,1,0,0,0|2,0,0]=4 2594 B9R1.6 N=C(N)c1ccccn1 Amb2725149 [1,0,1,0,0,0|2,0,0]=4 2595 B9R1.6 N=C(N)c1cccnc1 Amb2695043 [1,0,1,0,0,0|2,0,0]=4 2596 B9R1.6 N=C(N)c1cccnc1 Amb2782187 [1,0,1,0,0,0|2,0,0]=4 2597 B9R1.6 N=C(N)c1ccncc1 Amb2695050 [1,0,1,0,0,0|2,0,0]=4 2598 B9R1.6 N=C(N)c1ccncc1 Amb2724144 [1,0,1,0,0,0|2,0,0]=4 2599 B9R1.6 N=C(N)c1ccncc1 Amb34916282 [1,0,1,0,0,0|2,0,0]=4 2600 B9R1.6 N=C(N)c1ccncc1 Amb8630084 [1,0,1,0,0,0|2,0,0]=4 2601 B9R1.6 N=C(O)c1cnccn1 Amb22166847 [1,0,1,0,0,0|2,0,0]=4 2602 B9R1.6 NC(=O)c1ccccc1 Amb6399766 [1,0,1,0,0,0|0,0,2]=4 2603 B9R1.6 NC(=S)c1ccccc1 Amb6338789 [1,0,1,0,0,0|0,1,1]=4 2604 B9R1.6 O=C(Br)c1ccccc1 Amb8513573 [1,0,1,0,0,0|1,0,1]=4 2605 B9R1.6 O=C(Cl)c1ccccc1 Amb3939302 [1,0,1,0,0,0|1,0,1]=4 2606 B9R1.6 O=C(F)c1ccccc1 Amb10607152 [1,0,1,0,0,0|1,0,1]=4 2607 B9R1.6 O=C(O)c1ccccc1 Amb1935196 [1,0,1,0,0,0|0,0,1]=3 2608 B9R1.6 O=C(O)c1ccccc1 Amb22002523 [1,0,1,0,0,0|0,0,1]=3 2609 B9R1.6 O=C(O)c1ccccc1 Amb22336602 [1,0,1,0,0,0|0,0,1]=3 2610 B9R1.6 O=C(O)c1ccccc1 Amb22351742 [1,0,1,0,0,0|0,0,1]=3 2611 B9R1.6 O=C(O)c1ccccn1 Amb1227737 [1,0,1,0,0,0|1,0,1]=4 2612 B9R1.6 O=C(O)c1ccccn1 Amb4035065 [1,0,1,0,0,0|1,0,1]=4 2613 B9R1.6 O=C(O)c1cccnc1 Amb1195995 [1,0,1,0,0,0|1,0,1]=4 2614 B9R1.6 O=C(O)c1ccncc1 Amb2609990 [1,0,1,0,0,0|1,0,1]=4 2615 B9R1.6 O=C(S)c1ccccc1 Amb8513358 [1,0,1,0,0,0|0,1,1]=4 2616 B9R1.6 O=C([O-])c1ccccc1 Amb22053472 [1,0,1,0,0,0|0,0,2]=4 2617 B9R1.6 O=C([O-])c1ccccc1 Amb22168438 [1,0,1,0,0,0|0,0,2]=4 2618 B9R1.6 O=C([O-])c1ccccc1 Amb8387740 [1,0,1,0,0,0|0,0,2]=4 2619 B9R1.6 O=C([O-])c1ccccc1 Amb8513916 [1,0,1,0,0,0|0,0,2]=4 2620 B9R1.6 O=C([O-])c1ccccc1 Amb8517378 [1,0,1,0,0,0|0,0,2]=4 2621 B9R1.6 O=S(O)c1ccccc1 Amb17939345 [1,0,1,0,0,0|1,0,1]=4 2622 B9R1.6 O=[PH](O)c1ccccc1 Amb3371978 [1,0,1,0,0,0|1,0,1]=4 2623 B9R1.6 O=[Se](O)c1ccccc1 Amb4138617 [1,0,1,0,0,0|1,0,1]=4 2624 B9R1.6 OB(O)c1ccccc1 Amb22587706 [1,0,1,0,0,0|1,0,0]=3 2625 B9R1.6 OB(O)c1ccccc1 Amb6365485 [1,0,1,0,0,0|1,0,0]=3 2626 B9R1.6 OB(O)c1ccccn1 Amb2383498 [1,0,1,0,0,0|2,0,0]=4 2627 B9R1.6 OB(O)c1cccnc1 Amb1353193 [1,0,1,0,0,0|2,0,0]=4 2628 B9R1.6 OB(O)c1cccnc1 Amb21954295 [1,0,1,0,0,0|2,0,0]=4 2629 B9R1.6 OB(O)c1ccncc1 Amb13887063 [1,0,1,0,0,0|2,0,0]=4 2630 B9R1.6 OB(O)c1ccncc1 Amb2383497 [1,0,1,0,0,0|2,0,0]=4 2631 B9R1.6 OB(O)c1ccncc1 Amb2690422 [1,0,1,0,0,0|2,0,0]=4 2632 B9R1.6 OC(=S)c1ccccc1 Amb17942862 [1,0,1,0,0,0|0,1,0]=3 2633 B9R1.6 OC(=S)c1cccnc1 Amb22731908 [1,0,1,0,0,0|1,1,0]=4 2634 B9R1.6 ON(O)c1ccncc1 Amb24572621 [1,0,1,0,0,0|2,0,0]=4 2635 B9R1.6 OP(O)c1ccccc1 Amb2684568 [1,0,1,0,0,0|1,0,0]=3 2636 B9R1.6 O[C@@H](Br)c1ccccc1 Amb27233551 [1,0,1,0,0,0|1,0,1]=4 2637 B9R1.6 O[C@@H](Cl)c1ccccc1 Amb28119929 [1,0,1,0,0,0|1,0,1]=4 2638 B9R1.6 S=C(Cl)c1ccccc1 Amb25294215 [1,0,1,0,0,0|1,1,0]=4 2639 B9R1.6 S=C(S)c1ccccc1 Amb22051683 [1,0,1,0,0,0|0,2,0]=4 2640 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [1,0,1,0,0,0|2,0,0]=4 2641 B9R1.8 Br\C=C\c1ccccc1 Amb3940204 [1,0,1,0,0,0|2,0,0]=4 2642 B9R1.8 C#COc1ccccc1 Amb27194589 [1,0,1,0,0,0|1,0,1]=4 2643 B9R1.8 C=CCc1ccccc1 Amb2599341 [1,0,1,0,0,0|2,0,0]=4 2644 B9R1.8 C=COc1ccccc1 Amb10564213 [1,0,1,0,0,0|1,0,0]=3 2645 B9R1.8 C=COc1cccnc1 Amb24085952 [1,0,1,0,0,0|2,0,0]=4 2646 B9R1.8 C=CSc1ccccc1 Amb8387516 [1,0,1,0,0,0|1,1,0]=4 2647 B9R1.8 C=NCc1ccccc1 Amb28256747 [1,0,1,0,0,0|1,0,0]=3 2648 B9R1.8 C=NCc1ccncc1 Amb27758185 [1,0,1,0,0,0|2,0,0]=4 2649 B9R1.8 CCOc1ccccc1 Amb2842270 [1,0,1,0,0,0|1,0,1]=4 2650 B9R1.8 C\C=C/c1ccccc1 Amb2690400 [1,0,1,0,0,0|2,0,0]=4 2651 B9R1.8 C\C=C\c1ccccc1 Amb6366726 [1,0,1,0,0,0|2,0,0]=4 2652 B9R1.8 C\C=N\c1ccccc1 Amb8392386 [1,0,1,0,0,0|1,0,0]=3 2653 B9R1.8 C\C=N\c1cccnc1 Amb27787691 [1,0,1,0,0,0|2,0,0]=4 2654 B9R1.8 C\N=C\c1ccccc1 Amb8513063 [1,0,1,0,0,0|1,0,0]=3 2655 B9R1.8 C\N=C\c1ccncc1 Amb22330508 [1,0,1,0,0,0|2,0,0]=4 2656 B9R1.8 ClCOc1ccccc1 Amb22059503 [1,0,1,0,0,0|1,0,1]=4 2657 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [1,0,1,0,0,0|2,0,0]=4 2658 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [1,0,1,0,0,0|2,0,0]=4 2659 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [1,0,1,0,0,0|2,0,0]=4 2660 B9R1.8 N#COc1ccccc1 Amb15692860 [1,0,1,0,0,0|1,0,1]=4 2661 B9R1.8 NCOc1ccccc1 Amb25128781 [1,0,1,0,0,0|1,0,1]=4 2662 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [1,0,1,0,0,0|1,0,0]=3 2663 B9R1.8 N\C=P\c1ccccc1 Amb27643938 [1,0,1,0,0,0|1,1,0]=4 2664 B9R1.8 N\N=C\c1ccccc1 Amb31284503 [1,0,1,0,0,0|1,0,0]=3 2665 B9R1.8 N\N=C\c1cccnc1 Amb8485037 [1,0,1,0,0,0|2,0,0]=4 2666 B9R1.8 N\N=C\c1ccncc1 Amb27837636 [1,0,1,0,0,0|2,0,0]=4 2667 B9R1.8 O=C=Nc1ccccc1 Amb3939417 [1,0,1,0,0,0|0,0,2]=4 2668 B9R1.8 O=CCc1ccccc1 Amb3939950 [1,0,1,0,0,0|1,0,1]=4 2669 B9R1.8 O=CNc1ccccc1 Amb2613772 [1,0,1,0,0,0|0,0,2]=4 2670 B9R1.8 O=COc1ccccc1 Amb22002710 [1,0,1,0,0,0|0,0,1]=3 2671 B9R1.8 O=S=Nc1ccccc1 Amb2720783 [1,0,1,0,0,0|1,0,1]=4 2672 B9R1.8 OCCc1ccccc1 Amb2793058 [1,0,1,0,0,0|1,0,1]=4 2673 B9R1.8 OCSc1ccccc1 Amb27776457 [1,0,1,0,0,0|0,1,1]=4 2674 B9R1.8 ONCc1ccccc1 Amb22001943 [1,0,1,0,0,0|0,0,2]=4 2675 B9R1.8 ONCc1ccccc1 Amb9825936 [1,0,1,0,0,0|0,0,2]=4 2676 B9R1.8 O\N=C/C1=CNC=CC1 Amb27862035 [1,0,1,0,0,0|1,0,1]=4 2677 B9R1.8 O\N=C/c1ccccc1 Amb6298335 [1,0,1,0,0,0|0,0,0]=2 2678 B9R1.8 O\N=C/c1ccncc1 Amb9821776 [1,0,1,0,0,0|1,0,0]=3 2679 B9R1.8 O\N=C/c1ccnnc1 Amb8439020 [1,0,1,0,0,0|2,0,0]=4 2680 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [1,0,1,0,0,0|0,0,0]=2 2681 B9R1.8 O\N=C\c1ccccn1 Amb719680 [1,0,1,0,0,0|1,0,0]=3 2682 B9R1.8 O\N=C\c1cccnc1 Amb3427823 [1,0,1,0,0,0|1,0,0]=3 2683 B9R1.8 O\N=C\c1cccnn1 Amb23539035 [1,0,1,0,0,0|2,0,0]=4 2684 B9R1.8 O\N=C\c1ccncc1 Amb1793802 [1,0,1,0,0,0|1,0,0]=3 2685 B9R1.8 O\N=C\c1ccncn1 Amb20668794 [1,0,1,0,0,0|2,0,0]=4 2686 B9R1.8 O\N=C\c1ccnnc1 Amb23539003 [1,0,1,0,0,0|2,0,0]=4 2687 B9R1.8 O\N=C\c1cnccn1 Amb27185837 [1,0,1,0,0,0|2,0,0]=4 2688 B9R1.8 O\N=C\c1cncnc1 Amb25943293 [1,0,1,0,0,0|2,0,0]=4 2689 B9R1.8 O\N=N\c1ccccn1 Amb17940654 [1,0,1,0,0,0|2,0,0]=4 2690 B9R1.8 S=C=Nc1ccccc1 Amb1161696 [1,0,1,0,0,0|0,1,1]=4 2691 B9R1.8 S=CNc1ccccc1 Amb25788857 [1,0,1,0,0,0|0,1,1]=4 2692 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [1,0,1,0,0,0|1,0,1]=4 2693 B9R1.8 [N-]=[N+]=Nc1ccccc1 Amb6892570 [1,0,1,0,0,0|2,0,0]=4 2694 B9R1.7 Cc1cc(\C=C\Br)on1 Amb33135276 [1,0,1,0,0,0|2,0,0]=4 2695 B9R1.7 N\C=C\c1cc(Cl)no1 Amb24562459 [1,0,1,0,0,0|2,0,0]=4 2696 B9R1.12 C=C\C=C\c1cccs1 Amb26418485 [1,0,1,0,0,0|1,1,0]=4 2697 B9R1.12 C=C\C=C\c1ccsc1 Amb26569661 [1,0,1,0,0,0|1,1,0]=4 2698 B9R1.12 O=C\C=C/c1ccco1 Amb27590405 [1,0,1,0,0,0|2,0,0]=4 2699 B9R1.12 O=C\C=C\c1ccco1 Amb33870988 [1,0,1,0,0,0|2,0,0]=4 2700 B9R1.12 O=C\C=C\c1ccns1 Amb35719811 [1,0,1,0,0,0|1,1,0]=4 2701 B9R1.12 O=C\C=C\c1ccoc1 Amb33136412 [1,0,1,0,0,0|2,0,0]=4 2702 B9R1.15 C#Cc1ccccc1O Amb10603592 [1,0,1,0,0,0|1,0,1]=4 2703 B9R1.15 C=Cc1ccccc1Br Amb6365618 [1,0,1,0,0,0|2,0,0]=4 2704 B9R1.15 C=Cc1ccccc1C Amb2695476 [1,0,1,0,0,0|2,0,0]=4 2705 B9R1.15 C=Cc1ccccc1Cl Amb3940227 [1,0,1,0,0,0|2,0,0]=4 2706 B9R1.15 C=Cc1ccccc1F Amb3940550 [1,0,1,0,0,0|2,0,0]=4 2707 B9R1.15 C=Cc1ccccc1I Amb8384620 [1,0,1,0,0,0|2,0,0]=4 2708 B9R1.15 C=Cc1ccccc1N Amb17593221 [1,0,1,0,0,0|1,0,1]=4 2709 B9R1.15 C=Cc1ccccc1N Amb21857764 [1,0,1,0,0,0|1,0,1]=4 2710 B9R1.15 C=Cc1ccccc1O Amb17593227 [1,0,1,0,0,0|1,0,0]=3 2711 B9R1.15 C=Cc1ccncc1O Amb25358569 [1,0,1,0,0,0|2,0,0]=4 2712 B9R1.15 CCc1ccccc1O Amb3939546 [1,0,1,0,0,0|1,0,1]=4 2713 B9R1.15 CNc1ccccc1O Amb6336644 [1,0,1,0,0,0|2,0,0]=4 2714 B9R1.15 COc1ccccc1Br Amb2684946 [1,0,1,0,0,0|2,0,0]=4 2715 B9R1.15 COc1ccccc1C Amb8513241 [1,0,1,0,0,0|1,0,1]=4 2716 B9R1.15 COc1ccccc1Cl Amb6297184 [1,0,1,0,0,0|2,0,0]=4 2717 B9R1.15 COc1ccccc1F Amb2688014 [1,0,1,0,0,0|2,0,0]=4 2718 B9R1.15 COc1ccccc1I Amb2688832 [1,0,1,0,0,0|2,0,0]=4 2719 B9R1.15 COc1ccccc1N Amb19929908 [1,0,1,0,0,0|2,0,0]=4 2720 B9R1.15 COc1ccccc1N Amb840071 [1,0,1,0,0,0|2,0,0]=4 2721 B9R1.15 COc1ccccc1O Amb3939629 [1,0,1,0,0,0|1,0,0]=3 2722 B9R1.15 COc1ccccc1P Amb22228914 [1,0,1,0,0,0|2,0,0]=4 2723 B9R1.15 COc1ccccc1S Amb2689086 [1,0,1,0,0,0|1,1,0]=4 2724 B9R1.15 COc1cccnc1O Amb8428106 [1,0,1,0,0,0|2,0,0]=4 2725 B9R1.15 COc1ccncc1O Amb10067115 [1,0,1,0,0,0|2,0,0]=4 2726 B9R1.15 COc1cnccc1O Amb19895108 [1,0,1,0,0,0|2,0,0]=4 2727 B9R1.15 COc1ncccc1O Amb9792642 [1,0,1,0,0,0|2,0,0]=4 2728 B9R1.15 CSc1ccccc1O Amb2688795 [1,0,1,0,0,0|1,1,0]=4 2729 B9R1.15 Cc1ccccc1C=O Amb2725485 [1,0,1,0,0,0|1,0,1]=4 2730 B9R1.15 Cc1ccccc1CO Amb837463 [1,0,1,0,0,0|1,0,1]=4 2731 B9R1.15 Cc1ccccc1NO Amb21961958 [1,0,1,0,0,0|2,0,0]=4 2732 B9R1.15 Cc1ccccc1[NH2+]O Amb24113085 [1,0,1,0,0,0|2,0,0]=4 2733 B9R1.15 N#Cc1ccccc1O Amb1803244 [1,0,1,0,0,0|0,0,2]=4 2734 B9R1.15 N#[N+]c1ccccc1O Amb28125164 [1,0,1,0,0,0|1,0,1]=4 2735 B9R1.15 N=C1C=CC=C\C1=C\Br Amb27607660 [1,0,1,0,0,0|1,0,0]=3 2736 B9R1.15 N=Cc1ccccc1Cl Amb26046361 [1,0,1,0,0,0|1,0,0]=3 2737 B9R1.15 N=Cc1ccccc1O Amb28382612 [1,0,1,0,0,0|0,0,0]=2 2738 B9R1.15 N=Cc1cnncc1O Amb28052824 [1,0,1,0,0,0|2,0,0]=4 2739 B9R1.15 NCc1ccccc1O Amb1111172 [1,0,1,0,0,0|0,0,2]=4 2740 B9R1.15 NCc1ccccc1O Amb13951900 [1,0,1,0,0,0|0,0,2]=4 2741 B9R1.15 NCc1ccccc1O Amb30594500 [1,0,1,0,0,0|0,0,2]=4 2742 B9R1.15 NNc1ccccc1O Amb25827397 [1,0,1,0,0,0|1,0,1]=4 2743 B9R1.15 NOc1ccccc1Br Amb24556800 [1,0,1,0,0,0|1,0,1]=4 2744 B9R1.15 NOc1ccccc1Cl Amb18124665 [1,0,1,0,0,0|1,0,1]=4 2745 B9R1.15 NOc1ccccc1Cl Amb32651980 [1,0,1,0,0,0|1,0,1]=4 2746 B9R1.15 NOc1ccccc1F Amb22900914 [1,0,1,0,0,0|1,0,1]=4 2747 B9R1.15 NOc1ccccc1F Amb26427812 [1,0,1,0,0,0|1,0,1]=4 2748 B9R1.15 Nc1ccccc1C=O Amb30634288 [1,0,1,0,0,0|0,0,2]=4 2749 B9R1.15 Nc1ccccc1C=O Amb6307282 [1,0,1,0,0,0|0,0,2]=4 2750 B9R1.15 Nc1ccccc1CO Amb1808337 [1,0,1,0,0,0|0,0,2]=4 2751 B9R1.15 O=Cc1ccccc1Br Amb2684948 [1,0,1,0,0,0|1,0,1]=4 2752 B9R1.15 O=Cc1ccccc1Cl Amb2387351 [1,0,1,0,0,0|1,0,1]=4 2753 B9R1.15 O=Cc1ccccc1F Amb2688017 [1,0,1,0,0,0|1,0,1]=4 2754 B9R1.15 O=Cc1ccccc1I Amb1207354 [1,0,1,0,0,0|1,0,1]=4 2755 B9R1.15 O=Cc1ccccc1O Amb2792756 [1,0,1,0,0,0|0,0,1]=3 2756 B9R1.15 O=Cc1ccccc1S Amb18643290 [1,0,1,0,0,0|0,1,1]=4 2757 B9R1.15 O=Cc1cccnc1O Amb18642078 [1,0,1,0,0,0|1,0,1]=4 2758 B9R1.15 O=Cc1ccncc1O Amb2697950 [1,0,1,0,0,0|1,0,1]=4 2759 B9R1.15 O=Cc1cnccc1O Amb20247827 [1,0,1,0,0,0|1,0,1]=4 2760 B9R1.15 O=Cc1ncccc1O Amb22495285 [1,0,1,0,0,0|1,0,1]=4 2761 B9R1.15 O=Cc1ncccc1O Amb2691308 [1,0,1,0,0,0|1,0,1]=4 2762 B9R1.15 O=Nc1ccccc1O Amb17593255 [1,0,1,0,0,0|1,0,1]=4 2763 B9R1.15 OCc1ccccc1Br Amb3939081 [1,0,1,0,0,0|1,0,1]=4 2764 B9R1.15 OCc1ccccc1Cl Amb837338 [1,0,1,0,0,0|1,0,1]=4 2765 B9R1.15 OCc1ccccc1F Amb837270 [1,0,1,0,0,0|1,0,1]=4 2766 B9R1.15 OCc1ccccc1I Amb6373404 [1,0,1,0,0,0|1,0,1]=4 2767 B9R1.15 OCc1ccccc1O Amb3940117 [1,0,1,0,0,0|0,0,1]=3 2768 B9R1.15 OCc1ccccc1S Amb2689068 [1,0,1,0,0,0|0,1,1]=4 2769 B9R1.15 OCc1cccnc1O Amb20247914 [1,0,1,0,0,0|1,0,1]=4 2770 B9R1.15 OCc1ccncc1O Amb8439447 [1,0,1,0,0,0|1,0,1]=4 2771 B9R1.15 OCc1ncccc1O Amb2611945 [1,0,1,0,0,0|1,0,1]=4 2772 B9R1.15 OCc1ncccc1O Amb8384342 [1,0,1,0,0,0|1,0,1]=4 2773 B9R1.15 ONc1ccccc1Cl Amb24093632 [1,0,1,0,0,0|2,0,0]=4 2774 B9R1.15 ONc1ccccc1I Amb22230990 [1,0,1,0,0,0|2,0,0]=4 2775 B9R1.15 Oc1ccccc1CBr Amb18129657 [1,0,1,0,0,0|1,0,1]=4 2776 B9R1.15 Oc1ccccc1CCl Amb17477840 [1,0,1,0,0,0|1,0,1]=4 2777 B9R1.15 Oc1ccccc1CS Amb25188976 [1,0,1,0,0,0|0,1,1]=4 2778 B9R1.27 C=Cc1c(C)noc1C Amb3777360 [1,0,1,0,0,0|1,0,1]=4 2779 B9R1.14 C=Cc1cscc1C=C Amb27202321 [1,0,1,0,0,0|2,0,0]=4 2780 B11R1.7 CC(O)(CO)c1ccccc1 Amb9825861 [0,1,1,0,0,0|1,0,1]=4 2781 B11R1.7 C[C@@](O)(CO)c1ccccc1 Amb27448075 [0,1,1,0,0,0|1,0,1]=4 2782 B11R1.7 O=P(O)(CO)c1ccccc1 Amb27860311 [0,1,1,0,0,0|2,0,0]=4 2783 B11R1.12 C=C\C(=N/O)c1ccccc1 Amb5718393 [0,1,1,0,0,0|1,0,0]=3 2784 B11R1.12 CC\C(=N/O)c1ccccc1 Amb3367838 [0,1,1,0,0,0|1,0,0]=3 2785 B11R1.12 CN\C(=N\O)c1ccccn1 Amb28240868 [0,1,1,0,0,0|2,0,0]=4 2786 B11R1.12 CN\C(=N\O)c1cccnc1 Amb27848060 [0,1,1,0,0,0|2,0,0]=4 2787 B11R1.12 CN\C(=N\O)c1ccncc1 Amb27945463 [0,1,1,0,0,0|2,0,0]=4 2788 B11R1.12 COC(CO)c1ccccc1 Amb3939163 [0,1,1,0,0,0|1,0,1]=4 2789 B11R1.12 CO[C@H](CO)c1ccccc1 Amb10807423 [0,1,1,0,0,0|1,0,1]=4 2790 B11R1.12 C\N=C(/NC)c1ccccc1 Amb8487310 [0,1,1,0,0,0|2,0,0]=4 2791 B11R1.12 C\N=C(/SC)c1ccccc1 Amb32718735 [0,1,1,0,0,0|1,1,0]=4 2792 B11R1.12 N#C\C(=C/O)c1ccccc1 Amb2417622 [0,1,1,0,0,0|2,0,0]=4 2793 B11R1.12 N#C\C(=N\O)c1ccccn1 Amb27838171 [0,1,1,0,0,0|2,0,0]=4 2794 B11R1.12 N=C\C(=C\O)c1ccccc1 Amb27397057 [0,1,1,0,0,0|2,0,0]=4 2795 B11R1.12 NC\C(=N\O)c1ccccc1 Amb25368564 [0,1,1,0,0,0|1,0,0]=3 2796 B11R1.12 NN\C(=N/O)c1ccccc1 Amb4008710 [0,1,1,0,0,0|1,0,0]=3 2797 B11R1.12 NOC(CO)c1ccccc1 Amb28321529 [0,1,1,0,0,0|1,0,1]=4 2798 B11R1.12 NO[C@H](CO)c1ccccc1 Amb27835967 [0,1,1,0,0,0|1,0,1]=4 2799 B11R1.12 N\N=C(\CO)c1ccccn1 Amb27978377 [0,1,1,0,0,0|2,0,0]=4 2800 B11R1.12 N\N=C(\NN)c1ccccc1 Amb27949046 [0,1,1,0,0,0|2,0,0]=4 2801 B11R1.12 O=C\C(=C/O)c1ccccc1 Amb10576572 [0,1,1,0,0,0|1,0,1]=4 2802 B11R1.12 O=C\C(=C\O)c1ccccc1 Amb25092916 [0,1,1,0,0,0|1,0,1]=4 2803 B11R1.12 O=C\C(=N/O)c1ccccc1 Amb28345218 [0,1,1,0,0,0|0,0,1]=3 2804 B11R1.12 O=C\C(=N\O)c1ccccc1 Amb26580467 [0,1,1,0,0,0|0,0,1]=3 2805 B11R1.12 OCC(CO)c1ccccc1 Amb4034678 [0,1,1,0,0,0|1,0,1]=4 2806 B11R1.12 OCC(NO)c1ccccc1 Amb27245910 [0,1,1,0,0,0|0,0,2]=4 2807 B11R1.12 OCN(CO)c1ccccc1 Amb27240792 [0,1,1,0,0,0|2,0,0]=4 2808 B11R1.12 OCP(CO)c1ccccc1 Amb22733968 [0,1,1,0,0,0|2,0,0]=4 2809 B11R1.12 OC\C(=C\F)c1ccccc1 Amb27972253 [0,1,1,0,0,0|2,0,0]=4 2810 B11R1.12 O\N=C(/CBr)c1ccccc1 Amb1047358 [0,1,1,0,0,0|1,0,0]=3 2811 B11R1.12 O\N=C(\CBr)c1ccccc1 Amb22489773 [0,1,1,0,0,0|1,0,0]=3 2812 B11R1.12 O\N=C(\CCl)c1ccccc1 Amb10569199 [0,1,1,0,0,0|1,0,0]=3 2813 B11R1.12 O\N=C(\CCl)c1cccnc1 Amb27185832 [0,1,1,0,0,0|2,0,0]=4 2814 B11R1.12 O\N=C(\CF)c1ccccc1 Amb7969465 [0,1,1,0,0,0|1,0,0]=3 2815 B11R1.12 O\N=C(\NO)c1ccccc1 Amb27751854 [0,1,1,0,0,0|0,0,0]=2 2816 B11R1.16 C=C(COC)c1ccccc1 Amb28188323 [0,1,1,0,0,0|2,0,0]=4 2817 B11R1.16 C=C(N=[N+]=[N-])c1ccccc1 Amb27863728 [0,1,1,0,0,0|2,0,0]=4 2818 B11R1.16 CC(\C=N\O)c1ccccc1 Amb4018201 [0,1,1,0,0,0|1,0,1]=4 2819 B11R1.16 CN\N=C(/N)c1ccccc1 Amb20623020 [0,1,1,0,0,0|2,0,0]=4 2820 B11R1.16 COCC(=O)c1ccccc1 Amb4605981 [0,1,1,0,0,0|1,0,1]=4 2821 B11R1.16 COCC(O)c1ccccc1 Amb18791504 [0,1,1,0,0,0|1,0,1]=4 2822 B11R1.16 COC[C@H](O)c1ccccc1 Amb27410269 [0,1,1,0,0,0|1,0,1]=4 2823 B11R1.16 CONC(=O)c1ccccc1 Amb16969913 [0,1,1,0,0,0|0,0,2]=4 2824 B11R1.16 CO\N=C(/N)c1ccccc1 Amb18224270 [0,1,1,0,0,0|1,0,0]=3 2825 B11R1.16 CO\N=C(/N)c1ccccn1 Amb18224284 [0,1,1,0,0,0|2,0,0]=4 2826 B11R1.16 CO\N=C(/N)c1cccnc1 Amb18224285 [0,1,1,0,0,0|2,0,0]=4 2827 B11R1.16 CO\N=C(/N)c1ccncc1 Amb18224286 [0,1,1,0,0,0|2,0,0]=4 2828 B11R1.16 CS\N=C(\N)c1ccccc1 Amb28365468 [0,1,1,0,0,0|1,1,0]=4 2829 B11R1.16 C\C(=C/CO)c1ccccc1 Amb8392366 [0,1,1,0,0,0|2,0,0]=4 2830 B11R1.16 N#C\N=C(/N)c1ccccc1 Amb1146072 [0,1,1,0,0,0|2,0,0]=4 2831 B11R1.16 N#C\N=C(\N)c1ccccc1 Amb4437466 [0,1,1,0,0,0|2,0,0]=4 2832 B11R1.16 N=C=NC(=O)c1ccccc1 Amb28127436 [0,1,1,0,0,0|1,0,1]=4 2833 B11R1.16 NOCC(=O)c1ccccc1 Amb29848094 [0,1,1,0,0,0|1,0,1]=4 2834 B11R1.16 NOCC(O)c1ccccc1 Amb17334342 [0,1,1,0,0,0|1,0,1]=4 2835 B11R1.16 N\N=C\C(=O)c1ccccc1 Amb9824983 [0,1,1,0,0,0|1,0,1]=4 2836 B11R1.16 O=C(CCO)c1ccccc1 Amb16231606 [0,1,1,0,0,0|1,0,1]=4 2837 B11R1.16 O=C(N=C=S)c1ccccc1 Amb2092776 [0,1,1,0,0,0|0,1,1]=4 2838 B11R1.16 O=C(NCO)c1ccccc1 Amb1200467 [0,1,1,0,0,0|0,0,2]=4 2839 B11R1.16 O=C(NO[K])c1ccccc1 Amb33457787 [0,1,1,0,0,0|0,0,2]=4 2840 B11R1.16 O=C(OCO)c1ccccc1 Amb25115920 [0,1,1,0,0,0|1,0,1]=4 2841 B11R1.16 O=C(\C=N\O)c1ccccc1 Amb2781112 [0,1,1,0,0,0|0,0,1]=3 2842 B11R1.16 O=C(\N=C\S)c1ccccc1 Amb24485844 [0,1,1,0,0,0|0,1,1]=4 2843 B11R1.16 O=C=NC(=O)c1ccccc1 Amb3940094 [0,1,1,0,0,0|0,0,2]=4 2844 B11R1.16 OCCC(O)c1ccccc1 Amb17777842 [0,1,1,0,0,0|1,0,1]=4 2845 B11R1.16 OCC[C@@H](O)c1ccccc1 Amb8516760 [0,1,1,0,0,0|1,0,1]=4 2846 B11R1.16 OCOB(O)c1ccccc1 Amb33512956 [0,1,1,0,0,0|2,0,0]=4 2847 B11R1.16 OC\C=C(\Br)c1ccccc1 Amb28284946 [0,1,1,0,0,0|2,0,0]=4 2848 B11R1.16 ONCC(O)c1ccccc1 Amb4009046 [0,1,1,0,0,0|0,0,2]=4 2849 B11R1.16 [N-]=[N+]=NC(=O)c1ccccc1 Amb8938214 [0,1,1,0,0,0|1,0,1]=4 2850 B11R1.22 C[n+]1ccc(\C(N)=N\O)cc1 Amb27230859 [0,1,1,0,0,0|2,0,0]=4 2851 B11R1.22 C\C(=N/N)c1ccc(C)cc1 Amb4019900 [0,1,1,0,0,0|2,0,0]=4 2852 B11R1.22 C\C(=N/N)c1ccc(N)cc1 Amb27225960 [0,1,1,0,0,0|2,0,0]=4 2853 B11R1.22 C\C(=N/O)c1ccc(Br)cc1 Amb6388233 [0,1,1,0,0,0|1,0,0]=3 2854 B11R1.22 C\C(=N/O)c1ccc(C)cc1 Amb6346454 [0,1,1,0,0,0|1,0,0]=3 2855 B11R1.22 C\C(=N/O)c1ccc(F)cc1 Amb928420 [0,1,1,0,0,0|1,0,0]=3 2856 B11R1.22 C\C(=N/O)c1ccc(I)cc1 Amb27171022 [0,1,1,0,0,0|1,0,0]=3 2857 B11R1.22 C\C(=N/O)c1ccc(O)cc1 Amb24324955 [0,1,1,0,0,0|1,0,0]=3 2858 B11R1.22 C\C(=N\N)c1ccc(Br)cc1 Amb10552972 [0,1,1,0,0,0|2,0,0]=4 2859 B11R1.22 C\C(=N\N)c1ccc(C)cc1 Amb27840228 [0,1,1,0,0,0|2,0,0]=4 2860 B11R1.22 C\C(=N\O)c1ccc(Br)cn1 Amb35702360 [0,1,1,0,0,0|2,0,0]=4 2861 B11R1.22 C\C(=N\O)c1ccc(C)cc1 Amb4020197 [0,1,1,0,0,0|1,0,0]=3 2862 B11R1.22 C\C(=N\O)c1ccc(Cl)cc1 Amb19767547 [0,1,1,0,0,0|1,0,0]=3 2863 B11R1.22 C\C(=N\O)c1ccc(Cl)nc1 Amb27173858 [0,1,1,0,0,0|2,0,0]=4 2864 B11R1.22 C\C(=N\O)c1ccc(F)cc1 Amb22735392 [0,1,1,0,0,0|1,0,0]=3 2865 B11R1.22 C\C(=N\O)c1ccc(F)nc1 Amb27633296 [0,1,1,0,0,0|2,0,0]=4 2866 B11R1.22 C\C(=N\O)c1ccc(I)cc1 Amb27595013 [0,1,1,0,0,0|1,0,0]=3 2867 B11R1.22 C\C(=N\O)c1ccc(N)cc1 Amb8503907 [0,1,1,0,0,0|1,0,0]=3 2868 B11R1.22 C\C(=N\O)c1ccc(O)cc1 Amb27451236 [0,1,1,0,0,0|1,0,0]=3 2869 B11R1.22 C\C=C(/O)c1ccc(F)cc1 Amb24100278 [0,1,1,0,0,0|2,0,0]=4 2870 B11R1.22 Cc1ccc(C(=N)NO)cc1 Amb33715887 [0,1,1,0,0,0|1,0,1]=4 2871 B11R1.22 Cc1ccc(C(=N)NO)cc1 Amb8631025 [0,1,1,0,0,0|1,0,1]=4 2872 B11R1.22 Cc1ccc(C(=O)CO)cc1 Amb5638929 [0,1,1,0,0,0|1,0,1]=4 2873 B11R1.22 Cc1ccc(C(=O)NO)cc1 Amb6444120 [0,1,1,0,0,0|0,0,2]=4 2874 B11R1.22 Cc1ccc(C(O)CO)cc1 Amb18563446 [0,1,1,0,0,0|1,0,1]=4 2875 B11R1.22 Cc1ccc(N(O)N=O)cc1 Amb27622782 [0,1,1,0,0,0|1,0,1]=4 2876 B11R1.22 Cc1ccc(\C(Cl)=N\O)cc1 Amb33998097 [0,1,1,0,0,0|1,0,0]=3 2877 B11R1.22 Cc1ccc(\C(Cl)=N\O)nc1 Amb25357808 [0,1,1,0,0,0|2,0,0]=4 2878 B11R1.22 Cc1ccc(\C(N)=N\O)cc1 Amb33334649 [0,1,1,0,0,0|1,0,0]=3 2879 B11R1.22 Cc1ccc(\C(N)=N\O)cc1 Amb6342700 [0,1,1,0,0,0|1,0,0]=3 2880 B11R1.22 Cc1ccc(\C(N)=N\O)cn1 Amb25893286 [0,1,1,0,0,0|2,0,0]=4 2881 B11R1.22 Cc1ccc(\C(N)=N\O)nc1 Amb22047910 [0,1,1,0,0,0|2,0,0]=4 2882 B11R1.22 N=C(NO)c1ccc(N)cc1 Amb8631027 [0,1,1,0,0,0|1,0,1]=4 2883 B11R1.22 N=C1C=CC(=C(N)NO)C=C1 Amb27398679 [0,1,1,0,0,0|1,0,1]=4 2884 B11R1.22 N\C(=N/O)c1ccc(Br)cc1 Amb33536697 [0,1,1,0,0,0|1,0,0]=3 2885 B11R1.22 N\C(=N/O)c1ccc(Cl)cc1 Amb6383877 [0,1,1,0,0,0|1,0,0]=3 2886 B11R1.22 N\C(=N/O)c1ccc(Cl)nc1 Amb9175016 [0,1,1,0,0,0|2,0,0]=4 2887 B11R1.22 N\C(=N/O)c1ccc(F)cc1 Amb5729050 [0,1,1,0,0,0|1,0,0]=3 2888 B11R1.22 N\C(=N/O)c1ccc(N)cc1 Amb1115880 [0,1,1,0,0,0|1,0,0]=3 2889 B11R1.22 N\C(=N/O)c1ccc(N)cn1 Amb22048150 [0,1,1,0,0,0|2,0,0]=4 2890 B11R1.22 N\C(=N/O)c1ccc(O)cc1 Amb1156668 [0,1,1,0,0,0|1,0,0]=3 2891 B11R1.22 N\C(=N/O)c1ccc(O)nc1 Amb8855307 [0,1,1,0,0,0|2,0,0]=4 2892 B11R1.22 N\C(=N\Cl)c1ccc(Cl)cc1 Amb28250215 [0,1,1,0,0,0|2,0,0]=4 2893 B11R1.22 N\C(=N\O)c1cc[n+]([O-])cc1 Amb22044097 [0,1,1,0,0,0|2,0,0]=4 2894 B11R1.22 N\C(=N\O)c1ccc(Br)cc1 Amb2695928 [0,1,1,0,0,0|1,0,0]=3 2895 B11R1.22 N\C(=N\O)c1ccc(Br)cn1 Amb24484944 [0,1,1,0,0,0|2,0,0]=4 2896 B11R1.22 N\C(=N\O)c1ccc(Br)nc1 Amb26354824 [0,1,1,0,0,0|2,0,0]=4 2897 B11R1.22 N\C(=N\O)c1ccc(Cl)cc1 Amb4018570 [0,1,1,0,0,0|1,0,0]=3 2898 B11R1.22 N\C(=N\O)c1ccc(Cl)cn1 Amb25241555 [0,1,1,0,0,0|2,0,0]=4 2899 B11R1.22 N\C(=N\O)c1ccc(Cl)nc1 Amb22264432 [0,1,1,0,0,0|2,0,0]=4 2900 B11R1.22 N\C(=N\O)c1ccc(F)cc1 Amb1106020 [0,1,1,0,0,0|1,0,0]=3 2901 B11R1.22 N\C(=N\O)c1ccc(F)cn1 Amb25364696 [0,1,1,0,0,0|2,0,0]=4 2902 B11R1.22 N\C(=N\O)c1ccc(N)nc1 Amb22044051 [0,1,1,0,0,0|2,0,0]=4 2903 B11R1.22 N\C(=N\O)c1ccc(O)cc1 Amb2696132 [0,1,1,0,0,0|1,0,0]=3 2904 B11R1.22 N\N=C(/N)c1ccc(Br)cc1 Amb33250363 [0,1,1,0,0,0|2,0,0]=4 2905 B11R1.22 N\N=C(/N)c1ccc(Cl)cc1 Amb2695041 [0,1,1,0,0,0|2,0,0]=4 2906 B11R1.22 N\N=C(\N)c1ccc(Br)cc1 Amb25169225 [0,1,1,0,0,0|2,0,0]=4 2907 B11R1.22 N\N=C(\N)c1ccc(F)cc1 Amb18787467 [0,1,1,0,0,0|2,0,0]=4 2908 B11R1.22 Nc1ccc(C(=O)CO)cc1 Amb28255444 [0,1,1,0,0,0|1,0,1]=4 2909 B11R1.22 O=C(CO)c1ccc(Br)cc1 Amb2726212 [0,1,1,0,0,0|1,0,1]=4 2910 B11R1.22 O=C(CO)c1ccc(Cl)cc1 Amb2736179 [0,1,1,0,0,0|1,0,1]=4 2911 B11R1.22 O=C(CO)c1ccc(F)cc1 Amb2740436 [0,1,1,0,0,0|1,0,1]=4 2912 B11R1.22 O=C(CO)c1ccc(I)cc1 Amb5638978 [0,1,1,0,0,0|1,0,1]=4 2913 B11R1.22 O=C(NO)c1ccc(Br)cc1 Amb6444119 [0,1,1,0,0,0|0,0,2]=4 2914 B11R1.22 O=C(NO)c1ccc(Cl)cc1 Amb6264774 [0,1,1,0,0,0|0,0,2]=4 2915 B11R1.22 O=C(NO)c1ccc(F)cc1 Amb6271764 [0,1,1,0,0,0|0,0,2]=4 2916 B11R1.22 O=C(NO)c1ccc(I)cc1 Amb7756049 [0,1,1,0,0,0|0,0,2]=4 2917 B11R1.22 OCC(O)c1ccc(Br)cc1 Amb18570007 [0,1,1,0,0,0|1,0,1]=4 2918 B11R1.22 OCC(O)c1ccc(Cl)cc1 Amb18563992 [0,1,1,0,0,0|1,0,1]=4 2919 B11R1.22 OCC(O)c1ccc(F)cc1 Amb18065446 [0,1,1,0,0,0|1,0,1]=4 2920 B11R1.22 OCC(O)c1ccc(O)cc1 Amb18644612 [0,1,1,0,0,0|1,0,1]=4 2921 B11R1.22 OC[C@@H](O)c1ccc(Br)cc1 Amb35747149 [0,1,1,0,0,0|1,0,1]=4 2922 B11R1.22 OC[C@H](O)c1ccc(Br)cc1 Amb33743367 [0,1,1,0,0,0|1,0,1]=4 2923 B11R1.22 OC[C@H](O)c1ccc(Cl)cc1 Amb27600596 [0,1,1,0,0,0|1,0,1]=4 2924 B11R1.22 OC[C@H](O)c1ccc(F)cc1 Amb28200871 [0,1,1,0,0,0|1,0,1]=4 2925 B11R1.22 O\N=C(/Cl)c1ccc(Br)cc1 Amb23247556 [0,1,1,0,0,0|1,0,0]=3 2926 B11R1.22 O\N=C(/Cl)c1ccc(Br)cc1 Amb33714740 [0,1,1,0,0,0|1,0,0]=3 2927 B11R1.22 O\N=C(/Cl)c1ccc(Br)cn1 Amb30666643 [0,1,1,0,0,0|2,0,0]=4 2928 B11R1.22 O\N=C(/Cl)c1ccc(Cl)cc1 Amb6383879 [0,1,1,0,0,0|1,0,0]=3 2929 B11R1.22 O\N=C(/Cl)c1ccc(Cl)nc1 Amb32414491 [0,1,1,0,0,0|2,0,0]=4 2930 B11R1.22 O\N=C(/Cl)c1ccc(F)cc1 Amb31276044 [0,1,1,0,0,0|1,0,0]=3 2931 B11R1.22 O\N=C(/S)c1ccc(O)cc1 Amb25964762 [0,1,1,0,0,0|0,1,0]=3 2932 B11R1.22 O\N=C(\Br)c1ccc(O)cc1 Amb27626576 [0,1,1,0,0,0|1,0,0]=3 2933 B11R1.22 O\N=C(\Cl)c1ccc(Br)cn1 Amb28061917 [0,1,1,0,0,0|2,0,0]=4 2934 B11R1.22 O\N=C(\Cl)c1ccc(Cl)cn1 Amb28436347 [0,1,1,0,0,0|2,0,0]=4 2935 B11R1.22 O\N=C(\Cl)c1ccc(Cl)nc1 Amb27426996 [0,1,1,0,0,0|2,0,0]=4 2936 B11R1.22 O\N=C(\O)c1ccc(O)cc1 Amb4017917 [0,1,1,0,0,0|0,0,0]=2 2937 B11R1.23 C\C(=N/N)c1cccc(O)c1 Amb24484530 [0,1,1,0,0,0|2,0,0]=4 2938 B11R1.23 C\C(=N/O)c1cccc(Br)c1 Amb2752469 [0,1,1,0,0,0|1,0,0]=3 2939 B11R1.23 C\C(=N/O)c1cccc(Cl)c1 Amb25187132 [0,1,1,0,0,0|1,0,0]=3 2940 B11R1.23 C\C(=N/O)c1cccc(F)c1 Amb29844581 [0,1,1,0,0,0|1,0,0]=3 2941 B11R1.23 C\C(=N/O)c1cccc(O)c1 Amb27948502 [0,1,1,0,0,0|1,0,0]=3 2942 B11R1.23 C\C(=N\N)c1cccc(Cl)c1 Amb27425260 [0,1,1,0,0,0|2,0,0]=4 2943 B11R1.23 C\C(=N\O)c1cc(Cl)ccn1 Amb27849199 [0,1,1,0,0,0|2,0,0]=4 2944 B11R1.23 C\C(=N\O)c1cccc(Br)c1 Amb22261517 [0,1,1,0,0,0|1,0,0]=3 2945 B11R1.23 C\C(=N\O)c1cccc(C)n1 Amb28182490 [0,1,1,0,0,0|2,0,0]=4 2946 B11R1.23 C\C(=N\O)c1cccc(N)c1 Amb25992663 [0,1,1,0,0,0|1,0,0]=3 2947 B11R1.23 C\C(=N\O)c1cccc(O)c1 Amb26624798 [0,1,1,0,0,0|1,0,0]=3 2948 B11R1.23 C\C(=N\O)c1ccnc(F)c1 Amb27453095 [0,1,1,0,0,0|2,0,0]=4 2949 B11R1.23 C\C(=N\O)c1ccnc(N)c1 Amb27659327 [0,1,1,0,0,0|2,0,0]=4 2950 B11R1.23 Cc1cc(\C(N)=N\O)ccn1 Amb24358402 [0,1,1,0,0,0|2,0,0]=4 2951 B11R1.23 Cc1cccc(C(=O)CO)c1 Amb18182731 [0,1,1,0,0,0|1,0,1]=4 2952 B11R1.23 Cc1cccc(C(=O)NO)c1 Amb6258947 [0,1,1,0,0,0|0,0,2]=4 2953 B11R1.23 Cc1cccc(C(O)CO)c1 Amb24116522 [0,1,1,0,0,0|1,0,1]=4 2954 B11R1.23 Cc1cccc([C@@H](O)CO)c1 Amb27598612 [0,1,1,0,0,0|1,0,1]=4 2955 B11R1.23 Cc1cccc([C@H](O)CO)c1 Amb27448748 [0,1,1,0,0,0|1,0,1]=4 2956 B11R1.23 Cc1cccc(\C(Cl)=N\O)n1 Amb32414490 [0,1,1,0,0,0|2,0,0]=4 2957 B11R1.23 Cc1cccc(\C(N)=N\N)c1 Amb25282227 [0,1,1,0,0,0|2,0,0]=4 2958 B11R1.23 Cc1cccc(\C(N)=N\O)c1 Amb6573044 [0,1,1,0,0,0|1,0,0]=3 2959 B11R1.23 Cc1cccc(\C(N)=N\O)n1 Amb23447048 [0,1,1,0,0,0|2,0,0]=4 2960 B11R1.23 Cc1ccnc(\C(N)=N\O)c1 Amb23447049 [0,1,1,0,0,0|2,0,0]=4 2961 B11R1.23 N\C(=N/O)c1cc(Cl)ccn1 Amb33328417 [0,1,1,0,0,0|2,0,0]=4 2962 B11R1.23 N\C(=N/O)c1cc(F)ccn1 Amb33328429 [0,1,1,0,0,0|2,0,0]=4 2963 B11R1.23 N\C(=N/O)c1ccc[n+]([O-])c1 Amb3429821 [0,1,1,0,0,0|2,0,0]=4 2964 B11R1.23 N\C(=N/O)c1cccc(Br)c1 Amb1106109 [0,1,1,0,0,0|1,0,0]=3 2965 B11R1.23 N\C(=N/O)c1cccc(Cl)c1 Amb1154245 [0,1,1,0,0,0|1,0,0]=3 2966 B11R1.23 N\C(=N/O)c1cccc(F)c1 Amb13952252 [0,1,1,0,0,0|1,0,0]=3 2967 B11R1.23 N\C(=N/O)c1cccc(F)n1 Amb33328419 [0,1,1,0,0,0|2,0,0]=4 2968 B11R1.23 N\C(=N/O)c1cccc(N)c1 Amb1115893 [0,1,1,0,0,0|1,0,0]=3 2969 B11R1.23 N\C(=N/O)c1cccc(O)c1 Amb8831945 [0,1,1,0,0,0|1,0,0]=3 2970 B11R1.23 N\C(=N/O)c1ccnc(Cl)c1 Amb20527641 [0,1,1,0,0,0|2,0,0]=4 2971 B11R1.23 N\C(=N/O)c1cncc(F)c1 Amb23557106 [0,1,1,0,0,0|2,0,0]=4 2972 B11R1.23 N\C(=N\O)c1cccc(Br)c1 Amb2695926 [0,1,1,0,0,0|1,0,0]=3 2973 B11R1.23 N\C(=N\O)c1cccc(Cl)c1 Amb2696047 [0,1,1,0,0,0|1,0,0]=3 2974 B11R1.23 N\C(=N\O)c1cccc(F)c1 Amb2696610 [0,1,1,0,0,0|1,0,0]=3 2975 B11R1.23 N\C(=N\O)c1cccc(I)c1 Amb2696228 [0,1,1,0,0,0|1,0,0]=3 2976 B11R1.23 N\C(=N\O)c1cccc(O)c1 Amb22044213 [0,1,1,0,0,0|1,0,0]=3 2977 B11R1.23 N\C(=N\O)c1cccc(O)n1 Amb28146677 [0,1,1,0,0,0|2,0,0]=4 2978 B11R1.23 N\C(=N\O)c1ccnc(Cl)c1 Amb10975614 [0,1,1,0,0,0|2,0,0]=4 2979 B11R1.23 N\C(=N\O)c1ccnc(F)c1 Amb25764540 [0,1,1,0,0,0|2,0,0]=4 2980 B11R1.23 N\C(=N\O)c1ccnc(S)c1 Amb25127400 [0,1,1,0,0,0|2,0,0]=4 2981 B11R1.23 N\C(=N\O)c1cncc(Br)c1 Amb27952622 [0,1,1,0,0,0|2,0,0]=4 2982 B11R1.23 N\N=C(\N)c1cccc(Br)c1 Amb25304357 [0,1,1,0,0,0|2,0,0]=4 2983 B11R1.23 N\N=C(\N)c1cccc(F)c1 Amb18177247 [0,1,1,0,0,0|2,0,0]=4 2984 B11R1.23 Nc1cccc(C(O)CO)c1 Amb18285028 [0,1,1,0,0,0|1,0,1]=4 2985 B11R1.23 O=C(CO)c1cccc(Br)c1 Amb24579747 [0,1,1,0,0,0|1,0,1]=4 2986 B11R1.23 O=C(CO)c1cccc(Cl)c1 Amb18185666 [0,1,1,0,0,0|1,0,1]=4 2987 B11R1.23 O=C(CO)c1cccc(F)c1 Amb18182894 [0,1,1,0,0,0|1,0,1]=4 2988 B11R1.23 O=C(CO)c1cccc(I)c1 Amb33623872 [0,1,1,0,0,0|1,0,1]=4 2989 B11R1.23 O=C(NO)c1cccc(Br)c1 Amb6275747 [0,1,1,0,0,0|0,0,2]=4 2990 B11R1.23 O=C(NO)c1cccc(Cl)c1 Amb6265167 [0,1,1,0,0,0|0,0,2]=4 2991 B11R1.23 O=C(NO)c1cccc(F)c1 Amb6267435 [0,1,1,0,0,0|0,0,2]=4 2992 B11R1.23 O=C(NO)c1cccc(O)c1 Amb6270436 [0,1,1,0,0,0|0,0,2]=4 2993 B11R1.23 O=C(OO)c1cccc(Cl)c1 Amb6365645 [0,1,1,0,0,0|1,0,1]=4 2994 B11R1.23 O=NN(O)c1cccc(O)c1 Amb27599441 [0,1,1,0,0,0|1,0,1]=4 2995 B11R1.23 OCC(O)c1cccc(Br)c1 Amb24123027 [0,1,1,0,0,0|1,0,1]=4 2996 B11R1.23 OCC(O)c1cccc(Cl)c1 Amb24116517 [0,1,1,0,0,0|1,0,1]=4 2997 B11R1.23 OCC(O)c1cccc(F)c1 Amb24123033 [0,1,1,0,0,0|1,0,1]=4 2998 B11R1.23 OCC(O)c1cccc(O)c1 Amb25087164 [0,1,1,0,0,0|1,0,1]=4 2999 B11R1.23 OC[C@@H](O)c1cccc(Cl)c1 Amb22745596 [0,1,1,0,0,0|1,0,1]=4 3000 B11R1.23 OC[C@@H](O)c1cccc(O)c1 Amb27174418 [0,1,1,0,0,0|1,0,1]=4 3001 B11R1.23 OC[C@H](O)c1cccc(Cl)c1 Amb25230571 [0,1,1,0,0,0|1,0,1]=4 3002 B11R1.23 OC[C@H](O)c1cccc(O)c1 Amb28280080 [0,1,1,0,0,0|1,0,1]=4 3003 B11R1.23 O\N=C(/Cl)c1cccc(Br)c1 Amb23247552 [0,1,1,0,0,0|1,0,0]=3 3004 B11R1.23 O\N=C(/Cl)c1cccc(Cl)c1 Amb23247548 [0,1,1,0,0,0|1,0,0]=3 3005 B11R1.23 O\N=C(/Cl)c1cccc(F)c1 Amb33999155 [0,1,1,0,0,0|1,0,0]=3 3006 B11R1.23 O\N=C(/Cl)c1cccc(O)c1 Amb27255465 [0,1,1,0,0,0|1,0,0]=3 3007 B11R1.23 O\N=C(\Cl)c1cccc(Br)c1 Amb25148358 [0,1,1,0,0,0|1,0,0]=3 3008 B11R1.23 O\N=C(\Cl)c1cccc(Cl)c1 Amb27823522 [0,1,1,0,0,0|1,0,0]=3 3009 B11R1.23 O\N=C(\Cl)c1cccc(F)c1 Amb24487004 [0,1,1,0,0,0|1,0,0]=3 3010 B11R1.36 C=C(B(O)O)c1ccccc1 Amb10071036 [0,1,1,0,0,0|2,0,0]=4 3011 B11R1.36 C=C(C(=O)O)c1ccccc1 Amb8628277 [0,1,1,0,0,0|2,0,0]=4 3012 B11R1.36 CC(O)C(=O)c1ccccc1 Amb18799361 [0,1,1,0,0,0|1,0,1]=4 3013 B11R1.36 CN(O)C(=O)c1ccccc1 Amb25082592 [0,1,1,0,0,0|0,0,2]=4 3014 B11R1.36 C[C@H](O)[C@H](O)c1ccccc1 Amb25362712 [0,1,1,0,0,0|1,0,1]=4 3015 B11R1.36 O=C(O)C(=O)c1ccccc1 Amb2611302 [0,1,1,0,0,0|1,0,1]=4 3016 B11R1.36 O=C(O)C(=O)c1ccccc1 Amb33204525 [0,1,1,0,0,0|1,0,1]=4 3017 B11R1.36 O=C(O)C(O)c1ccccc1 Amb4018578 [0,1,1,0,0,0|1,0,1]=4 3018 B11R1.36 O=C(O)C(O)c1ccccc1 Amb9703097 [0,1,1,0,0,0|1,0,1]=4 3019 B11R1.36 O=C(O)[C@@H](O)c1ccccc1 Amb6354582 [0,1,1,0,0,0|1,0,1]=4 3020 B11R1.36 O=C(O)[C@H](O)c1ccccc1 Amb3428495 [0,1,1,0,0,0|1,0,1]=4 3021 B11R1.36 O=C(c1ccccc1)C(O)Cl Amb24528115 [0,1,1,0,0,0|1,0,1]=4 3022 B11R1.36 O=C(c1ccccc1)C(O)O Amb8392241 [0,1,1,0,0,0|1,0,1]=4 3023 B11R1.36 O=[PH](O)C(O)c1ccccc1 Amb21618921 [0,1,1,0,0,0|0,1,1]=4 3024 B11R1.222 C[n+]1ccccc1\C(N)=N\O Amb24628569 [0,1,1,0,0,0|2,0,0]=4 3025 B11R1.222 C\C(=N/O)c1ccccc1Cl Amb2752474 [0,1,1,0,0,0|1,0,0]=3 3026 B11R1.222 C\C(=N/O)c1ccccc1F Amb18799449 [0,1,1,0,0,0|1,0,0]=3 3027 B11R1.222 C\C(=N/O)c1ccccc1N Amb24059902 [0,1,1,0,0,0|1,0,0]=3 3028 B11R1.222 C\C(=N/O)c1ccccc1O Amb2436546 [0,1,1,0,0,0|1,0,0]=3 3029 B11R1.222 C\C(=N/O)c1ccncc1F Amb32651919 [0,1,1,0,0,0|2,0,0]=4 3030 B11R1.222 C\C(=N/O)c1ccncc1F Amb32652194 [0,1,1,0,0,0|2,0,0]=4 3031 B11R1.222 C\C(=N\Cl)c1ccccc1O Amb27818155 [0,1,1,0,0,0|2,0,0]=4 3032 B11R1.222 C\C(=N\O)c1ccccc1Br Amb2611267 [0,1,1,0,0,0|1,0,0]=3 3033 B11R1.222 C\C(=N\O)c1ccccc1O Amb5837374 [0,1,1,0,0,0|1,0,0]=3 3034 B11R1.222 C\C(=N\O)c1ccncc1F Amb28454405 [0,1,1,0,0,0|2,0,0]=4 3035 B11R1.222 C\C(=N\O)c1cnccc1C Amb27267765 [0,1,1,0,0,0|2,0,0]=4 3036 B11R1.222 C\C(=N\O)c1ncccc1F Amb27634699 [0,1,1,0,0,0|2,0,0]=4 3037 B11R1.222 C\C(NO)=C1\C=CC=CC1=O Amb33512951 [0,1,1,0,0,0|1,0,1]=4 3038 B11R1.222 C\N=C(/C)c1ccccc1O Amb27591596 [0,1,1,0,0,0|2,0,0]=4 3039 B11R1.222 C\N=C(\C)c1ccccc1O Amb27426431 [0,1,1,0,0,0|2,0,0]=4 3040 B11R1.222 C\N=C(\F)c1ccccc1O Amb28132410 [0,1,1,0,0,0|2,0,0]=4 3041 B11R1.222 Cc1ccccc1C(=O)CO Amb18182730 [0,1,1,0,0,0|1,0,1]=4 3042 B11R1.222 Cc1ccccc1C(=O)NO Amb6278426 [0,1,1,0,0,0|0,0,2]=4 3043 B11R1.222 Cc1ccccc1C(O)CO Amb27146455 [0,1,1,0,0,0|1,0,1]=4 3044 B11R1.222 Cc1ccccc1[C@H](O)CO Amb27776437 [0,1,1,0,0,0|1,0,1]=4 3045 B11R1.222 Cc1ccccc1\C(N)=N\N Amb28410471 [0,1,1,0,0,0|2,0,0]=4 3046 B11R1.222 Cc1ccccc1\C(N)=N\O Amb1641417 [0,1,1,0,0,0|1,0,0]=3 3047 B11R1.222 Cc1ccccc1\C(N)=N\O Amb32679865 [0,1,1,0,0,0|1,0,0]=3 3048 B11R1.222 Cc1cccnc1\C(N)=N\O Amb2689677 [0,1,1,0,0,0|2,0,0]=4 3049 B11R1.222 Cc1ccncc1\C(N)=N\O Amb16231236 [0,1,1,0,0,0|2,0,0]=4 3050 B11R1.222 Cc1cnccc1\C(Cl)=N\O Amb27198972 [0,1,1,0,0,0|2,0,0]=4 3051 B11R1.222 Cc1cnccc1\C(N)=N\O Amb25065278 [0,1,1,0,0,0|2,0,0]=4 3052 B11R1.222 N=C(NO)c1ccccc1Br Amb22489654 [0,1,1,0,0,0|1,0,1]=4 3053 B11R1.222 N=C(NO)c1ccccc1Cl Amb33714746 [0,1,1,0,0,0|1,0,1]=4 3054 B11R1.222 N=C(NO)c1ccccc1N Amb8631029 [0,1,1,0,0,0|1,0,1]=4 3055 B11R1.222 N\C(=C\O)c1ccccc1Cl Amb28043985 [0,1,1,0,0,0|2,0,0]=4 3056 B11R1.222 N\C(=N/O)C1=CC=CNC1=O Amb19514603 [0,1,1,0,0,0|2,0,0]=4 3057 B11R1.222 N\C(=N/O)c1ccccc1Cl Amb1104662 [0,1,1,0,0,0|1,0,0]=3 3058 B11R1.222 N\C(=N/O)c1ccccc1F Amb20407543 [0,1,1,0,0,0|1,0,0]=3 3059 B11R1.222 N\C(=N/O)c1ccccc1O Amb8384635 [0,1,1,0,0,0|1,0,0]=3 3060 B11R1.222 N\C(=N/O)c1cccnc1Cl Amb1094045 [0,1,1,0,0,0|2,0,0]=4 3061 B11R1.222 N\C(=N/O)c1cnccc1Cl Amb33328427 [0,1,1,0,0,0|2,0,0]=4 3062 B11R1.222 N\C(=N\O)C1=CC=CNC1=S Amb24367235 [0,1,1,0,0,0|2,0,0]=4 3063 B11R1.222 N\C(=N\O)c1cccc[n+]1[O-] Amb24536340 [0,1,1,0,0,0|2,0,0]=4 3064 B11R1.222 N\C(=N\O)c1ccccc1Cl Amb2696045 [0,1,1,0,0,0|1,0,0]=3 3065 B11R1.222 N\C(=N\O)c1ccccc1F Amb2696612 [0,1,1,0,0,0|1,0,0]=3 3066 B11R1.222 N\C(=N\O)c1ccncc1Br Amb24562891 [0,1,1,0,0,0|2,0,0]=4 3067 B11R1.222 N\C(=N\O)c1ccncc1Cl Amb26622037 [0,1,1,0,0,0|2,0,0]=4 3068 B11R1.222 N\C(=N\O)c1ncccc1Br Amb26584782 [0,1,1,0,0,0|2,0,0]=4 3069 B11R1.222 N\C(=N\O)c1ncccc1Cl Amb25149517 [0,1,1,0,0,0|2,0,0]=4 3070 B11R1.222 N\C(=N\O)c1ncccc1O Amb27796283 [0,1,1,0,0,0|2,0,0]=4 3071 B11R1.222 N\N=C(\N)c1ccccc1Br Amb27171792 [0,1,1,0,0,0|2,0,0]=4 3072 B11R1.222 N\N=C(\N)c1ccccc1F Amb18787466 [0,1,1,0,0,0|2,0,0]=4 3073 B11R1.222 Nc1ccccc1C(=O)NO Amb3094175 [0,1,1,0,0,0|0,0,2]=4 3074 B11R1.222 O=C(CO)c1ccccc1Br Amb24639690 [0,1,1,0,0,0|1,0,1]=4 3075 B11R1.222 O=C(CO)c1ccccc1Cl Amb18185665 [0,1,1,0,0,0|1,0,1]=4 3076 B11R1.222 O=C(CO)c1ccccc1F Amb18182895 [0,1,1,0,0,0|1,0,1]=4 3077 B11R1.222 O=C(CO)c1ccccc1I Amb33623873 [0,1,1,0,0,0|1,0,1]=4 3078 B11R1.222 O=C(CO)c1ccccc1O Amb18125347 [0,1,1,0,0,0|1,0,1]=4 3079 B11R1.222 O=C(NO)c1ccccc1Br Amb6269839 [0,1,1,0,0,0|0,0,2]=4 3080 B11R1.222 O=C(NO)c1ccccc1Cl Amb6259829 [0,1,1,0,0,0|0,0,2]=4 3081 B11R1.222 O=C(NO)c1ccccc1F Amb6269743 [0,1,1,0,0,0|0,0,2]=4 3082 B11R1.222 O=C(NO)c1ccccc1O Amb2504335 [0,1,1,0,0,0|0,0,2]=4 3083 B11R1.222 OCC(O)c1ccccc1Br Amb24123020 [0,1,1,0,0,0|1,0,1]=4 3084 B11R1.222 OCC(O)c1ccccc1Cl Amb24123046 [0,1,1,0,0,0|1,0,1]=4 3085 B11R1.222 OCC(O)c1ccccc1F Amb24123031 [0,1,1,0,0,0|1,0,1]=4 3086 B11R1.222 OCC(O)c1ccccc1I Amb27176284 [0,1,1,0,0,0|1,0,1]=4 3087 B11R1.222 OCC(O)c1ccccc1O Amb24646646 [0,1,1,0,0,0|1,0,1]=4 3088 B11R1.222 OC[C@@H](O)c1ccccc1Cl Amb6365718 [0,1,1,0,0,0|1,0,1]=4 3089 B11R1.222 OC[C@H](O)c1ccccc1Br Amb27867396 [0,1,1,0,0,0|1,0,1]=4 3090 B11R1.222 OC[C@H](O)c1ccccc1Cl Amb25776080 [0,1,1,0,0,0|1,0,1]=4 3091 B11R1.222 O\N=C(/Br)c1ccccc1O Amb27823433 [0,1,1,0,0,0|1,0,0]=3 3092 B11R1.222 O\N=C(/Cl)c1ccccc1Br Amb25075705 [0,1,1,0,0,0|1,0,0]=3 3093 B11R1.222 O\N=C(/Cl)c1ccccc1Cl Amb10569880 [0,1,1,0,0,0|1,0,0]=3 3094 B11R1.222 O\N=C(/Cl)c1ccccc1F Amb2444282 [0,1,1,0,0,0|1,0,0]=3 3095 B11R1.222 