0 B10R1.17 BrC=C=Cc1ccccc1 Amb17673290 [0,0,0,0,0,0|1,0,3]=4 1 B10R1.17 BrCC#Cc1cccc[n]1 Amb24482311 [0,0,0,0,0,0|2,0,2]=4 2 B10R1.17 BrCCCc1c[n]c[n]c1 Amb25092294 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.17 BrCCCc1cc[n]cc1 Amb24094393 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.17 BrCCCc1cccnc1 Amb1102301 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.17 BrCCCc1cccnc1 Amb17610084 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.17 BrCCOC1C=CC=CO1 Amb25227874 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.17 BrCCOc1cccc[n]1 Amb25808972 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.17 BrCCOc1ccccc1 Amb1152333 [0,0,0,0,0,0|2,0,0]=2 9 B10R1.17 BrCCSc1c[n]cc[n]1 Amb24476914 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.17 Br[Mg]C#Cc1ccccc1 Amb22353480 [0,0,0,0,0,0|2,0,2]=4 11 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.17 Br[Zn]C#Cc1ccccc1 Amb22898101 [0,0,0,0,0,0|2,0,2]=4 13 B10R1.17 Br[Zn]CCc1ccccc1 Amb22000434 [0,0,0,0,0,0|2,0,0]=2 14 B10R1.17 Br\C=C/Oc1ccccc1 Amb25794486 [0,0,0,0,0,0|2,0,2]=4 15 B10R1.17 Br\C=C\Cc1ccccc1 Amb22053885 [0,0,0,0,0,0|1,0,2]=3 16 B10R1.17 Br\C=N/Nc1ccccc1 Amb25783866 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.17 Br\C=N\Nc1ccccc1 Amb25274154 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.17 C#CC#Cc1ccccc1 Amb24585690 [0,0,0,0,0,0|1,0,3]=4 19 B10R1.17 C#CCCc1c[n]ccc1 Amb24085226 [0,0,0,0,0,0|2,0,1]=3 20 B10R1.17 C#CCCc1cc[n]cc1 Amb24091331 [0,0,0,0,0,0|2,0,1]=3 21 B10R1.17 C#CCCc1cccc[n]1 Amb24571654 [0,0,0,0,0,0|2,0,1]=3 22 B10R1.17 C#CCNc1c[n]ccc1 Amb24752597 [0,0,0,0,0,0|3,0,1]=4 23 B10R1.17 C#CCNc1cc[n]cc1 Amb18284709 [0,0,0,0,0,0|3,0,1]=4 24 B10R1.17 C#CCNc1cccc[n]1 Amb18959521 [0,0,0,0,0,0|3,0,1]=4 25 B10R1.17 C#CCNc1ccccc1 Amb21953889 [0,0,0,0,0,0|2,0,1]=3 26 B10R1.17 C#CCOc1c[n]ccc1 Amb22586592 [0,0,0,0,0,0|3,0,1]=4 27 B10R1.17 C#CCOc1cc[n]cc1 Amb24117045 [0,0,0,0,0,0|3,0,1]=4 28 B10R1.17 C#CCOc1cccc[n]1 Amb24407701 [0,0,0,0,0,0|3,0,1]=4 29 B10R1.17 C#CCSc1cccc[n]1 Amb24070203 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.17 C#C\C=C\c1ccccc1 Amb25146407 [0,0,0,0,0,0|1,0,3]=4 31 B10R1.17 C=C/C=C/c1ccccc1 Amb17938988 [0,0,0,0,0,0|1,0,3]=4 32 B10R1.17 C=C=CCc1cccc[n]1 Amb24649907 [0,0,0,0,0,0|2,0,2]=4 33 B10R1.17 C=C=COc1ccccc1 Amb17673264 [0,0,0,0,0,0|2,0,2]=4 34 B10R1.17 C=CC#Cc1ccccc1 Amb25696607 [0,0,0,0,0,0|1,0,3]=4 35 B10R1.17 C=CCCc1c[n]ccc1 Amb24477186 [0,0,0,0,0,0|2,0,1]=3 36 B10R1.17 C=CCCc1cc[n]cc1 Amb25719590 [0,0,0,0,0,0|2,0,1]=3 37 B10R1.17 C=CCCc1cccc[n]1 Amb25337662 [0,0,0,0,0,0|2,0,1]=3 38 B10R1.17 C=CCNc1cc[n]cc1 Amb18986519 [0,0,0,0,0,0|3,0,1]=4 39 B10R1.17 C=CCOc1cc[n]cc1 Amb25234559 [0,0,0,0,0,0|3,0,1]=4 40 B10R1.17 C=CCSc1cc[n]cc1 Amb25725359 [0,0,0,0,0,0|3,0,1]=4 41 B10R1.17 C=CC[Se]c1cccc[n]1 Amb24101157 [0,0,0,0,0,0|3,0,1]=4 42 B10R1.17 C=CC[Se]c1ccccc1 Amb22729991 [0,0,0,0,0,0|2,0,1]=3 43 B10R1.17 C=CNCc1ccccc1 Amb24505107 [0,0,0,0,0,0|2,0,1]=3 44 B10R1.17 C=COCc1ccccc1 Amb17940722 [0,0,0,0,0,0|2,0,1]=3 45 B10R1.17 C=NOCc1ccccc1 Amb24704253 [0,0,0,0,0,0|3,0,0]=3 46 B10R1.17 CC#COc1ccccc1 Amb25146348 [0,0,0,0,0,0|2,0,2]=4 47 B10R1.17 CC/C=C/c1ccccc1 Amb17673826 [0,0,0,0,0,0|1,0,2]=3 48 B10R1.17 CCC#Cc1c[n]ccc1 Amb24085891 [0,0,0,0,0,0|2,0,2]=4 49 B10R1.17 CCC#Cc1cccc[n]1 Amb24069949 [0,0,0,0,0,0|2,0,2]=4 50 B10R1.17 CCC=Cc1c[n]ccc1 Amb24085334 [0,0,0,0,0,0|2,0,2]=4 51 B10R1.17 CCCCC1C=CC=CN1 Amb25721630 [0,0,0,0,0,0|2,0,1]=3 52 B10R1.17 CCCCc1[n]ccc[n]1 Amb24104101 [0,0,0,0,0,0|3,0,0]=3 53 B10R1.17 CCCCc1c[n]c[n]c1 Amb24071084 [0,0,0,0,0,0|3,0,0]=3 54 B10R1.17 CCCCc1cc[n]c[n]1 Amb24091332 [0,0,0,0,0,0|3,0,0]=3 55 B10R1.17 CCCCc1ccc[n][n]1 Amb22235740 [0,0,0,0,0,0|3,0,0]=3 56 B10R1.17 CCCCc1ccccn1 Amb10574134 [0,0,0,0,0,0|2,0,0]=2 57 B10R1.17 CCCCc1ccncc1 Amb10555008 [0,0,0,0,0,0|2,0,0]=2 58 B10R1.17 CCCNc1c[n][n]cc1 Amb23559651 [0,0,0,0,0,0|4,0,0]=4 59 B10R1.17 CCCNc1cc[n]c[n]1 Amb18973881 [0,0,0,0,0,0|4,0,0]=4 60 B10R1.17 CCCNc1ccc[n][n]1 Amb18991535 [0,0,0,0,0,0|4,0,0]=4 61 B10R1.17 CCCNc1ccccc1 Amb22284540 [0,0,0,0,0,0|2,0,0]=2 62 B10R1.17 CCCOc1[n]ccc[n]1 Amb24084957 [0,0,0,0,0,0|4,0,0]=4 63 B10R1.17 CCCOc1c[n]cc[n]1 Amb24061285 [0,0,0,0,0,0|4,0,0]=4 64 B10R1.17 CCCOc1c[n]ccc1 Amb25064833 [0,0,0,0,0,0|3,0,0]=3 65 B10R1.17 CCCOc1cc[n]c[n]1 Amb24070634 [0,0,0,0,0,0|4,0,0]=4 66 B10R1.17 CCCOc1ccc[n][n]1 Amb24062248 [0,0,0,0,0,0|4,0,0]=4 67 B10R1.17 CCCOc1cccc[n]1 Amb24096899 [0,0,0,0,0,0|3,0,0]=3 68 B10R1.17 CCCSc1cc[n]c[n]1 Amb24454548 [0,0,0,0,0,0|4,0,0]=4 69 B10R1.17 CCCSc1ccc[n][n]1 Amb25098258 [0,0,0,0,0,0|4,0,0]=4 70 B10R1.17 CCCSc1cccc[n]1 Amb24733306 [0,0,0,0,0,0|3,0,0]=3 71 B10R1.17 CCN=Cc1ccccc1 Amb15692852 [0,0,0,0,0,0|2,0,1]=3 72 B10R1.17 CCNCc1[n]ccc[n]1 Amb18300295 [0,0,0,0,0,0|4,0,0]=4 73 B10R1.17 CCNCc1c[n]c[n]c1 Amb18300013 [0,0,0,0,0,0|4,0,0]=4 74 B10R1.17 CCNCc1c[n]ccc1 Amb21972163 [0,0,0,0,0,0|3,0,0]=3 75 B10R1.17 CCNCc1cc[n]c[n]1 Amb18300830 [0,0,0,0,0,0|4,0,0]=4 76 B10R1.17 CCNCc1ccc[n][n]1 Amb24477246 [0,0,0,0,0,0|4,0,0]=4 77 B10R1.17 CCNCc1ccncc1 Amb1214646 [0,0,0,0,0,0|3,0,0]=3 78 B10R1.17 CCOCc1c[n]c[n]c1 Amb24070812 [0,0,0,0,0,0|4,0,0]=4 79 B10R1.17 CCOCc1ccc[n][n]1 Amb25253318 [0,0,0,0,0,0|4,0,0]=4 80 B10R1.17 CCONc1cccc[n]1 Amb25307411 [0,0,0,0,0,0|4,0,0]=4 81 B10R1.17 CCSCc1c[n]cc[n]1 Amb24609247 [0,0,0,0,0,0|4,0,0]=4 82 B10R1.17 CC\C=C/c1c[n]ccc1 Amb24602371 [0,0,0,0,0,0|2,0,2]=4 83 B10R1.17 CC\C=C/c1cc[n]cc1 Amb25831273 [0,0,0,0,0,0|2,0,2]=4 84 B10R1.17 CC\C=C\c1cc[n]cc1 Amb25379243 [0,0,0,0,0,0|2,0,2]=4 85 B10R1.17 CC\C=C\c1cccc[n]1 Amb22170387 [0,0,0,0,0,0|2,0,2]=4 86 B10R1.17 CC\N=C/c1c[n]ccc1 Amb24068896 [0,0,0,0,0,0|3,0,1]=4 87 B10R1.17 CC\N=C/c1cc[n]cc1 Amb25808022 [0,0,0,0,0,0|3,0,1]=4 88 B10R1.17 CC\N=C\c1cccc[n]1 Amb24585676 [0,0,0,0,0,0|3,0,1]=4 89 B10R1.17 CC\N=C\c1ccccc1 Amb10558476 [0,0,0,0,0,0|2,0,1]=3 90 B10R1.17 CN/N=C/c1ccccc1 Amb17867553 [0,0,0,0,0,0|3,0,1]=4 91 B10R1.17 CN=C=Nc1ccccc1 Amb24096797 [0,0,0,0,0,0|3,0,1]=4 92 B10R1.17 CNCCc1c[n]cc[n]1 Amb22059364 [0,0,0,0,0,0|4,0,0]=4 93 B10R1.17 CNCCc1cc[n]cc1 Amb19958269 [0,0,0,0,0,0|3,0,0]=3 94 B10R1.17 CNCCc1cccc[n]1 Amb22167479 [0,0,0,0,0,0|3,0,0]=3 95 B10R1.17 CNCCc1ccccc1 Amb1132990 [0,0,0,0,0,0|2,0,0]=2 96 B10R1.17 CNCCc1ccccc1 Amb2119452 [0,0,0,0,0,0|2,0,0]=2 97 B10R1.17 CNCCc1ccccn1 Amb1651624 [0,0,0,0,0,0|3,0,0]=3 98 B10R1.17 CNCCc1cccnc1 Amb10068754 [0,0,0,0,0,0|3,0,0]=3 99 B10R1.17 CNCCc1cccnc1 Amb10576212 [0,0,0,0,0,0|3,0,0]=3 100 B10R1.17 CNCCc1cccnc1 Amb10576410 [0,0,0,0,0,0|3,0,0]=3 101 B10R1.17 CNCCc1ccncc1 Amb10071184 [0,0,0,0,0,0|3,0,0]=3 102 B10R1.17 CNNCc1c[n]ccc1 Amb24558769 [0,0,0,0,0,0|4,0,0]=4 103 B10R1.17 CNNCc1ccccc1 Amb10553073 [0,0,0,0,0,0|3,0,0]=3 104 B10R1.17 CNOCc1ccccc1 Amb22059601 [0,0,0,0,0,0|3,0,0]=3 105 B10R1.17 CN\C=N\c1ccccc1 Amb25348617 [0,0,0,0,0,0|3,0,1]=4 106 B10R1.17 CN\N=N\c1ccccc1 Amb25720206 [0,0,0,0,0,0|4,0,0]=4 107 B10R1.17 COCCN1CC=CC=C1 Amb24064033 [0,0,0,0,0,0|3,0,1]=4 108 B10R1.17 COCC[n+]1ccccc1 Amb10554471 [0,0,0,0,0,0|3,0,0]=3 109 B10R1.17 COCCc1cccc[n]1 Amb24089662 [0,0,0,0,0,0|3,0,0]=3 110 B10R1.17 COCNc1ccccc1 Amb10565397 [0,0,0,0,0,0|3,0,0]=3 111 B10R1.17 COCOc1cccnc1 Amb10561791 [0,0,0,0,0,0|4,0,0]=4 112 B10R1.17 COCSc1cc[n]cc1 Amb25185189 [0,0,0,0,0,0|4,0,0]=4 113 B10R1.17 COCSc1cccc[n]1 Amb24482838 [0,0,0,0,0,0|4,0,0]=4 114 B10R1.17 CON=Cc1ccccc1 Amb22896936 [0,0,0,0,0,0|3,0,1]=4 115 B10R1.17 CONCc1c[n]ccc1 Amb24062508 [0,0,0,0,0,0|4,0,0]=4 116 B10R1.17 CONCc1cc[n]cc1 Amb25046027 [0,0,0,0,0,0|4,0,0]=4 117 B10R1.17 CONCc1cccc[n]1 Amb25723329 [0,0,0,0,0,0|4,0,0]=4 118 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [0,0,0,0,0,0|2,0,2]=4 119 B10R1.17 CO\N=C\c1ccccc1 Amb25762975 [0,0,0,0,0,0|3,0,1]=4 120 B10R1.17 CSCCc1cccc[n]1 Amb24552366 [0,0,0,0,0,0|3,0,0]=3 121 B10R1.17 CSCCc1ccncc1 Amb1864660 [0,0,0,0,0,0|3,0,0]=3 122 B10R1.17 CSCOc1ccccc1 Amb22231357 [0,0,0,0,0,0|3,0,0]=3 123 B10R1.17 CSCSc1cccc[n]1 Amb24658343 [0,0,0,0,0,0|4,0,0]=4 124 B10R1.17 CSCSc1ccccc1 Amb25162526 [0,0,0,0,0,0|3,0,0]=3 125 B10R1.17 CSSCc1ccccc1 Amb22230274 [0,0,0,0,0,0|3,0,0]=3 126 B10R1.17 C\C=C\C[n+]1ccccc1 Amb24464480 [0,0,0,0,0,0|2,0,2]=4 127 B10R1.17 C\C=C\Oc1ccccc1 Amb10564701 [0,0,0,0,0,0|2,0,2]=4 128 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [0,0,0,0,0,0|2,0,2]=4 129 B10R1.17 C\C=N\Cc1cc[n]cc1 Amb25243601 [0,0,0,0,0,0|3,0,1]=4 130 B10R1.17 ClC=C=Cc1ccccc1 Amb17670635 [0,0,0,0,0,0|1,0,3]=4 131 B10R1.17 ClC=CCc1ccccc1 Amb24093913 [0,0,0,0,0,0|1,0,2]=3 132 B10R1.17 ClCC#Cc1c[n]ccc1 Amb18791489 [0,0,0,0,0,0|2,0,2]=4 133 B10R1.17 ClCC#Cc1cc[n]cc1 Amb25047964 [0,0,0,0,0,0|2,0,2]=4 134 B10R1.17 ClCC#Cc1ccccc1 Amb17772264 [0,0,0,0,0,0|1,0,2]=3 135 B10R1.17 ClCC=Cc1c[n]ccc1 Amb24082988 [0,0,0,0,0,0|2,0,2]=4 136 B10R1.17 ClCCC[n+]1ccccc1 Amb24487853 [0,0,0,0,0,0|2,0,0]=2 137 B10R1.17 ClCCCc1[n]ccc[n]1 Amb24657327 [0,0,0,0,0,0|3,0,0]=3 138 B10R1.17 ClCCCc1cc[n]cc1 Amb21961566 [0,0,0,0,0,0|2,0,0]=2 139 B10R1.17 ClCCCc1ccccn1 Amb17477793 [0,0,0,0,0,0|2,0,0]=2 140 B10R1.17 ClCCCc1cccnc1 Amb17477795 [0,0,0,0,0,0|2,0,0]=2 141 B10R1.17 ClCCCc1ccncc1 Amb17477794 [0,0,0,0,0,0|2,0,0]=2 142 B10R1.17 ClCCNc1c[n]cc[n]1 Amb25256817 [0,0,0,0,0,0|4,0,0]=4 143 B10R1.17 ClCCNc1ccc[n][n]1 Amb25740858 [0,0,0,0,0,0|4,0,0]=4 144 B10R1.17 ClCCNc1ccccc1 Amb17334388 [0,0,0,0,0,0|2,0,0]=2 145 B10R1.17 ClCCOc1c[n]ccc1 Amb19878080 [0,0,0,0,0,0|3,0,0]=3 146 B10R1.17 ClCCOc1c[n]ccc1 Amb22052586 [0,0,0,0,0,0|3,0,0]=3 147 B10R1.17 ClCCOc1cccc[n]1 Amb25098766 [0,0,0,0,0,0|3,0,0]=3 148 B10R1.17 ClCCPc1ccccc1 Amb24390336 [0,0,0,0,0,0|2,0,0]=2 149 B10R1.17 ClCCSc1cc[n]c[n]1 Amb18177992 [0,0,0,0,0,0|4,0,0]=4 150 B10R1.17 ClCCSc1ccc[n][n]1 Amb18185675 [0,0,0,0,0,0|4,0,0]=4 151 B10R1.17 ClCSCc1ccccc1 Amb16231183 [0,0,0,0,0,0|2,0,0]=2 152 B10R1.17 ClC[SiH2]Cc1ccccc1 Amb24433498 [0,0,0,0,0,0|1,1,0]=2 153 B10R1.17 ClC\C=C/c1c[n]ccc1 Amb24567985 [0,0,0,0,0,0|2,0,2]=4 154 B10R1.17 ClC\C=C\c1cccc[n]1 Amb24353572 [0,0,0,0,0,0|2,0,2]=4 155 B10R1.17 Cl[Mg]CCc1ccccc1 Amb22338391 [0,0,0,0,0,0|2,0,0]=2 156 B10R1.17 Cl\C=C\C[n+]1ccccc1 Amb24396864 [0,0,0,0,0,0|2,0,2]=4 157 B10R1.17 Cl\C=C\Cc1cc[n]cc1 Amb24697784 [0,0,0,0,0,0|2,0,2]=4 158 B10R1.17 Cl\C=C\Cc1ccccc1 Amb24384369 [0,0,0,0,0,0|1,0,2]=3 159 B10R1.17 FCC#Cc1ccccc1 Amb24586400 [0,0,0,0,0,0|1,0,2]=3 160 B10R1.17 FCCCc1ccccc1 Amb25737014 [0,0,0,0,0,0|1,0,0]=1 161 B10R1.17 FCCNc1c[n]ccc1 Amb24062313 [0,0,0,0,0,0|3,0,0]=3 162 B10R1.17 FCCNc1cc[n]cc1 Amb24099520 [0,0,0,0,0,0|3,0,0]=3 163 B10R1.17 FCCNc1cccc[n]1 Amb24509379 [0,0,0,0,0,0|3,0,0]=3 164 B10R1.17 FCCOc1c[n]ccc1 Amb24750081 [0,0,0,0,0,0|3,0,0]=3 165 B10R1.17 FCCOc1cccc[n]1 Amb24349895 [0,0,0,0,0,0|3,0,0]=3 166 B10R1.17 FCCOc1ccccc1 Amb25350055 [0,0,0,0,0,0|2,0,0]=2 167 B10R1.17 FCCSc1cc[n]c[n]1 Amb24574252 [0,0,0,0,0,0|4,0,0]=4 168 B10R1.17 ICCCc1ccccc1 Amb10605506 [0,0,0,0,0,0|1,0,0]=1 169 B10R1.17 ICCOc1ccccc1 Amb10608588 [0,0,0,0,0,0|2,0,0]=2 170 B10R1.17 ICCSc1[n]ccc[n]1 Amb24540162 [0,0,0,0,0,0|4,0,0]=4 171 B10R1.17 N#CC#Cc1ccccc1 Amb17593333 [0,0,0,0,0,0|1,0,3]=4 172 B10R1.17 N#CCCc1c[n]cc[n]1 Amb25830701 [0,0,0,0,0,0|3,0,1]=4 173 B10R1.17 N#CCCc1ccccn1 Amb1102488 [0,0,0,0,0,0|2,0,1]=3 174 B10R1.17 N#CCCc1cccnc1 Amb10605345 [0,0,0,0,0,0|2,0,1]=3 175 B10R1.17 N#CCNc1c[n]ccc1 Amb25757230 [0,0,0,0,0,0|3,0,1]=4 176 B10R1.17 N#CCNc1cccc[n]1 Amb22052191 [0,0,0,0,0,0|3,0,1]=4 177 B10R1.17 N#CCNc1ccccc1 Amb1651088 [0,0,0,0,0,0|2,0,1]=3 178 B10R1.17 N#CCOc1ccccn1 Amb2459771 [0,0,0,0,0,0|3,0,1]=4 179 B10R1.17 N#CCOc1cccnc1 Amb17399827 [0,0,0,0,0,0|3,0,1]=4 180 B10R1.17 N#CCSc1cc[n]cc1 Amb25725230 [0,0,0,0,0,0|3,0,1]=4 181 B10R1.17 N#CCSc1ccccn1 Amb2496389 [0,0,0,0,0,0|3,0,1]=4 182 B10R1.17 N#CNCc1cccnc1 Amb16186969 [0,0,0,0,0,0|3,0,1]=4 183 B10R1.17 N#CSCc1cc[n]cc1 Amb24596154 [0,0,0,0,0,0|3,0,1]=4 184 B10R1.17 N#C[Se]Cc1ccccc1 Amb22731764 [0,0,0,0,0,0|2,0,1]=3 185 B10R1.17 N#C\C=C\c1ccccc1 Amb1678044 [0,0,0,0,0,0|1,0,3]=4 186 B10R1.17 N=COCc1ccccc1 Amb22269902 [0,0,0,0,0,0|2,0,1]=3 187 B10R1.17 N=COCc1ccccc1 Amb24652885 [0,0,0,0,0,0|2,0,1]=3 188 B10R1.17 NCC#Cc1c[n]ccc1 Amb18281095 [0,0,0,0,0,0|2,0,2]=4 189 B10R1.17 NCC#Cc1cccc[n]1 Amb20668332 [0,0,0,0,0,0|2,0,2]=4 190 B10R1.17 NCC#Cc1ccccc1 Amb1239477 [0,0,0,0,0,0|1,0,2]=3 191 B10R1.17 NCC#Cc1ccccc1 Amb2371766 [0,0,0,0,0,0|1,0,2]=3 192 B10R1.17 NCCCc1[n][n]cc[n]1 Amb18203026 [0,0,0,0,0,0|4,0,0]=4 193 B10R1.17 NCCCc1[n]c[n]c[n]1 Amb18224126 [0,0,0,0,0,0|4,0,0]=4 194 B10R1.17 NCCCc1[n]ccc[n]1 Amb18064230 [0,0,0,0,0,0|3,0,0]=3 195 B10R1.17 NCCCc1c[n][n]cc1 Amb23559549 [0,0,0,0,0,0|3,0,0]=3 196 B10R1.17 NCCCc1c[n]c[n]c1 Amb22751643 [0,0,0,0,0,0|3,0,0]=3 197 B10R1.17 NCCCc1c[n]cc[n]1 Amb18832322 [0,0,0,0,0,0|3,0,0]=3 198 B10R1.17 NCCCc1c[n]cc[n]1 Amb20622876 [0,0,0,0,0,0|3,0,0]=3 199 B10R1.17 NCCCc1c[n]ccc1 Amb18363942 [0,0,0,0,0,0|2,0,0]=2 200 B10R1.17 NCCCc1cc[n]c[n]1 Amb18981848 [0,0,0,0,0,0|3,0,0]=3 201 B10R1.17 NCCCc1cc[n]cc1 Amb22490382 [0,0,0,0,0,0|2,0,0]=2 202 B10R1.17 NCCCc1cc[n]cc1 Amb24099592 [0,0,0,0,0,0|2,0,0]=2 203 B10R1.17 NCCCc1ccc[n][n]1 Amb25031583 [0,0,0,0,0,0|3,0,0]=3 204 B10R1.17 NCCCc1cccc[n]1 Amb21954278 [0,0,0,0,0,0|2,0,0]=2 205 B10R1.17 NCCCc1ccccc1 Amb22490482 [0,0,0,0,0,0|1,0,0]=1 206 B10R1.17 NCCCc1ccccn1 Amb1088884 [0,0,0,0,0,0|2,0,0]=2 207 B10R1.17 NCCNc1c[n][n]cc1 Amb25290327 [0,0,0,0,0,0|4,0,0]=4 208 B10R1.17 NCCNc1c[n]c[n]c1 Amb18298014 [0,0,0,0,0,0|4,0,0]=4 209 B10R1.17 NCCNc1cc[n]c[n]1 Amb18973879 [0,0,0,0,0,0|4,0,0]=4 210 B10R1.17 NCCNc1cc[n]cc1 Amb19887545 [0,0,0,0,0,0|3,0,0]=3 211 B10R1.17 NCCNc1ccc[n][n]1 Amb18298689 [0,0,0,0,0,0|4,0,0]=4 212 B10R1.17 NCCNc1ccccc1 Amb23412206 [0,0,0,0,0,0|2,0,0]=2 213 B10R1.17 NCCNc1ccccn1 Amb10608961 [0,0,0,0,0,0|3,0,0]=3 214 B10R1.17 NCCNc1ccccn1 Amb1154294 [0,0,0,0,0,0|3,0,0]=3 215 B10R1.17 NCCNc1cccnc1 Amb10607840 [0,0,0,0,0,0|3,0,0]=3 216 B10R1.17 NCCNc1cnccn1 Amb1108614 [0,0,0,0,0,0|4,0,0]=4 217 B10R1.17 NCCNc1ncccn1 Amb1108055 [0,0,0,0,0,0|4,0,0]=4 218 B10R1.17 NCCNc1ncccn1 Amb15740843 [0,0,0,0,0,0|4,0,0]=4 219 B10R1.17 NCCOc1[n]ccc[n]1 Amb18292247 [0,0,0,0,0,0|4,0,0]=4 220 B10R1.17 NCCOc1c[n]cc[n]1 Amb18296473 [0,0,0,0,0,0|4,0,0]=4 221 B10R1.17 NCCOc1cc[n]c[n]1 Amb18292252 [0,0,0,0,0,0|4,0,0]=4 222 B10R1.17 NCCOc1cc[n]cc1 Amb18988858 [0,0,0,0,0,0|3,0,0]=3 223 B10R1.17 NCCOc1cc[n]cc1 Amb22728098 [0,0,0,0,0,0|3,0,0]=3 224 B10R1.17 NCCOc1cc[n]cc1 Amb24182077 [0,0,0,0,0,0|3,0,0]=3 225 B10R1.17 NCCOc1ccc[n][n]1 Amb18298723 [0,0,0,0,0,0|4,0,0]=4 226 B10R1.17 NCCOc1ccccc1 Amb1214559 [0,0,0,0,0,0|2,0,0]=2 227 B10R1.17 NCCOc1ccccc1 Amb2099529 [0,0,0,0,0,0|2,0,0]=2 228 B10R1.17 NCCOc1ccccn1 Amb2237065 [0,0,0,0,0,0|3,0,0]=3 229 B10R1.17 NCCPc1ccccc1 Amb24482461 [0,0,0,0,0,0|2,0,0]=2 230 B10R1.17 NCCSc1c[n]cc[n]1 Amb18251482 [0,0,0,0,0,0|4,0,0]=4 231 B10R1.17 NCCSc1cc[n]c[n]1 Amb18251484 [0,0,0,0,0,0|4,0,0]=4 232 B10R1.17 NCCSc1cc[n]cc1 Amb21861873 [0,0,0,0,0,0|3,0,0]=3 233 B10R1.17 NCCSc1ccccn1 Amb13949032 [0,0,0,0,0,0|3,0,0]=3 234 B10R1.17 NC\C=C/c1c[n]ccc1 Amb25349251 [0,0,0,0,0,0|2,0,2]=4 235 B10R1.17 NC\C=C/c1cc[n]cc1 Amb25295348 [0,0,0,0,0,0|2,0,2]=4 236 B10R1.17 NC\C=C/c1cccc[n]1 Amb25299216 [0,0,0,0,0,0|2,0,2]=4 237 B10R1.17 NC\C=C/c1ccccc1 Amb24746209 [0,0,0,0,0,0|1,0,2]=3 238 B10R1.17 NC\C=C\c1c[n]ccc1 Amb18063302 [0,0,0,0,0,0|2,0,2]=4 239 B10R1.17 NC\C=C\c1cc[n]cc1 Amb18062333 [0,0,0,0,0,0|2,0,2]=4 240 B10R1.17 NC\C=C\c1cccc[n]1 Amb18063261 [0,0,0,0,0,0|2,0,2]=4 241 B10R1.17 NC\C=C\c1ccccc1 Amb16187112 [0,0,0,0,0,0|1,0,2]=3 242 B10R1.17 NNC#Cc1ccccc1 Amb24443265 [0,0,0,0,0,0|2,0,2]=4 243 B10R1.17 NNCCc1c[n]ccc1 Amb22491198 [0,0,0,0,0,0|3,0,0]=3 244 B10R1.17 NNCCc1cccc[n]1 Amb20669588 [0,0,0,0,0,0|3,0,0]=3 245 B10R1.17 NNCCc1ccccc1 Amb10608987 [0,0,0,0,0,0|2,0,0]=2 246 B10R1.17 NNCCc1ccccc1 Amb1117029 [0,0,0,0,0,0|2,0,0]=2 247 B10R1.17 NOCCc1c[n]ccc1 Amb25779030 [0,0,0,0,0,0|3,0,0]=3 248 B10R1.17 NOCCc1ccccn1 Amb17231907 [0,0,0,0,0,0|3,0,0]=3 249 B10R1.17 NOCCc1ccncc1 Amb17231908 [0,0,0,0,0,0|3,0,0]=3 250 B10R1.17 O=C=NCc1cccnc1 Amb17090261 [0,0,0,0,0,0|2,0,2]=4 251 B10R1.17 O=C=NCc1ccncc1 Amb17090262 [0,0,0,0,0,0|2,0,2]=4 252 B10R1.17 O=CCCc1[n]ccc[n]1 Amb24056162 [0,0,0,0,0,0|2,0,2]=4 253 B10R1.17 O=CCCc1c[n]c[n]c1 Amb24657168 [0,0,0,0,0,0|2,0,2]=4 254 B10R1.17 O=CCCc1ccccn1 Amb17081674 [0,0,0,0,0,0|1,0,2]=3 255 B10R1.17 O=CCCc1cccnc1 Amb17081675 [0,0,0,0,0,0|1,0,2]=3 256 B10R1.17 O=CCNc1cccc[n]1 Amb24100487 [0,0,0,0,0,0|2,0,2]=4 257 B10R1.17 O=CCNc1ccccc1 Amb24566865 [0,0,0,0,0,0|1,0,2]=3 258 B10R1.17 O=CCOc1c[n]ccc1 Amb24068437 [0,0,0,0,0,0|2,0,2]=4 259 B10R1.17 O=CCOc1cc[n]cc1 Amb24068570 [0,0,0,0,0,0|2,0,2]=4 260 B10R1.17 O=CCSc1cc[n]cc1 Amb24475471 [0,0,0,0,0,0|2,0,2]=4 261 B10R1.17 O=CCSc1cccc[n]1 Amb18799459 [0,0,0,0,0,0|2,0,2]=4 262 B10R1.17 O=CCSc1ccccc1 Amb17082903 [0,0,0,0,0,0|1,0,2]=3 263 B10R1.17 O=CNCc1cccc[n]1 Amb22370826 [0,0,0,0,0,0|2,0,2]=4 264 B10R1.17 O=CNCc1ccccc1 Amb1916036 [0,0,0,0,0,0|1,0,2]=3 265 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [0,0,0,0,0,0|0,0,4]=4 266 B10R1.17 O=C\C=N\c1ccccc1 Amb24561719 [0,0,0,0,0,0|1,0,3]=4 267 B10R1.17 O=NC#Cc1ccccc1 Amb24068843 [0,0,0,0,0,0|1,0,3]=4 268 B10R1.17 OCC#Cc1[n]ccc[n]1 Amb24068881 [0,0,0,0,0,0|2,0,2]=4 269 B10R1.17 OCC#Cc1ccccn1 Amb2227478 [0,0,0,0,0,0|1,0,2]=3 270 B10R1.17 OCC#Cc1cncnc1 Amb1086948 [0,0,0,0,0,0|2,0,2]=4 271 B10R1.17 OCCCC1=CCCCO1 Amb25758698 [0,0,0,0,0,0|1,0,3]=4 272 B10R1.17 OCCCC1C=CCCO1 Amb24379874 [0,0,0,0,0,0|1,0,3]=4 273 B10R1.17 OCCCC=1CC=CCC1 Amb22047467 [0,0,0,0,0,0|0,0,2]=2 274 B10R1.17 OCCCC=1CCSCC1 Amb24637828 [0,0,0,0,0,0|1,0,3]=4 275 B10R1.17 OCCC[C@@H]1CCCC=C1 Amb24481216 [0,0,0,0,0,0|0,0,4]=4 276 B10R1.17 OCCCc1[n]ccc[n]1 Amb22499265 [0,0,0,0,0,0|2,0,0]=2 277 B10R1.17 OCCCc1c[n][n]cc1 Amb23559794 [0,0,0,0,0,0|2,0,0]=2 278 B10R1.17 OCCCc1c[n]c[n]c1 Amb24063145 [0,0,0,0,0,0|2,0,0]=2 279 B10R1.17 OCCCc1c[n]cc[n]1 Amb22499266 [0,0,0,0,0,0|2,0,0]=2 280 B10R1.17 OCCCc1cc[n]c[n]1 Amb24099660 [0,0,0,0,0,0|2,0,0]=2 281 B10R1.17 OCCCc1cccc[n]1 Amb22749323 [0,0,0,0,0,0|1,0,0]=1 282 B10R1.17 OCCNc1c[n]c[n]c1 Amb18270517 [0,0,0,0,0,0|3,0,0]=3 283 B10R1.17 OCCNc1c[n]ccc1 Amb18266115 [0,0,0,0,0,0|2,0,0]=2 284 B10R1.17 OCCNc1cc[n]c[n]1 Amb18973688 [0,0,0,0,0,0|3,0,0]=3 285 B10R1.17 OCCNc1ccc[n][n]1 Amb18298692 [0,0,0,0,0,0|3,0,0]=3 286 B10R1.17 OCCNc1ccccc1 Amb24065196 [0,0,0,0,0,0|1,0,0]=1 287 B10R1.17 OCCNc1ccccc1 Amb24065197 [0,0,0,0,0,0|1,0,0]=1 288 B10R1.17 OCCNc1ccccn1 Amb10809152 [0,0,0,0,0,0|2,0,0]=2 289 B10R1.17 OCCOc1c[n]c[n]c1 Amb24095083 [0,0,0,0,0,0|3,0,0]=3 290 B10R1.17 OCCOc1c[n]ccc1 Amb19333986 [0,0,0,0,0,0|2,0,0]=2 291 B10R1.17 OCCOc1ccc[n][n]1 Amb24728293 [0,0,0,0,0,0|3,0,0]=3 292 B10R1.17 OCCOc1cccc[n]1 Amb23598433 [0,0,0,0,0,0|2,0,0]=2 293 B10R1.17 OCCOc1ccccc1 Amb2209344 [0,0,0,0,0,0|1,0,0]=1 294 B10R1.17 OCCOc1ccncc1 Amb10552812 [0,0,0,0,0,0|2,0,0]=2 295 B10R1.17 OCCSc1c[n]ccc1 Amb25343843 [0,0,0,0,0,0|2,0,0]=2 296 B10R1.17 OCCSc1cc[n]c[n]1 Amb18787627 [0,0,0,0,0,0|3,0,0]=3 297 B10R1.17 OCCSc1ccc[n][n]1 Amb18799688 [0,0,0,0,0,0|3,0,0]=3 298 B10R1.17 OCNCc1ccccc1 Amb24756521 [0,0,0,0,0,0|1,0,0]=1 299 B10R1.17 OCOCc1ccccc1 Amb25727798 [0,0,0,0,0,0|1,0,0]=1 300 B10R1.17 OC\C=C\c1cc[n]cc1 Amb22749186 [0,0,0,0,0,0|1,0,2]=3 301 B10R1.17 OC\C=C\c1cccc[n]1 Amb22749315 [0,0,0,0,0,0|1,0,2]=3 302 B10R1.17 OC\C=C\c1cccnc1 Amb17619713 [0,0,0,0,0,0|1,0,2]=3 303 B10R1.17 OC\C=N\c1ccccc1 Amb25740591 [0,0,0,0,0,0|1,0,1]=2 304 B10R1.17 OC\N=C\c1ccccc1 Amb25105990 [0,0,0,0,0,0|1,0,1]=2 305 B10R1.17 ONCCc1ccccc1 Amb24117032 [0,0,0,0,0,0|1,0,0]=1 306 B10R1.17 O\N=C\Cc1cc[n]c[n]1 Amb24559505 [0,0,0,0,0,0|3,0,1]=4 307 B10R1.17 S=C=CNc1ccccc1 Amb25728146 [0,0,0,0,0,0|1,1,2]=4 308 B10R1.17 S=C=NCc1ccccc1 Amb1102095 [0,0,0,0,0,0|1,1,1]=3 309 B10R1.17 S=C=NCc1cccnc1 Amb1107163 [0,0,0,0,0,0|2,1,1]=4 310 B10R1.17 SCCCc1ccccn1 Amb17399950 [0,0,0,0,0,0|1,1,0]=2 311 B10R1.17 SCCCc1cccnc1 Amb17399951 [0,0,0,0,0,0|1,1,0]=2 312 B10R1.17 SCCCc1ccncc1 Amb17399952 [0,0,0,0,0,0|1,1,0]=2 313 B10R1.17 SCCNc1[n]ccc[n]1 Amb24509517 [0,0,0,0,0,0|3,1,0]=4 314 B10R1.17 SCCNc1c[n]c[n]c1 Amb24095074 [0,0,0,0,0,0|3,1,0]=4 315 B10R1.17 SCCNc1cccc[n]1 Amb24340493 [0,0,0,0,0,0|2,1,0]=3 316 B10R1.17 SCCNc1ccccc1 Amb24065195 [0,0,0,0,0,0|1,1,0]=2 317 B10R1.17 SCCOc1c[n]ccc1 Amb25741157 [0,0,0,0,0,0|2,1,0]=3 318 B10R1.17 SCCSc1c[n]cc[n]1 Amb24340187 [0,0,0,0,0,0|3,1,0]=4 319 B10R1.17 SCCSc1ccccc1 Amb13881734 [0,0,0,0,0,0|1,1,0]=2 320 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [0,0,0,0,0,0|2,0,0]=2 321 B10R1.17 [C-]#[N+]CCc1ccncc1 Amb2235948 [0,0,0,0,0,0|3,0,0]=3 322 B10R1.17 [N-]=[N+]=NCc1cc[n]cc1 Amb19373643 [0,0,0,0,0,0|4,0,0]=4 323 B10R1.17 [N-]=[N+]=NCc1ccccn1 Amb10608487 [0,0,0,0,0,0|4,0,0]=4 324 B10R1.17 [N-]=[N+]=NCc1cccnc1 Amb10608488 [0,0,0,0,0,0|4,0,0]=4 325 B10R1.17 [NH-]\[NH+]=N\Cc1ccccc1 Amb25857928 [0,0,0,0,0,0|3,0,0]=3 326 B10R1.17 [NH3+]CC#Cc1ccccc1 Amb10555899 [0,0,0,0,0,0|1,0,2]=3 327 B10R1.17 [SiH3]CCCc1c[n]ccc1 Amb24085247 [0,0,0,0,0,0|2,0,0]=2 328 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [0,0,0,0,0,0|1,0,0]=1 329 B9R1.8 BOCc1cccc[n]1 Amb24406683 [1,0,0,0,0,0|3,0,0]=4 330 B9R1.8 BrC#Cc1ccccc1 Amb16233213 [1,0,0,0,0,0|1,0,2]=4 331 B9R1.8 BrCCc1c[n]c[n]c1 Amb18327370 [1,0,0,0,0,0|3,0,0]=4 332 B9R1.8 BrCCc1c[n]cc[n]1 Amb24652166 [1,0,0,0,0,0|3,0,0]=4 333 B9R1.8 BrCCc1c[n]ccc1 Amb19069960 [1,0,0,0,0,0|2,0,0]=3 334 B9R1.8 BrCCc1c[n]ccc1 Amb19372982 [1,0,0,0,0,0|2,0,0]=3 335 B9R1.8 BrCCc1cc[n]c[n]1 Amb25681855 [1,0,0,0,0,0|3,0,0]=4 336 B9R1.8 BrCCc1cc[n]cc1 Amb18326675 [1,0,0,0,0,0|2,0,0]=3 337 B9R1.8 BrCCc1ccccn1 Amb1102303 [1,0,0,0,0,0|2,0,0]=3 338 B9R1.8 BrCCc1ccccn1 Amb17935743 [1,0,0,0,0,0|2,0,0]=3 339 B9R1.8 BrCNc1ccccc1 Amb25758335 [1,0,0,0,0,0|2,0,0]=3 340 B9R1.8 Br[Mg]Cc1ccccc1 Amb20240676 [1,0,0,0,0,0|2,0,0]=3 341 B9R1.8 Br[Zn]Cc1ccccc1 Amb22000396 [1,0,0,0,0,0|2,0,0]=3 342 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [1,0,0,0,0,0|1,0,2]=4 343 B9R1.8 C#CC[n+]1ccccc1 Amb2227878 [1,0,0,0,0,0|1,0,2]=4 344 B9R1.8 C#CCc1cc[n]cc1 Amb24478677 [1,0,0,0,0,0|1,0,2]=4 345 B9R1.8 C#CCc1cccc[n]1 Amb25759001 [1,0,0,0,0,0|1,0,2]=4 346 B9R1.8 C#CSc1ccccc1 Amb17940373 [1,0,0,0,0,0|1,0,2]=4 347 B9R1.8 C#C[I+]c1ccccc1 Amb19883870 [1,0,0,0,0,0|1,0,2]=4 348 B9R1.8 C=CC[n+]1ccccc1 Amb10554482 [1,0,0,0,0,0|1,0,2]=4 349 B9R1.8 C=CC[n+]1ccccc1 Amb10573243 [1,0,0,0,0,0|1,0,2]=4 350 B9R1.8 C=CCc1c[n]ccc1 Amb24477831 [1,0,0,0,0,0|1,0,2]=4 351 B9R1.8 C=CNc1ccccc1 Amb24476658 [1,0,0,0,0,0|1,0,2]=4 352 B9R1.8 C=COc1ccccc1 Amb10564213 [1,0,0,0,0,0|1,0,2]=4 353 B9R1.8 C=NCc1c[n]ccc1 Amb24062506 [1,0,0,0,0,0|2,0,1]=4 354 B9R1.8 CC#Cc1c[n]ccc1 Amb24085144 [1,0,0,0,0,0|1,0,2]=4 355 B9R1.8 CC#Cc1cccc[n]1 Amb25147069 [1,0,0,0,0,0|1,0,2]=4 356 B9R1.8 CCC[n+]1ccccc1 Amb24325390 [1,0,0,0,0,0|1,0,0]=2 357 B9R1.8 CCCc1[n]ccc[n]1 Amb24084965 [1,0,0,0,0,0|2,0,0]=3 358 B9R1.8 CCCc1c[n]c[n]c1 Amb24071652 [1,0,0,0,0,0|2,0,0]=3 359 B9R1.8 CCCc1cc[n]c[n]1 Amb24070638 [1,0,0,0,0,0|2,0,0]=3 360 B9R1.8 CCCc1ccc[n][n]1 Amb24447402 [1,0,0,0,0,0|2,0,0]=3 361 B9R1.8 CCCc1ccccc1 Amb2447143 [1,0,0,0,0,0|0,0,0]=1 362 B9R1.8 CCNc1c[n][n]cc1 Amb23559704 [1,0,0,0,0,0|3,0,0]=4 363 B9R1.8 CCNc1c[n]c[n]c1 Amb18270553 [1,0,0,0,0,0|3,0,0]=4 364 B9R1.8 CCNc1cc[n]c[n]1 Amb18282107 [1,0,0,0,0,0|3,0,0]=4 365 B9R1.8 CCNc1ccc[n][n]1 Amb18286130 [1,0,0,0,0,0|3,0,0]=4 366 B9R1.8 CCNc1ccccc1 Amb22731692 [1,0,0,0,0,0|1,0,0]=2 367 B9R1.8 CCOc1[n]ccc[n]1 Amb22498694 [1,0,0,0,0,0|3,0,0]=4 368 B9R1.8 CCOc1c[n][n]cc1 Amb22500251 [1,0,0,0,0,0|3,0,0]=4 369 B9R1.8 CCOc1c[n]c[n]c1 Amb23412498 [1,0,0,0,0,0|3,0,0]=4 370 B9R1.8 CCOc1cc[n]c[n]1 Amb24091512 [1,0,0,0,0,0|3,0,0]=4 371 B9R1.8 CCOc1ccc[n][n]1 Amb19958352 [1,0,0,0,0,0|3,0,0]=4 372 B9R1.8 CCOc1cccnc1 Amb10573342 [1,0,0,0,0,0|2,0,0]=3 373 B9R1.8 CCSc1c[n]c[n]c1 Amb24070802 [1,0,0,0,0,0|3,0,0]=4 374 B9R1.8 CCSc1cc[n]c[n]1 Amb24102978 [1,0,0,0,0,0|3,0,0]=4 375 B9R1.8 CCSc1ccc[n][n]1 Amb24462843 [1,0,0,0,0,0|3,0,0]=4 376 B9R1.8 CNCc1[n]ccc[n]1 Amb22886406 [1,0,0,0,0,0|3,0,0]=4 377 B9R1.8 CNCc1c[n][n]cc1 Amb24183593 [1,0,0,0,0,0|3,0,0]=4 378 B9R1.8 CNCc1c[n]cc[n]1 Amb21959600 [1,0,0,0,0,0|3,0,0]=4 379 B9R1.8 CNCc1c[n]cc[n]1 Amb22498352 [1,0,0,0,0,0|3,0,0]=4 380 B9R1.8 CNCc1cc[n]c[n]1 Amb21962059 [1,0,0,0,0,0|3,0,0]=4 381 B9R1.8 CNCc1cc[n]c[n]1 Amb22587684 [1,0,0,0,0,0|3,0,0]=4 382 B9R1.8 CNCc1ccccn1 Amb10068750 [1,0,0,0,0,0|2,0,0]=3 383 B9R1.8 CNCc1ccccn1 Amb10576408 [1,0,0,0,0,0|2,0,0]=3 384 B9R1.8 CNCc1cccnc1 Amb10066918 [1,0,0,0,0,0|2,0,0]=3 385 B9R1.8 CNCc1cccnc1 Amb10576409 [1,0,0,0,0,0|2,0,0]=3 386 B9R1.8 CNCc1cccnc1 Amb1648828 [1,0,0,0,0,0|2,0,0]=3 387 B9R1.8 CNCc1ccncc1 Amb10068773 [1,0,0,0,0,0|2,0,0]=3 388 B9R1.8 CNCc1ccncc1 Amb10576211 [1,0,0,0,0,0|2,0,0]=3 389 B9R1.8 CNCc1ccncc1 Amb1115812 [1,0,0,0,0,0|2,0,0]=3 390 B9R1.8 CNCc1cnccn1 Amb1094140 [1,0,0,0,0,0|3,0,0]=4 391 B9R1.8 CNNc1cccc[n]1 Amb25146742 [1,0,0,0,0,0|3,0,0]=4 392 B9R1.8 CNNc1ccccc1 Amb20242875 [1,0,0,0,0,0|2,0,0]=3 393 B9R1.8 CNSc1ccccc1 Amb25811332 [1,0,0,0,0,0|2,0,0]=3 394 B9R1.8 COC[n+]1ccccc1 Amb25309455 [1,0,0,0,0,0|2,0,0]=3 395 B9R1.8 COCc1c[n]cc[n]1 Amb24656513 [1,0,0,0,0,0|3,0,0]=4 396 B9R1.8 COCc1c[n]ccc1 Amb24106446 [1,0,0,0,0,0|2,0,0]=3 397 B9R1.8 COCc1cc[n]cc1 Amb24075931 [1,0,0,0,0,0|2,0,0]=3 398 B9R1.8 COCc1ccc[n][n]1 Amb25178748 [1,0,0,0,0,0|3,0,0]=4 399 B9R1.8 CONc1c[n]ccc1 Amb25347084 [1,0,0,0,0,0|3,0,0]=4 400 B9R1.8 COPc1ccccc1 Amb22729661 [1,0,0,0,0,0|2,0,0]=3 401 B9R1.8 CSCc1[n]ccc[n]1 Amb24476755 [1,0,0,0,0,0|3,0,0]=4 402 B9R1.8 CSCc1c[n]cc[n]1 Amb22490462 [1,0,0,0,0,0|3,0,0]=4 403 B9R1.8 CSCc1c[n]ccc1 Amb24523080 [1,0,0,0,0,0|2,0,0]=3 404 B9R1.8 CSNc1cccc[n]1 Amb24072693 [1,0,0,0,0,0|3,0,0]=4 405 B9R1.8 CSSc1cc[n]cc1 Amb24081959 [1,0,0,0,0,0|3,0,0]=4 406 B9R1.8 CSSc1cccc[n]1 Amb25215539 [1,0,0,0,0,0|3,0,0]=4 407 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [1,0,0,0,0,0|1,0,0]=2 408 B9R1.8 C\C=C/c1c[n]ccc1 Amb25147168 [1,0,0,0,0,0|1,0,2]=4 409 B9R1.8 C\C=C/c1cc[n]cc1 Amb25064785 [1,0,0,0,0,0|1,0,2]=4 410 B9R1.8 C\C=C\[n+]1ccccc1 Amb22485619 [1,0,0,0,0,0|1,0,2]=4 411 B9R1.8 C\C=C\c1c[n]ccc1 Amb25290985 [1,0,0,0,0,0|1,0,2]=4 412 B9R1.8 C\C=N\c1cccc[n]1 Amb24533295 [1,0,0,0,0,0|2,0,1]=4 413 B9R1.8 C\N=C/c1cccc[n]1 Amb25337459 [1,0,0,0,0,0|2,0,1]=4 414 B9R1.8 C\N=C\c1c[n]ccc1 Amb21962079 [1,0,0,0,0,0|2,0,1]=4 415 B9R1.8 C\N=C\c1cc[n]cc1 Amb22330508 [1,0,0,0,0,0|2,0,1]=4 416 B9R1.8 C\N=C\c1cccc[n]1 Amb24553183 [1,0,0,0,0,0|2,0,1]=4 417 B9R1.8 ClC#Cc1ccccc1 Amb17670521 [1,0,0,0,0,0|1,0,2]=4 418 B9R1.8 ClC=Pc1ccccc1 Amb24480023 [1,0,0,0,0,0|2,0,1]=4 419 B9R1.8 ClCCc1[n]ccc[n]1 Amb25845186 [1,0,0,0,0,0|3,0,0]=4 420 B9R1.8 ClCCc1c[n]c[n]c1 Amb24529105 [1,0,0,0,0,0|3,0,0]=4 421 B9R1.8 ClCCc1c[n]cc[n]1 Amb24477833 [1,0,0,0,0,0|3,0,0]=4 422 B9R1.8 ClCCc1c[n]ccc1 Amb20241066 [1,0,0,0,0,0|2,0,0]=3 423 B9R1.8 ClCCc1c[n]ccc1 Amb24061504 [1,0,0,0,0,0|2,0,0]=3 424 B9R1.8 ClCCc1cc[n]c[n]1 Amb25100826 [1,0,0,0,0,0|3,0,0]=4 425 B9R1.8 ClCCc1cc[n]cc1 Amb23400891 [1,0,0,0,0,0|2,0,0]=3 426 B9R1.8 ClCCc1ccc[n][n]1 Amb25373976 [1,0,0,0,0,0|3,0,0]=4 427 B9R1.8 ClCCc1cccc[n]1 Amb19892295 [1,0,0,0,0,0|2,0,0]=3 428 B9R1.8 ClCCc1ccccn1 Amb1102254 [1,0,0,0,0,0|2,0,0]=3 429 B9R1.8 ClCNc1ccccc1 Amb25836772 [1,0,0,0,0,0|2,0,0]=3 430 B9R1.8 ClCOc1c[n]ccc1 Amb25780203 [1,0,0,0,0,0|3,0,0]=4 431 B9R1.8 ClCOc1ccccc1 Amb22059503 [1,0,0,0,0,0|2,0,0]=3 432 B9R1.8 ClCPc1ccccc1 Amb25294535 [1,0,0,0,0,0|2,0,0]=3 433 B9R1.8 ClCSc1c[n]ccc1 Amb25837457 [1,0,0,0,0,0|3,0,0]=4 434 B9R1.8 ClC[SiH2]c1ccccc1 Amb22230170 [1,0,0,0,0,0|1,1,0]=3 435 B9R1.8 ClSSc1ccccc1 Amb25248198 [1,0,0,0,0,0|3,0,0]=4 436 B9R1.8 Cl[Hg]Cc1ccccc1 Amb22360147 [1,0,0,0,0,0|2,0,0]=3 437 B9R1.8 Cl[Zn]Cc1cccc[n]1 Amb22000362 [1,0,0,0,0,0|3,0,0]=4 438 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [1,0,0,0,0,0|1,0,2]=4 439 B9R1.8 Cl\C=N\c1ccccc1 Amb24710175 [1,0,0,0,0,0|2,0,1]=4 440 B9R1.8 FC#Cc1ccccc1 Amb25080554 [1,0,0,0,0,0|1,0,2]=4 441 B9R1.8 FCCc1c[n]ccc1 Amb24085191 [1,0,0,0,0,0|2,0,0]=3 442 B9R1.8 FCCc1cc[n]cc1 Amb24102730 [1,0,0,0,0,0|2,0,0]=3 443 B9R1.8 FCCc1cccc[n]1 Amb24070130 [1,0,0,0,0,0|2,0,0]=3 444 B9R1.8 FCOc1ccccc1 Amb24099991 [1,0,0,0,0,0|2,0,0]=3 445 B9R1.8 FCSc1cccc[n]1 Amb24106749 [1,0,0,0,0,0|3,0,0]=4 446 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [1,0,0,0,0,0|1,0,2]=4 447 B9R1.8 ICCc1cccc[n]1 Amb24573930 [1,0,0,0,0,0|2,0,0]=3 448 B9R1.8 I[Hg]Cc1ccccc1 Amb22347189 [1,0,0,0,0,0|2,0,0]=3 449 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [1,0,0,0,0,0|1,0,2]=4 450 B9R1.8 N#CC[n+]1ccccc1 Amb10554489 [1,0,0,0,0,0|2,0,1]=4 451 B9R1.8 N#COc1ccccc1 Amb15692860 [1,0,0,0,0,0|2,0,1]=4 452 B9R1.8 N#C[13CH2]c1ccccc1 Amb22337751 [1,0,0,0,0,0|1,0,1]=3 453 B9R1.8 N#[13C]Cc1ccccc1 Amb22363279 [1,0,0,0,0,0|1,0,1]=3 454 B9R1.8 N#[13C][13CH2]c1ccccc1 Amb22367491 [1,0,0,0,0,0|1,0,1]=3 455 B9R1.8 NCCc1[n]ccc[n]1 Amb18199432 [1,0,0,0,0,0|3,0,0]=4 456 B9R1.8 NCCc1[n]ccc[n]1 Amb23399636 [1,0,0,0,0,0|3,0,0]=4 457 B9R1.8 NCCc1[n]ccc[n]1 Amb24066982 [1,0,0,0,0,0|3,0,0]=4 458 B9R1.8 NCCc1c[n]cc[n]1 Amb22756001 [1,0,0,0,0,0|3,0,0]=4 459 B9R1.8 NCCc1c[n]cc[n]1 Amb24066949 [1,0,0,0,0,0|3,0,0]=4 460 B9R1.8 NCCc1c[n]ccc1 Amb20241523 [1,0,0,0,0,0|2,0,0]=3 461 B9R1.8 NCCc1cc[n]c[n]1 Amb22899210 [1,0,0,0,0,0|3,0,0]=4 462 B9R1.8 NCCc1cc[n]cc1 Amb20240779 [1,0,0,0,0,0|2,0,0]=3 463 B9R1.8 NCCc1ccc[n][n]1 Amb23592188 [1,0,0,0,0,0|3,0,0]=4 464 B9R1.8 NCCc1cccc[n]1 Amb24065228 [1,0,0,0,0,0|2,0,0]=3 465 B9R1.8 NCCc1cccc[n]1 Amb24066975 [1,0,0,0,0,0|2,0,0]=3 466 B9R1.8 NCCc1ccccc1 Amb17772283 [1,0,0,0,0,0|1,0,0]=2 467 B9R1.8 NCCc1ccccc1 Amb17843439 [1,0,0,0,0,0|1,0,0]=2 468 B9R1.8 NCCc1ccccc1 Amb22360716 [1,0,0,0,0,0|1,0,0]=2 469 B9R1.8 NCCc1ccccc1 Amb24325112 [1,0,0,0,0,0|1,0,0]=2 470 B9R1.8 NCCc1ccccc1 Amb24325408 [1,0,0,0,0,0|1,0,0]=2 471 B9R1.8 NCCc1ccccn1 Amb1156071 [1,0,0,0,0,0|2,0,0]=3 472 B9R1.8 NCCc1cccnc1 Amb1134784 [1,0,0,0,0,0|2,0,0]=3 473 B9R1.8 NCCc1cccnc1 Amb16230500 [1,0,0,0,0,0|2,0,0]=3 474 B9R1.8 NCCc1ccncc1 Amb1102164 [1,0,0,0,0,0|2,0,0]=3 475 B9R1.8 NCCc1cnccn1 Amb10067912 [1,0,0,0,0,0|3,0,0]=4 476 B9R1.8 NCCc1cnccn1 Amb1995199 [1,0,0,0,0,0|3,0,0]=4 477 B9R1.8 NCCc1ncccn1 Amb17074351 [1,0,0,0,0,0|3,0,0]=4 478 B9R1.8 NCNc1ccccc1 Amb17117015 [1,0,0,0,0,0|2,0,0]=3 479 B9R1.8 NCOc1ccccc1 Amb25128781 [1,0,0,0,0,0|2,0,0]=3 480 B9R1.8 NCSc1ccccc1 Amb25128061 [1,0,0,0,0,0|2,0,0]=3 481 B9R1.8 NC[13CH2]c1ccccc1 Amb22367506 [1,0,0,0,0,0|1,0,0]=2 482 B9R1.8 NNCc1c[n]ccc1 Amb19893243 [1,0,0,0,0,0|3,0,0]=4 483 B9R1.8 NNCc1c[n]ccc1 Amb22491471 [1,0,0,0,0,0|3,0,0]=4 484 B9R1.8 NNCc1cc[n]cc1 Amb19893255 [1,0,0,0,0,0|3,0,0]=4 485 B9R1.8 NNCc1cccc[n]1 Amb19893254 [1,0,0,0,0,0|3,0,0]=4 486 B9R1.8 NNCc1ccccc1 Amb1105200 [1,0,0,0,0,0|2,0,0]=3 487 B9R1.8 NNCc1ccccc1 Amb16231890 [1,0,0,0,0,0|2,0,0]=3 488 B9R1.8 NNCc1ccccc1 Amb22492438 [1,0,0,0,0,0|2,0,0]=3 489 B9R1.8 NNCc1ccccn1 Amb1117330 [1,0,0,0,0,0|3,0,0]=4 490 B9R1.8 NNCc1cccnc1 Amb1121062 [1,0,0,0,0,0|3,0,0]=4 491 B9R1.8 NNCc1ccncc1 Amb1118337 [1,0,0,0,0,0|3,0,0]=4 492 B9R1.8 NOCc1c[n]ccc1 Amb22059440 [1,0,0,0,0,0|3,0,0]=4 493 B9R1.8 NOCc1c[n]ccc1 Amb24074265 [1,0,0,0,0,0|3,0,0]=4 494 B9R1.8 NOCc1cc[n]cc1 Amb22397036 [1,0,0,0,0,0|3,0,0]=4 495 B9R1.8 NOCc1cccc[n]1 Amb18642195 [1,0,0,0,0,0|3,0,0]=4 496 B9R1.8 NOCc1ccccc1 Amb1154307 [1,0,0,0,0,0|2,0,0]=3 497 B9R1.8 NOCc1ccccc1 Amb16204809 [1,0,0,0,0,0|2,0,0]=3 498 B9R1.8 NOCc1ccccc1 Amb22489499 [1,0,0,0,0,0|2,0,0]=3 499 B9R1.8 N[13CH2][13CH2]c1ccccc1 Amb22367507 [1,0,0,0,0,0|1,0,0]=2 500 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [1,0,0,0,0,0|2,0,1]=4 501 B9R1.8 N\N=C\c1ccccc1 Amb2539422 [1,0,0,0,0,0|2,0,1]=4 502 B9R1.8 O/N=N/c1ccccn1 Amb17940654 [1,0,0,0,0,0|3,0,0]=4 503 B9R1.8 O=C=Cc1ccccc1 Amb25348365 [1,0,0,0,0,0|0,0,3]=4 504 B9R1.8 O=C=Nc1ccccc1 Amb22336344 [1,0,0,0,0,0|1,0,2]=4 505 B9R1.8 O=CCc1ccccn1 Amb17089528 [1,0,0,0,0,0|1,0,2]=4 506 B9R1.8 O=CCc1ccncc1 Amb17089529 [1,0,0,0,0,0|1,0,2]=4 507 B9R1.8 O=COc1ccccc1 Amb22002710 [1,0,0,0,0,0|1,0,2]=4 508 B9R1.8 OCC[n+]1ccccc1 Amb22364462 [1,0,0,0,0,0|1,0,0]=2 509 B9R1.8 OCCc1[n]ccc[n]1 Amb22896758 [1,0,0,0,0,0|2,0,0]=3 510 B9R1.8 OCCc1c[n][n]cc1 Amb23559765 [1,0,0,0,0,0|2,0,0]=3 511 B9R1.8 OCCc1c[n]c[n]c1 Amb20240921 [1,0,0,0,0,0|2,0,0]=3 512 B9R1.8 OCCc1cc[n]cc1 Amb24325389 [1,0,0,0,0,0|1,0,0]=2 513 B9R1.8 OCCc1ccc[n][n]1 Amb25086060 [1,0,0,0,0,0|2,0,0]=3 514 B9R1.8 OCCc1ccncn1 Amb17593271 [1,0,0,0,0,0|2,0,0]=3 515 B9R1.8 OCNc1[n]ccc[n]1 Amb24068196 [1,0,0,0,0,0|3,0,0]=4 516 B9R1.8 OCNc1cccc[n]1 Amb25066721 [1,0,0,0,0,0|2,0,0]=3 517 B9R1.8 OCOc1ccccc1 Amb25847006 [1,0,0,0,0,0|1,0,0]=2 518 B9R1.8 ON=Cc1ccccn1 Amb10573542 [1,0,0,0,0,0|2,0,1]=4 519 B9R1.8 ON=Cc1ccncc1 Amb10075320 [1,0,0,0,0,0|2,0,1]=4 520 B9R1.8 ONCc1[n]ccc[n]1 Amb23586395 [1,0,0,0,0,0|3,0,0]=4 521 B9R1.8 ONCc1c[n][n]cc1 Amb23586390 [1,0,0,0,0,0|3,0,0]=4 522 B9R1.8 ONCc1c[n]ccc1 Amb25147084 [1,0,0,0,0,0|2,0,0]=3 523 B9R1.8 ONCc1cc[n]c[n]1 Amb23586394 [1,0,0,0,0,0|3,0,0]=4 524 B9R1.8 ONCc1cc[n]cc1 Amb25851052 [1,0,0,0,0,0|2,0,0]=3 525 B9R1.8 ONCc1ccc[n][n]1 Amb23586391 [1,0,0,0,0,0|3,0,0]=4 526 B9R1.8 ONCc1ccccc1 Amb22001943 [1,0,0,0,0,0|1,0,0]=2 527 B9R1.8 O\N=C/c1c[n]ccc1 Amb24611619 [1,0,0,0,0,0|2,0,1]=4 528 B9R1.8 O\N=C/c1ccccn1 Amb10069892 [1,0,0,0,0,0|2,0,1]=4 529 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [1,0,0,0,0,0|1,0,1]=3 530 B9R1.8 O\N=C\c1ccncc1 Amb1793802 [1,0,0,0,0,0|2,0,1]=4 531 B9R1.8 S=C=Cc1ccccc1 Amb24084687 [1,0,0,0,0,0|0,1,2]=4 532 B9R1.8 S=C=Nc1ccccc1 Amb1161696 [1,0,0,0,0,0|1,1,1]=4 533 B9R1.8 S=CNc1ccccc1 Amb25788857 [1,0,0,0,0,0|1,1,1]=4 534 B9R1.8 SCCc1c[n]ccc1 Amb22008806 [1,0,0,0,0,0|1,1,0]=3 535 B9R1.8 SCCc1ccccn1 Amb17619707 [1,0,0,0,0,0|1,1,0]=3 536 B9R1.8 SCCc1ccncc1 Amb10552830 [1,0,0,0,0,0|1,1,0]=3 537 B9R1.8 [2H]C#Cc1ccccc1 Amb22351662 [1,0,0,0,0,0|1,0,2]=4 538 B9R1.8 [2H]\C=C/c1ccccc1 Amb22338396 [1,0,0,0,0,0|1,0,2]=4 539 B9R1.8 [2H]\C=C\c1ccccc1 Amb22351848 [1,0,0,0,0,0|1,0,2]=4 540 B9R1.8 [C-]#[N+]Cc1ccccc1 Amb2234859 [1,0,0,0,0,0|1,0,1]=3 541 B9R1.8 [C-]#[N+]Cc1ccccn1 Amb1981098 [1,0,0,0,0,0|2,0,1]=4 542 B9R1.8 [C-]#[N+]Cc1cccnc1 Amb1981058 [1,0,0,0,0,0|2,0,1]=4 543 B9R1.8 [C-]#[N+]Cc1ccncc1 Amb1981059 [1,0,0,0,0,0|2,0,1]=4 544 B9R1.8 [CH2-]\C=C\c1ccccc1 Amb22748801 [1,0,0,0,0,0|0,0,3]=4 545 B9R1.8 [Cu]C#Cc1ccccc1 Amb2480676 [1,0,0,0,0,0|1,0,2]=4 546 B9R1.8 [Li]C#Cc1ccccc1 Amb22336681 [1,0,0,0,0,0|1,0,2]=4 547 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [1,0,0,0,0,0|2,0,1]=4 548 B9R1.8 [NH3+]CCc1cc[nH+]cc1 Amb10553712 [1,0,0,0,0,0|2,0,0]=3 549 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [1,0,0,0,0,0|1,0,0]=2 550 B11R1.1 BrCCCc1ccc(I)cc1 Amb25083701 [0,1,0,0,0,0|1,0,0]=2 551 B11R1.1 BrCCCc1ccc(cc1)Br Amb17104577 [0,1,0,0,0,0|1,0,0]=2 552 B11R1.1 BrCCCc1ccc(cc1)C Amb17104554 [0,1,0,0,0,0|1,0,0]=2 553 B11R1.1 BrCCCc1ccc(cc1)Cl Amb17104562 [0,1,0,0,0,0|1,0,0]=2 554 B11R1.1 BrCCCc1ccc(cc1)F Amb17104556 [0,1,0,0,0,0|1,0,0]=2 555 B11R1.1 BrCCOc1ccc(cc1)Br Amb1106775 [0,1,0,0,0,0|2,0,0]=3 556 B11R1.1 BrCCOc1ccc(cc1)C Amb1397755 [0,1,0,0,0,0|2,0,0]=3 557 B11R1.1 BrCCOc1ccc(cc1)Cl Amb1151965 [0,1,0,0,0,0|2,0,0]=3 558 B11R1.1 BrCCOc1ccc(cc1)F Amb1152775 [0,1,0,0,0,0|2,0,0]=3 559 B11R1.1 Br[Zn]CCc1ccc(cc1)Br Amb13890855 [0,1,0,0,0,0|2,0,0]=3 560 B11R1.1 Brc1ccc(C[Se]C#N)cc1 Amb17779550 [0,1,0,0,0,0|2,0,1]=4 561 B11R1.1 Brc1ccc(c[n]1)OCCBr Amb25716754 [0,1,0,0,0,0|3,0,0]=4 562 B11R1.1 Brc1ccc(cc1)C#CCBr Amb25704336 [0,1,0,0,0,0|1,0,2]=4 563 B11R1.1 C#CCCN1C=CC(=O)C=C1 Amb24471657 [0,1,0,0,0,0|2,0,1]=4 564 B11R1.1 C#CCCc1ccc(Br)cc1 Amb18116967 [0,1,0,0,0,0|1,0,1]=3 565 B11R1.1 C#CCCc1ccc(Cl)cc1 Amb18116815 [0,1,0,0,0,0|1,0,1]=3 566 B11R1.1 C#CCCc1ccc(F)cc1 Amb18116891 [0,1,0,0,0,0|1,0,1]=3 567 B11R1.1 C#CCNc1ccc(F)cc1 Amb24070273 [0,1,0,0,0,0|2,0,1]=4 568 B11R1.1 C#CCNc1ccc(I)cc1 Amb25195277 [0,1,0,0,0,0|2,0,1]=4 569 B11R1.1 C#CCNc1ccc(O)cc1 Amb24563278 [0,1,0,0,0,0|2,0,1]=4 570 B11R1.1 C#CCOc1ccc(F)cc1 Amb18182727 [0,1,0,0,0,0|2,0,1]=4 571 B11R1.1 C#CCOc1ccc(I)cc1 Amb24476574 [0,1,0,0,0,0|2,0,1]=4 572 B11R1.1 C#CCOc1ccc(N)cc1 Amb22587338 [0,1,0,0,0,0|2,0,1]=4 573 B11R1.1 C#CCOc1ccc(cc1)N Amb13783679 [0,1,0,0,0,0|2,0,1]=4 574 B11R1.1 C#CCSc1ccc(Br)cc1 Amb24669370 [0,1,0,0,0,0|2,0,1]=4 575 B11R1.1 C#CCSc1ccc(F)cc1 Amb18801035 [0,1,0,0,0,0|2,0,1]=4 576 B11R1.1 C#CCSc1ccc(O)cc1 Amb18792578 [0,1,0,0,0,0|2,0,1]=4 577 B11R1.1 C=CCCc1ccc(Br)c[n]1 Amb24759377 [0,1,0,0,0,0|2,0,1]=4 578 B11R1.1 C=CCCc1ccc(I)cc1 Amb25349986 [0,1,0,0,0,0|1,0,1]=3 579 B11R1.1 C=CCCc1ccc(N)cc1 Amb18124837 [0,1,0,0,0,0|1,0,1]=3 580 B11R1.1 C=CCCc1ccc(O)cc1 Amb25249578 [0,1,0,0,0,0|1,0,1]=3 581 B11R1.1 C=CCNc1ccc(N)cc1 Amb18991898 [0,1,0,0,0,0|2,0,1]=4 582 B11R1.1 C=CCNc1ccc(cc1)Br Amb17306795 [0,1,0,0,0,0|2,0,1]=4 583 B11R1.1 C=CCNc1ccc(cc1)C Amb17306868 [0,1,0,0,0,0|2,0,1]=4 584 B11R1.1 C=CCNc1ccc(cc1)Cl Amb17307236 [0,1,0,0,0,0|2,0,1]=4 585 B11R1.1 C=CCNc1ccc(cc1)F Amb17306180 [0,1,0,0,0,0|2,0,1]=4 586 B11R1.1 C=CCNc1ccc(cc1)I Amb17306247 [0,1,0,0,0,0|2,0,1]=4 587 B11R1.1 C=CCOc1ccc(Cl)cc1 Amb17933920 [0,1,0,0,0,0|2,0,1]=4 588 B11R1.1 C=CCOc1ccc(I)cc1 Amb25699607 [0,1,0,0,0,0|2,0,1]=4 589 B11R1.1 C=CCSc1ccc(F)cc1 Amb24615573 [0,1,0,0,0,0|2,0,1]=4 590 B11R1.1 C=NCCc1ccc(O)cc1 Amb25327788 [0,1,0,0,0,0|2,0,0]=3 591 B11R1.1 CC=CCc1ccc(O)cc1 Amb24094301 [0,1,0,0,0,0|1,0,2]=4 592 B11R1.1 CCC#Cc1ccc(F)cc1 Amb24730740 [0,1,0,0,0,0|1,0,2]=4 593 B11R1.1 CCCCC1=CNC(=O)C=N1 Amb24501761 [0,1,0,0,0,0|3,0,0]=4 594 B11R1.1 CCCCC1=CNC(=S)C=N1 Amb25834146 [0,1,0,0,0,0|3,0,0]=4 595 B11R1.1 CCCCC=1C=CC(=O)NN1 Amb25791568 [0,1,0,0,0,0|3,0,0]=4 596 B11R1.1 CCCCC=1C=CC(=S)NN1 Amb24643765 [0,1,0,0,0,0|3,0,0]=4 597 B11R1.1 CCCCC=1C=NC(=O)NC1 Amb24384526 [0,1,0,0,0,0|3,0,0]=4 598 B11R1.1 CCCCN1C=CC(=N)C=C1 Amb19805017 [0,1,0,0,0,0|2,0,0]=3 599 B11R1.1 CCCCN1C=CC(=N)C=C1 Amb21922071 [0,1,0,0,0,0|2,0,0]=3 600 B11R1.1 CCCCN1C=CC(=[NH2+])C=C1 Amb22555482 [0,1,0,0,0,0|2,0,0]=3 601 B11R1.1 CCCCN1C=CC(S)C=C1 Amb24099597 [0,1,0,0,0,0|2,0,1]=4 602 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22350531 [0,1,0,0,0,0|2,0,0]=3 603 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22350545 [0,1,0,0,0,0|2,0,0]=3 604 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22353653 [0,1,0,0,0,0|2,0,0]=3 605 B11R1.1 CCCCc1[n]cc(N)c[n]1 Amb18560900 [0,1,0,0,0,0|3,0,0]=4 606 B11R1.1 CCCCc1c[n]c(Cl)c[n]1 Amb24561022 [0,1,0,0,0,0|3,0,0]=4 607 B11R1.1 CCCCc1c[n]c(N)[n]c1 Amb24061340 [0,1,0,0,0,0|3,0,0]=4 608 B11R1.1 CCCCc1c[n]c(N)c[n]1 Amb18125320 [0,1,0,0,0,0|3,0,0]=4 609 B11R1.1 CCCCc1ccc(Br)c[n]1 Amb24483961 [0,1,0,0,0,0|2,0,0]=3 610 B11R1.1 CCCCc1ccc(Cl)[n]c1 Amb21963887 [0,1,0,0,0,0|2,0,0]=3 611 B11R1.1 CCCCc1ccc(F)cc1 Amb22730516 [0,1,0,0,0,0|1,0,0]=2 612 B11R1.1 CCCCc1ccc(O)c[n]1 Amb25831110 [0,1,0,0,0,0|2,0,0]=3 613 B11R1.1 CCCNc1c[n]c(Cl)cc1 Amb24700682 [0,1,0,0,0,0|3,0,0]=4 614 B11R1.1 CCCNc1ccc(Cl)cc1 Amb19407162 [0,1,0,0,0,0|2,0,0]=3 615 B11R1.1 CCCNc1ccc(F)c[n]1 Amb18975389 [0,1,0,0,0,0|3,0,0]=4 616 B11R1.1 CCCNc1ccc(cn1)N Amb1113758 [0,1,0,0,0,0|3,0,0]=4 617 B11R1.1 CCCOc1c[n]c(Br)cc1 Amb20617679 [0,1,0,0,0,0|3,0,0]=4 618 B11R1.1 CCCOc1c[n]c(I)cc1 Amb24450842 [0,1,0,0,0,0|3,0,0]=4 619 B11R1.1 CCCOc1ccc(Br)c[n]1 Amb19959351 [0,1,0,0,0,0|3,0,0]=4 620 B11R1.1 CCCOc1ccc(Cl)cc1 Amb25126411 [0,1,0,0,0,0|2,0,0]=3 621 B11R1.1 CCCOc1ccc(F)cc1 Amb24105714 [0,1,0,0,0,0|2,0,0]=3 622 B11R1.1 CCCOc1ccc(I)c[n]1 Amb24437593 [0,1,0,0,0,0|3,0,0]=4 623 B11R1.1 CCCOc1ccc(I)cc1 Amb24064716 [0,1,0,0,0,0|2,0,0]=3 624 B11R1.1 CCCOc1ccc(S)cc1 Amb25225762 [0,1,0,0,0,0|2,0,0]=3 625 B11R1.1 CCCOc1ccc(cc1)N Amb1125044 [0,1,0,0,0,0|2,0,0]=3 626 B11R1.1 CCCOc1ccc(cc1)O Amb1810008 [0,1,0,0,0,0|2,0,0]=3 627 B11R1.1 CCCSc1c[n]c(Cl)cc1 Amb24719868 [0,1,0,0,0,0|3,0,0]=4 628 B11R1.1 CCCSc1ccc(Br)c[n]1 Amb24476580 [0,1,0,0,0,0|3,0,0]=4 629 B11R1.1 CCCSc1ccc(N)cc1 Amb22588114 [0,1,0,0,0,0|2,0,0]=3 630 B11R1.1 CCCSc1ccc(O)cc1 Amb18180159 [0,1,0,0,0,0|2,0,0]=3 631 B11R1.1 CCCSc1ccc(S)cc1 Amb24362640 [0,1,0,0,0,0|2,0,0]=3 632 B11R1.1 CCNCc1ccc(Br)[n]c1 Amb20618628 [0,1,0,0,0,0|3,0,0]=4 633 B11R1.1 CCNCc1ccc(Br)[n]c1 Amb22265392 [0,1,0,0,0,0|3,0,0]=4 634 B11R1.1 CCNCc1ccc(Br)c[n]1 Amb19000786 [0,1,0,0,0,0|3,0,0]=4 635 B11R1.1 CCNCc1ccc(Cl)[n]c1 Amb20618619 [0,1,0,0,0,0|3,0,0]=4 636 B11R1.1 CCNCc1ccc(Cl)[n]c1 Amb21988425 [0,1,0,0,0,0|3,0,0]=4 637 B11R1.1 CCNCc1ccc(Cl)[n]c1 Amb22265398 [0,1,0,0,0,0|3,0,0]=4 638 B11R1.1 CCNCc1ccc(F)[n]c1 Amb24719134 [0,1,0,0,0,0|3,0,0]=4 639 B11R1.1 CCNCc1ccc(I)cc1 Amb25050868 [0,1,0,0,0,0|2,0,0]=3 640 B11R1.1 CCNCc1ccc(N)[n]c1 Amb24649871 [0,1,0,0,0,0|3,0,0]=4 641 B11R1.1 CCNCc1ccc(N)c[n]1 Amb24649846 [0,1,0,0,0,0|3,0,0]=4 642 B11R1.1 CCNCc1ccc(O)c[n]1 Amb24340338 [0,1,0,0,0,0|3,0,0]=4 643 B11R1.1 CCNCc1ccc(cc1)O Amb13952053 [0,1,0,0,0,0|2,0,0]=3 644 B11R1.1 CCNNc1ccc(F)cc1 Amb24086321 [0,1,0,0,0,0|3,0,0]=4 645 B11R1.1 CCOCc1ccc(Br)[n]c1 Amb20618627 [0,1,0,0,0,0|3,0,0]=4 646 B11R1.1 CCOCc1ccc(Br)c[n]1 Amb25213350 [0,1,0,0,0,0|3,0,0]=4 647 B11R1.1 CCOCc1ccc(Br)cc1 Amb19415022 [0,1,0,0,0,0|2,0,0]=3 648 B11R1.1 CCOCc1ccc(N)[n]c1 Amb18295807 [0,1,0,0,0,0|3,0,0]=4 649 B11R1.1 CCOCc1ccc(O)cc1 Amb18125402 [0,1,0,0,0,0|2,0,0]=3 650 B11R1.1 CCOCc1ccc(cc1)N Amb1125782 [0,1,0,0,0,0|2,0,0]=3 651 B11R1.1 CCON=C1C=CC(=O)C=C1 Amb25128866 [0,1,0,0,0,0|3,0,0]=4 652 B11R1.1 CCOOc1ccc(O)cc1 Amb24102976 [0,1,0,0,0,0|3,0,0]=4 653 B11R1.1 CCSCc1ccc(Br)cc1 Amb25684606 [0,1,0,0,0,0|2,0,0]=3 654 B11R1.1 CCSCc1ccc(Cl)c[n]1 Amb25262148 [0,1,0,0,0,0|3,0,0]=4 655 B11R1.1 CCSCc1ccc(Cl)cc1 Amb24402210 [0,1,0,0,0,0|2,0,0]=3 656 B11R1.1 CCSCc1ccc(F)c[n]1 Amb24484009 [0,1,0,0,0,0|3,0,0]=4 657 B11R1.1 CCSCc1ccc(F)cc1 Amb24486978 [0,1,0,0,0,0|2,0,0]=3 658 B11R1.1 CCSCc1ccc(N)[n]c1 Amb18295825 [0,1,0,0,0,0|3,0,0]=4 659 B11R1.1 CCSCc1ccc(O)cc1 Amb18126551 [0,1,0,0,0,0|2,0,0]=3 660 B11R1.1 CCSSc1ccc(N)cc1 Amb24396326 [0,1,0,0,0,0|3,0,0]=4 661 B11R1.1 CC\C=C/c1ccc(F)cc1 Amb24725207 [0,1,0,0,0,0|1,0,2]=4 662 B11R1.1 CC\C=C\c1ccc(O)cc1 Amb24655008 [0,1,0,0,0,0|1,0,2]=4 663 B11R1.1 CC\N=C\c1ccc(cc1)C Amb10553998 [0,1,0,0,0,0|2,0,1]=4 664 B11R1.1 CNCCN1C=CC(=O)C=C1 Amb18999197 [0,1,0,0,0,0|3,0,0]=4 665 B11R1.1 CNCC[n+]1ccc(C)cc1 Amb25289045 [0,1,0,0,0,0|3,0,0]=4 666 B11R1.1 CNCCc1ccc(N)c[n]1 Amb24387854 [0,1,0,0,0,0|3,0,0]=4 667 B11R1.1 CNCCc1ccc(N)cc1 Amb18290354 [0,1,0,0,0,0|2,0,0]=3 668 B11R1.1 CNCCc1ccc(cc1)O Amb15690577 [0,1,0,0,0,0|2,0,0]=3 669 B11R1.1 COCCN1C=CC(=O)C=C1 Amb24460542 [0,1,0,0,0,0|3,0,0]=4 670 B11R1.1 COCCc1ccc(Cl)cc1 Amb24118075 [0,1,0,0,0,0|2,0,0]=3 671 B11R1.1 COCCc1ccc(I)cc1 Amb25360538 [0,1,0,0,0,0|2,0,0]=3 672 B11R1.1 COCCc1ccc(cc1)N Amb1139224 [0,1,0,0,0,0|2,0,0]=3 673 B11R1.1 COCNc1ccc(F)cc1 Amb24070274 [0,1,0,0,0,0|3,0,0]=4 674 B11R1.1 COCOc1ccc(Br)cc1 Amb22001005 [0,1,0,0,0,0|3,0,0]=4 675 B11R1.1 COCOc1ccc(F)cc1 Amb22546791 [0,1,0,0,0,0|3,0,0]=4 676 B11R1.1 COCOc1ccc(N)cc1 Amb24092674 [0,1,0,0,0,0|3,0,0]=4 677 B11R1.1 COCOc1ccc(O)cc1 Amb25268752 [0,1,0,0,0,0|3,0,0]=4 678 B11R1.1 COCSc1ccc(Br)cc1 Amb24473100 [0,1,0,0,0,0|3,0,0]=4 679 B11R1.1 COCSc1ccc(Cl)cc1 Amb24393521 [0,1,0,0,0,0|3,0,0]=4 680 B11R1.1 COCSc1ccc(N)cc1 Amb25714979 [0,1,0,0,0,0|3,0,0]=4 681 B11R1.1 CONCc1ccc(Br)cc1 Amb25151171 [0,1,0,0,0,0|3,0,0]=4 682 B11R1.1 CONCc1ccc(O)cc1 Amb24383951 [0,1,0,0,0,0|3,0,0]=4 683 B11R1.1 CSCCN1C=CC(=O)C=C1 Amb24376848 [0,1,0,0,0,0|3,0,0]=4 684 B11R1.1 CSCCc1ccc(N)cc1 Amb18971649 [0,1,0,0,0,0|2,0,0]=3 685 B11R1.1 CSCOc1ccc(Cl)cc1 Amb24553356 [0,1,0,0,0,0|3,0,0]=4 686 B11R1.1 CSCOc1ccc(F)cc1 Amb24645973 [0,1,0,0,0,0|3,0,0]=4 687 B11R1.1 CSCSc1ccc(Br)cc1 Amb25162619 [0,1,0,0,0,0|3,0,0]=4 688 B11R1.1 CSCSc1ccc(F)cc1 Amb25768258 [0,1,0,0,0,0|3,0,0]=4 689 B11R1.1 C\C=C\Cc1ccc(N)cc1 Amb22751067 [0,1,0,0,0,0|1,0,2]=4 690 B11R1.1 C\C=C\Cc1ccc(O)cc1 Amb18124917 [0,1,0,0,0,0|1,0,2]=4 691 B11R1.1 Cc1[n]cc(CCCC)c[n]1 Amb24071081 [0,1,0,0,0,0|3,0,0]=4 692 B11R1.1 Cc1[n]cc(CCCN)c[n]1 Amb18201573 [0,1,0,0,0,0|3,0,0]=4 693 B11R1.1 Cc1c[n]c(CCCN)[n]c1 Amb24477627 [0,1,0,0,0,0|3,0,0]=4 694 B11R1.1 Cc1c[n]c(CCCN)c[n]1 Amb18201571 [0,1,0,0,0,0|3,0,0]=4 695 B11R1.1 Cc1c[n]c([n]c1)SCCO Amb18180265 [0,1,0,0,0,0|3,0,0]=4 696 B11R1.1 Cc1cc[n+](CCCO)cc1 Amb24466262 [0,1,0,0,0,0|1,0,0]=2 697 B11R1.1 Cc1ccc(C=CCO)cc1 Amb22345885 [0,1,0,0,0,0|0,0,2]=3 698 B11R1.1 Cc1ccc(CCC#C)cc1 Amb18634818 [0,1,0,0,0,0|1,0,1]=3 699 B11R1.1 Cc1ccc(CCC#N)[n]c1 Amb18124806 [0,1,0,0,0,0|2,0,1]=4 700 B11R1.1 Cc1ccc(CCC=C)[n]c1 Amb24100505 [0,1,0,0,0,0|2,0,1]=4 701 B11R1.1 Cc1ccc(CCC=O)[n]c1 Amb25723084 [0,1,0,0,0,0|1,0,2]=4 702 B11R1.1 Cc1ccc(CCCC)[n]c1 Amb24676615 [0,1,0,0,0,0|2,0,0]=3 703 B11R1.1 Cc1ccc(CCCC)cc1 Amb22002059 [0,1,0,0,0,0|1,0,0]=2 704 B11R1.1 Cc1ccc(CCCN)[n]c1 Amb25348517 [0,1,0,0,0,0|2,0,0]=3 705 B11R1.1 Cc1ccc(CCCN)c[n]1 Amb22886484 [0,1,0,0,0,0|2,0,0]=3 706 B11R1.1 Cc1ccc(CCCN)c[n]1 Amb25069217 [0,1,0,0,0,0|2,0,0]=3 707 B11R1.1 Cc1ccc(CCCO)[n]c1 Amb25073187 [0,1,0,0,0,0|1,0,0]=2 708 B11R1.1 Cc1ccc(CCCO)c[n]1 Amb24533220 [0,1,0,0,0,0|1,0,0]=2 709 B11R1.1 Cc1ccc(CCNC)[n]c1 Amb18125195 [0,1,0,0,0,0|3,0,0]=4 710 B11R1.1 Cc1ccc(CCNN)c[n]1 Amb24666011 [0,1,0,0,0,0|3,0,0]=4 711 B11R1.1 Cc1ccc(CNCC)[n]c1 Amb18201812 [0,1,0,0,0,0|3,0,0]=4 712 B11R1.1 Cc1ccc(COCC)[n]c1 Amb24723080 [0,1,0,0,0,0|3,0,0]=4 713 B11R1.1 Cc1ccc(CSC#N)cc1 Amb19944266 [0,1,0,0,0,0|2,0,1]=4 714 B11R1.1 Cc1ccc(CSCC)cc1 Amb24536616 [0,1,0,0,0,0|2,0,0]=3 715 B11R1.1 Cc1ccc(CSCCl)cc1 Amb25108662 [0,1,0,0,0,0|2,0,0]=3 716 B11R1.1 Cc1ccc(C[Se]C#N)cc1 Amb17779544 [0,1,0,0,0,0|2,0,1]=4 717 B11R1.1 Cc1ccc(C\C=C\Br)cc1 Amb25720563 [0,1,0,0,0,0|1,0,2]=4 718 B11R1.1 Cc1ccc(NCCCl)[n]c1 Amb25341757 [0,1,0,0,0,0|3,0,0]=4 719 B11R1.1 Cc1ccc(NCCN)[n]c1 Amb19515509 [0,1,0,0,0,0|3,0,0]=4 720 B11R1.1 Cc1ccc(NCCO)[n][n]1 Amb18975347 [0,1,0,0,0,0|3,0,0]=4 721 B11R1.1 Cc1ccc([n][n]1)SCCO Amb18177939 [0,1,0,0,0,0|3,0,0]=4 722 B11R1.1 Cc1ccc([n]c1)OCCN Amb18296482 [0,1,0,0,0,0|3,0,0]=4 723 B11R1.1 Cc1ccc([n]c1)SCCC Amb25792073 [0,1,0,0,0,0|3,0,0]=4 724 B11R1.1 Cc1ccc([n]c1)SCCF Amb25717499 [0,1,0,0,0,0|3,0,0]=4 725 B11R1.1 Cc1ccc(\C=C\CBr)cc1 Amb24575176 [0,1,0,0,0,0|1,0,2]=4 726 B11R1.1 Cc1ccc(\C=C\CN)cc1 Amb18563249 [0,1,0,0,0,0|1,0,2]=4 727 B11R1.1 Cc1ccc(\C=C\CO)c[n]1 Amb25790076 [0,1,0,0,0,0|1,0,2]=4 728 B11R1.1 Cc1ccc(\C=C\CO)cc1 Amb23442829 [0,1,0,0,0,0|0,0,2]=3 729 B11R1.1 Cc1ccc(\C=C\NO)cc1 Amb24621859 [0,1,0,0,0,0|1,0,2]=4 730 B11R1.1 Cc1ccc(c[n]1)NCCN Amb24477635 [0,1,0,0,0,0|3,0,0]=4 731 B11R1.1 Cc1ccc(c[n]1)OCCC Amb25111097 [0,1,0,0,0,0|3,0,0]=4 732 B11R1.1 Cc1ccc(c[n]1)OCCN Amb18992842 [0,1,0,0,0,0|3,0,0]=4 733 B11R1.1 Cc1ccc(c[n]1)OCCO Amb23455913 [0,1,0,0,0,0|2,0,0]=3 734 B11R1.1 Cc1ccc(cc1)C#CCCl Amb18792612 [0,1,0,0,0,0|1,0,2]=4 735 B11R1.1 Cc1ccc(cc1)C#CCN Amb18281200 [0,1,0,0,0,0|1,0,2]=4 736 B11R1.1 Cc1ccc(cc1)NCC#C Amb21953776 [0,1,0,0,0,0|2,0,1]=4 737 B11R1.1 Cc1ccc(cc1)NCCBr Amb24575185 [0,1,0,0,0,0|2,0,0]=3 738 B11R1.1 Cc1ccc(cc1)NCCS Amb24538179 [0,1,0,0,0,0|1,1,0]=3 739 B11R1.1 Cc1ccc(cc1)NCOC Amb25301269 [0,1,0,0,0,0|3,0,0]=4 740 B11R1.1 Cc1ccc(cc1)OCC#C Amb19373357 [0,1,0,0,0,0|2,0,1]=4 741 B11R1.1 Cc1ccc(cc1)OCOC Amb20241783 [0,1,0,0,0,0|3,0,0]=4 742 B11R1.1 Cc1ccc(cc1)SCOC Amb25032720 [0,1,0,0,0,0|3,0,0]=4 743 B11R1.1 Cc1ccc(cc1)\N=C\CCl Amb25791668 [0,1,0,0,0,0|2,0,1]=4 744 B11R1.1 Cc1ccc(cc1)\N=C\CO Amb24430956 [0,1,0,0,0,0|1,0,1]=3 745 B11R1.1 ClCCCc1ccc(cc1)Br Amb17104549 [0,1,0,0,0,0|1,0,0]=2 746 B11R1.1 ClCCCc1ccc(cc1)C Amb17104527 [0,1,0,0,0,0|1,0,0]=2 747 B11R1.1 ClCCCc1ccc(cc1)F Amb17104529 [0,1,0,0,0,0|1,0,0]=2 748 B11R1.1 ClCCCc1ccc(cc1)N Amb17477708 [0,1,0,0,0,0|1,0,0]=2 749 B11R1.1 ClCCCc1ccc(cc1)O Amb17477722 [0,1,0,0,0,0|1,0,0]=2 750 B11R1.1 ClCCNc1ccc(cc1)Br Amb17346195 [0,1,0,0,0,0|2,0,0]=3 751 B11R1.1 ClCCNc1ccc(cc1)C Amb17334787 [0,1,0,0,0,0|2,0,0]=3 752 B11R1.1 ClCCNc1ccc(cc1)Cl Amb17336182 [0,1,0,0,0,0|2,0,0]=3 753 B11R1.1 ClCCNc1ccc(cc1)F Amb17334965 [0,1,0,0,0,0|2,0,0]=3 754 B11R1.1 ClCCSc1ccc(cc1)C Amb1657286 [0,1,0,0,0,0|2,0,0]=3 755 B11R1.1 ClCCSc1ccc(cc1)Cl Amb1154201 [0,1,0,0,0,0|2,0,0]=3 756 B11R1.1 ClCOCc1ccc(Br)cc1 Amb24376347 [0,1,0,0,0,0|2,0,0]=3 757 B11R1.1 ClC\C=C\c1ccc(Br)cc1 Amb21926649 [0,1,0,0,0,0|1,0,2]=4 758 B11R1.1 ClC\C=C\c1ccc(I)cc1 Amb24614945 [0,1,0,0,0,0|1,0,2]=4 759 B11R1.1 Clc1ccc(CC[Mg]Cl)cc1 Amb22897275 [0,1,0,0,0,0|2,0,0]=3 760 B11R1.1 Clc1ccc(CC[Zn]Br)cc1 Amb22000488 [0,1,0,0,0,0|2,0,0]=3 761 B11R1.1 Clc1ccc(CC[Zn]Cl)cc1 Amb22897728 [0,1,0,0,0,0|2,0,0]=3 762 B11R1.1 Clc1ccc(CSCCl)cc1 Amb25704966 [0,1,0,0,0,0|2,0,0]=3 763 B11R1.1 Clc1ccc(NCCCl)[n]c1 Amb25191177 [0,1,0,0,0,0|3,0,0]=4 764 B11R1.1 Clc1ccc([n]c1)SCCBr Amb24509249 [0,1,0,0,0,0|3,0,0]=4 765 B11R1.1 Clc1ccc(\C=C\CBr)cc1 Amb22007806 [0,1,0,0,0,0|1,0,2]=4 766 B11R1.1 Clc1ccc(\C=C\CCl)cc1 Amb25185292 [0,1,0,0,0,0|1,0,2]=4 767 B11R1.1 Clc1ccc(cc1)C#CCBr Amb24384136 [0,1,0,0,0,0|1,0,2]=4 768 B11R1.1 Clc1ccc(cc1)C#CCCl Amb18319781 [0,1,0,0,0,0|1,0,2]=4 769 B11R1.1 Clc1ccc(cc1)C#CCI Amb25353537 [0,1,0,0,0,0|1,0,2]=4 770 B11R1.1 Clc1ccc(cc1)OCCI Amb25833023 [0,1,0,0,0,0|2,0,0]=3 771 B11R1.1 FCC#Cc1ccc(Cl)cc1 Amb25825390 [0,1,0,0,0,0|1,0,2]=4 772 B11R1.1 FCC#Cc1ccc(I)cc1 Amb25353811 [0,1,0,0,0,0|1,0,2]=4 773 B11R1.1 FCCOc1ccc(Br)c[n]1 Amb25301795 [0,1,0,0,0,0|3,0,0]=4 774 B11R1.1 FCCOc1ccc(Br)cc1 Amb22227902 [0,1,0,0,0,0|2,0,0]=3 775 B11R1.1 FCCOc1ccc(I)cc1 Amb22227565 [0,1,0,0,0,0|2,0,0]=3 776 B11R1.1 FCCOc1ccc(S)cc1 Amb23580141 [0,1,0,0,0,0|2,0,0]=3 777 B11R1.1 FCCSc1ccc(Br)c[n]1 Amb24734597 [0,1,0,0,0,0|3,0,0]=4 778 B11R1.1 FCCSc1ccc(Cl)cc1 Amb24644973 [0,1,0,0,0,0|2,0,0]=3 779 B11R1.1 FCSCc1ccc(Cl)cc1 Amb24437363 [0,1,0,0,0,0|2,0,0]=3 780 B11R1.1 Fc1ccc(CC[Zn]Br)cc1 Amb22000495 [0,1,0,0,0,0|2,0,0]=3 781 B11R1.1 Fc1ccc(CNC=S)cc1 Amb25241123 [0,1,0,0,0,0|1,1,1]=4 782 B11R1.1 Fc1ccc(C[Se]C#N)cc1 Amb17779547 [0,1,0,0,0,0|2,0,1]=4 783 B11R1.1 Fc1ccc(NCCF)[n]c1 Amb25831303 [0,1,0,0,0,0|3,0,0]=4 784 B11R1.1 Fc1ccc([n]c1)SCCCl Amb18317647 [0,1,0,0,0,0|3,0,0]=4 785 B11R1.1 Fc1ccc(\C=C\CCl)cc1 Amb25074621 [0,1,0,0,0,0|1,0,2]=4 786 B11R1.1 Fc1ccc(c[n]1)OCCF Amb24395747 [0,1,0,0,0,0|3,0,0]=4 787 B11R1.1 Fc1ccc(cc1)C#CCBr Amb25737916 [0,1,0,0,0,0|1,0,2]=4 788 B11R1.1 Fc1ccc(cc1)C#CCCl Amb18180184 [0,1,0,0,0,0|1,0,2]=4 789 B11R1.1 Fc1ccc(cc1)NCCS Amb24545874 [0,1,0,0,0,0|1,1,0]=3 790 B11R1.1 Fc1ccc(cc1)OCCF Amb24686958 [0,1,0,0,0,0|2,0,0]=3 791 B11R1.1 Fc1ccc(cc1)SCCF Amb24484072 [0,1,0,0,0,0|2,0,0]=3 792 B11R1.1 Fc1ccc(cc1)SCCS Amb24689240 [0,1,0,0,0,0|1,1,0]=3 793 B11R1.1 N#CCCN1C=CC(=O)C=C1 Amb18039989 [0,1,0,0,0,0|2,0,1]=4 794 B11R1.1 N#CCCc1ccc(I)cc1 Amb25785381 [0,1,0,0,0,0|1,0,1]=3 795 B11R1.1 N#CCCc1ccc(cc1)C Amb17204297 [0,1,0,0,0,0|1,0,1]=3 796 B11R1.1 N#CCCc1ccc(cc1)F Amb17204299 [0,1,0,0,0,0|1,0,1]=3 797 B11R1.1 N#CCCn1ccc(=O)cc1 Amb10552965 [0,1,0,0,0,0|2,0,1]=4 798 B11R1.1 N#CCSc1ccc(O)cc1 Amb18180090 [0,1,0,0,0,0|2,0,1]=4 799 B11R1.1 N#CCSc1ccc(cc1)Br Amb17644 [0,1,0,0,0,0|2,0,1]=4 800 B11R1.1 N#CCSc1ccc(cc1)Cl Amb1156063 [0,1,0,0,0,0|2,0,1]=4 801 B11R1.1 N#CCSc1ccc(cc1)F Amb1152494 [0,1,0,0,0,0|2,0,1]=4 802 B11R1.1 N#CNCc1ccc(Br)cc1 Amb25761722 [0,1,0,0,0,0|2,0,1]=4 803 B11R1.1 N#CNCc1ccc(O)cc1 Amb25683003 [0,1,0,0,0,0|2,0,1]=4 804 B11R1.1 N#CNCc1ccc(cc1)C Amb16186976 [0,1,0,0,0,0|2,0,1]=4 805 B11R1.1 N#CNCc1ccc(cc1)Cl Amb16186974 [0,1,0,0,0,0|2,0,1]=4 806 B11R1.1 N#CNCc1ccc(cc1)F Amb16186972 [0,1,0,0,0,0|2,0,1]=4 807 B11R1.1 N#CSCc1ccc(Br)cc1 Amb21959352 [0,1,0,0,0,0|2,0,1]=4 808 B11R1.1 N#CSCc1ccc(Cl)cc1 Amb19889458 [0,1,0,0,0,0|2,0,1]=4 809 B11R1.1 N#CSCc1ccc(cc1)F Amb10789219 [0,1,0,0,0,0|2,0,1]=4 810 B11R1.1 NCC#Cc1ccc(Br)cc1 Amb18253475 [0,1,0,0,0,0|1,0,2]=4 811 B11R1.1 NCC#Cc1ccc(Cl)cc1 Amb18950127 [0,1,0,0,0,0|1,0,2]=4 812 B11R1.1 NCC#Cc1ccc(F)cc1 Amb18949804 [0,1,0,0,0,0|1,0,2]=4 813 B11R1.1 NCCCN1C=CC(=O)C=C1 Amb18029471 [0,1,0,0,0,0|2,0,0]=3 814 B11R1.1 NCCCN1C=NC(=O)C=C1 Amb18201102 [0,1,0,0,0,0|3,0,0]=4 815 B11R1.1 NCCCc1c[n]c(Cl)[n]c1 Amb25085992 [0,1,0,0,0,0|3,0,0]=4 816 B11R1.1 NCCCc1c[n]c(O)[n]c1 Amb25359917 [0,1,0,0,0,0|3,0,0]=4 817 B11R1.1 NCCCc1c[n]c(S)[n]c1 Amb25223889 [0,1,0,0,0,0|3,0,0]=4 818 B11R1.1 NCCCc1cc[n+]([O-])cc1 Amb25145870 [0,1,0,0,0,0|2,0,0]=3 819 B11R1.1 NCCCc1ccc(Br)[n]c1 Amb24453424 [0,1,0,0,0,0|2,0,0]=3 820 B11R1.1 NCCCc1ccc(Cl)[n]c1 Amb25849321 [0,1,0,0,0,0|2,0,0]=3 821 B11R1.1 NCCCc1ccc(I)cc1 Amb25172834 [0,1,0,0,0,0|1,0,0]=2 822 B11R1.1 NCCCc1ccc(S)cc1 Amb25228495 [0,1,0,0,0,0|1,0,0]=2 823 B11R1.1 NCCCc1ccc(cc1)Cl Amb1092541 [0,1,0,0,0,0|1,0,0]=2 824 B11R1.1 NCCCc1ccc(cc1)Cl Amb13952055 [0,1,0,0,0,0|1,0,0]=2 825 B11R1.1 NCCCc1ccc(cc1)N Amb17477693 [0,1,0,0,0,0|1,0,0]=2 826 B11R1.1 NCCCc1ccc(cc1)O Amb10066893 [0,1,0,0,0,0|1,0,0]=2 827 B11R1.1 NCCCc1ccc(cc1)O Amb17598403 [0,1,0,0,0,0|1,0,0]=2 828 B11R1.1 NCCNc1ccc(F)c[n]1 Amb18291560 [0,1,0,0,0,0|3,0,0]=4 829 B11R1.1 NCCNc1ccc(F)cc1 Amb17845075 [0,1,0,0,0,0|2,0,0]=3 830 B11R1.1 NCCNc1ccc(cc1)Br Amb17057752 [0,1,0,0,0,0|2,0,0]=3 831 B11R1.1 NCCNc1ccc(cc1)C Amb17057746 [0,1,0,0,0,0|2,0,0]=3 832 B11R1.1 NCCNc1ccc(cc1)Cl Amb17057751 [0,1,0,0,0,0|2,0,0]=3 833 B11R1.1 NCCOc1c[n]c(I)cc1 Amb24707119 [0,1,0,0,0,0|3,0,0]=4 834 B11R1.1 NCCOc1ccc(Br)c[n]1 Amb18988876 [0,1,0,0,0,0|3,0,0]=4 835 B11R1.1 NCCOc1ccc(Br)cc1 Amb19338687 [0,1,0,0,0,0|2,0,0]=3 836 B11R1.1 NCCOc1ccc(Cl)c[n]1 Amb18988875 [0,1,0,0,0,0|3,0,0]=4 837 B11R1.1 NCCOc1ccc(Cl)c[n]1 Amb20631070 [0,1,0,0,0,0|3,0,0]=4 838 B11R1.1 NCCOc1ccc(F)c[n]1 Amb18296419 [0,1,0,0,0,0|3,0,0]=4 839 B11R1.1 NCCOc1ccc(O)cc1 Amb18125536 [0,1,0,0,0,0|2,0,0]=3 840 B11R1.1 NCCOc1ccc(cc1)Br Amb1098668 [0,1,0,0,0,0|2,0,0]=3 841 B11R1.1 NCCOc1ccc(cc1)C Amb1101721 [0,1,0,0,0,0|2,0,0]=3 842 B11R1.1 NCCOc1ccc(cc1)C Amb2196480 [0,1,0,0,0,0|2,0,0]=3 843 B11R1.1 NCCOc1ccc(cc1)Cl Amb1153919 [0,1,0,0,0,0|2,0,0]=3 844 B11R1.1 NCCOc1ccc(cc1)F Amb1102015 [0,1,0,0,0,0|2,0,0]=3 845 B11R1.1 NCCSc1ccc(Br)c[n]1 Amb24509248 [0,1,0,0,0,0|3,0,0]=4 846 B11R1.1 NCCSc1ccc(Cl)c[n]1 Amb18252999 [0,1,0,0,0,0|3,0,0]=4 847 B11R1.1 NCCSc1ccc(O)cc1 Amb18971693 [0,1,0,0,0,0|2,0,0]=3 848 B11R1.1 NCCSc1ccc(cc1)Br Amb1105170 [0,1,0,0,0,0|2,0,0]=3 849 B11R1.1 NCCSc1ccc(cc1)Cl Amb2236679 [0,1,0,0,0,0|2,0,0]=3 850 B11R1.1 NC\C=C/c1ccc(cc1)C Amb10560257 [0,1,0,0,0,0|1,0,2]=4 851 B11R1.1 NC\C=C\c1ccc(Br)cc1 Amb18066634 [0,1,0,0,0,0|1,0,2]=4 852 B11R1.1 NC\C=C\c1ccc(Cl)cc1 Amb18563824 [0,1,0,0,0,0|1,0,2]=4 853 B11R1.1 NC\C=C\c1ccc(F)cc1 Amb18065348 [0,1,0,0,0,0|1,0,2]=4 854 B11R1.1 NC\C=C\c1ccc(O)cc1 Amb18124993 [0,1,0,0,0,0|1,0,2]=4 855 B11R1.1 NNCCc1ccc(Br)c[n]1 Amb25300628 [0,1,0,0,0,0|3,0,0]=4 856 B11R1.1 NOCCN1C=CC(=O)C=C1 Amb25263439 [0,1,0,0,0,0|3,0,0]=4 857 B11R1.1 NOCCc1ccc(F)cc1 Amb22896631 [0,1,0,0,0,0|2,0,0]=3 858 B11R1.1 NOCCc1ccc(O)cc1 Amb25053130 [0,1,0,0,0,0|2,0,0]=3 859 B11R1.1 Nc1[n]cc(CCCO)c[n]1 Amb22394981 [0,1,0,0,0,0|2,0,0]=3 860 B11R1.1 Nc1[n]cc(c[n]1)NCCO Amb25268650 [0,1,0,0,0,0|3,0,0]=4 861 B11R1.1 Nc1[n]cc(c[n]1)OCCO Amb24649854 [0,1,0,0,0,0|3,0,0]=4 862 B11R1.1 Nc1c[n]c(NCCO)[n]c1 Amb18972657 [0,1,0,0,0,0|3,0,0]=4 863 B11R1.1 Nc1c[n]c([n]c1)OCCO Amb18290429 [0,1,0,0,0,0|3,0,0]=4 864 B11R1.1 Nc1c[n]c([n]c1)SCCO Amb18972723 [0,1,0,0,0,0|3,0,0]=4 865 B11R1.1 Nc1c[n]c(c[n]1)NCCO Amb22495878 [0,1,0,0,0,0|3,0,0]=4 866 B11R1.1 Nc1c[n]c(c[n]1)SCCO Amb24487958 [0,1,0,0,0,0|3,0,0]=4 867 B11R1.1 Nc1ccc(CCCBr)cc1 Amb22229466 [0,1,0,0,0,0|1,0,0]=2 868 B11R1.1 Nc1ccc(CCCF)cc1 Amb25697152 [0,1,0,0,0,0|1,0,0]=2 869 B11R1.1 Nc1ccc(CCCO)cc1 Amb21964655 [0,1,0,0,0,0|0,0,0]=1 870 B11R1.1 Nc1ccc(CNC=O)cc1 Amb24072314 [0,1,0,0,0,0|1,0,2]=4 871 B11R1.1 Nc1ccc(COCF)cc1 Amb25764872 [0,1,0,0,0,0|2,0,0]=3 872 B11R1.1 Nc1ccc(NCCF)[n]c1 Amb24725236 [0,1,0,0,0,0|3,0,0]=4 873 B11R1.1 Nc1ccc(NCCO)[n]c1 Amb24080718 [0,1,0,0,0,0|2,0,0]=3 874 B11R1.1 Nc1ccc([n]c1)OCCF Amb24484769 [0,1,0,0,0,0|3,0,0]=4 875 B11R1.1 Nc1ccc([n]c1)SCCN Amb18291131 [0,1,0,0,0,0|3,0,0]=4 876 B11R1.1 Nc1ccc(\C=C\CN)cc1 Amb24527675 [0,1,0,0,0,0|1,0,2]=4 877 B11R1.1 Nc1ccc(c[n]1)NCCF Amb25150683 [0,1,0,0,0,0|3,0,0]=4 878 B11R1.1 Nc1ccc(c[n]1)NCCN Amb18991503 [0,1,0,0,0,0|3,0,0]=4 879 B11R1.1 Nc1ccc(c[n]1)SCCF Amb24562126 [0,1,0,0,0,0|3,0,0]=4 880 B11R1.1 Nc1ccc(c[n]1)SCCN Amb18291321 [0,1,0,0,0,0|3,0,0]=4 881 B11R1.1 Nc1ccc(cc1)C#CCBr Amb25188870 [0,1,0,0,0,0|1,0,2]=4 882 B11R1.1 Nc1ccc(cc1)C#CCF Amb24554108 [0,1,0,0,0,0|1,0,2]=4 883 B11R1.1 Nc1ccc(cc1)C#CCO Amb22228978 [0,1,0,0,0,0|0,0,2]=3 884 B11R1.1 Nc1ccc(cc1)NCC#N Amb24089891 [0,1,0,0,0,0|2,0,1]=4 885 B11R1.1 Nc1ccc(cc1)NCCF Amb25804656 [0,1,0,0,0,0|2,0,0]=3 886 B11R1.1 Nc1ccc(cc1)NCCN Amb18298668 [0,1,0,0,0,0|2,0,0]=3 887 B11R1.1 Nc1ccc(cc1)OCCBr Amb20620461 [0,1,0,0,0,0|2,0,0]=3 888 B11R1.1 Nc1ccc(cc1)OCCCl Amb18126855 [0,1,0,0,0,0|2,0,0]=3 889 B11R1.1 Nc1ccc(cc1)OCCF Amb23579951 [0,1,0,0,0,0|2,0,0]=3 890 B11R1.1 Nc1ccc(cc1)OCCN Amb23401881 [0,1,0,0,0,0|2,0,0]=3 891 B11R1.1 Nc1ccc(cc1)SCCN Amb18975711 [0,1,0,0,0,0|2,0,0]=3 892 B11R1.1 O=C1C=CN(C=C1)SCCF Amb24357187 [0,1,0,0,0,0|3,0,0]=4 893 B11R1.1 O=C1C=CN(CCCBr)C=C1 Amb24350690 [0,1,0,0,0,0|2,0,0]=3 894 B11R1.1 O=C1C=CN(CCCCl)C=C1 Amb18178000 [0,1,0,0,0,0|2,0,0]=3 895 B11R1.1 O=C1C=CN(CCCF)C=C1 Amb24453605 [0,1,0,0,0,0|2,0,0]=3 896 B11R1.1 O=C1C=CN(CCCS)C=C1 Amb25792215 [0,1,0,0,0,0|1,1,0]=3 897 B11R1.1 O=C=NCc1ccc(cc1)O Amb17090278 [0,1,0,0,0,0|1,0,2]=4 898 B11R1.1 O=CCCN1C=CC(=O)C=C1 