O\N=C(/O)c1ccccc1O Amb21811585 [0,1,1,0,0,0|0,0,0]=2 3096 B11R1.222 O\N=C(\Cl)c1ccccc1Br Amb27804520 [0,1,1,0,0,0|1,0,0]=3 3097 B11R1.222 O\N=C(\Cl)c1ccccc1F Amb28142171 [0,1,1,0,0,0|1,0,0]=3 3098 B11R1.222 O\N=C(\Cl)c1ccccc1O Amb28053947 [0,1,1,0,0,0|1,0,0]=3 3099 B11R1.222 O\N=C(\Cl)c1cccnc1Cl Amb27805038 [0,1,1,0,0,0|2,0,0]=4 3100 B11R1.222 O\N=C(\O)c1ccccc1O Amb17777872 [0,1,1,0,0,0|0,0,0]=2 3101 B11R1.15 Cc1cc(C(=O)\C=C\Cl)on1 Amb29880150 [0,1,1,0,0,0|2,0,0]=4 3102 B11R1.27 C\C=C\C=C\c1nc(C)no1 Amb27598330 [0,1,1,0,0,0|2,0,0]=4 3103 B11R1.39 C\C(C=O)=C/c1cc(C)no1 Amb27808055 [0,1,1,0,0,0|2,0,0]=4 3104 B11R1.75 CC(=O)\C=C\c1cc(C)no1 Amb26021563 [0,1,1,0,0,0|1,0,1]=4 3105 B11R1.75 Cc1cc(\C=C/C(N)=O)on1 Amb28254231 [0,1,1,0,0,0|2,0,0]=4 3106 B11R1.75 Cc1cc(\C=C\C(=O)O)on1 Amb33079891 [0,1,1,0,0,0|2,0,0]=4 3107 B11R1.75 O=C(O)\C=C\c1cc(Cl)no1 Amb18127135 [0,1,1,0,0,0|2,0,0]=4 3108 B11R1.214 COc1cc(\C=C\C=O)on1 Amb32727388 [0,1,1,0,0,0|1,0,0]=3 3109 B11R1.214 COc1cc(\C=C\C=O)sn1 Amb27435713 [0,1,1,0,0,0|1,1,0]=4 3110 B11R1.214 COc1cc(\C=C\CN)on1 Amb32727386 [0,1,1,0,0,0|1,0,1]=4 3111 B11R1.214 COc1cc(\C=C\CO)on1 Amb32727387 [0,1,1,0,0,0|1,0,1]=4 3112 B11R1.1 C=CCOc1ccc(Br)cc1 Amb5722388 [0,1,1,0,0,0|2,0,0]=4 3113 B11R1.1 C=CCOc1ccc(C)cc1 Amb3940652 [0,1,1,0,0,0|2,0,0]=4 3114 B11R1.1 C=CCOc1ccc(Cl)cc1 Amb17933920 [0,1,1,0,0,0|2,0,0]=4 3115 B11R1.1 C=CCOc1ccc(F)cc1 Amb27214032 [0,1,1,0,0,0|2,0,0]=4 3116 B11R1.1 C=CCOc1ccc(I)cc1 Amb25699607 [0,1,1,0,0,0|2,0,0]=4 3117 B11R1.1 C=CCOc1ccc(N)cc1 Amb2592767 [0,1,1,0,0,0|2,0,0]=4 3118 B11R1.1 C=CCOc1ccc(N)cc1 Amb6541454 [0,1,1,0,0,0|2,0,0]=4 3119 B11R1.1 C=CCOc1ccc(O)cc1 Amb2612084 [0,1,1,0,0,0|2,0,0]=4 3120 B11R1.1 C\C=C\Oc1ccc(N)cc1 Amb27859329 [0,1,1,0,0,0|2,0,0]=4 3121 B11R1.1 Cc1ccc(OCC=O)cc1 Amb5731821 [0,1,1,0,0,0|1,0,1]=4 3122 B11R1.1 Cc1ccc(OCCO)cc1 Amb2209347 [0,1,1,0,0,0|1,0,1]=4 3123 B11R1.1 Cc1ccc(O\C=C/Cl)cc1 Amb27400345 [0,1,1,0,0,0|2,0,0]=4 3124 B11R1.1 Cc1ccc(\C=N\CO)cc1 Amb27598320 [0,1,1,0,0,0|1,0,1]=4 3125 B11R1.1 Cl\C=C\Oc1ccc(Cl)cc1 Amb27878895 [0,1,1,0,0,0|2,0,0]=4 3126 B11R1.1 N\C=N\Nc1ccc(N)cc1 Amb24637265 [0,1,1,0,0,0|2,0,0]=4 3127 B11R1.1 Nc1ccc(OCCO)cc1 Amb15740917 [0,1,1,0,0,0|1,0,1]=4 3128 B11R1.1 Nc1ccc(OCCO)cc1 Amb6702377 [0,1,1,0,0,0|1,0,1]=4 3129 B11R1.1 O=CCOc1ccc(Cl)cc1 Amb5731836 [0,1,1,0,0,0|1,0,1]=4 3130 B11R1.1 O=CCOc1ccc(F)cc1 Amb5731822 [0,1,1,0,0,0|1,0,1]=4 3131 B11R1.1 O=CCOc1ccc(I)cc1 Amb27640919 [0,1,1,0,0,0|1,0,1]=4 3132 B11R1.1 O=C\N=C\c1ccc(O)cc1 Amb26557720 [0,1,1,0,0,0|1,0,1]=4 3133 B11R1.1 OCCOc1ccc(Br)cc1 Amb3939111 [0,1,1,0,0,0|1,0,1]=4 3134 B11R1.1 OCCOc1ccc(Cl)cc1 Amb2209356 [0,1,1,0,0,0|1,0,1]=4 3135 B11R1.1 OCCOc1ccc(F)cc1 Amb9370676 [0,1,1,0,0,0|1,0,1]=4 3136 B11R1.1 OCCOc1ccc(I)cc1 Amb9247649 [0,1,1,0,0,0|1,0,1]=4 3137 B11R1.1 OCCOc1ccc(O)cc1 Amb33528799 [0,1,1,0,0,0|1,0,1]=4 3138 B11R1.17 C=CCOc1ccccc1Br Amb4422143 [0,1,1,0,0,0|2,0,0]=4 3139 B11R1.17 C=CCOc1ccccc1C Amb2721161 [0,1,1,0,0,0|2,0,0]=4 3140 B11R1.17 C=CCOc1ccccc1Cl Amb3940570 [0,1,1,0,0,0|2,0,0]=4 3141 B11R1.17 C=CCOc1ccccc1F Amb2688315 [0,1,1,0,0,0|2,0,0]=4 3142 B11R1.17 C=CCOc1ccccc1I Amb24384940 [0,1,1,0,0,0|2,0,0]=4 3143 B11R1.17 C=CCOc1ccccc1N Amb2081548 [0,1,1,0,0,0|2,0,0]=4 3144 B11R1.17 C=CCOc1ccccc1N Amb2721826 [0,1,1,0,0,0|2,0,0]=4 3145 B11R1.17 C=CCOc1ccccc1O Amb8837354 [0,1,1,0,0,0|2,0,0]=4 3146 B11R1.17 C\C=C/Oc1ccccc1O Amb28137745 [0,1,1,0,0,0|2,0,0]=4 3147 B11R1.17 C\C=N\Nc1ccccc1N Amb27167739 [0,1,1,0,0,0|2,0,0]=4 3148 B11R1.17 Cc1ccccc1OCC=O Amb5731819 [0,1,1,0,0,0|1,0,1]=4 3149 B11R1.17 Cc1ccccc1OCCO Amb2209345 [0,1,1,0,0,0|1,0,1]=4 3150 B11R1.17 Nc1ccccc1OCCO Amb33734854 [0,1,1,0,0,0|1,0,1]=4 3151 B11R1.17 Nc1ccccc1OCCO Amb6702378 [0,1,1,0,0,0|1,0,1]=4 3152 B11R1.17 O=CCOc1ccccc1Br Amb17099950 [0,1,1,0,0,0|1,0,1]=4 3153 B11R1.17 O=CCOc1ccccc1Cl Amb5731835 [0,1,1,0,0,0|1,0,1]=4 3154 B11R1.17 O=CCOc1ccccc1F Amb18182892 [0,1,1,0,0,0|1,0,1]=4 3155 B11R1.17 O=CCOc1ccccc1I Amb27871520 [0,1,1,0,0,0|1,0,1]=4 3156 B11R1.17 O=CCOc1ccccc1O Amb27176428 [0,1,1,0,0,0|1,0,1]=4 3157 B11R1.17 O=C\N=C\c1ccccc1O Amb24422424 [0,1,1,0,0,0|1,0,1]=4 3158 B11R1.17 OCCOc1ccccc1Br Amb6702414 [0,1,1,0,0,0|1,0,1]=4 3159 B11R1.17 OCCOc1ccccc1Cl Amb2209355 [0,1,1,0,0,0|1,0,1]=4 3160 B11R1.17 OCCOc1ccccc1F Amb9370651 [0,1,1,0,0,0|1,0,1]=4 3161 B11R1.17 OCCOc1ccccc1I Amb25761613 [0,1,1,0,0,0|1,0,1]=4 3162 B11R1.17 OCCOc1ccccc1O Amb1144452 [0,1,1,0,0,0|1,0,1]=4 3163 B11R1.24 C=CCOc1cccc(Br)c1 Amb6263292 [0,1,1,0,0,0|2,0,0]=4 3164 B11R1.24 C=CCOc1cccc(Cl)c1 Amb27223591 [0,1,1,0,0,0|2,0,0]=4 3165 B11R1.24 C=CCOc1cccc(N)c1 Amb2094493 [0,1,1,0,0,0|2,0,0]=4 3166 B11R1.24 C=CCOc1cccc(N)c1 Amb33527291 [0,1,1,0,0,0|2,0,0]=4 3167 B11R1.24 C=CCOc1cccc(O)c1 Amb8837461 [0,1,1,0,0,0|2,0,0]=4 3168 B11R1.24 Cc1cccc(OCC=O)c1 Amb5731820 [0,1,1,0,0,0|1,0,1]=4 3169 B11R1.24 Cc1cccc(OCCO)c1 Amb2209346 [0,1,1,0,0,0|1,0,1]=4 3170 B11R1.24 Cc1cccc(O\C=C\Cl)c1 Amb27471988 [0,1,1,0,0,0|2,0,0]=4 3171 B11R1.24 Nc1cccc(OCCO)c1 Amb2586519 [0,1,1,0,0,0|1,0,1]=4 3172 B11R1.24 O=CCOc1cccc(Br)c1 Amb17099951 [0,1,1,0,0,0|1,0,1]=4 3173 B11R1.24 O=CCOc1cccc(Cl)c1 Amb18806821 [0,1,1,0,0,0|1,0,1]=4 3174 B11R1.24 O=CCOc1cccc(I)c1 Amb27838178 [0,1,1,0,0,0|1,0,1]=4 3175 B11R1.24 OCCOc1cccc(Br)c1 Amb33527712 [0,1,1,0,0,0|1,0,1]=4 3176 B11R1.24 OCCOc1cccc(Cl)c1 Amb33531543 [0,1,1,0,0,0|1,0,1]=4 3177 B11R1.24 OCCOc1cccc(F)c1 Amb9370687 [0,1,1,0,0,0|1,0,1]=4 3178 B11R1.24 OCCOc1cccc(I)c1 Amb9370547 [0,1,1,0,0,0|1,0,1]=4 3179 B11R1.28 C=CCCOc1ccccc1 Amb27271699 [0,1,1,0,0,0|2,0,0]=4 3180 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [0,1,1,0,0,0|2,0,0]=4 3181 B11R1.28 C=CCO[BrH]c1ccccc1 Amb27001649 [0,1,1,0,0,0|2,0,0]=4 3182 B11R1.28 C=CNOCc1ccccc1 Amb27791078 [0,1,1,0,0,0|1,0,1]=4 3183 B11R1.28 CC\C=N\Nc1ccccc1 Amb27258240 [0,1,1,0,0,0|2,0,0]=4 3184 B11R1.28 COCCOc1ccccc1 Amb4018811 [0,1,1,0,0,0|1,0,1]=4 3185 B11R1.28 CO\C=C/Oc1ccccc1 Amb24069136 [0,1,1,0,0,0|1,0,0]=3 3186 B11R1.28 C\C=C\COc1ccccc1 Amb4036065 [0,1,1,0,0,0|2,0,0]=4 3187 B11R1.28 ClC\C=N\Cc1ccccc1 Amb26887419 [0,1,1,0,0,0|2,0,0]=4 3188 B11R1.28 Cl\C=C\COc1ccccc1 Amb27668260 [0,1,1,0,0,0|2,0,0]=4 3189 B11R1.28 NOCCOc1ccccc1 Amb17088287 [0,1,1,0,0,0|1,0,1]=4 3190 B11R1.28 NOCCOc1ccccc1 Amb19894640 [0,1,1,0,0,0|1,0,1]=4 3191 B11R1.28 O=C=NCOc1ccccc1 Amb20668487 [0,1,1,0,0,0|0,0,2]=4 3192 B11R1.28 O=CCCOc1ccccc1 Amb5731758 [0,1,1,0,0,0|1,0,1]=4 3193 B11R1.28 O=CCOCc1ccccc1 Amb3939958 [0,1,1,0,0,0|1,0,1]=4 3194 B11R1.28 O=CNOCc1ccccc1 Amb27805476 [0,1,1,0,0,0|0,0,2]=4 3195 B11R1.28 O=CN\N=C/c1ccccc1 Amb2612268 [0,1,1,0,0,0|1,0,1]=4 3196 B11R1.28 O=C\C=C\Oc1ccccc1 Amb24585165 [0,1,1,0,0,0|1,0,1]=4 3197 B11R1.28 O=C\C=N\Nc1ccccc1 Amb2417721 [0,1,1,0,0,0|1,0,1]=4 3198 B11R1.28 OCCCOc1ccccc1 Amb4476987 [0,1,1,0,0,0|1,0,1]=4 3199 B11R1.28 OCCOCc1ccccc1 Amb3939139 [0,1,1,0,0,0|1,0,1]=4 3200 B11R1.28 OC\C=C\Cc1ccccc1 Amb32951814 [0,1,1,0,0,0|2,0,0]=4 3201 B11R1.28 OC\C=C\Oc1ccccn1 Amb27823751 [0,1,1,0,0,0|2,0,0]=4 3202 B11R1.28 OC\C=C\Sc1ccccc1 Amb27164022 [0,1,1,0,0,0|1,1,0]=4 3203 B11R1.28 ONCCOc1ccccc1 Amb17088413 [0,1,1,0,0,0|1,0,1]=4 3204 B11R1.28 O\C=C\C=C\c1ccccc1 Amb27970649 [0,1,1,0,0,0|2,0,0]=4 3205 B11R1.28 O\N=C\C=C/c1ccccc1 Amb24668019 [0,1,1,0,0,0|2,0,0]=4 3206 B11R1.28 O\N=C\C=C\c1ccccc1 Amb28366863 [0,1,1,0,0,0|2,0,0]=4 3207 B11R1.40 CC(C=O)Oc1ccccc1 Amb22011729 [0,1,1,0,0,0|1,0,1]=4 3208 B11R1.40 CC(CO)Oc1ccccc1 Amb17232100 [0,1,1,0,0,0|1,0,1]=4 3209 B11R1.40 C[C@@H](C=O)Oc1ccccc1 Amb24504931 [0,1,1,0,0,0|1,0,1]=4 3210 B11R1.40 C[C@H](CO)Oc1ccccc1 Amb28182636 [0,1,1,0,0,0|1,0,1]=4 3211 B11R1.40 Cl\C=C(/Cl)Oc1ccccc1 Amb34048810 [0,1,1,0,0,0|2,0,0]=4 3212 B11R1.40 Cl\C=C(\Cl)Oc1ccccc1 Amb25968444 [0,1,1,0,0,0|2,0,0]=4 3213 B11R1.40 F\C(=C\Cl)Oc1ccccc1 Amb27477898 [0,1,1,0,0,0|2,0,0]=4 3214 B11R1.40 O=C(NO)Oc1ccccc1 Amb22493600 [0,1,1,0,0,0|2,0,0]=4 3215 B11R1.40 OCC(O)Oc1ccccc1 Amb28344634 [0,1,1,0,0,0|1,0,1]=4 3216 B11R1.91 C=C(C)COc1ccccc1 Amb10601706 [0,1,1,0,0,0|2,0,0]=4 3217 B11R1.91 C=C(O)OCc1ccccc1 Amb26478129 [0,1,1,0,0,0|2,0,0]=4 3218 B11R1.91 CC(=O)COc1ccccc1 Amb8515312 [0,1,1,0,0,0|1,0,1]=4 3219 B11R1.91 CC(=O)\N=N\c1ccccc1 Amb16231119 [0,1,1,0,0,0|1,0,1]=4 3220 B11R1.91 CC(C)=COc1ccccc1 Amb28182600 [0,1,1,0,0,0|2,0,0]=4 3221 B11R1.91 CC(C)=NCc1ccccc1 Amb10568469 [0,1,1,0,0,0|2,0,0]=4 3222 B11R1.91 CC(C)=NOc1ccccn1 Amb27807356 [0,1,1,0,0,0|2,0,0]=4 3223 B11R1.91 CC(C)=NOc1ccncc1 Amb22364427 [0,1,1,0,0,0|2,0,0]=4 3224 B11R1.91 CC(O)COc1ccccc1 Amb6298844 [0,1,1,0,0,0|1,0,1]=4 3225 B11R1.91 CN(O)\N=N\c1ccccc1 Amb27185830 [0,1,1,0,0,0|2,0,0]=4 3226 B11R1.91 C[C@@H](O)COc1ccccc1 Amb27776994 [0,1,1,0,0,0|1,0,1]=4 3227 B11R1.91 N=C(N)COc1ccccc1 Amb2725000 [0,1,1,0,0,0|2,0,0]=4 3228 B11R1.91 N=C(N)COc1ccccc1 Amb33551040 [0,1,1,0,0,0|2,0,0]=4 3229 B11R1.91 NC(=O)COc1ccccc1 Amb6358162 [0,1,1,0,0,0|1,0,1]=4 3230 B11R1.91 NC(=O)\N=C\c1ccccc1 Amb28364091 [0,1,1,0,0,0|1,0,1]=4 3231 B11R1.91 NC(=S)COc1ccccc1 Amb1155418 [0,1,1,0,0,0|1,1,0]=4 3232 B11R1.91 NC(=S)\N=N\c1ccccc1 Amb27984870 [0,1,1,0,0,0|1,1,0]=4 3233 B11R1.91 NC(N)=NCc1ccccc1 Amb19374239 [0,1,1,0,0,0|2,0,0]=4 3234 B11R1.91 NC(N)=NNc1ccccc1 Amb24726173 [0,1,1,0,0,0|2,0,0]=4 3235 B11R1.91 O=C(Cl)COc1ccccc1 Amb844296 [0,1,1,0,0,0|1,0,1]=4 3236 B11R1.91 O=C(O)C#Cc1ccccc1 Amb6364732 [0,1,1,0,0,0|2,0,0]=4 3237 B11R1.91 O=C(O)CCc1ccccc1 Amb6356505 [0,1,1,0,0,0|2,0,0]=4 3238 B11R1.91 O=C(O)CNc1ccccc1 Amb840513 [0,1,1,0,0,0|2,0,0]=4 3239 B11R1.91 O=C(O)COc1ccccc1 Amb1213413 [0,1,1,0,0,0|1,0,0]=3 3240 B11R1.91 O=C(O)COc1ccccc1 Amb22274444 [0,1,1,0,0,0|1,0,0]=3 3241 B11R1.91 O=C(O)COc1ccccn1 Amb2610077 [0,1,1,0,0,0|2,0,0]=4 3242 B11R1.91 O=C(O)COc1ccccn1 Amb34912615 [0,1,1,0,0,0|2,0,0]=4 3243 B11R1.91 O=C(O)COc1cccnc1 Amb22738612 [0,1,1,0,0,0|2,0,0]=4 3244 B11R1.91 O=C(O)COc1cccnc1 Amb33552775 [0,1,1,0,0,0|2,0,0]=4 3245 B11R1.91 O=C(O)COc1cccnc1 Amb836933 [0,1,1,0,0,0|2,0,0]=4 3246 B11R1.91 O=C(O)COc1ccncc1 Amb18125520 [0,1,1,0,0,0|2,0,0]=4 3247 B11R1.91 O=C(O)CSc1ccccc1 Amb1038999 [0,1,1,0,0,0|1,1,0]=4 3248 B11R1.91 O=C(O)\C=C/c1ccccc1 Amb26880208 [0,1,1,0,0,0|2,0,0]=4 3249 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb33719192 [0,1,1,0,0,0|2,0,0]=4 3250 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb6456608 [0,1,1,0,0,0|2,0,0]=4 3251 B11R1.91 O=C([O-])COc1ccccc1 Amb6366707 [0,1,1,0,0,0|1,0,1]=4 3252 B11R1.91 O=C([O-])\N=N\c1ccccc1 Amb26350249 [0,1,1,0,0,0|1,0,1]=4 3253 B11R1.37 C=Cc1cc(Br)ccc1OC Amb4296984 [0,1,1,0,0,0|2,0,0]=4 3254 B11R1.37 C=Cc1cc(C)ccc1OC Amb25771138 [0,1,1,0,0,0|2,0,0]=4 3255 B11R1.37 C=Cc1cc(Cl)ccc1OC Amb33413843 [0,1,1,0,0,0|2,0,0]=4 3256 B11R1.37 C=Cc1cc(F)ccc1OC Amb27840364 [0,1,1,0,0,0|2,0,0]=4 3257 B11R1.37 C=Cc1cc(I)ccc1OC Amb10243490 [0,1,1,0,0,0|2,0,0]=4 3258 B11R1.37 C=Cc1ccc(Br)cc1OC Amb24613121 [0,1,1,0,0,0|2,0,0]=4 3259 B11R1.37 C=Cc1ccc(C)cc1OC Amb33142616 [0,1,1,0,0,0|2,0,0]=4 3260 B11R1.37 C=Cc1ccc(Cl)cc1OC Amb33052198 [0,1,1,0,0,0|2,0,0]=4 3261 B11R1.37 C=Cc1ccc(F)cc1OC Amb33313255 [0,1,1,0,0,0|2,0,0]=4 3262 B11R1.37 C=Cc1ccc(O)cc1OC Amb24070686 [0,1,1,0,0,0|2,0,0]=4 3263 B11R1.37 COC1=CC(=O)C=C\C1=N/O Amb26429558 [0,1,1,0,0,0|2,0,0]=4 3264 B11R1.37 COc1cc(Br)ccc1C=O Amb9025347 [0,1,1,0,0,0|1,0,1]=4 3265 B11R1.37 COc1cc(Br)ccc1CO Amb9025876 [0,1,1,0,0,0|1,0,1]=4 3266 B11R1.37 COc1cc(C)ccc1C=O Amb2721829 [0,1,1,0,0,0|1,0,1]=4 3267 B11R1.37 COc1cc(C)ccc1CO Amb2689141 [0,1,1,0,0,0|1,0,1]=4 3268 B11R1.37 COc1cc(Cl)ccc1C=O Amb18806820 [0,1,1,0,0,0|1,0,1]=4 3269 B11R1.37 COc1cc(F)ccc1C=O Amb2688143 [0,1,1,0,0,0|1,0,1]=4 3270 B11R1.37 COc1cc(F)ccc1CO Amb22229765 [0,1,1,0,0,0|1,0,1]=4 3271 B11R1.37 COc1cc(I)ccc1C=O Amb24394974 [0,1,1,0,0,0|1,0,1]=4 3272 B11R1.37 COc1cc(I)ccc1CO Amb25113637 [0,1,1,0,0,0|1,0,1]=4 3273 B11R1.37 COc1cc(N)ccc1CO Amb28436813 [0,1,1,0,0,0|1,0,1]=4 3274 B11R1.37 COc1cc(O)ccc1C=O Amb1230574 [0,1,1,0,0,0|1,0,1]=4 3275 B11R1.37 COc1cc(O)ccc1CO Amb9788673 [0,1,1,0,0,0|1,0,1]=4 3276 B11R1.37 COc1ccc(Br)cc1C=O Amb1880434 [0,1,1,0,0,0|1,0,1]=4 3277 B11R1.37 COc1ccc(Br)cc1CO Amb1154413 [0,1,1,0,0,0|1,0,1]=4 3278 B11R1.37 COc1ccc(C)cc1C=O Amb1215596 [0,1,1,0,0,0|1,0,1]=4 3279 B11R1.37 COc1ccc(C)cc1CO Amb1110443 [0,1,1,0,0,0|1,0,1]=4 3280 B11R1.37 COc1ccc(Cl)cc1C=N Amb28435216 [0,1,1,0,0,0|2,0,0]=4 3281 B11R1.37 COc1ccc(Cl)cc1C=O Amb6424172 [0,1,1,0,0,0|1,0,1]=4 3282 B11R1.37 COc1ccc(Cl)cc1CO Amb3939479 [0,1,1,0,0,0|1,0,1]=4 3283 B11R1.37 COc1ccc(F)cc1C=O Amb3939415 [0,1,1,0,0,0|1,0,1]=4 3284 B11R1.37 COc1ccc(F)cc1CO Amb8983231 [0,1,1,0,0,0|1,0,1]=4 3285 B11R1.37 COc1ccc(I)cc1C=O Amb6296502 [0,1,1,0,0,0|1,0,1]=4 3286 B11R1.37 COc1ccc(N)cc1C=O Amb18201744 [0,1,1,0,0,0|1,0,1]=4 3287 B11R1.37 COc1ccc(N)cc1CO Amb9214974 [0,1,1,0,0,0|1,0,1]=4 3288 B11R1.37 COc1ccc(O)cc1C=O Amb6329141 [0,1,1,0,0,0|1,0,1]=4 3289 B11R1.37 COc1ccc(O)cc1CO Amb25198159 [0,1,1,0,0,0|1,0,1]=4 3290 B11R1.41 C=CCc1ccccc1OC Amb6299111 [0,1,1,0,0,0|2,0,0]=4 3291 B11R1.41 C=COc1ccccc1C=O Amb26334217 [0,1,1,0,0,0|1,0,1]=4 3292 B11R1.41 C=Cc1ccccc1COC Amb25234064 [0,1,1,0,0,0|2,0,0]=4 3293 B11R1.41 C=Cc1ccccc1OCC Amb26635795 [0,1,1,0,0,0|2,0,0]=4 3294 B11R1.41 CCOc1ccccc1C=O Amb845365 [0,1,1,0,0,0|1,0,1]=4 3295 B11R1.41 CCOc1ccccc1CO Amb3546826 [0,1,1,0,0,0|1,0,1]=4 3296 B11R1.41 CNc1ccccc1\C=N\O Amb27484177 [0,1,1,0,0,0|2,0,0]=4 3297 B11R1.41 COCc1ccccc1C=O Amb18644422 [0,1,1,0,0,0|1,0,1]=4 3298 B11R1.41 COCc1ccccc1CO Amb24069032 [0,1,1,0,0,0|1,0,1]=4 3299 B11R1.41 COSc1ccccc1C=O Amb28074650 [0,1,1,0,0,0|1,0,1]=4 3300 B11R1.41 COc1ccccc1CC=O Amb9782680 [0,1,1,0,0,0|1,0,1]=4 3301 B11R1.41 COc1ccccc1CCO Amb3939092 [0,1,1,0,0,0|1,0,1]=4 3302 B11R1.41 COc1ccccc1CNO Amb23449445 [0,1,1,0,0,0|1,0,1]=4 3303 B11R1.41 COc1ccccc1CON Amb17091435 [0,1,1,0,0,0|1,0,1]=4 3304 B11R1.41 COc1ccccc1CON Amb21929115 [0,1,1,0,0,0|1,0,1]=4 3305 B11R1.41 COc1ccccc1NC=O Amb4016519 [0,1,1,0,0,0|1,0,1]=4 3306 B11R1.41 COc1ccccc1NC=S Amb27484178 [0,1,1,0,0,0|1,1,0]=4 3307 B11R1.41 COc1ccccc1OCO Amb27835885 [0,1,1,0,0,0|1,0,1]=4 3308 B11R1.41 COc1ccccc1\C=C\Br Amb33134852 [0,1,1,0,0,0|2,0,0]=4 3309 B11R1.41 COc1ccccc1\C=N\N Amb27661692 [0,1,1,0,0,0|2,0,0]=4 3310 B11R1.41 COc1ccccc1\C=N\O Amb4036201 [0,1,1,0,0,0|1,0,0]=3 3311 B11R1.41 COc1cnccc1\C=N\O Amb27665873 [0,1,1,0,0,0|2,0,0]=4 3312 B11R1.41 COc1ncccc1\C=N\O Amb27962961 [0,1,1,0,0,0|2,0,0]=4 3313 B11R1.41 C\C=C\c1ccccc1OC Amb28064969 [0,1,1,0,0,0|2,0,0]=4 3314 B11R1.41 C\N=C\c1ccccc1OC Amb1106347 [0,1,1,0,0,0|2,0,0]=4 3315 B11R1.41 N#COc1ccccc1C=O Amb25700946 [0,1,1,0,0,0|0,0,2]=4 3316 B11R1.41 N#Cc1ccccc1\C=N\O Amb25357539 [0,1,1,0,0,0|1,0,1]=4 3317 B11R1.41 O=Cc1ccccc1OCCl Amb27878777 [0,1,1,0,0,0|1,0,1]=4 3318 B11R1.53 C#Cc1ccccc1C(=O)O Amb10068419 [0,1,1,0,0,0|2,0,0]=4 3319 B11R1.53 C=C(Br)c1ccccc1OC Amb22736847 [0,1,1,0,0,0|2,0,0]=4 3320 B11R1.53 C=C(I)c1ccccc1OC Amb28246087 [0,1,1,0,0,0|2,0,0]=4 3321 B11R1.53 C=Cc1ccccc1C(=O)O Amb16185425 [0,1,1,0,0,0|2,0,0]=4 3322 B11R1.53 CCc1ccccc1C(=O)O Amb3940731 [0,1,1,0,0,0|2,0,0]=4 3323 B11R1.53 CNc1ccccc1C(=O)O Amb1209109 [0,1,1,0,0,0|2,0,0]=4 3324 B11R1.53 COc1ccccc1B(O)O Amb2383496 [0,1,1,0,0,0|2,0,0]=4 3325 B11R1.53 COc1ccccc1C(=N)N Amb22494243 [0,1,1,0,0,0|2,0,0]=4 3326 B11R1.53 COc1ccccc1C(=N)N Amb2696305 [0,1,1,0,0,0|2,0,0]=4 3327 B11R1.53 COc1ccccc1C(=N)N Amb8630187 [0,1,1,0,0,0|2,0,0]=4 3328 B11R1.53 COc1ccccc1C(=O)Cl Amb3429823 [0,1,1,0,0,0|1,0,1]=4 3329 B11R1.53 COc1ccccc1C(=O)F Amb27860257 [0,1,1,0,0,0|1,0,1]=4 3330 B11R1.53 COc1ccccc1C(=O)O Amb2592793 [0,1,1,0,0,0|1,0,0]=3 3331 B11R1.53 COc1ccccc1C(C)=O Amb2209367 [0,1,1,0,0,0|1,0,1]=4 3332 B11R1.53 COc1ccccc1C(C)O Amb2689207 [0,1,1,0,0,0|1,0,1]=4 3333 B11R1.53 COc1ccccc1C(N)=O Amb3564650 [0,1,1,0,0,0|1,0,1]=4 3334 B11R1.53 COc1ccccc1C(N)=S Amb1216517 [0,1,1,0,0,0|1,1,0]=4 3335 B11R1.53 COc1ccccc1S(=O)O Amb18862871 [0,1,1,0,0,0|2,0,0]=4 3336 B11R1.53 COc1ccccc1[C@@H](C)O Amb6893452 [0,1,1,0,0,0|1,0,1]=4 3337 B11R1.53 COc1ccccc1[C@H](C)O Amb6893451 [0,1,1,0,0,0|1,0,1]=4 3338 B11R1.53 COc1cccnc1C(=O)O Amb10842137 [0,1,1,0,0,0|2,0,0]=4 3339 B11R1.53 COc1ccncc1C(=O)O Amb21964513 [0,1,1,0,0,0|2,0,0]=4 3340 B11R1.53 COc1cnccc1C(=O)O Amb16230607 [0,1,1,0,0,0|2,0,0]=4 3341 B11R1.53 COc1ncccc1C(=O)O Amb1130324 [0,1,1,0,0,0|2,0,0]=4 3342 B11R1.53 CSc1ccccc1C(=O)O Amb6357476 [0,1,1,0,0,0|1,1,0]=4 3343 B11R1.53 C\C=C1/C=CC=C/C1=C(/C)O Amb27848191 [0,1,1,0,0,0|2,0,0]=4 3344 B11R1.53 C\C=C1\C=CC=C\C1=C(\C)O Amb27875406 [0,1,1,0,0,0|2,0,0]=4 3345 B11R1.53 N#Cc1ccccc1C(=O)O Amb1971492 [0,1,1,0,0,0|1,0,1]=4 3346 B11R1.53 N=Cc1ccccc1C(=O)O Amb27413879 [0,1,1,0,0,0|1,0,0]=3 3347 B11R1.53 NCc1ccccc1C(=O)O Amb1092013 [0,1,1,0,0,0|1,0,1]=4 3348 B11R1.53 NCc1ccccc1C(=O)O Amb21955326 [0,1,1,0,0,0|1,0,1]=4 3349 B11R1.53 NNc1ccccc1C(=O)O Amb1202653 [0,1,1,0,0,0|1,0,1]=4 3350 B11R1.53 NNc1ccccc1C(=O)O Amb2235199 [0,1,1,0,0,0|1,0,1]=4 3351 B11R1.53 O=C(O)c1ccccc1CBr Amb1935113 [0,1,1,0,0,0|2,0,0]=4 3352 B11R1.53 O=C(O)c1ccccc1CCl Amb6892775 [0,1,1,0,0,0|2,0,0]=4 3353 B11R1.53 O=C(O)c1ccccc1CF Amb25109949 [0,1,1,0,0,0|2,0,0]=4 3354 B11R1.53 O=C(O)c1ccccc1CO Amb33529359 [0,1,1,0,0,0|2,0,0]=4 3355 B11R1.53 O=C(O)c1ccccc1CS Amb17498634 [0,1,1,0,0,0|2,0,0]=4 3356 B11R1.53 O=C(O)c1ccccc1NO Amb26512688 [0,1,1,0,0,0|2,0,0]=4 3357 B11R1.53 O=C(O)c1ccccc1SCl Amb28136748 [0,1,1,0,0,0|1,1,0]=4 3358 B11R1.53 O=Cc1ccccc1C(=O)O Amb2568292 [0,1,1,0,0,0|2,0,0]=4 3359 B11R1.53 O=Nc1ccccc1C(=O)O Amb17593754 [0,1,1,0,0,0|2,0,0]=4 3360 B11R1.53 O=[IH2]c1ccccc1C(=O)O Amb9809713 [0,1,1,0,0,0|2,0,0]=4 3361 B11R1.53 [C-]#[N+]c1ccccc1C(=O)O Amb28125730 [0,1,1,0,0,0|2,0,0]=4 3362 B11R1.53 [NH3+]Nc1ccccc1C(=O)O Amb6365989 [0,1,1,0,0,0|1,0,1]=4 3363 B11R1.265 C=Cc1c(Br)cccc1OC Amb22737601 [0,1,1,0,0,0|2,0,0]=4 3364 B11R1.265 C=Cc1c(C)cccc1OC Amb33447256 [0,1,1,0,0,0|2,0,0]=4 3365 B11R1.265 C=Cc1c(Cl)cccc1OC Amb25204370 [0,1,1,0,0,0|2,0,0]=4 3366 B11R1.265 C=Cc1c(F)cccc1OC Amb25744451 [0,1,1,0,0,0|2,0,0]=4 3367 B11R1.265 C=Cc1cccc(Br)c1OC Amb33007434 [0,1,1,0,0,0|2,0,0]=4 3368 B11R1.265 C=Cc1cccc(C)c1OC Amb33322694 [0,1,1,0,0,0|2,0,0]=4 3369 B11R1.265 C=Cc1cccc(Cl)c1OC Amb33262088 [0,1,1,0,0,0|2,0,0]=4 3370 B11R1.265 C=Cc1cccc(F)c1OC Amb26887407 [0,1,1,0,0,0|2,0,0]=4 3371 B11R1.265 COc1c(Br)cccc1C=O Amb10602255 [0,1,1,0,0,0|1,0,1]=4 3372 B11R1.265 COc1c(Br)cccc1CO Amb10071373 [0,1,1,0,0,0|1,0,1]=4 3373 B11R1.265 COc1c(C)cccc1C=O Amb5559733 [0,1,1,0,0,0|1,0,1]=4 3374 B11R1.265 COc1c(C)cccc1CO Amb22751268 [0,1,1,0,0,0|1,0,1]=4 3375 B11R1.265 COc1c(Cl)cccc1C=O Amb19957542 [0,1,1,0,0,0|1,0,1]=4 3376 B11R1.265 COc1c(Cl)cccc1CO Amb24088513 [0,1,1,0,0,0|1,0,1]=4 3377 B11R1.265 COc1c(F)cccc1C=O Amb16233201 [0,1,1,0,0,0|1,0,1]=4 3378 B11R1.265 COc1c(F)cccc1CO Amb19957982 [0,1,1,0,0,0|1,0,1]=4 3379 B11R1.265 COc1c(I)cccc1C=O Amb27453687 [0,1,1,0,0,0|1,0,1]=4 3380 B11R1.265 COc1c(I)cccc1CO Amb25857436 [0,1,1,0,0,0|1,0,1]=4 3381 B11R1.265 COc1c(N)cccc1C=O Amb24447419 [0,1,1,0,0,0|1,0,1]=4 3382 B11R1.265 COc1c(N)cccc1CO Amb27244689 [0,1,1,0,0,0|1,0,1]=4 3383 B11R1.265 COc1c(O)cccc1C=O Amb33544321 [0,1,1,0,0,0|1,0,1]=4 3384 B11R1.265 COc1c(O)cccc1CO Amb25340477 [0,1,1,0,0,0|1,0,1]=4 3385 B11R1.265 COc1cccc(Br)c1C=O Amb19889861 [0,1,1,0,0,0|1,0,1]=4 3386 B11R1.265 COc1cccc(Br)c1CO Amb22737590 [0,1,1,0,0,0|1,0,1]=4 3387 B11R1.265 COc1cccc(C)c1C=O Amb6760023 [0,1,1,0,0,0|1,0,1]=4 3388 B11R1.265 COc1cccc(C)c1CO Amb22500689 [0,1,1,0,0,0|1,0,1]=4 3389 B11R1.265 COc1cccc(Cl)c1C=O Amb6717808 [0,1,1,0,0,0|1,0,1]=4 3390 B11R1.265 COc1cccc(Cl)c1CO Amb7776033 [0,1,1,0,0,0|1,0,1]=4 3391 B11R1.265 COc1cccc(F)c1C=O Amb2404871 [0,1,1,0,0,0|1,0,1]=4 3392 B11R1.265 COc1cccc(F)c1CO Amb6298051 [0,1,1,0,0,0|1,0,1]=4 3393 B11R1.265 COc1cccc(I)c1CO Amb20248940 [0,1,1,0,0,0|1,0,1]=4 3394 B11R1.265 COc1cccc(N)c1CO Amb22751283 [0,1,1,0,0,0|1,0,1]=4 3395 B11R1.265 COc1cccc(O)c1C=O Amb5717413 [0,1,1,0,0,0|1,0,1]=4 3396 B11R1.265 COc1cccc(O)c1CO Amb6297620 [0,1,1,0,0,0|1,0,1]=4 3397 B11R1.265 [*]Oc1cccc(Br)c1C=O Amb33716480 [0,1,1,0,0,0|1,0,1]=4 3398 B11R1.199 Cc1nocc1C(=O)\C=C\Cl Amb29880233 [0,1,1,0,0,0|2,0,0]=4 3399 B11R1.465 Cc1noc(C)c1\C=C\C=O Amb33429274 [0,1,1,0,0,0|2,0,0]=4 3400 B11R1.87 CC(C)(O)c1ccccc1O Amb2618567 [0,1,1,0,0,0|1,0,1]=4 3401 B11R1.87 CS(=N)(=O)c1ccccc1O Amb26880558 [0,1,1,0,0,0|1,0,1]=4 3402 B11R1.87 O=S(=O)(O)c1ccccc1O Amb17594378 [0,1,1,0,0,0|2,0,0]=4 3403 B11R1.156 C=C(C)c1c(C)cccc1O Amb27823429 [0,1,1,0,0,0|2,0,0]=4 3404 B11R1.156 CC(=N)C1=C(O)C=CNC1=O Amb27413572 [0,1,1,0,0,0|2,0,0]=4 3405 B11R1.156 CC(=O)c1c(C)cccc1O Amb18125108 [0,1,1,0,0,0|1,0,1]=4 3406 B11R1.156 CC(=O)c1c(O)cccc1Br Amb19895172 [0,1,1,0,0,0|1,0,1]=4 3407 B11R1.156 CC(=O)c1c(O)cccc1Cl Amb3428659 [0,1,1,0,0,0|1,0,1]=4 3408 B11R1.156 CC(=O)c1c(O)cccc1F Amb8397099 [0,1,1,0,0,0|1,0,1]=4 3409 B11R1.156 CC(=O)c1c(O)cccc1O Amb2609021 [0,1,1,0,0,0|1,0,1]=4 3410 B11R1.156 CC(O)c1c(O)cccc1O Amb28285078 [0,1,1,0,0,0|1,0,1]=4 3411 B11R1.156 C[C@@H](O)c1c(O)cccc1Br Amb33331569 [0,1,1,0,0,0|1,0,1]=4 3412 B11R1.156 C[C@@H](O)c1c(O)cccc1Cl Amb33261481 [0,1,1,0,0,0|1,0,1]=4 3413 B11R1.156 C[C@H](O)c1c(O)cccc1Br Amb33331572 [0,1,1,0,0,0|1,0,1]=4 3414 B11R1.156 C[C@H](O)c1c(O)cccc1Cl Amb33261482 [0,1,1,0,0,0|1,0,1]=4 3415 B11R1.156 Cc1cccc(Br)c1C(=O)O Amb6366145 [0,1,1,0,0,0|2,0,0]=4 3416 B11R1.156 Cc1cccc(Br)c1C(O)=S Amb27465547 [0,1,1,0,0,0|2,0,0]=4 3417 B11R1.156 Cc1cccc(C)c1C(=N)N Amb2695867 [0,1,1,0,0,0|2,0,0]=4 3418 B11R1.156 Cc1cccc(C)c1C(=O)O Amb2612269 [0,1,1,0,0,0|2,0,0]=4 3419 B11R1.156 Cc1cccc(C)c1C(O)=S Amb27156742 [0,1,1,0,0,0|2,0,0]=4 3420 B11R1.156 Cc1cccc(Cl)c1C(=N)N Amb2696050 [0,1,1,0,0,0|2,0,0]=4 3421 B11R1.156 Cc1cccc(Cl)c1C(=O)O Amb2686194 [0,1,1,0,0,0|2,0,0]=4 3422 B11R1.156 Cc1cccc(F)c1C(=N)N Amb33148302 [0,1,1,0,0,0|2,0,0]=4 3423 B11R1.156 Cc1cccc(F)c1C(=O)O Amb33544415 [0,1,1,0,0,0|2,0,0]=4 3424 B11R1.156 Cc1cccc(F)c1C(O)=S Amb24599765 [0,1,1,0,0,0|2,0,0]=4 3425 B11R1.156 Cc1cccc(I)c1C(=O)O Amb6297500 [0,1,1,0,0,0|2,0,0]=4 3426 B11R1.156 Cc1cccc(I)c1C(O)=S Amb25315406 [0,1,1,0,0,0|2,0,0]=4 3427 B11R1.156 Cc1cccc(N)c1C(=O)O Amb2782003 [0,1,1,0,0,0|2,0,0]=4 3428 B11R1.156 Cc1cccc(O)c1B(O)O Amb25864286 [0,1,1,0,0,0|2,0,0]=4 3429 B11R1.156 Cc1cccc(O)c1C(=N)N Amb27823137 [0,1,1,0,0,0|1,0,0]=3 3430 B11R1.156 Cc1cccc(O)c1C(=O)O Amb6298569 [0,1,1,0,0,0|1,0,0]=3 3431 B11R1.156 Cc1cccc(O)c1C(=S)S Amb28282199 [0,1,1,0,0,0|1,1,0]=4 3432 B11R1.156 Cc1cccc(O)c1C(N)=O Amb22500875 [0,1,1,0,0,0|0,0,2]=4 3433 B11R1.156 Cc1cccc(O)c1C(O)=S Amb27256635 [0,1,1,0,0,0|1,0,0]=3 3434 B11R1.156 Cc1cccc(S)c1C(=O)O Amb18126520 [0,1,1,0,0,0|1,1,0]=4 3435 B11R1.156 Cc1ccnc(O)c1C(=O)O Amb17621632 [0,1,1,0,0,0|2,0,0]=4 3436 B11R1.156 Cc1cncc(O)c1C(=O)O Amb18201191 [0,1,1,0,0,0|2,0,0]=4 3437 B11R1.156 Cc1nccc(O)c1C(=O)O Amb22491762 [0,1,1,0,0,0|2,0,0]=4 3438 B11R1.156 N=C(N)c1c(Br)cccc1Br Amb33009392 [0,1,1,0,0,0|2,0,0]=4 3439 B11R1.156 N=C(N)c1c(Cl)cccc1Cl Amb2695836 [0,1,1,0,0,0|2,0,0]=4 3440 B11R1.156 N=C(N)c1c(F)cccc1Br Amb24399820 [0,1,1,0,0,0|2,0,0]=4 3441 B11R1.156 N=C(N)c1c(F)cccc1Cl Amb2696048 [0,1,1,0,0,0|2,0,0]=4 3442 B11R1.156 N=C(N)c1c(F)cccc1Cl Amb8630161 [0,1,1,0,0,0|2,0,0]=4 3443 B11R1.156 N=C(N)c1c(F)cccc1F Amb2695832 [0,1,1,0,0,0|2,0,0]=4 3444 B11R1.156 N=C(N)c1c(O)cccc1Br Amb25049275 [0,1,1,0,0,0|1,0,0]=3 3445 B11R1.156 N=C(N)c1c(O)cccc1Cl Amb18806822 [0,1,1,0,0,0|1,0,0]=3 3446 B11R1.156 N=C(N)c1c(O)cccc1Cl Amb28719620 [0,1,1,0,0,0|1,0,0]=3 3447 B11R1.156 N=C(N)c1c(O)cccc1F Amb28719625 [0,1,1,0,0,0|1,0,0]=3 3448 B11R1.156 NC(=O)c1c(O)cccc1Br Amb25376948 [0,1,1,0,0,0|0,0,2]=4 3449 B11R1.156 NC(=O)c1c(O)cccc1Cl Amb27792106 [0,1,1,0,0,0|0,0,2]=4 3450 B11R1.156 NC(=O)c1c(O)cccc1F Amb24091708 [0,1,1,0,0,0|0,0,2]=4 3451 B11R1.156 NC(=O)c1c(O)cccc1I Amb27215330 [0,1,1,0,0,0|0,0,2]=4 3452 B11R1.156 NC(=O)c1c(O)cccc1O Amb6298857 [0,1,1,0,0,0|0,0,2]=4 3453 B11R1.156 NC(=S)c1c(O)cccc1Br Amb26616255 [0,1,1,0,0,0|0,1,1]=4 3454 B11R1.156 NC(=S)c1c(O)cccc1Cl Amb19077086 [0,1,1,0,0,0|0,1,1]=4 3455 B11R1.156 NC(=S)c1c(O)cccc1F Amb26371112 [0,1,1,0,0,0|0,1,1]=4 3456 B11R1.156 Nc1cccc(Br)c1C(=O)O Amb6308306 [0,1,1,0,0,0|2,0,0]=4 3457 B11R1.156 Nc1cccc(Cl)c1C(=O)O Amb1039017 [0,1,1,0,0,0|2,0,0]=4 3458 B11R1.156 Nc1cccc(Cl)c1C(=O)O Amb22283047 [0,1,1,0,0,0|2,0,0]=4 3459 B11R1.156 Nc1cccc(F)c1C(=O)O Amb2684411 [0,1,1,0,0,0|2,0,0]=4 3460 B11R1.156 Nc1cccc(I)c1C(=O)O Amb8629778 [0,1,1,0,0,0|2,0,0]=4 3461 B11R1.156 Nc1cccc(O)c1C(=O)O Amb18644549 [0,1,1,0,0,0|1,0,0]=3 3462 B11R1.156 Nc1cccc(S)c1C(=O)O Amb24445234 [0,1,1,0,0,0|1,1,0]=4 3463 B11R1.156 O=C(Cl)c1c(O)cccc1Br Amb28286688 [0,1,1,0,0,0|1,0,1]=4 3464 B11R1.156 O=C(Cl)c1c(O)cccc1Cl Amb24665648 [0,1,1,0,0,0|1,0,1]=4 3465 B11R1.156 O=C(O)c1c(Br)cccc1Br Amb2609567 [0,1,1,0,0,0|2,0,0]=4 3466 B11R1.156 O=C(O)c1c(Br)cccc1I Amb22228686 [0,1,1,0,0,0|2,0,0]=4 3467 B11R1.156 O=C(O)c1c(Br)ccnc1O Amb28186084 [0,1,1,0,0,0|2,0,0]=4 3468 B11R1.156 O=C(O)c1c(Cl)cccc1Br Amb2684994 [0,1,1,0,0,0|2,0,0]=4 3469 B11R1.156 O=C(O)c1c(Cl)cccc1Cl Amb535704 [0,1,1,0,0,0|2,0,0]=4 3470 B11R1.156 O=C(O)c1c(Cl)cccc1I Amb22233816 [0,1,1,0,0,0|2,0,0]=4 3471 B11R1.156 O=C(O)c1c(F)cccc1Br Amb2685188 [0,1,1,0,0,0|2,0,0]=4 3472 B11R1.156 O=C(O)c1c(F)cccc1Cl Amb2685950 [0,1,1,0,0,0|2,0,0]=4 3473 B11R1.156 O=C(O)c1c(F)cccc1F Amb534282 [0,1,1,0,0,0|2,0,0]=4 3474 B11R1.156 O=C(O)c1c(F)cccc1I Amb2688125 [0,1,1,0,0,0|2,0,0]=4 3475 B11R1.156 O=C(O)c1c(F)cccc1S Amb25045824 [0,1,1,0,0,0|1,1,0]=4 3476 B11R1.156 O=C(O)c1c(F)ccnc1O Amb26532620 [0,1,1,0,0,0|2,0,0]=4 3477 B11R1.156 O=C(O)c1c(I)cccc1I Amb26350232 [0,1,1,0,0,0|2,0,0]=4 3478 B11R1.156 O=C(O)c1c(O)cccc1Br Amb10842167 [0,1,1,0,0,0|1,0,0]=3 3479 B11R1.156 O=C(O)c1c(O)cccc1Cl Amb33531272 [0,1,1,0,0,0|1,0,0]=3 3480 B11R1.156 O=C(O)c1c(O)cccc1F Amb2688417 [0,1,1,0,0,0|1,0,0]=3 3481 B11R1.156 O=C(O)c1c(O)cccc1I Amb22737636 [0,1,1,0,0,0|1,0,0]=3 3482 B11R1.156 O=C(O)c1c(O)cccc1O Amb534793 [0,1,1,0,0,0|1,0,0]=3 3483 B11R1.156 O=C(O)c1c(O)cccc1S Amb28244781 [0,1,1,0,0,0|1,0,0]=3 3484 B11R1.156 O=C(O)c1c(O)ccnc1Br Amb10070849 [0,1,1,0,0,0|2,0,0]=4 3485 B11R1.156 O=C(O)c1c(O)cncc1F Amb25348423 [0,1,1,0,0,0|2,0,0]=4 3486 B11R1.156 O=C(O)c1c(O)cncc1O Amb27965725 [0,1,1,0,0,0|2,0,0]=4 3487 B11R1.156 O=C(O)c1c(S)cccc1Br Amb18133856 [0,1,1,0,0,0|1,1,0]=4 3488 B11R1.156 O=C(O)c1c(S)cccc1I Amb24395228 [0,1,1,0,0,0|1,1,0]=4 3489 B11R1.156 O=C(O)c1c(S)cccc1S Amb27657798 [0,1,1,0,0,0|1,1,0]=4 3490 B11R1.156 OB(O)c1c(O)cccc1Cl Amb20171151 [0,1,1,0,0,0|2,0,0]=4 3491 B11R1.156 OB(O)c1c(O)cccc1F Amb22169323 [0,1,1,0,0,0|2,0,0]=4 3492 B11R1.156 OB(O)c1c(O)cccc1O Amb10069372 [0,1,1,0,0,0|2,0,0]=4 3493 B11R1.156 [2H]c1cccc([2H])c1C(=O)O Amb22325326 [0,1,1,0,0,0|2,0,0]=4 3494 B11R1.156 [NH3+]c1cccc(F)c1C(=O)O Amb22641606 [0,1,1,0,0,0|2,0,0]=4 3495 B11R1.159 CC(=N)c1cccc(O)c1O Amb28202319 [0,1,1,0,0,0|1,0,0]=3 3496 B11R1.159 CC(=O)c1cccc(Br)c1O Amb19895168 [0,1,1,0,0,0|1,0,1]=4 3497 B11R1.159 CC(=O)c1cccc(C)c1O Amb1489192 [0,1,1,0,0,0|1,0,1]=4 3498 B11R1.159 CC(=O)c1cccc(Cl)c1O Amb844172 [0,1,1,0,0,0|1,0,1]=4 3499 B11R1.159 CC(=O)c1cccc(F)c1O Amb10603316 [0,1,1,0,0,0|1,0,1]=4 3500 B11R1.159 CC(=O)c1cccc(N)c1O Amb32653166 [0,1,1,0,0,0|1,0,1]=4 3501 B11R1.159 CC(=O)c1cccc(N)c1O Amb6297076 [0,1,1,0,0,0|1,0,1]=4 3502 B11R1.159 CC(=O)c1cccc(N)c1O Amb8391120 [0,1,1,0,0,0|1,0,1]=4 3503 B11R1.159 CC(=O)c1cccc(O)c1O Amb10603302 [0,1,1,0,0,0|1,0,1]=4 3504 B11R1.159 CC(O)c1cccc(O)c1O Amb27262937 [0,1,1,0,0,0|1,0,1]=4 3505 B11R1.159 C[C@@H](O)c1cccc(Br)c1O Amb33332168 [0,1,1,0,0,0|1,0,1]=4 3506 B11R1.159 C[C@@H](O)c1cccc(Cl)c1O Amb33223506 [0,1,1,0,0,0|1,0,1]=4 3507 B11R1.159 C[C@@H](O)c1cccc(F)c1O Amb26028488 [0,1,1,0,0,0|1,0,1]=4 3508 B11R1.159 C[C@@H](O)c1cccc(O)c1O Amb26871108 [0,1,1,0,0,0|1,0,1]=4 3509 B11R1.159 C[C@H](O)c1cccc(Br)c1O Amb33332224 [0,1,1,0,0,0|1,0,1]=4 3510 B11R1.159 C[C@H](O)c1cccc(Cl)c1O Amb33223509 [0,1,1,0,0,0|1,0,1]=4 3511 B11R1.159 C[C@H](O)c1cccc(F)c1O Amb26506408 [0,1,1,0,0,0|1,0,1]=4 3512 B11R1.159 C[C@H](O)c1cccc(O)c1O Amb25860088 [0,1,1,0,0,0|1,0,1]=4 3513 B11R1.159 Cc1c(Br)cccc1C(=N)N Amb25050579 [0,1,1,0,0,0|2,0,0]=4 3514 B11R1.159 Cc1c(Br)cccc1C(=O)O Amb2685317 [0,1,1,0,0,0|2,0,0]=4 3515 B11R1.159 Cc1c(Cl)cccc1C(=N)N Amb2696069 [0,1,1,0,0,0|2,0,0]=4 3516 B11R1.159 Cc1c(Cl)cccc1C(=O)O Amb6366012 [0,1,1,0,0,0|2,0,0]=4 3517 B11R1.159 Cc1c(Cl)cccc1C(O)=S Amb26611312 [0,1,1,0,0,0|2,0,0]=4 3518 B11R1.159 Cc1c(F)cccc1C(=N)N Amb33428035 [0,1,1,0,0,0|2,0,0]=4 3519 B11R1.159 Cc1c(F)cccc1C(=O)O Amb3940032 [0,1,1,0,0,0|2,0,0]=4 3520 B11R1.159 Cc1c(F)cccc1C(O)=S Amb27823459 [0,1,1,0,0,0|2,0,0]=4 3521 B11R1.159 Cc1c(I)cccc1C(=O)O Amb2688855 [0,1,1,0,0,0|2,0,0]=4 3522 B11R1.159 Cc1c(N)cccc1C(=O)O Amb3618855 [0,1,1,0,0,0|2,0,0]=4 3523 B11R1.159 Cc1c(N)cccc1C(O)=S Amb25863584 [0,1,1,0,0,0|2,0,0]=4 3524 B11R1.159 Cc1c(O)cccc1C(=N)N Amb27839931 [0,1,1,0,0,0|2,0,0]=4 3525 B11R1.159 Cc1c(O)cccc1C(=O)O Amb8384204 [0,1,1,0,0,0|2,0,0]=4 3526 B11R1.159 Cc1c(O)cccc1C(O)=S Amb25359964 [0,1,1,0,0,0|2,0,0]=4 3527 B11R1.159 Cc1c(S)cccc1C(=O)O Amb24487895 [0,1,1,0,0,0|2,0,0]=4 3528 B11R1.159 Cc1cccc(B(O)O)c1O Amb13890334 [0,1,1,0,0,0|2,0,0]=4 3529 B11R1.159 Cc1cccc(C(=N)N)c1C Amb2696679 [0,1,1,0,0,0|2,0,0]=4 3530 B11R1.159 Cc1cccc(C(=N)N)c1Cl Amb24376129 [0,1,1,0,0,0|2,0,0]=4 3531 B11R1.159 Cc1cccc(C(=N)N)c1F Amb24733596 [0,1,1,0,0,0|2,0,0]=4 3532 B11R1.159 Cc1cccc(C(=O)O)c1Br Amb2685314 [0,1,1,0,0,0|2,0,0]=4 3533 B11R1.159 Cc1cccc(C(=O)O)c1C Amb1207390 [0,1,1,0,0,0|2,0,0]=4 3534 B11R1.159 Cc1cccc(C(=O)O)c1Cl Amb2686192 [0,1,1,0,0,0|2,0,0]=4 3535 B11R1.159 Cc1cccc(C(=O)O)c1F Amb2735902 [0,1,1,0,0,0|2,0,0]=4 3536 B11R1.159 Cc1cccc(C(=O)O)c1I Amb1129052 [0,1,1,0,0,0|2,0,0]=4 3537 B11R1.159 Cc1cccc(C(=O)O)c1N Amb6358183 [0,1,1,0,0,0|2,0,0]=4 3538 B11R1.159 Cc1cccc(C(=O)O)c1O Amb6355878 [0,1,1,0,0,0|1,0,0]=3 3539 B11R1.159 Cc1cccc(C(=O)O)c1S Amb18126519 [0,1,1,0,0,0|1,1,0]=4 3540 B11R1.159 Cc1cccc(C(=O)[O-])c1O Amb10067431 [0,1,1,0,0,0|1,0,1]=4 3541 B11R1.159 Cc1cccc(C(N)=O)c1O Amb6671846 [0,1,1,0,0,0|0,0,2]=4 3542 B11R1.159 Cc1cccc(C(N)=S)c1O Amb27248667 [0,1,1,0,0,0|0,1,1]=4 3543 B11R1.159 Cc1cccc(C(O)=S)c1C Amb27663349 [0,1,1,0,0,0|2,0,0]=4 3544 B11R1.159 Cc1ccnc(C(=O)O)c1O Amb25359831 [0,1,1,0,0,0|2,0,0]=4 3545 B11R1.159 Cc1ccnc(C(=O)O)c1O Amb32671475 [0,1,1,0,0,0|2,0,0]=4 3546 B11R1.159 Cc1nccc(C(=O)O)c1O Amb18125511 [0,1,1,0,0,0|2,0,0]=4 3547 B11R1.159 Cc1nccc(C(=O)O)c1O Amb35788655 [0,1,1,0,0,0|2,0,0]=4 3548 B11R1.159 N=C(N)c1cccc(Br)c1F Amb24483934 [0,1,1,0,0,0|2,0,0]=4 3549 B11R1.159 N=C(N)c1cccc(Br)c1O Amb33484748 [0,1,1,0,0,0|1,0,0]=3 3550 B11R1.159 N=C(N)c1cccc(Cl)c1Cl Amb2699605 [0,1,1,0,0,0|2,0,0]=4 3551 B11R1.159 N=C(N)c1cccc(Cl)c1Cl Amb8834129 [0,1,1,0,0,0|2,0,0]=4 3552 B11R1.159 N=C(N)c1cccc(Cl)c1F Amb25332732 [0,1,1,0,0,0|2,0,0]=4 3553 B11R1.159 N=C(N)c1cccc(Cl)c1O Amb33057242 [0,1,1,0,0,0|1,0,0]=3 3554 B11R1.159 N=C(N)c1cccc(F)c1Br Amb26073883 [0,1,1,0,0,0|2,0,0]=4 3555 B11R1.159 N=C(N)c1cccc(F)c1F Amb2695834 [0,1,1,0,0,0|2,0,0]=4 3556 B11R1.159 N=C(N)c1cccc(F)c1O Amb24102155 [0,1,1,0,0,0|1,0,0]=3 3557 B11R1.159 N=C(N)c1cccc(O)c1Br Amb33386915 [0,1,1,0,0,0|2,0,0]=4 3558 B11R1.159 N=C(N)c1cccc(O)c1O Amb24355333 [0,1,1,0,0,0|1,0,0]=3 3559 B11R1.159 N=C1C=CC=C(C(=O)O)C1=N Amb27849034 [0,1,1,0,0,0|2,0,0]=4 3560 B11R1.159 NC(=O)c1cccc(Br)c1O Amb22501164 [0,1,1,0,0,0|0,0,2]=4 3561 B11R1.159 NC(=O)c1cccc(Cl)c1O Amb25173632 [0,1,1,0,0,0|0,0,2]=4 3562 B11R1.159 NC(=O)c1cccc(I)c1O Amb27600668 [0,1,1,0,0,0|0,0,2]=4 3563 B11R1.159 NC(=O)c1cccc(O)c1O Amb25783945 [0,1,1,0,0,0|0,0,2]=4 3564 B11R1.159 NC(=S)c1cccc(Br)c1O Amb25352519 [0,1,1,0,0,0|0,1,1]=4 3565 B11R1.159 NC(=S)c1cccc(Cl)c1O Amb26372322 [0,1,1,0,0,0|0,1,1]=4 3566 B11R1.159 NC(=S)c1cccc(F)c1O Amb24472603 [0,1,1,0,0,0|0,1,1]=4 3567 B11R1.159 NC(=S)c1cccc(N)c1O Amb25267281 [0,1,1,0,0,0|0,1,1]=4 3568 B11R1.159 NC(=S)c1cccc(O)c1O Amb24591199 [0,1,1,0,0,0|0,1,1]=4 3569 B11R1.159 Nc1c(Br)cccc1C(=O)O Amb2724966 [0,1,1,0,0,0|2,0,0]=4 3570 B11R1.159 Nc1c(Cl)cccc1C(=O)O Amb1223239 [0,1,1,0,0,0|2,0,0]=4 3571 B11R1.159 Nc1c(F)cccc1C(=O)O Amb2608596 [0,1,1,0,0,0|2,0,0]=4 3572 B11R1.159 Nc1c(I)cccc1C(=O)O Amb7784298 [0,1,1,0,0,0|2,0,0]=4 3573 B11R1.159 Nc1c(O)cccc1C(=O)O Amb4418489 [0,1,1,0,0,0|2,0,0]=4 3574 B11R1.159 Nc1c(O)cccc1C(=O)O Amb6296629 [0,1,1,0,0,0|2,0,0]=4 3575 B11R1.159 Nc1c(S)cccc1C(=O)O Amb18938265 [0,1,1,0,0,0|2,0,0]=4 3576 B11R1.159 Nc1cccc(C(=O)O)c1Br Amb10842077 [0,1,1,0,0,0|2,0,0]=4 3577 B11R1.159 Nc1cccc(C(=O)O)c1Cl Amb6296789 [0,1,1,0,0,0|2,0,0]=4 3578 B11R1.159 Nc1cccc(C(=O)O)c1F Amb6298253 [0,1,1,0,0,0|2,0,0]=4 3579 B11R1.159 Nc1cccc(C(=O)O)c1I Amb10842076 [0,1,1,0,0,0|2,0,0]=4 3580 B11R1.159 Nc1cccc(C(=O)O)c1N Amb1094141 [0,1,1,0,0,0|2,0,0]=4 3581 B11R1.159 Nc1cccc(C(=O)O)c1N Amb22283993 [0,1,1,0,0,0|2,0,0]=4 3582 B11R1.159 Nc1cccc(C(=O)O)c1O Amb1043752 [0,1,1,0,0,0|1,0,0]=3 3583 B11R1.159 Nc1cccc(C(=O)O)c1S Amb24710021 [0,1,1,0,0,0|1,1,0]=4 3584 B11R1.159 Nc1ccnc(C(=O)O)c1O Amb27186184 [0,1,1,0,0,0|2,0,0]=4 3585 B11R1.159 O=C(Cl)c1cccc(Br)c1O Amb27230332 [0,1,1,0,0,0|1,0,1]=4 3586 B11R1.159 O=C(O)C1=C(O)C(=O)C=CO1 Amb27400361 [0,1,1,0,0,0|2,0,0]=4 3587 B11R1.159 O=C(O)C1=C(O)C(=O)NC=C1 Amb18200553 [0,1,1,0,0,0|2,0,0]=4 3588 B11R1.159 O=C(O)C1=CC=CC(=O)N1O Amb19959009 [0,1,1,0,0,0|2,0,0]=4 3589 B11R1.159 O=C(O)C1=CC=CC(=S)N1O Amb28124200 [0,1,1,0,0,0|2,0,0]=4 3590 B11R1.159 O=C(O)c1cccc(=O)n1O Amb22227966 [0,1,1,0,0,0|2,0,0]=4 3591 B11R1.159 O=C(O)c1cccc(Br)c1Br Amb22228260 [0,1,1,0,0,0|2,0,0]=4 3592 B11R1.159 O=C(O)c1cccc(Br)c1Cl Amb16231626 [0,1,1,0,0,0|2,0,0]=4 3593 B11R1.159 O=C(O)c1cccc(Br)c1F Amb2685189 [0,1,1,0,0,0|2,0,0]=4 3594 B11R1.159 O=C(O)c1cccc(Br)c1I Amb20634419 [0,1,1,0,0,0|2,0,0]=4 3595 B11R1.159 O=C(O)c1cccc(Br)c1O Amb6298168 [0,1,1,0,0,0|1,0,0]=3 3596 B11R1.159 O=C(O)c1cccc(Cl)c1Br Amb19888103 [0,1,1,0,0,0|2,0,0]=4 3597 B11R1.159 O=C(O)c1cccc(Cl)c1Cl Amb1207372 [0,1,1,0,0,0|2,0,0]=4 3598 B11R1.159 O=C(O)c1cccc(Cl)c1F Amb2447457 [0,1,1,0,0,0|2,0,0]=4 3599 B11R1.159 O=C(O)c1cccc(Cl)c1I Amb20076024 [0,1,1,0,0,0|2,0,0]=4 3600 B11R1.159 O=C(O)c1cccc(Cl)c1O Amb7764649 [0,1,1,0,0,0|1,0,0]=3 3601 B11R1.159 O=C(O)c1cccc(Cl)c1S Amb18650043 [0,1,1,0,0,0|1,1,0]=4 3602 B11R1.159 O=C(O)c1cccc(F)c1Br Amb2685187 [0,1,1,0,0,0|2,0,0]=4 3603 B11R1.159 O=C(O)c1cccc(F)c1Cl Amb2685947 [0,1,1,0,0,0|2,0,0]=4 3604 B11R1.159 O=C(O)c1cccc(F)c1F Amb2687070 [0,1,1,0,0,0|2,0,0]=4 3605 B11R1.159 O=C(O)c1cccc(F)c1I Amb8397074 [0,1,1,0,0,0|2,0,0]=4 3606 B11R1.159 O=C(O)c1cccc(F)c1O Amb33528918 [0,1,1,0,0,0|1,0,0]=3 3607 B11R1.159 O=C(O)c1cccc(F)c1S Amb18947820 [0,1,1,0,0,0|1,1,0]=4 3608 B11R1.159 O=C(O)c1cccc(I)c1Br Amb10976054 [0,1,1,0,0,0|2,0,0]=4 3609 B11R1.159 O=C(O)c1cccc(I)c1Cl Amb22166862 [0,1,1,0,0,0|2,0,0]=4 3610 B11R1.159 O=C(O)c1cccc(I)c1F Amb8628761 [0,1,1,0,0,0|2,0,0]=4 3611 B11R1.159 O=C(O)c1cccc(I)c1I Amb25733022 [0,1,1,0,0,0|2,0,0]=4 3612 B11R1.159 O=C(O)c1cccc(I)c1O Amb25890548 [0,1,1,0,0,0|1,0,0]=3 3613 B11R1.159 O=C(O)c1cccc(O)c1Br Amb18171413 [0,1,1,0,0,0|2,0,0]=4 3614 B11R1.159 O=C(O)c1cccc(O)c1Cl Amb22001548 [0,1,1,0,0,0|2,0,0]=4 3615 B11R1.159 O=C(O)c1cccc(O)c1F Amb2697884 [0,1,1,0,0,0|2,0,0]=4 3616 B11R1.159 O=C(O)c1cccc(O)c1I Amb25890501 [0,1,1,0,0,0|2,0,0]=4 3617 B11R1.159 O=C(O)c1cccc(O)c1O Amb2721163 [0,1,1,0,0,0|1,0,0]=3 3618 B11R1.159 O=C(O)c1cccc(O)c1S Amb25920759 [0,1,1,0,0,0|1,1,0]=4 3619 B11R1.159 O=C(O)c1cccc(S)c1Br Amb28284809 [0,1,1,0,0,0|2,0,0]=4 3620 B11R1.159 O=C(O)c1cccc(S)c1Cl Amb24334625 [0,1,1,0,0,0|2,0,0]=4 3621 B11R1.159 O=C(O)c1cccc(S)c1F Amb26480110 [0,1,1,0,0,0|2,0,0]=4 3622 B11R1.159 O=C(O)c1cccc(S)c1I Amb26470770 [0,1,1,0,0,0|2,0,0]=4 3623 B11R1.159 O=C(O)c1cccc(S)c1O Amb18647320 [0,1,1,0,0,0|1,0,0]=3 3624 B11R1.159 O=C(O)c1cccc(S)c1S Amb27878723 [0,1,1,0,0,0|1,1,0]=4 3625 B11R1.159 O=C(O)c1ccnc(Br)c1O Amb27606297 [0,1,1,0,0,0|2,0,0]=4 3626 B11R1.159 O=C(O)c1ccnc(Cl)c1O Amb33542977 [0,1,1,0,0,0|2,0,0]=4 3627 B11R1.159 O=C(O)c1cncc(Br)c1O Amb19958699 [0,1,1,0,0,0|2,0,0]=4 3628 B11R1.159 O=C(O)c1cncc(F)c1O Amb24099314 [0,1,1,0,0,0|2,0,0]=4 3629 B11R1.159 O=C(O)c1nccc(Br)c1O Amb27617463 [0,1,1,0,0,0|2,0,0]=4 3630 B11R1.159 O=C(O)c1nccc(Br)c1O Amb35749343 [0,1,1,0,0,0|2,0,0]=4 3631 B11R1.159 O=C(O)c1nccc(Cl)c1O Amb22057869 [0,1,1,0,0,0|2,0,0]=4 3632 B11R1.159 O=C(O)c1nccc(F)c1O Amb25352096 [0,1,1,0,0,0|2,0,0]=4 3633 B11R1.159 O=C(O)c1nccc(O)c1O Amb24740856 [0,1,1,0,0,0|2,0,0]=4 3634 B11R1.159 OB(O)c1cccc(Br)c1O Amb13890452 [0,1,1,0,0,0|2,0,0]=4 3635 B11R1.159 OB(O)c1cccc(Cl)c1O Amb13890335 [0,1,1,0,0,0|2,0,0]=4 3636 B11R1.159 OB(O)c1cccc(F)c1O Amb10841161 [0,1,1,0,0,0|2,0,0]=4 3637 B11R1.159 [NH3+]c1cccc(C(=O)O)c1O Amb22641593 [0,1,1,0,0,0|1,0,0]=3 3638 B11R1.166 CC(=N)c1ccc(F)cc1O Amb27978693 [0,1,1,0,0,0|1,0,0]=3 3639 B11R1.166 CC(=N)c1ccc(O)cc1O Amb17593763 [0,1,1,0,0,0|1,0,0]=3 3640 B11R1.166 CC(=O)c1ccc(Br)cc1O Amb2508446 [0,1,1,0,0,0|1,0,1]=4 3641 B11R1.166 CC(=O)c1ccc(C)cc1O Amb1673131 [0,1,1,0,0,0|1,0,1]=4 3642 B11R1.166 CC(=O)c1ccc(Cl)cc1O Amb2612557 [0,1,1,0,0,0|1,0,1]=4 3643 B11R1.166 CC(=O)c1ccc(F)cc1O Amb2688103 [0,1,1,0,0,0|1,0,1]=4 3644 B11R1.166 CC(=O)c1ccc(I)cc1O Amb22001987 [0,1,1,0,0,0|1,0,1]=4 3645 B11R1.166 CC(=O)c1ccc(N)cc1O Amb2722861 [0,1,1,0,0,0|1,0,1]=4 3646 B11R1.166 CC(=O)c1ccc(O)cc1O Amb1811488 [0,1,1,0,0,0|1,0,1]=4 3647 B11R1.166 CC(O)c1ccc(Br)cc1O Amb28245627 [0,1,1,0,0,0|1,0,1]=4 3648 B11R1.166 CC(O)c1ccc(F)cc1O Amb18787618 [0,1,1,0,0,0|1,0,1]=4 3649 B11R1.166 C[C@@H](O)c1ccc(Br)cc1O Amb28382506 [0,1,1,0,0,0|1,0,1]=4 3650 B11R1.166 C[C@@H](O)c1ccc(Cl)cc1O Amb33260088 [0,1,1,0,0,0|1,0,1]=4 3651 B11R1.166 C[C@@H](O)c1ccc(F)cc1O Amb27652018 [0,1,1,0,0,0|1,0,1]=4 3652 B11R1.166 C[C@@H](O)c1ccc(O)cc1O Amb26080876 [0,1,1,0,0,0|1,0,1]=4 3653 B11R1.166 C[C@H](O)c1ccc(Br)cc1O Amb28045924 [0,1,1,0,0,0|1,0,1]=4 3654 B11R1.166 C[C@H](O)c1ccc(Cl)cc1O Amb33260091 [0,1,1,0,0,0|1,0,1]=4 3655 B11R1.166 C[C@H](O)c1ccc(F)cc1O Amb28185439 [0,1,1,0,0,0|1,0,1]=4 3656 B11R1.166 C[C@H](O)c1ccc(O)cc1O Amb24485881 [0,1,1,0,0,0|1,0,1]=4 3657 B11R1.166 Cc1cc(Br)ccc1C(=N)N Amb10066931 [0,1,1,0,0,0|2,0,0]=4 3658 B11R1.166 Cc1cc(Br)ccc1C(=N)N Amb2695979 [0,1,1,0,0,0|2,0,0]=4 3659 B11R1.166 Cc1cc(Br)ccc1C(=O)O Amb3939977 [0,1,1,0,0,0|2,0,0]=4 3660 B11R1.166 Cc1cc(Cl)ccc1C(=N)N Amb2696071 [0,1,1,0,0,0|2,0,0]=4 3661 B11R1.166 Cc1cc(Cl)ccc1C(=O)O Amb2686195 [0,1,1,0,0,0|2,0,0]=4 3662 B11R1.166 Cc1cc(Cl)ccc1C(O)=S Amb26484370 [0,1,1,0,0,0|2,0,0]=4 3663 B11R1.166 Cc1cc(F)ccc1C(=N)N Amb26961128 [0,1,1,0,0,0|2,0,0]=4 3664 B11R1.166 Cc1cc(F)ccc1C(=O)O Amb8393513 [0,1,1,0,0,0|2,0,0]=4 3665 B11R1.166 Cc1cc(F)ccc1C(O)=S Amb24701278 [0,1,1,0,0,0|2,0,0]=4 3666 B11R1.166 Cc1cc(I)ccc1C(=O)O Amb22756850 [0,1,1,0,0,0|2,0,0]=4 3667 B11R1.166 Cc1cc(I)ccc1C(O)=S Amb27785720 [0,1,1,0,0,0|2,0,0]=4 3668 B11R1.166 Cc1cc(N)ccc1C(=O)O Amb8439105 [0,1,1,0,0,0|2,0,0]=4 3669 B11R1.166 Cc1cc(N)ccc1C(O)=S Amb26396181 [0,1,1,0,0,0|2,0,0]=4 3670 B11R1.166 Cc1cc(O)c(C(=N)N)cn1 Amb27787119 [0,1,1,0,0,0|2,0,0]=4 3671 B11R1.166 Cc1cc(O)c(C(=O)O)cn1 Amb8390913 [0,1,1,0,0,0|2,0,0]=4 3672 B11R1.166 Cc1cc(O)ccc1C(=N)N Amb27781547 [0,1,1,0,0,0|2,0,0]=4 3673 B11R1.166 Cc1cc(O)ccc1C(=O)O Amb6297546 [0,1,1,0,0,0|2,0,0]=4 3674 B11R1.166 Cc1cc(O)ccc1C(O)=S Amb28118695 [0,1,1,0,0,0|2,0,0]=4 3675 B11R1.166 Cc1cc(S)ccc1C(=O)O Amb25884179 [0,1,1,0,0,0|2,0,0]=4 3676 B11R1.166 Cc1ccc(B(O)O)c(O)c1 Amb22275951 [0,1,1,0,0,0|2,0,0]=4 3677 B11R1.166 Cc1ccc(C(=N)N)c(Br)c1 Amb26508703 [0,1,1,0,0,0|2,0,0]=4 3678 B11R1.166 Cc1ccc(C(=N)N)c(C)c1 Amb2695865 [0,1,1,0,0,0|2,0,0]=4 3679 B11R1.166 Cc1ccc(C(=N)N)c(Cl)c1 Amb22831355 [0,1,1,0,0,0|2,0,0]=4 3680 B11R1.166 Cc1ccc(C(=N)N)c(F)c1 Amb33322862 [0,1,1,0,0,0|2,0,0]=4 3681 B11R1.166 Cc1ccc(C(=N)N)c(N)c1 Amb28397661 [0,1,1,0,0,0|2,0,0]=4 3682 B11R1.166 Cc1ccc(C(=N)N)c(O)c1 Amb18796633 [0,1,1,0,0,0|1,0,0]=3 3683 B11R1.166 Cc1ccc(C(=O)Cl)c(O)c1 Amb6743396 [0,1,1,0,0,0|1,0,1]=4 3684 B11R1.166 Cc1ccc(C(=O)O)c(Br)c1 Amb2685315 [0,1,1,0,0,0|2,0,0]=4 3685 B11R1.166 Cc1ccc(C(=O)O)c(C)c1 Amb3940029 [0,1,1,0,0,0|2,0,0]=4 3686 B11R1.166 Cc1ccc(C(=O)O)c(Cl)c1 Amb10071244 [0,1,1,0,0,0|2,0,0]=4 3687 B11R1.166 Cc1ccc(C(=O)O)c(F)c1 Amb8396213 [0,1,1,0,0,0|2,0,0]=4 3688 B11R1.166 Cc1ccc(C(=O)O)c(I)c1 Amb4451333 [0,1,1,0,0,0|2,0,0]=4 3689 B11R1.166 Cc1ccc(C(=O)O)c(N)c1 Amb2726205 [0,1,1,0,0,0|2,0,0]=4 3690 B11R1.166 Cc1ccc(C(=O)O)c(N)c1 Amb32665268 [0,1,1,0,0,0|2,0,0]=4 3691 B11R1.166 Cc1ccc(C(=O)O)c(O)c1 Amb2691963 [0,1,1,0,0,0|1,0,0]=3 3692 B11R1.166 Cc1ccc(C(=O)O)c(O)n1 Amb2725657 [0,1,1,0,0,0|2,0,0]=4 3693 B11R1.166 Cc1ccc(C(=O)O)c(S)c1 Amb18948052 [0,1,1,0,0,0|1,1,0]=4 3694 B11R1.166 Cc1ccc(C(=O)O)c([O-])c1 Amb8466413 [0,1,1,0,0,0|1,0,1]=4 3695 B11R1.166 Cc1ccc(C(N)=O)c(O)c1 Amb1230548 [0,1,1,0,0,0|0,0,2]=4 3696 B11R1.166 Cc1ccc(C(N)=S)c(O)c1 Amb18182648 [0,1,1,0,0,0|0,1,1]=4 3697 B11R1.166 Cc1ccc(C(O)=S)c(C)c1 Amb27476311 [0,1,1,0,0,0|2,0,0]=4 3698 B11R1.166 Cc1ccc([C@@H](C)O)c(O)c1 Amb25135778 [0,1,1,0,0,0|1,0,1]=4 3699 B11R1.166 Cc1ccc([C@H](C)O)c(O)c1 Amb25191267 [0,1,1,0,0,0|1,0,1]=4 3700 B11R1.166 Cc1cnc(C(=O)O)c(O)c1 Amb23400039 [0,1,1,0,0,0|2,0,0]=4 3701 B11R1.166 Cc1cnc(C(=O)O)c(O)c1 Amb28872322 [0,1,1,0,0,0|2,0,0]=4 3702 B11R1.166 N=C(N)c1ccc(Br)cc1Br Amb33432326 [0,1,1,0,0,0|2,0,0]=4 3703 B11R1.166 N=C(N)c1ccc(Br)cc1Cl Amb26974335 [0,1,1,0,0,0|2,0,0]=4 3704 B11R1.166 N=C(N)c1ccc(Br)cc1F Amb22497715 [0,1,1,0,0,0|2,0,0]=4 3705 B11R1.166 N=C(N)c1ccc(Br)cc1F Amb23116938 [0,1,1,0,0,0|2,0,0]=4 3706 B11R1.166 N=C(N)c1ccc(Br)cc1O Amb24486140 [0,1,1,0,0,0|1,0,0]=3 3707 B11R1.166 N=C(N)c1ccc(Cl)cc1Br Amb25370593 [0,1,1,0,0,0|2,0,0]=4 3708 B11R1.166 N=C(N)c1ccc(Cl)cc1Cl Amb2699604 [0,1,1,0,0,0|2,0,0]=4 3709 B11R1.166 N=C(N)c1ccc(Cl)cc1Cl Amb9210512 [0,1,1,0,0,0|2,0,0]=4 3710 B11R1.166 N=C(N)c1ccc(Cl)cc1F Amb21937169 [0,1,1,0,0,0|2,0,0]=4 3711 B11R1.166 N=C(N)c1ccc(Cl)cc1F Amb22394985 [0,1,1,0,0,0|2,0,0]=4 3712 B11R1.166 N=C(N)c1ccc(Cl)cc1O Amb18177963 [0,1,1,0,0,0|1,0,0]=3 3713 B11R1.166 N=C(N)c1ccc(Cl)cc1O Amb28719622 [0,1,1,0,0,0|1,0,0]=3 3714 B11R1.166 N=C(N)c1ccc(F)cc1Br Amb26365325 [0,1,1,0,0,0|2,0,0]=4 3715 B11R1.166 N=C(N)c1ccc(F)cc1Cl Amb2696058 [0,1,1,0,0,0|2,0,0]=4 3716 B11R1.166 N=C(N)c1ccc(F)cc1F Amb2695840 [0,1,1,0,0,0|2,0,0]=4 3717 B11R1.166 N=C(N)c1ccc(F)cc1F Amb8630146 [0,1,1,0,0,0|2,0,0]=4 3718 B11R1.166 N=C(N)c1ccc(N)cc1Cl Amb18280804 [0,1,1,0,0,0|2,0,0]=4 3719 B11R1.166 N=C(N)c1ccc(O)cc1Cl Amb18177962 [0,1,1,0,0,0|2,0,0]=4 3720 B11R1.166 N=C(N)c1ccc(O)cc1F Amb2696599 [0,1,1,0,0,0|2,0,0]=4 3721 B11R1.166 N=C(N)c1ccc(O)cc1O Amb24101693 [0,1,1,0,0,0|1,0,0]=3 3722 B11R1.166 NC(=O)c1ccc(Br)cc1O Amb24065862 [0,1,1,0,0,0|0,0,2]=4 3723 B11R1.166 NC(=O)c1ccc(Cl)cc1O Amb6671844 [0,1,1,0,0,0|0,0,2]=4 3724 B11R1.166 NC(=O)c1ccc(N)cc1O Amb22235499 [0,1,1,0,0,0|0,0,2]=4 3725 B11R1.166 NC(=O)c1ccc(O)cc1O Amb6297903 [0,1,1,0,0,0|0,0,2]=4 3726 B11R1.166 NC(=S)c1ccc(Br)cc1O Amb27409749 [0,1,1,0,0,0|0,1,1]=4 3727 B11R1.166 NC(=S)c1ccc(Cl)cc1O Amb18317727 [0,1,1,0,0,0|0,1,1]=4 3728 B11R1.166 NC(=S)c1ccc(O)cc1O Amb1119614 [0,1,1,0,0,0|0,1,1]=4 3729 B11R1.166 Nc1cc(Br)ccc1C(=O)O Amb6296449 [0,1,1,0,0,0|2,0,0]=4 3730 B11R1.166 Nc1cc(Cl)ccc1C(=O)O Amb2684369 [0,1,1,0,0,0|2,0,0]=4 3731 B11R1.166 Nc1cc(F)ccc1C(=O)O Amb1229908 [0,1,1,0,0,0|2,0,0]=4 3732 B11R1.166 Nc1cc(F)ccc1C(=O)O Amb22234003 [0,1,1,0,0,0|2,0,0]=4 3733 B11R1.166 Nc1cc(I)ccc1C(=O)O Amb8629779 [0,1,1,0,0,0|2,0,0]=4 3734 B11R1.166 Nc1cc(O)ccc1C(=O)O Amb18125508 [0,1,1,0,0,0|2,0,0]=4 3735 B11R1.166 Nc1ccc(B(O)O)c(O)c1 Amb27617446 [0,1,1,0,0,0|2,0,0]=4 3736 B11R1.166 Nc1ccc(C(=O)O)c(Br)c1 Amb18657903 [0,1,1,0,0,0|2,0,0]=4 3737 B11R1.166 Nc1ccc(C(=O)O)c(Br)c1 Amb33527621 [0,1,1,0,0,0|2,0,0]=4 3738 B11R1.166 Nc1ccc(C(=O)O)c(Cl)c1 Amb10631465 [0,1,1,0,0,0|2,0,0]=4 3739 B11R1.166 Nc1ccc(C(=O)O)c(Cl)c1 Amb845544 [0,1,1,0,0,0|2,0,0]=4 3740 B11R1.166 Nc1ccc(C(=O)O)c(F)c1 Amb3427847 [0,1,1,0,0,0|2,0,0]=4 3741 B11R1.166 Nc1ccc(C(=O)O)c(I)c1 Amb13953193 [0,1,1,0,0,0|2,0,0]=4 3742 B11R1.166 Nc1ccc(C(=O)O)c(N)c1 Amb18944997 [0,1,1,0,0,0|2,0,0]=4 3743 B11R1.166 Nc1ccc(C(=O)O)c(N)c1 Amb6297656 [0,1,1,0,0,0|2,0,0]=4 3744 B11R1.166 Nc1ccc(C(=O)O)c(O)c1 Amb1215242 [0,1,1,0,0,0|1,0,0]=3 3745 B11R1.166 Nc1ccc(C(=O)O)c(O)n1 Amb25794144 [0,1,1,0,0,0|2,0,0]=4 3746 B11R1.166 Nc1ccc(C(=O)O)c(S)c1 Amb22330588 [0,1,1,0,0,0|1,1,0]=4 3747 B11R1.166 Nc1ccc(C(=O)[O-])c(O)c1 Amb3940936 [0,1,1,0,0,0|1,0,1]=4 3748 B11R1.166 Nc1cnc(C(=O)O)c(O)c1 Amb27984701 [0,1,1,0,0,0|2,0,0]=4 3749 B11R1.166 O=C(Cl)c1ccc(Br)cc1O Amb25921428 [0,1,1,0,0,0|1,0,1]=4 3750 B11R1.166 O=C(Cl)c1ccc(Cl)cc1O Amb6743392 [0,1,1,0,0,0|1,0,1]=4 3751 B11R1.166 O=C(O)c1ccc(Br)cc1Br Amb10069353 [0,1,1,0,0,0|2,0,0]=4 3752 B11R1.166 O=C(O)c1ccc(Br)cc1Cl Amb3939978 [0,1,1,0,0,0|2,0,0]=4 3753 B11R1.166 O=C(O)c1ccc(Br)cc1F Amb1229903 [0,1,1,0,0,0|2,0,0]=4 3754 B11R1.166 O=C(O)c1ccc(Br)cc1I Amb16231633 [0,1,1,0,0,0|2,0,0]=4 3755 B11R1.166 O=C(O)c1ccc(Br)cc1O Amb33528931 [0,1,1,0,0,0|1,0,0]=3 3756 B11R1.166 O=C(O)c1ccc(Br)cc1S Amb20622936 [0,1,1,0,0,0|1,1,0]=4 3757 B11R1.166 O=C(O)c1ccc(Br)nc1O Amb26849872 [0,1,1,0,0,0|2,0,0]=4 3758 B11R1.166 O=C(O)c1ccc(Cl)cc1Br Amb2684993 [0,1,1,0,0,0|2,0,0]=4 3759 B11R1.166 O=C(O)c1ccc(Cl)cc1Cl Amb1933216 [0,1,1,0,0,0|2,0,0]=4 3760 B11R1.166 O=C(O)c1ccc(Cl)cc1F Amb1228486 [0,1,1,0,0,0|2,0,0]=4 3761 B11R1.166 O=C(O)c1ccc(Cl)cc1I Amb1125469 [0,1,1,0,0,0|2,0,0]=4 3762 B11R1.166 O=C(O)c1ccc(Cl)cc1O Amb3940316 [0,1,1,0,0,0|1,0,0]=3 3763 B11R1.166 O=C(O)c1ccc(Cl)cc1S Amb18280981 [0,1,1,0,0,0|1,1,0]=4 3764 B11R1.166 O=C(O)c1ccc(Cl)nc1O Amb21856158 [0,1,1,0,0,0|2,0,0]=4 3765 B11R1.166 O=C(O)c1ccc(F)cc1Br Amb1228455 [0,1,1,0,0,0|2,0,0]=4 3766 B11R1.166 O=C(O)c1ccc(F)cc1Cl Amb2685948 [0,1,1,0,0,0|2,0,0]=4 3767 B11R1.166 O=C(O)c1ccc(F)cc1F Amb2687071 [0,1,1,0,0,0|2,0,0]=4 3768 B11R1.166 O=C(O)c1ccc(F)cc1I Amb1130134 [0,1,1,0,0,0|2,0,0]=4 3769 B11R1.166 O=C(O)c1ccc(F)cc1O Amb33531195 [0,1,1,0,0,0|1,0,0]=3 3770 B11R1.166 O=C(O)c1ccc(F)cc1S Amb2371919 [0,1,1,0,0,0|1,1,0]=4 3771 B11R1.166 O=C(O)c1ccc(F)nc1O Amb27246860 [0,1,1,0,0,0|2,0,0]=4 3772 B11R1.166 O=C(O)c1ccc(I)cc1Br Amb16231627 [0,1,1,0,0,0|2,0,0]=4 3773 B11R1.166 O=C(O)c1ccc(I)cc1Cl Amb845610 [0,1,1,0,0,0|2,0,0]=4 3774 B11R1.166 O=C(O)c1ccc(I)cc1F Amb8628258 [0,1,1,0,0,0|2,0,0]=4 3775 B11R1.166 O=C(O)c1ccc(I)cc1I Amb25891482 [0,1,1,0,0,0|2,0,0]=4 3776 B11R1.166 O=C(O)c1ccc(I)cc1O Amb33532095 [0,1,1,0,0,0|1,0,0]=3 3777 B11R1.166 O=C(O)c1ccc(I)cc1S Amb25922904 [0,1,1,0,0,0|1,1,0]=4 3778 B11R1.166 O=C(O)c1ccc(O)cc1Br Amb22492055 [0,1,1,0,0,0|2,0,0]=4 3779 B11R1.166 O=C(O)c1ccc(O)cc1Cl Amb19894796 [0,1,1,0,0,0|2,0,0]=4 3780 B11R1.166 O=C(O)c1ccc(O)cc1Cl Amb2720213 [0,1,1,0,0,0|2,0,0]=4 3781 B11R1.166 O=C(O)c1ccc(O)cc1F Amb6296326 [0,1,1,0,0,0|2,0,0]=4 3782 B11R1.166 O=C(O)c1ccc(O)cc1O Amb1934138 [0,1,1,0,0,0|1,0,0]=3 3783 B11R1.166 O=C(O)c1ccc(O)cc1S Amb28068121 [0,1,1,0,0,0|1,1,0]=4 3784 B11R1.166 O=C(O)c1ccc(S)cc1Cl Amb18280754 [0,1,1,0,0,0|2,0,0]=4 3785 B11R1.166 O=C(O)c1ccc(S)cc1F Amb25106908 [0,1,1,0,0,0|2,0,0]=4 3786 B11R1.166 O=C(O)c1ccc(S)cc1I Amb26851539 [0,1,1,0,0,0|2,0,0]=4 3787 B11R1.166 O=C(O)c1ccc(S)cc1O Amb26966998 [0,1,1,0,0,0|1,0,0]=3 3788 B11R1.166 O=C(O)c1cnc(F)cc1O Amb24738558 [0,1,1,0,0,0|2,0,0]=4 3789 B11R1.166 O=C(O)c1cnc(I)cc1O Amb28200537 [0,1,1,0,0,0|2,0,0]=4 3790 B11R1.166 O=C(O)c1cnc(O)cc1O Amb2773495 [0,1,1,0,0,0|2,0,0]=4 3791 B11R1.166 O=C(O)c1ncc(Br)cc1O Amb20241848 [0,1,1,0,0,0|2,0,0]=4 3792 B11R1.166 O=C(O)c1ncc(Br)cc1O Amb32680458 [0,1,1,0,0,0|2,0,0]=4 3793 B11R1.166 O=C(O)c1ncc(Cl)cc1O Amb28461116 [0,1,1,0,0,0|2,0,0]=4 3794 B11R1.166 O=C(O)c1ncc(F)cc1O Amb25831206 [0,1,1,0,0,0|2,0,0]=4 3795 B11R1.166 O=C1C=C(O)C(C(=O)O)=CN1 Amb18200554 [0,1,1,0,0,0|2,0,0]=4 3796 B11R1.166 OB(O)c1ccc(Br)cc1O Amb22490167 [0,1,1,0,0,0|2,0,0]=4 3797 B11R1.166 OB(O)c1ccc(Cl)cc1O Amb25024239 [0,1,1,0,0,0|2,0,0]=4 3798 B11R1.166 OB(O)c1ccc(F)cc1O Amb10838884 [0,1,1,0,0,0|2,0,0]=4 3799 B11R1.166 OB(O)c1ccc(O)cc1O Amb26880454 [0,1,1,0,0,0|2,0,0]=4 3800 B11R1.167 C=C(C)c1cc(Br)ccc1O Amb28282187 [0,1,1,0,0,0|2,0,0]=4 3801 B11R1.167 CC(=O)c1cc(Br)ccc1O Amb1233024 [0,1,1,0,0,0|1,0,1]=4 3802 B11R1.167 CC(=O)c1cc(C)ccc1O Amb6323798 [0,1,1,0,0,0|1,0,1]=4 3803 B11R1.167 CC(=O)c1cc(Cl)ccc1O Amb1656443 [0,1,1,0,0,0|1,0,1]=4 3804 B11R1.167 CC(=O)c1cc(F)ccc1O Amb1639929 [0,1,1,0,0,0|1,0,1]=4 3805 B11R1.167 CC(=O)c1cc(N)ccc1O Amb2697318 [0,1,1,0,0,0|1,0,1]=4 3806 B11R1.167 CC(=O)c1cc(O)ccc1O Amb1299878 [0,1,1,0,0,0|1,0,1]=4 3807 B11R1.167 CC(O)c1cc(Br)ccc1O Amb1111043 [0,1,1,0,0,0|1,0,1]=4 3808 B11R1.167 CC(O)c1cc(Cl)ccc1O Amb1110276 [0,1,1,0,0,0|1,0,1]=4 3809 B11R1.167 CC(O)c1cc(F)ccc1O Amb17935749 [0,1,1,0,0,0|1,0,1]=4 3810 B11R1.167 CC(O)c1cc(N)ccc1O Amb27223808 [0,1,1,0,0,0|1,0,1]=4 3811 B11R1.167 C[C@@H](O)c1cc(Br)ccc1O Amb27752417 [0,1,1,0,0,0|1,0,1]=4 3812 B11R1.167 C[C@@H](O)c1cc(Cl)ccc1O Amb27632956 [0,1,1,0,0,0|1,0,1]=4 3813 B11R1.167 C[C@@H](O)c1cc(F)ccc1O Amb26964151 [0,1,1,0,0,0|1,0,1]=4 3814 B11R1.167 C[C@@H](O)c1cc(O)ccc1O Amb33269238 [0,1,1,0,0,0|1,0,1]=4 3815 B11R1.167 C[C@H](O)c1cc(Br)ccc1O Amb26612031 [0,1,1,0,0,0|1,0,1]=4 3816 B11R1.167 C[C@H](O)c1cc(Cl)ccc1O Amb24350637 [0,1,1,0,0,0|1,0,1]=4 3817 B11R1.167 C[C@H](O)c1cc(F)ccc1O Amb26354564 [0,1,1,0,0,0|1,0,1]=4 3818 B11R1.167 C[C@H](O)c1cc(O)ccc1O Amb33269237 [0,1,1,0,0,0|1,0,1]=4 3819 B11R1.167 Cc1cc(C(=O)O)c(O)cn1 Amb22587559 [0,1,1,0,0,0|2,0,0]=4 3820 B11R1.167 Cc1ccc(Br)c(C(=N)N)c1 Amb33477923 [0,1,1,0,0,0|2,0,0]=4 3821 B11R1.167 Cc1ccc(Br)c(C(=O)O)c1 Amb2685316 [0,1,1,0,0,0|2,0,0]=4 3822 B11R1.167 Cc1ccc(Br)cc1C(=N)N Amb25761254 [0,1,1,0,0,0|2,0,0]=4 3823 B11R1.167 Cc1ccc(Br)cc1C(=O)O Amb2610499 [0,1,1,0,0,0|2,0,0]=4 3824 B11R1.167 Cc1ccc(C)c(C(=N)N)c1 Amb2695866 [0,1,1,0,0,0|2,0,0]=4 3825 B11R1.167 Cc1ccc(C)c(C(=O)O)c1 Amb6335835 [0,1,1,0,0,0|2,0,0]=4 3826 B11R1.167 Cc1ccc(C)c(C(O)=S)c1 Amb27236265 [0,1,1,0,0,0|2,0,0]=4 3827 B11R1.167 Cc1ccc(Cl)c(C(=N)N)c1 Amb28285375 [0,1,1,0,0,0|2,0,0]=4 3828 B11R1.167 Cc1ccc(Cl)c(C(=O)O)c1 Amb2686193 [0,1,1,0,0,0|2,0,0]=4 3829 B11R1.167 Cc1ccc(Cl)cc1C(=N)N Amb2696073 [0,1,1,0,0,0|2,0,0]=4 3830 B11R1.167 Cc1ccc(Cl)cc1C(=O)O Amb2686197 [0,1,1,0,0,0|2,0,0]=4 3831 B11R1.167 Cc1ccc(Cl)cc1C(O)=S Amb24358360 [0,1,1,0,0,0|2,0,0]=4 3832 B11R1.167 Cc1ccc(F)c(C(=N)N)c1 Amb2696603 [0,1,1,0,0,0|2,0,0]=4 3833 B11R1.167 Cc1ccc(F)c(C(=O)O)c1 Amb2684161 [0,1,1,0,0,0|2,0,0]=4 3834 B11R1.167 Cc1ccc(F)cc1C(=N)N Amb22304681 [0,1,1,0,0,0|2,0,0]=4 3835 B11R1.167 Cc1ccc(F)cc1C(=N)N Amb2696601 [0,1,1,0,0,0|2,0,0]=4 3836 B11R1.167 Cc1ccc(F)cc1C(=O)O Amb1229971 [0,1,1,0,0,0|2,0,0]=4 3837 B11R1.167 Cc1ccc(F)cc1C(O)=S Amb25709802 [0,1,1,0,0,0|2,0,0]=4 3838 B11R1.167 Cc1ccc(I)c(C(=O)O)c1 Amb2688854 [0,1,1,0,0,0|2,0,0]=4 3839 B11R1.167 Cc1ccc(I)cc1C(=O)O Amb17835261 [0,1,1,0,0,0|2,0,0]=4 3840 B11R1.167 Cc1ccc(I)cc1C(O)=S Amb26596351 [0,1,1,0,0,0|2,0,0]=4 3841 B11R1.167 Cc1ccc(N)c(C(=O)O)c1 Amb1353188 [0,1,1,0,0,0|2,0,0]=4 3842 B11R1.167 Cc1ccc(N)cc1C(=O)O Amb2716204 [0,1,1,0,0,0|2,0,0]=4 3843 B11R1.167 Cc1ccc(N)cc1C(O)=S Amb27223137 [0,1,1,0,0,0|2,0,0]=4 3844 B11R1.167 Cc1ccc(O)c(B(O)O)c1 Amb22168991 [0,1,1,0,0,0|2,0,0]=4 3845 B11R1.167 Cc1ccc(O)c(C(=N)N)c1 Amb28398552 [0,1,1,0,0,0|1,0,0]=3 3846 B11R1.167 Cc1ccc(O)c(C(=O)O)c1 Amb3429668 [0,1,1,0,0,0|1,0,0]=3 3847 B11R1.167 Cc1ccc(O)c(C(=O)O)n1 Amb33547036 [0,1,1,0,0,0|2,0,0]=4 3848 B11R1.167 Cc1ccc(O)c(C(C)O)c1 Amb1110593 [0,1,1,0,0,0|1,0,1]=4 3849 B11R1.167 Cc1ccc(O)c(C(N)=O)c1 Amb6671843 [0,1,1,0,0,0|0,0,2]=4 3850 B11R1.167 Cc1ccc(O)c(C(N)=S)c1 Amb25361023 [0,1,1,0,0,0|0,1,1]=4 3851 B11R1.167 Cc1ccc(O)c([C@@H](C)O)c1 Amb24533196 [0,1,1,0,0,0|1,0,1]=4 3852 B11R1.167 Cc1ccc(O)c([C@H](C)O)c1 Amb25803133 [0,1,1,0,0,0|1,0,1]=4 3853 B11R1.167 Cc1ccc(O)cc1C(=O)O Amb8384398 [0,1,1,0,0,0|2,0,0]=4 3854 B11R1.167 Cc1ccc(S)c(C(=O)O)c1 Amb18280213 [0,1,1,0,0,0|1,1,0]=4 3855 B11R1.167 Cc1ccc(S)cc1C(=O)O Amb25310962 [0,1,1,0,0,0|2,0,0]=4 3856 B11R1.167 N=C(N)c1cc(Br)ccc1Br Amb33335173 [0,1,1,0,0,0|2,0,0]=4 3857 B11R1.167 N=C(N)c1cc(Br)ccc1Cl Amb27751058 [0,1,1,0,0,0|2,0,0]=4 3858 B11R1.167 N=C(N)c1cc(Br)ccc1F Amb22057712 [0,1,1,0,0,0|2,0,0]=4 3859 B11R1.167 N=C(N)c1cc(Br)ccc1I Amb27268312 [0,1,1,0,0,0|2,0,0]=4 3860 B11R1.167 N=C(N)c1cc(Br)ccc1O Amb25849724 [0,1,1,0,0,0|1,0,0]=3 3861 B11R1.167 N=C(N)c1cc(Cl)ccc1Br Amb25312161 [0,1,1,0,0,0|2,0,0]=4 3862 B11R1.167 N=C(N)c1cc(Cl)ccc1Cl Amb27478883 [0,1,1,0,0,0|2,0,0]=4 3863 B11R1.167 N=C(N)c1cc(Cl)ccc1Cl Amb8630611 [0,1,1,0,0,0|2,0,0]=4 3864 B11R1.167 N=C(N)c1cc(Cl)ccc1F Amb10844867 [0,1,1,0,0,0|2,0,0]=4 3865 B11R1.167 N=C(N)c1cc(Cl)ccc1O Amb28719619 [0,1,1,0,0,0|1,0,0]=3 3866 B11R1.167 N=C(N)c1cc(F)ccc1Br Amb26484637 [0,1,1,0,0,0|2,0,0]=4 3867 B11R1.167 N=C(N)c1cc(F)ccc1Cl Amb27830364 [0,1,1,0,0,0|2,0,0]=4 3868 B11R1.167 N=C(N)c1cc(F)ccc1F Amb2695842 [0,1,1,0,0,0|2,0,0]=4 3869 B11R1.167 N=C(N)c1cc(F)ccc1O Amb28351707 [0,1,1,0,0,0|1,0,0]=3 3870 B11R1.167 N=C(N)c1cc(I)ccc1F Amb27188741 [0,1,1,0,0,0|2,0,0]=4 3871 B11R1.167 N=C(N)c1cc(N)ccc1Br Amb29864447 [0,1,1,0,0,0|2,0,0]=4 3872 B11R1.167 N=C(N)c1cc(N)ccc1Cl Amb29864385 [0,1,1,0,0,0|2,0,0]=4 3873 B11R1.167 N=C(N)c1cc(O)ccc1Br Amb26876854 [0,1,1,0,0,0|2,0,0]=4 3874 B11R1.167 N=C(N)c1cc(O)ccc1O Amb33268151 [0,1,1,0,0,0|1,0,0]=3 3875 B11R1.167 NC(=O)c1cc(Br)ccc1O Amb4035341 [0,1,1,0,0,0|0,0,2]=4 3876 B11R1.167 NC(=O)c1cc(Cl)ccc1O Amb1211940 [0,1,1,0,0,0|0,0,2]=4 3877 B11R1.167 NC(=O)c1cc(F)ccc1O Amb18057849 [0,1,1,0,0,0|0,0,2]=4 3878 B11R1.167 NC(=O)c1cc(I)ccc1O Amb24756472 [0,1,1,0,0,0|0,0,2]=4 3879 B11R1.167 NC(=O)c1cc(N)ccc1O Amb18947692 [0,1,1,0,0,0|0,0,2]=4 3880 B11R1.167 NC(=S)c1cc(Br)ccc1O Amb5776101 [0,1,1,0,0,0|0,1,1]=4 3881 B11R1.167 NC(=S)c1cc(Cl)ccc1O Amb1120609 [0,1,1,0,0,0|0,1,1]=4 3882 B11R1.167 NC(=S)c1cc(F)ccc1O Amb24689440 [0,1,1,0,0,0|0,1,1]=4 3883 B11R1.167 NC(=S)c1cc(O)ccc1O Amb26559621 [0,1,1,0,0,0|0,1,1]=4 3884 B11R1.167 Nc1ccc(Br)c(C(=O)O)c1 Amb6298248 [0,1,1,0,0,0|2,0,0]=4 3885 B11R1.167 Nc1ccc(Br)cc1C(=O)O Amb6364862 [0,1,1,0,0,0|2,0,0]=4 3886 B11R1.167 Nc1ccc(Cl)c(C(=O)O)c1 Amb2684371 [0,1,1,0,0,0|2,0,0]=4 3887 B11R1.167 Nc1ccc(Cl)cc1C(=O)O Amb1353189 [0,1,1,0,0,0|2,0,0]=4 3888 B11R1.167 Nc1ccc(Cl)cc1C(=O)O Amb2695796 [0,1,1,0,0,0|2,0,0]=4 3889 B11R1.167 Nc1ccc(F)c(C(=O)O)c1 Amb2684412 [0,1,1,0,0,0|2,0,0]=4 3890 B11R1.167 Nc1ccc(F)cc1C(=O)O Amb1104986 [0,1,1,0,0,0|2,0,0]=4 3891 B11R1.167 Nc1ccc(I)cc1C(=O)O Amb1233201 [0,1,1,0,0,0|2,0,0]=4 3892 B11R1.167 Nc1ccc(N)c(C(=O)O)c1 Amb4139702 [0,1,1,0,0,0|2,0,0]=4 3893 B11R1.167 Nc1ccc(N)c(C(=O)O)c1 Amb6874952 [0,1,1,0,0,0|2,0,0]=4 3894 B11R1.167 Nc1ccc(O)c(C(=O)O)c1 Amb1072203 [0,1,1,0,0,0|1,0,0]=3 3895 B11R1.167 Nc1ccc(O)c(C(=O)O)c1 Amb24081346 [0,1,1,0,0,0|1,0,0]=3 3896 B11R1.167 Nc1ccc(O)c(C(=O)[O-])c1 Amb19958949 [0,1,1,0,0,0|1,0,1]=4 3897 B11R1.167 Nc1ccc(O)cc1C(=O)O Amb534955 [0,1,1,0,0,0|2,0,0]=4 3898 B11R1.167 Nc1ccc(S)c(C(=O)O)c1 Amb20620211 [0,1,1,0,0,0|1,1,0]=4 3899 B11R1.167 Nc1ccc(S)cc1C(=O)O Amb27614432 [0,1,1,0,0,0|2,0,0]=4 3900 B11R1.167 O=C(Cl)c1cc(Br)ccc1O Amb25877910 [0,1,1,0,0,0|1,0,1]=4 3901 B11R1.167 O=C(Cl)c1cc(Cl)ccc1O Amb6743397 [0,1,1,0,0,0|1,0,1]=4 3902 B11R1.167 O=C(Cl)c1cc(I)ccc1O Amb28398100 [0,1,1,0,0,0|1,0,1]=4 3903 B11R1.167 O=C(Cl)c1cc(O)ccc1O Amb27170728 [0,1,1,0,0,0|1,0,1]=4 3904 B11R1.167 O=C(O)c1cc(Br)ccc1Br Amb3941526 [0,1,1,0,0,0|2,0,0]=4 3905 B11R1.167 O=C(O)c1cc(Br)ccc1Cl Amb264314 [0,1,1,0,0,0|2,0,0]=4 3906 B11R1.167 O=C(O)c1cc(Br)ccc1F Amb1233202 [0,1,1,0,0,0|2,0,0]=4 3907 B11R1.167 O=C(O)c1cc(Br)ccc1I Amb1107594 [0,1,1,0,0,0|2,0,0]=4 3908 B11R1.167 O=C(O)c1cc(Br)ccc1O Amb1934189 [0,1,1,0,0,0|1,0,0]=3 3909 B11R1.167 O=C(O)c1cc(Br)ccc1S Amb18134858 [0,1,1,0,0,0|1,1,0]=4 3910 B11R1.167 O=C(O)c1cc(Br)cnc1O Amb535747 [0,1,1,0,0,0|2,0,0]=4 3911 B11R1.167 O=C(O)c1cc(Br)ncc1O Amb22499548 [0,1,1,0,0,0|2,0,0]=4 3912 B11R1.167 O=C(O)c1cc(Cl)ccc1Br Amb845609 [0,1,1,0,0,0|2,0,0]=4 3913 B11R1.167 O=C(O)c1cc(Cl)ccc1Cl Amb2099522 [0,1,1,0,0,0|2,0,0]=4 3914 B11R1.167 O=C(O)c1cc(Cl)ccc1F Amb1229906 [0,1,1,0,0,0|2,0,0]=4 3915 B11R1.167 O=C(O)c1cc(Cl)ccc1I Amb1133362 [0,1,1,0,0,0|2,0,0]=4 3916 B11R1.167 O=C(O)c1cc(Cl)ccc1O Amb3941495 [0,1,1,0,0,0|1,0,0]=3 3917 B11R1.167 O=C(O)c1cc(Cl)ccc1S Amb18279260 [0,1,1,0,0,0|1,1,0]=4 3918 B11R1.167 O=C(O)c1cc(Cl)ncc1O Amb19516096 [0,1,1,0,0,0|2,0,0]=4 3919 B11R1.167 O=C(O)c1cc(F)ccc1Br Amb1228485 [0,1,1,0,0,0|2,0,0]=4 3920 B11R1.167 O=C(O)c1cc(F)ccc1Cl Amb2685949 [0,1,1,0,0,0|2,0,0]=4 3921 B11R1.167 O=C(O)c1cc(F)ccc1F Amb1214894 [0,1,1,0,0,0|2,0,0]=4 3922 B11R1.167 O=C(O)c1cc(F)ccc1I Amb5721972 [0,1,1,0,0,0|2,0,0]=4 3923 B11R1.167 O=C(O)c1cc(F)ccc1O Amb2688416 [0,1,1,0,0,0|1,0,0]=3 3924 B11R1.167 O=C(O)c1cc(F)ccc1S Amb10838443 [0,1,1,0,0,0|1,1,0]=4 3925 B11R1.167 O=C(O)c1cc(F)cnc1O Amb8393044 [0,1,1,0,0,0|2,0,0]=4 3926 B11R1.167 O=C(O)c1cc(F)ncc1O Amb24620476 [0,1,1,0,0,0|2,0,0]=4 3927 B11R1.167 O=C(O)c1cc(I)ccc1Br Amb1785330 [0,1,1,0,0,0|2,0,0]=4 3928 B11R1.167 O=C(O)c1cc(I)ccc1Cl Amb2686131 [0,1,1,0,0,0|2,0,0]=4 3929 B11R1.167 O=C(O)c1cc(I)ccc1F Amb2688124 [0,1,1,0,0,0|2,0,0]=4 3930 B11R1.167 O=C(O)c1cc(I)ccc1I Amb6848402 [0,1,1,0,0,0|2,0,0]=4 3931 B11R1.167 O=C(O)c1cc(I)ccc1O Amb3940317 [0,1,1,0,0,0|1,0,0]=3 3932 B11R1.167 O=C(O)c1cc(I)ccc1S Amb27166774 [0,1,1,0,0,0|1,1,0]=4 3933 B11R1.167 O=C(O)c1cc(I)cnc1O Amb9677759 [0,1,1,0,0,0|2,0,0]=4 3934 B11R1.167 O=C(O)c1cc(O)ccc1Br Amb6297119 [0,1,1,0,0,0|2,0,0]=4 3935 B11R1.167 O=C(O)c1cc(O)ccc1Cl Amb6297059 [0,1,1,0,0,0|2,0,0]=4 3936 B11R1.167 O=C(O)c1cc(O)ccc1F Amb2684159 [0,1,1,0,0,0|2,0,0]=4 3937 B11R1.167 O=C(O)c1cc(O)ccc1I Amb17938038 [0,1,1,0,0,0|2,0,0]=4 3938 B11R1.167 O=C(O)c1cc(O)ccc1O Amb33779430 [0,1,1,0,0,0|1,0,0]=3 3939 B11R1.167 O=C(O)c1cc(O)ccc1O Amb6491145 [0,1,1,0,0,0|1,0,0]=3 3940 B11R1.167 O=C(O)c1cc(O)ccc1S Amb27390277 [0,1,1,0,0,0|1,1,0]=4 3941 B11R1.167 O=C(O)c1cc(O)cnc1O Amb8009492 [0,1,1,0,0,0|2,0,0]=4 3942 B11R1.167 O=C(O)c1cc(S)ccc1Br Amb27248662 [0,1,1,0,0,0|2,0,0]=4 3943 B11R1.167 O=C(O)c1cc(S)ccc1Cl Amb20623491 [0,1,1,0,0,0|2,0,0]=4 3944 B11R1.167 O=C(O)c1cc(S)ccc1F Amb25152849 [0,1,1,0,0,0|2,0,0]=4 3945 B11R1.167 O=C(O)c1cc(S)ccc1I Amb26931773 [0,1,1,0,0,0|2,0,0]=4 3946 B11R1.167 O=C(O)c1cc(S)ccc1O Amb26481378 [0,1,1,0,0,0|1,0,0]=3 3947 B11R1.167 O=C(O)c1cc(S)ccc1S Amb25288094 [0,1,1,0,0,0|1,1,0]=4 3948 B11R1.167 O=C(O)c1nc(Br)ccc1O Amb19958147 [0,1,1,0,0,0|2,0,0]=4 3949 B11R1.167 O=C(O)c1nc(Cl)ccc1O Amb25760648 [0,1,1,0,0,0|2,0,0]=4 3950 B11R1.167 O=C(O)c1nc(F)ccc1O Amb25151163 [0,1,1,0,0,0|2,0,0]=4 3951 B11R1.167 O=C(S)c1cc(Br)ccc1O Amb27864996 [0,1,1,0,0,0|1,0,1]=4 3952 B11R1.167 O=C([O-])c1cc(Br)ccc1O Amb22495805 [0,1,1,0,0,0|1,0,1]=4 3953 B11R1.167 O=C([O-])c1cc(O)ccc1O Amb9825417 [0,1,1,0,0,0|1,0,1]=4 3954 B11R1.167 O=C1C=C(C(=O)O)C(O)=CN1 Amb20242309 [0,1,1,0,0,0|2,0,0]=4 3955 B11R1.167 O=C1C=CN(O)C(C(=O)O)=C1 Amb27861943 [0,1,1,0,0,0|2,0,0]=4 3956 B11R1.167 OB(O)c1cc(Br)ccc1O Amb4012125 [0,1,1,0,0,0|2,0,0]=4 3957 B11R1.167 OB(O)c1cc(Cl)ccc1O Amb9766227 [0,1,1,0,0,0|2,0,0]=4 3958 B11R1.167 OB(O)c1cc(F)ccc1O Amb8387608 [0,1,1,0,0,0|2,0,0]=4 3959 B11R1.167 Oc1ccc(O)c(C(O)Cl)c1 Amb27651926 [0,1,1,0,0,0|1,0,1]=4 3960 B11R1.875 C=CC(=O)c1c(C)noc1C Amb24485904 [0,1,1,0,0,0|1,0,1]=4 3961 B11R2.10 BrC1=Cc2ccccc2C1 Amb8517387 [1,1,0,0,0,0|2,0,0]=4 3962 B11R2.10 BrP1Oc2ccccc2O1 Amb4008592 [1,1,0,0,0,0|1,1,0]=4 3963 B11R2.10 Brb1oc2ccccc2o1 Amb22731967 [1,1,0,0,0,0|2,0,0]=4 3964 B11R2.10 Brc1cc2ccccc2o1 Amb2723106 [1,1,0,0,0,0|1,0,0]=3 3965 B11R2.10 Brc1cc2ccccc2s1 Amb2723178 [1,1,0,0,0,0|1,1,0]=4 3966 B11R2.10 Brc1cc2cnccc2o1 Amb18187766 [1,1,0,0,0,0|2,0,0]=4 3967 B11R2.10 Brc1cc2ncccc2o1 Amb25133797 [1,1,0,0,0,0|2,0,0]=4 3968 B11R2.10 Brc1cc2ncccc2o1 Amb32683420 [1,1,0,0,0,0|2,0,0]=4 3969 B11R2.10 Brc1nc2ccccc2o1 Amb19054929 [1,1,0,0,0,0|2,0,0]=4 3970 B11R2.10 CC1=Cc2ccccc2C1 Amb15692403 [1,1,0,0,0,0|2,0,0]=4 3971 B11R2.10 CC1Cc2ccccc2O1 Amb6374258 [1,1,0,0,0,0|1,0,1]=4 3972 B11R2.10 Cc1cc2ccccc2o1 Amb20621560 [1,1,0,0,0,0|1,0,0]=3 3973 B11R2.10 Cc1cc2ccccc2s1 Amb2237023 [1,1,0,0,0,0|1,1,0]=4 3974 B11R2.10 Cc1cc2cccnc2o1 Amb25299352 [1,1,0,0,0,0|2,0,0]=4 3975 B11R2.10 Cc1cc2cnccc2o1 Amb23590993 [1,1,0,0,0,0|2,0,0]=4 3976 B11R2.10 Cc1nc2ccccc2o1 Amb2599323 [1,1,0,0,0,0|2,0,0]=4 3977 B11R2.10 ClC1=Cc2ccccc2C1 Amb22752069 [1,1,0,0,0,0|2,0,0]=4 3978 B11R2.10 ClC1Oc2ccccc2O1 Amb25887658 [1,1,0,0,0,0|2,0,0]=4 3979 B11R2.10 ClP1Nc2ccccc2O1 Amb4297469 [1,1,0,0,0,0|1,1,0]=4 3980 B11R2.10 ClP1Oc2ccccc2O1 Amb6365815 [1,1,0,0,0,0|1,1,0]=4 3981 B11R2.10 Clb1oc2ccccc2o1 Amb22801025 [1,1,0,0,0,0|2,0,0]=4 3982 B11R2.10 Clc1cc2ccccc2o1 Amb24104234 [1,1,0,0,0,0|1,0,0]=3 3983 B11R2.10 Clc1cc2ccncc2o1 Amb28126707 [1,1,0,0,0,0|2,0,0]=4 3984 B11R2.10 Clc1nc2ccccc2o1 Amb1106378 [1,1,0,0,0,0|2,0,0]=4 3985 B11R2.10 Cln1cc2ccccc2n1 Amb2609846 [1,1,0,0,0,0|1,0,1]=4 3986 B11R2.10 Cn1cc2ccccc2c1 Amb28313764 [1,1,0,0,0,0|1,0,1]=4 3987 B11R2.10 Cn1cc2ccccc2n1 Amb2609633 [1,1,0,0,0,0|1,0,1]=4 3988 B11R2.10 FP1Oc2ccccc2O1 Amb27216671 [1,1,0,0,0,0|1,1,0]=4 3989 B11R2.10 Ic1cc2ccccc2o1 Amb24482100 [1,1,0,0,0,0|1,0,0]=3 3990 B11R2.10 Ic1cc2ccccc2s1 Amb22896395 [1,1,0,0,0,0|1,1,0]=4 3991 B11R2.10 Nc1cc2ccccc2s1 Amb17593717 [1,1,0,0,0,0|1,1,0]=4 3992 B11R2.10 Nc1cc2cnccc2o1 Amb18203158 [1,1,0,0,0,0|2,0,0]=4 3993 B11R2.10 Nc1nc2ccccc2o1 Amb1153977 [1,1,0,0,0,0|2,0,0]=4 3994 B11R2.10 Nn1cc2ccccc2n1 Amb24479670 [1,1,0,0,0,0|1,0,1]=4 3995 B11R2.10 O=C1C=C2C=CC=CC2=N1 Amb24620213 [1,1,0,0,0,0|2,0,0]=4 3996 B11R2.10 O=C1C=C2C=COC=C2O1 Amb19132425 [1,1,0,0,0,0|2,0,0]=4 3997 B11R2.10 O=C1Cc2ccccc2O1 Amb2781615 [1,1,0,0,0,0|1,0,1]=4 3998 B11R2.10 O=C1Nc2ccccc2O1 Amb18043097 [1,1,0,0,0,0|2,0,0]=4 3999 B11R2.10 O=C1Oc2ccccc2O1 Amb19514273 [1,1,0,0,0,0|2,0,0]=4 4000 B11R2.10 OC1Cc2ccccc2O1 Amb27410400 [1,1,0,0,0,0|1,0,1]=4 4001 B11R2.10 Ob1oc2ccccc2o1 Amb24674117 [1,1,0,0,0,0|2,0,0]=4 4002 B11R2.10 Oc1cc2ccccc2s1 Amb24518934 [1,1,0,0,0,0|1,1,0]=4 4003 B11R2.10 Oc1cc2ncccc2o1 Amb28385482 [1,1,0,0,0,0|2,0,0]=4 4004 B11R2.10 S=C1Nc2ccccc2O1 Amb18799383 [1,1,0,0,0,0|2,0,0]=4 4005 B11R2.10 S=C1Oc2ccccc2O1 Amb22363540 [1,1,0,0,0,0|2,0,0]=4 4006 B11R2.10 S=C1Oc2ccccc2S1 Amb27839135 [1,1,0,0,0,0|2,0,0]=4 4007 B11R2.10 Sc1cc2ccccc2s1 Amb24105482 [1,1,0,0,0,0|1,1,0]=4 4008 B11R2.10 Sc1nc2ccccc2o1 Amb17570013 [1,1,0,0,0,0|2,0,0]=4 4009 B11R2.10 [SH3]c1nc2ccccc2o1 Amb18046725 [1,1,0,0,0,0|2,0,0]=4 4010 B11R2.36 Brc1cc2cnoc2cn1 Amb18811003 [1,1,0,0,0,0|1,0,0]=3 4011 B11R2.36 Brc1cc2occc2cn1 Amb18187805 [1,1,0,0,0,0|2,0,0]=4 4012 B11R2.36 Brc1cc2oncc2cn1 Amb27617096 [1,1,0,0,0,0|1,0,0]=3 4013 B11R2.36 Brc1ccc2c(c1)C=CC2 Amb2383763 [1,1,0,0,0,0|2,0,0]=4 4014 B11R2.36 Brc1ccc2c(c1)CC=C2 Amb22002296 [1,1,0,0,0,0|2,0,0]=4 4015 B11R2.36 Brc1ccc2c(c1)CCO2 Amb2685123 [1,1,0,0,0,0|1,0,1]=4 4016 B11R2.36 Brc1ccc2c(c1)OCC2 Amb22002410 [1,1,0,0,0,0|1,0,1]=4 4017 B11R2.36 Brc1ccc2c(c1)OCO2 Amb2720556 [1,1,0,0,0,0|2,0,0]=4 4018 B11R2.36 Brc1ccc2ccoc2c1 Amb16192026 [1,1,0,0,0,0|1,0,0]=3 4019 B11R2.36 Brc1ccc2ccoc2n1 Amb23437182 [1,1,0,0,0,0|2,0,0]=4 4020 B11R2.36 Brc1ccc2ccsc2c1 Amb10975970 [1,1,0,0,0,0|1,1,0]=4 4021 B11R2.36 Brc1ccc2cncn2c1 Amb21864793 [1,1,0,0,0,0|2,0,0]=4 4022 B11R2.36 Brc1ccc2cnnn2c1 Amb24425171 [1,1,0,0,0,0|2,0,0]=4 4023 B11R2.36 Brc1ccc2cnoc2c1 Amb18187784 [1,1,0,0,0,0|0,0,0]=2 4024 B11R2.36 Brc1ccc2cnoc2n1 Amb18187624 [1,1,0,0,0,0|1,0,0]=3 4025 B11R2.36 Brc1ccc2cnsc2c1 Amb18770292 [1,1,0,0,0,0|0,1,0]=3 4026 B11R2.36 Brc1ccc2conc2c1 Amb25336471 [1,1,0,0,0,0|2,0,0]=4 4027 B11R2.36 Brc1ccc2cscc2c1 Amb21858239 [1,1,0,0,0,0|2,0,0]=4 4028 B11R2.36 Brc1ccc2csnc2c1 Amb22735785 [1,1,0,0,0,0|2,0,0]=4 4029 B11R2.36 Brc1ccc2ncoc2c1 Amb10602229 [1,1,0,0,0,0|2,0,0]=4 4030 B11R2.36 Brc1ccc2nncn2c1 Amb10067448 [1,1,0,0,0,0|2,0,0]=4 4031 B11R2.36 Brc1ccc2nnoc2c1 Amb18811023 [1,1,0,0,0,0|1,0,0]=3 4032 B11R2.36 Brc1ccc2nnsc2c1 Amb33465356 [1,1,0,0,0,0|1,1,0]=4 4033 B11R2.36 Brc1ccc2nocc2c1 Amb18187781 [1,1,0,0,0,0|2,0,0]=4 4034 B11R2.36 Brc1ccc2nscc2c1 Amb19958165 [1,1,0,0,0,0|2,0,0]=4 4035 B11R2.36 Brc1ccc2occc2c1 Amb2694966 [1,1,0,0,0,0|1,0,0]=3 4036 B11R2.36 Brc1ccc2occc2n1 Amb18187816 [1,1,0,0,0,0|2,0,0]=4 4037 B11R2.36 Brc1ccc2ocnc2c1 Amb3941364 [1,1,0,0,0,0|2,0,0]=4 4038 B11R2.36 Brc1ccc2oncc2c1 Amb19957546 [1,1,0,0,0,0|0,0,0]=2 4039 B11R2.36 Brc1ccc2onnc2c1 Amb18811027 [1,1,0,0,0,0|1,0,0]=3 4040 B11R2.36 Brc1ccc2sccc2c1 Amb2447430 [1,1,0,0,0,0|1,1,0]=4 4041 B11R2.36 Brc1ccc2sncc2c1 Amb22584104 [1,1,0,0,0,0|0,1,0]=3 4042 B11R2.36 Brc1ccc2snnc2c1 Amb33330872 [1,1,0,0,0,0|1,1,0]=4 4043 B11R2.36 Brc1ccn2cncc2c1 Amb24707866 [1,1,0,0,0,0|2,0,0]=4 4044 B11R2.36 Brc1ccn2cnnc2c1 Amb19958184 [1,1,0,0,0,0|2,0,0]=4 4045 B11R2.36 Brc1ccn2nncc2c1 Amb18187317 [1,1,0,0,0,0|2,0,0]=4 4046 B11R2.36 Brc1cnc2cnoc2c1 Amb33493359 [1,1,0,0,0,0|1,0,0]=3 4047 B11R2.36 Brc1cnc2occc2c1 Amb4560959 [1,1,0,0,0,0|2,0,0]=4 4048 B11R2.36 Brc1cnc2oncc2c1 Amb28050290 [1,1,0,0,0,0|1,0,0]=3 4049 B11R2.36 Brc1ncc2cnoc2n1 Amb18187377 [1,1,0,0,0,0|2,0,0]=4 4050 B11R2.36 Brc1ncc2oncc2n1 Amb18810523 [1,1,0,0,0,0|2,0,0]=4 4051 B11R2.36 C[n+]1ccc2ccoc2c1 Amb27230410 [1,1,0,0,0,0|2,0,0]=4 4052 B11R2.36 Cc1ccc2c(c1)C=CC2 Amb24062964 [1,1,0,0,0,0|2,0,0]=4 4053 B11R2.36 Cc1ccc2c(c1)CC=C2 Amb28204212 [1,1,0,0,0,0|2,0,0]=4 4054 B11R2.36 Cc1ccc2c(c1)CCO2 Amb2447310 [1,1,0,0,0,0|1,0,1]=4 4055 B11R2.36 Cc1ccc2c(c1)OCN2 Amb28325699 [1,1,0,0,0,0|2,0,0]=4 4056 B11R2.36 Cc1ccc2c(c1)OCO2 Amb2721033 [1,1,0,0,0,0|2,0,0]=4 4057 B11R2.36 Cc1ccc2ccoc2c1 Amb22039412 [1,1,0,0,0,0|1,0,0]=3 4058 B11R2.36 Cc1ccc2ccsc2c1 Amb10603775 [1,1,0,0,0,0|1,1,0]=4 4059 B11R2.36 Cc1ccc2cncn2c1 Amb24360913 [1,1,0,0,0,0|2,0,0]=4 4060 B11R2.36 Cc1ccc2cnoc2c1 Amb22002117 [1,1,0,0,0,0|0,0,0]=2 4061 B11R2.36 Cc1ccc2ncoc2c1 Amb6875051 [1,1,0,0,0,0|2,0,0]=4 4062 B11R2.36 Cc1ccc2nocc2c1 Amb28124034 [1,1,0,0,0,0|2,0,0]=4 4063 B11R2.36 Cc1ccc2nscc2c1 Amb27160735 [1,1,0,0,0,0|2,0,0]=4 4064 B11R2.36 Cc1ccc2occc2c1 Amb22751743 [1,1,0,0,0,0|1,0,0]=3 4065 B11R2.36 Cc1ccc2occc2n1 Amb26844414 [1,1,0,0,0,0|2,0,0]=4 4066 B11R2.36 Cc1ccc2ocnc2c1 Amb2433105 [1,1,0,0,0,0|2,0,0]=4 4067 B11R2.36 Cc1ccc2oncc2c1 Amb27975667 [1,1,0,0,0,0|0,0,0]=2 4068 B11R2.36 Cc1ccc2sccc2c1 Amb2689331 [1,1,0,0,0,0|1,1,0]=4 4069 B11R2.36 Cc1ccn2cnnc2c1 Amb26006662 [1,1,0,0,0,0|2,0,0]=4 4070 B11R2.36 Cc1cnc2ccoc2c1 Amb27478517 [1,1,0,0,0,0|2,0,0]=4 4071 B11R2.36 Cc1cnc2occc2c1 Amb23403003 [1,1,0,0,0,0|2,0,0]=4 4072 B11R2.36 Clc1cc2ccoc2cn1 Amb27756425 [1,1,0,0,0,0|2,0,0]=4 4073 B11R2.36 Clc1cc2occc2cn1 