Amb18177172 [0,1,0,0,0,0|1,0,2]=4 899 B11R1.1 O=CCCc1ccc(Br)c[n]1 Amb24704728 [0,1,0,0,0,0|1,0,2]=4 900 B11R1.1 O=CCCc1ccc(cc1)Br Amb10602155 [0,1,0,0,0,0|0,0,2]=3 901 B11R1.1 O=CCCc1ccc(cc1)F Amb10602156 [0,1,0,0,0,0|0,0,2]=3 902 B11R1.1 O=CCCc1ccc(cc1)O Amb17081693 [0,1,0,0,0,0|0,0,2]=3 903 B11R1.1 O=CCOc1ccc(cc1)Br Amb17099949 [0,1,0,0,0,0|1,0,2]=4 904 B11R1.1 O=CCSc1ccc(cc1)Br Amb17082907 [0,1,0,0,0,0|1,0,2]=4 905 B11R1.1 O=CCSc1ccc(cc1)C Amb17082904 [0,1,0,0,0,0|1,0,2]=4 906 B11R1.1 O=CCSc1ccc(cc1)Cl Amb17082906 [0,1,0,0,0,0|1,0,2]=4 907 B11R1.1 O=CCSc1ccc(cc1)F Amb17082905 [0,1,0,0,0,0|1,0,2]=4 908 B11R1.1 O=CNCc1ccc(Cl)cc1 Amb24486673 [0,1,0,0,0,0|1,0,2]=4 909 B11R1.1 O=CNCc1ccc(cc1)C Amb1916037 [0,1,0,0,0,0|1,0,2]=4 910 B11R1.1 OCCCC=1C=CC(=O)NN1 Amb25762182 [0,1,0,0,0,0|2,0,0]=3 911 B11R1.1 OCCCN1C=CC(=O)C=C1 Amb18041267 [0,1,0,0,0,0|1,0,0]=2 912 B11R1.1 OCCCc1c[n]c(S)[n]c1 Amb22394982 [0,1,0,0,0,0|2,0,0]=3 913 B11R1.1 OCCCc1ccc(Br)[n]c1 Amb21963678 [0,1,0,0,0,0|1,0,0]=2 914 B11R1.1 OCCCc1ccc(Br)c[n]1 Amb25309177 [0,1,0,0,0,0|1,0,0]=2 915 B11R1.1 OCCCc1ccc(Cl)[n]c1 Amb21963672 [0,1,0,0,0,0|1,0,0]=2 916 B11R1.1 OCCCc1ccc(F)[n][n]1 Amb24062291 [0,1,0,0,0,0|2,0,0]=3 917 B11R1.1 OCCCc1ccc(F)[n]c1 Amb24085299 [0,1,0,0,0,0|1,0,0]=2 918 B11R1.1 OCCCc1ccc(I)cc1 Amb24406298 [0,1,0,0,0,0|0,0,0]=1 919 B11R1.1 OCCCc1ccc(cc1)Br Amb13883587 [0,1,0,0,0,0|0,0,0]=1 920 B11R1.1 OCCCc1ccc(cc1)F Amb17089497 [0,1,0,0,0,0|0,0,0]=1 921 B11R1.1 OCCCc1ccc(cc1)N Amb17477700 [0,1,0,0,0,0|0,0,0]=1 922 B11R1.1 OCCCc1ncc(cn1)S Amb1971490 [0,1,0,0,0,0|2,0,0]=3 923 B11R1.1 OCCNc1[n]cc(Br)c[n]1 Amb22233773 [0,1,0,0,0,0|3,0,0]=4 924 B11R1.1 OCCNc1[n]cc(F)c[n]1 Amb24486783 [0,1,0,0,0,0|3,0,0]=4 925 B11R1.1 OCCNc1[n]cc(I)c[n]1 Amb24488137 [0,1,0,0,0,0|3,0,0]=4 926 B11R1.1 OCCNc1c[n]c(Br)c[n]1 Amb24413181 [0,1,0,0,0,0|3,0,0]=4 927 B11R1.1 OCCNc1ccc(F)c[n]1 Amb18975393 [0,1,0,0,0,0|2,0,0]=3 928 B11R1.1 OCCNc1ccc(I)c[n]1 Amb25301350 [0,1,0,0,0,0|2,0,0]=3 929 B11R1.1 OCCOc1[n]cc(Br)c[n]1 Amb25117502 [0,1,0,0,0,0|3,0,0]=4 930 B11R1.1 OCCOc1c[n]c(Br)c[n]1 Amb25150720 [0,1,0,0,0,0|3,0,0]=4 931 B11R1.1 OCCOc1c[n]c(Br)cc1 Amb24434701 [0,1,0,0,0,0|2,0,0]=3 932 B11R1.1 OCCOc1c[n]c(Cl)cc1 Amb24607926 [0,1,0,0,0,0|2,0,0]=3 933 B11R1.1 OCCOc1c[n]c(F)cc1 Amb24447457 [0,1,0,0,0,0|2,0,0]=3 934 B11R1.1 OCCOc1c[n]c(I)cc1 Amb25316966 [0,1,0,0,0,0|2,0,0]=3 935 B11R1.1 OCCOc1ccc(Br)c[n]1 Amb19515691 [0,1,0,0,0,0|2,0,0]=3 936 B11R1.1 OCCOc1ccc(Cl)c[n]1 Amb23598439 [0,1,0,0,0,0|2,0,0]=3 937 B11R1.1 OCCOc1ccc(S)cc1 Amb24100726 [0,1,0,0,0,0|1,0,0]=2 938 B11R1.1 OCCOc1ccc(cc1)C Amb2209347 [0,1,0,0,0,0|1,0,0]=2 939 B11R1.1 OCCOc1ccc(cc1)Cl Amb2209356 [0,1,0,0,0,0|1,0,0]=2 940 B11R1.1 OCCOc1ccc(cc1)N Amb15740917 [0,1,0,0,0,0|1,0,0]=2 941 B11R1.1 OCCSN1C=CC(=O)C=C1 Amb25151653 [0,1,0,0,0,0|2,0,0]=3 942 B11R1.1 OCCSc1[n]cc(I)c[n]1 Amb25125772 [0,1,0,0,0,0|3,0,0]=4 943 B11R1.1 OCCSc1ccc(F)c[n]1 Amb18789954 [0,1,0,0,0,0|2,0,0]=3 944 B11R1.1 OCCSc1ccc(cc1)O Amb10575943 [0,1,0,0,0,0|1,0,0]=2 945 B11R1.1 OC\C=C\c1ccc(Cl)cc1 Amb21964138 [0,1,0,0,0,0|0,0,2]=3 946 B11R1.1 OC\C=C\c1ccc(F)cc1 Amb23442931 [0,1,0,0,0,0|0,0,2]=3 947 B11R1.1 OC\C=C\c1ccc(I)cc1 Amb24418980 [0,1,0,0,0,0|0,0,2]=3 948 B11R1.1 OC\C=C\c1ccc(cc1)O Amb2445151 [0,1,0,0,0,0|0,0,2]=3 949 B11R1.1 OC\N=C\c1ccc(Cl)cc1 Amb24466242 [0,1,0,0,0,0|1,0,1]=3 950 B11R1.1 Oc1[n]cc(CCCO)c[n]1 Amb25150392 [0,1,0,0,0,0|2,0,0]=3 951 B11R1.1 Oc1ccc(CCCBr)cc1 Amb25703932 [0,1,0,0,0,0|1,0,0]=2 952 B11R1.1 Oc1ccc(CNC=O)cc1 Amb25172814 [0,1,0,0,0,0|1,0,2]=4 953 B11R1.1 Oc1ccc(C\C=C\Cl)cc1 Amb25724911 [0,1,0,0,0,0|1,0,2]=4 954 B11R1.1 Oc1ccc(C\C=N\O)cc1 Amb25705671 [0,1,0,0,0,0|1,0,1]=3 955 B11R1.1 Oc1ccc(NCCO)[n][n]1 Amb21984450 [0,1,0,0,0,0|3,0,0]=4 956 B11R1.1 Oc1ccc(NCCO)[n]c1 Amb24458585 [0,1,0,0,0,0|2,0,0]=3 957 B11R1.1 Oc1ccc([n]c1)OCCO Amb24433383 [0,1,0,0,0,0|2,0,0]=3 958 B11R1.1 Oc1ccc(\C=C/CO)cc1 Amb25720012 [0,1,0,0,0,0|0,0,2]=3 959 B11R1.1 Oc1ccc(\C=C\CCl)cc1 Amb24598884 [0,1,0,0,0,0|1,0,2]=4 960 B11R1.1 Oc1ccc(cc1)C#CCCl Amb25315448 [0,1,0,0,0,0|1,0,2]=4 961 B11R1.1 Oc1ccc(cc1)C#CCI Amb25341074 [0,1,0,0,0,0|1,0,2]=4 962 B11R1.1 Oc1ccc(cc1)OCC=O Amb18125345 [0,1,0,0,0,0|1,0,2]=4 963 B11R1.1 Oc1ccc(cc1)OCCCl Amb18126982 [0,1,0,0,0,0|2,0,0]=3 964 B11R1.1 Oc1ccc(cc1)OCCF Amb24543531 [0,1,0,0,0,0|2,0,0]=3 965 B11R1.1 Oc1ccc(cc1)SCCCl Amb18650050 [0,1,0,0,0,0|2,0,0]=3 966 B11R1.1 Oc1ccc(cc1)SCCF Amb25699332 [0,1,0,0,0,0|2,0,0]=3 967 B11R1.1 S=C=NCc1ccc(I)cc1 Amb24504908 [0,1,0,0,0,0|1,1,1]=4 968 B11R1.1 S=C=NCc1ccc(cc1)Cl Amb2092731 [0,1,0,0,0,0|1,1,1]=4 969 B11R1.1 S=C=NCc1ccc(cc1)O Amb17615159 [0,1,0,0,0,0|1,1,1]=4 970 B11R1.1 SCCCc1ccc(cc1)Br Amb17407562 [0,1,0,0,0,0|0,1,0]=2 971 B11R1.1 SCCCc1ccc(cc1)C Amb17400220 [0,1,0,0,0,0|0,1,0]=2 972 B11R1.1 SCCCc1ccc(cc1)Cl Amb17401097 [0,1,0,0,0,0|0,1,0]=2 973 B11R1.1 SCCCc1ccc(cc1)F Amb17400333 [0,1,0,0,0,0|0,1,0]=2 974 B11R1.1 SCCNc1ccc(Cl)cc1 Amb25696044 [0,1,0,0,0,0|1,1,0]=3 975 B11R1.1 SCCOc1ccc(cc1)F Amb17232868 [0,1,0,0,0,0|1,1,0]=3 976 B11R1.1 SCCOc1ccc(cc1)N Amb17504126 [0,1,0,0,0,0|1,1,0]=3 977 B11R1.1 SCCSc1ccc(Cl)c[n]1 Amb24354265 [0,1,0,0,0,0|2,1,0]=4 978 B11R1.1 SCCSc1ccc(cc1)C Amb13881735 [0,1,0,0,0,0|1,1,0]=3 979 B11R1.1 SCCSc1ccc(cc1)Cl Amb13881736 [0,1,0,0,0,0|1,1,0]=3 980 B11R1.1 [C-]#[N+]CCc1ccc(O)cc1 Amb25730088 [0,1,0,0,0,0|2,0,0]=3 981 B11R1.1 [C-]#[N+]CSc1ccc(C)cc1 Amb25777926 [0,1,0,0,0,0|3,0,0]=4 982 B11R1.1 [N-]=[N+]=NCc1ccc(I)cc1 Amb22059741 [0,1,0,0,0,0|3,0,0]=4 983 B11R1.1 [NH3+]c1ccc(cc1)OCCF Amb22455028 [0,1,0,0,0,0|2,0,0]=3 984 B11R1.16 BrCCC(Br)c1ccccc1 Amb23456167 [0,1,0,0,0,0|1,0,0]=2 985 B11R1.16 C#CCC(Cl)c1ccccc1 Amb25264417 [0,1,0,0,0,0|1,0,1]=3 986 B11R1.16 C#CCC(N)c1c[n]ccc1 Amb18959769 [0,1,0,0,0,0|2,0,1]=4 987 B11R1.16 C#CCC(N)c1cc[n]cc1 Amb18959770 [0,1,0,0,0,0|2,0,1]=4 988 B11R1.16 C#CCC(N)c1cccc[n]1 Amb18284997 [0,1,0,0,0,0|2,0,1]=4 989 B11R1.16 C#CCC(N)c1ccccc1 Amb18959773 [0,1,0,0,0,0|1,0,1]=3 990 B11R1.16 C#CCC(O)c1c[n]ccc1 Amb22756005 [0,1,0,0,0,0|2,0,1]=4 991 B11R1.16 C#CCC(O)c1cccc[n]1 Amb19373060 [0,1,0,0,0,0|2,0,1]=4 992 B11R1.16 C#CCS(=O)c1ccccc1 Amb25241742 [0,1,0,0,0,0|2,0,1]=4 993 B11R1.16 C#CC[C@@H](N)c1ccccc1 Amb24181858 [0,1,0,0,0,0|1,0,1]=3 994 B11R1.16 C#CC[C@H](N)c1ccccc1 Amb25169470 [0,1,0,0,0,0|1,0,1]=3 995 B11R1.16 C#CC[C@H](O)c1c[n]ccc1 Amb25373838 [0,1,0,0,0,0|2,0,1]=4 996 B11R1.16 C=C=CC(O)c1ccccc1 Amb25198813 [0,1,0,0,0,0|1,0,2]=4 997 B11R1.16 C=C=C[C@@H](O)c1ccccc1 Amb25045780 [0,1,0,0,0,0|1,0,2]=4 998 B11R1.16 C=CCC(=O)c1ccccc1 Amb17334260 [0,1,0,0,0,0|1,0,2]=4 999 B11R1.16 C=CCC(Br)c1ccccc1 Amb24668989 [0,1,0,0,0,0|1,0,1]=3 1000 B11R1.16 C=CCC(N)c1c[n]ccc1 Amb18292092 [0,1,0,0,0,0|2,0,1]=4 1001 B11R1.16 C=CCC(N)c1cc[n]cc1 Amb18292093 [0,1,0,0,0,0|2,0,1]=4 1002 B11R1.16 C=CCC(N)c1cc[n]cc1 Amb19374106 [0,1,0,0,0,0|2,0,1]=4 1003 B11R1.16 C=CCC(N)c1cccc[n]1 Amb18977590 [0,1,0,0,0,0|2,0,1]=4 1004 B11R1.16 C=CCC(N)c1ccccc1 Amb22831520 [0,1,0,0,0,0|1,0,1]=3 1005 B11R1.16 C=CCC(O)c1cccc[n]1 Amb25735233 [0,1,0,0,0,0|2,0,1]=4 1006 B11R1.16 C=CCC(O)c1ccccc1 Amb22228007 [0,1,0,0,0,0|1,0,1]=3 1007 B11R1.16 C=CCC(c1ccccc1)N Amb17226687 [0,1,0,0,0,0|1,0,1]=3 1008 B11R1.16 C=CCC(c1ccccc1)O Amb2389146 [0,1,0,0,0,0|1,0,1]=3 1009 B11R1.16 C=CCN(c1ccccc1)N Amb17226668 [0,1,0,0,0,0|2,0,1]=4 1010 B11R1.16 C=CCS(=O)c1ccccc1 Amb17933936 [0,1,0,0,0,0|2,0,1]=4 1011 B11R1.16 C=CC[C@@H](N)c1c[n]ccc1 Amb24487504 [0,1,0,0,0,0|2,0,1]=4 1012 B11R1.16 C=CC[C@@H](N)c1cccc[n]1 Amb25844369 [0,1,0,0,0,0|2,0,1]=4 1013 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22829899 [0,1,0,0,0,0|1,0,1]=3 1014 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22831832 [0,1,0,0,0,0|1,0,1]=3 1015 B11R1.16 C=CC[C@@H](O)c1ccccc1 Amb24726216 [0,1,0,0,0,0|1,0,1]=3 1016 B11R1.16 C=CC[C@H](N)c1c[n]ccc1 Amb24699940 [0,1,0,0,0,0|2,0,1]=4 1017 B11R1.16 C=CC[C@H](N)c1cccc[n]1 Amb25117558 [0,1,0,0,0,0|2,0,1]=4 1018 B11R1.16 C=CC[C@H](O)c1c[n]ccc1 Amb25724316 [0,1,0,0,0,0|2,0,1]=4 1019 B11R1.16 C=CC[C@H](O)c1cc[n]cc1 Amb25854958 [0,1,0,0,0,0|2,0,1]=4 1020 B11R1.16 C=CC[S@@](=O)c1ccccc1 Amb22747466 [0,1,0,0,0,0|2,0,1]=4 1021 B11R1.16 CC#CC(N)c1ccccc1 Amb25113894 [0,1,0,0,0,0|1,0,2]=4 1022 B11R1.16 CC#CC(O)c1ccccc1 Amb25148346 [0,1,0,0,0,0|1,0,2]=4 1023 B11R1.16 CC#C[C@@H](O)c1ccccc1 Amb25188578 [0,1,0,0,0,0|1,0,2]=4 1024 B11R1.16 CC(=CCC)c1ccccc1 Amb22228912 [0,1,0,0,0,0|1,0,2]=4 1025 B11R1.16 CC(CC#C)c1ccccc1 Amb18117214 [0,1,0,0,0,0|1,0,1]=3 1026 B11R1.16 CC(CC#N)c1cc[n]cc1 Amb18124804 [0,1,0,0,0,0|2,0,1]=4 1027 B11R1.16 CC(CC#N)c1cccc[n]1 Amb25073965 [0,1,0,0,0,0|2,0,1]=4 1028 B11R1.16 CC(CC=C)c1c[n]ccc1 Amb24085283 [0,1,0,0,0,0|2,0,1]=4 1029 B11R1.16 CC(CC=C)c1ccccc1 Amb25829403 [0,1,0,0,0,0|1,0,1]=3 1030 B11R1.16 CC(CC=O)c1c[n]ccc1 Amb18125013 [0,1,0,0,0,0|1,0,2]=4 1031 B11R1.16 CC(CC=O)c1cc[n]cc1 Amb25283017 [0,1,0,0,0,0|1,0,2]=4 1032 B11R1.16 CC(CCN)c1c[n]c[n]c1 Amb24467901 [0,1,0,0,0,0|3,0,0]=4 1033 B11R1.16 CC(CCN)c1c[n]ccc1 Amb18293554 [0,1,0,0,0,0|2,0,0]=3 1034 B11R1.16 CC(CCN)c1cc[n]cc1 Amb18293553 [0,1,0,0,0,0|2,0,0]=3 1035 B11R1.16 CC(CCN)c1cccc[n]1 Amb18981390 [0,1,0,0,0,0|2,0,0]=3 1036 B11R1.16 CC(CCN)c1ccccc1 Amb17991256 [0,1,0,0,0,0|1,0,0]=2 1037 B11R1.16 CC(CCO)c1c[n]ccc1 Amb25808756 [0,1,0,0,0,0|1,0,0]=2 1038 B11R1.16 CC(CNN)c1c[n]ccc1 Amb25734660 [0,1,0,0,0,0|3,0,0]=4 1039 B11R1.16 CC(CNN)c1ccccc1 Amb18791463 [0,1,0,0,0,0|2,0,0]=3 1040 B11R1.16 CC(C[Zn]Br)c1ccccc1 Amb22897843 [0,1,0,0,0,0|2,0,0]=3 1041 B11R1.16 CC(N=[N+]=[N-])c1ccccc1 Amb18632995 [0,1,0,0,0,0|3,0,0]=4 1042 B11R1.16 CC(NC=S)c1ccccc1 Amb25191191 [0,1,0,0,0,0|1,1,1]=4 1043 B11R1.16 CC(NN=O)c1ccccc1 Amb24392128 [0,1,0,0,0,0|2,0,1]=4 1044 B11R1.16 CC(OC=C)c1ccccc1 Amb22522122 [0,1,0,0,0,0|2,0,1]=4 1045 B11R1.16 CC(OC=O)c1ccccc1 Amb22735162 [0,1,0,0,0,0|1,0,2]=4 1046 B11R1.16 CC(OCO)c1ccccc1 Amb24613529 [0,1,0,0,0,0|1,0,0]=2 1047 B11R1.16 CC(SCCl)c1ccccc1 Amb24487902 [0,1,0,0,0,0|2,0,0]=3 1048 B11R1.16 CC(\C=C\Cl)c1ccccc1 Amb24710339 [0,1,0,0,0,0|1,0,2]=4 1049 B11R1.16 CC(\C=N\N)c1ccccc1 Amb24412748 [0,1,0,0,0,0|2,0,1]=4 1050 B11R1.16 CC(c1ccccc1)CC#N Amb17593643 [0,1,0,0,0,0|1,0,1]=3 1051 B11R1.16 CC(c1ccccc1)N=C=O Amb2092860 [0,1,0,0,0,0|1,0,2]=4 1052 B11R1.16 CC=CC(O)c1ccccc1 Amb22228005 [0,1,0,0,0,0|1,0,2]=4 1053 B11R1.16 CCCC(=C)c1ccccc1 Amb24669524 [0,1,0,0,0,0|1,0,1]=3 1054 B11R1.16 CCCC(=O)c1cc[n]cc1 Amb22235246 [0,1,0,0,0,0|2,0,1]=4 1055 B11R1.16 CCCC(=O)c1cccnc1 Amb17232054 [0,1,0,0,0,0|2,0,1]=4 1056 B11R1.16 CCCC(Br)c1cccc[n]1 Amb25675709 [0,1,0,0,0,0|2,0,0]=3 1057 B11R1.16 CCCC(Cl)c1c[n]c[n]c1 Amb25369663 [0,1,0,0,0,0|3,0,0]=4 1058 B11R1.16 CCCC(Cl)c1cc[n]cc1 Amb24102654 [0,1,0,0,0,0|2,0,0]=3 1059 B11R1.16 CCCC(N)c1[n]ccc[n]1 Amb18984962 [0,1,0,0,0,0|3,0,0]=4 1060 B11R1.16 CCCC(N)c1c[n]c[n]c1 Amb18991851 [0,1,0,0,0,0|3,0,0]=4 1061 B11R1.16 CCCC(N)c1c[n]ccc1 Amb18984960 [0,1,0,0,0,0|2,0,0]=3 1062 B11R1.16 CCCC(N)c1cc[n]c[n]1 Amb25293433 [0,1,0,0,0,0|3,0,0]=4 1063 B11R1.16 CCCC(N)c1cc[n]cc1 Amb18984961 [0,1,0,0,0,0|2,0,0]=3 1064 B11R1.16 CCCC(N)c1cccc[n]1 Amb18984959 [0,1,0,0,0,0|2,0,0]=3 1065 B11R1.16 CCCC(O)c1[n]ccc[n]1 Amb18179424 [0,1,0,0,0,0|3,0,0]=4 1066 B11R1.16 CCCC(O)c1c[n]c[n]c1 Amb18799414 [0,1,0,0,0,0|3,0,0]=4 1067 B11R1.16 CCCC(O)c1c[n]cc[n]1 Amb18179423 [0,1,0,0,0,0|3,0,0]=4 1068 B11R1.16 CCCC(O)c1cc[n]c[n]1 Amb25145824 [0,1,0,0,0,0|3,0,0]=4 1069 B11R1.16 CCCC(O)c1cc[n]cc1 Amb18179398 [0,1,0,0,0,0|2,0,0]=3 1070 B11R1.16 CCCC(O)c1cccc[n]1 Amb18179397 [0,1,0,0,0,0|2,0,0]=3 1071 B11R1.16 CCCC(c1ccccc1)[NH3+] Amb10560246 [0,1,0,0,0,0|1,0,0]=2 1072 B11R1.16 CCCC(c1cccnc1)O Amb17232090 [0,1,0,0,0,0|2,0,0]=3 1073 B11R1.16 CCCC(c1cnccn1)N Amb17505550 [0,1,0,0,0,0|3,0,0]=4 1074 B11R1.16 CCCN(C)c1cccc[n]1 Amb24719444 [0,1,0,0,0,0|3,0,0]=4 1075 B11R1.16 CCCN(O)c1ccccc1 Amb25349642 [0,1,0,0,0,0|2,0,0]=3 1076 B11R1.16 CCC[C@@H](N)c1c[n]cc[n]1 Amb24484506 [0,1,0,0,0,0|3,0,0]=4 1077 B11R1.16 CCC[C@@H](N)c1c[n]ccc1 Amb24617547 [0,1,0,0,0,0|2,0,0]=3 1078 B11R1.16 CCC[C@@H](N)c1cc[n]c[n]1 Amb25120203 [0,1,0,0,0,0|3,0,0]=4 1079 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb22388605 [0,1,0,0,0,0|1,0,0]=2 1080 B11R1.16 CCC[C@@H](O)c1c[n]c[n]c1 Amb24622286 [0,1,0,0,0,0|3,0,0]=4 1081 B11R1.16 CCC[C@@H](O)c1cc[n]cc1 Amb24429371 [0,1,0,0,0,0|2,0,0]=3 1082 B11R1.16 CCC[C@@H](O)c1cccc[n]1 Amb25795692 [0,1,0,0,0,0|2,0,0]=3 1083 B11R1.16 CCC[C@@H](O)c1ccccc1 Amb22338826 [0,1,0,0,0,0|1,0,0]=2 1084 B11R1.16 CCC[C@H](N)c1cc[n]c[n]1 Amb25150206 [0,1,0,0,0,0|3,0,0]=4 1085 B11R1.16 CCC[C@H](N)c1cccc[n]1 Amb25836783 [0,1,0,0,0,0|2,0,0]=3 1086 B11R1.16 CCC[C@H](N)c1ccccc1 Amb20241164 [0,1,0,0,0,0|1,0,0]=2 1087 B11R1.16 CCC[C@H](N)c1ccccc1 Amb23385315 [0,1,0,0,0,0|1,0,0]=2 1088 B11R1.16 CCC[C@H](O)c1c[n]ccc1 Amb25845549 [0,1,0,0,0,0|2,0,0]=3 1089 B11R1.16 CCC[C@H](O)c1cc[n]cc1 Amb24414462 [0,1,0,0,0,0|2,0,0]=3 1090 B11R1.16 CCC[C@H](O)c1ccccc1 Amb22338698 [0,1,0,0,0,0|1,0,0]=2 1091 B11R1.16 CCC[C@H](c1ccccc1)N Amb16233791 [0,1,0,0,0,0|1,0,0]=2 1092 B11R1.16 CCNC(=N)c1ccccc1 Amb23447118 [0,1,0,0,0,0|2,0,1]=4 1093 B11R1.16 CCNC(C)c1cc[n]cc1 Amb19515613 [0,1,0,0,0,0|3,0,0]=4 1094 B11R1.16 CCNC(c1ccccc1)C Amb1771733 [0,1,0,0,0,0|2,0,0]=3 1095 B11R1.16 CCN[C@H](C)c1c[n]ccc1 Amb25114990 [0,1,0,0,0,0|3,0,0]=4 1096 B11R1.16 CCN[C@H](C)c1ccccc1 Amb24363134 [0,1,0,0,0,0|2,0,0]=3 1097 B11R1.16 CCOC(=C)c1ccccc1 Amb24495644 [0,1,0,0,0,0|2,0,1]=4 1098 B11R1.16 CCOC(=N)c1ccccc1 Amb17666955 [0,1,0,0,0,0|2,0,1]=4 1099 B11R1.16 CCOC(=O)c1ccccc1 Amb22367067 [0,1,0,0,0,0|2,0,1]=4 1100 B11R1.16 CCOC(=[NH2+])c1ccccc1 Amb22445379 [0,1,0,0,0,0|2,0,1]=4 1101 B11R1.16 CCOC(C)c1c[n]ccc1 Amb24085116 [0,1,0,0,0,0|3,0,0]=4 1102 B11R1.16 CCOC(C)c1ccccc1 Amb17940188 [0,1,0,0,0,0|2,0,0]=3 1103 B11R1.16 CCOC(Cl)c1ccccc1 Amb24419639 [0,1,0,0,0,0|2,0,0]=3 1104 B11R1.16 CCOC(O)c1c[n]ccc1 Amb24379956 [0,1,0,0,0,0|3,0,0]=4 1105 B11R1.16 CCOC(O)c1cccc[n]1 Amb25057798 [0,1,0,0,0,0|3,0,0]=4 1106 B11R1.16 CCOP(=O)c1ccccc1 Amb10601587 [0,1,0,0,0,0|3,0,0]=4 1107 B11R1.16 CCSC(C)c1c[n]ccc1 Amb25099407 [0,1,0,0,0,0|3,0,0]=4 1108 B11R1.16 CCSC(Cl)c1ccccc1 Amb25109977 [0,1,0,0,0,0|2,0,0]=3 1109 B11R1.16 CC\N=C(\Cl)/c1ccccc1 Amb24463735 [0,1,0,0,0,0|2,0,1]=4 1110 B11R1.16 CN(CC#C)c1ccccc1 Amb19514873 [0,1,0,0,0,0|2,0,1]=4 1111 B11R1.16 CN(CCBr)c1ccccc1 Amb24477466 [0,1,0,0,0,0|2,0,0]=3 1112 B11R1.16 CN(CCCl)c1cccc[n]1 Amb24695070 [0,1,0,0,0,0|3,0,0]=4 1113 B11R1.16 CN(CCF)c1ccccc1 Amb24485344 [0,1,0,0,0,0|2,0,0]=3 1114 B11R1.16 CN(CCN)c1cc[n]cc1 Amb18993102 [0,1,0,0,0,0|3,0,0]=4 1115 B11R1.16 CN(CCN)c1cccc[n]1 Amb18302344 [0,1,0,0,0,0|3,0,0]=4 1116 B11R1.16 CN(CCO)c1[n]ccc[n]1 Amb18182843 [0,1,0,0,0,0|3,0,0]=4 1117 B11R1.16 CN(CCO)c1c[n][n]cc1 Amb24618695 [0,1,0,0,0,0|3,0,0]=4 1118 B11R1.16 CN(CCO)c1cc[n]c[n]1 Amb18177262 [0,1,0,0,0,0|3,0,0]=4 1119 B11R1.16 CN(CCO)c1cc[n]cc1 Amb18179433 [0,1,0,0,0,0|2,0,0]=3 1120 B11R1.16 CN(CCO)c1cc[n]cc1 Amb19373596 [0,1,0,0,0,0|2,0,0]=3 1121 B11R1.16 CN(CCO)c1ccc[n][n]1 Amb18182850 [0,1,0,0,0,0|3,0,0]=4 1122 B11R1.16 CN(CCO)c1cccc[n]1 Amb21955495 [0,1,0,0,0,0|2,0,0]=3 1123 B11R1.16 CN(c1cnccn1)CCO Amb2445427 [0,1,0,0,0,0|3,0,0]=4 1124 B11R1.16 CNCC(=C)c1ccccc1 Amb18124860 [0,1,0,0,0,0|2,0,1]=4 1125 B11R1.16 CNCC(Br)c1ccccc1 Amb25224394 [0,1,0,0,0,0|2,0,0]=3 1126 B11R1.16 CNCC(C)c1cccc[n]1 Amb18644449 [0,1,0,0,0,0|3,0,0]=4 1127 B11R1.16 CNCC(F)c1cc[n]cc1 Amb25331906 [0,1,0,0,0,0|3,0,0]=4 1128 B11R1.16 CNCC(F)c1ccccc1 Amb24710254 [0,1,0,0,0,0|2,0,0]=3 1129 B11R1.16 CNCC(N)c1ccccc1 Amb18290185 [0,1,0,0,0,0|2,0,0]=3 1130 B11R1.16 CNCC(O)c1c[n]ccc1 Amb19515701 [0,1,0,0,0,0|3,0,0]=4 1131 B11R1.16 CNCC(S)c1ccccc1 Amb25685409 [0,1,0,0,0,0|2,0,0]=3 1132 B11R1.16 CNCC(c1ccccc1)C Amb17619365 [0,1,0,0,0,0|2,0,0]=3 1133 B11R1.16 CNCC(c1ccccc1)N Amb13883001 [0,1,0,0,0,0|2,0,0]=3 1134 B11R1.16 CNCC(c1ccccn1)O Amb17138440 [0,1,0,0,0,0|3,0,0]=4 1135 B11R1.16 CNCC(c1cccnc1)O Amb17138441 [0,1,0,0,0,0|3,0,0]=4 1136 B11R1.16 CNCC(c1ccncc1)O Amb17138442 [0,1,0,0,0,0|3,0,0]=4 1137 B11R1.16 CNC[C@@H](N)c1ccccc1 Amb24487965 [0,1,0,0,0,0|2,0,0]=3 1138 B11R1.16 CNC[C@H](C)c1ccccc1 Amb24399611 [0,1,0,0,0,0|2,0,0]=3 1139 B11R1.16 CNC[C@H](N)c1ccccc1 Amb25040662 [0,1,0,0,0,0|2,0,0]=3 1140 B11R1.16 CNC[C@H](O)c1c[n]ccc1 Amb25172815 [0,1,0,0,0,0|3,0,0]=4 1141 B11R1.16 CNC[C@H](O)c1ccccc1 Amb25674653 [0,1,0,0,0,0|2,0,0]=3 1142 B11R1.16 CNNC(Br)c1ccccc1 Amb24643804 [0,1,0,0,0,0|3,0,0]=4 1143 B11R1.16 COCC(Br)c1cccc[n]1 Amb24469291 [0,1,0,0,0,0|3,0,0]=4 1144 B11R1.16 COCC(C)c1ccccc1 Amb24079980 [0,1,0,0,0,0|2,0,0]=3 1145 B11R1.16 COCC(Cl)c1ccccc1 Amb24509304 [0,1,0,0,0,0|2,0,0]=3 1146 B11R1.16 COCC(N)c1c[n]ccc1 Amb18292631 [0,1,0,0,0,0|3,0,0]=4 1147 B11R1.16 COCC(O)c1c[n]ccc1 Amb18179473 [0,1,0,0,0,0|3,0,0]=4 1148 B11R1.16 COCC(O)c1ccccc1 Amb18791504 [0,1,0,0,0,0|2,0,0]=3 1149 B11R1.16 COCC(S)c1ccccc1 Amb25698414 [0,1,0,0,0,0|2,0,0]=3 1150 B11R1.16 COCC(c1ccccc1)N Amb1134749 [0,1,0,0,0,0|2,0,0]=3 1151 B11R1.16 COCC(c1ccccc1)N Amb13952604 [0,1,0,0,0,0|2,0,0]=3 1152 B11R1.16 COCC(c1ccccn1)N Amb10607922 [0,1,0,0,0,0|3,0,0]=4 1153 B11R1.16 COCC(c1ccccn1)N Amb13949181 [0,1,0,0,0,0|3,0,0]=4 1154 B11R1.16 COC[C@@H](N)c1c[n]ccc1 Amb24351094 [0,1,0,0,0,0|3,0,0]=4 1155 B11R1.16 COC[C@@H](N)c1cc[n]cc1 Amb24428710 [0,1,0,0,0,0|3,0,0]=4 1156 B11R1.16 COC[C@@H](N)c1cccc[n]1 Amb25104762 [0,1,0,0,0,0|3,0,0]=4 1157 B11R1.16 COC[C@@H](O)c1ccccc1 Amb22746575 [0,1,0,0,0,0|2,0,0]=3 1158 B11R1.16 COC[C@H](N)c1c[n]ccc1 Amb24533043 [0,1,0,0,0,0|3,0,0]=4 1159 B11R1.16 COC[C@H](N)c1ccccc1 Amb22737495 [0,1,0,0,0,0|2,0,0]=3 1160 B11R1.16 COC[C@H](c1ccccc1)N Amb17061641 [0,1,0,0,0,0|2,0,0]=3 1161 B11R1.16 CONC(C)c1ccccc1 Amb22896960 [0,1,0,0,0,0|3,0,0]=4 1162 B11R1.16 CP(CCN)c1ccccc1 Amb25685240 [0,1,0,0,0,0|2,0,0]=3 1163 B11R1.16 CSCC(C)c1ccccc1 Amb25143821 [0,1,0,0,0,0|2,0,0]=3 1164 B11R1.16 CSCC(N)c1c[n]ccc1 Amb18300195 [0,1,0,0,0,0|3,0,0]=4 1165 B11R1.16 CSCC(N)c1ccccc1 Amb18300065 [0,1,0,0,0,0|2,0,0]=3 1166 B11R1.16 CSCC(O)c1c[n]ccc1 Amb18801395 [0,1,0,0,0,0|3,0,0]=4 1167 B11R1.16 CSCC(O)c1ccccc1 Amb18793198 [0,1,0,0,0,0|2,0,0]=3 1168 B11R1.16 CSC[C@@H](N)c1ccccc1 Amb25368447 [0,1,0,0,0,0|2,0,0]=3 1169 B11R1.16 C[C@@H](CCBr)c1ccccc1 Amb24395063 [0,1,0,0,0,0|1,0,0]=2 1170 B11R1.16 C[C@@H](N=[N+]=[N-])c1ccccc1 Amb24671324 [0,1,0,0,0,0|3,0,0]=4 1171 B11R1.16 C[C@H](CC=O)c1ccccc1 Amb25843699 [0,1,0,0,0,0|0,0,2]=3 1172 B11R1.16 C[C@H](CCBr)c1ccccc1 Amb25690423 [0,1,0,0,0,0|1,0,0]=2 1173 B11R1.16 C[C@H](CCO)c1ccccc1 Amb24371178 [0,1,0,0,0,0|0,0,0]=1 1174 B11R1.16 C[C@H](NC=O)c1ccccc1 Amb24696096 [0,1,0,0,0,0|1,0,2]=4 1175 B11R1.16 C\C(=C/CC)\c1ccccc1 Amb25151168 [0,1,0,0,0,0|1,0,2]=4 1176 B11R1.16 C\C(=C/CN)\c1ccccc1 Amb23555622 [0,1,0,0,0,0|1,0,2]=4 1177 B11R1.16 C\C(=C/CO)\c1cccc[n]1 Amb24373086 [0,1,0,0,0,0|1,0,2]=4 1178 B11R1.16 C\C(=C\CCl)\c1ccccc1 Amb24579744 [0,1,0,0,0,0|1,0,2]=4 1179 B11R1.16 C\C(=C\CN)\c1ccccc1 Amb25145810 [0,1,0,0,0,0|1,0,2]=4 1180 B11R1.16 C\C(=C\CO)\c1cccc[n]1 Amb24563551 [0,1,0,0,0,0|1,0,2]=4 1181 B11R1.16 C\C(=N\CO)\c1cccc[n]1 Amb24069128 [0,1,0,0,0,0|2,0,1]=4 1182 B11R1.16 C\C=C\C(N)c1ccccc1 Amb18124850 [0,1,0,0,0,0|1,0,2]=4 1183 B11R1.16 C\C=C\[C@@H](O)c1ccccc1 Amb25760539 [0,1,0,0,0,0|1,0,2]=4 1184 B11R1.16 C\C=C\[C@H](O)c1ccccc1 Amb25190477 [0,1,0,0,0,0|1,0,2]=4 1185 B11R1.16 ClCCC(Br)c1ccccc1 Amb21856734 [0,1,0,0,0,0|1,0,0]=2 1186 B11R1.16 ClCCC(Cl)c1ccccc1 Amb17872667 [0,1,0,0,0,0|1,0,0]=2 1187 B11R1.16 ClCCC(c1ccccc1)C Amb17232691 [0,1,0,0,0,0|1,0,0]=2 1188 B11R1.16 ClCCC(c1ccccc1)O Amb17611064 [0,1,0,0,0,0|1,0,0]=2 1189 B11R1.16 ClCCN(c1ccccc1)C Amb17334788 [0,1,0,0,0,0|2,0,0]=3 1190 B11R1.16 ClCCP(Cl)c1ccccc1 Amb24398805 [0,1,0,0,0,0|2,0,0]=3 1191 B11R1.16 ClCC[C@@H](c1ccccc1)O Amb17611058 [0,1,0,0,0,0|1,0,0]=2 1192 B11R1.16 ClC\C=C(\Br)/c1ccccc1 Amb25777111 [0,1,0,0,0,0|1,0,2]=4 1193 B11R1.16 Cl\C=C\C(Cl)c1ccccc1 Amb24634048 [0,1,0,0,0,0|1,0,2]=4 1194 B11R1.16 FCCC(=O)c1ccccc1 Amb10603695 [0,1,0,0,0,0|1,0,1]=3 1195 B11R1.16 N#CCC(=O)c1ccccc1 Amb1644485 [0,1,0,0,0,0|1,0,2]=4 1196 B11R1.16 N#CCC(Cl)c1ccccc1 Amb25238256 [0,1,0,0,0,0|1,0,1]=3 1197 B11R1.16 N#CCC(F)c1ccccc1 Amb25127669 [0,1,0,0,0,0|1,0,1]=3 1198 B11R1.16 N#CCC(O)c1c[n]ccc1 Amb24062545 [0,1,0,0,0,0|2,0,1]=4 1199 B11R1.16 N#CCC(O)c1cccc[n]1 Amb25149159 [0,1,0,0,0,0|2,0,1]=4 1200 B11R1.16 N#CCS(=O)c1ccccc1 Amb22505329 [0,1,0,0,0,0|2,0,1]=4 1201 B11R1.16 N#CC[C@@H](O)c1c[n]ccc1 Amb24675507 [0,1,0,0,0,0|2,0,1]=4 1202 B11R1.16 N#CC[C@@H](O)c1ccccc1 Amb25680039 [0,1,0,0,0,0|1,0,1]=3 1203 B11R1.16 N#CC[C@H](O)c1cc[n]cc1 Amb24398008 [0,1,0,0,0,0|2,0,1]=4 1204 B11R1.16 N#CC[C@H](O)c1ccccc1 Amb24617537 [0,1,0,0,0,0|1,0,1]=3 1205 B11R1.16 N=CCC(=O)c1ccccc1 Amb24408300 [0,1,0,0,0,0|1,0,2]=4 1206 B11R1.16 NC(CC#N)c1c[n]ccc1 Amb18064998 [0,1,0,0,0,0|2,0,1]=4 1207 B11R1.16 NC(CC#N)c1cc[n]cc1 Amb18065148 [0,1,0,0,0,0|2,0,1]=4 1208 B11R1.16 NC(CC#N)c1cccc[n]1 Amb18064993 [0,1,0,0,0,0|2,0,1]=4 1209 B11R1.16 NC(CC#N)c1ccccc1 Amb18964887 [0,1,0,0,0,0|1,0,1]=3 1210 B11R1.16 NC(CC#N)c1ccccc1 Amb20632783 [0,1,0,0,0,0|1,0,1]=3 1211 B11R1.16 NC(CCCl)c1cccc[n]1 Amb24355932 [0,1,0,0,0,0|2,0,0]=3 1212 B11R1.16 NC(CCO)c1c[n]cc[n]1 Amb22296969 [0,1,0,0,0,0|2,0,0]=3 1213 B11R1.16 NC(CCO)c1cc[n]c[n]1 Amb25093068 [0,1,0,0,0,0|2,0,0]=3 1214 B11R1.16 NC(CCO)c1cccc[n]1 Amb18120551 [0,1,0,0,0,0|1,0,0]=2 1215 B11R1.16 NC(CCO)c1ccccc1 Amb22730035 [0,1,0,0,0,0|0,0,0]=1 1216 B11R1.16 NCCC(=O)c1cc[n]cc1 Amb18639595 [0,1,0,0,0,0|2,0,1]=4 1217 B11R1.16 NCCC(=O)c1ccc[n]c1 Amb18121496 [0,1,0,0,0,0|2,0,1]=4 1218 B11R1.16 NCCC(=O)c1cccc[n]1 Amb18121375 [0,1,0,0,0,0|2,0,1]=4 1219 B11R1.16 NCCC(Cl)c1ccccc1 Amb24487859 [0,1,0,0,0,0|1,0,0]=2 1220 B11R1.16 NCCC(F)c1c[n]cc[n]1 Amb24486934 [0,1,0,0,0,0|3,0,0]=4 1221 B11R1.16 NCCC(F)c1cc[n]cc1 Amb25329368 [0,1,0,0,0,0|2,0,0]=3 1222 B11R1.16 NCCC(N)c1cccc[n]1 Amb24580750 [0,1,0,0,0,0|2,0,0]=3 1223 B11R1.16 NCCC(N)c1ccccc1 Amb18972395 [0,1,0,0,0,0|1,0,0]=2 1224 B11R1.16 NCCC(O)c1c[n]cc[n]1 Amb23512600 [0,1,0,0,0,0|3,0,0]=4 1225 B11R1.16 NCCC(O)c1c[n]ccc1 Amb18639338 [0,1,0,0,0,0|2,0,0]=3 1226 B11R1.16 NCCC(O)c1cc[n]cc1 Amb18121042 [0,1,0,0,0,0|2,0,0]=3 1227 B11R1.16 NCCC(O)c1cccc[n]1 Amb18121017 [0,1,0,0,0,0|2,0,0]=3 1228 B11R1.16 NCCC(O)c1ccccc1 Amb21984527 [0,1,0,0,0,0|1,0,0]=2 1229 B11R1.16 NCCC(S)c1ccccc1 Amb18251942 [0,1,0,0,0,0|1,0,0]=2 1230 B11R1.16 NCCC(c1ccccc1)O Amb2383139 [0,1,0,0,0,0|1,0,0]=2 1231 B11R1.16 NCCN(c1ccccc1)C Amb13949227 [0,1,0,0,0,0|2,0,0]=3 1232 B11R1.16 NCCN(c1ccccc1)C Amb2371516 [0,1,0,0,0,0|2,0,0]=3 1233 B11R1.16 NCCS(=O)c1ccccc1 Amb18974516 [0,1,0,0,0,0|2,0,0]=3 1234 B11R1.16 NCCS(=O)c1ccccc1 Amb19349568 [0,1,0,0,0,0|2,0,0]=3 1235 B11R1.16 NCC[C@@H](N)c1ccccc1 Amb25210474 [0,1,0,0,0,0|1,0,0]=2 1236 B11R1.16 NCC[C@@H](O)c1ccccc1 Amb22225304 [0,1,0,0,0,0|1,0,0]=2 1237 B11R1.16 NCC[C@H](N)c1cccc[n]1 Amb25326719 [0,1,0,0,0,0|2,0,0]=3 1238 B11R1.16 NCC[C@H](O)c1ccccc1 