Amb27265954 [1,1,0,0,0,0|2,0,0]=4 4074 B11R2.36 Clc1ccc2c(c1)C=CC2 Amb2383761 [1,1,0,0,0,0|2,0,0]=4 4075 B11R2.36 Clc1ccc2c(c1)CC=C2 Amb26349302 [1,1,0,0,0,0|2,0,0]=4 4076 B11R2.36 Clc1ccc2c(c1)CCO2 Amb22498241 [1,1,0,0,0,0|1,0,1]=4 4077 B11R2.36 Clc1ccc2c(c1)OCO2 Amb2686216 [1,1,0,0,0,0|2,0,0]=4 4078 B11R2.36 Clc1ccc2ccoc2n1 Amb23437178 [1,1,0,0,0,0|2,0,0]=4 4079 B11R2.36 Clc1ccc2ccsc2c1 Amb24091106 [1,1,0,0,0,0|1,1,0]=4 4080 B11R2.36 Clc1ccc2cncn2c1 Amb26864594 [1,1,0,0,0,0|2,0,0]=4 4081 B11R2.36 Clc1ccc2cnoc2c1 Amb24073976 [1,1,0,0,0,0|0,0,0]=2 4082 B11R2.36 Clc1ccc2cnoc2n1 Amb27169582 [1,1,0,0,0,0|1,0,0]=3 4083 B11R2.36 Clc1ccc2cnsc2c1 Amb26451436 [1,1,0,0,0,0|0,1,0]=3 4084 B11R2.36 Clc1ccc2conc2c1 Amb22751080 [1,1,0,0,0,0|2,0,0]=4 4085 B11R2.36 Clc1ccc2ncoc2c1 Amb9783095 [1,1,0,0,0,0|2,0,0]=4 4086 B11R2.36 Clc1ccc2nncn2c1 Amb9677823 [1,1,0,0,0,0|2,0,0]=4 4087 B11R2.36 Clc1ccc2nnsc2c1 Amb25067775 [1,1,0,0,0,0|1,1,0]=4 4088 B11R2.36 Clc1ccc2nocc2c1 Amb10571862 [1,1,0,0,0,0|2,0,0]=4 4089 B11R2.36 Clc1ccc2nscc2c1 Amb22496026 [1,1,0,0,0,0|2,0,0]=4 4090 B11R2.36 Clc1ccc2occc2c1 Amb20248132 [1,1,0,0,0,0|1,0,0]=3 4091 B11R2.36 Clc1ccc2occc2n1 Amb21864771 [1,1,0,0,0,0|2,0,0]=4 4092 B11R2.36 Clc1ccc2ocnc2c1 Amb2747117 [1,1,0,0,0,0|2,0,0]=4 4093 B11R2.36 Clc1ccc2oncc2c1 Amb22495862 [1,1,0,0,0,0|0,0,0]=2 4094 B11R2.36 Clc1ccc2sccc2c1 Amb8629060 [1,1,0,0,0,0|1,1,0]=4 4095 B11R2.36 Clc1ccc2sncc2c1 Amb27596077 [1,1,0,0,0,0|0,1,0]=3 4096 B11R2.36 Clc1ccc2snnc2c1 Amb27468620 [1,1,0,0,0,0|1,1,0]=4 4097 B11R2.36 Clc1ccn2cncc2c1 Amb25147800 [1,1,0,0,0,0|2,0,0]=4 4098 B11R2.36 Clc1ccn2cnnc2c1 Amb27163226 [1,1,0,0,0,0|2,0,0]=4 4099 B11R2.36 Clc1cnc2ccoc2c1 Amb13890158 [1,1,0,0,0,0|2,0,0]=4 4100 B11R2.36 Clc1cnc2occc2c1 Amb25256318 [1,1,0,0,0,0|2,0,0]=4 4101 B11R2.36 Fc1ccc2c(c1)C=CC2 Amb2383762 [1,1,0,0,0,0|2,0,0]=4 4102 B11R2.36 Fc1ccc2c(c1)CC=C2 Amb25927316 [1,1,0,0,0,0|2,0,0]=4 4103 B11R2.36 Fc1ccc2c(c1)CCO2 Amb10841652 [1,1,0,0,0,0|1,0,1]=4 4104 B11R2.36 Fc1ccc2c(c1)OCO2 Amb25125976 [1,1,0,0,0,0|2,0,0]=4 4105 B11R2.36 Fc1ccc2ccoc2c1 Amb27636754 [1,1,0,0,0,0|1,0,0]=3 4106 B11R2.36 Fc1ccc2cncn2c1 Amb25916329 [1,1,0,0,0,0|2,0,0]=4 4107 B11R2.36 Fc1ccc2cnsc2c1 Amb27154037 [1,1,0,0,0,0|0,1,0]=3 4108 B11R2.36 Fc1ccc2ncoc2c1 Amb24463817 [1,1,0,0,0,0|2,0,0]=4 4109 B11R2.36 Fc1ccc2nncn2c1 Amb25967540 [1,1,0,0,0,0|2,0,0]=4 4110 B11R2.36 Fc1ccc2occc2c1 Amb20241175 [1,1,0,0,0,0|1,0,0]=3 4111 B11R2.36 Fc1ccc2ocnc2c1 Amb10841895 [1,1,0,0,0,0|2,0,0]=4 4112 B11R2.36 Fc1ccc2oncc2c1 Amb22495874 [1,1,0,0,0,0|0,0,0]=2 4113 B11R2.36 Fc1ccc2sccc2c1 Amb19958720 [1,1,0,0,0,0|1,1,0]=4 4114 B11R2.36 Fc1ccc2sncc2c1 Amb24554887 [1,1,0,0,0,0|0,1,0]=3 4115 B11R2.36 Fc1ccn2cncc2c1 Amb24410341 [1,1,0,0,0,0|2,0,0]=4 4116 B11R2.36 Ic1ccc2c(c1)C=CC2 Amb25313198 [1,1,0,0,0,0|2,0,0]=4 4117 B11R2.36 Ic1ccc2c(c1)CCO2 Amb2455961 [1,1,0,0,0,0|1,0,1]=4 4118 B11R2.36 Ic1ccc2c(c1)OCC2 Amb27974776 [1,1,0,0,0,0|1,0,1]=4 4119 B11R2.36 Ic1ccc2c(c1)OCO2 Amb2688856 [1,1,0,0,0,0|2,0,0]=4 4120 B11R2.36 Ic1ccc2ccoc2c1 Amb23401822 [1,1,0,0,0,0|1,0,0]=3 4121 B11R2.36 Ic1ccc2cnoc2c1 Amb27656210 [1,1,0,0,0,0|0,0,0]=2 4122 B11R2.36 Ic1ccc2nncn2c1 Amb27780549 [1,1,0,0,0,0|2,0,0]=4 4123 B11R2.36 Ic1ccc2occc2c1 Amb23401832 [1,1,0,0,0,0|1,0,0]=3 4124 B11R2.36 Ic1ccc2occc2n1 Amb24760836 [1,1,0,0,0,0|2,0,0]=4 4125 B11R2.36 Ic1ccc2ocnc2c1 Amb22737648 [1,1,0,0,0,0|2,0,0]=4 4126 B11R2.36 Ic1ccc2oncc2c1 Amb24392287 [1,1,0,0,0,0|0,0,0]=2 4127 B11R2.36 Ic1ccc2sccc2c1 Amb24062930 [1,1,0,0,0,0|1,1,0]=4 4128 B11R2.36 Ic1ccc2sncc2c1 Amb25888317 [1,1,0,0,0,0|0,1,0]=3 4129 B11R2.36 Ic1ccn2cnnc2c1 Amb22752367 [1,1,0,0,0,0|2,0,0]=4 4130 B11R2.36 Ic1cnc2ccoc2c1 Amb13890154 [1,1,0,0,0,0|2,0,0]=4 4131 B11R2.36 Nc1cc2cnoc2cn1 Amb18203125 [1,1,0,0,0,0|1,0,0]=3 4132 B11R2.36 Nc1cc2occc2cn1 Amb18832517 [1,1,0,0,0,0|2,0,0]=4 4133 B11R2.36 Nc1ccc2c(c1)CCO2 Amb1125736 [1,1,0,0,0,0|1,0,1]=4 4134 B11R2.36 Nc1ccc2c(c1)CCO2 Amb6239359 [1,1,0,0,0,0|1,0,1]=4 4135 B11R2.36 Nc1ccc2c(c1)N=NC2 Amb22493911 [1,1,0,0,0,0|1,0,1]=4 4136 B11R2.36 Nc1ccc2c(c1)OCC2 Amb33544801 [1,1,0,0,0,0|1,0,1]=4 4137 B11R2.36 Nc1ccc2c(c1)OCO2 Amb535232 [1,1,0,0,0,0|2,0,0]=4 4138 B11R2.36 Nc1ccc2c(c1)OCS2 Amb27619218 [1,1,0,0,0,0|2,0,0]=4 4139 B11R2.36 Nc1ccc2ccoc2c1 Amb18137748 [1,1,0,0,0,0|1,0,0]=3 4140 B11R2.36 Nc1ccc2ccoc2c1 Amb32661636 [1,1,0,0,0,0|1,0,0]=3 4141 B11R2.36 Nc1ccc2ccsc2c1 Amb30633689 [1,1,0,0,0,0|1,1,0]=4 4142 B11R2.36 Nc1ccc2ccsc2c1 Amb8439505 [1,1,0,0,0,0|1,1,0]=4 4143 B11R2.36 Nc1ccc2cncn2c1 Amb24405824 [1,1,0,0,0,0|2,0,0]=4 4144 B11R2.36 Nc1ccc2cncn2c1 Amb32932465 [1,1,0,0,0,0|2,0,0]=4 4145 B11R2.36 Nc1ccc2cnoc2c1 Amb10603847 [1,1,0,0,0,0|0,0,0]=2 4146 B11R2.36 Nc1ccc2cnsc2c1 Amb24060601 [1,1,0,0,0,0|0,1,0]=3 4147 B11R2.36 Nc1ccc2cnsc2n1 Amb27752101 [1,1,0,0,0,0|1,1,0]=4 4148 B11R2.36 Nc1ccc2conc2c1 Amb28208739 [1,1,0,0,0,0|2,0,0]=4 4149 B11R2.36 Nc1ccc2csnc2c1 Amb22736287 [1,1,0,0,0,0|2,0,0]=4 4150 B11R2.36 Nc1ccc2ncoc2c1 Amb2724961 [1,1,0,0,0,0|2,0,0]=4 4151 B11R2.36 Nc1ccc2nncn2c1 Amb17093668 [1,1,0,0,0,0|2,0,0]=4 4152 B11R2.36 Nc1ccc2nncn2c1 Amb18090834 [1,1,0,0,0,0|2,0,0]=4 4153 B11R2.36 Nc1ccc2nnoc2c1 Amb18203121 [1,1,0,0,0,0|1,0,0]=3 4154 B11R2.36 Nc1ccc2nnsc2c1 Amb27400326 [1,1,0,0,0,0|1,1,0]=4 4155 B11R2.36 Nc1ccc2nocc2c1 Amb18832516 [1,1,0,0,0,0|2,0,0]=4 4156 B11R2.36 Nc1ccc2nscc2c1 Amb22736327 [1,1,0,0,0,0|2,0,0]=4 4157 B11R2.36 Nc1ccc2occc2c1 Amb2425577 [1,1,0,0,0,0|1,0,0]=3 4158 B11R2.36 Nc1ccc2occc2n1 Amb24445845 [1,1,0,0,0,0|2,0,0]=4 4159 B11R2.36 Nc1ccc2ocnc2c1 Amb2433112 [1,1,0,0,0,0|2,0,0]=4 4160 B11R2.36 Nc1ccc2oncc2c1 Amb21927333 [1,1,0,0,0,0|0,0,0]=2 4161 B11R2.36 Nc1ccc2oncc2n1 Amb18203126 [1,1,0,0,0,0|1,0,0]=3 4162 B11R2.36 Nc1ccc2onnc2c1 Amb27670091 [1,1,0,0,0,0|1,0,0]=3 4163 B11R2.36 Nc1ccc2sccc2c1 Amb33526381 [1,1,0,0,0,0|1,1,0]=4 4164 B11R2.36 Nc1ccc2sccc2c1 Amb482302 [1,1,0,0,0,0|1,1,0]=4 4165 B11R2.36 Nc1ccc2sncc2c1 Amb17621839 [1,1,0,0,0,0|0,1,0]=3 4166 B11R2.36 Nc1ccc2snnc2c1 Amb18644468 [1,1,0,0,0,0|1,1,0]=4 4167 B11R2.36 Nc1ccn2cnnc2c1 Amb22727973 [1,1,0,0,0,0|2,0,0]=4 4168 B11R2.36 Nc1cnc2occc2c1 Amb22496271 [1,1,0,0,0,0|2,0,0]=4 4169 B11R2.36 Nc1ncc2cnoc2n1 Amb18832484 [1,1,0,0,0,0|2,0,0]=4 4170 B11R2.36 Nc1ncc2oncc2n1 Amb18832483 [1,1,0,0,0,0|2,0,0]=4 4171 B11R2.36 O=C1C=C2C=NNC2=CN1 Amb22756419 [1,1,0,0,0,0|2,0,0]=4 4172 B11R2.36 O=C1C=CC2=CNNC2=C1 Amb22489531 [1,1,0,0,0,0|1,0,1]=4 4173 B11R2.36 Oc1ccc2c(c1)C=CC2 Amb18124353 [1,1,0,0,0,0|2,0,0]=4 4174 B11R2.36 Oc1ccc2c(c1)CCO2 Amb8388337 [1,1,0,0,0,0|1,0,1]=4 4175 B11R2.36 Oc1ccc2c(c1)OCC2 Amb18643055 [1,1,0,0,0,0|1,0,1]=4 4176 B11R2.36 Oc1ccc2c(c1)OCO2 Amb21912504 [1,1,0,0,0,0|2,0,0]=4 4177 B11R2.36 Oc1ccc2c(c1)OCO2 Amb533667 [1,1,0,0,0,0|2,0,0]=4 4178 B11R2.36 Oc1ccc2c(c1)SCO2 Amb27972905 [1,1,0,0,0,0|2,0,0]=4 4179 B11R2.36 Oc1ccc2ccoc2c1 Amb18124404 [1,1,0,0,0,0|1,0,0]=3 4180 B11R2.36 Oc1ccc2ccsc2c1 Amb18644429 [1,1,0,0,0,0|1,1,0]=4 4181 B11R2.36 Oc1ccc2cnoc2c1 Amb10603075 [1,1,0,0,0,0|0,0,0]=2 4182 B11R2.36 Oc1ccc2cnsc2c1 Amb24466965 [1,1,0,0,0,0|0,1,0]=3 4183 B11R2.36 Oc1ccc2csnc2c1 Amb27389693 [1,1,0,0,0,0|2,0,0]=4 4184 B11R2.36 Oc1ccc2ncoc2c1 Amb33546968 [1,1,0,0,0,0|2,0,0]=4 4185 B11R2.36 Oc1ccc2nncn2c1 Amb28205353 [1,1,0,0,0,0|2,0,0]=4 4186 B11R2.36 Oc1ccc2occc2c1 Amb16185813 [1,1,0,0,0,0|1,0,0]=3 4187 B11R2.36 Oc1ccc2ocnc2c1 Amb17479110 [1,1,0,0,0,0|2,0,0]=4 4188 B11R2.36 Oc1ccc2oncc2c1 Amb23403626 [1,1,0,0,0,0|0,0,0]=2 4189 B11R2.36 Oc1ccc2sccc2c1 Amb18644430 [1,1,0,0,0,0|1,1,0]=4 4190 B11R2.36 Oc1ccc2sncc2c1 Amb18125219 [1,1,0,0,0,0|0,1,0]=3 4191 B11R2.36 Oc1ccc2snnc2c1 Amb28049355 [1,1,0,0,0,0|1,1,0]=4 4192 B11R2.36 Oc1ccn2cnnc2c1 Amb26949915 [1,1,0,0,0,0|2,0,0]=4 4193 B11R2.36 Sc1ccc2c(c1)CCO2 Amb7773594 [1,1,0,0,0,0|1,0,1]=4 4194 B11R2.36 Sc1ccc2c(c1)OCO2 Amb2689430 [1,1,0,0,0,0|2,0,0]=4 4195 B11R2.36 Sc1ccc2ncoc2c1 Amb28072623 [1,1,0,0,0,0|2,0,0]=4 4196 B11R2.36 Sc1ccc2occc2c1 Amb24089279 [1,1,0,0,0,0|1,0,0]=3 4197 B11R2.36 [O-][n+]1ccc2ccoc2c1 Amb28182446 [1,1,0,0,0,0|2,0,0]=4 4198 B11R2.106 BrC1=CC=CC2N=NC=C12 Amb27227997 [1,1,0,0,0,0|1,0,1]=4 4199 B11R2.106 Brc1cccc2c1CC=C2 Amb20247104 [1,1,0,0,0,0|2,0,0]=4 4200 B11R2.106 Brc1cccc2c1CCO2 Amb22054550 [1,1,0,0,0,0|1,0,1]=4 4201 B11R2.106 Brc1cccc2c1OCC2 Amb18187519 [1,1,0,0,0,0|1,0,1]=4 4202 B11R2.106 Brc1cccc2c1OCO2 Amb33548833 [1,1,0,0,0,0|2,0,0]=4 4203 B11R2.106 Brc1cccc2ccoc12 Amb10069261 [1,1,0,0,0,0|1,0,0]=3 4204 B11R2.106 Brc1cccc2ccsc12 Amb6572040 [1,1,0,0,0,0|1,1,0]=4 4205 B11R2.106 Brc1cccc2cncn12 Amb22169741 [1,1,0,0,0,0|2,0,0]=4 4206 B11R2.106 Brc1cccc2cncn12 Amb30594754 [1,1,0,0,0,0|2,0,0]=4 4207 B11R2.106 Brc1cccc2cnnn12 Amb18187313 [1,1,0,0,0,0|2,0,0]=4 4208 B11R2.106 Brc1cccc2cnoc12 Amb19149301 [1,1,0,0,0,0|0,0,0]=2 4209 B11R2.106 Brc1cccc2cnsc12 Amb18771333 [1,1,0,0,0,0|0,1,0]=3 4210 B11R2.106 Brc1cccc2conc12 Amb18187785 [1,1,0,0,0,0|2,0,0]=4 4211 B11R2.106 Brc1cccc2ncoc12 Amb17570811 [1,1,0,0,0,0|2,0,0]=4 4212 B11R2.106 Brc1cccc2nncn12 Amb10067874 [1,1,0,0,0,0|2,0,0]=4 4213 B11R2.106 Brc1cccc2nnoc12 Amb18811019 [1,1,0,0,0,0|1,0,0]=3 4214 B11R2.106 Brc1cccc2nnsc12 Amb18771070 [1,1,0,0,0,0|1,1,0]=4 4215 B11R2.106 Brc1cccc2occc12 Amb16192002 [1,1,0,0,0,0|1,0,0]=3 4216 B11R2.106 Brc1cccc2ocnc12 Amb16185763 [1,1,0,0,0,0|2,0,0]=4 4217 B11R2.106 Brc1cccc2oncc12 Amb18187792 [1,1,0,0,0,0|0,0,0]=2 4218 B11R2.106 Brc1cccc2sccc12 Amb2447607 [1,1,0,0,0,0|1,1,0]=4 4219 B11R2.106 Brc1cccc2sncc12 Amb24331358 [1,1,0,0,0,0|0,1,0]=3 4220 B11R2.106 Brc1cccc2snnc12 Amb33330873 [1,1,0,0,0,0|1,1,0]=4 4221 B11R2.106 Brc1cccn2cncc12 Amb25861849 [1,1,0,0,0,0|2,0,0]=4 4222 B11R2.106 Brc1cccn2cnnc12 Amb19149043 [1,1,0,0,0,0|2,0,0]=4 4223 B11R2.106 Brc1cccn2nncc12 Amb18187312 [1,1,0,0,0,0|2,0,0]=4 4224 B11R2.106 Brc1ccnc2ccoc12 Amb27419817 [1,1,0,0,0,0|2,0,0]=4 4225 B11R2.106 Brc1ccnc2cnoc12 Amb18187627 [1,1,0,0,0,0|1,0,0]=3 4226 B11R2.106 Brc1ccnc2cnsc12 Amb18771092 [1,1,0,0,0,0|1,1,0]=4 4227 B11R2.106 Brc1ccnc2oncc12 Amb22496305 [1,1,0,0,0,0|1,0,0]=3 4228 B11R2.106 Brc1cncc2ccoc12 Amb18187811 [1,1,0,0,0,0|2,0,0]=4 4229 B11R2.106 Brc1nccc2ccoc12 Amb27823558 [1,1,0,0,0,0|2,0,0]=4 4230 B11R2.106 Brc1nccc2occc12 Amb18187770 [1,1,0,0,0,0|2,0,0]=4 4231 B11R2.106 Brc1ncnc2oncc12 Amb18187365 [1,1,0,0,0,0|2,0,0]=4 4232 B11R2.106 CC1=CC=CN2ONC=C12 Amb27147301 [1,1,0,0,0,0|1,0,1]=4 4233 B11R2.106 Cc1cccc2c1C=CC2 Amb22232331 [1,1,0,0,0,0|2,0,0]=4 4234 B11R2.106 Cc1cccc2c1CC=C2 Amb22406488 [1,1,0,0,0,0|2,0,0]=4 4235 B11R2.106 Cc1cccc2c1N=NC2 Amb28435446 [1,1,0,0,0,0|1,0,1]=4 4236 B11R2.106 Cc1cccc2ccoc12 Amb2444982 [1,1,0,0,0,0|1,0,0]=3 4237 B11R2.106 Cc1cccc2ccsc12 Amb19419751 [1,1,0,0,0,0|1,1,0]=4 4238 B11R2.106 Cc1cccc2cncn12 Amb22494013 [1,1,0,0,0,0|2,0,0]=4 4239 B11R2.106 Cc1cccc2cnsc12 Amb26622206 [1,1,0,0,0,0|0,1,0]=3 4240 B11R2.106 Cc1cccc2csnc12 Amb27445105 [1,1,0,0,0,0|2,0,0]=4 4241 B11R2.106 Cc1cccc2ncoc12 Amb17569953 [1,1,0,0,0,0|2,0,0]=4 4242 B11R2.106 Cc1cccc2nscc12 Amb24517093 [1,1,0,0,0,0|2,0,0]=4 4243 B11R2.106 Cc1cccc2sccc12 Amb21856961 [1,1,0,0,0,0|1,1,0]=4 4244 B11R2.106 Cc1cccc2sncc12 Amb24428918 [1,1,0,0,0,0|0,1,0]=3 4245 B11R2.106 Cc1cccn2cnnc12 Amb28239260 [1,1,0,0,0,0|2,0,0]=4 4246 B11R2.106 Cc1ccnc2occc12 Amb23437177 [1,1,0,0,0,0|2,0,0]=4 4247 B11R2.106 Cc1nccc2occc12 Amb23585452 [1,1,0,0,0,0|2,0,0]=4 4248 B11R2.106 Clc1cccc2c1C=CC2 Amb27237036 [1,1,0,0,0,0|2,0,0]=4 4249 B11R2.106 Clc1cccc2c1CC=C2 Amb2383766 [1,1,0,0,0,0|2,0,0]=4 4250 B11R2.106 Clc1cccc2c1CCO2 Amb8389512 [1,1,0,0,0,0|1,0,1]=4 4251 B11R2.106 Clc1cccc2c1OCC2 Amb20620687 [1,1,0,0,0,0|1,0,1]=4 4252 B11R2.106 Clc1cccc2ccoc12 Amb21856195 [1,1,0,0,0,0|1,0,0]=3 4253 B11R2.106 Clc1cccc2ccsc12 Amb19516069 [1,1,0,0,0,0|1,1,0]=4 4254 B11R2.106 Clc1cccc2cncn12 Amb25147799 [1,1,0,0,0,0|2,0,0]=4 4255 B11R2.106 Clc1cccc2cnoc12 Amb22751081 [1,1,0,0,0,0|0,0,0]=2 4256 B11R2.106 Clc1cccc2cnsc12 Amb28049336 [1,1,0,0,0,0|0,1,0]=3 4257 B11R2.106 Clc1cccc2csnc12 Amb27837779 [1,1,0,0,0,0|2,0,0]=4 4258 B11R2.106 Clc1cccc2ncoc12 Amb17570018 [1,1,0,0,0,0|2,0,0]=4 4259 B11R2.106 Clc1cccc2nncn12 Amb10067577 [1,1,0,0,0,0|2,0,0]=4 4260 B11R2.106 Clc1cccc2nnsc12 Amb2752979 [1,1,0,0,0,0|1,1,0]=4 4261 B11R2.106 Clc1cccc2nocc12 Amb27758905 [1,1,0,0,0,0|2,0,0]=4 4262 B11R2.106 Clc1cccc2nscc12 Amb27224886 [1,1,0,0,0,0|2,0,0]=4 4263 B11R2.106 Clc1cccc2oncc12 Amb22497808 [1,1,0,0,0,0|0,0,0]=2 4264 B11R2.106 Clc1cccc2sccc12 Amb22586109 [1,1,0,0,0,0|1,1,0]=4 4265 B11R2.106 Clc1cccc2sncc12 Amb24645158 [1,1,0,0,0,0|0,1,0]=3 4266 B11R2.106 Clc1cccn2cncc12 Amb28124649 [1,1,0,0,0,0|2,0,0]=4 4267 B11R2.106 Clc1cccn2cnnc12 Amb10067450 [1,1,0,0,0,0|2,0,0]=4 4268 B11R2.106 Clc1ccnc2ccoc12 Amb21960750 [1,1,0,0,0,0|2,0,0]=4 4269 B11R2.106 Clc1ccnc2occc12 Amb22002181 [1,1,0,0,0,0|2,0,0]=4 4270 B11R2.106 Clc1nccc2ccoc12 Amb10067872 [1,1,0,0,0,0|2,0,0]=4 4271 B11R2.106 Clc1nccc2occc12 Amb19958464 [1,1,0,0,0,0|2,0,0]=4 4272 B11R2.106 Clc1nccc2occc12 Amb2724787 [1,1,0,0,0,0|2,0,0]=4 4273 B11R2.106 Clc1ncnc2oncc12 Amb8878131 [1,1,0,0,0,0|2,0,0]=4 4274 B11R2.106 Fc1cccc2c1CC=C2 Amb2383767 [1,1,0,0,0,0|2,0,0]=4 4275 B11R2.106 Fc1cccc2c1OCC2 Amb23399921 [1,1,0,0,0,0|1,0,1]=4 4276 B11R2.106 Fc1cccc2c1OCO2 Amb21856737 [1,1,0,0,0,0|2,0,0]=4 4277 B11R2.106 Fc1cccc2ccoc12 Amb22372186 [1,1,0,0,0,0|1,0,0]=3 4278 B11R2.106 Fc1cccc2ccsc12 Amb22234737 [1,1,0,0,0,0|1,1,0]=4 4279 B11R2.106 Fc1cccc2cncn12 Amb26982081 [1,1,0,0,0,0|2,0,0]=4 4280 B11R2.106 Fc1cccc2cnoc12 Amb33493352 [1,1,0,0,0,0|0,0,0]=2 4281 B11R2.106 Fc1cccc2cnsc12 Amb26452227 [1,1,0,0,0,0|0,1,0]=3 4282 B11R2.106 Fc1cccc2ncoc12 Amb17569957 [1,1,0,0,0,0|2,0,0]=4 4283 B11R2.106 Fc1cccc2occc12 Amb20241435 [1,1,0,0,0,0|1,0,0]=3 4284 B11R2.106 Fc1cccc2ocnc12 Amb28050333 [1,1,0,0,0,0|2,0,0]=4 4285 B11R2.106 Fc1cccc2oncc12 Amb22497809 [1,1,0,0,0,0|0,0,0]=2 4286 B11R2.106 Fc1cccc2sccc12 Amb20171578 [1,1,0,0,0,0|1,1,0]=4 4287 B11R2.106 Fc1cccn2cnnc12 Amb25844367 [1,1,0,0,0,0|2,0,0]=4 4288 B11R2.106 Fc1cncc2ccoc12 Amb27444117 [1,1,0,0,0,0|2,0,0]=4 4289 B11R2.106 Fc1nccc2occc12 Amb33621245 [1,1,0,0,0,0|2,0,0]=4 4290 B11R2.106 Ic1cccc2c1CCO2 Amb23399919 [1,1,0,0,0,0|1,0,1]=4 4291 B11R2.106 Ic1cccc2c1OCC2 Amb7990028 [1,1,0,0,0,0|1,0,1]=4 4292 B11R2.106 Ic1cccc2c1OCO2 Amb21858263 [1,1,0,0,0,0|2,0,0]=4 4293 B11R2.106 Ic1cccc2ccoc12 Amb23401835 [1,1,0,0,0,0|1,0,0]=3 4294 B11R2.106 Ic1cccc2ccsc12 Amb26974076 [1,1,0,0,0,0|1,1,0]=4 4295 B11R2.106 Ic1cccc2cncn12 Amb26935886 [1,1,0,0,0,0|2,0,0]=4 4296 B11R2.106 Ic1cccc2cnnn12 Amb33465438 [1,1,0,0,0,0|2,0,0]=4 4297 B11R2.106 Ic1cccc2cnsc12 Amb25325115 [1,1,0,0,0,0|0,1,0]=3 4298 B11R2.106 Ic1cccc2nnsc12 Amb27231479 [1,1,0,0,0,0|1,1,0]=4 4299 B11R2.106 Ic1cccc2ocnc12 Amb22736067 [1,1,0,0,0,0|2,0,0]=4 4300 B11R2.106 Ic1ccnc2occc12 Amb30869427 [1,1,0,0,0,0|2,0,0]=4 4301 B11R2.106 Nc1cccc2c1CC=C2 Amb24539420 [1,1,0,0,0,0|2,0,0]=4 4302 B11R2.106 Nc1cccc2c1CCO2 Amb16233744 [1,1,0,0,0,0|1,0,1]=4 4303 B11R2.106 Nc1cccc2c1OCC2 Amb7990030 [1,1,0,0,0,0|1,0,1]=4 4304 B11R2.106 Nc1cccc2c1OCO2 Amb18547318 [1,1,0,0,0,0|2,0,0]=4 4305 B11R2.106 Nc1cccc2c1OCO2 Amb32751243 [1,1,0,0,0,0|2,0,0]=4 4306 B11R2.106 Nc1cccc2ccoc12 Amb15772371 [1,1,0,0,0,0|1,0,0]=3 4307 B11R2.106 Nc1cccc2ccoc12 Amb31291351 [1,1,0,0,0,0|1,0,0]=3 4308 B11R2.106 Nc1cccc2ccsc12 Amb17570001 [1,1,0,0,0,0|1,1,0]=4 4309 B11R2.106 Nc1cccc2ccsc12 Amb28555542 [1,1,0,0,0,0|1,1,0]=4 4310 B11R2.106 Nc1cccc2cncn12 Amb22751511 [1,1,0,0,0,0|2,0,0]=4 4311 B11R2.106 Nc1cccc2cnnn12 Amb25871316 [1,1,0,0,0,0|2,0,0]=4 4312 B11R2.106 Nc1cccc2cnoc12 Amb22233975 [1,1,0,0,0,0|0,0,0]=2 4313 B11R2.106 Nc1cccc2cnsc12 Amb18201818 [1,1,0,0,0,0|0,1,0]=3 4314 B11R2.106 Nc1cccc2conc12 Amb18203159 [1,1,0,0,0,0|2,0,0]=4 4315 B11R2.106 Nc1cccc2csnc12 Amb22736384 [1,1,0,0,0,0|2,0,0]=4 4316 B11R2.106 Nc1cccc2ncoc12 Amb17231888 [1,1,0,0,0,0|2,0,0]=4 4317 B11R2.106 Nc1cccc2nncn12 Amb25174542 [1,1,0,0,0,0|2,0,0]=4 4318 B11R2.106 Nc1cccc2nnoc12 Amb18203123 [1,1,0,0,0,0|1,0,0]=3 4319 B11R2.106 Nc1cccc2nnsc12 Amb18201617 [1,1,0,0,0,0|1,1,0]=4 4320 B11R2.106 Nc1cccc2nocc12 Amb18203157 [1,1,0,0,0,0|2,0,0]=4 4321 B11R2.106 Nc1cccc2nscc12 Amb22736314 [1,1,0,0,0,0|2,0,0]=4 4322 B11R2.106 Nc1cccc2occc12 Amb17569954 [1,1,0,0,0,0|1,0,0]=3 4323 B11R2.106 Nc1cccc2occc12 Amb35750149 [1,1,0,0,0,0|1,0,0]=3 4324 B11R2.106 Nc1cccc2ocnc12 Amb2433128 [1,1,0,0,0,0|2,0,0]=4 4325 B11R2.106 Nc1cccc2ocnc12 Amb30586492 [1,1,0,0,0,0|2,0,0]=4 4326 B11R2.106 Nc1cccc2oncc12 Amb22495450 [1,1,0,0,0,0|0,0,0]=2 4327 B11R2.106 Nc1cccc2sccc12 Amb22499707 [1,1,0,0,0,0|1,1,0]=4 4328 B11R2.106 Nc1cccc2sccc12 Amb8439504 [1,1,0,0,0,0|1,1,0]=4 4329 B11R2.106 Nc1cccn2cncc12 Amb24081863 [1,1,0,0,0,0|2,0,0]=4 4330 B11R2.106 Nc1cccn2cnnc12 Amb15701627 [1,1,0,0,0,0|2,0,0]=4 4331 B11R2.106 Nc1cccn2nncc12 Amb27963366 [1,1,0,0,0,0|2,0,0]=4 4332 B11R2.106 Nc1ccnc2occc12 Amb28286823 [1,1,0,0,0,0|2,0,0]=4 4333 B11R2.106 Nc1ccnc2oncc12 Amb27193848 [1,1,0,0,0,0|1,0,0]=3 4334 B11R2.106 Nc1cncc2ccoc12 Amb27193901 [1,1,0,0,0,0|2,0,0]=4 4335 B11R2.106 Nc1nccc2occc12 Amb23590989 [1,1,0,0,0,0|2,0,0]=4 4336 B11R2.106 O=C1NC=Cc2ccoc21 Amb21927943 [1,1,0,0,0,0|2,0,0]=4 4337 B11R2.106 O=C1NC=Cc2occc21 Amb19267112 [1,1,0,0,0,0|2,0,0]=4 4338 B11R2.106 Oc1cccc2c1C=CC2 Amb26875548 [1,1,0,0,0,0|2,0,0]=4 4339 B11R2.106 Oc1cccc2c1CCO2 Amb26621958 [1,1,0,0,0,0|1,0,1]=4 4340 B11R2.106 Oc1cccc2c1OCC2 Amb22264532 [1,1,0,0,0,0|1,0,1]=4 4341 B11R2.106 Oc1cccc2c1OCO2 Amb24066383 [1,1,0,0,0,0|2,0,0]=4 4342 B11R2.106 Oc1cccc2ccoc12 Amb10070901 [1,1,0,0,0,0|1,0,0]=3 4343 B11R2.106 Oc1cccc2ccsc12 Amb18644431 [1,1,0,0,0,0|1,1,0]=4 4344 B11R2.106 Oc1cccc2cncn12 Amb27972019 [1,1,0,0,0,0|2,0,0]=4 4345 B11R2.106 Oc1cccc2cnoc12 Amb15701577 [1,1,0,0,0,0|0,0,0]=2 4346 B11R2.106 Oc1cccc2cnsc12 Amb28198574 [1,1,0,0,0,0|0,1,0]=3 4347 B11R2.106 Oc1cccc2csnc12 Amb27882576 [1,1,0,0,0,0|2,0,0]=4 4348 B11R2.106 Oc1cccc2ncoc12 Amb26949852 [1,1,0,0,0,0|2,0,0]=4 4349 B11R2.106 Oc1cccc2nnsc12 Amb27424823 [1,1,0,0,0,0|1,1,0]=4 4350 B11R2.106 Oc1cccc2nscc12 Amb28315796 [1,1,0,0,0,0|2,0,0]=4 4351 B11R2.106 Oc1cccc2occc12 Amb18124403 [1,1,0,0,0,0|1,0,0]=3 4352 B11R2.106 Oc1cccc2ocnc12 Amb10603972 [1,1,0,0,0,0|2,0,0]=4 4353 B11R2.106 Oc1cccc2oncc12 Amb23437223 [1,1,0,0,0,0|0,0,0]=2 4354 B11R2.106 Oc1cccc2onnc12 Amb28368671 [1,1,0,0,0,0|1,0,0]=3 4355 B11R2.106 Oc1cccc2sccc12 Amb18125084 [1,1,0,0,0,0|1,1,0]=4 4356 B11R2.106 Oc1cccc2sncc12 Amb24331356 [1,1,0,0,0,0|0,1,0]=3 4357 B11R2.106 Oc1cccn2cnnc12 Amb33712853 [1,1,0,0,0,0|2,0,0]=4 4358 B11R2.106 Oc1ccnc2ccoc12 Amb33624225 [1,1,0,0,0,0|2,0,0]=4 4359 B11R2.106 Oc1ccnc2occc12 Amb27225150 [1,1,0,0,0,0|2,0,0]=4 4360 B11R2.106 Oc1cncc2ccoc12 Amb28250077 [1,1,0,0,0,0|2,0,0]=4 4361 B11R2.106 S=C1NC=Cc2occc21 Amb25939581 [1,1,0,0,0,0|2,0,0]=4 4362 B11R2.106 Sc1cccc2c1OCC2 Amb33416983 [1,1,0,0,0,0|1,0,1]=4 4363 B11R2.106 Sc1cccc2c1OCO2 Amb27410459 [1,1,0,0,0,0|2,0,0]=4 4364 B11R2.106 Sc1cccc2ocnc12 Amb27971096 [1,1,0,0,0,0|2,0,0]=4 4365 B11R2.106 Sc1ncnc2oncc12 Amb13881471 [1,1,0,0,0,0|2,0,0]=4 4366 B11R2.106 [O-][n+]1cccc2ccoc21 Amb22234598 [1,1,0,0,0,0|2,0,0]=4 4367 B11R2.106 [O-][n+]1cccc2occc21 Amb13883494 [1,1,0,0,0,0|2,0,0]=4 4368 B11R2.66 Cc1noc2oc(Br)cc12 Amb18787304 [0,1,0,0,1,0|2,0,0]=4 4369 B11R2.191 OCC1=NN=C2C=CC=C21 Amb27970989 [0,1,0,0,1,0|1,0,0]=3 4370 B11R2.191 OCc1noc2ccsc12 Amb25916465 [0,1,0,0,1,0|1,0,0]=3 4371 B11R2.54 CC1C(=O)c2ccccc21 Amb27602983 [0,1,0,0,1,0|1,0,1]=4 4372 B11R2.54 C[C@H]1c2ccccc2[C@@H]1O Amb27484595 [0,1,0,0,1,0|1,0,1]=4 4373 B11R2.54 O=C1C(=O)c2ccccc21 Amb18048412 [0,1,0,0,1,0|1,0,1]=4 4374 B11R2.54 O=C1c2ccccc2C1Cl Amb21948336 [0,1,0,0,1,0|1,0,1]=4 4375 B11R2.54 O=C1c2ccccc2C1O Amb27164695 [0,1,0,0,1,0|1,0,1]=4 4376 B11R2.54 O[C@H]1c2ccccc2[C@H]1O Amb27406819 [0,1,0,0,1,0|1,0,1]=4 4377 B11R2.59 CC1(O)Cc2ccccc21 Amb17844000 [0,1,0,0,1,0|1,0,1]=4 4378 B11R2.59 [2H]C1(O)Cc2ccccc21 Amb17778677 [0,1,0,0,1,0|1,0,1]=4 4379 B11R2.104 Cc1cccc2c1CC2=O Amb17843957 [0,1,0,0,1,0|1,0,1]=4 4380 B11R2.117 Cc1ccc2c(c1)C(=O)C2 Amb17843960 [0,1,0,0,1,0|1,0,1]=4 4381 B11R2.117 O=C1Cc2ccc(Cl)cc21 Amb28253954 [0,1,0,0,1,0|1,0,1]=4 4382 B11R2.117 O=C1Cc2ccc(F)cc21 Amb25729418 [0,1,0,0,1,0|1,0,1]=4 4383 B11R2.117 OC1Cc2ccc(Cl)cc21 Amb28207165 [0,1,0,0,1,0|1,0,1]=4 4384 B11R2.117 OC1Cc2ccc(F)cc21 Amb27198002 [0,1,0,0,1,0|1,0,1]=4 4385 B11R2.363 Cc1ccc2c(c1)CC2=O Amb17843959 [0,1,0,0,1,0|1,0,1]=4 4386 B11R2.363 Nc1ccc2c(c1)NC2O Amb27214112 [0,1,0,0,1,0|0,0,2]=4 4387 B11R2.363 O=C1Cc2cc(Br)ccc21 Amb27839410 [0,1,0,0,1,0|1,0,1]=4 4388 B11R2.363 O=C1Cc2cc(O)ccc21 Amb27802518 [0,1,0,0,1,0|1,0,1]=4 4389 B11R2.468 Cc1cccc2c1C(=O)C2 Amb27770444 [0,1,0,0,1,0|1,0,1]=4 4390 B11R2.468 O=C1Cc2cccc(Br)c21 Amb17843975 [0,1,0,0,1,0|1,0,1]=4 4391 B11R2.468 O=C1Cc2cccc(Cl)c21 Amb21948281 [0,1,0,0,1,0|1,0,1]=4 4392 B11R2.468 O=C1Cc2cccc(F)c21 Amb17778729 [0,1,0,0,1,0|1,0,1]=4 4393 B11R2.468 OC1Cc2cccc(Cl)c21 Amb28350295 [0,1,0,0,1,0|1,0,1]=4 4394 B11R2.468 OC1Cc2cccc(F)c21 Amb17778679 [0,1,0,0,1,0|1,0,1]=4 4395 B11R2.988 CCC1=Cc2ccccc21 Amb27641412 [0,1,0,0,1,0|2,0,0]=4 4396 B11R2.988 COC1=Cc2ccccc21 Amb27267205 [0,1,0,0,1,0|1,0,0]=3 4397 B11R2.988 COC1Cc2ccccc21 Amb24455687 [0,1,0,0,1,0|1,0,1]=4 4398 B11R2.988 N#CC1=Cc2ccccc21 Amb22227852 [0,1,0,0,1,0|2,0,0]=4 4399 B11R2.988 OCC1Cc2ccccc21 Amb8395939 [0,1,0,0,1,0|1,0,1]=4 4400 B11R2.988 O\N=C1/Cc2ccccc21 Amb3862130 [0,1,0,0,1,0|1,0,0]=3 4401 B13R2.32 Brc1ncc2ccccc2c1Br Amb2609660 [0,1,0,0,0,1|2,0,0]=4 4402 B13R2.32 C=C1COc2ccccc2C1=O Amb18063792 [0,1,0,0,0,1|2,0,0]=4 4403 B13R2.32 C=C1COc2ccccc2C1O Amb27587627 [0,1,0,0,0,1|2,0,0]=4 4404 B13R2.32 CC1=COc2ccccc2C1=O Amb18048475 [0,1,0,0,0,1|2,0,0]=4 4405 B13R2.32 CC1=NNc2ccccc2C1=O Amb22522609 [0,1,0,0,0,1|2,0,0]=4 4406 B13R2.32 CN1C(=O)COc2ccccc21 Amb1351378 [0,1,0,0,0,1|1,0,1]=4 4407 B13R2.32 Cc1c(O)ccc2ccccc12 Amb4016608 [0,1,0,0,0,1|2,0,0]=4 4408 B13R2.32 Cc1c(O)cnc2ccccc12 Amb18645166 [0,1,0,0,0,1|2,0,0]=4 4409 B13R2.32 Cc1ncc2ccccc2c1Br Amb10573335 [0,1,0,0,0,1|2,0,0]=4 4410 B13R2.32 Cc1ncc2ccccc2c1C Amb23560126 [0,1,0,0,0,1|2,0,0]=4 4411 B13R2.32 Cc1ncc2ccccc2c1O Amb18126185 [0,1,0,0,0,1|2,0,0]=4 4412 B13R2.32 Cc1nnc2ccccc2c1Cl Amb22522610 [0,1,0,0,0,1|2,0,0]=4 4413 B13R2.32 Clc1c(Br)nnc2ccccc12 Amb20669156 [0,1,0,0,0,1|2,0,0]=4 4414 B13R2.32 Clc1ncc2ccccc2c1Br Amb24381966 [0,1,0,0,0,1|2,0,0]=4 4415 B13R2.32 Clc1ncc2ccccc2c1Cl Amb27434433 [0,1,0,0,0,1|2,0,0]=4 4416 B13R2.32 Clc1nnc2ccccc2c1Cl Amb33624321 [0,1,0,0,0,1|2,0,0]=4 4417 B13R2.32 N=C1COc2ccccc2C1=O Amb27186345 [0,1,0,0,0,1|2,0,0]=4 4418 B13R2.32 NC1=COc2ccccc2C1=O Amb23399677 [0,1,0,0,0,1|2,0,0]=4 4419 B13R2.32 NC1c2ccccc2OCC1O Amb18646282 [0,1,0,0,0,1|1,0,1]=4 4420 B13R2.32 N[C@H]1c2ccccc2OC[C@@H]1O Amb26351500 [0,1,0,0,0,1|1,0,1]=4 4421 B13R2.32 N[C@H]1c2ccccc2OC[C@H]1O Amb22747398 [0,1,0,0,0,1|1,0,1]=4 4422 B13R2.32 Nc1c(Br)ncc2ccccc12 Amb18658784 [0,1,0,0,0,1|2,0,0]=4 4423 B13R2.32 Nc1c(Cl)ncc2ccccc12 Amb10603681 [0,1,0,0,0,1|2,0,0]=4 4424 B13R2.32 Nc1c(I)ncc2ccccc12 Amb27847148 [0,1,0,0,0,1|2,0,0]=4 4425 B13R2.32 Nc1c(O)ccc2ccccc12 Amb1088955 [0,1,0,0,0,1|2,0,0]=4 4426 B13R2.32 Nc1c(O)ccc2ccccc12 Amb2592795 [0,1,0,0,0,1|2,0,0]=4 4427 B13R2.32 Nc1c(O)ncc2ccccc12 Amb25249568 [0,1,0,0,0,1|1,0,0]=3 4428 B13R2.32 Nc1ncc2ccccc2c1Cl Amb22498015 [0,1,0,0,0,1|2,0,0]=4 4429 B13R2.32 Nc1ncc2ccccc2c1I Amb22498014 [0,1,0,0,0,1|2,0,0]=4 4430 B13R2.32 O=C1C(Br)=COc2ccccc21 Amb19664799 [0,1,0,0,0,1|2,0,0]=4 4431 B13R2.32 O=C1C(Br)=NNc2ccccc21 Amb22057604 [0,1,0,0,0,1|2,0,0]=4 4432 B13R2.32 O=C1C(Cl)=COc2ccccc21 Amb27492891 [0,1,0,0,0,1|2,0,0]=4 4433 B13R2.32 O=C1C(Cl)=NNc2ccccc21 Amb24062609 [0,1,0,0,0,1|2,0,0]=4 4434 B13R2.32 O=C1C(I)=COc2ccccc21 Amb19887490 [0,1,0,0,0,1|2,0,0]=4 4435 B13R2.32 O=C1C(O)=CSc2ccccc21 Amb20252018 [0,1,0,0,0,1|1,1,0]=4 4436 B13R2.32 O=C1COc2ccccc2N1O Amb2423861 [0,1,0,0,0,1|1,0,1]=4 4437 B13R2.32 O=C1N=Cc2ccccc2N1O Amb28248668 [0,1,0,0,0,1|1,0,1]=4 4438 B13R2.32 O=C1c2ccccc2N=NN1O Amb19654296 [0,1,0,0,0,1|2,0,0]=4 4439 B13R2.32 O=C1c2ccccc2OCC1O Amb26593098 [0,1,0,0,0,1|1,0,1]=4 4440 B13R2.32 OC1COc2ccccc2C1O Amb27164472 [0,1,0,0,0,1|1,0,1]=4 4441 B13R2.32 O[C@H]1COc2ccccc2[C@H]1O Amb27625657 [0,1,0,0,0,1|1,0,1]=4 4442 B13R2.32 Oc1c(Br)nnc2ccccc12 Amb18659029 [0,1,0,0,0,1|2,0,0]=4 4443 B13R2.32 Oc1c(Cl)ncc2ccccc12 Amb22284687 [0,1,0,0,0,1|2,0,0]=4 4444 B13R2.32 Oc1c(I)nnc2ccccc12 Amb22057786 [0,1,0,0,0,1|2,0,0]=4 4445 B13R2.32 Oc1ccc2ccccc2c1Br Amb6399651 [0,1,0,0,0,1|2,0,0]=4 4446 B13R2.32 Oc1ccc2ccccc2c1Cl Amb17594574 [0,1,0,0,0,1|2,0,0]=4 4447 B13R2.32 Oc1ccc2ccccc2c1F Amb18645624 [0,1,0,0,0,1|2,0,0]=4 4448 B13R2.32 Oc1ccc2ccccc2c1I Amb2782872 [0,1,0,0,0,1|2,0,0]=4 4449 B13R2.32 Oc1ccc2ccccc2c1O Amb18054059 [0,1,0,0,0,1|2,0,0]=4 4450 B13R2.32 Oc1ccc2ccccc2c1S Amb20093303 [0,1,0,0,0,1|2,0,0]=4 4451 B13R2.32 Oc1cnc2ccccc2c1Br Amb8438944 [0,1,0,0,0,1|2,0,0]=4 4452 B13R2.32 Oc1cnc2ccccc2c1Cl Amb18648301 [0,1,0,0,0,1|2,0,0]=4 4453 B13R2.32 Oc1cnc2ccccc2c1Cl Amb32653571 [0,1,0,0,0,1|2,0,0]=4 4454 B13R2.32 Oc1cnc2ccccc2c1F Amb27592408 [0,1,0,0,0,1|2,0,0]=4 4455 B13R2.32 Oc1cnc2ccccc2c1I Amb22752326 [0,1,0,0,0,1|2,0,0]=4 4456 B13R2.32 Oc1cnc2ccccc2c1O Amb5718045 [0,1,0,0,0,1|2,0,0]=4 4457 B13R2.32 Oc1cnc2ccccc2c1S Amb18127892 [0,1,0,0,0,1|2,0,0]=4 4458 B13R2.32 [NH3+]c1c(O)ccc2ccccc12 Amb22489532 [0,1,0,0,0,1|2,0,0]=4 4459 B13R2.57 BrCc1ncc2ccccc2n1 Amb27172666 [0,1,0,0,0,1|2,0,0]=4 4460 B13R2.57 C#Cc1cc2ccccc2nn1 Amb22752028 [0,1,0,0,0,1|2,0,0]=4 4461 B13R2.57 CNc1ncc2ccccc2n1 Amb25363322 [0,1,0,0,0,1|2,0,0]=4 4462 B13R2.57 COC1=Nc2ccccc2CC1 Amb27179706 [0,1,0,0,0,1|2,0,0]=4 4463 B13R2.57 COC1=Nc2ccccc2OC1 Amb33218462 [0,1,0,0,0,1|1,0,0]=3 4464 B13R2.57 COC1=Nc2ccccc2SC1 Amb24116116 [0,1,0,0,0,1|1,1,0]=4 4465 B13R2.57 COc1cc2ccccc2cn1 Amb25861237 [0,1,0,0,0,1|1,0,0]=3 4466 B13R2.57 COc1cc2ccncc2cn1 Amb28250059 [0,1,0,0,0,1|2,0,0]=4 4467 B13R2.57 COc1cc2ncccc2cn1 Amb27847145 [0,1,0,0,0,1|2,0,0]=4 4468 B13R2.57 COc1ccc2ccccc2c1 Amb2610832 [0,1,0,0,0,1|2,0,0]=4 4469 B13R2.57 COc1ccc2ccccc2n1 Amb20171196 [0,1,0,0,0,1|2,0,0]=4 4470 B13R2.57 COc1cnc2ccccc2c1 Amb19957896 [0,1,0,0,0,1|2,0,0]=4 4471 B13R2.57 COc1ncc2ccccc2n1 Amb22745160 [0,1,0,0,0,1|1,0,0]=3 4472 B13R2.57 CSC1=NCc2ccccc2N1 Amb10976190 [0,1,0,0,0,1|1,1,0]=4 4473 B13R2.57 CSC1=NCc2ccccc2N1 Amb24678310 [0,1,0,0,0,1|1,1,0]=4 4474 B13R2.57 ClCC1=Cc2ccccc2OC1 Amb24470057 [0,1,0,0,0,1|2,0,0]=4 4475 B13R2.57 ClCc1cc2ccccc2cn1 Amb20620761 [0,1,0,0,0,1|2,0,0]=4 4476 B13R2.57 ClCc1cc2ccccc2cn1 Amb22235579 [0,1,0,0,0,1|2,0,0]=4 4477 B13R2.57 ClCc1ncc2ccccc2n1 Amb24065130 [0,1,0,0,0,1|2,0,0]=4 4478 B13R2.57 ClCc1nnc2ccccc2n1 Amb25035078 [0,1,0,0,0,1|2,0,0]=4 4479 B13R2.57 N#CC1=COc2ccccc2O1 Amb27416465 [0,1,0,0,0,1|2,0,0]=4 4480 B13R2.57 N#CC1=Cc2ccccc2OC1 Amb1106140 [0,1,0,0,0,1|2,0,0]=4 4481 B13R2.57 N#CC1=NCc2ccccc2N1 Amb19866560 [0,1,0,0,0,1|2,0,0]=4 4482 B13R2.57 N#Cc1cc2ccccc2cn1 Amb8395995 [0,1,0,0,0,1|2,0,0]=4 4483 B13R2.57 NCC1=COc2ccccc2O1 Amb18645814 [0,1,0,0,0,1|2,0,0]=4 4484 B13R2.57 NCC1=Cc2ccccc2OC1 Amb22642376 [0,1,0,0,0,1|2,0,0]=4 4485 B13R2.57 NCc1cc2ccccc2cn1 Amb22728928 [0,1,0,0,0,1|2,0,0]=4 4486 B13R2.57 NCc1cc2ccccc2cn1 Amb8010863 [0,1,0,0,0,1|2,0,0]=4 4487 B13R2.57 NCc1cc2ccccc2nn1 Amb18830354 [0,1,0,0,0,1|2,0,0]=4 4488 B13R2.57 NCc1ncc2ccccc2n1 Amb18137485 [0,1,0,0,0,1|2,0,0]=4 4489 B13R2.57 NCc1nnc2ccccc2n1 Amb18830191 [0,1,0,0,0,1|2,0,0]=4 4490 B13R2.57 NNC1=Nc2ccccc2OC1 Amb19852876 [0,1,0,0,0,1|2,0,0]=4 4491 B13R2.57 NNc1cc2ccccc2cn1 Amb5494121 [0,1,0,0,0,1|2,0,0]=4 4492 B13R2.57 NNc1ncc2ccccc2n1 Amb27655524 [0,1,0,0,0,1|2,0,0]=4 4493 B13R2.57 N\N=C1\COc2ccccc2C1 Amb27752198 [0,1,0,0,0,1|2,0,0]=4 4494 B13R2.57 O=CC1=COc2ccccc2O1 Amb25348637 [0,1,0,0,0,1|1,0,1]=4 4495 B13R2.57 O=CC1=Cc2ccccc2OC1 Amb1158025 [0,1,0,0,0,1|1,0,1]=4 4496 B13R2.57 O=Cc1cc2ccccc2cn1 Amb8010573 [0,1,0,0,0,1|1,0,1]=4 4497 B13R2.57 OCC1=CNc2ccccc2N1 Amb24309070 [0,1,0,0,0,1|2,0,0]=4 4498 B13R2.57 OCC1=Cc2ccccc2OC1 Amb2723365 [0,1,0,0,0,1|1,0,0]=3 4499 B13R2.57 OCC1=Cc2ccccc2SS1 Amb27589744 [0,1,0,0,0,1|1,1,0]=4 4500 B13R2.57 OCC1COc2ccccc2C1 Amb2723392 [0,1,0,0,0,1|1,0,1]=4 4501 B13R2.57 OCC1COc2ccccc2N1 Amb22002592 [0,1,0,0,0,1|1,0,1]=4 4502 B13R2.57 OCC1COc2ccccc2O1 Amb6335233 [0,1,0,0,0,1|1,0,1]=4 4503 B13R2.57 OC[C@@H]1COc2ccccc2C1 Amb27829913 [0,1,0,0,0,1|1,0,1]=4 4504 B13R2.57 OC[C@@H]1Cc2ccccc2C=N1 Amb28350417 [0,1,0,0,0,1|1,0,1]=4 4505 B13R2.57 OC[C@H]1COc2ccccc2C1 Amb28065246 [0,1,0,0,0,1|1,0,1]=4 4506 B13R2.57 OC[C@H]1COc2ccccc2O1 Amb20242972 [0,1,0,0,0,1|1,0,1]=4 4507 B13R2.57 OCc1cc2ccccc2cn1 Amb8439028 [0,1,0,0,0,1|1,0,0]=3 4508 B13R2.57 OCc1ccc2ccccc2c1 Amb2389960 [0,1,0,0,0,1|2,0,0]=4 4509 B13R2.57 OCc1ccc2ccccc2n1 Amb1154605 [0,1,0,0,0,1|2,0,0]=4 4510 B13R2.57 OCc1cnc2ccccc2c1 Amb1995109 [0,1,0,0,0,1|2,0,0]=4 4511 B13R2.57 OCc1cnc2ccccc2c1 Amb20668047 [0,1,0,0,0,1|2,0,0]=4 4512 B13R2.57 OCc1cnc2ccccc2n1 Amb33532423 [0,1,0,0,0,1|2,0,0]=4 4513 B13R2.57 OCc1nnc2ccccc2n1 Amb26374373 [0,1,0,0,0,1|1,0,0]=3 4514 B13R2.57 O\N=C1/COc2ccccc2N1 Amb27174281 [0,1,0,0,0,1|1,0,0]=3 4515 B13R2.57 O\N=C1\CCc2ccccc2C1 Amb27223803 [0,1,0,0,0,1|2,0,0]=4 4516 B13R2.57 O\N=C1\CNc2ccccc2N1 Amb27751194 [0,1,0,0,0,1|2,0,0]=4 4517 B13R2.57 O\N=C1\COc2ccccc2C1 Amb28313271 [0,1,0,0,0,1|1,0,0]=3 4518 B13R2.155 Brc1ccc2cnc(Br)cc2c1 Amb27646822 [0,1,0,0,0,1|2,0,0]=4 4519 B13R2.155 Brc1ccc2cnc(I)nc2c1 Amb25159687 [0,1,0,0,0,1|2,0,0]=4 4520 B13R2.155 Cc1cc2cc(Br)ccc2cn1 Amb23401576 [0,1,0,0,0,1|2,0,0]=4 4521 B13R2.155 Cc1cc2cc(Cl)ccc2cn1 Amb21964541 [0,1,0,0,0,1|2,0,0]=4 4522 B13R2.155 Cc1cc2cc(F)ccc2cn1 Amb22586589 [0,1,0,0,0,1|2,0,0]=4 4523 B13R2.155 Cc1cc2cc(N)ccc2cn1 Amb28324250 [0,1,0,0,0,1|2,0,0]=4 4524 B13R2.155 Cc1ccc2c(c1)CC(O)CO2 Amb25877738 [0,1,0,0,0,1|1,0,1]=4 4525 B13R2.155 Cc1ccc2c(c1)NC(=O)CO2 Amb1950694 [0,1,0,0,0,1|1,0,1]=4 4526 B13R2.155 Cc1ccc2c(c1)NC(=O)N=C2 Amb24468183 [0,1,0,0,0,1|1,0,1]=4 4527 B13R2.155 Cc1ccc2c(c1)NC(=S)CO2 Amb20407671 [0,1,0,0,0,1|1,1,0]=4 4528 B13R2.155 Cc1ccc2ccc(O)cc2c1 Amb18645051 [0,1,0,0,0,1|2,0,0]=4 4529 B13R2.155 Cc1ccc2cnc(Br)nc2c1 Amb23400709 [0,1,0,0,0,1|2,0,0]=4 4530 B13R2.155 Cc1ccc2cnc(C)cc2c1 Amb24085597 [0,1,0,0,0,1|2,0,0]=4 4531 B13R2.155 Cc1ccc2cnc(Cl)cc2c1 Amb24744437 [0,1,0,0,0,1|2,0,0]=4 4532 B13R2.155 Cc1ccc2cnc(Cl)nc2c1 Amb23400026 [0,1,0,0,0,1|2,0,0]=4 4533 B13R2.155 Cc1ccc2cnc(N)cc2c1 Amb22234743 [0,1,0,0,0,1|2,0,0]=4 4534 B13R2.155 Cc1ccc2cnc(N)nc2c1 Amb23400710 [0,1,0,0,0,1|2,0,0]=4 4535 B13R2.155 Cc1ccc2ncc(O)cc2c1 Amb8506040 [0,1,0,0,0,1|2,0,0]=4 4536 B13R2.155 Cc1ncc2ccc(Br)cc2n1 Amb21964485 [0,1,0,0,0,1|2,0,0]=4 4537 B13R2.155 Cc1ncc2ccc(N)cc2n1 Amb23401001 [0,1,0,0,0,1|2,0,0]=4 4538 B13R2.155 Cc1nnc2ccc(N)cc2n1 Amb28282770 [0,1,0,0,0,1|2,0,0]=4 4539 B13R2.155 Clc1cc2cc(Br)ccc2cn1 Amb16185765 [0,1,0,0,0,1|2,0,0]=4 4540 B13R2.155 Clc1ccc2cnc(Br)cc2c1 Amb21927750 [0,1,0,0,0,1|2,0,0]=4 4541 B13R2.155 Clc1ccc2cnc(Br)nc2c1 Amb25331988 [0,1,0,0,0,1|2,0,0]=4 4542 B13R2.155 Clc1ccc2cnc(Cl)cc2c1 Amb24634977 [0,1,0,0,0,1|2,0,0]=4 4543 B13R2.155 Clc1ccc2cnc(Cl)nc2c1 Amb22756153 [0,1,0,0,0,1|2,0,0]=4 4544 B13R2.155 Clc1ncc2ccc(Br)cc2n1 Amb10603902 [0,1,0,0,0,1|2,0,0]=4 4545 B13R2.155 Fc1cc2cc(Br)ccc2cn1 Amb21963499 [0,1,0,0,0,1|2,0,0]=4 4546 B13R2.155 Fc1ccc2cnc(Br)nc2c1 Amb27604384 [0,1,0,0,0,1|2,0,0]=4 4547 B13R2.155 Fc1ccc2cnc(Cl)cc2c1 Amb26458404 [0,1,0,0,0,1|2,0,0]=4 4548 B13R2.155 Fc1ccc2cnc(Cl)nc2c1 Amb17949580 [0,1,0,0,0,1|2,0,0]=4 4549 B13R2.155 NC1=Nc2cc(N)ccc2OC1 Amb18122008 [0,1,0,0,0,1|2,0,0]=4 4550 B13R2.155 Nc1cc2cc(Br)ccc2cn1 Amb19517021 [0,1,0,0,0,1|2,0,0]=4 4551 B13R2.155 Nc1cc2cc(Cl)ccc2cn1 Amb22499392 [0,1,0,0,0,1|2,0,0]=4 4552 B13R2.155 Nc1cc2cc(Cl)ccc2nn1 Amb27407804 [0,1,0,0,0,1|2,0,0]=4 4553 B13R2.155 Nc1cc2cc(F)ccc2cn1 Amb28315392 [0,1,0,0,0,1|2,0,0]=4 4554 B13R2.155 Nc1cc2cc(O)ccc2cn1 Amb25915246 [0,1,0,0,0,1|2,0,0]=4 4555 B13R2.155 Nc1ccc2c(c1)N=C(O)CO2 Amb17914492 [0,1,0,0,0,1|1,0,0]=3 4556 B13R2.155 Nc1ccc2c(c1)NC(=O)CO2 Amb1102026 [0,1,0,0,0,1|1,0,1]=4 4557 B13R2.155 Nc1ccc2ccc(O)cc2c1 Amb21955697 [0,1,0,0,0,1|2,0,0]=4 4558 B13R2.155 Nc1ccc2ccc(O)cc2c1 Amb9173657 [0,1,0,0,0,1|2,0,0]=4 4559 B13R2.155 Nc1ccc2cnc(Cl)cc2c1 Amb22735854 [0,1,0,0,0,1|2,0,0]=4 4560 B13R2.155 Nc1ccc2cnc(Cl)nc2c1 Amb32428596 [0,1,0,0,0,1|2,0,0]=4 4561 B13R2.155 Nc1ccc2cnc(O)cc2c1 Amb22735994 [0,1,0,0,0,1|1,0,0]=3 4562 B13R2.155 Nc1ccc2ncc(O)cc2c1 Amb24183776 [0,1,0,0,0,1|2,0,0]=4 4563 B13R2.155 Nc1ncc2ccc(Br)cc2n1 Amb22011600 [0,1,0,0,0,1|2,0,0]=4 4564 B13R2.155 Nc1ncc2ccc(Cl)cc2n1 Amb10601972 [0,1,0,0,0,1|2,0,0]=4 4565 B13R2.155 Nc1ncc2ccc(F)cc2n1 Amb13883462 [0,1,0,0,0,1|2,0,0]=4 4566 B13R2.155 Nc1ncc2ccc(I)cc2n1 Amb23403094 [0,1,0,0,0,1|2,0,0]=4 4567 B13R2.155 Nc1nnc2ccc(Cl)cc2n1 Amb18648443 [0,1,0,0,0,1|2,0,0]=4 4568 B13R2.155 O=C1COc2ccc(Br)cc2C1 Amb22001903 [0,1,0,0,0,1|1,0,1]=4 4569 B13R2.155 O=C1COc2ccc(Br)cc2N1 Amb185669 [0,1,0,0,0,1|1,0,1]=4 4570 B13R2.155 O=C1COc2ccc(Cl)cc2N1 Amb1156028 [0,1,0,0,0,1|1,0,1]=4 4571 B13R2.155 O=C1COc2ccc(F)cc2N1 Amb6316179 [0,1,0,0,0,1|1,0,1]=4 4572 B13R2.155 O=C1COc2ccc(I)cc2C1 Amb22498280 [0,1,0,0,0,1|1,0,1]=4 4573 B13R2.155 O=C1COc2ccc(O)cc2N1 Amb17217469 [0,1,0,0,0,1|1,0,1]=4 4574 B13R2.155 O=C1COc2ccc(O)cc2O1 Amb27229107 [0,1,0,0,0,1|1,0,1]=4 4575 B13R2.155 O=C1COc2ccc(S)cc2N1 Amb518685 [0,1,0,0,0,1|1,0,1]=4 4576 B13R2.155 O=C1N=Cc2ccc(Br)cc2N1 Amb21963258 [0,1,0,0,0,1|1,0,1]=4 4577 B13R2.155 OC1=Nc2cc(F)ccc2CC1 Amb22731752 [0,1,0,0,0,1|2,0,0]=4 4578 B13R2.155 OC1=Nc2cc(O)ccc2CC1 Amb2453777 [0,1,0,0,0,1|2,0,0]=4 4579 B13R2.155 OC1COc2ccc(Br)cc2C1 Amb27398493 [0,1,0,0,0,1|1,0,1]=4 4580 B13R2.155 OC1COc2ccc(Cl)cc2C1 Amb22498278 [0,1,0,0,0,1|1,0,1]=4 4581 B13R2.155 Oc1cc2cc(Br)ccc2cn1 Amb16185816 [0,1,0,0,0,1|1,0,0]=3 4582 B13R2.155 Oc1cc2cc(F)ccc2cn1 Amb20171182 [0,1,0,0,0,1|1,0,0]=3 4583 B13R2.155 Oc1ccc2ccc(Br)cc2c1 Amb17596083 [0,1,0,0,0,1|2,0,0]=4 4584 B13R2.155 Oc1ccc2ccc(Br)cc2n1 Amb22284792 [0,1,0,0,0,1|2,0,0]=4 4585 B13R2.155 Oc1ccc2ccc(Cl)cc2c1 Amb17594576 [0,1,0,0,0,1|2,0,0]=4 4586 B13R2.155 Oc1ccc2ccc(Cl)cc2n1 Amb10603917 [0,1,0,0,0,1|2,0,0]=4 4587 B13R2.155 Oc1ccc2ccc(F)cc2c1 Amb24589653 [0,1,0,0,0,1|2,0,0]=4 4588 B13R2.155 Oc1ccc2ccc(I)cc2c1 Amb24429632 [0,1,0,0,0,1|2,0,0]=4 4589 B13R2.155 Oc1ccc2ccc(I)cc2n1 Amb24605587 [0,1,0,0,0,1|2,0,0]=4 4590 B13R2.155 Oc1ccc2ccc(O)cc2c1 Amb6357388 [0,1,0,0,0,1|2,0,0]=4 4591 B13R2.155 Oc1ccc2ccc(O)nc2c1 Amb10602568 [0,1,0,0,0,1|2,0,0]=4 4592 B13R2.155 Oc1ccc2cnc(Br)nc2c1 Amb27451076 [0,1,0,0,0,1|2,0,0]=4 4593 B13R2.155 Oc1ccc2cnc(Cl)cc2c1 Amb22735856 [0,1,0,0,0,1|2,0,0]=4 4594 B13R2.155 Oc1ccc2cnc(Cl)nc2c1 Amb28249029 [0,1,0,0,0,1|2,0,0]=4 4595 B13R2.155 Oc1ccc2cnc(O)cc2c1 Amb27240825 [0,1,0,0,0,1|1,0,0]=3 4596 B13R2.155 Oc1ccc2ncc(O)cc2c1 Amb24485547 [0,1,0,0,0,1|2,0,0]=4 4597 B13R2.155 Oc1cnc2ccc(Br)cc2c1 Amb33548540 [0,1,0,0,0,1|2,0,0]=4 4598 B13R2.155 Oc1cnc2ccc(Cl)cc2c1 Amb33547567 [0,1,0,0,0,1|2,0,0]=4 4599 B13R2.155 Oc1cnc2ccc(F)cc2c1 Amb22494761 [0,1,0,0,0,1|2,0,0]=4 4600 B13R2.155 Oc1cnc2ccc(I)cc2c1 Amb22494758 [0,1,0,0,0,1|2,0,0]=4 4601 B13R2.155 Oc1ncc2ccc(F)cc2n1 Amb26058146 [0,1,0,0,0,1|1,0,0]=3 4602 B13R2.155 S=C1COc2ccc(Br)cc2N1 Amb26607467 [0,1,0,0,0,1|1,1,0]=4 4603 B13R2.162 Cc1cc2c(Br)cccc2cn1 Amb18349267 [0,1,0,0,0,1|2,0,0]=4 4604 B13R2.162 Cc1cc2c(C)cccc2cn1 Amb27847100 [0,1,0,0,0,1|2,0,0]=4 4605 B13R2.162 Cc1cc2c(Cl)cccc2cn1 Amb24727684 [0,1,0,0,0,1|2,0,0]=4 4606 B13R2.162 Cc1cc2c(F)cccc2cn1 Amb32684127 [0,1,0,0,0,1|2,0,0]=4 4607 B13R2.162 Cc1cc2c(I)cccc2cn1 Amb25218079 [0,1,0,0,0,1|2,0,0]=4 4608 B13R2.162 Cc1cc2c(N)cccc2cn1 Amb8009308 [0,1,0,0,0,1|2,0,0]=4 4609 B13R2.162 Cc1cc2c(N)cccc2nn1 Amb2227080 [0,1,0,0,0,1|2,0,0]=4 4610 B13R2.162 Cc1cccc2c1NC(=O)CO2 Amb21961863 [0,1,0,0,0,1|1,0,1]=4 4611 B13R2.162 Cc1cccc2c1NC(=S)CO2 Amb28410429 [0,1,0,0,0,1|1,1,0]=4 4612 B13R2.162 Cc1cccc2ccc(O)cc12 Amb28347350 [0,1,0,0,0,1|2,0,0]=4 4613 B13R2.162 Cc1cccc2cnc(Cl)cc12 Amb24689948 [0,1,0,0,0,1|2,0,0]=4 4614 B13R2.162 Cc1cccc2cnc(Cl)nc12 Amb22753233 [0,1,0,0,0,1|2,0,0]=4 4615 B13R2.162 Cc1cccc2cnc(N)nc12 Amb23401914 [0,1,0,0,0,1|2,0,0]=4 4616 B13R2.162 Cc1cccc2ncc(O)cc12 Amb25696317 [0,1,0,0,0,1|2,0,0]=4 4617 B13R2.162 Cc1ncc2cccc(Br)c2n1 Amb22500586 [0,1,0,0,0,1|2,0,0]=4 4618 B13R2.162 Cc1ncc2cccc(F)c2n1 Amb23400998 [0,1,0,0,0,1|2,0,0]=4 4619 B13R2.162 Cc1ncc2cccc(O)c2n1 Amb23400926 [0,1,0,0,0,1|2,0,0]=4 4620 B13R2.162 Clc1cc2c(Br)cccc2cn1 Amb16185768 [0,1,0,0,0,1|2,0,0]=4 4621 B13R2.162 Clc1cccc2cnc(Br)cc12 Amb21927749 [0,1,0,0,0,1|2,0,0]=4 4622 B13R2.162 Clc1ncc2cccc(Br)c2n1 Amb10603938 [0,1,0,0,0,1|2,0,0]=4 4623 B13R2.162 Clc1ncc2cccc(Cl)c2n1 Amb21962065 [0,1,0,0,0,1|2,0,0]=4 4624 B13R2.162 Fc1cccc2cnc(Cl)cc12 Amb24085911 [0,1,0,0,0,1|2,0,0]=4 4625 B13R2.162 Fc1cccc2cnc(Cl)nc12 Amb23400027 [0,1,0,0,0,1|2,0,0]=4 4626 B13R2.162 Nc1cc2c(Br)cccc2cn1 Amb22500647 [0,1,0,0,0,1|2,0,0]=4 4627 B13R2.162 Nc1cc2c(Cl)cccc2cn1 Amb24361389 [0,1,0,0,0,1|2,0,0]=4 4628 B13R2.162 Nc1cc2c(F)cccc2cn1 Amb26539511 [0,1,0,0,0,1|2,0,0]=4 4629 B13R2.162 Nc1cccc2c1NC(=O)CO2 Amb10842123 [0,1,0,0,0,1|1,0,1]=4 4630 B13R2.162 Nc1cccc2ccc(O)cc12 Amb17750263 [0,1,0,0,0,1|2,0,0]=4 4631 B13R2.162 Nc1cccc2cnc(Br)cc12 Amb22496106 [0,1,0,0,0,1|2,0,0]=4 4632 B13R2.162 Nc1cccc2cnc(Cl)cc12 Amb10603682 [0,1,0,0,0,1|2,0,0]=4 4633 B13R2.162 Nc1cccc2cnc(Cl)nc12 Amb32428594 [0,1,0,0,0,1|2,0,0]=4 4634 B13R2.162 Nc1cccc2cnc(I)cc12 Amb22496091 [0,1,0,0,0,1|2,0,0]=4 4635 B13R2.162 Nc1cccc2cnc(O)cc12 Amb22735993 [0,1,0,0,0,1|1,0,0]=3 4636 B13R2.162 Nc1cccc2ncc(O)cc12 Amb22899411 [0,1,0,0,0,1|2,0,0]=4 4637 B13R2.162 Nc1ncc2cccc(Br)c2n1 Amb22500589 [0,1,0,0,0,1|2,0,0]=4 4638 B13R2.162 Nc1ncc2cccc(Cl)c2n1 Amb10601973 [0,1,0,0,0,1|2,0,0]=4 4639 B13R2.162 Nc1ncc2cccc(F)c2n1 Amb17933792 [0,1,0,0,0,1|2,0,0]=4 4640 B13R2.162 Nc1ncc2cccc(I)c2n1 Amb23403095 [0,1,0,0,0,1|2,0,0]=4 4641 B13R2.162 Nc1ncc2cccc(N)c2n1 Amb27963070 [0,1,0,0,0,1|2,0,0]=4 4642 B13R2.162 Nc1nnc2cccc(F)c2n1 Amb28196588 [0,1,0,0,0,1|2,0,0]=4 4643 B13R2.162 O=C1COc2cccc(Br)c2N1 Amb26352590 [0,1,0,0,0,1|1,0,1]=4 4644 B13R2.162 O=C1COc2cccc(Cl)c2N1 Amb26548332 [0,1,0,0,0,1|1,0,1]=4 4645 B13R2.162 O=C1COc2cccc(F)c2N1 Amb20075679 [0,1,0,0,0,1|1,0,1]=4 4646 B13R2.162 O=C1COc2cccc(O)c2N1 Amb33543974 [0,1,0,0,0,1|1,0,1]=4 4647 B13R2.162 O=C1N=Cc2cccc(Cl)c2N1 Amb27153655 [0,1,0,0,0,1|1,0,1]=4 4648 B13R2.162 Oc1cc2c(Br)cccc2cn1 Amb21857983 [0,1,0,0,0,1|1,0,0]=3 4649 B13R2.162 Oc1cc2c(Cl)cccc2cn1 Amb23401156 [0,1,0,0,0,1|1,0,0]=3 4650 B13R2.162 Oc1cc2c(F)cccc2cn1 Amb23401157 [0,1,0,0,0,1|1,0,0]=3 4651 B13R2.162 Oc1cc2c(O)cccc2cn1 Amb27856805 [0,1,0,0,0,1|1,0,0]=3 4652 B13R2.162 Oc1ccc2cccc(Br)c2c1 Amb16231039 [0,1,0,0,0,1|2,0,0]=4 4653 B13R2.162 Oc1ccc2cccc(Br)c2n1 Amb22371957 [0,1,0,0,0,1|2,0,0]=4 4654 B13R2.162 Oc1ccc2cccc(Cl)c2c1 Amb17594577 [0,1,0,0,0,1|2,0,0]=4 4655 B13R2.162 Oc1ccc2cccc(Cl)c2n1 Amb22235418 [0,1,0,0,0,1|2,0,0]=4 4656 B13R2.162 Oc1ccc2cccc(F)c2c1 Amb18645622 [0,1,0,0,0,1|2,0,0]=4 4657 B13R2.162 Oc1ccc2cccc(I)c2c1 Amb25148831 [0,1,0,0,0,1|2,0,0]=4 4658 B13R2.162 Oc1ccc2cccc(O)c2c1 Amb8516929 [0,1,0,0,0,1|2,0,0]=4 4659 B13R2.162 Oc1ccc2cccc(O)c2n1 Amb4324700 [0,1,0,0,0,1|2,0,0]=4 4660 B13R2.162 Oc1cccc2cnc(Br)nc12 Amb23399832 [0,1,0,0,0,1|2,0,0]=4 4661 B13R2.162 Oc1cccc2cnc(Cl)cc12 Amb27167733 [0,1,0,0,0,1|2,0,0]=4 4662 B13R2.162 Oc1cccc2cnc(Cl)nc12 Amb23399899 [0,1,0,0,0,1|2,0,0]=4 4663 B13R2.162 Oc1cnc2cccc(Br)c2c1 Amb22494956 [0,1,0,0,0,1|2,0,0]=4 4664 B13R2.162 Oc1cnc2cccc(Cl)c2c1 Amb24183754 [0,1,0,0,0,1|2,0,0]=4 4665 B13R2.162 Oc1cnc2cccc(Cl)c2n1 Amb22496025 [0,1,0,0,0,1|2,0,0]=4 4666 B13R2.162 Oc1cnc2cccc(F)c2c1 Amb24183767 [0,1,0,0,0,1|2,0,0]=4 4667 B13R2.162 Oc1cnc2cccc(I)c2c1 Amb26868844 [0,1,0,0,0,1|2,0,0]=4 4668 B13R2.162 Oc1cnc2cccc(O)c2c1 Amb26861197 [0,1,0,0,0,1|2,0,0]=4 4669 B13R2.162 Oc1ncc2cncc(Br)c2n1 Amb27636723 [0,1,0,0,0,1|2,0,0]=4 4670 B13R2.222 CC1(O)COc2ccccc2O1 Amb4139818 [0,1,0,0,0,1|1,0,1]=4 4671 B13R2.328 Brc1cc2ccccc2c(Br)n1 Amb2609658 [0,1,0,0,0,1|2,0,0]=4 4672 B13R2.328 Brc1nc(Br)c2ccccc2n1 Amb10603504 [0,1,0,0,0,1|2,0,0]=4 4673 B13R2.328 CC1=NC(=O)c2ccccc2N1 Amb19844242 [0,1,0,0,0,1|2,0,0]=4 4674 B13R2.328 CN1CC(O)=Cc2ccccc21 Amb27827527 [0,1,0,0,0,1|2,0,0]=4 4675 B13R2.328 Cc1cc(O)cc2ccccc12 Amb18645052 [0,1,0,0,0,1|2,0,0]=4 4676 B13R2.328 Cc1cc(O)nc2ccccc12 Amb6335240 [0,1,0,0,0,1|2,0,0]=4 4677 B13R2.328 Cc1cc2ccccc2c(Br)n1 Amb18346662 [0,1,0,0,0,1|2,0,0]=4 4678 B13R2.328 Cc1cc2ccccc2c(C)n1 Amb24382962 [0,1,0,0,0,1|2,0,0]=4 4679 B13R2.328 Cc1cc2ccccc2c(Cl)n1 Amb18790902 [0,1,0,0,0,1|2,0,0]=4 4680 B13R2.328 Cc1cc2ccccc2c(N)n1 Amb23589139 [0,1,0,0,0,1|2,0,0]=4 4681 B13R2.328 Cc1cc2ccccc2c(O)n1 Amb18645154 [0,1,0,0,0,1|2,0,0]=4 4682 B13R2.328 Cc1nc(=O)c2ccccc2o1 Amb344572 [0,1,0,0,0,1|2,0,0]=4 4683 B13R2.328 Cc1nc(Br)c2ccccc2n1 Amb20618768 [0,1,0,0,0,1|2,0,0]=4 4684 B13R2.328 Cc1nc(Br)cc2ccccc12 Amb22494860 [0,1,0,0,0,1|2,0,0]=4 4685 B13R2.328 Cc1nc(Br)nc2ccccc12 Amb20618708 [0,1,0,0,0,1|2,0,0]=4 4686 B13R2.328 Cc1nc(C)c2ccccc2n1 Amb19957953 [0,1,0,0,0,1|2,0,0]=4 4687 B13R2.328 Cc1nc(Cl)c2ccccc2n1 Amb4449857 [0,1,0,0,0,1|2,0,0]=4 4688 B13R2.328 Cc1nc(Cl)cc2ccccc12 Amb25692259 [0,1,0,0,0,1|2,0,0]=4 4689 B13R2.328 Cc1nc(Cl)nc2ccccc12 Amb33528692 [0,1,0,0,0,1|2,0,0]=4 4690 B13R2.328 Cc1nc(F)c2ccccc2n1 Amb35643322 [0,1,0,0,0,1|2,0,0]=4 4691 B13R2.328 Cc1nc(N)c2ccccc2n1 Amb5385927 [0,1,0,0,0,1|2,0,0]=4 4692 B13R2.328 Cc1nc(N)cc2ccccc12 Amb22491342 [0,1,0,0,0,1|2,0,0]=4 4693 B13R2.328 Cc1nc(N)nc2ccccc12 Amb1781469 [0,1,0,0,0,1|2,0,0]=4 4694 B13R2.328 Cc1nc(O)c2ccccc2n1 Amb6540413 [0,1,0,0,0,1|2,0,0]=4 4695 B13R2.328 Cc1nc(O)nc2ccccc12 Amb20618709 [0,1,0,0,0,1|1,0,0]=3 4696 B13R2.328 Cc1nc(S)c2ccccc2n1 Amb1105825 [0,1,0,0,0,1|2,0,0]=4 4697 B13R2.328 Cc1nc(S)nc2ccccc12 Amb9787094 [0,1,0,0,0,1|1,1,0]=4 4698 B13R2.328 Clc1cc2ccccc2c(Cl)n1 Amb1156942 [0,1,0,0,0,1|2,0,0]=4 4699 B13R2.328 Clc1nc(Br)cc2ccccc12 Amb20242096 [0,1,0,0,0,1|2,0,0]=4 4700 B13R2.328 Clc1nc(Br)nc2ccccc12 Amb28134019 [0,1,0,0,0,1|2,0,0]=4 4701 B13R2.328 Clc1nc(Cl)c2ccccc2n1 Amb3319258 [0,1,0,0,0,1|2,0,0]=4 4702 B13R2.328 Clc1nc(I)c2ccccc2n1 Amb27441585 [0,1,0,0,0,1|2,0,0]=4 4703 B13R2.328 Fc1cc2ccccc2c(Br)n1 Amb26055863 [0,1,0,0,0,1|2,0,0]=4 4704 B13R2.328 Fc1cc2ccccc2c(F)n1 Amb27638755 [0,1,0,0,0,1|2,0,0]=4 4705 B13R2.328 Fc1nc(Br)nc2ccccc12 Amb27466420 [0,1,0,0,0,1|2,0,0]=4 4706 B13R2.328 Fc1nc(Cl)cc2ccccc12 Amb25312649 [0,1,0,0,0,1|2,0,0]=4 4707 B13R2.328 Fc1nc(F)c2ccccc2n1 Amb27642914 [0,1,0,0,0,1|2,0,0]=4 4708 B13R2.328 N=C1N=C(O)c2ccccc2S1 Amb22572494 [0,1,0,0,0,1|2,0,0]=4 4709 B13R2.328 NC1=NC(=O)c2ccccc2N1 Amb19665071 [0,1,0,0,0,1|2,0,0]=4 4710 B13R2.328 NC1=NC(=S)Nc2ccccc21 Amb18048537 [0,1,0,0,0,1|1,1,0]=4 4711 B13R2.328 Nc1cc(O)cc2ccccc12 Amb18048469 [0,1,0,0,0,1|2,0,0]=4 4712 B13R2.328 Nc1cc2ccccc2c(Br)n1 Amb2609969 [0,1,0,0,0,1|2,0,0]=4 4713 B13R2.328 Nc1cc2ccccc2c(Cl)n1 Amb18648196 [0,1,0,0,0,1|2,0,0]=4 4714 B13R2.328 Nc1nc(Br)c2ccccc2n1 Amb20618705 [0,1,0,0,0,1|2,0,0]=4 4715 B13R2.328 Nc1nc(Br)cc2ccccc12 Amb25699182 [0,1,0,0,0,1|2,0,0]=4 4716 B13R2.328 Nc1nc(Br)nc2ccccc12 Amb20618704 [0,1,0,0,0,1|2,0,0]=4 4717 B13R2.328 Nc1nc(Cl)cc2ccccc12 Amb22749871 [0,1,0,0,0,1|2,0,0]=4 4718 B13R2.328 Nc1nc(Cl)nc2ccccc12 Amb3319288 [0,1,0,0,0,1|2,0,0]=4 4719 B13R2.328 Nc1nc(F)nc2ccccc12 Amb35677824 [0,1,0,0,0,1|2,0,0]=4 4720 B13R2.328 Nc1nc(N)c2ccccc2n1 Amb4009200 [0,1,0,0,0,1|2,0,0]=4 4721 B13R2.328 Nc1nc(S)cc2ccccc12 Amb27484730 [0,1,0,0,0,1|1,1,0]=4 4722 B13R2.328 Nc1nc2ccccc2[n+]([O-])n1 Amb626405 [0,1,0,0,0,1|2,0,0]=4 4723 B13R2.328 O=C1C=C(O)Sc2ccccc21 Amb26517364 [0,1,0,0,0,1|2,0,0]=4 4724 B13R2.328 O=C1N=C(Cl)Sc2ccccc21 Amb19513972 [0,1,0,0,0,1|2,0,0]=4 4725 B13R2.328 O=C1N=C(Cl)c2ccccc2N1 Amb22371858 [0,1,0,0,0,1|1,0,1]=4 4726 B13R2.328 O=C1N=C(S)Nc2ccccc21 Amb19748659 [0,1,0,0,0,1|1,1,0]=4 4727 B13R2.328 O=C1N=C(S)Sc2ccccc21 Amb19906700 [0,1,0,0,0,1|1,1,0]=4 4728 B13R2.328 O=C1N=[N+]([O-])c2ccccc2N1 Amb20527610 [0,1,0,0,0,1|1,0,1]=4 4729 B13R2.328 O=C1OC(O)=Nc2ccccc21 Amb22569820 [0,1,0,0,0,1|2,0,0]=4 4730 B13R2.328 OC1=NC(=S)Nc2ccccc21 Amb22527681 [0,1,0,0,0,1|1,1,0]=4 4731 B13R2.328 OC1=NC(=S)Sc2ccccc21 Amb22572201 [0,1,0,0,0,1|1,1,0]=4 4732 B13R2.328 Oc1cc(Br)c2ccccc2c1 Amb17596081 [0,1,0,0,0,1|2,0,0]=4 4733 B13R2.328 Oc1cc(F)c2ccccc2c1 Amb26843113 [0,1,0,0,0,1|2,0,0]=4 4734 B13R2.328 Oc1cc(I)c2ccccc2c1 Amb26850789 [0,1,0,0,0,1|2,0,0]=4 4735 B13R2.328 Oc1cc(O)c2ccccc2c1 Amb6357421 [0,1,0,0,0,1|2,0,0]=4 4736 B13R2.328 Oc1cc(O)c2ccccc2n1 Amb1104174 [0,1,0,0,0,1|2,0,0]=4 4737 B13R2.328 Oc1cc2cccnc2c(O)n1 Amb28139812 [0,1,0,0,0,1|2,0,0]=4 4738 B13R2.328 Oc1nc(Br)c2ccccc2n1 Amb20618707 [0,1,0,0,0,1|1,0,0]=3 4739 B13R2.328 Oc1nc(Br)nc2ccccc12 Amb20618706 [0,1,0,0,0,1|2,0,0]=4 4740 B13R2.328 Oc1nc(F)c2ccccc2n1 Amb28348658 [0,1,0,0,0,1|1,0,0]=3 4741 B13R2.328 Oc1nc(F)nc2ccccc12 Amb35677176 [0,1,0,0,0,1|2,0,0]=4 4742 B13R2.328 Oc1nc(O)c2ccccc2n1 Amb776682 [0,1,0,0,0,1|1,0,0]=3 4743 B13R2.328 Oc1nc(O)c2ncccc2n1 Amb21964494 [0,1,0,0,0,1|2,0,0]=4 4744 B13R2.328 Oc1nc(S)c2ccccc2n1 Amb20246241 [0,1,0,0,0,1|1,0,0]=3 4745 B13R2.328 S=C1N=C(Cl)Cc2ccccc21 Amb28044956 [0,1,0,0,0,1|2,0,0]=4 4746 B13R2.328 S=C1N=C(Cl)c2ccccc2N1 Amb28241352 [0,1,0,0,0,1|1,1,0]=4 4747 B13R2.328 Sc1nc(Cl)cc2ccccc12 Amb25273217 [0,1,0,0,0,1|2,0,0]=4 4748 B13R2.328 Sc1nc(S)c2ccccc2n1 Amb1081949 [0,1,0,0,0,1|1,1,0]=4 4749 B13R2.328 [O-][n+]1cc(O)cc2ccccc21 Amb25873892 [0,1,0,0,0,1|2,0,0]=4 4750 B13R2.328 [O-][n+]1cc(O)nc2ccccc21 Amb17594025 [0,1,0,0,0,1|2,0,0]=4 4751 B13R2.369 C=C1Nc2ccccc2OC1=O Amb25996357 [0,1,0,0,0,1|2,0,0]=4 4752 B13R2.369 CC1=Cc2ccccc2OC1=O Amb20247474 [0,1,0,0,0,1|2,0,0]=4 4753 B13R2.369 CC1=Nc2ccccc2OC1=O Amb27482974 [0,1,0,0,0,1|2,0,0]=4 4754 B13R2.369 CC1Oc2ccccc2N=C1Cl Amb18118342 [0,1,0,0,0,1|2,0,0]=4 4755 B13R2.369 CC1Oc2ccccc2N=C1N Amb25992518 [0,1,0,0,0,1|2,0,0]=4 4756 B13R2.369 CC1Oc2ccccc2NC1=O Amb2568450 [0,1,0,0,0,1|1,0,1]=4 4757 B13R2.369 Cc1cc2ccccc2cc1O Amb22262990 [0,1,0,0,0,1|2,0,0]=4 4758 B13R2.369 Cc1nc2ccccc2cc1O Amb660984 [0,1,0,0,0,1|2,0,0]=4 4759 B13R2.369 Cc1nc2ccccc2nc1O Amb631810 [0,1,0,0,0,1|2,0,0]=4 4760 B13R2.369 N=C1Nc2ccccc2OC1=O Amb20053203 [0,1,0,0,0,1|2,0,0]=4 4761 B13R2.369 NC1=Cc2ccccc2OC1=O Amb18511494 [0,1,0,0,0,1|2,0,0]=4 4762 B13R2.369 Nc1cc2ccccc2cc1O Amb2781576 [0,1,0,0,0,1|2,0,0]=4 4763 B13R2.369 Nc1cc2ccccc2nc1O Amb18645300 [0,1,0,0,0,1|2,0,0]=4 4764 B13R2.369 Nc1nc2ccccc2cc1O Amb27471786 [0,1,0,0,0,1|2,0,0]=4 4765 B13R2.369 O=C1Cc2ccccc2OC1=O Amb22755081 [0,1,0,0,0,1|1,0,1]=4 4766 B13R2.369 O=C1Nc2ccccc2C=C1O Amb20619410 [0,1,0,0,0,1|2,0,0]=4 4767 B13R2.369 O=C1Nc2ccccc2OC1=O Amb19650977 [0,1,0,0,0,1|1,0,1]=4 4768 B13R2.369 O=C1Nc2ccccc2OC1Br Amb33328763 [0,1,0,0,0,1|1,0,1]=4 4769 B13R2.369 O=C1Nc2ccccc2OC1O Amb9824611 [0,1,0,0,0,1|1,0,1]=4 4770 B13R2.369 O=C1Oc2ccccc2C=C1Br Amb19655979 [0,1,0,0,0,1|2,0,0]=4 4771 B13R2.369 O=C1Oc2ccccc2C=C1F Amb22547186 [0,1,0,0,0,1|2,0,0]=4 4772 B13R2.369 O=C1Oc2ccccc2C=C1O Amb18511465 [0,1,0,0,0,1|1,0,0]=3 4773 B13R2.369 O=C1Oc2ccccc2C=C1S Amb27173626 [0,1,0,0,0,1|1,1,0]=4 4774 B13R2.369 O=C1Oc2ccccc2N=C1Cl Amb21858712 [0,1,0,0,0,1|2,0,0]=4 4775 B13R2.369 O=C1Oc2ccccc2N=C1O Amb22494623 [0,1,0,0,0,1|1,0,0]=3 4776 B13R2.369 O=C1Oc2ccccc2NC1=S Amb27947432 [0,1,0,0,0,1|1,1,0]=4 4777 B13R2.369 O=C1Oc2ccccc2NC1O Amb27767886 [0,1,0,0,0,1|1,0,1]=4 4778 B13R2.369 OC1Oc2ccccc2C=C1Cl Amb27218912 [0,1,0,0,0,1|2,0,0]=4 4779 B13R2.369 Oc1cc2ccccc2cc1Br Amb17596080 [0,1,0,0,0,1|2,0,0]=4 4780 B13R2.369 Oc1cc2ccccc2cc1Cl Amb4010282 [0,1,0,0,0,1|2,0,0]=4 4781 B13R2.369 Oc1cc2ccccc2cc1F Amb26494442 [0,1,0,0,0,1|2,0,0]=4 4782 B13R2.369 Oc1cc2ccccc2cc1I Amb25148790 [0,1,0,0,0,1|2,0,0]=4 4783 B13R2.369 Oc1cc2ccccc2cc1O Amb6296607 [0,1,0,0,0,1|2,0,0]=4 4784 B13R2.369 Oc1cc2ccccc2nc1Br Amb18134374 [0,1,0,0,0,1|2,0,0]=4 4785 B13R2.369 Oc1cc2ccccc2nc1Cl Amb21963885 [0,1,0,0,0,1|2,0,0]=4 4786 B13R2.369 Oc1cc2ccccc2nc1F Amb27244594 [0,1,0,0,0,1|2,0,0]=4 4787 B13R2.369 Oc1cc2ccccc2nc1I Amb28187128 [0,1,0,0,0,1|2,0,0]=4 4788 B13R2.369 Oc1nc2ccccc2cc1Br Amb10608236 [0,1,0,0,0,1|2,0,0]=4 4789 B13R2.369 Oc1nc2ccccc2nc1Cl Amb22497412 [0,1,0,0,0,1|2,0,0]=4 4790 B13R2.369 Oc1nc2ccccc2nc1O Amb6334823 [0,1,0,0,0,1|2,0,0]=4 4791 B13R2.369 Oc1nc2ccccc2nc1S Amb4138352 [0,1,0,0,0,1|2,0,0]=4 4792 B13R2.3683 Brc1ccc2cc(Br)ncc2c1 Amb27208548 [0,1,0,0,0,1|2,0,0]=4 4793 B13R2.3683 Brc1ccc2nc(Br)ncc2c1 Amb10603526 [0,1,0,0,0,1|2,0,0]=4 4794 B13R2.3683 Cc1cc2ccc(Br)cc2cn1 Amb23401097 [0,1,0,0,0,1|2,0,0]=4 4795 B13R2.3683 Cc1cc2ccc(Cl)cc2cn1 Amb27959160 [0,1,0,0,0,1|2,0,0]=4 4796 B13R2.3683 Cc1cc2ccc(F)cc2cn1 Amb32684120 [0,1,0,0,0,1|2,0,0]=4 4797 B13R2.3683 Cc1cc2ccc(N)cc2cn1 Amb25687409 [0,1,0,0,0,1|2,0,0]=4 4798 B13R2.3683 Cc1cc2ccc(O)cc2cn1 Amb18645159 [0,1,0,0,0,1|2,0,0]=4 4799 B13R2.3683 Cc1ccc2c(c1)C=NC(=O)N2 Amb24741810 [0,1,0,0,0,1|1,0,1]=4 4800 B13R2.3683 Cc1ccc2c(c1)OCC(=O)N2 Amb6331646 [0,1,0,0,0,1|1,0,1]=4 4801 B13R2.3683 Cc1ccc2c(c1)OCC(=S)N2 Amb19747839 [0,1,0,0,0,1|1,1,0]=4 4802 B13R2.3683 Cc1ccc2cc(Cl)ncc2c1 Amb20171137 [0,1,0,0,0,1|2,0,0]=4 4803 B13R2.3683 Cc1ccc2cc(O)ccc2c1 Amb21964548 [0,1,0,0,0,1|2,0,0]=4 4804 B13R2.3683 Cc1ccc2cc(O)cnc2c1 Amb24407164 [0,1,0,0,0,1|2,0,0]=4 4805 B13R2.3683 Cc1ccc2nc(C)ncc2c1 Amb23400997 [0,1,0,0,0,1|2,0,0]=4 4806 B13R2.3683 Cc1ccc2nc(Cl)ncc2c1 Amb22263227 [0,1,0,0,0,1|2,0,0]=4 4807 B13R2.3683 Cc1ccc2nc(N)ncc2c1 Amb22235549 [0,1,0,0,0,1|2,0,0]=4 4808 B13R2.3683 Cc1ccc2nc(N)nnc2c1 Amb4005074 [0,1,0,0,0,1|2,0,0]=4 4809 B13R2.3683 Cc1ncc2cc(Br)ccc2n1 Amb20248624 [0,1,0,0,0,1|2,0,0]=4 4810 B13R2.3683 Cc1ncc2cc(F)ccc2n1 Amb23400992 [0,1,0,0,0,1|2,0,0]=4 4811 B13R2.3683 Cc1ncc2cc(I)ccc2n1 Amb23400993 [0,1,0,0,0,1|2,0,0]=4 4812 B13R2.3683 Cc1ncc2cc(N)ccc2n1 Amb23400995 [0,1,0,0,0,1|2,0,0]=4 4813 B13R2.3683 Clc1cc2ccc(Br)cc2cn1 Amb16185769 [0,1,0,0,0,1|2,0,0]=4 4814 B13R2.3683 Clc1ccc2cc(Br)ncc2c1 Amb21927751 [0,1,0,0,0,1|2,0,0]=4 4815 B13R2.3683 Clc1ccc2cc(Br)nnc2c1 Amb27624396 [0,1,0,0,0,1|2,0,0]=4 4816 B13R2.3683 Clc1ccc2cc(Cl)ncc2c1 Amb22498303 [0,1,0,0,0,1|2,0,0]=4 4817 B13R2.3683 Clc1ccc2nc(Cl)ncc2c1 Amb23401245 [0,1,0,0,0,1|2,0,0]=4 4818 B13R2.3683 Clc1ncc2cc(Br)ccc2n1 Amb19957555 [0,1,0,0,0,1|2,0,0]=4 4819 B13R2.3683 Clc1ncc2cc(I)ccc2n1 Amb23400025 [0,1,0,0,0,1|2,0,0]=4 4820 B13R2.3683 Fc1ccc2cc(Cl)ncc2c1 Amb24099957 [0,1,0,0,0,1|2,0,0]=4 4821 B13R2.3683 Fc1ccc2cc(F)ncc2c1 Amb27968064 [0,1,0,0,0,1|2,0,0]=4 4822 B13R2.3683 Fc1ccc2nc(Cl)ncc2c1 Amb19515775 [0,1,0,0,0,1|2,0,0]=4 4823 B13R2.3683 Nc1cc2ccc(Br)cc2cn1 Amb19957600 [0,1,0,0,0,1|2,0,0]=4 4824 B13R2.3683 Nc1cc2ccc(Cl)cc2cn1 Amb22499619 [0,1,0,0,0,1|2,0,0]=4 4825 B13R2.3683 Nc1cc2ccc(F)cc2cn1 Amb25869874 [0,1,0,0,0,1|2,0,0]=4 4826 B13R2.3683 Nc1ccc2c(c1)OCC(=O)N2 Amb3428059 [0,1,0,0,0,1|1,0,1]=4 4827 B13R2.3683 Nc1ccc2cc(Cl)ncc2c1 Amb22735855 [0,1,0,0,0,1|2,0,0]=4 4828 B13R2.3683 Nc1ccc2cc(O)ccc2c1 Amb17843066 [0,1,0,0,0,1|2,0,0]=4 4829 B13R2.3683 Nc1ccc2cc(O)cnc2c1 Amb22899407 [0,1,0,0,0,1|2,0,0]=4 4830 B13R2.3683 Nc1ccc2cc(O)ncc2c1 Amb22735997 [0,1,0,0,0,1|1,0,0]=3 4831 B13R2.3683 Nc1ccc2nc(Cl)ncc2c1 Amb32428599 [0,1,0,0,0,1|2,0,0]=4 4832 B13R2.3683 Nc1ccc2nc(N)ncc2c1 Amb22495944 [0,1,0,0,0,1|2,0,0]=4 4833 B13R2.3683 Nc1ccc2nc(O)ccc2c1 Amb9310455 [0,1,0,0,0,1|2,0,0]=4 4834 B13R2.3683 Nc1ncc2cc(Br)ccc2n1 Amb10603010 [0,1,0,0,0,1|2,0,0]=4 4835 B13R2.3683 Nc1ncc2cc(Cl)ccc2n1 Amb10601971 [0,1,0,0,0,1|2,0,0]=4 4836 B13R2.3683 Nc1ncc2cc(F)ccc2n1 Amb20241822 [0,1,0,0,0,1|2,0,0]=4 4837 B13R2.3683 Nc1ncc2cc(I)ccc2n1 Amb23403093 [0,1,0,0,0,1|2,0,0]=4 4838 B13R2.3683 Nc1nnc2cc(Br)ccc2n1 Amb21864578 [0,1,0,0,0,1|2,0,0]=4 4839 B13R2.3683 Nc1nnc2cc(Cl)ccc2n1 Amb21864908 [0,1,0,0,0,1|2,0,0]=4 4840 B13R2.3683 O=C1COc2cc(Br)ccc2C1 Amb21964898 [0,1,0,0,0,1|1,0,1]=4 4841 B13R2.3683 O=C1COc2cc(Br)ccc2N1 Amb5846258 [0,1,0,0,0,1|1,0,1]=4 4842 B13R2.3683 O=C1COc2cc(Cl)ccc2N1 Amb6353686 [0,1,0,0,0,1|1,0,1]=4 4843 B13R2.3683 O=C1COc2cc(F)ccc2N1 Amb10975233 [0,1,0,0,0,1|1,0,1]=4 4844 B13R2.3683 O=C1COc2cc(I)ccc2N1 Amb19958155 [0,1,0,0,0,1|1,0,1]=4 4845 B13R2.3683 O=C1COc2cc(O)ccc2C1 Amb28054310 [0,1,0,0,0,1|1,0,1]=4 4846 B13R2.3683 O=C1COc2cc(O)ccc2N1 Amb17217473 [0,1,0,0,0,1|1,0,1]=4 4847 B13R2.3683 O=C1N=Cc2cc(Br)ccc2N1 Amb21858215 [0,1,0,0,0,1|1,0,1]=4 4848 B13R2.3683 O=C1N=Nc2cc(Cl)ccc2N1 Amb27947280 [0,1,0,0,0,1|1,0,1]=4 4849 B13R2.3683 OC1=Nc2ccc(Cl)cc2CC1 Amb22330532 [0,1,0,0,0,1|2,0,0]=4 4850 B13R2.3683 Oc1cc2ccc(Br)cc2cn1 Amb16185814 [0,1,0,0,0,1|1,0,0]=3 4851 B13R2.3683 Oc1cc2ccc(Br)cc2nn1 Amb22499432 [0,1,0,0,0,1|1,0,0]=3 4852 B13R2.3683 Oc1cc2ccc(F)cc2cn1 Amb25127158 [0,1,0,0,0,1|1,0,0]=3 4853 B13R2.3683 Oc1ccc2cc(Br)ccc2c1 Amb1333685 [0,1,0,0,0,1|2,0,0]=4 4854 B13R2.3683 Oc1ccc2cc(Br)ccc2n1 Amb1994326 [0,1,0,0,0,1|2,0,0]=4 4855 B13R2.3683 Oc1ccc2cc(Cl)ccc2c1 Amb17777189 [0,1,0,0,0,1|2,0,0]=4 4856 B13R2.3683 Oc1ccc2cc(Cl)ncc2c1 Amb22735857 [0,1,0,0,0,1|2,0,0]=4 4857 B13R2.3683 Oc1ccc2cc(F)ccc2c1 Amb22751763 [0,1,0,0,0,1|2,0,0]=4 4858 B13R2.3683 Oc1ccc2cc(I)ccc2c1 Amb25669689 [0,1,0,0,0,1|2,0,0]=4 4859 B13R2.3683 Oc1ccc2cc(I)ccc2n1 Amb19958372 [0,1,0,0,0,1|2,0,0]=4 4860 B13R2.3683 Oc1ccc2cc(O)ccc2c1 Amb2708568 [0,1,0,0,0,1|2,0,0]=4 4861 B13R2.3683 Oc1ccc2cc(S)ccc2c1 Amb17594487 [0,1,0,0,0,1|2,0,0]=4 4862 B13R2.3683 Oc1ccc2nc(Cl)ncc2c1 Amb23412166 [0,1,0,0,0,1|2,0,0]=4 4863 B13R2.3683 Oc1ccc2nc(O)ccc2c1 Amb9825996 [0,1,0,0,0,1|2,0,0]=4 4864 B13R2.3683 Oc1cnc2cc(Br)ccc2c1 Amb22494957 [0,1,0,0,0,1|2,0,0]=4 4865 B13R2.3683 Oc1cnc2cc(Br)ccc2n1 Amb18659002 [0,1,0,0,0,1|2,0,0]=4 4866 B13R2.3683 Oc1cnc2cc(Cl)ccc2c1 Amb24183780 [0,1,0,0,0,1|2,0,0]=4 4867 B13R2.3683 Oc1cnc2cc(F)ccc2c1 Amb24183788 [0,1,0,0,0,1|2,0,0]=4 4868 B13R2.3683 Oc1cnc2cc(I)ccc2c1 Amb25883423 [0,1,0,0,0,1|2,0,0]=4 4869 B13R2.3683 Oc1cnc2cc(O)ccc2c1 Amb27214209 [0,1,0,0,0,1|2,0,0]=4 4870 B13R2.3683 Oc1ncc2cc(Cl)ccc2n1 Amb24623653 [0,1,0,0,0,1|1,0,0]=3 4871 B13R2.3683 Oc1ncc2cc(F)ccc2n1 Amb25086066 [0,1,0,0,0,1|1,0,0]=3 4872 B13R2.5179 CC1=COc2c(N)cccc2O1 Amb17570074 [0,1,0,0,0,1|2,0,0]=4 4873 B13R2.5179 Cc1cc2cccc(Br)c2cn1 Amb26028339 [0,1,0,0,0,1|2,0,0]=4 4874 B13R2.5179 Cc1cc2cccc(Cl)c2cn1 Amb32684129 [0,1,0,0,0,1|2,0,0]=4 4875 B13R2.5179 Cc1cc2cccc(F)c2cn1 Amb32684124 [0,1,0,0,0,1|2,0,0]=4 4876 B13R2.5179 Cc1cc2cccc(N)c2cn1 Amb24610579 [0,1,0,0,0,1|2,0,0]=4 4877 B13R2.5179 Cc1cc2cccc(O)c2cn1 Amb26450488 [0,1,0,0,0,1|2,0,0]=4 4878 B13R2.5179 Cc1cccc2c1OCC(=O)N2 Amb17570068 [0,1,0,0,0,1|1,0,1]=4 4879 B13R2.5179 Cc1cccc2cc(Cl)ncc12 Amb32685496 [0,1,0,0,0,1|2,0,0]=4 4880 B13R2.5179 Cc1cccc2cc(N)ncc12 Amb24417691 [0,1,0,0,0,1|2,0,0]=4 4881 B13R2.5179 Cc1cccc2cc(O)cnc12 Amb27878570 [0,1,0,0,0,1|2,0,0]=4 4882 B13R2.5179 Cc1cccc2nc(Br)ncc12 Amb23400706 [0,1,0,0,0,1|2,0,0]=4 4883 B13R2.5179 Cc1cccc2nc(Cl)ncc12 Amb23400024 [0,1,0,0,0,1|2,0,0]=4 4884 B13R2.5179 Cc1cccc2nc(N)ncc12 Amb23400708 [0,1,0,0,0,1|2,0,0]=4 4885 B13R2.5179 Cc1ncc2c(Cl)cccc2n1 Amb23400988 [0,1,0,0,0,1|2,0,0]=4 4886 B13R2.5179 Cc1ncc2c(N)cccc2n1 Amb23400989 [0,1,0,0,0,1|2,0,0]=4 4887 B13R2.5179 Clc1cc2cccc(Br)c2cn1 Amb16185767 [0,1,0,0,0,1|2,0,0]=4 4888 B13R2.5179 Clc1cc2cccc(Cl)c2cn1 Amb26586245 [0,1,0,0,0,1|2,0,0]=4 4889 B13R2.5179 Clc1cccc2cc(Br)ncc12 Amb21927752 [0,1,0,0,0,1|2,0,0]=4 4890 B13R2.5179 Clc1cccc2nc(Br)ncc12 Amb28044168 [0,1,0,0,0,1|2,0,0]=4 4891 B13R2.5179 Clc1cccc2nc(I)ncc12 Amb27613052 [0,1,0,0,0,1|2,0,0]=4 4892 B13R2.5179 Clc1ncc2c(Br)cccc2n1 Amb21962847 [0,1,0,0,0,1|2,0,0]=4 4893 B13R2.5179 Clc1ncc2c(Cl)cccc2n1 Amb22001672 [0,1,0,0,0,1|2,0,0]=4 4894 B13R2.5179 Fc1cccc2cc(Cl)ncc12 Amb28118501 [0,1,0,0,0,1|2,0,0]=4 4895 B13R2.5179 Fc1cccc2nc(Cl)ncc12 Amb23400023 [0,1,0,0,0,1|2,0,0]=4 4896 B13R2.5179 Nc1cc2cccc(Br)c2cn1 Amb22500648 [0,1,0,0,0,1|2,0,0]=4 4897 B13R2.5179 Nc1cc2cccc(Cl)c2cn1 Amb22499396 [0,1,0,0,0,1|2,0,0]=4 4898 B13R2.5179 Nc1cc2cccc(F)c2cn1 Amb22499395 [0,1,0,0,0,1|2,0,0]=4 4899 B13R2.5179 Nc1cccc2c1OCC(=O)N2 Amb10068365 [0,1,0,0,0,1|1,0,1]=4 4900 B13R2.5179 Nc1cccc2cc(Cl)ncc12 Amb28042933 [0,1,0,0,0,1|2,0,0]=4 4901 B13R2.5179 Nc1cccc2cc(O)ccc12 Amb2776482 [0,1,0,0,0,1|2,0,0]=4 4902 B13R2.5179 Nc1cccc2cc(O)cnc12 Amb24183774 [0,1,0,0,0,1|2,0,0]=4 4903 B13R2.5179 Nc1cccc2cc(O)ncc12 Amb22735996 [0,1,0,0,0,1|1,0,0]=3 4904 B13R2.5179 Nc1cccc2nc(Cl)ncc12 Amb32418907 [0,1,0,0,0,1|2,0,0]=4 4905 B13R2.5179 Nc1ncc2c(Br)cccc2n1 Amb21963497 [0,1,0,0,0,1|2,0,0]=4 4906 B13R2.5179 Nc1ncc2c(Cl)cccc2n1 Amb2428711 [0,1,0,0,0,1|2,0,0]=4 4907 B13R2.5179 Nc1ncc2c(F)cccc2n1 Amb22371242 [0,1,0,0,0,1|2,0,0]=4 4908 B13R2.5179 Nc1ncc2c(I)cccc2n1 Amb23403092 [0,1,0,0,0,1|2,0,0]=4 4909 B13R2.5179 O=C1C=CC=C2OC(O)=CC=C12 Amb27959181 [0,1,0,0,0,1|2,0,0]=4 4910 B13R2.5179 O=C1COc2c(Br)cccc2C1 Amb15692701 [0,1,0,0,0,1|1,0,1]=4 4911 B13R2.5179 O=C1COc2c(Br)cccc2N1 Amb17572141 [0,1,0,0,0,1|1,0,1]=4 4912 B13R2.5179 O=C1COc2c(Cl)cccc2C1 Amb22498279 [0,1,0,0,0,1|1,0,1]=4 4913 B13R2.5179 O=C1COc2c(Cl)cccc2N1 Amb1094037 [0,1,0,0,0,1|1,0,1]=4 4914 B13R2.5179 O=C1COc2c(F)cccc2C1 Amb27260708 [0,1,0,0,0,1|1,0,1]=4 4915 B13R2.5179 O=C1COc2c(F)cccc2N1 Amb17570109 [0,1,0,0,0,1|1,0,1]=4 4916 B13R2.5179 O=C1COc2c(I)cccc2N1 Amb22586344 [0,1,0,0,0,1|1,0,1]=4 4917 B13R2.5179 O=C1N=Cc2c(Cl)cccc2N1 Amb24532716 [0,1,0,0,0,1|1,0,1]=4 4918 B13R2.5179 OC1=Nc2cccc(Cl)c2OC1 Amb2451752 [0,1,0,0,0,1|1,0,0]=3 4919 B13R2.5179 Oc1cc2cccc(Cl)c2cn1 Amb18648302 [0,1,0,0,0,1|1,0,0]=3 4920 B13R2.5179 Oc1cc2cccc(F)c2cn1 Amb24389770 [0,1,0,0,0,1|1,0,0]=3 4921 B13R2.5179 Oc1ccc2c(Br)cccc2c1 Amb17596082 [0,1,0,0,0,1|2,0,0]=4 4922 B13R2.5179 Oc1ccc2c(Br)cccc2n1 Amb22371958 [0,1,0,0,0,1|2,0,0]=4 4923 B13R2.5179 Oc1ccc2c(Cl)cccc2c1 Amb17594575 [0,1,0,0,0,1|2,0,0]=4 4924 B13R2.5179 Oc1ccc2c(Cl)cccc2n1 Amb24725156 [0,1,0,0,0,1|2,0,0]=4 4925 B13R2.5179 Oc1ccc2c(F)cccc2c1 Amb28342977 [0,1,0,0,0,1|2,0,0]=4 4926 B13R2.5179 Oc1ccc2c(F)cccc2n1 Amb23448556 [0,1,0,0,0,1|2,0,0]=4 4927 B13R2.5179 Oc1ccc2c(I)cccc2c1 Amb25883430 [0,1,0,0,0,1|2,0,0]=4 4928 B13R2.5179 Oc1ccc2c(I)cccc2n1 Amb23401167 [0,1,0,0,0,1|2,0,0]=4 4929 B13R2.5179 Oc1ccc2c(O)cccc2c1 Amb6357829 [0,1,0,0,0,1|2,0,0]=4 4930 B13R2.5179 Oc1cccc2cc(Cl)ncc12 Amb27390546 [0,1,0,0,0,1|2,0,0]=4 4931 B13R2.5179 Oc1cnc2c(Br)cccc2c1 Amb22494958 [0,1,0,0,0,1|2,0,0]=4 4932 B13R2.5179 Oc1cnc2c(Cl)cccc2c1 Amb24183739 [0,1,0,0,0,1|2,0,0]=4 4933 B13R2.5179 Oc1cnc2c(Cl)cccc2n1 Amb22496024 [0,1,0,0,0,1|2,0,0]=4 4934 B13R2.5179 Oc1cnc2c(F)cccc2c1 Amb22899408 [0,1,0,0,0,1|2,0,0]=4 4935 B13R2.5179 Oc1cnc2c(O)cccc2c1 Amb27175611 [0,1,0,0,0,1|2,0,0]=4 4936 B13R2.5179 Oc1ncc2c(Br)cccc2n1 Amb25816213 [0,1,0,0,0,1|1,0,0]=3 4937 B13R2.5179 Oc1ncc2c(F)cccc2n1 Amb27840841 [0,1,0,0,0,1|1,0,0]=3 4938 B13R2.383 Cc1coc2c1C=CC=CC2=O Amb28253710 [0,1,0,0,0,1|2,0,0]=4 4939 B13R2.342 Brc1cccc2c(Br)nccc12 Amb18346668 [0,1,0,0,0,1|2,0,0]=4 4940 B13R2.342 Brc1cccc2c(I)nccc12 Amb27259393 [0,1,0,0,0,1|2,0,0]=4 4941 B13R2.342 Cc1cccc2c(Br)cncc12 Amb32645670 [0,1,0,0,0,1|2,0,0]=4 4942 B13R2.342 Cc1cccc2c(Br)nccc12 Amb18346598 [0,1,0,0,0,1|2,0,0]=4 4943 B13R2.342 Cc1cccc2c(C)nccc12 Amb27631264 [0,1,0,0,0,1|2,0,0]=4 4944 B13R2.342 Cc1cccc2c(Cl)cnnc12 Amb22753763 [0,1,0,0,0,1|2,0,0]=4 4945 B13R2.342 Cc1cccc2c(Cl)nccc12 Amb18346728 [0,1,0,0,0,1|2,0,0]=4 4946 B13R2.342 Cc1cccc2c(Cl)ncnc12 Amb16231040 [0,1,0,0,0,1|2,0,0]=4 4947 B13R2.342 Cc1cccc2c(F)ncnc12 Amb35657355 [0,1,0,0,0,1|2,0,0]=4 4948 B13R2.342 Cc1cccc2c(N)cncc12 Amb18357191 [0,1,0,0,0,1|2,0,0]=4 4949 B13R2.342 Cc1cccc2c(N)cnnc12 Amb10976634 [0,1,0,0,0,1|2,0,0]=4 4950 B13R2.342 Cc1cccc2c(N)nccc12 Amb26506542 [0,1,0,0,0,1|2,0,0]=4 4951 B13R2.342 Cc1cccc2c(O)cccc12 Amb18061789 [0,1,0,0,0,1|2,0,0]=4 4952 B13R2.342 Cc1cccc2c(O)ccnc12 Amb1994184 [0,1,0,0,0,1|2,0,0]=4 4953 B13R2.342 Cc1cccc2c(O)cncc12 Amb19110678 [0,1,0,0,0,1|1,0,0]=3 4954 B13R2.342 Cc1cccc2c(O)cnnc12 Amb4012547 [0,1,0,0,0,1|1,0,0]=3 4955 B13R2.342 Cc1cccc2c(O)nccc12 Amb22170094 [0,1,0,0,0,1|1,0,0]=3 4956 B13R2.342 Cc1cccc2c1C=NNC2=O Amb27623526 [0,1,0,0,0,1|1,0,1]=4 4957 B13R2.342 Cc1cccc2c1OC=CC2=O Amb22901115 [0,1,0,0,0,1|1,0,1]=4 4958 B13R2.342 Cc1cccc2c1OCCC2=O Amb33552806 [0,1,0,0,0,1|1,0,1]=4 4959 B13R2.342 Cc1cccc2c1OCCC2O Amb17107276 [0,1,0,0,0,1|1,0,1]=4 4960 B13R2.342 Cc1cccc2c1OCC[C@@H]2O Amb26010248 [0,1,0,0,0,1|1,0,1]=4 4961 B13R2.342 Cc1cccc2c1OCC[C@H]2O Amb24407938 [0,1,0,0,0,1|1,0,1]=4 4962 B13R2.342 Cc1cncc2c(Br)cccc12 Amb22546390 [0,1,0,0,0,1|2,0,0]=4 4963 B13R2.342 Cc1cncc2c(Cl)cccc12 Amb32904163 [0,1,0,0,0,1|2,0,0]=4 4964 B13R2.342 Cc1cnnc2c(Br)cccc12 Amb33549353 [0,1,0,0,0,1|2,0,0]=4 4965 B13R2.342 Cc1nccc2c(Br)cccc12 Amb24468312 [0,1,0,0,0,1|2,0,0]=4 4966 B13R2.342 Cc1nccc2c(Cl)cccc12 Amb27178529 [0,1,0,0,0,1|2,0,0]=4 4967 B13R2.342 Cc1nccc2c(I)cccc12 Amb27751837 [0,1,0,0,0,1|2,0,0]=4 4968 B13R2.342 Cc1nccc2c(N)cccc12 Amb18645065 [0,1,0,0,0,1|2,0,0]=4 4969 B13R2.342 Cc1ncnc2c(Br)cccc12 Amb22500588 [0,1,0,0,0,1|2,0,0]=4 4970 B13R2.342 Cc1ncnc2c(O)cccc12 Amb25112602 [0,1,0,0,0,1|2,0,0]=4 4971 B13R2.342 Clc1cccc2c(Br)cncc12 Amb24183746 [0,1,0,0,0,1|2,0,0]=4 4972 B13R2.342 Clc1cccc2c(Br)cnnc12 Amb27461081 [0,1,0,0,0,1|2,0,0]=4 4973 B13R2.342 Clc1cccc2c(Br)nccc12 Amb18346641 [0,1,0,0,0,1|2,0,0]=4 4974 B13R2.342 Clc1cccc2c(Br)ncnc12 Amb27209011 [0,1,0,0,0,1|2,0,0]=4 4975 B13R2.342 Clc1cccc2c(Cl)nccc12 Amb18346733 [0,1,0,0,0,1|2,0,0]=4 4976 B13R2.342 Clc1nccc2c(Br)cccc12 Amb16710940 [0,1,0,0,0,1|2,0,0]=4 4977 B13R2.342 Clc1nccc2c(I)cccc12 Amb23401165 [0,1,0,0,0,1|2,0,0]=4 4978 B13R2.342 Clc1ncnc2c(Br)cccc12 Amb1137043 [0,1,0,0,0,1|2,0,0]=4 4979 B13R2.342 Clc1ncnc2c(Cl)cccc12 Amb2700594 [0,1,0,0,0,1|2,0,0]=4 4980 B13R2.342 Clc1ncnc2c(I)cccc12 Amb8629821 [0,1,0,0,0,1|2,0,0]=4 4981 B13R2.342 Clc1nncc2c(Br)cccc12 Amb25040582 [0,1,0,0,0,1|2,0,0]=4 4982 B13R2.342 Fc1cccc2c(Br)cncc12 Amb24183763 [0,1,0,0,0,1|2,0,0]=4 4983 B13R2.342 Fc1cccc2c(Br)nccc12 Amb19099640 [0,1,0,0,0,1|2,0,0]=4 4984 B13R2.342 Fc1cccc2c(Cl)cnnc12 Amb35750399 [0,1,0,0,0,1|2,0,0]=4 4985 B13R2.342 Fc1cccc2c(Cl)nccc12 Amb18346708 [0,1,0,0,0,1|2,0,0]=4 4986 B13R2.342 Fc1cccc2c(Cl)ncnc12 Amb8629831 [0,1,0,0,0,1|2,0,0]=4 4987 B13R2.342 Fc1cccc2c(I)nccc12 Amb22738878 [0,1,0,0,0,1|2,0,0]=4 4988 B13R2.342 Fc1nccc2c(Br)cccc12 Amb35653673 [0,1,0,0,0,1|2,0,0]=4 4989 B13R2.342 Fc1ncnc2c(Br)cccc12 Amb35648863 [0,1,0,0,0,1|2,0,0]=4 4990 B13R2.342 Fc1ncnc2c(F)cccc12 Amb35653663 [0,1,0,0,0,1|2,0,0]=4 4991 B13R2.342 Nc1cccc2c(Br)cncc12 Amb19929497 [0,1,0,0,0,1|2,0,0]=4 4992 B13R2.342 Nc1cccc2c(Cl)cncc12 Amb24183786 [0,1,0,0,0,1|2,0,0]=4 4993 B13R2.342 Nc1cccc2c(Cl)nccc12 Amb10071461 [0,1,0,0,0,1|2,0,0]=4 4994 B13R2.342 Nc1cccc2c(F)cncc12 Amb24183782 [0,1,0,0,0,1|2,0,0]=4 4995 B13R2.342 Nc1cccc2c(F)nccc12 Amb33035405 [0,1,0,0,0,1|2,0,0]=4 4996 B13R2.342 Nc1cccc2c(O)cccc12 Amb534953 [0,1,0,0,0,1|2,0,0]=4 4997 B13R2.342 Nc1cccc2c(O)ccnc12 Amb21858728 [0,1,0,0,0,1|2,0,0]=4 4998 B13R2.342 Nc1cccc2c(O)cnnc12 Amb23401743 [0,1,0,0,0,1|1,0,0]=3 4999 B13R2.342 Nc1cccc2c(O)nccc12 Amb22371893 [0,1,0,0,0,1|1,0,0]=3 5000 B13R2.342 Nc1cccc2c(S)nccc12 Amb30008927 [0,1,0,0,0,1|1,1,0]=4 5001 B13R2.342 Nc1cccc2c1C=NNC2=O Amb18645459 [0,1,0,0,0,1|1,0,1]=4 5002 B13R2.342 Nc1cccc2c1NC=NC2=O Amb25074510 [0,1,0,0,0,1|1,0,1]=4 5003 B13R2.342 Nc1cccc2c1OCCC2=O Amb17570075 [0,1,0,0,0,1|1,0,1]=4 5004 B13R2.342 Nc1cccc2c1OCCC2O Amb27971949 [0,1,0,0,0,1|1,0,1]=4 5005 B13R2.342 Nc1cncc2c(Cl)cccc12 Amb24183752 [0,1,0,0,0,1|2,0,0]=4 5006 B13R2.342 Nc1cncc2c(Cl)cccc12 Amb33484021 [0,1,0,0,0,1|2,0,0]=4 5007 B13R2.342 Nc1cncc2c(F)cccc12 Amb24493523 [0,1,0,0,0,1|2,0,0]=4 5008 B13R2.342 Nc1cncc2c(O)cccc12 Amb27635919 [0,1,0,0,0,1|2,0,0]=4 5009 B13R2.342 Nc1nccc2c(Br)cccc12 Amb16185643 [0,1,0,0,0,1|2,0,0]=4 5010 B13R2.342 Nc1nccc2c(Cl)cccc12 Amb18648191 [0,1,0,0,0,1|2,0,0]=4 5011 B13R2.342 Nc1nccc2c(F)cccc12 Amb27175842 [0,1,0,0,0,1|2,0,0]=4 5012 B13R2.342 Nc1ncnc2c(Br)cccc12 Amb16889547 [0,1,0,0,0,1|2,0,0]=4 5013 B13R2.342 Nc1ncnc2c(Cl)cccc12 Amb22498027 [0,1,0,0,0,1|2,0,0]=4 5014 B13R2.342 Nc1ncnc2c(F)cccc12 Amb28124186 [0,1,0,0,0,1|2,0,0]=4 5015 B13R2.342 Nc1ncnc2c(O)cccc12 Amb27445741 [0,1,0,0,0,1|2,0,0]=4 5016 B13R2.342 Nc1nncc2c(Br)cccc12 Amb32418365 [0,1,0,0,0,1|2,0,0]=4 5017 B13R2.342 O=C1C=COc2c(Br)cccc21 Amb27481107 [0,1,0,0,0,1|1,0,1]=4 5018 B13R2.342 O=C1C=NNc2c(Br)cccc21 Amb23559900 [0,1,0,0,0,1|1,0,1]=4 5019 B13R2.342 O=C1C=NNc2c(F)cccc21 Amb23559968 [0,1,0,0,0,1|1,0,1]=4 5020 B13R2.342 O=C1C=NNc2c(I)cccc21 Amb23559972 [0,1,0,0,0,1|1,0,1]=4 5021 B13R2.342 O=C1C=NNc2c(O)cccc21 Amb27177549 [0,1,0,0,0,1|1,0,1]=4 5022 B13R2.342 O=C1CCOc2c(Br)cccc21 Amb8843607 [0,1,0,0,0,1|1,0,1]=4 5023 B13R2.342 O=C1CCOc2c(Cl)cccc21 Amb8843606 [0,1,0,0,0,1|1,0,1]=4 5024 B13R2.342 O=C1CCOc2c(F)cccc21 Amb33552655 [0,1,0,0,0,1|1,0,1]=4 5025 B13R2.342 O=C1N=CNc2c(Br)cccc21 Amb19957594 [0,1,0,0,0,1|1,0,1]=4 5026 B13R2.342 O=C1N=CNc2c(F)cccc21 Amb21857673 [0,1,0,0,0,1|1,0,1]=4 5027 B13R2.342 O=C1NN=Cc2c(Cl)cccc21 Amb27966203 [0,1,0,0,0,1|1,0,1]=4 5028 B13R2.342 O=C1NN=Cc2c(F)cccc21 Amb26444875 [0,1,0,0,0,1|1,0,1]=4 5029 B13R2.342 O=C1NN=Cc2c(O)cccc21 Amb25773416 [0,1,0,0,0,1|1,0,1]=4 5030 B13R2.342 O=C1NN=Nc2c(Cl)cccc21 Amb26049916 [0,1,0,0,0,1|1,0,1]=4 5031 B13R2.342 O=C1OCOc2c(Br)cccc21 Amb24077635 [0,1,0,0,0,1|1,0,1]=4 5032 B13R2.342 O=C1OCOc2c(F)cccc21 Amb24077631 [0,1,0,0,0,1|1,0,1]=4 5033 B13R2.342 O=c1ccoc2c(Cl)cccc12 Amb1159444 [0,1,0,0,0,1|1,0,1]=4 5034 B13R2.342 OC1CCOc2c(Cl)cccc21 Amb17107284 [0,1,0,0,0,1|1,0,1]=4 5035 B13R2.342 OC1CCOc2c(F)cccc21 Amb17107283 [0,1,0,0,0,1|1,0,1]=4 5036 B13R2.342 O[C@@H]1CCOc2c(Br)cccc21 Amb26841176 [0,1,0,0,0,1|1,0,1]=4 5037 B13R2.342 O[C@@H]1CCOc2c(Cl)cccc21 Amb13952921 [0,1,0,0,0,1|1,0,1]=4 5038 B13R2.342 O[C@@H]1CCOc2c(F)cccc21 Amb13952917 [0,1,0,0,0,1|1,0,1]=4 5039 B13R2.342 O[C@H]1CCOc2c(Br)cccc21 Amb27807025 [0,1,0,0,0,1|1,0,1]=4 5040 B13R2.342 O[C@H]1CCOc2c(Cl)cccc21 Amb13952920 [0,1,0,0,0,1|1,0,1]=4 5041 B13R2.342 O[C@H]1CCOc2c(F)cccc21 Amb13952916 [0,1,0,0,0,1|1,0,1]=4 5042 B13R2.342 Oc1cccc2c(Br)cccc12 Amb17596076 [0,1,0,0,0,1|2,0,0]=4 5043 B13R2.342 Oc1cccc2c(Br)cncc12 Amb30633580 [0,1,0,0,0,1|2,0,0]=4 5044 B13R2.342 Oc1cccc2c(Cl)cccc12 Amb17594570 [0,1,0,0,0,1|2,0,0]=4 5045 B13R2.342 Oc1cccc2c(Cl)cnnc12 Amb28243847 [0,1,0,0,0,1|2,0,0]=4 5046 B13R2.342 Oc1cccc2c(Cl)nccc12 Amb24465072 [0,1,0,0,0,1|2,0,0]=4 5047 B13R2.342 Oc1cccc2c(Cl)ncnc12 Amb27265822 [0,1,0,0,0,1|2,0,0]=4 5048 B13R2.342 Oc1cccc2c(F)cccc12 Amb17748021 [0,1,0,0,0,1|2,0,0]=4 5049 B13R2.342 Oc1cccc2c(I)cccc12 Amb10069414 [0,1,0,0,0,1|2,0,0]=4 5050 B13R2.342 Oc1cccc2c(O)cccc12 Amb6357757 [0,1,0,0,0,1|2,0,0]=4 5051 B13R2.342 Oc1cccc2c(O)nccc12 Amb33533315 [0,1,0,0,0,1|1,0,0]=3 5052 B13R2.342 Oc1cccc2c(S)cccc12 Amb18127662 [0,1,0,0,0,1|2,0,0]=4 5053 B13R2.342 Oc1ccnc2c(Br)cccc12 Amb1994214 [0,1,0,0,0,1|2,0,0]=4 5054 B13R2.342 Oc1ccnc2c(Cl)cccc12 Amb1994241 [0,1,0,0,0,1|2,0,0]=4 5055 B13R2.342 Oc1ccnc2c(F)cccc12 Amb1971626 [0,1,0,0,0,1|2,0,0]=4 5056 B13R2.342 Oc1cncc2c(Br)cccc12 Amb26575005 [0,1,0,0,0,1|1,0,0]=3 5057 B13R2.342 Oc1cncc2c(F)cccc12 Amb27427554 [0,1,0,0,0,1|1,0,0]=3 5058 B13R2.342 Oc1cnnc2c(Cl)cccc12 Amb4009395 [0,1,0,0,0,1|1,0,0]=3 5059 B13R2.342 Oc1nccc2c(Br)cccc12 Amb22170093 [0,1,0,0,0,1|1,0,0]=3 5060 B13R2.342 Oc1ncnc2c(Cl)cccc12 Amb21856980 [0,1,0,0,0,1|1,0,0]=3 5061 B13R2.342 Sc1cnnc2c(Cl)cccc12 Amb2612333 [0,1,0,0,0,1|1,1,0]=4 5062 B13R2.371 Brc1cnc(Br)c2ccccc12 Amb2609659 [0,1,0,0,0,1|2,0,0]=4 5063 B13R2.371 Brc1ncc(I)c2ccccc12 Amb22495208 [0,1,0,0,0,1|2,0,0]=4 5064 B13R2.371 Brc1nnc(Br)c2ccccc12 Amb24663215 [0,1,0,0,0,1|2,0,0]=4 5065 B13R2.371 CB1NN=C(Br)c2ccccc21 Amb2611420 [0,1,0,0,0,1|2,0,0]=4 5066 B13R2.371 CC1=NCC(C)c2ccccc21 Amb8384389 [0,1,0,0,0,1|2,0,0]=4 5067 B13R2.371 CC1=NNC(=O)c2ccccc21 Amb19132657 [0,1,0,0,0,1|1,0,1]=4 5068 B13R2.371 CC1=NNC(=S)c2ccccc21 Amb18043598 [0,1,0,0,0,1|1,1,0]=4 5069 B13R2.371 CC1=NOC(=O)c2ccccc21 Amb21927595 [0,1,0,0,0,1|1,0,0]=3 5070 B13R2.371 CN1C=NC(=O)c2ccccc21 Amb22752698 [0,1,0,0,0,1|1,0,1]=4 5071 B13R2.371 CN1N=CC(=O)c2ccccc21 Amb26626061 [0,1,0,0,0,1|1,0,1]=4 5072 B13R2.371 Cc1ccc(O)c2ccccc12 Amb17200159 [0,1,0,0,0,1|2,0,0]=4 5073 B13R2.371 Cc1cnc(Br)c2ccccc12 Amb18346618 [0,1,0,0,0,1|2,0,0]=4 5074 B13R2.371 Cc1cnc(Cl)c2ccccc12 Amb18346727 [0,1,0,0,0,1|2,0,0]=4 5075 B13R2.371 Cc1cnc(O)c2ccccc12 Amb18645157 [0,1,0,0,0,1|1,0,0]=3 5076 B13R2.371 Cc1ncc(Br)c2ccccc12 Amb22757013 [0,1,0,0,0,1|2,0,0]=4 5077 B13R2.371 Cc1ncc(N)c2ccccc12 Amb22753790 [0,1,0,0,0,1|2,0,0]=4 5078 B13R2.371 Cc1nnc(Cl)c2ccccc12 Amb1153584 [0,1,0,0,0,1|2,0,0]=4 5079 B13R2.371 Cc1nnc(F)c2ccccc12 Amb35653849 [0,1,0,0,0,1|2,0,0]=4 5080 B13R2.371 Cc1nnc(N)c2ccccc12 Amb33531651 [0,1,0,0,0,1|2,0,0]=4 5081 B13R2.371 Cc1nnc(O)c2ccccc12 Amb2371419 [0,1,0,0,0,1|1,0,0]=3 5082 B13R2.371 Cc1nnc(O)c2cccnc12 Amb18645460 [0,1,0,0,0,1|2,0,0]=4 5083 B13R2.371 Clc1cnc(Br)c2ccccc12 Amb22494769 [0,1,0,0,0,1|2,0,0]=4 5084 B13R2.371 Clc1cnc(Cl)c2ccccc12 Amb19957822 [0,1,0,0,0,1|2,0,0]=4 5085 B13R2.371 Clc1ncc(Br)c2ccccc12 Amb8389361 [0,1,0,0,0,1|2,0,0]=4 5086 B13R2.371 Clc1ncc(I)c2ccccc12 Amb22494770 [0,1,0,0,0,1|2,0,0]=4 5087 B13R2.371 Clc1nnc(Br)c2ccccc12 Amb26334925 [0,1,0,0,0,1|2,0,0]=4 5088 B13R2.371 Clc1nnc(Cl)c2ccccc12 Amb2719758 [0,1,0,0,0,1|2,0,0]=4 5089 B13R2.371 Clc1nnc(I)c2ccccc12 Amb27259898 [0,1,0,0,0,1|2,0,0]=4 5090 B13R2.371 Fc1cnc(Br)c2ccccc12 Amb22495207 [0,1,0,0,0,1|2,0,0]=4 5091 B13R2.371 Fc1cnc(Cl)c2ccccc12 Amb22495209 [0,1,0,0,0,1|2,0,0]=4 5092 B13R2.371 Fc1nnc(Cl)c2ccccc12 Amb25335769 [0,1,0,0,0,1|2,0,0]=4 5093 B13R2.371 Fc1nnc(F)c2ccccc12 Amb23401887 [0,1,0,0,0,1|2,0,0]=4 5094 B13R2.371 NC1=NNC(=O)c2ccccc21 Amb18645470 [0,1,0,0,0,1|1,0,1]=4 5095 B13R2.371 Nc1ccc(O)c2ccccc12 Amb2371292 [0,1,0,0,0,1|2,0,0]=4 5096 B13R2.371 Nc1cnc(Br)c2ccccc12 Amb24079635 [0,1,0,0,0,1|2,0,0]=4 5097 B13R2.371 Nc1cnc(Cl)c2ccccc12 Amb22497800 [0,1,0,0,0,1|2,0,0]=4 5098 B13R2.371 Nc1cnc(N)c2ccccc12 Amb27947004 [0,1,0,0,0,1|2,0,0]=4 5099 B13R2.371 Nc1cnc(N)c2ccccc12 Amb29083387 [0,1,0,0,0,1|2,0,0]=4 5100 B13R2.371 Nc1ncc(Br)c2ccccc12 Amb10975819 [0,1,0,0,0,1|2,0,0]=4 5101 B13R2.371 Nc1ncc(Cl)c2ccccc12 Amb18648197 [0,1,0,0,0,1|2,0,0]=4 5102 B13R2.371 Nc1ncc(I)c2ccccc12 Amb22728130 [0,1,0,0,0,1|2,0,0]=4 5103 B13R2.371 Nc1nnc(Cl)c2ccccc12 Amb18278111 [0,1,0,0,0,1|2,0,0]=4 5104 B13R2.371 Nc1nnc(F)c2ccccc12 Amb32669700 [0,1,0,0,0,1|2,0,0]=4 5105 B13R2.371 Nc1nnc(N)c2ccccc12 Amb1147542 [0,1,0,0,0,1|2,0,0]=4 5106 B13R2.371 Nc1nnc(O)c2ccccc12 Amb22492172 [0,1,0,0,0,1|1,0,0]=3 5107 B13R2.371 O=C1CN=C(Cl)c2ccccc21 Amb28077322 [0,1,0,0,0,1|1,0,1]=4 5108 B13R2.371 O=C1COC(=O)c2ccccc21 Amb24078409 [0,1,0,0,0,1|1,0,1]=4 5109 B13R2.371 O=C1COC(O)c2ccccc21 Amb27948576 [0,1,0,0,0,1|1,0,1]=4 5110 B13R2.371 O=C1N=CN(O)c2ccccc21 Amb22752699 [0,1,0,0,0,1|1,0,1]=4 5111 B13R2.371 O=C1NN=C(Br)c2ccccc21 Amb24468810 [0,1,0,0,0,1|1,0,1]=4 5112 B13R2.371 O=C1NN=C(Cl)c2ccccc21 Amb19665276 [0,1,0,0,0,1|1,0,1]=4 5113 B13R2.371 O=C1OCC(O)c2ccccc21 Amb27978275 [0,1,0,0,0,1|1,0,1]=4 5114 B13R2.371 Oc1ccc(Br)c2ccccc12 Amb6487355 [0,1,0,0,0,1|2,0,0]=4 5115 B13R2.371 Oc1ccc(Cl)c2ccccc12 Amb6297771 [0,1,0,0,0,1|2,0,0]=4 5116 B13R2.371 Oc1ccc(F)c2ccccc12 Amb8467864 [0,1,0,0,0,1|2,0,0]=4 5117 B13R2.371 Oc1ccc(I)c2ccccc12 Amb23402064 [0,1,0,0,0,1|2,0,0]=4 5118 B13R2.371 Oc1ccc(O)c2ccccc12 Amb2725812 [0,1,0,0,0,1|2,0,0]=4 5119 B13R2.371 Oc1ccc(S)c2ccccc12 Amb17594486 [0,1,0,0,0,1|2,0,0]=4 5120 B13R2.371 Oc1cnc(Br)c2ccccc12 Amb28145361 [0,1,0,0,0,1|1,0,0]=3 5121 B13R2.371 Oc1cnc(Cl)c2ccccc12 Amb16231030 [0,1,0,0,0,1|1,0,0]=3 5122 B13R2.371 Oc1cnc(O)c2ccccc12 Amb22295929 [0,1,0,0,0,1|1,0,0]=3 5123 B13R2.371 Oc1cnc(O)c2ccncc12 Amb27667321 [0,1,0,0,0,1|2,0,0]=4 5124 B13R2.371 Oc1cnc(O)c2ncccc12 Amb28051551 [0,1,0,0,0,1|2,0,0]=4 5125 B13R2.371 Oc1ncc(Br)c2ccccc12 Amb16185652 [0,1,0,0,0,1|1,0,0]=3 5126 B13R2.371 Oc1ncc(Br)c2cccnc12 Amb7101463 [0,1,0,0,0,1|2,0,0]=4 5127 B13R2.371 Oc1ncc(F)c2ccccc12 Amb27623321 [0,1,0,0,0,1|1,0,0]=3 5128 B13R2.371 Oc1ncc(I)c2ncccc12 Amb25148689 [0,1,0,0,0,1|2,0,0]=4 5129 B13R2.371 Oc1nnc(Cl)c2ccccc12 Amb6373966 [0,1,0,0,0,1|1,0,0]=3 5130 B13R2.371 Oc1nnc(O)c2ccccc12 Amb2762640 [0,1,0,0,0,1|1,0,0]=3 5131 B13R2.371 Sc1ncc(I)c2ccccc12 Amb28071261 [0,1,0,0,0,1|1,1,0]=4 5132 B13R2.371 Sc1nnc(S)c2ccccc12 Amb2610322 [0,1,0,0,0,1|1,1,0]=4 5133 B13R2.371 [NH3+]c1ccc(O)c2ccccc12 Amb22034889 [0,1,0,0,0,1|2,0,0]=4 5134 B13R2.371 [O-][n+]1ccc(O)c2ccccc21 Amb2609672 [0,1,0,0,0,1|2,0,0]=4 5135 B13R2.1613 BrCc1cncc2ccccc12 Amb22736516 [0,1,0,0,0,1|2,0,0]=4 5136 B13R2.1613 BrCc1cncc2ccccc12 Amb27986050 [0,1,0,0,0,1|2,0,0]=4 5137 B13R2.1613 BrCc1nccc2ccccc12 Amb2723079 [0,1,0,0,0,1|2,0,0]=4 5138 B13R2.1613 BrCc1nccc2ccccc12 Amb8631541 [0,1,0,0,0,1|2,0,0]=4 5139 B13R2.1613 BrCc1ncnc2ccccc12 Amb27209284 [0,1,0,0,0,1|2,0,0]=4 5140 B13R2.1613 C#Cc1cncc2ccccc12 Amb21857752 [0,1,0,0,0,1|2,0,0]=4 5141 B13R2.1613 C#Cc1nncc2ccccc12 Amb28291261 [0,1,0,0,0,1|2,0,0]=4 5142 B13R2.1613 C=Cc1cncc2ccccc12 Amb25076725 [0,1,0,0,0,1|2,0,0]=4 5143 B13R2.1613 C=Cc1nccc2ccccc12 Amb17940141 [0,1,0,0,0,1|2,0,0]=4 5144 B13R2.1613 CCC1=NCCc2ccccc21 Amb25035624 [0,1,0,0,0,1|2,0,0]=4 5145 B13R2.1613 CCc1nncc2ccccc12 Amb27847124 [0,1,0,0,0,1|2,0,0]=4 5146 B13R2.1613 CNC1=NCCc2ccccc21 Amb28240971 [0,1,0,0,0,1|2,0,0]=4 5147 B13R2.1613 CNc1cnnc2ccccc12 Amb10553679 [0,1,0,0,0,1|2,0,0]=4 5148 B13R2.1613 CNc1nccc2ccccc12 Amb18456056 [0,1,0,0,0,1|2,0,0]=4 5149 B13R2.1613 CNc1ncnc2ccccc12 Amb13952346 [0,1,0,0,0,1|2,0,0]=4 5150 B13R2.1613 CNc1nncc2ccccc12 Amb9276862 [0,1,0,0,0,1|2,0,0]=4 5151 B13R2.1613 CNc1nnnc2ccccc12 Amb23536336 [0,1,0,0,0,1|2,0,0]=4 5152 B13R2.1613 COC1=CCCc2ccccc21 Amb8392114 [0,1,0,0,0,1|2,0,0]=4 5153 B13R2.1613 COC1=NCCc2ccccc21 Amb24665738 [0,1,0,0,0,1|1,0,0]=3 5154 B13R2.1613 COc1cccc2ccccc12 Amb4317506 [0,1,0,0,0,1|2,0,0]=4 5155 B13R2.1613 COc1ccnc2ccccc12 Amb2694871 [0,1,0,0,0,1|2,0,0]=4 5156 B13R2.1613 COc1cncc2ccccc12 Amb19957897 [0,1,0,0,0,1|1,0,0]=3 5157 B13R2.1613 COc1cnnc2ccccc12 Amb25034761 [0,1,0,0,0,1|1,0,0]=3 5158 B13R2.1613 COc1nccc2ccccc12 Amb22364879 [0,1,0,0,0,1|1,0,0]=3 5159 B13R2.1613 COc1nccc2ncccc12 Amb27616741 [0,1,0,0,0,1|2,0,0]=4 5160 B13R2.1613 COc1nncc2ccccc12 Amb10552963 [0,1,0,0,0,1|1,0,0]=3 5161 B13R2.1613 COc1nncc2cnccc12 Amb27759977 [0,1,0,0,0,1|2,0,0]=4 5162 B13R2.1613 CSc1ncnc2ccccc12 Amb1349919 [0,1,0,0,0,1|1,1,0]=4 5163 B13R2.1613 CSc1nncc2ccccc12 Amb27669012 [0,1,0,0,0,1|1,1,0]=4 5164 B13R2.1613 CSc1nnnc2ccccc12 Amb2645614 [0,1,0,0,0,1|1,1,0]=4 5165 B13R2.1613 ClCC1=NCCc2ccccc21 Amb17506200 [0,1,0,0,0,1|2,0,0]=4 5166 B13R2.1613 ClCC1=NCCc2ccccc21 Amb506434 [0,1,0,0,0,1|2,0,0]=4 5167 B13R2.1613 ClCc1nccc2ccccc12 Amb18184251 [0,1,0,0,0,1|2,0,0]=4 5168 B13R2.1613 ClCc1nncc2ccccc12 Amb27654938 [0,1,0,0,0,1|2,0,0]=4 5169 B13R2.1613 N#CC1=CCOc2ccccc21 Amb17232199 [0,1,0,0,0,1|2,0,0]=4 5170 B13R2.1613 N#Cc1cncc2ccccc12 Amb17938213 [0,1,0,0,0,1|2,0,0]=4 5171 B13R2.1613 N#Cc1cnnc2ccccc12 Amb18644713 [0,1,0,0,0,1|2,0,0]=4 5172 B13R2.1613 N#Cc1nccc2ccccc12 Amb1063462 [0,1,0,0,0,1|2,0,0]=4 5173 B13R2.1613 N#Cc1nncc2ccccc12 Amb18644714 [0,1,0,0,0,1|2,0,0]=4 5174 B13R2.1613 NCC1=CCOc2ccccc21 Amb18063317 [0,1,0,0,0,1|2,0,0]=4 5175 B13R2.1613 NCC1=NCCc2ccccc21 Amb29848147 [0,1,0,0,0,1|2,0,0]=4 5176 B13R2.1613 NCc1cncc2ccccc12 Amb8011340 [0,1,0,0,0,1|2,0,0]=4 5177 B13R2.1613 NCc1cnnc2ccccc12 Amb27203933 [0,1,0,0,0,1|2,0,0]=4 5178 B13R2.1613 NCc1nccc2ccccc12 Amb1083112 [0,1,0,0,0,1|2,0,0]=4 5179 B13R2.1613 NCc1nccc2ccccc12 Amb137506 [0,1,0,0,0,1|2,0,0]=4 5180 B13R2.1613 NCc1nccc2ccccc12 Amb7969521 [0,1,0,0,0,1|2,0,0]=4 5181 B13R2.1613 NCc1ncnc2ccccc12 Amb8011555 [0,1,0,0,0,1|2,0,0]=4 5182 B13R2.1613 NCc1nncc2ccccc12 Amb18893424 [0,1,0,0,0,1|2,0,0]=4 5183 B13R2.1613 NNC1=NCCc2ccccc21 Amb18126292 [0,1,0,0,0,1|2,0,0]=4 5184 B13R2.1613 NNc1cnnc2ccccc12 Amb17516270 [0,1,0,0,0,1|2,0,0]=4 5185 B13R2.1613 NNc1nccc2ccccc12 Amb22587221 [0,1,0,0,0,1|2,0,0]=4 5186 B13R2.1613 NNc1nccc2ccccc12 Amb6752535 [0,1,0,0,0,1|2,0,0]=4 5187 B13R2.1613 NNc1ncnc2ccccc12 Amb1154617 [0,1,0,0,0,1|2,0,0]=4 5188 B13R2.1613 NNc1nncc2ccccc12 Amb1107104 [0,1,0,0,0,1|2,0,0]=4 5189 B13R2.1613 NOc1cccc2ccccc12 Amb28048224 [0,1,0,0,0,1|2,0,0]=4 5190 B13R2.1613 N\N=C1/NN=Cc2ccccc21 Amb22411665 [0,1,0,0,0,1|2,0,0]=4 5191 B13R2.1613 N\N=C1\NN=Cc2ccccc21 Amb22276126 [0,1,0,0,0,1|2,0,0]=4 5192 B13R2.1613 O=Cc1cncc2ccccc12 Amb6572006 [0,1,0,0,0,1|1,0,1]=4 5193 B13R2.1613 O=Cc1nccc2ccccc12 Amb8010574 [0,1,0,0,0,1|1,0,1]=4 5194 B13R2.1613 O=Cc1ncnc2ccccc12 Amb21963279 [0,1,0,0,0,1|1,0,1]=4 5195 B13R2.1613 O=Nc1nccc2ccccc12 Amb27847659 [0,1,0,0,0,1|1,0,1]=4 5196 B13R2.1613 O=Nc1ncnc2ccccc12 Amb28051690 [0,1,0,0,0,1|1,0,1]=4 5197 B13R2.1613 O=Nc1nncc2ccccc12 Amb27186201 [0,1,0,0,0,1|1,0,1]=4 5198 B13R2.1613 OCC1=CCOc2ccccc21 Amb28292189 [0,1,0,0,0,1|1,0,0]=3 5199 B13R2.1613 OCC1=CNCc2ccccc21 Amb27228922 [0,1,0,0,0,1|1,0,1]=4 5200 B13R2.1613 OCC1CCOc2ccccc21 Amb27250372 [0,1,0,0,0,1|1,0,1]=4 5201 B13R2.1613 OCC1COCc2ccccc21 Amb27652931 [0,1,0,0,0,1|1,0,1]=4 5202 B13R2.1613 OCc1cccc2ccccc12 Amb3939082 [0,1,0,0,0,1|2,0,0]=4 5203 B13R2.1613 OCc1ccnc2ccccc12 Amb8439281 [0,1,0,0,0,1|2,0,0]=4 5204 B13R2.1613 OCc1cncc2ccccc12 Amb18353502 [0,1,0,0,0,1|1,0,0]=3 5205 B13R2.1613 OCc1cncc2cnccc12 Amb27429163 [0,1,0,0,0,1|2,0,0]=4 5206 B13R2.1613 OCc1cnnc2ccccc12 Amb24473309 [0,1,0,0,0,1|1,0,0]=3 5207 B13R2.1613 OCc1nccc2ccccc12 Amb2519172 [0,1,0,0,0,1|1,0,0]=3 5208 B13R2.1613 OCc1nccc2ccncc12 Amb27604287 [0,1,0,0,0,1|2,0,0]=4 5209 B13R2.1613 OCc1nccc2ncccc12 Amb24714526 [0,1,0,0,0,1|2,0,0]=4 5210 B13R2.1613 ONC1CCOc2ccccc21 Amb28289239 [0,1,0,0,0,1|1,0,1]=4 5211 B13R2.1613 ONc1cccc2ccccc12 Amb25127990 [0,1,0,0,0,1|2,0,0]=4 5212 B13R2.1613 ONc1cnnc2ccccc12 Amb27776635 [0,1,0,0,0,1|1,0,0]=3 5213 B13R2.1613 ONc1nccc2ccccc12 Amb27478801 [0,1,0,0,0,1|1,0,0]=3 5214 B13R2.1613 ONc1ncnc2ccccc12 Amb28456836 [0,1,0,0,0,1|1,0,0]=3 5215 B13R2.1613 ONc1ncnc2ccncc12 Amb28145996 [0,1,0,0,0,1|2,0,0]=4 5216 B13R2.1613 ONc1nncc2ccccc12 Amb27468446 [0,1,0,0,0,1|1,0,0]=3 5217 B13R2.1613 O\N=C1/CCCc2ccccc21 Amb22727930 [0,1,0,0,0,1|2,0,0]=4 5218 B13R2.1613 O\N=C1/CCNc2ccccc21 Amb27240399 [0,1,0,0,0,1|2,0,0]=4 5219 B13R2.1613 O\N=C1/CCOc2ccccc21 Amb19372590 [0,1,0,0,0,1|1,0,0]=3 5220 B13R2.1613 O\N=C1/CCOc2ccccc21 Amb33715894 [0,1,0,0,0,1|1,0,0]=3 5221 B13R2.1613 O\N=C1/CCOc2cccnc21 Amb28322872 [0,1,0,0,0,1|2,0,0]=4 5222 B13R2.1613 O\N=C1/CCSc2ccccc21 Amb22366070 [0,1,0,0,0,1|1,1,0]=4 5223 B13R2.1613 O\N=C1\CCCc2ccccc21 Amb6296018 [0,1,0,0,0,1|2,0,0]=4 5224 B13R2.1613 O\N=C1\CCOc2ccccc21 Amb26409966 [0,1,0,0,0,1|1,0,0]=3 5225 B13R2.1613 O\N=C1\CSCc2ccccc21 Amb27426833 [0,1,0,0,0,1|1,1,0]=4 5226 B13R2.1613 SCc1cncc2ccccc12 Amb26363308 [0,1,0,0,0,1|1,1,0]=4 5227 B13R2.1613 [C-]#[N+]c1nccc2ccccc12 Amb33733086 [0,1,0,0,0,1|2,0,0]=4 5228 B13R2.1613 [NH3+]Nc1nncc2ccccc12 Amb24113852 [0,1,0,0,0,1|2,0,0]=4 5229 B13R2.3122 CC1(O)CCOc2ccccc21 Amb26517607 [0,1,0,0,0,1|1,0,1]=4 5230 B13R2.4818 Brc1cccc2ccnc(Br)c12 Amb18346675 [0,1,0,0,0,1|2,0,0]=4 5231 B13R2.4818 Brc1cccc2cncc(Br)c12 Amb27870733 [0,1,0,0,0,1|2,0,0]=4 5232 B13R2.4818 CC1=CCOc2cccc(N)c21 Amb27658773 [0,1,0,0,0,1|2,0,0]=4 5233 B13R2.4818 Cc1cccc2c1C(=O)C=CO2 Amb27638796 [0,1,0,0,0,1|1,0,1]=4 5234 B13R2.4818 Cc1cccc2c1C(=O)CCO2 Amb18829762 [0,1,0,0,0,1|1,0,1]=4 5235 B13R2.4818 Cc1cccc2c1C(=O)NN=C2 Amb27795144 [0,1,0,0,0,1|1,0,1]=4 5236 B13R2.4818 Cc1cccc2c1C(O)CCO2 Amb26918383 [0,1,0,0,0,1|1,0,1]=4 5237 B13R2.4818 Cc1cccc2cccc(O)c12 Amb18645050 [0,1,0,0,0,1|2,0,0]=4 5238 B13R2.4818 Cc1cccc2ccnc(Br)c12 Amb18062829 [0,1,0,0,0,1|2,0,0]=4 5239 B13R2.4818 Cc1cccc2ccnc(C)c12 Amb27872126 [0,1,0,0,0,1|2,0,0]=4 5240 B13R2.4818 Cc1cccc2ccnc(Cl)c12 Amb18560362 [0,1,0,0,0,1|2,0,0]=4 5241 B13R2.4818 Cc1cccc2ccnc(N)c12 Amb18062844 [0,1,0,0,0,1|2,0,0]=4 5242 B13R2.4818 Cc1cccc2ccnc(O)c12 Amb18560330 [0,1,0,0,0,1|1,0,0]=3 5243 B13R2.4818 Cc1cccc2cncc(Br)c12 Amb33297996 [0,1,0,0,0,1|2,0,0]=4 5244 B13R2.4818 Cc1cccc2cncc(C)c12 Amb28051686 [0,1,0,0,0,1|2,0,0]=4 5245 B13R2.4818 Cc1cccc2cncc(N)c12 Amb18357169 [0,1,0,0,0,1|2,0,0]=4 5246 B13R2.4818 Cc1cccc2cncc(O)c12 Amb19110676 [0,1,0,0,0,1|1,0,0]=3 5247 B13R2.4818 Cc1cccc2nccc(O)c12 Amb24066111 [0,1,0,0,0,1|2,0,0]=4 5248 B13R2.4818 Cc1cccc2ncnc(Cl)c12 Amb18790997 [0,1,0,0,0,1|2,0,0]=4 5249 B13R2.4818 Cc1cccc2ncnc(F)c12 Amb35653792 [0,1,0,0,0,1|2,0,0]=4 5250 B13R2.4818 Cc1cccc2ncnc(N)c12 Amb25783326 [0,1,0,0,0,1|2,0,0]=4 5251 B13R2.4818 Cc1cncc2cccc(Br)c12 Amb16185649 [0,1,0,0,0,1|2,0,0]=4 5252 B13R2.4818 Cc1cncc2cccc(N)c12 Amb21857862 [0,1,0,0,0,1|2,0,0]=4 5253 B13R2.4818 Cc1cnnc2cccc(N)c12 Amb27593161 [0,1,0,0,0,1|2,0,0]=4 5254 B13R2.4818 Cc1nccc2cccc(Br)c12 Amb26632608 [0,1,0,0,0,1|2,0,0]=4 5255 B13R2.4818 Cc1nccc2cccc(F)c12 Amb24531551 [0,1,0,0,0,1|2,0,0]=4 5256 B13R2.4818 Cc1nccc2cccc(O)c12 Amb24591300 [0,1,0,0,0,1|2,0,0]=4 5257 B13R2.4818 Clc1cccc2ccnc(Br)c12 Amb18062832 [0,1,0,0,0,1|2,0,0]=4 5258 B13R2.4818 Clc1cccc2ccnc(Cl)c12 Amb18560358 [0,1,0,0,0,1|2,0,0]=4 5259 B13R2.4818 Clc1cccc2cncc(Br)c12 Amb27400640 [0,1,0,0,0,1|2,0,0]=4 5260 B13R2.4818 Clc1cccc2cnnc(Cl)c12 Amb26872078 [0,1,0,0,0,1|2,0,0]=4 5261 B13R2.4818 Clc1cccc2ncnc(Br)c12 Amb22497762 [0,1,0,0,0,1|2,0,0]=4 5262 B13R2.4818 Clc1cccc2ncnc(Cl)c12 Amb8629833 [0,1,0,0,0,1|2,0,0]=4 5263 B13R2.4818 Clc1cccc2nncc(Br)c12 Amb27813074 [0,1,0,0,0,1|2,0,0]=4 5264 B13R2.4818 Clc1cncc2cccc(Br)c12 Amb24183783 [0,1,0,0,0,1|2,0,0]=4 5265 B13R2.4818 Clc1nccc2cccc(Br)c12 Amb18346751 [0,1,0,0,0,1|2,0,0]=4 5266 B13R2.4818 Clc1nccc2cccc(I)c12 Amb34145131 [0,1,0,0,0,1|2,0,0]=4 5267 B13R2.4818 Clc1ncnc2cccc(Br)c12 Amb1137658 [0,1,0,0,0,1|2,0,0]=4 5268 B13R2.4818 Clc1ncnc2cccc(I)c12 Amb8629819 [0,1,0,0,0,1|2,0,0]=4 5269 B13R2.4818 Clc1nncc2cccc(Br)c12 Amb28282590 [0,1,0,0,0,1|2,0,0]=4 5270 B13R2.4818 Fc1cccc2ccnc(Br)c12 Amb18560395 [0,1,0,0,0,1|2,0,0]=4 5271 B13R2.4818 Fc1cccc2ccnc(Cl)c12 Amb18560363 [0,1,0,0,0,1|2,0,0]=4 5272 B13R2.4818 Fc1cccc2ncnc(Br)c12 Amb25114903 [0,1,0,0,0,1|2,0,0]=4 5273 B13R2.4818 Fc1cccc2ncnc(Cl)c12 Amb20241698 [0,1,0,0,0,1|2,0,0]=4 5274 B13R2.4818 Fc1cccc2ncnc(Cl)c12 Amb8629830 [0,1,0,0,0,1|2,0,0]=4 5275 B13R2.4818 Fc1cccc2ncnc(F)c12 Amb35653954 [0,1,0,0,0,1|2,0,0]=4 5276 B13R2.4818 Fc1cncc2cccc(Br)c12 Amb24183791 [0,1,0,0,0,1|2,0,0]=4 5277 B13R2.4818 Nc1cccc2c1C(=O)N=CN2 Amb22489697 [0,1,0,0,0,1|1,0,1]=4 5278 B13R2.4818 Nc1cccc2cccc(O)c12 Amb10604376 [0,1,0,0,0,1|2,0,0]=4 5279 B13R2.4818 Nc1cccc2cccc(O)c12 Amb32663182 [0,1,0,0,0,1|2,0,0]=4 5280 B13R2.4818 Nc1cccc2ccnc(Cl)c12 Amb24729481 [0,1,0,0,0,1|2,0,0]=4 5281 B13R2.4818 Nc1cccc2ccnc(O)c12 Amb22736518 [0,1,0,0,0,1|1,0,0]=3 5282 B13R2.4818 Nc1cccc2cncc(Br)c12 Amb22170091 [0,1,0,0,0,1|2,0,0]=4 5283 B13R2.4818 Nc1cccc2cncc(Cl)c12 Amb22490412 [0,1,0,0,0,1|2,0,0]=4 5284 B13R2.4818 Nc1cccc2cncc(F)c12 Amb24183736 [0,1,0,0,0,1|2,0,0]=4 5285 B13R2.4818 Nc1cccc2nccc(O)c12 Amb22495240 [0,1,0,0,0,1|2,0,0]=4 5286 B13R2.4818 Nc1cccc2ncnc(Cl)c12 Amb26508534 [0,1,0,0,0,1|2,0,0]=4 5287 B13R2.4818 Nc1cncc2cccc(O)c12 Amb28434860 [0,1,0,0,0,1|2,0,0]=4 5288 B13R2.4818 Nc1nccc2cccc(Br)c12 Amb22735842 [0,1,0,0,0,1|2,0,0]=4 5289 B13R2.4818 Nc1nccc2cccc(Cl)c12 Amb18062846 [0,1,0,0,0,1|2,0,0]=4 5290 B13R2.4818 Nc1nccc2cccc(F)c12 Amb18062845 [0,1,0,0,0,1|2,0,0]=4 5291 B13R2.4818 Nc1nccc2cccc(O)c12 Amb25253737 [0,1,0,0,0,1|2,0,0]=4 5292 B13R2.4818 Nc1nccc2cccc(O)c12 Amb32665394 [0,1,0,0,0,1|2,0,0]=4 5293 B13R2.4818 Nc1ncnc2cccc(Br)c12 Amb19958625 [0,1,0,0,0,1|2,0,0]=4 5294 B13R2.4818 Nc1ncnc2cccc(Cl)c12 Amb16199956 [0,1,0,0,0,1|2,0,0]=4 5295 B13R2.4818 Nc1ncnc2cccc(F)c12 Amb2610296 [0,1,0,0,0,1|2,0,0]=4 5296 B13R2.4818 O=C1C=NNc2cccc(Br)c21 Amb23559906 [0,1,0,0,0,1|1,0,1]=4 5297 B13R2.4818 O=C1CCOc2cccc(Br)c21 Amb16233097 [0,1,0,0,0,1|1,0,1]=4 5298 B13R2.4818 O=C1CCOc2cccc(Cl)c21 Amb16233096 [0,1,0,0,0,1|1,0,1]=4 5299 B13R2.4818 O=C1CCOc2cccc(F)c21 Amb16233077 [0,1,0,0,0,1|1,0,1]=4 5300 B13R2.4818 O=C1CCOc2cccc(O)c21 Amb27855395 [0,1,0,0,0,1|1,0,1]=4 5301 B13R2.4818 O=C1CCOc2cccc(S)c21 Amb27815330 [0,1,0,0,0,1|1,0,1]=4 5302 B13R2.4818 O=C1COCc2cccc(Cl)c21 Amb24081478 [0,1,0,0,0,1|1,0,1]=4 5303 B13R2.4818 O=C1COCc2cccc(I)c21 Amb25096376 [0,1,0,0,0,1|1,0,1]=4 5304 B13R2.4818 O=C1COCc2cccc(O)c21 Amb28388764 [0,1,0,0,0,1|1,0,1]=4 5305 B13R2.4818 O=C1N=CNc2cccc(F)c21 Amb19958984 [0,1,0,0,0,1|1,0,1]=4 5306 B13R2.4818 O=C1NN=Cc2cccc(Cl)c21 Amb22170156 [0,1,0,0,0,1|1,0,1]=4 5307 B13R2.4818 O=C1NN=Cc2cccc(F)c21 Amb25198237 [0,1,0,0,0,1|1,0,1]=4 5308 B13R2.4818 O=C1NN=Cc2cccc(O)c21 Amb32658725 [0,1,0,0,0,1|1,0,1]=4 5309 B13R2.4818 O=C1OCOc2cccc(Br)c21 Amb24077632 [0,1,0,0,0,1|1,0,1]=4 5310 B13R2.4818 O=C1OCOc2cccc(F)c21 Amb24077628 [0,1,0,0,0,1|1,0,1]=4 5311 B13R2.4818 OC1CCOc2cccc(Cl)c21 Amb27862095 [0,1,0,0,0,1|1,0,1]=4 5312 B13R2.4818 OC1CCOc2cccc(I)c21 Amb24620808 [0,1,0,0,0,1|1,0,1]=4 5313 B13R2.4818 O[C@@H]1CCOc2cccc(F)c21 Amb27796123 [0,1,0,0,0,1|1,0,1]=4 5314 B13R2.4818 O[C@H]1CCOc2cccc(F)c21 Amb27862152 [0,1,0,0,0,1|1,0,1]=4 5315 B13R2.4818 Oc1cccc2cccc(Br)c12 Amb17596079 [0,1,0,0,0,1|2,0,0]=4 5316 B13R2.4818 Oc1cccc2cccc(Cl)c12 Amb17594573 [0,1,0,0,0,1|2,0,0]=4 5317 B13R2.4818 Oc1cccc2cccc(F)c12 Amb25707652 [0,1,0,0,0,1|2,0,0]=4 5318 B13R2.4818 Oc1cccc2cccc(O)c12 Amb33544403 [0,1,0,0,0,1|2,0,0]=4 5319 B13R2.4818 Oc1cccc2ccnc(Cl)c12 Amb25898668 [0,1,0,0,0,1|2,0,0]=4 5320 B13R2.4818 Oc1cccc2cncc(Br)c12 Amb25896880 [0,1,0,0,0,1|2,0,0]=4 5321 B13R2.4818 Oc1cccc2cncc(Cl)c12 Amb30633581 [0,1,0,0,0,1|2,0,0]=4 5322 B13R2.4818 Oc1cccc2cncc(O)c12 Amb27791148 [0,1,0,0,0,1|1,0,0]=3 5323 B13R2.4818 Oc1cccc2ncnc(Cl)c12 Amb25337525 [0,1,0,0,0,1|2,0,0]=4 5324 B13R2.4818 Oc1ccnc2cccc(Br)c12 Amb19958449 [0,1,0,0,0,1|2,0,0]=4 5325 B13R2.4818 Oc1ccnc2cccc(F)c12 Amb13883527 [0,1,0,0,0,1|2,0,0]=4 5326 B13R2.4818 Oc1ccnc2cccc(I)c12 Amb26867551 [0,1,0,0,0,1|2,0,0]=4 5327 B13R2.4818 Oc1cncc2cccc(Cl)c12 Amb18357349 [0,1,0,0,0,1|1,0,0]=3 5328 B13R2.4818 Oc1cncc2cccc(F)c12 Amb27441330 [0,1,0,0,0,1|1,0,0]=3 5329 B13R2.4818 Oc1nccc2cccc(Br)c12 Amb22492475 [0,1,0,0,0,1|1,0,0]=3 5330 B13R2.4818 Oc1ncnc2cccc(Br)c12 Amb19958354 [0,1,0,0,0,1|1,0,0]=3 5331 B13R2.4818 Oc1ncnc2cccc(F)c12 Amb2688111 [0,1,0,0,0,1|1,0,0]=3 5332 B13R2.4818 Oc1ncnc2nccc(Br)c12 Amb33038495 [0,1,0,0,0,1|2,0,0]=4 5333 B13R2.1 BrCCc1coc2ccccc12 Amb25679155 [0,2,0,0,0,0|2,0,0]=4 5334 B13R2.1 BrCCc1noc2ccccc12 Amb17108211 [0,2,0,0,0,0|1,0,0]=3 5335 B13R2.1 BrCCc1nsc2ccccc12 Amb27475297 [0,2,0,0,0,0|1,1,0]=4 5336 B13R2.1 CCCc1noc2ccccc12 Amb27225179 [0,2,0,0,0,0|1,0,0]=3 5337 B13R2.1 CCNc1coc2ccccc12 Amb25119969 [0,2,0,0,0,0|2,0,0]=4 5338 B13R2.1 CCNc1noc2ccccc12 Amb27454266 [0,2,0,0,0,0|1,0,0]=3 5339 B13R2.1 CCNc1nsc2ccccc12 Amb24066790 [0,2,0,0,0,0|1,1,0]=4 5340 B13R2.1 CCNc1nsc2ccccc12 Amb24488581 [0,2,0,0,0,0|1,1,0]=4 5341 B13R2.1 CCOc1coc2cccnc12 Amb27954718 [0,2,0,0,0,0|2,0,0]=4 5342 B13R2.1 CCOc1nsc2ccccc12 Amb27962492 [0,2,0,0,0,0|0,1,0]=3 5343 B13R2.1 CNCc1coc2ccccc12 Amb19649828 [0,2,0,0,0,0|2,0,0]=4 5344 B13R2.1 CNCc1noc2ncccc12 Amb27200417 [0,2,0,0,0,0|2,0,0]=4 5345 B13R2.1 COCc1coc2ncccc12 Amb27175694 [0,2,0,0,0,0|2,0,0]=4 5346 B13R2.1 COCc1noc2ccccc12 Amb27185986 [0,2,0,0,0,0|0,0,0]=2 5347 B13R2.1 COCn1ncc2ccccc21 Amb23401112 [0,2,0,0,0,0|2,0,0]=4 5348 B13R2.1 COCn1nnc2ccccc21 Amb2747406 [0,2,0,0,0,0|2,0,0]=4 5349 B13R2.1 CONC1COc2ccccc21 Amb27868132 [0,2,0,0,0,0|1,0,1]=4 5350 B13R2.1 CONc1nsc2ccccc12 Amb27598422 [0,2,0,0,0,0|0,1,0]=3 5351 B13R2.1 CO\N=C1\CCc2ccccc21 Amb22752143 [0,2,0,0,0,0|2,0,0]=4 5352 B13R2.1 CO\N=C1\COc2cccnc21 Amb27480125 [0,2,0,0,0,0|2,0,0]=4 5353 B13R2.1 ClCCc1noc2ccccc12 Amb17108104 [0,2,0,0,0,0|1,0,0]=3 5354 B13R2.1 N#CCc1coc2ccccc12 Amb2723682 [0,2,0,0,0,0|2,0,0]=4 5355 B13R2.1 N#CCc1noc2cnccc12 Amb27427581 [0,2,0,0,0,0|2,0,0]=4 5356 B13R2.1 N#CCc1noc2ncccc12 Amb18645141 [0,2,0,0,0,0|2,0,0]=4 5357 B13R2.1 N#CCc1nsc2ccccc12 Amb2608947 [0,2,0,0,0,0|1,1,0]=4 5358 B13R2.1 NCCc1coc2ccccc12 Amb2723681 [0,2,0,0,0,0|2,0,0]=4 5359 B13R2.1 NCCc1noc2ccccc12 Amb18251617 [0,2,0,0,0,0|1,0,0]=3 5360 B13R2.1 NCCc1noc2ccccc12 Amb28600228 [0,2,0,0,0,0|1,0,0]=3 5361 B13R2.1 NCCc1noc2cnccc12 Amb27200416 [0,2,0,0,0,0|2,0,0]=4 5362 B13R2.1 NCCc1nsc2ccccc12 Amb25214793 [0,2,0,0,0,0|1,1,0]=4 5363 B13R2.1 NCCc1nsc2ccccc12 Amb28556073 [0,2,0,0,0,0|1,1,0]=4 5364 B13R2.1 NNCc1coc2ccccc12 Amb19664673 [0,2,0,0,0,0|2,0,0]=4 5365 B13R2.1 NNCc1noc2ccccc12 Amb24736646 [0,2,0,0,0,0|1,0,0]=3 5366 B13R2.1 NOCC1COc2ccccc21 Amb27759143 [0,2,0,0,0,0|1,0,1]=4 5367 B13R2.1 NOCc1coc2ccccc12 Amb26406297 [0,2,0,0,0,0|1,0,0]=3 5368 B13R2.1 NOCc1csc2ccccc12 Amb25791722 [0,2,0,0,0,0|1,1,0]=4 5369 B13R2.1 NOCc1occ2ccccc12 Amb25319347 [0,2,0,0,0,0|2,0,0]=4 5370 B13R2.1 N\C=N\c1nsc2ccccc12 Amb25301365 [0,2,0,0,0,0|1,1,0]=4 5371 B13R2.1 N\N=C\c1coc2ccccc12 Amb27485719 [0,2,0,0,0,0|2,0,0]=4 5372 B13R2.1 OCCc1coc2ccccc12 Amb2723680 [0,2,0,0,0,0|1,0,0]=3 5373 B13R2.1 OCCc1csc2ccccc12 Amb24066376 [0,2,0,0,0,0|1,1,0]=4 5374 B13R2.1 OCCc1ncc2ccccn12 Amb28126981 [0,2,0,0,0,0|2,0,0]=4 5375 B13R2.1 OCCc1noc2ccccc12 Amb17108006 [0,2,0,0,0,0|0,0,0]=2 5376 B13R2.1 OCCc1noc2ccncc12 Amb27423443 [0,2,0,0,0,0|1,0,0]=3 5377 B13R2.1 OCCc1nsc2ccccc12 Amb26932497 [0,2,0,0,0,0|0,1,0]=3 5378 B13R2.1 OCCn1ncc2ccccc21 Amb18792418 [0,2,0,0,0,0|2,0,0]=4 5379 B13R2.1 OCCn1nnc2ccccc21 Amb3432740 [0,2,0,0,0,0|2,0,0]=4 5380 B13R2.1 OC\C=C1\C=Cc2ccccc21 Amb27651915 [0,2,0,0,0,0|2,0,0]=4 5381 B13R2.1 ONCc1csc2ccccc12 Amb27975174 [0,2,0,0,0,0|1,1,0]=4 5382 B13R2.1 O\N=C/c1occ2ccccc12 Amb27490828 [0,2,0,0,0,0|2,0,0]=4 5383 B13R2.1 O\N=C\c1csc2ccccc12 Amb27452936 [0,2,0,0,0,0|1,1,0]=4 5384 B13R2.1 O\N=C\c1nsc2ccccc12 Amb27798976 [0,2,0,0,0,0|0,1,0]=3 5385 B13R2.1 SCCc1coc2ccccc12 Amb26862256 [0,2,0,0,0,0|1,1,0]=4 5386 B13R2.1 [N-]=[N+]=Nc1noc2ccccc12 Amb27792641 [0,2,0,0,0,0|1,0,0]=3 5387 B13R2.9 BrCc1coc2c(I)cccc12 Amb27968405 [0,2,0,0,0,0|2,0,0]=4 5388 B13R2.9 CCc1noc2c(C)cccc12 Amb28188769 [0,2,0,0,0,0|1,0,0]=3 5389 B13R2.9 Cc1cccc2c(C#N)coc12 Amb28348549 [0,2,0,0,0,0|2,0,0]=4 5390 B13R2.9 Cc1cccc2c(C=O)coc12 Amb18830292 [0,2,0,0,0,0|1,0,1]=4 5391 B13R2.9 Cc1cccc2c(CBr)coc12 Amb27649114 [0,2,0,0,0,0|2,0,0]=4 5392 B13R2.9 Cc1cccc2c(CN)noc12 Amb27413847 [0,2,0,0,0,0|1,0,0]=3 5393 B13R2.9 Cc1cccc2c(CN)nsc12 Amb32710105 [0,2,0,0,0,0|1,1,0]=4 5394 B13R2.9 Cc1cccc2c(CO)csc12 Amb28398602 [0,2,0,0,0,0|1,1,0]=4 5395 B13R2.9 Cc1cccc2c(CO)noc12 Amb32681968 [0,2,0,0,0,0|0,0,0]=2 5396 B13R2.9 Cc1cccc2c1OC[C@H]2CO Amb28079154 [0,2,0,0,0,0|1,0,1]=4 5397 B13R2.9 Fc1cccc2c(CBr)nsc12 Amb32794621 [0,2,0,0,0,0|1,1,0]=4 5398 B13R2.9 N#Cc1coc2c(Cl)cccc12 Amb27812076 [0,2,0,0,0,0|2,0,0]=4 5399 B13R2.9 N#Cc1coc2c(F)cccc12 Amb27410484 [0,2,0,0,0,0|2,0,0]=4 5400 B13R2.9 NCc1coc2c(Cl)cccc12 Amb27814094 [0,2,0,0,0,0|2,0,0]=4 5401 B13R2.9 NCc1coc2c(N)cccc12 Amb27259639 [0,2,0,0,0,0|2,0,0]=4 5402 B13R2.9 NCc1noc2c(N)cccc12 Amb28062486 [0,2,0,0,0,0|1,0,0]=3 5403 B13R2.9 NCc1nsc2c(Br)cccc12 Amb32710107 [0,2,0,0,0,0|1,1,0]=4 5404 B13R2.9 NCc1nsc2c(Cl)cccc12 Amb32710094 [0,2,0,0,0,0|1,1,0]=4 5405 B13R2.9 NCc1nsc2c(F)cccc12 Amb32710089 [0,2,0,0,0,0|1,1,0]=4 5406 B13R2.9 Nc1cccc2c(CO)occ12 Amb28044164 [0,2,0,0,0,0|2,0,0]=4 5407 B13R2.9 O=Cc1coc2c(Br)cccc12 Amb18754982 [0,2,0,0,0,0|1,0,1]=4 5408 B13R2.9 OCC1COc2c(F)cccc21 Amb27456563 [0,2,0,0,0,0|1,0,1]=4 5409 B13R2.9 OCc1coc2c(O)cccc12 Amb27219796 [0,2,0,0,0,0|1,0,0]=3 5410 B13R2.9 OCc1csc2c(Br)cccc12 Amb27178360 [0,2,0,0,0,0|1,1,0]=4 5411 B13R2.9 OCc1noc2c(Cl)cccc12 Amb28135031 [0,2,0,0,0,0|0,0,0]=2 5412 B13R2.9 OCn1ncc2c(Cl)cccc21 Amb23441648 [0,2,0,0,0,0|2,0,0]=4 5413 B13R2.9 O\N=C1\CCc2c(O)cccc21 Amb27660439 [0,2,0,0,0,0|2,0,0]=4 5414 B13R2.9 Oc1cccc2c(CBr)nsc12 Amb32794623 [0,2,0,0,0,0|1,1,0]=4 5415 B13R2.9 Oc1cccc2c(CF)noc12 Amb27211060 [0,2,0,0,0,0|1,0,0]=3 5416 B13R2.72 CC(=O)c1coc2ccccc12 Amb19887568 [0,2,0,0,0,0|1,0,1]=4 5417 B13R2.72 CC(=O)c1noc2ccccc12 Amb25723786 [0,2,0,0,0,0|0,0,1]=3 5418 B13R2.72 CC(=O)c1noc2ncccc12 Amb26638081 [0,2,0,0,0,0|1,0,1]=4 5419 B13R2.72 CC(Cl)c1coc2ccccc12 Amb35704189 [0,2,0,0,0,0|2,0,0]=4 5420 B13R2.72 CC(N)c1coc2ccccc12 Amb18829962 [0,2,0,0,0,0|2,0,0]=4 5421 B13R2.72 CC(O)C1=CCc2ccccc21 Amb28244189 [0,2,0,0,0,0|2,0,0]=4 5422 B13R2.72 CC(O)c1coc2ccccc12 Amb24061891 [0,2,0,0,0,0|1,0,0]=3 5423 B13R2.72 CC(O)c1csc2ccccc12 Amb18180840 [0,2,0,0,0,0|1,1,0]=4 5424 B13R2.72 CC(O)c1nnc2ccccn12 Amb27866627 [0,2,0,0,0,0|2,0,0]=4 5425 B13R2.72 CC(O)c1occ2ccccc12 Amb25899169 [0,2,0,0,0,0|2,0,0]=4 5426 B13R2.72 CC(O)n1nnc2ccccc21 Amb3432737 [0,2,0,0,0,0|2,0,0]=4 5427 B13R2.72 CN(C)c1nsc2ccccc12 Amb27151472 [0,2,0,0,0,0|1,1,0]=4 5428 B13R2.72 C[C@@H](N)c1coc2ccccc12 Amb25871849 [0,2,0,0,0,0|2,0,0]=4 5429 B13R2.72 C[C@@H](N)c1coc2ccccc12 Amb33331001 [0,2,0,0,0,0|2,0,0]=4 5430 B13R2.72 C[C@@H](O)c1coc2ccccc12 Amb25675222 [0,2,0,0,0,0|1,0,0]=3 5431 B13R2.72 C[C@@H](O)c1csc2ccccc12 Amb27247039 [0,2,0,0,0,0|1,1,0]=4 5432 B13R2.72 C[C@H](O)c1coc2ccccc12 Amb27766105 [0,2,0,0,0,0|1,0,0]=3 5433 B13R2.72 C[C@H](O)c1csc2ccccc12 Amb25132352 [0,2,0,0,0,0|1,1,0]=4 5434 B13R2.72 FC(F)c1coc2ccccc12 Amb27774852 [0,2,0,0,0,0|2,0,0]=4 5435 B13R2.72 NC(=O)c1coc2ccccc12 Amb23401825 [0,2,0,0,0,0|1,0,1]=4 5436 B13R2.72 NC(=O)c1nsc2ccccc12 Amb16677288 [0,2,0,0,0,0|0,1,1]=4 5437 B13R2.72 NC(=S)c1coc2ccccc12 Amb26346315 [0,2,0,0,0,0|1,1,0]=4 5438 B13R2.72 NC(=S)c1noc2ccccc12 Amb25771563 [0,2,0,0,0,0|0,1,0]=3 5439 B13R2.72 NC(=S)c1nsc2ccccc12 Amb27471767 [0,2,0,0,0,0|0,2,0]=4 5440 B13R2.72 O=C(Cl)c1coc2ccccc12 Amb9677570 [0,2,0,0,0,0|1,0,1]=4 5441 B13R2.72 O=C(Cl)c1nsc2ccccc12 Amb27198478 [0,2,0,0,0,0|0,1,1]=4 5442 B13R2.72 O=C(O)C1=CCc2ccccc21 Amb2691224 [0,2,0,0,0,0|2,0,0]=4 5443 B13R2.72 O=C(O)C1COc2ccccc21 Amb19372915 [0,2,0,0,0,0|1,0,1]=4 5444 B13R2.72 O=C(O)c1coc2ccccc12 Amb6355909 [0,2,0,0,0,0|1,0,0]=3 5445 B13R2.72 O=C(O)c1coc2cccnc12 Amb25109532 [0,2,0,0,0,0|2,0,0]=4 5446 B13R2.72 O=C(O)c1coc2ccncc12 Amb24666082 [0,2,0,0,0,0|2,0,0]=4 5447 B13R2.72 O=C(O)c1coc2ncccc12 Amb26500304 [0,2,0,0,0,0|2,0,0]=4 5448 B13R2.72 O=C(O)c1csc2ccccc12 Amb6335606 [0,2,0,0,0,0|1,1,0]=4 5449 B13R2.72 O=C(O)c1ncc2ccccn12 Amb17060780 [0,2,0,0,0,0|2,0,0]=4 5450 B13R2.72 O=C(O)c1ncn2ccccc12 Amb18559504 [0,2,0,0,0,0|2,0,0]=4 5451 B13R2.72 O=C(O)c1nnc2ccccn12 Amb17062672 [0,2,0,0,0,0|2,0,0]=4 5452 B13R2.72 O=C(O)c1nnn2ccccc12 Amb18645769 [0,2,0,0,0,0|2,0,0]=4 5453 B13R2.72 O=C(O)c1noc2ccccc12 Amb1994153 [0,2,0,0,0,0|0,0,0]=2 5454 B13R2.72 O=C(O)c1noc2cnccc12 Amb27754951 [0,2,0,0,0,0|1,0,0]=3 5455 B13R2.72 O=C(O)c1noc2ncccc12 Amb24343515 [0,2,0,0,0,0|1,0,0]=3 5456 B13R2.72 O=C(O)c1nsc2ccccc12 Amb33542908 [0,2,0,0,0,0|0,1,0]=3 5457 B13R2.72 O=C(O)c1occ2ccccc12 Amb6357074 [0,2,0,0,0,0|2,0,0]=4 5458 B13R2.72 O=C(O)c1onc2ccccc12 Amb2725091 [0,2,0,0,0,0|2,0,0]=4 5459 B13R2.72 O=C(O)c1snc2ccccc12 Amb17594585 [0,2,0,0,0,0|2,0,0]=4 5460 B13R2.72 O=C([O-])c1noc2cnccc12 Amb35788449 [0,2,0,0,0,0|1,0,1]=4 5461 B13R2.72 OB(O)C1=CCc2ccccc21 Amb24487374 [0,2,0,0,0,0|2,0,0]=4 5462 B13R2.72 OB(O)c1coc2ccccc12 Amb9780926 [0,2,0,0,0,0|1,0,0]=3 5463 B13R2.72 OB(O)c1csc2ccccc12 Amb2723183 [0,2,0,0,0,0|1,1,0]=4 5464 B13R2.72 OB(O)c1scc2ccccc12 Amb28186404 [0,2,0,0,0,0|2,0,0]=4 5465 B13R2.72 OC(O)=C1C=Cc2ccccc21 Amb24357578 [0,2,0,0,0,0|2,0,0]=4 5466 B13R2.135 C=C1Oc2ccccc2C1CO Amb25806105 [0,2,0,0,0,0|1,0,1]=4 5467 B13R2.135 CC1Cc2ccccc2\C1=N/O Amb27425215 [0,2,0,0,0,0|2,0,0]=4 5468 B13R2.135 CC1Nc2ccccc2\C1=N/O Amb27491638 [0,2,0,0,0,0|2,0,0]=4 5469 B13R2.135 CCc1c(Br)oc2ccccc12 Amb18754591 [0,2,0,0,0,0|2,0,0]=4 5470 B13R2.135 COc1c(Br)oc2ccccc12 Amb27224419 [0,2,0,0,0,0|1,0,0]=3 5471 B13R2.135 COc1c(Br)sc2ccccc12 Amb28053059 [0,2,0,0,0,0|1,1,0]=4 5472 B13R2.135 COc1c2ccccc2cn1C Amb28399341 [0,2,0,0,0,0|1,0,1]=4 5473 B13R2.135 COc1c2ccccc2nn1C Amb27968764 [0,2,0,0,0,0|1,0,1]=4 5474 B13R2.135 C\C=C1\C(=O)Oc2ccccc21 Amb27816657 [0,2,0,0,0,0|2,0,0]=4 5475 B13R2.135 Cc1oc2ccccc2c1C#N Amb341638 [0,2,0,0,0,0|2,0,0]=4 5476 B13R2.135 Cc1oc2ccccc2c1C=O Amb1003032 [0,2,0,0,0,0|1,0,1]=4 5477 B13R2.135 Cc1oc2ccccc2c1CN Amb24061887 [0,2,0,0,0,0|2,0,0]=4 5478 B13R2.135 Cc1oc2ccccc2c1CO Amb22011694 [0,2,0,0,0,0|1,0,0]=3 5479 B13R2.135 Cc1oc2ccccc2c1CS Amb32788223 [0,2,0,0,0,0|1,1,0]=4 5480 B13R2.135 Cc1sc2ccccc2c1CO Amb26363790 [0,2,0,0,0,0|1,1,0]=4 5481 B13R2.135 Clc1oc2ccccc2c1CBr Amb32665050 [0,2,0,0,0,0|2,0,0]=4 5482 B13R2.135 Cn1nc2ccccc2c1CO Amb2723783 [0,2,0,0,0,0|1,0,1]=4 5483 B13R2.135 N#Cc1c(O)oc2ccccc12 Amb32716347 [0,2,0,0,0,0|2,0,0]=4 5484 B13R2.135 NCc1c(Cl)oc2ccccc12 Amb26967340 [0,2,0,0,0,0|2,0,0]=4 5485 B13R2.135 NCc1c(Cl)oc2ccccc12 Amb32668148 [0,2,0,0,0,0|2,0,0]=4 5486 B13R2.135 Nc1oc2ccccc2c1C=O Amb18830101 [0,2,0,0,0,0|1,0,1]=4 5487 B13R2.135 Nc1oc2ccccc2c1C=S Amb28396646 [0,2,0,0,0,0|1,1,0]=4 5488 B13R2.135 O=C1Cc2ccccc2\C1=C\O Amb28122463 [0,2,0,0,0,0|2,0,0]=4 5489 B13R2.135 O=C1Nc2ccccc2\C1=C/O Amb25917825 [0,2,0,0,0,0|2,0,0]=4 5490 B13R2.135 O=C1Nc2ccccc2\C1=C\O Amb22494713 [0,2,0,0,0,0|2,0,0]=4 5491 B13R2.135 O=C1Nc2ccccc2\C1=N/O Amb2221666 [0,2,0,0,0,0|2,0,0]=4 5492 B13R2.135 O=C1Nc2ccccc2\C1=N\O Amb19959979 [0,2,0,0,0,0|2,0,0]=4 5493 B13R2.135 O=C1OC2=COC=CC2=C1CO Amb27270892 [0,2,0,0,0,0|2,0,0]=4 5494 B13R2.135 O=C1Oc2ccccc2\C1=C/O Amb27652914 [0,2,0,0,0,0|1,0,0]=3 5495 B13R2.135 O=C1Sc2ccccc2\C1=C/O Amb27270923 [0,2,0,0,0,0|1,1,0]=4 5496 B13R2.135 O=Cc1c(Cl)oc2ccccc12 Amb33527349 [0,2,0,0,0,0|1,0,1]=4 5497 B13R2.135 OCN1C(=S)Oc2ccccc21 Amb19773178 [0,2,0,0,0,0|2,0,0]=4 5498 B13R2.135 OCc1c(Cl)oc2ccccc12 Amb28141672 [0,2,0,0,0,0|1,0,0]=3 5499 B13R2.135 SCc1c(Cl)oc2ccccc12 Amb32788221 [0,2,0,0,0,0|1,1,0]=4 5500 B13R2.662 BrCc1coc2cc(Br)ccc12 Amb26561277 [0,2,0,0,0,0|2,0,0]=4 5501 B13R2.662 BrCc1nsc2cc(Br)ccc12 Amb32794460 [0,2,0,0,0,0|1,1,0]=4 5502 B13R2.662 CCc1noc2cc(Cl)ccc12 Amb28146304 [0,2,0,0,0,0|1,0,0]=3 5503 B13R2.662 CCc1noc2cc(O)ccc12 Amb18645800 [0,2,0,0,0,0|1,0,0]=3 5504 B13R2.662 CNc1noc2cc(C)ccc12 Amb22753656 [0,2,0,0,0,0|1,0,0]=3 5505 B13R2.662 COc1noc2cc(C)ccc12 Amb27179809 [0,2,0,0,0,0|0,0,0]=2 5506 B13R2.662 COc1noc2cc(Cl)ccc12 Amb27473349 [0,2,0,0,0,0|0,0,0]=2 5507 B13R2.662 COn1nnc2cc(C)ccc21 Amb28125642 [0,2,0,0,0,0|2,0,0]=4 5508 B13R2.662 Cc1ccc2c(C#N)noc2c1 Amb27849250 [0,2,0,0,0,0|1,0,0]=3 5509 B13R2.662 Cc1ccc2c(C=O)coc2c1 Amb18830294 [0,2,0,0,0,0|1,0,1]=4 5510 B13R2.662 Cc1ccc2c(CBr)noc2c1 Amb27959159 [0,2,0,0,0,0|1,0,0]=3 5511 B13R2.662 Cc1ccc2c(CN)coc2c1 Amb26864603 [0,2,0,0,0,0|2,0,0]=4 5512 B13R2.662 Cc1ccc2c(CN)noc2c1 Amb27616767 [0,2,0,0,0,0|1,0,0]=3 5513 B13R2.662 Cc1ccc2c(CN)nsc2c1 Amb32710102 [0,2,0,0,0,0|1,1,0]=4 5514 B13R2.662 Cc1ccc2c(CO)coc2c1 Amb27607093 [0,2,0,0,0,0|1,0,0]=3 5515 B13R2.662 Cc1ccc2c(CO)noc2c1 Amb32681967 [0,2,0,0,0,0|0,0,0]=2 5516 B13R2.662 Cc1ccc2c(cnn2CO)c1 Amb23441646 [0,2,0,0,0,0|2,0,0]=4 5517 B13R2.662 Fc1ccc2c(CBr)nsc2c1 Amb25283065 [0,2,0,0,0,0|1,1,0]=4 5518 B13R2.662 Fc1ccc2c(CCl)noc2c1 Amb28250674 [0,2,0,0,0,0|1,0,0]=3 5519 B13R2.662 N#Cc1coc2cc(O)ccc12 Amb27646998 [0,2,0,0,0,0|2,0,0]=4 5520 B13R2.662 N#Cc1noc2cc(Br)ccc12 Amb23399614 [0,2,0,0,0,0|1,0,0]=3 5521 B13R2.662 N#Cc1noc2cc(F)ccc12 Amb23399615 [0,2,0,0,0,0|1,0,0]=3 5522 B13R2.662 N#Cc1noc2cc(I)ccc12 Amb23403463 [0,2,0,0,0,0|1,0,0]=3 5523 B13R2.662 N#Cc1noc2cc(N)ccc12 Amb18645135 [0,2,0,0,0,0|1,0,0]=3 5524 B13R2.662 N#Cc1noc2cc(O)ccc12 Amb27791334 [0,2,0,0,0,0|1,0,0]=3 5525 B13R2.662 NCc1coc2cc(Br)ccc12 Amb32679696 [0,2,0,0,0,0|2,0,0]=4 5526 B13R2.662 NCc1coc2cc(F)ccc12 Amb27395992 [0,2,0,0,0,0|2,0,0]=4 5527 B13R2.662 NCc1noc2cc(Cl)ccc12 Amb24580088 [0,2,0,0,0,0|1,0,0]=3 5528 B13R2.662 NCc1noc2cc(F)ccc12 Amb30584904 [0,2,0,0,0,0|1,0,0]=3 5529 B13R2.662 NCc1noc2cc(F)ccc12 Amb8011558 [0,2,0,0,0,0|1,0,0]=3 5530 B13R2.662 NCc1noc2cc(N)ccc12 Amb28199154 [0,2,0,0,0,0|1,0,0]=3 5531 B13R2.662 NCc1noc2nc(Cl)ccc12 Amb28045686 [0,2,0,0,0,0|2,0,0]=4 5532 B13R2.662 NCc1nsc2cc(Br)ccc12 Amb32710088 [0,2,0,0,0,0|1,1,0]=4 5533 B13R2.662 NCc1nsc2cc(Cl)ccc12 Amb32710087 [0,2,0,0,0,0|1,1,0]=4 5534 B13R2.662 NCc1nsc2cc(F)ccc12 Amb32710083 [0,2,0,0,0,0|1,1,0]=4 5535 B13R2.662 N\N=C1\COc2cc(F)ccc21 Amb28121695 [0,2,0,0,0,0|2,0,0]=4 5536 B13R2.662 N\N=C1\COc2cc(O)ccc21 Amb28317519 [0,2,0,0,0,0|2,0,0]=4 5537 B13R2.662 Nc1ccc2c(CF)noc2c1 Amb27238015 [0,2,0,0,0,0|1,0,0]=3 5538 B13R2.662 Nc1ccc2c(CO)occ2c1 Amb25899082 [0,2,0,0,0,0|2,0,0]=4 5539 B13R2.662 Nc1ccc2c(c1)CC\C2=N/O Amb28456150 [0,2,0,0,0,0|2,0,0]=4 5540 B13R2.662 O=Cc1coc2cc(Br)ccc12 Amb18754953 [0,2,0,0,0,0|1,0,1]=4 5541 B13R2.662 O=Cc1coc2cc(I)ccc12 Amb28241034 [0,2,0,0,0,0|1,0,1]=4 5542 B13R2.662 O=Cc1noc2cc(Br)ccc12 Amb24435419 [0,2,0,0,0,0|0,0,1]=3 5543 B13R2.662 O=Cc1noc2cc(Cl)ccc12 Amb28400099 [0,2,0,0,0,0|0,0,1]=3 5544 B13R2.662 O=Cc1noc2cc(F)ccc12 Amb27194972 [0,2,0,0,0,0|0,0,1]=3 5545 B13R2.662 O=Cc1noc2nc(Br)ccc12 Amb18159750 [0,2,0,0,0,0|1,0,1]=4 5546 B13R2.662 O=Cc1noc2nc(Cl)ccc12 Amb18823466 [0,2,0,0,0,0|1,0,1]=4 5547 B13R2.662 O=Cc1nsc2cc(Br)ccc12 Amb28256793 [0,2,0,0,0,0|0,1,1]=4 5548 B13R2.662 O=Cc1nsc2cc(Cl)ccc12 Amb27178476 [0,2,0,0,0,0|0,1,1]=4 5549 B13R2.662 OCC1COc2cc(Cl)ccc21 Amb27835881 [0,2,0,0,0,0|1,0,1]=4 5550 B13R2.662 OCc1coc2cc(Br)ccc12 Amb27847402 [0,2,0,0,0,0|1,0,0]=3 5551 B13R2.662 OCc1coc2cc(I)ccc12 Amb23401418 [0,2,0,0,0,0|1,0,0]=3 5552 B13R2.662 OCc1nnn2cc(F)ccc12 Amb27483099 [0,2,0,0,0,0|2,0,0]=4 5553 B13R2.662 OCc1noc2cc(Br)ccc12 Amb25898789 [0,2,0,0,0,0|0,0,0]=2 5554 B13R2.662 OCc1noc2cc(Cl)ccc12 Amb25777621 [0,2,0,0,0,0|0,0,0]=2 5555 B13R2.662 OCc1noc2cc(F)ccc12 Amb28198099 [0,2,0,0,0,0|0,0,0]=2 5556 B13R2.662 OCc1noc2cc(O)ccc12 Amb28189364 [0,2,0,0,0,0|0,0,0]=2 5557 B13R2.662 OCc1noc2nc(F)ccc12 Amb27178411 [0,2,0,0,0,0|1,0,0]=3 5558 B13R2.662 OCc1nsc2cc(Cl)ccc12 Amb28436286 [0,2,0,0,0,0|0,1,0]=3 5559 B13R2.662 OCn1ncc2cc(Cl)ccc21 Amb27451060 [0,2,0,0,0,0|2,0,0]=4 5560 B13R2.662 ONc1coc2cc(O)ccc12 Amb28243803 [0,2,0,0,0,0|1,0,0]=3 5561 B13R2.662 O\N=C1\CCc2cc(Br)ccc21 Amb27389361 [0,2,0,0,0,0|2,0,0]=4 5562 B13R2.662 O\N=C1\CCc2cc(F)ccc21 Amb27948184 [0,2,0,0,0,0|2,0,0]=4 5563 B13R2.662 Oc1ccc2c(CBr)nsc2c1 Amb32794619 [0,2,0,0,0,0|1,1,0]=4 5564 B13R2.662 Oc1ccc2c(CF)coc2c1 Amb28198652 [0,2,0,0,0,0|2,0,0]=4 5565 B13R2.2091 BrCc1coc2cccc(Br)c12 Amb28127109 [0,2,0,0,0,0|2,0,0]=4 5566 B13R2.2091 CCc1coc2cccc(Br)c12 Amb18754585 [0,2,0,0,0,0|2,0,0]=4 5567 B13R2.2091 CCc1noc2cccc(Br)c12 Amb18753815 [0,2,0,0,0,0|1,0,0]=3 5568 B13R2.2091 CCc1noc2cccc(O)c12 Amb28243898 [0,2,0,0,0,0|1,0,0]=3 5569 B13R2.2091 CCc1noc2nccc(Cl)c12 Amb27878522 [0,2,0,0,0,0|2,0,0]=4 5570 B13R2.2091 CCc1nsc2cccc(Br)c12 Amb18728517 [0,2,0,0,0,0|1,1,0]=4 5571 B13R2.2091 CNc1noc2cccc(Br)c12 Amb26391353 [0,2,0,0,0,0|1,0,0]=3 5572 B13R2.2091 CNc1noc2cccc(F)c12 Amb23442979 [0,2,0,0,0,0|1,0,0]=3 5573 B13R2.2091 CNc1nsc2cccc(Cl)c12 Amb26974038 [0,2,0,0,0,0|1,1,0]=4 5574 B13R2.2091 COn1ncc2cccc(O)c21 Amb27240234 [0,2,0,0,0,0|2,0,0]=4 5575 B13R2.2091 Cc1cccc2occ(CBr)c12 Amb28430773 [0,2,0,0,0,0|2,0,0]=4 5576 B13R2.2091 Cc1cccc2onc(CO)c12 Amb32681969 [0,2,0,0,0,0|0,0,0]=2 5577 B13R2.2091 Cc1cccc2scc(CO)c12 Amb22756956 [0,2,0,0,0,0|1,1,0]=4 5578 B13R2.2091 ClCc1coc2cccc(Br)c12 Amb27953766 [0,2,0,0,0,0|2,0,0]=4 5579 B13R2.2091 Clc1cccc2snc(CBr)c12 Amb32794620 [0,2,0,0,0,0|1,1,0]=4 5580 B13R2.2091 Fc1cccc2snc(CBr)c12 Amb32794613 [0,2,0,0,0,0|1,1,0]=4 5581 B13R2.2091 N#Cc1coc2cccc(F)c12 Amb27494561 [0,2,0,0,0,0|2,0,0]=4 5582 B13R2.2091 N#Cc1coc2cccc(O)c12 Amb23560347 [0,2,0,0,0,0|2,0,0]=4 5583 B13R2.2091 N#Cc1noc2cccc(O)c12 Amb28129598 [0,2,0,0,0,0|1,0,0]=3 5584 B13R2.2091 NCc1coc2cccc(Br)c12 Amb25693352 [0,2,0,0,0,0|2,0,0]=4 5585 B13R2.2091 NCc1coc2cccc(Cl)c12 Amb24731865 [0,2,0,0,0,0|2,0,0]=4 5586 B13R2.2091 NCc1coc2cccc(F)c12 Amb27196411 [0,2,0,0,0,0|2,0,0]=4 5587 B13R2.2091 NCc1coc2cccc(O)c12 Amb18908614 [0,2,0,0,0,0|2,0,0]=4 5588 B13R2.2091 NCc1noc2cccc(N)c12 Amb27958636 [0,2,0,0,0,0|1,0,0]=3 5589 B13R2.2091 NCc1nsc2cccc(Br)c12 Amb32710101 [0,2,0,0,0,0|1,1,0]=4 5590 B13R2.2091 NCc1nsc2cccc(Cl)c12 Amb32710080 [0,2,0,0,0,0|1,1,0]=4 5591 B13R2.2091 NCc1nsc2cccc(F)c12 Amb32710082 [0,2,0,0,0,0|1,1,0]=4 5592 B13R2.2091 O=Cc1coc2cccc(Br)c12 Amb18754948 [0,2,0,0,0,0|1,0,1]=4 5593 B13R2.2091 O=Cc1coc2cccc(F)c12 Amb18829084 [0,2,0,0,0,0|1,0,1]=4 5594 B13R2.2091 OCc1noc2cccc(F)c12 Amb32681966 [0,2,0,0,0,0|0,0,0]=2 5595 B13R2.2091 OCc1occ2cccc(O)c12 Amb28244293 [0,2,0,0,0,0|2,0,0]=4 5596 B13R2.2091 O\N=C1\CCc2cccc(O)c21 Amb27637814 [0,2,0,0,0,0|2,0,0]=4 5597 B13R2.2091 O\N=C1\COc2cccc(F)c21 Amb27185890 [0,2,0,0,0,0|1,0,0]=3 5598 B13R2.2136 BrCc1coc2ccc(Br)cc12 Amb27416723 [0,2,0,0,0,0|2,0,0]=4 5599 B13R2.2136 BrCc1nsc2ccc(Br)cc12 Amb26595579 [0,2,0,0,0,0|1,1,0]=4 5600 B13R2.2136 C=Cc1nsc2ccc(C)cc12 Amb27636425 [0,2,0,0,0,0|1,1,0]=4 5601 B13R2.2136 CCc1coc2ccc(O)cc12 Amb20621203 [0,2,0,0,0,0|2,0,0]=4 5602 B13R2.2136 CCc1noc2ccc(Cl)cc12 Amb27756287 [0,2,0,0,0,0|1,0,0]=3 5603 B13R2.2136 CCc1noc2ccc(N)cc12 Amb26021651 [0,2,0,0,0,0|1,0,0]=3 5604 B13R2.2136 CCc1noc2ncc(N)cc12 Amb27667160 [0,2,0,0,0,0|2,0,0]=4 5605 B13R2.2136 CCc1nsc2ccc(C)cc12 Amb27209626 [0,2,0,0,0,0|1,1,0]=4 5606 B13R2.2136 CNc1noc2ccc(Br)cc12 Amb23402973 [0,2,0,0,0,0|1,0,0]=3 5607 B13R2.2136 CNc1noc2ccc(C)cc12 Amb23437115 [0,2,0,0,0,0|1,0,0]=3 5608 B13R2.2136 CNc1noc2ccc(Cl)cc12 Amb23443030 [0,2,0,0,0,0|1,0,0]=3 5609 B13R2.2136 COc1noc2ccc(Br)cc12 Amb23571256 [0,2,0,0,0,0|0,0,0]=2 5610 B13R2.2136 Cc1ccc2c(c1)\C(=N/O)CC2 Amb27177453 [0,2,0,0,0,0|2,0,0]=4 5611 B13R2.2136 Cc1ccc2c(c1)\C(=N/O)CO2 Amb27264915 [0,2,0,0,0,0|1,0,0]=3 5612 B13R2.2136 Cc1ccc2c(c1)\C(=N\O)CO2 Amb4032774 [0,2,0,0,0,0|1,0,0]=3 5613 B13R2.2136 Cc1ccc2occ(C#N)c2c1 Amb27416602 [0,2,0,0,0,0|2,0,0]=4 5614 B13R2.2136 Cc1ccc2occ(CBr)c2c1 Amb27748494 [0,2,0,0,0,0|2,0,0]=4 5615 B13R2.2136 Cc1ccc2onc(CBr)c2c1 Amb20528389 [0,2,0,0,0,0|1,0,0]=3 5616 B13R2.2136 Cc1ccc2onc(CN)c2c1 Amb23597963 [0,2,0,0,0,0|1,0,0]=3 5617 B13R2.2136 Cc1ccc2onc(CN)c2c1 Amb33610791 [0,2,0,0,0,0|1,0,0]=3 5618 B13R2.2136 Cc1ccc2onc(CO)c2c1 Amb27849259 [0,2,0,0,0,0|0,0,0]=2 5619 B13R2.2136 Cc1ccc2snc(CN)c2c1 Amb32710103 [0,2,0,0,0,0|1,1,0]=4 5620 B13R2.2136 ClCc1noc2ccc(Br)cc12 Amb27186342 [0,2,0,0,0,0|1,0,0]=3 5621 B13R2.2136 Clc1ccc2onc(CBr)c2c1 Amb23597980 [0,2,0,0,0,0|1,0,0]=3 5622 B13R2.2136 Clc1ccc2snc(CBr)c2c1 Amb27153924 [0,2,0,0,0,0|1,1,0]=4 5623 B13R2.2136 Fc1ccc2occ(CBr)c2c1 Amb26978475 [0,2,0,0,0,0|2,0,0]=4 5624 B13R2.2136 Fc1ccc2onc(CBr)c2c1 Amb23597979 [0,2,0,0,0,0|1,0,0]=3 5625 B13R2.2136 Fc1ccc2snc(CBr)c2c1 Amb32794617 [0,2,0,0,0,0|1,1,0]=4 5626 B13R2.2136 N#Cc1coc2ccc(Br)cc12 Amb27982968 [0,2,0,0,0,0|2,0,0]=4 5627 B13R2.2136 N#Cc1nsc2ccc(Br)cc12 Amb27959153 [0,2,0,0,0,0|1,1,0]=4 5628 B13R2.2136 NCc1coc2ccc(Cl)cc12 Amb26880726 [0,2,0,0,0,0|2,0,0]=4 5629 B13R2.2136 NCc1coc2ccc(F)cc12 Amb24668828 [0,2,0,0,0,0|2,0,0]=4 5630 B13R2.2136 NCc1coc2ccc(F)cc12 Amb33743530 [0,2,0,0,0,0|2,0,0]=4 5631 B13R2.2136 NCc1coc2ccc(N)cc12 Amb28323292 [0,2,0,0,0,0|2,0,0]=4 5632 B13R2.2136 NCc1noc2ccc(Cl)cc12 Amb23597976 [0,2,0,0,0,0|1,0,0]=3 5633 B13R2.2136 NCc1noc2ccc(Cl)cc12 Amb31291567 [0,2,0,0,0,0|1,0,0]=3 5634 B13R2.2136 NCc1noc2ccc(F)cc12 Amb23597960 [0,2,0,0,0,0|1,0,0]=3 5635 B13R2.2136 NCc1noc2ccc(F)cc12 Amb30584970 [0,2,0,0,0,0|1,0,0]=3 5636 B13R2.2136 NCc1noc2ccc(N)cc12 Amb27958635 [0,2,0,0,0,0|1,0,0]=3 5637 B13R2.2136 NCc1nsc2ccc(Br)cc12 Amb18136037 [0,2,0,0,0,0|1,1,0]=4 5638 B13R2.2136 NCc1nsc2ccc(Cl)cc12 Amb18652973 [0,2,0,0,0,0|1,1,0]=4 5639 B13R2.2136 NCc1nsc2ccc(Cl)cc12 Amb32988622 [0,2,0,0,0,0|1,1,0]=4 5640 B13R2.2136 NCc1nsc2ccc(F)cc12 Amb32710084 [0,2,0,0,0,0|1,1,0]=4 5641 B13R2.2136 Nc1ccc2nnc(CO)n2c1 Amb18947661 [0,2,0,0,0,0|2,0,0]=4 5642 B13R2.2136 Nc1ccc2occ(C=O)c2c1 Amb18830132 [0,2,0,0,0,0|1,0,1]=4 5643 B13R2.2136 Nc1ccc2onc(C=O)c2c1 Amb18829842 [0,2,0,0,0,0|0,0,1]=3 5644 B13R2.2136 Nc1ccc2onc(CF)c2c1 Amb27633625 [0,2,0,0,0,0|1,0,0]=3 5645 B13R2.2136 Nc1ccc2scc(CO)c2c1 Amb22297010 [0,2,0,0,0,0|1,1,0]=4 5646 B13R2.2136 O=Cc1coc2ccc(Br)cc12 Amb18754944 [0,2,0,0,0,0|1,0,1]=4 5647 B13R2.2136 O=Cc1coc2ccc(F)cc12 Amb18829085 [0,2,0,0,0,0|1,0,1]=4 5648 B13R2.2136 O=Cc1noc2ccc(Br)cc12 Amb33738130 [0,2,0,0,0,0|0,0,1]=3 5649 B13R2.2136 O=Cc1noc2ncc(Br)cc12 Amb18159742 [0,2,0,0,0,0|1,0,1]=4 5650 B13R2.2136 O=Cc1nsc2ccc(Br)cc12 Amb27977760 [0,2,0,0,0,0|0,1,1]=4 5651 B13R2.2136 OCc1coc2ccc(Cl)cc12 Amb10571984 [0,2,0,0,0,0|1,0,0]=3 5652 B13R2.2136 OCc1coc2ccc(F)cc12 Amb26843160 [0,2,0,0,0,0|1,0,0]=3 5653 B13R2.2136 OCc1csc2ccc(Cl)cc12 Amb2722993 [0,2,0,0,0,0|1,1,0]=4 5654 B13R2.2136 OCc1csc2ccc(O)cc12 Amb27803444 [0,2,0,0,0,0|1,1,0]=4 5655 B13R2.2136 OCc1noc2ccc(Cl)cc12 Amb28286964 [0,2,0,0,0,0|0,0,0]=2 5656 B13R2.2136 OCc1noc2ccc(F)cc12 Amb32681972 [0,2,0,0,0,0|0,0,0]=2 5657 B13R2.2136 OCc1snc2ccc(Br)cc12 Amb26953537 [0,2,0,0,0,0|2,0,0]=4 5658 B13R2.2136 O\N=C1\CCc2ccc(Cl)cc21 Amb27398300 [0,2,0,0,0,0|2,0,0]=4 5659 B13R2.2136 Oc1ccc2onc(CBr)c2c1 Amb27612967 [0,2,0,0,0,0|1,0,0]=3 5660 B13R2.2136 Oc1ccc2snc(CBr)c2c1 Amb32794507 [0,2,0,0,0,0|1,1,0]=4 5661 B13R2.2531 NCC1(O)COc2ccccc21 Amb17232525 [0,2,0,0,0,0|1,0,1]=4 5662 B13R2.2531 OCC1(O)COc2ccccc21 Amb27396971 [0,2,0,0,0,0|1,0,1]=4 5663 B13R2.2931 C#Cc1nn(C)c2ccccc12 Amb24078730 [0,2,0,0,0,0|2,0,0]=4 5664 B13R2.2931 C=Cc1nn(C)c2ccccc12 Amb27390543 [0,2,0,0,0,0|2,0,0]=4 5665 B13R2.2931 C=Cn1nc(Cl)c2ccccc21 Amb28437145 [0,2,0,0,0,0|2,0,0]=4 5666 B13R2.2931 CCc1nn(C)c2ccccc12 Amb26954394 [0,2,0,0,0,0|2,0,0]=4 5667 B13R2.2931 CCn1nc(Br)c2ccccc21 Amb22751457 [0,2,0,0,0,0|2,0,0]=4 5668 B13R2.2931 CCn1nc(C)c2ccccc21 Amb27201266 [0,2,0,0,0,0|2,0,0]=4 5669 B13R2.2931 CCn1nc(N)c2ccccc21 Amb10608066 [0,2,0,0,0,0|2,0,0]=4 5670 B13R2.2931 CNC1=NC(=O)c2ccccc21 Amb25295230 [0,2,0,0,0,0|1,0,1]=4 5671 B13R2.2931 CNC1=NS(=O)c2ccccc21 Amb27642513 [0,2,0,0,0,0|1,1,0]=4 5672 B13R2.2931 COC1=CC(C)c2ccccc21 Amb17778898 [0,2,0,0,0,0|2,0,0]=4 5673 B13R2.2931 COC1=NC(=N)c2ccccc21 Amb27209415 [0,2,0,0,0,0|1,0,0]=3 5674 B13R2.2931 COc1cn(C)c2ccccc12 Amb22751003 [0,2,0,0,0,0|2,0,0]=4 5675 B13R2.2931 COc1nn(C)c2ncccc12 Amb27847107 [0,2,0,0,0,0|2,0,0]=4 5676 B13R2.2931 Cc1nc(CO)c2ccccn12 Amb19374218 [0,2,0,0,0,0|2,0,0]=4 5677 B13R2.2931 ClCn1nc(Cl)c2ccccc21 Amb27487354 [0,2,0,0,0,0|2,0,0]=4 5678 B13R2.2931 Cn1cc(CO)c2ccccc21 Amb837472 [0,2,0,0,0,0|2,0,0]=4 5679 B13R2.2931 Cn1nc(C#N)c2ccccc21 Amb10608138 [0,2,0,0,0,0|2,0,0]=4 5680 B13R2.2931 Cn1nc(C=O)c2ccccc21 Amb2723099 [0,2,0,0,0,0|1,0,1]=4 5681 B13R2.2931 Cn1nc(CBr)c2ccccc21 Amb22492458 [0,2,0,0,0,0|2,0,0]=4 5682 B13R2.2931 Cn1nc(CCl)c2ccccc21 Amb2723103 [0,2,0,0,0,0|2,0,0]=4 5683 B13R2.2931 Cn1nc(CN)c2ccccc21 Amb2723101 [0,2,0,0,0,0|2,0,0]=4 5684 B13R2.2931 Cn1nc(CN)c2ccccc21 Amb9677569 [0,2,0,0,0,0|2,0,0]=4 5685 B13R2.2931 Cn1nc(CO)c2ccccc21 Amb2723100 [0,2,0,0,0,0|1,0,0]=3 5686 B13R2.2931 Cn1nc(CS)c2ccccc21 Amb25831461 [0,2,0,0,0,0|1,1,0]=4 5687 B13R2.2931 Cn1nc(NN)c2ccccc21 Amb33196021 [0,2,0,0,0,0|2,0,0]=4 5688 B13R2.2931 N#Cn1nc(Br)c2ccccc21 Amb27186329 [0,2,0,0,0,0|2,0,0]=4 5689 B13R2.2931 N#Cn1nc(Cl)c2ccccc21 Amb27971132 [0,2,0,0,0,0|2,0,0]=4 5690 B13R2.2931 N\N=C1\N=C(N)c2ccccc21 Amb22078265 [0,2,0,0,0,0|2,0,0]=4 5691 B13R2.2931 O=C1C\C(=N\O)c2ccccc21 Amb26992256 [0,2,0,0,0,0|2,0,0]=4 5692 B13R2.2931 O=C1N\C(=N\O)c2ccccc21 Amb21811521 [0,2,0,0,0,0|1,0,1]=4 5693 B13R2.2931 OCc1nc(Cl)n2ccccc12 Amb23560062 [0,2,0,0,0,0|2,0,0]=4 5694 B13R2.2931 OCn1nc(Br)c2ccccc21 Amb23449471 [0,2,0,0,0,0|2,0,0]=4 5695 B13R2.2931 OCn1nc(Cl)c2ccccc21 Amb27219803 [0,2,0,0,0,0|2,0,0]=4 5696 B13R2.2931 [C-]#[N+]c1nn(C)c2ccccc12 Amb33196722 [0,2,0,0,0,0|2,0,0]=4 5697 B13R2.45 BrCc1oc2ccccc2c1Br Amb32665146 [0,2,0,0,0,0|2,0,0]=4 5698 B13R2.45 C#Cc1oc2ccccc2c1C Amb33373372 [0,2,0,0,0,0|2,0,0]=4 5699 B13R2.45 C=Cc1oc2ccccc2c1C Amb24102391 [0,2,0,0,0,0|2,0,0]=4 5700 B13R2.45 CCC1Oc2ccccc2C1=O Amb24061517 [0,2,0,0,0,0|1,0,1]=4 5701 B13R2.45 CCc1oc2ccccc2c1Br Amb10569511 [0,2,0,0,0,0|2,0,0]=4 5702 B13R2.45 Cc1c(C#N)oc2ccccc12 Amb1152069 [0,2,0,0,0,0|2,0,0]=4 5703 B13R2.45 Cc1c(C=O)oc2ccccc12 Amb2702463 [0,2,0,0,0,0|2,0,0]=4 5704 B13R2.45 Cc1c(CBr)oc2ccccc12 Amb26953529 [0,2,0,0,0,0|2,0,0]=4 5705 B13R2.45 Cc1c(CCl)oc2ccccc12 Amb19649864 [0,2,0,0,0,0|2,0,0]=4 5706 B13R2.45 Cc1c(CN)oc2ccccc12 Amb15701585 [0,2,0,0,0,0|2,0,0]=4 5707 B13R2.45 Cc1c(CN)oc2ccccc12 Amb35788738 [0,2,0,0,0,0|2,0,0]=4 5708 B13R2.45 Cc1c(CO)oc2ccccc12 Amb18554026 [0,2,0,0,0,0|2,0,0]=4 5709 B13R2.45 Cc1c(CS)oc2ccccc12 Amb33372615 [0,2,0,0,0,0|2,0,0]=4 5710 B13R2.45 N#CC1Oc2ccccc2C1=O Amb18830409 [0,2,0,0,0,0|1,0,1]=4 5711 B13R2.45 N#Cc1oc2ccccc2c1N Amb1099163 [0,2,0,0,0,0|2,0,0]=4 5712 B13R2.45 N#Cc1oc2ccccc2c1O Amb2609397 [0,2,0,0,0,0|1,0,0]=3 5713 B13R2.45 N#Cc1sc2ccccc2c1O Amb2424154 [0,2,0,0,0,0|1,1,0]=4 5714 B13R2.45 N=Cc1oc2ccccc2c1O Amb26023954 [0,2,0,0,0,0|1,0,0]=3 5715 B13R2.45 N=Cc1sc2ccccc2c1O Amb27441867 [0,2,0,0,0,0|1,1,0]=4 5716 B13R2.45 NCc1oc2ccccc2c1Br Amb27796056 [0,2,0,0,0,0|2,0,0]=4 5717 B13R2.45 NCc1oc2ccccc2c1O Amb27641904 [0,2,0,0,0,0|1,0,0]=3 5718 B13R2.45 NCc1sc2ccccc2c1O Amb27624946 [0,2,0,0,0,0|1,1,0]=4 5719 B13R2.45 N\N=C1\Oc2ccccc2C1=O Amb28351488 [0,2,0,0,0,0|1,0,1]=4 5720 B13R2.45 Nc1c(C=O)oc2ccccc12 Amb18830111 [0,2,0,0,0,0|2,0,0]=4 5721 B13R2.45 O=Cc1oc2ccccc2c1Br Amb18134589 [0,2,0,0,0,0|2,0,0]=4 5722 B13R2.45 O=Cc1oc2ccccc2c1Cl Amb33528139 [0,2,0,0,0,0|2,0,0]=4 5723 B13R2.45 O=Cc1oc2ccccc2c1O Amb27636087 [0,2,0,0,0,0|1,0,0]=3 5724 B13R2.45 O=Cc1sc2ccccc2c1O Amb4303853 [0,2,0,0,0,0|1,1,0]=4 5725 B13R2.45 OCc1oc2ccccc2c1Br Amb24743941 [0,2,0,0,0,0|2,0,0]=4 5726 B13R2.243 CC1(C)Oc2ccccc2C1=O Amb26849546 [0,2,0,0,0,0|1,0,1]=4 5727 B13R2.243 CC1(C)Oc2ccccc2C1O Amb27654073 [0,2,0,0,0,0|1,0,1]=4 5728 B13R2.243 C[C@@]1(O)Oc2ccccc2[C@@H]1O Amb28455680 [0,2,0,0,0,0|1,0,1]=4 5729 B13R2.3028 C=C1C(=O)Oc2ccc(C)cc21 Amb9783196 [0,2,0,0,0,0|2,0,0]=4 5730 B13R2.3028 CC1Oc2ccc(Br)cc2C1=O Amb25683716 [0,2,0,0,0,0|1,0,1]=4 5731 B13R2.3028 CC1Oc2ccc(Br)cc2C1O Amb27260763 [0,2,0,0,0,0|1,0,1]=4 5732 B13R2.3028 CC1Oc2ccc(Cl)cc2C1=O Amb19068160 [0,2,0,0,0,0|1,0,1]=4 5733 B13R2.3028 CC1Oc2ccc(F)cc2C1=O Amb18798518 [0,2,0,0,0,0|1,0,1]=4 5734 B13R2.3028 CC1Oc2ccc(N)cc2C1=O Amb33310032 [0,2,0,0,0,0|1,0,1]=4 5735 B13R2.3028 CN1Oc2ccc(Br)cc2C1=O Amb24757038 [0,2,0,0,0,0|0,0,2]=4 5736 B13R2.3028 Cc1c(Br)oc2ccc(Cl)cc12 Amb27257705 [0,2,0,0,0,0|2,0,0]=4 5737 B13R2.3028 Cc1c(Br)oc2ccc(F)cc12 Amb18755598 [0,2,0,0,0,0|2,0,0]=4 5738 B13R2.3028 Cc1ccc2c(c1)C(=O)C(=O)O2 Amb27177687 [0,2,0,0,0,0|1,0,1]=4 5739 B13R2.3028 Cc1ccc2o[n+]([O-])c(C)c2c1 Amb27624604 [0,2,0,0,0,0|1,0,1]=4 5740 B13R2.3028 Cc1ccc2oc(C)c(C)c2c1 Amb26359812 [0,2,0,0,0,0|2,0,0]=4 5741 B13R2.3028 Cc1ccc2sc(Cl)c(O)c2c1 Amb27640302 [0,2,0,0,0,0|1,1,0]=4 5742 B13R2.3028 Cc1ccc2sc(F)c(O)c2c1 Amb28457688 [0,2,0,0,0,0|1,1,0]=4 5743 B13R2.3028 Cc1oc2ccc(Br)cc2c1C Amb22904302 [0,2,0,0,0,0|2,0,0]=4 5744 B13R2.3028 Cc1oc2ccc(N)cc2c1C Amb18645489 [0,2,0,0,0,0|2,0,0]=4 5745 B13R2.3028 Cc1oc2ccc(O)cc2c1N Amb18829458 [0,2,0,0,0,0|2,0,0]=4 5746 B13R2.3028 Cc1sc2ccc(F)cc2c1O Amb27618682 [0,2,0,0,0,0|1,1,0]=4 5747 B13R2.3028 Cc1sc2ccc(O)cc2c1O Amb27194704 [0,2,0,0,0,0|1,1,0]=4 5748 B13R2.3028 Nc1ccc2sc(N)c(O)c2c1 Amb27429341 [0,2,0,0,0,0|1,1,0]=4 5749 B13R2.3028 Nc1sc2ccc(I)cc2c1O Amb27435193 [0,2,0,0,0,0|1,1,0]=4 5750 B13R2.3028 O=C1c2cc(Br)ccc2OC1Br Amb22735818 [0,2,0,0,0,0|1,0,1]=4 5751 B13R2.3028 O=C1c2cc(F)ccc2OC1Br Amb22735496 [0,2,0,0,0,0|1,0,1]=4 5752 B13R2.3028 Oc1c(Br)sc2ccc(S)cc12 Amb28057123 [0,2,0,0,0,0|1,1,0]=4 5753 B13R2.3028 Oc1c(Cl)sc2ccc(F)cc12 Amb27230676 [0,2,0,0,0,0|1,1,0]=4 5754 B13R2.3028 Oc1c(Cl)sc2ccc(I)cc12 Amb28133660 [0,2,0,0,0,0|1,1,0]=4 5755 B13R2.3028 Oc1c(F)sc2ccc(F)cc12 Amb27782534 [0,2,0,0,0,0|1,1,0]=4 5756 B13R2.3028 Oc1c(F)sc2ccc(S)cc12 Amb28195405 [0,2,0,0,0,0|1,1,0]=4 5757 B13R2.3028 Oc1c(I)sc2ccc(I)cc12 Amb28292272 [0,2,0,0,0,0|1,1,0]=4 5758 B13R2.3028 Oc1c(S)sc2ccc(Cl)cc12 Amb28247433 [0,2,0,0,0,0|1,1,0]=4 5759 B13R2.3028 Oc1c(S)sc2ccc(I)cc12 Amb27216852 [0,2,0,0,0,0|1,1,0]=4 5760 B13R2.3028 Oc1ccc2sc(Br)c(O)c2c1 Amb27637165 [0,2,0,0,0,0|1,1,0]=4 5761 B13R2.3028 Oc1ccc2sc(F)c(O)c2c1 Amb28290777 [0,2,0,0,0,0|1,1,0]=4 5762 B13R2.3028 Oc1ccc2sc(I)c(O)c2c1 Amb28130534 [0,2,0,0,0,0|1,1,0]=4 5763 B13R2.3028 Oc1ccc2sc(O)c(O)c2c1 Amb28202900 [0,2,0,0,0,0|1,1,0]=4 5764 B13R2.3028 Oc1ccc2sc(S)c(O)c2c1 Amb27632900 [0,2,0,0,0,0|1,1,0]=4 5765 B13R2.3085 Cc1c(O)c2ccccc2n1C Amb32732864 [0,2,0,0,0,0|2,0,0]=4 5766 B13R2.4825 CC1Oc2c(Cl)cccc2C1=O Amb18325737 [0,2,0,0,0,0|1,0,1]=4 5767 B13R2.4825 CC1Oc2c(Cl)cccc2C1O Amb27982424 [0,2,0,0,0,0|1,0,1]=4 5768 B13R2.4825 CC1Oc2c(F)cccc2C1=O Amb18798517 [0,2,0,0,0,0|1,0,1]=4 5769 B13R2.4825 CC1Oc2c(N)cccc2C1=O Amb33310033 [0,2,0,0,0,0|1,0,1]=4 5770 B13R2.4825 CN1Oc2c(Br)cccc2C1=O Amb27225165 [0,2,0,0,0,0|0,0,2]=4 5771 B13R2.4825 Cc1c(Br)oc2c(F)cccc12 Amb18161576 [0,2,0,0,0,0|2,0,0]=4 5772 B13R2.4825 Cc1c(N)oc2c(Br)cccc12 Amb18160647 [0,2,0,0,0,0|2,0,0]=4 5773 B13R2.4825 Cc1cccc2c(O)c(I)sc12 Amb27966372 [0,2,0,0,0,0|1,1,0]=4 5774 B13R2.4825 Cc1cccc2c1OC(C)C2=O Amb18798089 [0,2,0,0,0,0|1,0,1]=4 5775 B13R2.4825 Cc1oc2c(Br)cccc2c1C Amb25148644 [0,2,0,0,0,0|2,0,0]=4 5776 B13R2.4825 Cc1sc2c(C)cccc2c1O Amb27224433 [0,2,0,0,0,0|1,1,0]=4 5777 B13R2.4825 Cc1sc2c(F)cccc2c1O Amb27202974 [0,2,0,0,0,0|1,1,0]=4 5778 B13R2.4825 Cc1sc2c(N)cccc2c1O Amb27210227 [0,2,0,0,0,0|1,1,0]=4 5779 B13R2.4825 Nc1cccc2c(O)c(Br)sc12 Amb27798635 [0,2,0,0,0,0|1,1,0]=4 5780 B13R2.4825 Nc1cccc2c(O)c(Cl)sc12 Amb27963758 [0,2,0,0,0,0|1,1,0]=4 5781 B13R2.4825 Nc1cccc2c(O)c(F)sc12 Amb27194779 [0,2,0,0,0,0|1,1,0]=4 5782 B13R2.4825 Nc1cccc2c(O)c(I)sc12 Amb27976650 [0,2,0,0,0,0|1,1,0]=4 5783 B13R2.4825 Nc1cccc2c(O)c(O)sc12 Amb27789301 [0,2,0,0,0,0|1,1,0]=4 5784 B13R2.4825 Nc1sc2c(F)cccc2c1O Amb27257432 [0,2,0,0,0,0|1,1,0]=4 5785 B13R2.4825 Nc1sc2c(N)cccc2c1O Amb27429345 [0,2,0,0,0,0|1,1,0]=4 5786 B13R2.4825 Nc1sc2c(S)cccc2c1O Amb27619997 [0,2,0,0,0,0|1,1,0]=4 5787 B13R2.4825 O=C1c2cccc(Br)c2OC1Br Amb22737718 [0,2,0,0,0,0|1,0,1]=4 5788 B13R2.4825 O=C1c2cccc(F)c2OC1Br Amb22739459 [0,2,0,0,0,0|1,0,1]=4 5789 B13R2.4825 Oc1c(Br)sc2c(Cl)cccc12 Amb27450197 [0,2,0,0,0,0|1,1,0]=4 5790 B13R2.4825 Oc1c(Br)sc2c(F)cccc12 Amb27643722 [0,2,0,0,0,0|1,1,0]=4 5791 B13R2.4825 Oc1c(Cl)sc2c(O)cccc12 Amb27192764 [0,2,0,0,0,0|1,1,0]=4 5792 B13R2.4825 Oc1c(Cl)sc2c(S)cccc12 Amb27265059 [0,2,0,0,0,0|1,1,0]=4 5793 B13R2.4825 Oc1c(F)sc2c(Br)cccc12 Amb28320410 [0,2,0,0,0,0|1,1,0]=4 5794 B13R2.4825 Oc1c(F)sc2c(Cl)cccc12 Amb27798549 [0,2,0,0,0,0|1,1,0]=4 5795 B13R2.4825 Oc1c(I)sc2c(S)cccc12 Amb27447443 [0,2,0,0,0,0|1,1,0]=4 5796 B13R2.4856 Cc1c(Br)oc2cccc(Cl)c12 Amb18717902 [0,2,0,0,0,0|2,0,0]=4 5797 B13R2.4856 Cc1c(Br)oc2cccc(F)c12 Amb18161575 [0,2,0,0,0,0|2,0,0]=4 5798 B13R2.4856 Cc1cccc2sc(Cl)c(O)c12 Amb27654426 [0,2,0,0,0,0|1,1,0]=4 5799 B13R2.4856 Cc1cccc2sc(I)c(O)c12 Amb28422913 [0,2,0,0,0,0|1,1,0]=4 5800 B13R2.4856 Cc1cccc2sc(N)c(O)c12 Amb27622914 [0,2,0,0,0,0|1,1,0]=4 5801 B13R2.4856 Cc1cccc2sc(O)c(O)c12 Amb27844841 [0,2,0,0,0,0|1,1,0]=4 5802 B13R2.4856 Cc1cccc2sc(S)c(O)c12 Amb27630766 [0,2,0,0,0,0|1,1,0]=4 5803 B13R2.4856 Cc1oc2cccc(Br)c2c1C Amb18754579 [0,2,0,0,0,0|2,0,0]=4 5804 B13R2.4856 Cc1oc2cccc(C)c2c1C Amb26872725 [0,2,0,0,0,0|2,0,0]=4 5805 B13R2.4856 Cc1sc2cccc(Br)c2c1O Amb27880306 [0,2,0,0,0,0|1,1,0]=4 5806 B13R2.4856 Cc1sc2cccc(C)c2c1O Amb28287001 [0,2,0,0,0,0|1,1,0]=4 5807 B13R2.4856 Cc1sc2cccc(I)c2c1O Amb27788654 [0,2,0,0,0,0|1,1,0]=4 5808 B13R2.4856 Cc1sc2cccc(N)c2c1O Amb27474910 [0,2,0,0,0,0|1,1,0]=4 5809 B13R2.4856 Nc1cccc2sc(Br)c(O)c12 Amb27439252 [0,2,0,0,0,0|1,1,0]=4 5810 B13R2.4856 Nc1cccc2sc(O)c(O)c12 Amb27845140 [0,2,0,0,0,0|1,1,0]=4 5811 B13R2.4856 O=C1c2c(Br)cccc2OC1Br Amb22737719 [0,2,0,0,0,0|1,0,1]=4 5812 B13R2.4856 O=C1c2c(F)cccc2OC1Br Amb22735515 [0,2,0,0,0,0|1,0,1]=4 5813 B13R2.4856 Oc1c(Br)sc2cccc(F)c12 Amb27880941 [0,2,0,0,0,0|1,1,0]=4 5814 B13R2.4856 Oc1c(Br)sc2cccc(I)c12 Amb27623016 [0,2,0,0,0,0|1,1,0]=4 5815 B13R2.4856 Oc1c(Cl)sc2cccc(S)c12 Amb27439751 [0,2,0,0,0,0|1,1,0]=4 5816 B13R2.4856 Oc1c(F)sc2cccc(Br)c12 Amb28057033 [0,2,0,0,0,0|1,1,0]=4 5817 B13R2.4856 Oc1c(F)sc2cccc(F)c12 Amb27845139 [0,2,0,0,0,0|1,1,0]=4 5818 B13R2.4856 Oc1c(F)sc2cccc(I)c12 Amb27618644 [0,2,0,0,0,0|1,1,0]=4 5819 B13R2.4856 Oc1c(I)sc2cccc(Cl)c12 Amb27258364 [0,2,0,0,0,0|1,1,0]=4 5820 B13R2.4856 Oc1c(S)sc2cccc(Br)c12 Amb27779399 [0,2,0,0,0,0|1,1,0]=4 5821 B13R2.4856 Oc1cccc2sc(F)c(O)c12 Amb27194703 [0,2,0,0,0,0|1,1,0]=4 5822 B13R2.4856 Oc1cccc2sc(I)c(O)c12 Amb28247228 [0,2,0,0,0,0|1,1,0]=4 5823 B13R2.4856 Oc1sc2cccc(Cl)c2c1O Amb27799193 [0,2,0,0,0,0|1,1,0]=4 5824 B13R2.4856 Oc1sc2cccc(F)c2c1O Amb28423776 [0,2,0,0,0,0|1,1,0]=4 5825 B13R2.4856 Oc1sc2cccc(I)c2c1O Amb27800242 [0,2,0,0,0,0|1,1,0]=4 5826 B13R2.5190 CC1Oc2cc(Cl)ccc2C1=O Amb27239410 [0,2,0,0,0,0|1,0,1]=4 5827 B13R2.5190 CC1Oc2cc(Cl)ccc2C1O Amb27877643 [0,2,0,0,0,0|1,0,1]=4 5828 B13R2.5190 CC1Oc2cc(F)ccc2C1=O Amb33550779 [0,2,0,0,0,0|1,0,1]=4 5829 B13R2.5190 Cc1c(Br)oc2cc(Cl)ccc12 Amb18717901 [0,2,0,0,0,0|2,0,0]=4 5830 B13R2.5190 Cc1c(Br)oc2cc(F)ccc12 Amb18161512 [0,2,0,0,0,0|2,0,0]=4 5831 B13R2.5190 Cc1ccc2c(C)c(Br)oc2c1 Amb18754577 [0,2,0,0,0,0|2,0,0]=4 5832 B13R2.5190 Cc1ccc2c(C)c(C)oc2c1 Amb27616941 [0,2,0,0,0,0|2,0,0]=4 5833 B13R2.5190 Cc1ccc2c(O)c(O)sc2c1 Amb27488420 [0,2,0,0,0,0|1,1,0]=4 5834 B13R2.5190 Cc1ccc2c(O)c(S)sc2c1 Amb28457686 [0,2,0,0,0,0|1,1,0]=4 5835 B13R2.5190 Cc1ccc2c(c1)OC(C)C2=O Amb26868636 [0,2,0,0,0,0|1,0,1]=4 5836 B13R2.5190 Cc1sc2cc(Br)ccc2c1O Amb28247451 [0,2,0,0,0,0|1,1,0]=4 5837 B13R2.5190 Cc1sc2cc(I)ccc2c1O Amb28287012 [0,2,0,0,0,0|1,1,0]=4 5838 B13R2.5190 Cc1sc2cc(N)ccc2c1O Amb27263093 [0,2,0,0,0,0|1,1,0]=4 5839 B13R2.5190 Cc1sc2cc(O)ccc2c1O Amb27844838 [0,2,0,0,0,0|1,1,0]=4 5840 B13R2.5190 Nc1ccc2c(O)c(N)sc2c1 Amb27429343 [0,2,0,0,0,0|1,1,0]=4 5841 B13R2.5190 Nc1ccc2c(O)c(S)sc2c1 Amb28142085 [0,2,0,0,0,0|1,1,0]=4 5842 B13R2.5190 Nc1sc2cc(F)ccc2c1O Amb27799279 [0,2,0,0,0,0|1,1,0]=4 5843 B13R2.5190 Nc1sc2cc(I)ccc2c1O Amb27460122 [0,2,0,0,0,0|1,1,0]=4 5844 B13R2.5190 O=C1c2ccc(Br)cc2OC1Br Amb22735817 [0,2,0,0,0,0|1,0,1]=4 5845 B13R2.5190 O=C1c2ccc(F)cc2OC1Br Amb22739426 [0,2,0,0,0,0|1,0,1]=4 5846 B13R2.5190 Oc1c(Br)sc2cc(Cl)ccc12 Amb27248772 [0,2,0,0,0,0|1,1,0]=4 5847 B13R2.5190 Oc1c(F)sc2cc(Br)ccc12 Amb27798625 [0,2,0,0,0,0|1,1,0]=4 5848 B13R2.5190 Oc1c(F)sc2cc(F)ccc12 Amb27797571 [0,2,0,0,0,0|1,1,0]=4 5849 B13R2.5190 Oc1c(S)sc2cc(Br)ccc12 Amb28345489 [0,2,0,0,0,0|1,1,0]=4 5850 B13R2.5190 Oc1ccc2c(O)c(Cl)sc2c1 Amb27192763 [0,2,0,0,0,0|1,1,0]=4 5851 B13R2.5190 Oc1ccc2c(O)c(I)sc2c1 Amb28133801 [0,2,0,0,0,0|1,1,0]=4 5852 B13R2.5190 Oc1ccc2c(O)c(O)sc2c1 Amb27429527 [0,2,0,0,0,0|1,1,0]=4 5853 B13R2.5190 Oc1sc2cc(Br)ccc2c1O Amb27622252 [0,2,0,0,0,0|1,1,0]=4 5854 B13R2.5190 Oc1sc2cc(I)ccc2c1O Amb28288205 [0,2,0,0,0,0|1,1,0]=4 5855 B13R2.669 C=Cc1ccc2c(c1)C(=O)NO2 Amb24497710 [0,2,0,0,0,0|0,0,2]=4 5856 B13R2.669 CCc1ccc2c(c1)C(=O)CO2 Amb9372571 [0,2,0,0,0,0|1,0,1]=4 5857 B13R2.669 CCc1ccc2c(c1)C(O)CO2 Amb27255533 [0,2,0,0,0,0|1,0,1]=4 5858 B13R2.669 CCc1ccc2occ(C)c2c1 Amb24071334 [0,2,0,0,0,0|2,0,0]=4 5859 B13R2.669 CCc1ccc2onc(C)c2c1 Amb25275392 [0,2,0,0,0,0|1,0,0]=3 5860 B13R2.669 CCc1ccc2onc(C)c2n1 Amb28244340 [0,2,0,0,0,0|2,0,0]=4 5861 B13R2.669 CCc1ccc2onc(O)c2c1 Amb32669327 [0,2,0,0,0,0|0,0,0]=2 5862 B13R2.669 CCc1cnc2onc(C)c2c1 Amb26872622 [0,2,0,0,0,0|2,0,0]=4 5863 B13R2.669 COc1ccc2c(c1)C(=O)CO2 Amb33534387 [0,2,0,0,0,0|1,0,1]=4 5864 B13R2.669 COc1ccc2c(c1)C(O)CO2 Amb27614583 [0,2,0,0,0,0|1,0,1]=4 5865 B13R2.669 COc1ccc2nnn(O)c2c1 Amb27416404 [0,2,0,0,0,0|2,0,0]=4 5866 B13R2.669 COc1ccc2occ(Br)c2c1 Amb18159604 [0,2,0,0,0,0|2,0,0]=4 5867 B13R2.669 COc1ccc2occ(C)c2c1 Amb22229996 [0,2,0,0,0,0|2,0,0]=4 5868 B13R2.669 COc1ccc2occ(N)c2c1 Amb18829457 [0,2,0,0,0,0|2,0,0]=4 5869 B13R2.669 COc1ccc2onc(C)c2n1 Amb26410981 [0,2,0,0,0,0|2,0,0]=4 5870 B13R2.669 COc1ccc2onc(Cl)c2c1 Amb23442974 [0,2,0,0,0,0|1,0,0]=3 5871 B13R2.669 COc1ccc2onc(N)c2c1 Amb23437112 [0,2,0,0,0,0|1,0,0]=3 5872 B13R2.669 COc1ccc2onc(O)c2c1 Amb23442973 [0,2,0,0,0,0|0,0,0]=2 5873 B13R2.669 COc1ccc2snc(C)c2c1 Amb26424521 [0,2,0,0,0,0|1,1,0]=4 5874 B13R2.669 COc1ccc2snc(N)c2c1 Amb26879802 [0,2,0,0,0,0|1,1,0]=4 5875 B13R2.669 CSc1ccc2onc(N)c2c1 Amb23402963 [0,2,0,0,0,0|1,0,0]=3 5876 B13R2.669 Cc1coc2ccc(C=O)cc12 Amb18830291 [0,2,0,0,0,0|2,0,0]=4 5877 B13R2.669 Cc1coc2ccc(NN)cc12 Amb27229170 [0,2,0,0,0,0|2,0,0]=4 5878 B13R2.669 Cc1noc2ccc(C#N)cc12 Amb22755829 [0,2,0,0,0,0|1,0,0]=3 5879 B13R2.669 Cc1noc2ccc(C=O)cc12 Amb18830133 [0,2,0,0,0,0|1,0,0]=3 5880 B13R2.669 Cc1noc2ccc(CN)cc12 Amb22235062 [0,2,0,0,0,0|1,0,0]=3 5881 B13R2.669 Cc1noc2ccc(CN)cc12 Amb22756377 [0,2,0,0,0,0|1,0,0]=3 5882 B13R2.669 Cc1noc2ccc(CN)nc12 Amb27445997 [0,2,0,0,0,0|2,0,0]=4 5883 B13R2.669 Cc1noc2ncc(C=O)cc12 Amb18829829 [0,2,0,0,0,0|2,0,0]=4 5884 B13R2.669 N#Cc1ccc2c(c1)C(=O)CO2 Amb24089256 [0,2,0,0,0,0|1,0,1]=4 5885 B13R2.669 N#Cc1ccc2c(c1)C(=O)N=N2 Amb28455623 [0,2,0,0,0,0|1,0,1]=4 5886 B13R2.669 N#Cc1ccc2onc(O)c2c1 Amb25304243 [0,2,0,0,0,0|0,0,0]=2 5887 B13R2.669 NCc1ccc2c(c1)C(=O)N=N2 Amb28207283 [0,2,0,0,0,0|1,0,1]=4 5888 B13R2.669 NCc1ccc2onc(N)c2c1 Amb22304302 [0,2,0,0,0,0|1,0,0]=3 5889 B13R2.669 Nc1noc2ccc(C=O)cc12 Amb18829863 [0,2,0,0,0,0|1,0,0]=3 5890 B13R2.669 O=Cc1ccc2c(c1)C(=O)N=C2 Amb22015325 [0,2,0,0,0,0|1,0,1]=4 5891 B13R2.669 O=Cc1ccc2c(c1)C(=O)NO2 Amb25860944 [0,2,0,0,0,0|0,0,2]=4 5892 B13R2.669 O=Cc1ccc2occ(Br)c2c1 Amb27788830 [0,2,0,0,0,0|2,0,0]=4 5893 B13R2.3742 Cc1cc(Br)c2c(c1)C(=O)CO2 Amb9372558 [0,2,0,0,0,0|1,0,1]=4 5894 B13R2.3742 Cc1cc(Br)c2c(c1)C(O)CO2 Amb27426606 [0,2,0,0,0,0|1,0,1]=4 5895 B13R2.3742 Cc1cc(Br)c2snc(Cl)c2c1 Amb32710069 [0,2,0,0,0,0|1,1,0]=4 5896 B13R2.3742 Cc1cc(Br)cc2c(Br)coc12 Amb28367926 [0,2,0,0,0,0|2,0,0]=4 5897 B13R2.3742 Cc1cc(C)c2onc(C)c2c1 Amb27767934 [0,2,0,0,0,0|1,0,0]=3 5898 B13R2.3742 Cc1cc(C)c2onc(O)c2c1 Amb32669312 [0,2,0,0,0,0|0,0,0]=2 5899 B13R2.3742 Cc1cc(C)c2scc(O)c2c1 Amb27268707 [0,2,0,0,0,0|1,1,0]=4 5900 B13R2.3742 Cc1cc(C)c2snc(N)c2c1 Amb27442413 [0,2,0,0,0,0|1,1,0]=4 5901 B13R2.3742 Cc1cc(Cl)c2c(c1)C(=O)CO2 Amb18325738 [0,2,0,0,0,0|1,0,1]=4 5902 B13R2.3742 Cc1cc(Cl)c2scc(O)c2c1 Amb28134779 [0,2,0,0,0,0|1,1,0]=4 5903 B13R2.3742 Cc1cc(Cl)cc2c1OCC2=O Amb9372547 [0,2,0,0,0,0|1,0,1]=4 5904 B13R2.3742 Cc1cc(Cl)cc2c1OCC2O Amb27854072 [0,2,0,0,0,0|1,0,1]=4 5905 B13R2.3742 Cc1cc(F)c2scc(O)c2c1 Amb28347025 [0,2,0,0,0,0|1,1,0]=4 5906 B13R2.3742 Cc1cc(F)cc2c(O)csc12 Amb28196829 [0,2,0,0,0,0|1,1,0]=4 5907 B13R2.3742 Cc1cc(I)c2scc(O)c2c1 Amb28202756 [0,2,0,0,0,0|1,1,0]=4 5908 B13R2.3742 Cc1cc(I)cc2c(O)csc12 Amb28246931 [0,2,0,0,0,0|1,1,0]=4 5909 B13R2.3742 Cc1cc(I)cc2c1ONC2=O Amb28280629 [0,2,0,0,0,0|0,0,2]=4 5910 B13R2.3742 Cc1cc(N)c2scc(O)c2c1 Amb27880940 [0,2,0,0,0,0|1,1,0]=4 5911 B13R2.3742 Cc1cc(O)c2scc(O)c2c1 Amb27778935 [0,2,0,0,0,0|1,1,0]=4 5912 B13R2.3742 Cc1cc(O)cc2c(O)csc12 Amb28252715 [0,2,0,0,0,0|1,1,0]=4 5913 B13R2.3742 Cc1coc2c(Br)cc(F)cc12 Amb27840762 [0,2,0,0,0,0|2,0,0]=4 5914 B13R2.3742 Cc1coc2c(C)cc(Cl)cc12 Amb27840715 [0,2,0,0,0,0|2,0,0]=4 5915 B13R2.3742 Cc1coc2c(Cl)cc(F)cc12 Amb27392926 [0,2,0,0,0,0|2,0,0]=4 5916 B13R2.3742 Cc1coc2c(F)cc(Br)cc12 Amb25139260 [0,2,0,0,0,0|2,0,0]=4 5917 B13R2.3742 Cc1coc2c(F)cc(F)cc12 Amb27840717 [0,2,0,0,0,0|2,0,0]=4 5918 B13R2.3742 Cc1noc2c(C)cc(N)cc12 Amb26845044 [0,2,0,0,0,0|1,0,0]=3 5919 B13R2.3742 Cc1noc2c(Cl)cc(Cl)nc12 Amb35825209 [0,2,0,0,0,0|2,0,0]=4 5920 B13R2.3742 Cc1noc2c(N)cc(Cl)cc12 Amb28291406 [0,2,0,0,0,0|1,0,0]=3 5921 B13R2.3742 Cc1noc2c(O)cc(O)nc12 Amb18646419 [0,2,0,0,0,0|2,0,0]=4 5922 B13R2.3742 Clc1cc(Br)c2snc(Cl)c2c1 Amb32710074 [0,2,0,0,0,0|1,1,0]=4 5923 B13R2.3742 Clc1cc(Br)cc2c(Br)coc12 Amb27817037 [0,2,0,0,0,0|2,0,0]=4 5924 B13R2.3742 Clc1noc2c(I)cc(I)cc12 Amb27445178 [0,2,0,0,0,0|1,0,0]=3 5925 B13R2.3742 Nc1cc(Br)cc2c(O)csc12 Amb27963464 [0,2,0,0,0,0|1,1,0]=4 5926 B13R2.3742 Nc1cc(Cl)c2c(c1)C(=O)CO2 Amb27398495 [0,2,0,0,0,0|1,0,1]=4 5927 B13R2.3742 Nc1cc(Cl)c2scc(O)c2c1 Amb27622713 [0,2,0,0,0,0|1,1,0]=4 5928 B13R2.3742 Nc1cc(Cl)cc2c(O)csc12 Amb27204108 [0,2,0,0,0,0|1,1,0]=4 5929 B13R2.3742 Nc1cc(F)cc2c1C=NC2=O Amb22015262 [0,2,0,0,0,0|1,0,1]=4 5930 B13R2.3742 Nc1cc(F)cc2c1OCC2=O Amb27799930 [0,2,0,0,0,0|1,0,1]=4 5931 B13R2.3742 Nc1cc(I)c2scc(O)c2c1 Amb27619994 [0,2,0,0,0,0|1,1,0]=4 5932 B13R2.3742 Nc1cc(I)cc2c(O)csc12 Amb28130814 [0,2,0,0,0,0|1,1,0]=4 5933 B13R2.3742 Nc1cc(N)c2c(c1)C(=O)N=N2 Amb28321450 [0,2,0,0,0,0|1,0,1]=4 5934 B13R2.3742 Nc1cc(O)c2scc(O)c2c1 Amb28130261 [0,2,0,0,0,0|1,1,0]=4 5935 B13R2.3742 Nc1cc(S)c2scc(O)c2c1 Amb28131196 [0,2,0,0,0,0|1,1,0]=4 5936 B13R2.3742 Nc1noc2c(Br)cc(Br)cc12 Amb23437122 [0,2,0,0,0,0|1,0,0]=3 5937 B13R2.3742 O=C1COc2c(Br)cc(Br)cc21 Amb24537638 [0,2,0,0,0,0|1,0,1]=4 5938 B13R2.3742 O=C1COc2c(Br)cc(Cl)cc21 Amb9372578 [0,2,0,0,0,0|1,0,1]=4 5939 B13R2.3742 O=C1COc2c(Cl)cc(Br)cc21 Amb33531627 [0,2,0,0,0,0|1,0,1]=4 5940 B13R2.3742 O=C1COc2c(Cl)cc(Cl)cc21 Amb2383544 [0,2,0,0,0,0|1,0,1]=4 5941 B13R2.3742 O=C1COc2c(Cl)cc(O)cc21 Amb27175602 [0,2,0,0,0,0|1,0,1]=4 5942 B13R2.3742 O=C1COc2c(F)cc(Br)cc21 Amb9372559 [0,2,0,0,0,0|1,0,1]=4 5943 B13R2.3742 O=C1COc2c(F)cc(Cl)cc21 Amb25381152 [0,2,0,0,0,0|1,0,1]=4 5944 B13R2.3742 O=C1COc2c(F)cc(F)cc21 Amb2383547 [0,2,0,0,0,0|1,0,1]=4 5945 B13R2.3742 O=C1N=Cc2c(Br)cc(O)cc21 Amb22015261 [0,2,0,0,0,0|1,0,1]=4 5946 B13R2.3742 O=C1N=Cc2c(Cl)cc(Cl)cc21 Amb22015256 [0,2,0,0,0,0|1,0,1]=4 5947 B13R2.3742 OC1COc2c(Cl)cc(Br)cc21 Amb27411663 [0,2,0,0,0,0|1,0,1]=4 5948 B13R2.3742 Oc1cc(F)c2scc(O)c2c1 Amb27798564 [0,2,0,0,0,0|1,1,0]=4 5949 B13R2.3742 Oc1csc2c(Br)cc(Cl)cc12 Amb27204093 [0,2,0,0,0,0|1,1,0]=4 5950 B13R2.3742 Oc1csc2c(Br)cc(F)cc12 Amb27446363 [0,2,0,0,0,0|1,1,0]=4 5951 B13R2.3742 Oc1csc2c(F)cc(Cl)cc12 Amb27257370 [0,2,0,0,0,0|1,1,0]=4 5952 B13R2.3742 Oc1csc2c(I)cc(Br)cc12 Amb27789302 [0,2,0,0,0,0|1,1,0]=4 5953 B13R2.3742 Oc1csc2c(I)cc(I)cc12 Amb28287914 [0,2,0,0,0,0|1,1,0]=4 5954 B13R2.3742 Oc1csc2c(O)cc(F)cc12 Amb28198206 [0,2,0,0,0,0|1,1,0]=4 5955 B13R2.3742 Oc1csc2c(S)cc(Br)cc12 Amb27460409 [0,2,0,0,0,0|1,1,0]=4 5956 B13R2.3742 Oc1noc2c(F)cc(F)cc12 Amb32669320 [0,2,0,0,0,0|0,0,0]=2 5957 B13R2.3790 Cc1c(Br)ccc2c1C(=O)CO2 Amb28071647 [0,2,0,0,0,0|1,0,1]=4 5958 B13R2.3790 Cc1c(Br)ccc2snc(Cl)c12 Amb32710076 [0,2,0,0,0,0|1,1,0]=4 5959 B13R2.3790 Cc1c(Cl)ccc2c1C(=O)CO2 Amb27830518 [0,2,0,0,0,0|1,0,1]=4 5960 B13R2.3790 Cc1c(I)ccc2scc(O)c12 Amb27810975 [0,2,0,0,0,0|1,1,0]=4 5961 B13R2.3790 Cc1ccc2onc(O)c2c1C Amb32669314 [0,2,0,0,0,0|0,0,0]=2 5962 B13R2.3790 Cc1ccc2scc(O)c2c1Cl Amb28134764 [0,2,0,0,0,0|1,1,0]=4 5963 B13R2.3790 Cc1ccc2scc(O)c2c1I Amb27220736 [0,2,0,0,0,0|1,1,0]=4 5964 B13R2.3790 Cc1ccc2scc(O)c2c1O Amb28198137 [0,2,0,0,0,0|1,1,0]=4 5965 B13R2.3790 Cc1ccc2snc(C)c2c1N Amb25100843 [0,2,0,0,0,0|1,1,0]=4 5966 B13R2.3790 Cc1ccc2snc(Cl)c2c1F Amb32710051 [0,2,0,0,0,0|1,1,0]=4 5967 B13R2.3790 Cc1coc2ccc(O)c(N)c12 Amb18829461 [0,2,0,0,0,0|2,0,0]=4 5968 B13R2.3790 Cc1noc2ccc(O)c(N)c12 Amb28140691 [0,2,0,0,0,0|1,0,0]=3 5969 B13R2.3790 Cc1noc2ncc(N)c(Cl)c12 Amb27964201 [0,2,0,0,0,0|2,0,0]=4 5970 B13R2.3790 Cc1nsc2ccc(Br)c(N)c12 Amb24397045 [0,2,0,0,0,0|1,1,0]=4 5971 B13R2.3790 Cc1nsc2ccc(Cl)c(Br)c12 Amb28249565 [0,2,0,0,0,0|1,1,0]=4 5972 B13R2.3790 Fc1ccc2snc(Cl)c2c1Cl Amb32710056 [0,2,0,0,0,0|1,1,0]=4 5973 B13R2.3790 Nc1ccc2scc(O)c2c1Br Amb27194663 [0,2,0,0,0,0|1,1,0]=4 5974 B13R2.3790 O=C1COc2ccc(O)c(O)c21 Amb27593380 [0,2,0,0,0,0|1,0,1]=4 5975 B13R2.3790 OC1COc2ccc(Cl)c(F)c21 Amb28205335 [0,2,0,0,0,0|1,0,1]=4 5976 B13R2.3790 Oc1ccc2scc(O)c2c1Cl Amb27192762 [0,2,0,0,0,0|1,1,0]=4 5977 B13R2.3790 Oc1ccc2scc(O)c2c1F Amb27446776 [0,2,0,0,0,0|1,1,0]=4 5978 B13R2.3790 Oc1ccc2scc(O)c2c1I Amb28059773 [0,2,0,0,0,0|1,1,0]=4 5979 B13R2.3790 Oc1csc2ccc(Br)c(O)c12 Amb27643793 [0,2,0,0,0,0|1,1,0]=4 5980 B13R2.3790 Oc1csc2ccc(Br)c(S)c12 Amb28134241 [0,2,0,0,0,0|1,1,0]=4 5981 B13R2.3790 Oc1csc2ccc(Cl)c(Br)c12 Amb27435104 [0,2,0,0,0,0|1,1,0]=4 5982 B13R2.3790 Oc1csc2ccc(Cl)c(Cl)c12 Amb28130121 [0,2,0,0,0,0|1,1,0]=4 5983 B13R2.3790 Oc1csc2ccc(Cl)c(I)c12 Amb27264066 [0,2,0,0,0,0|1,1,0]=4 5984 B13R2.3790 Oc1csc2ccc(I)c(Cl)c12 Amb27258365 [0,2,0,0,0,0|1,1,0]=4 5985 B13R2.3790 Oc1csc2ccc(I)c(F)c12 Amb27881939 [0,2,0,0,0,0|1,1,0]=4 5986 B13R2.3790 Oc1csc2ccc(I)c(O)c12 Amb27624071 [0,2,0,0,0,0|1,1,0]=4 5987 B13R2.3790 Oc1csc2ccc(I)c(S)c12 Amb27254332 [0,2,0,0,0,0|1,1,0]=4 5988 B13R2.3790 Oc1csc2ccc(S)c(Br)c12 Amb27870178 [0,2,0,0,0,0|1,1,0]=4 5989 B13R2.3790 Oc1csc2ccc(S)c(Cl)c12 Amb27265074 [0,2,0,0,0,0|1,1,0]=4 5990 B13R2.5187 Cc1ccc2c(C)nn(C)c2c1 Amb28251614 [0,2,0,0,0,0|2,0,0]=4 5991 B13R2.5187 Cc1ccc2c(I)nn(C)c2c1 Amb16185642 [0,2,0,0,0,0|2,0,0]=4 5992 B13R2.5187 Cc1ccc2c(N)nn(C)c2c1 Amb26630136 [0,2,0,0,0,0|2,0,0]=4 5993 B13R2.5187 Cc1ccc2c(c1)C(=N)N=C2N Amb27816140 [0,2,0,0,0,0|2,0,0]=4 5994 B13R2.5187 Cc1ccc2c(c1)c(Br)nn2C Amb23558929 [0,2,0,0,0,0|2,0,0]=4 5995 B13R2.5187 Cc1ccc2c(c1)c(I)nn2C Amb10608018 [0,2,0,0,0,0|2,0,0]=4 5996 B13R2.5187 Cc1nc(O)n2cc(N)ccc12 Amb24613173 [0,2,0,0,0,0|2,0,0]=4 5997 B13R2.5187 Cc1nn(C)c2cc(Br)ccc12 Amb10070872 [0,2,0,0,0,0|2,0,0]=4 5998 B13R2.5187 Cc1nn(C)c2cc(N)ccc12 Amb22406275 [0,2,0,0,0,0|2,0,0]=4 5999 B13R2.5187 Cc1nn(C)c2ccc(Br)cc12 Amb10070869 [0,2,0,0,0,0|2,0,0]=4 6000 B13R2.5187 Cc1nn(C)c2ccc(F)cc12 Amb28129531 [0,2,0,0,0,0|2,0,0]=4 6001 B13R2.5187 Cc1nn(C)c2ccc(N)cc12 Amb21962822 [0,2,0,0,0,0|2,0,0]=4 6002 B13R2.5187 Cn1cc(O)c2ccc(Cl)cc21 Amb33059329 [0,2,0,0,0,0|2,0,0]=4 6003 B13R2.5187 Cn1nc(Br)c2cc(Br)ccc21 Amb10067480 [0,2,0,0,0,0|2,0,0]=4 6004 B13R2.5187 Cn1nc(Br)c2cc(Cl)ccc21 Amb27647599 [0,2,0,0,0,0|2,0,0]=4 6005 B13R2.5187 Cn1nc(Br)c2cc(N)ccc21 Amb10067481 [0,2,0,0,0,0|2,0,0]=4 6006 B13R2.5187 Cn1nc(Br)c2cc(O)ccc21 Amb22500558 [0,2,0,0,0,0|2,0,0]=4 6007 B13R2.5187 Cn1nc(Br)c2ccc(Cl)cc21 Amb27394051 [0,2,0,0,0,0|2,0,0]=4 6008 B13R2.5187 Cn1nc(Br)c2ccc(N)cc21 Amb13890633 [0,2,0,0,0,0|2,0,0]=4 6009 B13R2.5187 Cn1nc(Br)c2ccc(O)cc21 Amb22500548 [0,2,0,0,0,0|2,0,0]=4 6010 B13R2.5187 Cn1nc(Cl)c2cc(Br)ccc21 Amb24556619 [0,2,0,0,0,0|2,0,0]=4 6011 B13R2.5187 Cn1nc(Cl)c2cc(O)ccc21 Amb22500559 [0,2,0,0,0,0|2,0,0]=4 6012 B13R2.5187 Cn1nc(Cl)c2ccc(Br)cc21 Amb22736805 [0,2,0,0,0,0|2,0,0]=4 6013 B13R2.5187 Cn1nc(Cl)c2ccc(O)cc21 Amb22500551 [0,2,0,0,0,0|2,0,0]=4 6014 B13R2.5187 Cn1nc(I)c2cc(Br)ccc21 Amb27264699 [0,2,0,0,0,0|2,0,0]=4 6015 B13R2.5187 Cn1nc(I)c2cc(Cl)ccc21 Amb24483674 [0,2,0,0,0,0|2,0,0]=4 6016 B13R2.5187 Cn1nc(I)c2cc(F)ccc21 Amb10608064 [0,2,0,0,0,0|2,0,0]=4 6017 B13R2.5187 Cn1nc(I)c2cc(N)ccc21 Amb20248091 [0,2,0,0,0,0|2,0,0]=4 6018 B13R2.5187 Cn1nc(I)c2cc(O)ccc21 Amb22500435 [0,2,0,0,0,0|2,0,0]=4 6019 B13R2.5187 Cn1nc(I)c2ccc(Cl)cc21 Amb25836267 [0,2,0,0,0,0|2,0,0]=4 6020 B13R2.5187 Cn1nc(I)c2ccc(F)cc21 Amb16185997 [0,2,0,0,0,0|2,0,0]=4 6021 B13R2.5187 Cn1nc(N)c2cc(Br)ccc21 Amb10070244 [0,2,0,0,0,0|2,0,0]=4 6022 B13R2.5187 Cn1nc(N)c2cc(F)ccc21 Amb10067537 [0,2,0,0,0,0|2,0,0]=4 6023 B13R2.5187 Cn1nc(N)c2cc(I)ccc21 Amb22736244 [0,2,0,0,0,0|2,0,0]=4 6024 B13R2.5187 Cn1nc(N)c2ccc(Br)cc21 Amb19895234 [0,2,0,0,0,0|2,0,0]=4 6025 B13R2.5187 Cn1nc(N)c2ccc(Cl)cc21 Amb10069956 [0,2,0,0,0,0|2,0,0]=4 6026 B13R2.5187 Cn1nc(N)c2ccc(F)cc21 Amb10067538 [0,2,0,0,0,0|2,0,0]=4 6027 B13R2.5187 Cn1nc(N)c2ccc(N)cc21 Amb28323238 [0,2,0,0,0,0|2,0,0]=4 6028 B13R2.5187 Cn1nc(N)c2ccc(O)cc21 Amb10975490 [0,2,0,0,0,0|2,0,0]=4 6029 B13R2.5187 Cn1nc(O)c2cc(Br)ccc21 Amb29838164 [0,2,0,0,0,0|1,0,0]=3 6030 B13R2.5187 Cn1nc(O)c2cc(Cl)ccc21 Amb23560684 [0,2,0,0,0,0|1,0,0]=3 6031 B13R2.5187 Cn1nc(O)c2cc(I)ccc21 Amb23560625 [0,2,0,0,0,0|1,0,0]=3 6032 B13R2.5187 Cn1nc(O)c2cc(N)ccc21 Amb23454582 [0,2,0,0,0,0|1,0,0]=3 6033 B13R2.5187 N=C1N=C(N)c2ccc(Cl)cc21 Amb28076655 [0,2,0,0,0,0|2,0,0]=4 6034 B13R2.5187 NC1=NC(=O)c2cc(Br)ccc21 Amb27970037 [0,2,0,0,0,0|1,0,1]=4 6035 B13R2.5187 NC1=NC(=O)c2cc(Cl)ccc21 Amb26636504 [0,2,0,0,0,0|1,0,1]=4 6036 B13R2.5187 O=C1N=C(O)c2cc(Br)ccc21 Amb22015284 [0,2,0,0,0,0|1,0,0]=3 6037 B13R2.11634 Cc1cc2c(C)noc2cc1Br Amb22751083 [0,2,0,0,0,0|1,0,0]=3 6038 B13R2.11634 Cc1cc2c(C)noc2cc1N Amb28067841 [0,2,0,0,0,0|1,0,0]=3 6039 B13R2.11634 Cc1cc2c(Cl)noc2cc1Cl Amb27856930 [0,2,0,0,0,0|1,0,0]=3 6040 B13R2.11634 Cc1cc2c(Cl)nsc2cc1F Amb32710066 [0,2,0,0,0,0|1,1,0]=4 6041 B13R2.11634 Cc1cc2c(N)noc2cc1Br Amb33716497 [0,2,0,0,0,0|1,0,0]=3 6042 B13R2.11634 Cc1cc2c(N)nsc2cc1Cl Amb24400542 [0,2,0,0,0,0|1,1,0]=4 6043 B13R2.11634 Cc1cc2c(O)csc2cc1Cl Amb27488730 [0,2,0,0,0,0|1,1,0]=4 6044 B13R2.11634 Cc1cc2c(O)csc2cc1I Amb27215738 [0,2,0,0,0,0|1,1,0]=4 6045 B13R2.11634 Cc1cc2c(O)csc2cc1N Amb27474911 [0,2,0,0,0,0|1,1,0]=4 6046 B13R2.11634 Cc1cc2c(O)csc2cc1O Amb27488422 [0,2,0,0,0,0|1,1,0]=4 6047 B13R2.11634 Cc1cc2c(O)csc2cc1S Amb28195428 [0,2,0,0,0,0|1,1,0]=4 6048 B13R2.11634 Cc1cc2c(cc1C)C(=O)CO2 Amb9372553 [0,2,0,0,0,0|1,0,1]=4 6049 B13R2.11634 Cc1cc2c(cc1C)C(O)CO2 Amb27793989 [0,2,0,0,0,0|1,0,1]=4 6050 B13R2.11634 Cc1cc2c(cc1F)OCC2O Amb27591843 [0,2,0,0,0,0|1,0,1]=4 6051 B13R2.11634 Cc1cc2nnn(O)c2cc1C Amb28348642 [0,2,0,0,0,0|2,0,0]=4 6052 B13R2.11634 Cc1cc2occ(C)c2cc1C Amb27834327 [0,2,0,0,0,0|2,0,0]=4 6053 B13R2.11634 Cc1cc2onc(O)c2cc1C Amb32669316 [0,2,0,0,0,0|0,0,0]=2 6054 B13R2.11634 Cc1cc2scc(O)c2cc1C Amb27769954 [0,2,0,0,0,0|1,1,0]=4 6055 B13R2.11634 Cc1cc2scc(O)c2cc1Cl Amb27435171 [0,2,0,0,0,0|1,1,0]=4 6056 B13R2.11634 Cc1cc2scc(O)c2cc1O Amb27488421 [0,2,0,0,0,0|1,1,0]=4 6057 B13R2.11634 Cc1cc2snc(Cl)c2cc1F Amb32710065 [0,2,0,0,0,0|1,1,0]=4 6058 B13R2.11634 Cc1noc2c1C=C(O)C(=O)N2 Amb27411869 [0,2,0,0,0,0|2,0,0]=4 6059 B13R2.11634 Cc1noc2c1NC(=O)C(O)=C2 Amb27646588 [0,2,0,0,0,0|2,0,0]=4 6060 B13R2.11634 Cc1noc2cc(F)c(Br)cc12 Amb18753848 [0,2,0,0,0,0|1,0,0]=3 6061 B13R2.11634 Cc1noc2cc(F)c(N)cc12 Amb21864569 [0,2,0,0,0,0|1,0,0]=3 6062 B13R2.11634 Cc1noc2cc(F)c(N)cc12 Amb21864960 [0,2,0,0,0,0|1,0,0]=3 6063 B13R2.11634 Cc1nsc2cc(Cl)c(N)cc12 Amb26567264 [0,2,0,0,0,0|1,1,0]=4 6064 B13R2.11634 Cc1nsc2cc(F)c(N)cc12 Amb18823716 [0,2,0,0,0,0|1,1,0]=4 6065 B13R2.11634 Clc1cc2c(Cl)noc2cc1Br Amb27171268 [0,2,0,0,0,0|1,0,0]=3 6066 B13R2.11634 Clc1cc2onc(Cl)c2cc1Cl Amb24493078 [0,2,0,0,0,0|1,0,0]=3 6067 B13R2.11634 Fc1cc2c(Cl)nsc2cc1Br Amb32710070 [0,2,0,0,0,0|1,1,0]=4 6068 B13R2.11634 Fc1cc2c(Cl)nsc2cc1Cl Amb32710046 [0,2,0,0,0,0|1,1,0]=4 6069 B13R2.11634 Fc1cc2snc(Cl)c2cc1Br Amb32710071 [0,2,0,0,0,0|1,1,0]=4 6070 B13R2.11634 Fc1cc2snc(Cl)c2cc1F Amb32710044 [0,2,0,0,0,0|1,1,0]=4 6071 B13R2.11634 Nc1cc2c(O)csc2cc1Br Amb28429026 [0,2,0,0,0,0|1,1,0]=4 6072 B13R2.11634 Nc1cc2c(O)csc2cc1Cl Amb27622733 [0,2,0,0,0,0|1,1,0]=4 6073 B13R2.11634 Nc1cc2c(O)csc2cc1F Amb27637320 [0,2,0,0,0,0|1,1,0]=4 6074 B13R2.11634 Nc1cc2c(O)csc2cc1S Amb27976666 [0,2,0,0,0,0|1,1,0]=4 6075 B13R2.11634 Nc1cc2scc(O)c2cc1Br Amb27446845 [0,2,0,0,0,0|1,1,0]=4 6076 B13R2.11634 Nc1cc2scc(O)c2cc1Cl Amb28198225 [0,2,0,0,0,0|1,1,0]=4 6077 B13R2.11634 Nc1cc2scc(O)c2cc1I Amb27258426 [0,2,0,0,0,0|1,1,0]=4 6078 B13R2.11634 Nc1cc2scc(O)c2cc1S Amb27459100 [0,2,0,0,0,0|1,1,0]=4 6079 B13R2.11634 Nc1noc2cc(F)c(F)cc12 Amb23402954 [0,2,0,0,0,0|1,0,0]=3 6080 B13R2.11634 O=C1COc2cc(Br)c(Cl)cc21 Amb24389271 [0,2,0,0,0,0|1,0,1]=4 6081 B13R2.11634 O=C1COc2cc(Br)c(F)cc21 Amb22735743 [0,2,0,0,0,0|1,0,1]=4 6082 B13R2.11634 O=C1COc2cc(Cl)c(Br)cc21 Amb27608114 [0,2,0,0,0,0|1,0,1]=4 6083 B13R2.11634 O=C1COc2cc(Cl)c(Cl)cc21 Amb28131029 [0,2,0,0,0,0|1,0,1]=4 6084 B13R2.11634 O=C1COc2cc(Cl)c(F)cc21 Amb27607256 [0,2,0,0,0,0|1,0,1]=4 6085 B13R2.11634 O=C1COc2cc(Cl)c(O)cc21 Amb27871438 [0,2,0,0,0,0|1,0,1]=4 6086 B13R2.11634 O=C1COc2cc(F)c(Br)cc21 Amb24057304 [0,2,0,0,0,0|1,0,1]=4 6087 B13R2.11634 O=C1COc2cc(F)c(Cl)cc21 Amb28282788 [0,2,0,0,0,0|1,0,1]=4 6088 B13R2.11634 O=C1COc2cc(O)c(Br)cc21 Amb27622715 [0,2,0,0,0,0|1,0,1]=4 6089 B13R2.11634 Oc1cc2c(O)csc2cc1Cl Amb27782756 [0,2,0,0,0,0|1,1,0]=4 6090 B13R2.11634 Oc1cc2scc(O)c2cc1I Amb27632915 [0,2,0,0,0,0|1,1,0]=4 6091 B13R2.11634 Oc1csc2cc(F)c(F)cc12 Amb28246948 [0,2,0,0,0,0|1,1,0]=4 6092 B13R2.11634 Oc1csc2cc(F)c(S)cc12 Amb28457669 [0,2,0,0,0,0|1,1,0]=4 6093 B13R2.11634 Oc1csc2cc(I)c(Cl)cc12 Amb27446770 [0,2,0,0,0,0|1,1,0]=4 6094 B13R2.11634 Oc1csc2cc(I)c(S)cc12 Amb27975880 [0,2,0,0,0,0|1,1,0]=4 6095 B13R2.11634 Oc1noc2cc(Br)c(Br)cc12 Amb27946966 [0,2,0,0,0,0|0,0,0]=2 6096 B13R2.11634 Oc1noc2cc(Br)c(Cl)cc12 Amb27241081 [0,2,0,0,0,0|0,0,0]=2 6097 B13R2.11634 Oc1noc2cc(Cl)c(Cl)cc12 Amb25329835 [0,2,0,0,0,0|0,0,0]=2 6098 B13R2.11634 Oc1noc2cc(I)c(Cl)cc12 Amb32669324 [0,2,0,0,0,0|0,0,0]=2 6099 B13R2.573 CCc1cccc2c(O)noc12 Amb32669325 [0,2,0,0,0,0|0,0,0]=2 6100 B13R2.573 COc1cccc2c(C)noc12 Amb27852863 [0,2,0,0,0,0|1,0,0]=3 6101 B13R2.573 COc1cccc2c(C)nsc12 Amb27441871 [0,2,0,0,0,0|1,1,0]=4 6102 B13R2.573 COc1cccc2c(Cl)nsc12 Amb25800980 [0,2,0,0,0,0|1,1,0]=4 6103 B13R2.573 COc1cccc2c(N)noc12 Amb27859577 [0,2,0,0,0,0|1,0,0]=3 6104 B13R2.573 COc1cccc2c(N)nsc12 Amb18648385 [0,2,0,0,0,0|1,1,0]=4 6105 B13R2.573 COc1cccc2c(O)csc12 Amb27634169 [0,2,0,0,0,0|1,1,0]=4 6106 B13R2.573 COc1cccc2c1OCC2=O Amb2383548 [0,2,0,0,0,0|1,0,1]=4 6107 B13R2.573 COc1cccc2c1ONC2=O Amb25697313 [0,2,0,0,0,0|0,0,2]=4 6108 B13R2.573 CSc1cccc2c(N)noc12 Amb23402966 [0,2,0,0,0,0|1,0,0]=3 6109 B13R2.573 Cc1coc2c(C=O)cccc12 Amb18199847 [0,2,0,0,0,0|2,0,0]=4 6110 B13R2.573 Cc1coc2c(CO)cccc12 Amb28251670 [0,2,0,0,0,0|2,0,0]=4 6111 B13R2.573 Cc1noc2c(C=O)cncc12 Amb18829839 [0,2,0,0,0,0|2,0,0]=4 6112 B13R2.573 Cc1noc2c(CO)cccc12 Amb28323324 [0,2,0,0,0,0|1,0,0]=3 6113 B13R2.573 N#Cc1cccc2c(N)noc12 Amb27229469 [0,2,0,0,0,0|1,0,0]=3 6114 B13R2.573 N#Cc1nccc2c(N)noc12 Amb28058929 [0,2,0,0,0,0|2,0,0]=4 6115 B13R2.573 O=Cc1cccc2c(Cl)coc12 Amb28189444 [0,2,0,0,0,0|2,0,0]=4 6116 B13R2.573 O=Cc1cncc2c(Br)noc12 Amb18159740 [0,2,0,0,0,0|2,0,0]=4 6117 B13R2.573 O=Cc1cncc2c(Cl)noc12 Amb18823464 [0,2,0,0,0,0|2,0,0]=4 6118 B13R2.4857 Cc1cccc2c(N)nn(C)c12 Amb24525584 [0,2,0,0,0,0|2,0,0]=4 6119 B13R2.4857 Cc1cccc2c1C(=N)N=C2N Amb27233627 [0,2,0,0,0,0|2,0,0]=4 6120 B13R2.4857 Cc1cccc2c1C(=O)N=C2N Amb25772837 [0,2,0,0,0,0|1,0,1]=4 6121 B13R2.4857 Cc1cccc2c1c(I)nn2C Amb10608091 [0,2,0,0,0,0|2,0,0]=4 6122 B13R2.4857 Cc1nn(C)c2c(Br)cccc12 Amb10070875 [0,2,0,0,0,0|2,0,0]=4 6123 B13R2.4857 Cc1nn(C)c2cccc(Br)c12 Amb10070865 [0,2,0,0,0,0|2,0,0]=4 6124 B13R2.4857 Cn1nc(Br)c2c(Br)cccc21 Amb28123577 [0,2,0,0,0,0|2,0,0]=4 6125 B13R2.4857 Cn1nc(Br)c2c(Cl)cccc21 Amb27223968 [0,2,0,0,0,0|2,0,0]=4 6126 B13R2.4857 Cn1nc(Br)c2c(N)cccc21 Amb10067479 [0,2,0,0,0,0|2,0,0]=4 6127 B13R2.4857 Cn1nc(Br)c2c(O)cccc21 Amb22500565 [0,2,0,0,0,0|2,0,0]=4 6128 B13R2.4857 Cn1nc(Br)c2cccc(N)c21 Amb13890634 [0,2,0,0,0,0|2,0,0]=4 6129 B13R2.4857 Cn1nc(Br)c2cccc(O)c21 Amb22500540 [0,2,0,0,0,0|2,0,0]=4 6130 B13R2.4857 Cn1nc(Cl)c2c(O)cccc21 Amb22500567 [0,2,0,0,0,0|2,0,0]=4 6131 B13R2.4857 Cn1nc(Cl)c2cccc(O)c21 Amb22500543 [0,2,0,0,0,0|2,0,0]=4 6132 B13R2.4857 Cn1nc(I)c2c(Cl)cccc21 Amb10608078 [0,2,0,0,0,0|2,0,0]=4 6133 B13R2.4857 Cn1nc(I)c2c(F)cccc21 Amb16186001 [0,2,0,0,0,0|2,0,0]=4 6134 B13R2.4857 Cn1nc(I)c2c(O)cccc21 Amb22500564 [0,2,0,0,0,0|2,0,0]=4 6135 B13R2.4857 Cn1nc(I)c2cccc(N)c21 Amb27779141 [0,2,0,0,0,0|2,0,0]=4 6136 B13R2.4857 Cn1nc(I)c2cccc(O)c21 Amb22500539 [0,2,0,0,0,0|2,0,0]=4 6137 B13R2.4857 Cn1nc(N)c2c(Br)cccc21 Amb22736263 [0,2,0,0,0,0|2,0,0]=4 6138 B13R2.4857 Cn1nc(N)c2c(Cl)cccc21 Amb10070572 [0,2,0,0,0,0|2,0,0]=4 6139 B13R2.4857 Cn1nc(N)c2c(F)cccc21 Amb10067536 [0,2,0,0,0,0|2,0,0]=4 6140 B13R2.4857 Cn1nc(N)c2c(I)cccc21 Amb10069982 [0,2,0,0,0,0|2,0,0]=4 6141 B13R2.4857 Cn1nc(N)c2c(N)cccc21 Amb28246132 [0,2,0,0,0,0|2,0,0]=4 6142 B13R2.4857 Cn1nc(N)c2cccc(F)c21 Amb10067539 [0,2,0,0,0,0|2,0,0]=4 6143 B13R2.4857 Cn1nc(N)c2cccc(N)c21 Amb27186710 [0,2,0,0,0,0|2,0,0]=4 6144 B13R2.4857 Cn1nc(O)c2cccc(Br)c21 Amb23400867 [0,2,0,0,0,0|1,0,0]=3 6145 B13R2.5151 Cc1ccc(Br)c2c(C)coc12 Amb27495264 [0,2,0,0,0,0|2,0,0]=4 6146 B13R2.5151 Cc1ccc(Br)c2c1C(=O)CO2 Amb35663103 [0,2,0,0,0,0|1,0,1]=4 6147 B13R2.5151 Cc1ccc(Br)c2c1C(O)CO2 Amb35600534 [0,2,0,0,0,0|1,0,1]=4 6148 B13R2.5151 Cc1ccc(Br)c2occ(C)c12 Amb35660870 [0,2,0,0,0,0|2,0,0]=4 6149 B13R2.5151 Cc1ccc(Br)c2scc(O)c12 Amb27880336 [0,2,0,0,0,0|1,1,0]=4 6150 B13R2.5151 Cc1ccc(C)c2c(C)coc12 Amb27616942 [0,2,0,0,0,0|2,0,0]=4 6151 B13R2.5151 Cc1ccc(C)c2c(O)noc12 Amb32669313 [0,2,0,0,0,0|0,0,0]=2 6152 B13R2.5151 Cc1ccc(Cl)c2c1C(=O)CO2 Amb9372585 [0,2,0,0,0,0|1,0,1]=4 6153 B13R2.5151 Cc1ccc(F)c2c(C)coc12 Amb27654528 [0,2,0,0,0,0|2,0,0]=4 6154 B13R2.5151 Cc1ccc(F)c2c(Cl)nsc12 Amb32710053 [0,2,0,0,0,0|1,1,0]=4 6155 B13R2.5151 Cc1ccc(F)c2c1C(=O)CO2 Amb27644308 [0,2,0,0,0,0|1,0,1]=4 6156 B13R2.5151 Cc1ccc(F)c2c1OCC2O Amb28046244 [0,2,0,0,0,0|1,0,1]=4 6157 B13R2.5151 Cc1ccc(F)c2occ(C)c12 Amb27840766 [0,2,0,0,0,0|2,0,0]=4 6158 B13R2.5151 Cc1ccc(N)c2c1C(=O)CO2 Amb27263930 [0,2,0,0,0,0|1,0,1]=4 6159 B13R2.5151 Cc1ccc(O)c2c(O)csc12 Amb28252713 [0,2,0,0,0,0|1,1,0]=4 6160 B13R2.5151 Cc1ccc(O)c2scc(O)c12 Amb27439210 [0,2,0,0,0,0|1,1,0]=4 6161 B13R2.5151 Cc1coc2c(Cl)ccc(Br)c12 Amb27840765 [0,2,0,0,0,0|2,0,0]=4 6162 B13R2.5151 Cc1coc2c(Cl)ccc(Cl)c12 Amb27392925 [0,2,0,0,0,0|2,0,0]=4 6163 B13R2.5151 Cc1coc2c(Cl)ccc(F)c12 Amb28283381 [0,2,0,0,0,0|2,0,0]=4 6164 B13R2.5151 Cc1nsc2c(N)ccc(Br)c12 Amb18135974 [0,2,0,0,0,0|1,1,0]=4 6165 B13R2.5151 Nc1ccc(Br)c2c1OCC2=O Amb27246362 [0,2,0,0,0,0|1,0,1]=4 6166 B13R2.5151 Nc1ccc(Cl)c2c(O)csc12 Amb27845738 [0,2,0,0,0,0|1,1,0]=4 6167 B13R2.5151 Nc1ccc(Cl)c2scc(O)c12 Amb28288096 [0,2,0,0,0,0|1,1,0]=4 6168 B13R2.5151 Nc1ccc(N)c2c(O)csc12 Amb27637316 [0,2,0,0,0,0|1,1,0]=4 6169 B13R2.5151 O=C1COc2c(Cl)ccc(F)c21 Amb27201273 [0,2,0,0,0,0|1,0,1]=4 6170 B13R2.5151 O=C1COc2c(F)ccc(Cl)c21 Amb27218489 [0,2,0,0,0,0|1,0,1]=4 6171 B13R2.5151 OC1COc2c(Cl)ccc(F)c21 Amb27638631 [0,2,0,0,0,0|1,0,1]=4 6172 B13R2.5151 Oc1ccc(Br)c2scc(O)c12 Amb27643873 [0,2,0,0,0,0|1,1,0]=4 6173 B13R2.5151 Oc1ccc(Cl)c2c(O)csc12 Amb27643936 [0,2,0,0,0,0|1,1,0]=4 6174 B13R2.5151 Oc1ccc(I)c2c(O)csc12 Amb27644081 [0,2,0,0,0,0|1,1,0]=4 6175 B13R2.5151 Oc1ccc(I)c2scc(O)c12 Amb28130532 [0,2,0,0,0,0|1,1,0]=4 6176 B13R2.5151 Oc1ccc(O)c2c(O)csc12 Amb28428902 [0,2,0,0,0,0|1,1,0]=4 6177 B13R2.5151 Oc1csc2c(Br)ccc(Br)c12 Amb27438874 [0,2,0,0,0,0|1,1,0]=4 6178 B13R2.5151 Oc1csc2c(Br)ccc(Cl)c12 Amb27622334 [0,2,0,0,0,0|1,1,0]=4 6179 B13R2.5151 Oc1csc2c(Cl)ccc(Br)c12 Amb28252716 [0,2,0,0,0,0|1,1,0]=4 6180 B13R2.5151 Oc1csc2c(Cl)ccc(Cl)c12 Amb27641336 [0,2,0,0,0,0|1,1,0]=4 6181 B13R2.5151 Oc1csc2c(Cl)ccc(I)c12 Amb27446306 [0,2,0,0,0,0|1,1,0]=4 6182 B13R2.5151 Oc1csc2c(F)ccc(Cl)c12 Amb27446766 [0,2,0,0,0,0|1,1,0]=4 6183 B13R2.5151 Oc1csc2c(F)ccc(F)c12 Amb27224499 [0,2,0,0,0,0|1,1,0]=4 6184 B13R2.5151 Oc1csc2c(F)ccc(I)c12 Amb28345772 [0,2,0,0,0,0|1,1,0]=4 6185 B13R2.5151 Oc1csc2c(I)ccc(Br)c12 Amb27268901 [0,2,0,0,0,0|1,1,0]=4 6186 B13R2.5151 Oc1csc2c(I)ccc(Cl)c12 Amb27489890 [0,2,0,0,0,0|1,1,0]=4 6187 B13R2.5151 Oc1csc2c(I)ccc(F)c12 Amb27202934 [0,2,0,0,0,0|1,1,0]=4 6188 B13R2.5151 Oc1csc2c(I)ccc(I)c12 Amb27616449 [0,2,0,0,0,0|1,1,0]=4 6189 B13R2.5151 Oc1noc2c(Cl)ccc(Br)c12 Amb32669333 [0,2,0,0,0,0|0,0,0]=2 6190 B13R2.5151 Oc1noc2c(F)ccc(Cl)c12 Amb32669332 [0,2,0,0,0,0|0,0,0]=2 6191 B13R2.5151 Oc1noc2c(F)ccc(F)c12 Amb32669322 [0,2,0,0,0,0|0,0,0]=2 6192 B13R2.5180 Cc1c(Br)ccc2c(Cl)nsc12 Amb32710075 [0,2,0,0,0,0|1,1,0]=4 6193 B13R2.5180 Cc1c(Br)ccc2c(O)csc12 Amb27460369 [0,2,0,0,0,0|1,1,0]=4 6194 B13R2.5180 Cc1c(Cl)ccc2c1OCC2=O Amb27246363 [0,2,0,0,0,0|1,0,1]=4 6195 B13R2.5180 Cc1c(F)ccc2c(O)csc12 Amb28057922 [0,2,0,0,0,0|1,1,0]=4 6196 B13R2.5180 Cc1c(F)ccc2c1OCC2=O Amb27185922 [0,2,0,0,0,0|1,0,1]=4 6197 B13R2.5180 Cc1c(O)ccc2c1OCC2=O Amb807568 [0,2,0,0,0,0|1,0,1]=4 6198 B13R2.5180 Cc1ccc2c(C)nsc2c1N Amb27214190 [0,2,0,0,0,0|1,1,0]=4 6199 B13R2.5180 Cc1ccc2c(Cl)nsc2c1F Amb32710055 [0,2,0,0,0,0|1,1,0]=4 6200 B13R2.5180 Cc1ccc2c(N)nsc2c1I Amb28244149 [0,2,0,0,0,0|1,1,0]=4 6201 B13R2.5180 Cc1ccc2c(O)noc2c1C Amb32669310 [0,2,0,0,0,0|0,0,0]=2 6202 B13R2.5180 Cc1ccc2c(c1F)OCC2O Amb28127852 [0,2,0,0,0,0|1,0,1]=4 6203 B13R2.5180 Cc1ccc2c(c1N)OCC2=O Amb28140674 [0,2,0,0,0,0|1,0,1]=4 6204 B13R2.5180 Cc1coc2c(F)c(Cl)ccc12 Amb27840767 [0,2,0,0,0,0|2,0,0]=4 6205 B13R2.5180 Cc1noc2c(N)c(O)ccc12 Amb18645976 [0,2,0,0,0,0|1,0,0]=3 6206 B13R2.5180 Fc1c(Br)ccc2c(Cl)nsc12 Amb32710063 [0,2,0,0,0,0|1,1,0]=4 6207 B13R2.5180 Fc1ccc2c(Cl)nsc2c1Cl Amb32710054 [0,2,0,0,0,0|1,1,0]=4 6208 B13R2.5180 Fc1ccc2c(Cl)nsc2c1F Amb32710045 [0,2,0,0,0,0|1,1,0]=4 6209 B13R2.5180 Nc1c(S)ccc2c(O)csc12 Amb28130827 [0,2,0,0,0,0|1,1,0]=4 6210 B13R2.5180 Nc1ccc2c(O)csc2c1Cl Amb27845782 [0,2,0,0,0,0|1,1,0]=4 6211 B13R2.5180 Nc1ccc2c(O)csc2c1N Amb28133751 [0,2,0,0,0,0|1,1,0]=4 6212 B13R2.5180 Nc1ccc2c(O)csc2c1O Amb27194056 [0,2,0,0,0,0|1,1,0]=4 6213 B13R2.5180 Nc1noc2c(F)c(F)ccc12 Amb23402955 [0,2,0,0,0,0|1,0,0]=3 6214 B13R2.5180 O=C1COc2c1ccc(Cl)c2Br Amb27185937 [0,2,0,0,0,0|1,0,1]=4 6215 B13R2.5180 O=C1COc2c1ccc(Cl)c2Cl Amb9372545 [0,2,0,0,0,0|1,0,1]=4 6216 B13R2.5180 O=C1COc2c1ccc(F)c2Br Amb24077391 [0,2,0,0,0,0|1,0,1]=4 6217 B13R2.5180 O=C1COc2c1ccc(F)c2Cl Amb27185912 [0,2,0,0,0,0|1,0,1]=4 6218 B13R2.5180 O=C1COc2c1ccc(F)c2F Amb18789164 [0,2,0,0,0,0|1,0,1]=4 6219 B13R2.5180 O=C1COc2c1ccc(I)c2F Amb22739483 [0,2,0,0,0,0|1,0,1]=4 6220 B13R2.5180 O=C1COc2c1ccc(O)c2O Amb2504869 [0,2,0,0,0,0|1,0,1]=4 6221 B13R2.5180 Oc1ccc2c(O)csc2c1S Amb27632917 [0,2,0,0,0,0|1,1,0]=4 6222 B13R2.5180 Oc1csc2c(Cl)c(I)ccc12 Amb28197868 [0,2,0,0,0,0|1,1,0]=4 6223 B13R2.5180 Oc1csc2c(F)c(Br)ccc12 Amb27622384 [0,2,0,0,0,0|1,1,0]=4 6224 B13R2.5180 Oc1csc2c(I)c(Br)ccc12 Amb28130266 [0,2,0,0,0,0|1,1,0]=4 6225 B13R2.5180 Oc1csc2c(O)c(Cl)ccc12 Amb27789367 [0,2,0,0,0,0|1,1,0]=4 6226 B13R2.5180 Oc1csc2c(O)c(F)ccc12 Amb27487636 [0,2,0,0,0,0|1,1,0]=4 6227 B13R2.5180 Oc1noc2c(F)c(F)ccc12 Amb32669319 [0,2,0,0,0,0|0,0,0]=2 6228 B13R2.582 CCc1cccc2onc(O)c12 Amb32669330 [0,2,0,0,0,0|0,0,0]=2 6229 B13R2.582 COc1cccc2c1C(=O)CO2 Amb18829059 [0,2,0,0,0,0|1,0,1]=4 6230 B13R2.582 COc1cccc2cnn(O)c12 Amb27186093 [0,2,0,0,0,0|2,0,0]=4 6231 B13R2.582 COc1cccc2occ(Br)c12 Amb27196445 [0,2,0,0,0,0|2,0,0]=4 6232 B13R2.582 COc1cccc2onc(C)c12 Amb28135546 [0,2,0,0,0,0|1,0,0]=3 6233 B13R2.582 COc1cccc2onc(Cl)c12 Amb25253388 [0,2,0,0,0,0|1,0,0]=3 6234 B13R2.582 COc1cccc2onc(N)c12 Amb2724788 [0,2,0,0,0,0|1,0,0]=3 6235 B13R2.582 COc1cccc2onc(O)c12 Amb26911953 [0,2,0,0,0,0|0,0,0]=2 6236 B13R2.582 COc1cccc2scc(O)c12 Amb27636486 [0,2,0,0,0,0|1,1,0]=4 6237 B13R2.582 COc1cccc2snc(C)c12 Amb27843594 [0,2,0,0,0,0|1,1,0]=4 6238 B13R2.582 COc1cccc2snc(Cl)c12 Amb24450095 [0,2,0,0,0,0|1,1,0]=4 6239 B13R2.582 COc1cccc2snc(N)c12 Amb26387279 [0,2,0,0,0,0|1,1,0]=4 6240 B13R2.582 COc1ccnc2onc(Br)c12 Amb27441213 [0,2,0,0,0,0|2,0,0]=4 6241 B13R2.582 COc1ccnc2onc(C)c12 Amb27249657 [0,2,0,0,0,0|2,0,0]=4 6242 B13R2.582 CSc1cccc2onc(N)c12 Amb23402962 [0,2,0,0,0,0|1,0,0]=3 6243 B13R2.582 O=Cc1cccc2c1C(=O)N=C2 Amb22015259 [0,2,0,0,0,0|1,0,1]=4 6244 B13R2.11642 CC1=CC(=O)Nc2onc(C)c21 Amb20619470 [0,2,0,0,0,0|2,0,0]=4 6245 B13R2.11642 CC1=Cc2onc(C)c2C(=O)O1 Amb27453525 [0,2,0,0,0,0|2,0,0]=4 6246 B13R2.11642 Cc1cc(Br)cc2onc(C)c12 Amb27764260 [0,2,0,0,0,0|1,0,0]=3 6247 B13R2.11642 Cc1cc(C)c2c(C)coc2c1 Amb27244728 [0,2,0,0,0,0|2,0,0]=4 6248 B13R2.11642 Cc1cc(C)c2c(C)noc2c1 Amb27480932 [0,2,0,0,0,0|1,0,0]=3 6249 B13R2.11642 Cc1cc(C)c2c(C)noc2n1 Amb26318164 [0,2,0,0,0,0|2,0,0]=4 6250 B13R2.11642 Cc1cc(C)c2c(Cl)noc2c1 Amb23443001 [0,2,0,0,0,0|1,0,0]=3 6251 B13R2.11642 Cc1cc(C)c2c(N)noc2c1 Amb23443013 [0,2,0,0,0,0|1,0,0]=3 6252 B13R2.11642 Cc1cc(C)c2c(N)noc2n1 Amb6357619 [0,2,0,0,0,0|2,0,0]=4 6253 B13R2.11642 Cc1cc(C)c2c(O)csc2c1 Amb27463641 [0,2,0,0,0,0|1,1,0]=4 6254 B13R2.11642 Cc1cc(C)c2c(O)noc2c1 Amb23443011 [0,2,0,0,0,0|0,0,0]=2 6255 B13R2.11642 Cc1cc(C)c2c(O)noc2n1 Amb25941920 [0,2,0,0,0,0|1,0,0]=3 6256 B13R2.11642 Cc1cc(C)c2c(c1)OCC2=O Amb9372544 [0,2,0,0,0,0|1,0,1]=4 6257 B13R2.11642 Cc1cc(Cl)c2c(C)noc2n1 Amb32675529 [0,2,0,0,0,0|2,0,0]=4 6258 B13R2.11642 Cc1cc(F)cc2scc(O)c12 Amb27788564 [0,2,0,0,0,0|1,1,0]=4 6259 B13R2.11642 Cc1cc(N)c2c(C)noc2n1 Amb24708338 [0,2,0,0,0,0|2,0,0]=4 6260 B13R2.11642 Cc1cc(N)c2c(O)csc2c1 Amb27622525 [0,2,0,0,0,0|1,1,0]=4 6261 B13R2.11642 Cc1cc(O)c2c(C)noc2c1 Amb27426810 [0,2,0,0,0,0|1,0,0]=3 6262 B13R2.11642 Cc1cc(O)c2c(C)noc2n1 Amb24552378 [0,2,0,0,0,0|2,0,0]=4 6263 B13R2.11642 Cc1cc(O)c2c(c1)OCC2=O Amb5759074 [0,2,0,0,0,0|1,0,1]=4 6264 B13R2.11642 Cc1cc(O)cc2c1C(=O)CO2 Amb806963 [0,2,0,0,0,0|1,0,1]=4 6265 B13R2.11642 Cc1cc2onc(Br)c2c(Cl)n1 Amb28135850 [0,2,0,0,0,0|2,0,0]=4 6266 B13R2.11642 Cc1cc2onc(Cl)c2c(Cl)n1 Amb27796613 [0,2,0,0,0,0|2,0,0]=4 6267 B13R2.11642 Cc1cc2onc(N)c2c(Cl)n1 Amb27669966 [0,2,0,0,0,0|2,0,0]=4 6268 B13R2.11642 Cc1coc2cc(F)cc(F)c12 Amb27985698 [0,2,0,0,0,0|2,0,0]=4 6269 B13R2.11642 Cc1noc2c1C(=O)NC(O)=C2 Amb27949626 [0,2,0,0,0,0|2,0,0]=4 6270 B13R2.11642 Cc1noc2cc(Br)cc(O)c12 Amb25276679 [0,2,0,0,0,0|1,0,0]=3 6271 B13R2.11642 Cc1noc2cc(Cl)nc(Cl)c12 Amb22447707 [0,2,0,0,0,0|2,0,0]=4 6272 B13R2.11642 Cc1noc2nc(Cl)cc(Cl)c12 Amb27488099 [0,2,0,0,0,0|2,0,0]=4 6273 B13R2.11642 Cc1noc2nc(O)cc(O)c12 Amb18646420 [0,2,0,0,0,0|2,0,0]=4 6274 B13R2.11642 Fc1cc(Br)cc2snc(Cl)c12 Amb32710057 [0,2,0,0,0,0|1,1,0]=4 6275 B13R2.11642 Fc1cc(F)c2c(Cl)nsc2c1 Amb32710048 [0,2,0,0,0,0|1,1,0]=4 6276 B13R2.11642 Nc1cc(Cl)c2c(O)csc2c1 Amb27798590 [0,2,0,0,0,0|1,1,0]=4 6277 B13R2.11642 Nc1cc(F)c2c(O)csc2c1 Amb28429034 [0,2,0,0,0,0|1,1,0]=4 6278 B13R2.11642 Nc1cc(I)c2c(O)csc2c1 Amb27976649 [0,2,0,0,0,0|1,1,0]=4 6279 B13R2.11642 Nc1cc(N)c2c(N)noc2n1 Amb28048902 [0,2,0,0,0,0|2,0,0]=4 6280 B13R2.11642 Nc1cc(N)c2c(O)csc2c1 Amb27429352 [0,2,0,0,0,0|1,1,0]=4 6281 B13R2.11642 Nc1cc(O)c2c(O)csc2c1 Amb27622251 [0,2,0,0,0,0|1,1,0]=4 6282 B13R2.11642 Nc1cc(S)cc2scc(O)c12 Amb27779484 [0,2,0,0,0,0|1,1,0]=4 6283 B13R2.11642 Nc1noc2cc(F)cc(F)c12 Amb23402956 [0,2,0,0,0,0|1,0,0]=3 6284 B13R2.11642 Nc1nsc2cc(Br)cc(F)c12 Amb26078092 [0,2,0,0,0,0|1,1,0]=4 6285 B13R2.11642 O=C1COc2cc(Br)cc(Br)c21 Amb27226180 [0,2,0,0,0,0|1,0,1]=4 6286 B13R2.11642 O=C1COc2cc(Cl)cc(Cl)c21 Amb9486208 [0,2,0,0,0,0|1,0,1]=4 6287 B13R2.11642 O=C1COc2cc(F)cc(F)c21 Amb18183577 [0,2,0,0,0,0|1,0,1]=4 6288 B13R2.11642 O=C1COc2cc(O)cc(Cl)c21 Amb27759892 [0,2,0,0,0,0|1,0,1]=4 6289 B13R2.11642 O=C1COc2cc(O)cc(O)c21 Amb549308 [0,2,0,0,0,0|1,0,1]=4 6290 B13R2.11642 Oc1csc2cc(Br)cc(Br)c12 Amb27225354 [0,2,0,0,0,0|1,1,0]=4 6291 B13R2.11642 Oc1csc2cc(Br)cc(Cl)c12 Amb27194142 [0,2,0,0,0,0|1,1,0]=4 6292 B13R2.11642 Oc1csc2cc(Br)cc(F)c12 Amb27488485 [0,2,0,0,0,0|1,1,0]=4 6293 B13R2.11642 Oc1csc2cc(Cl)cc(Br)c12 Amb28060453 [0,2,0,0,0,0|1,1,0]=4 6294 B13R2.11642 Oc1csc2cc(Cl)cc(I)c12 Amb27789392 [0,2,0,0,0,0|1,1,0]=4 6295 B13R2.11642 Oc1csc2cc(F)cc(Cl)c12 Amb28290771 [0,2,0,0,0,0|1,1,0]=4 6296 B13R2.11642 Oc1csc2cc(I)cc(Br)c12 Amb28133588 [0,2,0,0,0,0|1,1,0]=4 6297 B13R2.11642 Oc1csc2cc(I)cc(S)c12 Amb27788647 [0,2,0,0,0,0|1,1,0]=4 6298 B13R2.11642 Oc1csc2cc(S)cc(Br)c12 Amb27460060 [0,2,0,0,0,0|1,1,0]=4 6299 B13R2.11642 Oc1csc2cc(S)cc(O)c12 Amb27963516 [0,2,0,0,0,0|1,1,0]=4 6300 B13R2.2130 CCc1ccc2c(O)noc2c1 Amb32669326 [0,2,0,0,0,0|0,0,0]=2 6301 B13R2.2130 CCc1ccc2c(c1)OCC2=O Amb28244072 [0,2,0,0,0,0|1,0,1]=4 6302 B13R2.2130 COc1cc2onc(C)c2cn1 Amb26879923 [0,2,0,0,0,0|2,0,0]=4 6303 B13R2.2130 COc1ccc2c(C)noc2n1 Amb27453423 [0,2,0,0,0,0|2,0,0]=4 6304 B13R2.2130 COc1ccc2c(Cl)noc2c1 Amb25697012 [0,2,0,0,0,0|1,0,0]=3 6305 B13R2.2130 COc1ccc2c(Cl)nsc2c1 Amb25154078 [0,2,0,0,0,0|1,1,0]=4 6306 B13R2.2130 COc1ccc2c(N)noc2c1 Amb22263918 [0,2,0,0,0,0|1,0,0]=3 6307 B13R2.2130 COc1ccc2c(N)nsc2c1 Amb25139608 [0,2,0,0,0,0|1,1,0]=4 6308 B13R2.2130 COc1ccc2c(O)coc2c1 Amb24061892 [0,2,0,0,0,0|1,0,0]=3 6309 B13R2.2130 COc1ccc2c(O)csc2c1 Amb28368649 [0,2,0,0,0,0|1,1,0]=4 6310 B13R2.2130 COc1ccc2c(c1)C=NC2=O Amb22015142 [0,2,0,0,0,0|1,0,1]=4 6311 B13R2.2130 COc1ccc2c(c1)CN=C2N Amb24627274 [0,2,0,0,0,0|2,0,0]=4 6312 B13R2.2130 COc1ccc2c(c1)OCC2=O Amb2499974 [0,2,0,0,0,0|1,0,1]=4 6313 B13R2.2130 COc1ccc2c(c1)OCC2O Amb20623798 [0,2,0,0,0,0|1,0,1]=4 6314 B13R2.2130 COc1ccc2c(c1)ONC2=O Amb25992644 [0,2,0,0,0,0|0,0,2]=4 6315 B13R2.2130 CSc1ccc2c(C)nsc2c1 Amb27631637 [0,2,0,0,0,0|1,1,0]=4 6316 B13R2.2130 CSc1ccc2c(N)noc2c1 Amb23402964 [0,2,0,0,0,0|1,0,0]=3 6317 B13R2.2130 CSc1ccc2c(c1)OCC2=O Amb27799962 [0,2,0,0,0,0|1,0,1]=4 6318 B13R2.2130 Cc1coc2cc(CO)ccc12 Amb28062490 [0,2,0,0,0,0|2,0,0]=4 6319 B13R2.2130 Cc1noc2cc(C#N)ccc12 Amb28241247 [0,2,0,0,0,0|1,0,0]=3 6320 B13R2.2130 Cc1noc2cc(C=O)ccc12 Amb33743967 [0,2,0,0,0,0|1,0,0]=3 6321 B13R2.2130 Cc1noc2cc(CO)ccc12 Amb27441352 [0,2,0,0,0,0|1,0,0]=3 6322 B13R2.2130 Cc1noc2nc(C#N)ccc12 Amb27971156 [0,2,0,0,0,0|2,0,0]=4 6323 B13R2.2130 N#Cc1ccc2c(N)noc2c1 Amb19957568 [0,2,0,0,0,0|1,0,0]=3 6324 B13R2.2130 N#Cc1ccc2c(c1)OCC2=O Amb25335402 [0,2,0,0,0,0|1,0,1]=4 6325 B13R2.2130 N#Cc1ccn2c(O)nnc2c1 Amb27254125 [0,2,0,0,0,0|2,0,0]=4 6326 B13R2.2130 NCc1ccc2c(N)noc2c1 Amb25809457 [0,2,0,0,0,0|1,0,0]=3 6327 B13R2.2130 NCc1ccc2c(N)noc2c1 Amb28555770 [0,2,0,0,0,0|1,0,0]=3 6328 B13R2.2130 NCc1ccc2c(N)noc2c1 Amb32663644 [0,2,0,0,0,0|1,0,0]=3 6329 B13R2.2130 NCc1ccc2c(N)noc2n1 Amb24433868 [0,2,0,0,0,0|2,0,0]=4 6330 B13R2.2130 O=Cc1ccc2c(O)noc2c1 Amb32669323 [0,2,0,0,0,0|0,0,0]=2 6331 B13R2.2130 O=Cc1ccc2c(c1)C=NC2=O Amb22015266 [0,2,0,0,0,0|1,0,1]=4 6332 B13R2.2130 O=Cc1ccc2c(c1)OCC2O Amb18829058 [0,2,0,0,0,0|1,0,1]=4 6333 B13R2.2130 OCc1ccc2c(c1)nnn2O Amb26981325 [0,2,0,0,0,0|2,0,0]=4 6334 B13R2.12159 CC1=NS(=O)(=O)c2ccccc21 Amb19148057 [0,2,0,0,0,0|1,1,0]=4 6335 B13R2.12159 CS1(=O)=NC(=O)c2ccccc21 Amb31251514 [0,2,0,0,0,0|0,1,1]=4 6336 B13R2.12159 ClC1=NC(Cl)(Cl)c2ccccc21 Amb2792742 [0,2,0,0,0,0|2,0,0]=4 6337 B13R2.12159 NC1=NC(Cl)(Cl)c2ccccc21 Amb27445173 [0,2,0,0,0,0|2,0,0]=4 6338 B13R2.12159 NC1=NS(=O)(=O)c2ccccc21 Amb6336176 [0,2,0,0,0,0|1,1,0]=4 6339 B13R2.12159 O=S1(=O)N=C(Cl)c2ccccc21 Amb6369312 [0,2,0,0,0,0|1,1,0]=4 6340 B13R2.12159 O=S1(=O)N=C(F)c2ccccc21 Amb35653861 [0,2,0,0,0,0|1,1,0]=4 6341 B13R2.12159 O=S1(=O)N=C(O)c2ccccc21 Amb22058725 [0,2,0,0,0,0|0,1,0]=3 6342 B13R2.12159 O=S1(=O)N=C(S)c2ccccc21 Amb33528937 [0,2,0,0,0,0|0,2,0]=4 6343 B13R2.12159 O=S1(=O)N=C([O-])c2ccccc21 Amb22347862 [0,2,0,0,0,0|0,1,1]=4 6344 B9R0.2 C\C=C\C=C\C=C\C(=O)O Amb3987814 [0,0,2,0,0,0|2,0,0]=4 6345 B9R0.45 CO\C=C\C=C\C=C\C=O Amb27169346 [0,0,2,0,0,0|1,0,1]=4 6346 B11R2.20 C1=COc2ccccc2N1 Amb27828258 [0,0,1,1,0,0|2,0,0]=4 6347 B11R2.20 C1=Cc2ccccc2OC1 Amb17844055 [0,0,1,1,0,0|2,0,0]=4 6348 B11R2.20 C1=NCc2ccccc2N1 Amb19374085 [0,0,1,1,0,0|2,0,0]=4 6349 B11R2.20 C1=NNc2cccnc2O1 Amb28291339 [0,0,1,1,0,0|2,0,0]=4 6350 B11R2.20 C1=Nc2ccccc2OC1 Amb28456926 [0,0,1,1,0,0|2,0,0]=4 6351 B11R2.20 c1ccc2c(c1)OCCO2 Amb2722914 [0,0,1,1,0,0|1,0,1]=4 6352 B11R2.20 c1ccc2cnccc2c1 Amb2609970 [0,0,1,1,0,0|2,0,0]=4 6353 B11R2.20 c1ccc2ncncc2c1 Amb2609962 [0,0,1,1,0,0|2,0,0]=4 6354 B11R2.20 c1ccc2nnccc2c1 Amb21858429 [0,0,1,1,0,0|2,0,0]=4 6355 B11R2.20 c1ccc2nnccc2c1 Amb22001549 [0,0,1,1,0,0|2,0,0]=4 6356 B11R2.18 c1ccc2ccnc2cc1 Amb27620192 [0,0,1,1,0,0|2,0,0]=4 6357 B11R2.55 Oc1ccccc1C2=NO2 Amb28074741 [0,0,1,1,0,0|0,0,0]=2 6358 B11R2.55 Oc1ccccc1C2CO2 Amb22055488 [0,0,1,1,0,0|1,0,1]=4 6359 B13R3.28 c1ccc2c(c1)OCC3OC23 Amb6245688 [0,0,0,1,0,1|1,0,1]=4 6360 B13R3.28 c1ccc2c3c(ncc2c1)N3 Amb24428998 [0,0,0,1,0,1|2,0,0]=4 6361 B13R3.274 OC1c2ccccc2C3OC13 Amb28343274 [0,0,0,1,0,1|1,0,1]=4 6362 B9R1.11 CC(CO)=C1C=CC=C1 Amb27981717 [0,0,1,0,1,0|2,0,0]=4 6363 B9R1.11 C\C(=N/O)c1ccco1 Amb6739803 [0,0,1,0,1,0|2,0,0]=4 6364 B9R1.11 C\C(=N/O)c1cccs1 Amb6355845 [0,0,1,0,1,0|2,0,0]=4 6365 B9R1.11 C\C(=N\O)c1ccco1 Amb4018078 [0,0,1,0,1,0|2,0,0]=4 6366 B9R1.11 C\C(=N\O)c1cccs1 Amb4020390 [0,0,1,0,1,0|2,0,0]=4 6367 B9R1.11 C\C(=N\O)c1ccoc1 Amb28047667 [0,0,1,0,1,0|2,0,0]=4 6368 B9R1.11 C\C(=N\O)c1ccsc1 Amb27833776 [0,0,1,0,1,0|2,0,0]=4 6369 B9R1.11 N\C(=N/O)c1ccco1 Amb22587188 [0,0,1,0,1,0|2,0,0]=4 6370 B9R1.11 N\C(=N/O)c1ccco1 Amb8831731 [0,0,1,0,1,0|2,0,0]=4 6371 B9R1.11 N\C(=N/O)c1cccs1 Amb6384078 [0,0,1,0,1,0|2,0,0]=4 6372 B9R1.11 N\C(=N/O)c1ccsc1 Amb1154671 [0,0,1,0,1,0|2,0,0]=4 6373 B9R1.11 N\C(=N\O)c1ccco1 Amb2696503 [0,0,1,0,1,0|2,0,0]=4 6374 B9R1.11 N\C(=N\O)c1cccs1 Amb1106021 [0,0,1,0,1,0|2,0,0]=4 6375 B9R1.11 N\C(=N\O)c1ccoc1 Amb25728620 [0,0,1,0,1,0|2,0,0]=4 6376 B9R1.11 N\C(=N\O)c1ccsc1 Amb22053011 [0,0,1,0,1,0|2,0,0]=4 6377 B9R1.11 O\N=C(/Cl)c1ccsc1 Amb26570907 [0,0,1,0,1,0|2,0,0]=4 6378 B9R1.11 O\N=C(\Cl)c1cccs1 Amb27864158 [0,0,1,0,1,0|2,0,0]=4 6379 B9R1.41 O=C(O)c1cscc1O Amb18124673 [0,0,1,0,1,0|2,0,0]=4 6380 B9R1.41 O=C(O)c1sccc1O Amb10069920 [0,0,1,0,1,0|2,0,0]=4 6381 B9R2.3 C1=NCc2ccsc21 Amb27828755 [1,0,0,0,1,0|2,0,0]=4 6382 B9R2.3 c1cc2cscc2o1 Amb27817005 [1,0,0,0,1,0|2,0,0]=4 6383 B9R2.50 C1=Cc2ccccc21 Amb19515942 [1,0,0,0,1,0|1,0,0]=3 6384 B9R2.50 C1=Nc2ccncc21 Amb27490817 [1,0,0,0,1,0|1,0,0]=3 6385 B9R2.50 c1ccc2c(c1)CC2 Amb17778802 [1,0,0,0,1,0|1,0,1]=4 6386 B9R2.50 c1ccc2c(c1)CN2 Amb27460936 [1,0,0,0,1,0|0,0,2]=4 6387 B11R1.852 O=C(NO)C1=CC=CC=CC1 Amb25225570 [0,0,1,0,0,1|0,0,2]=4 6388 B11R1.51 COC1=CC=CCC=C1C=O Amb27401190 [0,0,1,0,0,1|1,0,1]=4 6389 B11R1.86 C=C(C)Sc1ccccc1O Amb18646620 [0,0,1,0,0,1|2,0,0]=4 6390 B11R1.86 CC(=N)Nc1ccccc1Br Amb28249813 [0,0,1,0,0,1|2,0,0]=4 6391 B11R1.86 CC(=N)Nc1ccccc1C Amb27644968 [0,0,1,0,0,1|2,0,0]=4 6392 B11R1.86 CC(=O)Cc1ccccc1O Amb18041942 [0,0,1,0,0,1|1,0,1]=4 6393 B11R1.86 CC(=O)Nc1ccccc1O Amb1212257 [0,0,1,0,0,1|1,0,1]=4 6394 B11R1.86 CC(=O)Oc1ccccc1O Amb18125344 [0,0,1,0,0,1|1,0,1]=4 6395 B11R1.86 CC(O)Cc1ccccc1O Amb18125386 [0,0,1,0,0,1|1,0,1]=4 6396 B11R1.86 CN(O)Cc1ccccc1O Amb24676904 [0,0,1,0,0,1|2,0,0]=4 6397 B11R1.86 C[C@@H](O)Cc1ccccc1O Amb22896916 [0,0,1,0,0,1|1,0,1]=4 6398 B11R1.86 C[C@H](O)Cc1ccccc1O Amb26497542 [0,0,1,0,0,1|1,0,1]=4 6399 B11R1.86 Cc1ccccc1CC(=N)N Amb2696413 [0,0,1,0,0,1|2,0,0]=4 6400 B11R1.86 Cc1ccccc1CC(=N)N Amb33549015 [0,0,1,0,0,1|2,0,0]=4 6401 B11R1.86 Cc1ccccc1CC(=O)O Amb2609430 [0,0,1,0,0,1|2,0,0]=4 6402 B11R1.86 Cc1ccccc1NC(=N)N Amb17505553 [0,0,1,0,0,1|2,0,0]=4 6403 B11R1.86 Cc1ccccc1NC(=N)N Amb9175311 [0,0,1,0,0,1|2,0,0]=4 6404 B11R1.86 N=C(N)Cc1ccccc1Br Amb16231135 [0,0,1,0,0,1|2,0,0]=4 6405 B11R1.86 N=C(N)Cc1ccccc1Br Amb6259549 [0,0,1,0,0,1|2,0,0]=4 6406 B11R1.86 N=C(N)Cc1ccccc1Cl Amb20673127 [0,0,1,0,0,1|2,0,0]=4 6407 B11R1.86 N=C(N)Cc1ccccc1Cl Amb6280626 [0,0,1,0,0,1|2,0,0]=4 6408 B11R1.86 N=C(N)Cc1ccccc1F Amb2696586 [0,0,1,0,0,1|2,0,0]=4 6409 B11R1.86 N=C(N)Cc1ccccc1F Amb7365488 [0,0,1,0,0,1|2,0,0]=4 6410 B11R1.86 N=C(N)Cc1ccccc1I Amb27945485 [0,0,1,0,0,1|2,0,0]=4 6411 B11R1.86 N=C(N)Cc1ccccc1O Amb25045573 [0,0,1,0,0,1|1,0,0]=3 6412 B11R1.86 N=C(N)Nc1ccccc1Br Amb10879748 [0,0,1,0,0,1|2,0,0]=4 6413 B11R1.86 N=C(N)Nc1ccccc1Cl Amb18183575 [0,0,1,0,0,1|2,0,0]=4 6414 B11R1.86 N=C(N)Nc1ccccc1F Amb18796697 [0,0,1,0,0,1|2,0,0]=4 6415 B11R1.86 N=C(N)Sc1ccccc1Br Amb27761151 [0,0,1,0,0,1|2,0,0]=4 6416 B11R1.86 N=C(N)Sc1ccccc1Cl Amb27652282 [0,0,1,0,0,1|2,0,0]=4 6417 B11R1.86 NC(=O)Cc1ccccc1O Amb4020853 [0,0,1,0,0,1|0,0,2]=4 6418 B11R1.86 NC(=O)Nc1ccccc1O Amb18125361 [0,0,1,0,0,1|0,0,2]=4 6419 B11R1.86 NC(=O)Oc1ccccc1O Amb27148270 [0,0,1,0,0,1|0,0,2]=4 6420 B11R1.86 NC(=S)Cc1ccccc1O Amb26373191 [0,0,1,0,0,1|0,1,1]=4 6421 B11R1.86 NC(=S)Nc1ccccc1O Amb2528108 [0,0,1,0,0,1|0,1,1]=4 6422 B11R1.86 Nc1ccccc1CC(=O)O Amb5519014 [0,0,1,0,0,1|2,0,0]=4 6423 B11R1.86 O=C(Cl)Cc1ccccc1O Amb27477566 [0,0,1,0,0,1|1,0,1]=4 6424 B11R1.86 O=C(O)C[n+]1ccccc1O Amb27233666 [0,0,1,0,0,1|2,0,0]=4 6425 B11R1.86 O=C(O)Cc1ccccc1Br Amb1139894 [0,0,1,0,0,1|2,0,0]=4 6426 B11R1.86 O=C(O)Cc1ccccc1Cl Amb6365808 [0,0,1,0,0,1|2,0,0]=4 6427 B11R1.86 O=C(O)Cc1ccccc1F Amb2688300 [0,0,1,0,0,1|2,0,0]=4 6428 B11R1.86 O=C(O)Cc1ccccc1I Amb2754650 [0,0,1,0,0,1|2,0,0]=4 6429 B11R1.86 O=C(O)Cc1ccccc1O Amb2388914 [0,0,1,0,0,1|1,0,0]=3 6430 B11R1.86 O=C(O)Cc1ccccc1S Amb17616851 [0,0,1,0,0,1|1,1,0]=4 6431 B11R1.86 O=C(O)Cc1cnccc1O Amb33547475 [0,0,1,0,0,1|2,0,0]=4 6432 B11R1.86 O=C(O)Cc1ncccc1O Amb18125512 [0,0,1,0,0,1|2,0,0]=4 6433 B11R1.86 O=C(O)Cc1ncccc1O Amb20247882 [0,0,1,0,0,1|2,0,0]=4 6434 B11R1.86 O=[PH](O)Oc1ccccc1O Amb28122429 [0,0,1,0,0,1|2,0,0]=4 6435 B11R1.86 OB(O)Oc1ccccc1O Amb28201143 [0,0,1,0,0,1|2,0,0]=4 6436 B11R1.86 Oc1ccccc1C=C(Br)Br Amb28077279 [0,0,1,0,0,1|2,0,0]=4 6437 B11R1.280 C=Cc1ccc(O)c(C=C)c1 Amb28287065 [0,0,1,0,0,1|2,0,0]=4 6438 B13R2.33 C=C1COc2ccccc2OC1 Amb25212686 [0,0,0,0,0,2|2,0,0]=4 6439 B13R2.33 CC1=NCc2ccccc2CN1 Amb25970914 [0,0,0,0,0,2|2,0,0]=4 6440 B13R2.33 CC1=NNc2ccccc2C=C1 Amb27421335 [0,0,0,0,0,2|2,0,0]=4 6441 B13R2.33 NC1=NNc2ccccc2C=C1 Amb27974235 [0,0,0,0,0,2|2,0,0]=4 6442 B13R2.33 O=C1C=Cc2ccccc2OC1 Amb27175937 [0,0,0,0,0,2|1,0,1]=4 6443 B13R2.33 O=C1C=Nc2ccccc2C=N1 Amb22489908 [0,0,0,0,0,2|1,0,1]=4 6444 B13R2.33 O=C1CCc2ccccc2OC1 Amb26925695 [0,0,0,0,0,2|1,0,1]=4 6445 B13R2.33 O=C1COc2ccccc2CN1 Amb2137257 [0,0,0,0,0,2|1,0,1]=4 6446 B13R2.33 O=C1COc2ccccc2SC1 Amb27616915 [0,0,0,0,0,2|1,0,1]=4 6447 B13R2.33 OC1CCc2ccccc2OC1 Amb27178603 [0,0,0,0,0,2|1,0,1]=4 6448 B13R2.33 OC1COc2ccccc2CN1 Amb22015233 [0,0,0,0,0,2|1,0,1]=4 6449 B13R2.33 OC1COc2ccccc2SC1 Amb22230116 [0,0,0,0,0,2|1,0,1]=4 6450 B13R2.163 CC1=CN=Cc2ccccc2N1 Amb27248260 [0,0,0,0,0,2|2,0,0]=4 6451 B13R2.163 O=C1CCOc2ccccc2C1 Amb24352115 [0,0,0,0,0,2|1,0,1]=4 6452 B13R2.163 O=C1CCOc2ccccc2N1 Amb10608982 [0,0,0,0,0,2|1,0,1]=4 6453 B13R2.163 O=C1COCc2ccccc2N1 Amb19516346 [0,0,0,0,0,2|1,0,1]=4 6454 B13R2.163 O=C1Nc2ccccc2C=NO1 Amb28255633 [0,0,0,0,0,2|1,0,1]=4 6455 B13R2.163 S=C1CCOc2ccccc2N1 Amb27974673 [0,0,0,0,0,2|1,1,0]=4 6456 B13R2.163 S=C1CN=Cc2ccccc2N1 Amb27602230 [0,0,0,0,0,2|1,1,0]=4 6457 B13R2.4820 OC1=CC=CC2=CNC=CC=C12 Amb27974161 [0,0,0,0,0,2|2,0,0]=4 6458 B13R2.5252 BrC1=CCCOc2ccccc21 Amb27649074 [0,0,0,0,0,2|2,0,0]=4 6459 B13R2.5252 C=C1CCCOc2ccccc21 Amb19316319 [0,0,0,0,0,2|2,0,0]=4 6460 B13R2.5252 O=C1CCCOc2ccccc21 Amb33545871 [0,0,0,0,0,2|1,0,1]=4 6461 B13R2.5252 O=C1N=CCOc2ccccc21 Amb27481084 [0,0,0,0,0,2|0,0,1]=3 6462 B13R2.5252 O=C1NCCOc2ccccc21 Amb2445337 [0,0,0,0,0,2|0,0,2]=4 6463 B13R2.5252 O=C1NN=COc2ccccc21 Amb2416930 [0,0,0,0,0,2|0,0,1]=3 6464 B13R2.5252 OC1CCCOc2ccccc21 Amb17578185 [0,0,0,0,0,2|1,0,1]=4 6465 B13R2.5252 O[C@@H]1CCCOc2ccccc21 Amb25093048 [0,0,0,0,0,2|1,0,1]=4 6466 B13R2.5252 O[C@H]1CCCOc2ccccc21 Amb26841182 [0,0,0,0,0,2|1,0,1]=4