Amb22226644 [0,1,0,0,0,0|1,0,0]=2 1239 B11R1.16 NCNC(=O)c1ccccc1 Amb24072660 [0,1,0,0,0,0|2,0,1]=4 1240 B11R1.16 NN(CCO)c1ccccc1 Amb24555138 [0,1,0,0,0,0|1,0,0]=2 1241 B11R1.16 NNCC(=O)c1ccccc1 Amb18125154 [0,1,0,0,0,0|2,0,1]=4 1242 B11R1.16 NNCC(F)c1ccccc1 Amb25061630 [0,1,0,0,0,0|2,0,0]=3 1243 B11R1.16 NNCC(O)c1cc[n]cc1 Amb18065401 [0,1,0,0,0,0|3,0,0]=4 1244 B11R1.16 NNCC(O)c1cccc[n]1 Amb18065400 [0,1,0,0,0,0|3,0,0]=4 1245 B11R1.16 NNCC(c1ccccc1)O Amb17232104 [0,1,0,0,0,0|2,0,0]=3 1246 B11R1.16 NNCC(c1cccnc1)O Amb17232118 [0,1,0,0,0,0|3,0,0]=4 1247 B11R1.16 NNC[C@@H](O)c1ccccc1 Amb24466315 [0,1,0,0,0,0|2,0,0]=3 1248 B11R1.16 NNC[C@H](O)c1ccccc1 Amb25236157 [0,1,0,0,0,0|2,0,0]=3 1249 B11R1.16 NOCC(=O)c1ccccc1 Amb22729387 [0,1,0,0,0,0|2,0,1]=4 1250 B11R1.16 NOCC(c1ccccc1)O Amb17334342 [0,1,0,0,0,0|2,0,0]=3 1251 B11R1.16 NOC[C@@H](O)c1ccccc1 Amb25152160 [0,1,0,0,0,0|2,0,0]=3 1252 B11R1.16 NSCC(=O)c1ccccc1 Amb24564884 [0,1,0,0,0,0|2,0,1]=4 1253 B11R1.16 N[C@@H](CC#N)c1cccc[n]1 Amb25843751 [0,1,0,0,0,0|2,0,1]=4 1254 B11R1.16 N[C@@H](CCO)c1cc[n]cc1 Amb25131721 [0,1,0,0,0,0|1,0,0]=2 1255 B11R1.16 N[C@H](CC#N)c1c[n]ccc1 Amb24700424 [0,1,0,0,0,0|2,0,1]=4 1256 B11R1.16 N[C@H](CC#N)c1cc[n]cc1 Amb25090361 [0,1,0,0,0,0|2,0,1]=4 1257 B11R1.16 N[C@H](CC#N)c1cccc[n]1 Amb24761314 [0,1,0,0,0,0|2,0,1]=4 1258 B11R1.16 N[C@H](CCO)c1c[n]cc[n]1 Amb25328092 [0,1,0,0,0,0|2,0,0]=3 1259 B11R1.16 N[C@H](CCO)c1cc[n]cc1 Amb25843798 [0,1,0,0,0,0|1,0,0]=2 1260 B11R1.16 N[C@H](CCO)c1cccc[n]1 Amb25789774 [0,1,0,0,0,0|1,0,0]=2 1261 B11R1.16 N[C@H](CCO)c1ccccc1 Amb22265524 [0,1,0,0,0,0|0,0,0]=1 1262 B11R1.16 O=C(CCCl)c1cc[n]cc1 Amb24117884 [0,1,0,0,0,0|2,0,1]=4 1263 B11R1.16 O=C(CCCl)c1cccc[n]1 Amb24422601 [0,1,0,0,0,0|2,0,1]=4 1264 B11R1.16 O=C(CN=O)c1ccccc1 Amb25821412 [0,1,0,0,0,0|1,0,2]=4 1265 B11R1.16 O=C(NCBr)c1ccccc1 Amb25772077 [0,1,0,0,0,0|2,0,1]=4 1266 B11R1.16 O=C(OCCl)c1ccccc1 Amb19958719 [0,1,0,0,0,0|2,0,1]=4 1267 B11R1.16 O=C(OCI)c1ccccc1 Amb25148286 [0,1,0,0,0,0|2,0,1]=4 1268 B11R1.16 O=CCC(=S)c1ccccc1 Amb25351016 [0,1,0,0,0,0|0,0,3]=4 1269 B11R1.16 O=CCC(Cl)c1ccccc1 Amb24470053 [0,1,0,0,0,0|0,0,2]=3 1270 B11R1.16 O=CCC(S)c1ccccc1 Amb18126455 [0,1,0,0,0,0|0,0,2]=3 1271 B11R1.16 O=CCS(=O)c1ccccc1 Amb25674931 [0,1,0,0,0,0|1,0,2]=4 1272 B11R1.16 O=COC(Cl)c1ccccc1 Amb24710112 [0,1,0,0,0,0|1,0,2]=4 1273 B11R1.16 O=NCC(Cl)c1ccccc1 Amb25177516 [0,1,0,0,0,0|1,0,1]=3 1274 B11R1.16 OC(CC=O)c1cc[n]cc1 Amb24434533 [0,1,0,0,0,0|1,0,2]=4 1275 B11R1.16 OC(CC=O)c1ccccc1 Amb18125126 [0,1,0,0,0,0|0,0,2]=3 1276 B11R1.16 OC(CCF)c1ccccc1 Amb24412986 [0,1,0,0,0,0|1,0,0]=2 1277 B11R1.16 OC(CCS)c1ccccc1 Amb25837914 [0,1,0,0,0,0|0,1,0]=2 1278 B11R1.16 OC(CNO)c1ccccc1 Amb22366087 [0,1,0,0,0,0|1,0,0]=2 1279 B11R1.16 OC(c1ccccc1)C#CBr Amb1083115 [0,1,0,0,0,0|1,0,2]=4 1280 B11R1.16 OCCC(=C)c1ccncc1 Amb10573777 [0,1,0,0,0,0|1,0,1]=3 1281 B11R1.16 OCCC(=O)c1cc[n]cc1 Amb24544067 [0,1,0,0,0,0|1,0,1]=3 1282 B11R1.16 OCCC(=O)c1ccccc1 Amb16231606 [0,1,0,0,0,0|0,0,1]=2 1283 B11R1.16 OCCC(O)c1c[n]cc[n]1 Amb22298360 [0,1,0,0,0,0|2,0,0]=3 1284 B11R1.16 OCCC(O)c1cc[n]cc1 Amb25760239 [0,1,0,0,0,0|1,0,0]=2 1285 B11R1.16 OCCC(O)c1cccc[n]1 Amb22756156 [0,1,0,0,0,0|1,0,0]=2 1286 B11R1.16 OCCC(O)c1ccccc1 Amb17777842 [0,1,0,0,0,0|0,0,0]=1 1287 B11R1.16 OCCC(c1ccccc1)N Amb1993953 [0,1,0,0,0,0|0,0,0]=1 1288 B11R1.16 OCCN(c1ccccn1)C Amb2445428 [0,1,0,0,0,0|2,0,0]=3 1289 B11R1.16 OCC[C@H](O)c1cc[n]cc1 Amb24715913 [0,1,0,0,0,0|1,0,0]=2 1290 B11R1.16 OCNC(=O)c1ccccc1 Amb1200467 [0,1,0,0,0,0|1,0,1]=3 1291 B11R1.16 OCNC(=S)c1ccc[n]c1 Amb24523133 [0,1,0,0,0,0|2,0,1]=4 1292 B11R1.16 OCNC(=S)c1ccccc1 Amb25289021 [0,1,0,0,0,0|1,0,1]=3 1293 B11R1.16 OCOC(=O)c1ccc[n]c1 Amb24062492 [0,1,0,0,0,0|2,0,1]=4 1294 B11R1.16 OCOC(=O)c1ccccc1 Amb25115920 [0,1,0,0,0,0|1,0,1]=3 1295 B11R1.16 OCSC(=S)c1ccccc1 Amb25806661 [0,1,0,0,0,0|1,0,1]=3 1296 B11R1.16 OC\C=C(\Cl)/c1ccccc1 Amb24748632 [0,1,0,0,0,0|0,0,2]=3 1297 B11R1.16 OC\C=C(\F)/c1ccccc1 Amb24355216 [0,1,0,0,0,0|0,0,2]=3 1298 B11R1.16 ONCC(c1ccccn1)O Amb17334345 [0,1,0,0,0,0|2,0,0]=3 1299 B11R1.16 ONCC(c1cccnc1)O Amb17334346 [0,1,0,0,0,0|2,0,0]=3 1300 B11R1.16 ONCC(c1ccncc1)O Amb17334347 [0,1,0,0,0,0|2,0,0]=3 1301 B11R1.16 OSCC(O)c1ccccc1 Amb25686224 [0,1,0,0,0,0|1,0,0]=2 1302 B11R1.16 OSC[C@@H](O)c1ccccc1 Amb25787381 [0,1,0,0,0,0|1,0,0]=2 1303 B11R1.16 O[C@H](CC=O)c1cc[n]cc1 Amb25142585 [0,1,0,0,0,0|1,0,2]=4 1304 B11R1.16 O[C@H](CC=O)c1ccccc1 Amb24533175 [0,1,0,0,0,0|0,0,2]=3 1305 B11R1.16 O\C=C\C(=S)c1ccccc1 Amb24645164 [0,1,0,0,0,0|0,0,3]=4 1306 B11R1.16 O\N=C/C(=O)c1ccccc1 Amb25767720 [0,1,0,0,0,0|1,0,2]=4 1307 B11R1.16 O\N=C\C(O)c1cccc[n]1 Amb25077983 [0,1,0,0,0,0|2,0,1]=4 1308 B11R1.16 O\N=C\C(O)c1ccccc1 Amb25149681 [0,1,0,0,0,0|1,0,1]=3 1309 B11R1.16 SCCC(=O)c1ccccc1 Amb17400214 [0,1,0,0,0,0|0,1,1]=3 1310 B11R1.16 SCCN(c1ccccc1)C Amb13881732 [0,1,0,0,0,0|1,1,0]=3 1311 B11R1.16 [N-]=[N+]=NC(O)c1ccccc1 Amb24724629 [0,1,0,0,0,0|3,0,0]=4 1312 B11R1.16 [O-]SOC(O)c1ccccc1 Amb24403740 [0,1,0,0,0,0|2,0,1]=4 1313 B11R1.17 BrCCCc1ccccc1C Amb17104552 [0,1,0,0,0,0|1,0,0]=2 1314 B11R1.17 BrCCCc1ccccc1Cl Amb17104560 [0,1,0,0,0,0|1,0,0]=2 1315 B11R1.17 BrCCCc1ccccc1F Amb17104555 [0,1,0,0,0,0|1,0,0]=2 1316 B11R1.17 BrCCOc1ccccc1C Amb1105693 [0,1,0,0,0,0|2,0,0]=3 1317 B11R1.17 BrCCOc1ccccc1Cl Amb1150980 [0,1,0,0,0,0|2,0,0]=3 1318 B11R1.17 BrCCOc1ccccc1F Amb1103643 [0,1,0,0,0,0|2,0,0]=3 1319 B11R1.17 Br[Mg]CCc1ccccc1F Amb13890864 [0,1,0,0,0,0|2,0,0]=3 1320 B11R1.17 Br[Zn]CCc1ccccc1F Amb13890853 [0,1,0,0,0,0|2,0,0]=3 1321 B11R1.17 Brc1c[n]ccc1CCCBr Amb24416596 [0,1,0,0,0,0|2,0,0]=3 1322 B11R1.17 Brc1ccccc1CCCI Amb25329656 [0,1,0,0,0,0|1,0,0]=2 1323 B11R1.17 Brc1ccccc1\C=C\CBr Amb25149093 [0,1,0,0,0,0|1,0,2]=4 1324 B11R1.17 C#CCCN1C=CC=CC1=O Amb24748736 [0,1,0,0,0,0|2,0,1]=4 1325 B11R1.17 C#CCCc1c[n]ccc1N Amb25075508 [0,1,0,0,0,0|2,0,1]=4 1326 B11R1.17 C#CCCc1ccccc1Cl Amb18116938 [0,1,0,0,0,0|1,0,1]=3 1327 B11R1.17 C#CCCc1ccccc1F Amb18636110 [0,1,0,0,0,0|1,0,1]=3 1328 B11R1.17 C#CCNc1ccccc1Br Amb25790145 [0,1,0,0,0,0|2,0,1]=4 1329 B11R1.17 C#CCNc1ccccc1Cl Amb18800988 [0,1,0,0,0,0|2,0,1]=4 1330 B11R1.17 C#CCNc1ccccc1N Amb24060500 [0,1,0,0,0,0|2,0,1]=4 1331 B11R1.17 C#CCOc1ccccc1Cl Amb18183540 [0,1,0,0,0,0|2,0,1]=4 1332 B11R1.17 C#CCOc1ccccc1F Amb18799352 [0,1,0,0,0,0|2,0,1]=4 1333 B11R1.17 C#CCOc1ccccc1N Amb22492402 [0,1,0,0,0,0|2,0,1]=4 1334 B11R1.17 C#CCSc1ccccc1Cl Amb18325307 [0,1,0,0,0,0|2,0,1]=4 1335 B11R1.17 C#CCSc1ccccc1F Amb18801036 [0,1,0,0,0,0|2,0,1]=4 1336 B11R1.17 C#CCSc1ccccc1O Amb18788312 [0,1,0,0,0,0|2,0,1]=4 1337 B11R1.17 C=C1CCCC=C1CCCO Amb25149743 [0,1,0,0,0,0|0,0,3]=4 1338 B11R1.17 C=CCCc1c[n]ccc1O Amb24334707 [0,1,0,0,0,0|2,0,1]=4 1339 B11R1.17 C=CCCc1cc[n]cc1Cl Amb24693753 [0,1,0,0,0,0|2,0,1]=4 1340 B11R1.17 C=CCCc1ccccc1N Amb18124836 [0,1,0,0,0,0|1,0,1]=3 1341 B11R1.17 C=CCCc1ccccc1O Amb18124913 [0,1,0,0,0,0|1,0,1]=3 1342 B11R1.17 C=CCNc1ccccc1Br Amb17306217 [0,1,0,0,0,0|2,0,1]=4 1343 B11R1.17 C=CCNc1ccccc1Cl Amb18185559 [0,1,0,0,0,0|2,0,1]=4 1344 B11R1.17 C=CCNc1ccccc1F Amb17306139 [0,1,0,0,0,0|2,0,1]=4 1345 B11R1.17 C=CCNc1ccccc1N Amb18992164 [0,1,0,0,0,0|2,0,1]=4 1346 B11R1.17 C=CCOc1ccccc1I Amb24384940 [0,1,0,0,0,0|2,0,1]=4 1347 B11R1.17 C=CCOc1ccccc1N Amb2081548 [0,1,0,0,0,0|2,0,1]=4 1348 B11R1.17 C=CCSc1ccccc1Br Amb25188543 [0,1,0,0,0,0|2,0,1]=4 1349 B11R1.17 C=CCSc1ccccc1N Amb22462667 [0,1,0,0,0,0|2,0,1]=4 1350 B11R1.17 C=CCSc1ccccc1O Amb18788504 [0,1,0,0,0,0|2,0,1]=4 1351 B11R1.17 C=COCc1ccccc1Br Amb25679589 [0,1,0,0,0,0|2,0,1]=4 1352 B11R1.17 C=COCc1ccccc1F Amb24569429 [0,1,0,0,0,0|2,0,1]=4 1353 B11R1.17 CC=CCc1ccccc1O Amb24089583 [0,1,0,0,0,0|1,0,2]=4 1354 B11R1.17 CCC#Cc1ccccc1Cl Amb25198269 [0,1,0,0,0,0|1,0,2]=4 1355 B11R1.17 CCC#Cc1ccccc1I Amb24447638 [0,1,0,0,0,0|1,0,2]=4 1356 B11R1.17 CCC#Cc1ccccc1N Amb24670207 [0,1,0,0,0,0|1,0,2]=4 1357 B11R1.17 CCC#Cc1ccccc1O Amb25320119 [0,1,0,0,0,0|1,0,2]=4 1358 B11R1.17 CCCCC1=CC=CNC1=O Amb25270944 [0,1,0,0,0,0|2,0,0]=3 1359 B11R1.17 CCCCC1=CC=NNC1=O Amb24674074 [0,1,0,0,0,0|3,0,0]=4 1360 B11R1.17 CCCCC1=CN=CNC1=O Amb25148175 [0,1,0,0,0,0|3,0,0]=4 1361 B11R1.17 CCCCC1=NC=CNC1=O Amb25832909 [0,1,0,0,0,0|3,0,0]=4 1362 B11R1.17 CCCCN1C=CC=CC1=O Amb22739996 [0,1,0,0,0,0|2,0,0]=3 1363 B11R1.17 CCCCN1C=CC=CC1=S Amb24415294 [0,1,0,0,0,0|2,0,0]=3 1364 B11R1.17 CCCCN1C=CC=CC1S Amb24485984 [0,1,0,0,0,0|2,0,1]=4 1365 B11R1.17 CCCCN1C=CC=NC1=O Amb25041666 [0,1,0,0,0,0|3,0,0]=4 1366 B11R1.17 CCCCN1C=CN=CC1=O Amb25137324 [0,1,0,0,0,0|3,0,0]=4 1367 B11R1.17 CCCCN1C=NC=CC1=O Amb22522708 [0,1,0,0,0,0|3,0,0]=4 1368 B11R1.17 CCCC[n+]1ccccc1C Amb25794246 [0,1,0,0,0,0|2,0,0]=3 1369 B11R1.17 CCCCc1[n]cc[n]c1N Amb22495916 [0,1,0,0,0,0|3,0,0]=4 1370 B11R1.17 CCCCc1c[n]c[n]c1N Amb24627089 [0,1,0,0,0,0|3,0,0]=4 1371 B11R1.17 CCCCc1c[n]ccc1N Amb25785815 [0,1,0,0,0,0|2,0,0]=3 1372 B11R1.17 CCCCc1cc[n]cc1Cl Amb24086569 [0,1,0,0,0,0|2,0,0]=3 1373 B11R1.17 CCCCc1ccc[n]c1Cl Amb24538109 [0,1,0,0,0,0|2,0,0]=3 1374 B11R1.17 CCCCc1ccccc1Br Amb15690808 [0,1,0,0,0,0|1,0,0]=2 1375 B11R1.17 CCCCc1ccccc1F Amb24426932 [0,1,0,0,0,0|1,0,0]=2 1376 B11R1.17 CCCCc1ccccc1O Amb25744605 [0,1,0,0,0,0|1,0,0]=2 1377 B11R1.17 CCCCc1ncncc1Br Amb10068155 [0,1,0,0,0,0|3,0,0]=4 1378 B11R1.17 CCCCn1ccccc1=O Amb10553753 [0,1,0,0,0,0|2,0,0]=3 1379 B11R1.17 CCCNc1[n]cccc1Br Amb18292051 [0,1,0,0,0,0|3,0,0]=4 1380 B11R1.17 CCCNc1[n]cccc1F Amb18300627 [0,1,0,0,0,0|3,0,0]=4 1381 B11R1.17 CCCNc1[n]cccc1N Amb20668081 [0,1,0,0,0,0|3,0,0]=4 1382 B11R1.17 CCCNc1[n]cccc1N Amb24077822 [0,1,0,0,0,0|3,0,0]=4 1383 B11R1.17 CCCNc1c[n]ccc1N Amb24379469 [0,1,0,0,0,0|3,0,0]=4 1384 B11R1.17 CCCNc1c[n]ccc1O Amb24554848 [0,1,0,0,0,0|3,0,0]=4 1385 B11R1.17 CCCNc1cc[n]cc1Cl Amb24742794 [0,1,0,0,0,0|3,0,0]=4 1386 B11R1.17 CCCNc1cc[n]cc1N Amb24077829 [0,1,0,0,0,0|3,0,0]=4 1387 B11R1.17 CCCNc1ccc[n]c1N Amb23557985 [0,1,0,0,0,0|3,0,0]=4 1388 B11R1.17 CCCNc1ccccc1O Amb18644480 [0,1,0,0,0,0|2,0,0]=3 1389 B11R1.17 CCCOC1=CC=CNC1=O Amb18034627 [0,1,0,0,0,0|3,0,0]=4 1390 B11R1.17 CCCOc1[n]cccc1Br Amb19959527 [0,1,0,0,0,0|3,0,0]=4 1391 B11R1.17 CCCOc1c[n]ccc1Cl Amb24055245 [0,1,0,0,0,0|3,0,0]=4 1392 B11R1.17 CCCOc1c[n]ccc1N Amb24320961 [0,1,0,0,0,0|3,0,0]=4 1393 B11R1.17 CCCOc1cc[n]cc1Br Amb24320776 [0,1,0,0,0,0|3,0,0]=4 1394 B11R1.17 CCCOc1ccc[n]c1Br Amb24321030 [0,1,0,0,0,0|3,0,0]=4 1395 B11R1.17 CCCOc1ccccc1Cl Amb25216415 [0,1,0,0,0,0|2,0,0]=3 1396 B11R1.17 CCCOc1ccccc1F Amb21856719 [0,1,0,0,0,0|2,0,0]=3 1397 B11R1.17 CCCOc1ccccc1N Amb1210617 [0,1,0,0,0,0|2,0,0]=3 1398 B11R1.17 CCCOc1ncccc1I Amb10844704 [0,1,0,0,0,0|3,0,0]=4 1399 B11R1.17 CCCSc1[n]cccc1Cl Amb24485285 [0,1,0,0,0,0|3,0,0]=4 1400 B11R1.17 CCCSc1ccc[n]c1N Amb25301401 [0,1,0,0,0,0|3,0,0]=4 1401 B11R1.17 CCCSc1ccccc1N Amb22588094 [0,1,0,0,0,0|2,0,0]=3 1402 B11R1.17 CCCSc1ccccc1O Amb18177881 [0,1,0,0,0,0|2,0,0]=3 1403 B11R1.17 CCNCC1=CNC=CC1=O Amb24412918 [0,1,0,0,0,0|3,0,0]=4 1404 B11R1.17 CCNCc1[n]cccc1Br Amb25125234 [0,1,0,0,0,0|3,0,0]=4 1405 B11R1.17 CCNCc1[n]cccc1Cl Amb25790062 [0,1,0,0,0,0|3,0,0]=4 1406 B11R1.17 CCNCc1[n]cccc1N Amb25282475 [0,1,0,0,0,0|3,0,0]=4 1407 B11R1.17 CCNCc1[n]cccc1O Amb24659507 [0,1,0,0,0,0|3,0,0]=4 1408 B11R1.17 CCNCc1cc[n]cc1Br Amb25695866 [0,1,0,0,0,0|3,0,0]=4 1409 B11R1.17 CCNCc1cc[n]cc1F Amb25151390 [0,1,0,0,0,0|3,0,0]=4 1410 B11R1.17 CCNCc1cc[n]cc1N Amb25132570 [0,1,0,0,0,0|3,0,0]=4 1411 B11R1.17 CCNCc1ccc[n]c1F Amb25374012 [0,1,0,0,0,0|3,0,0]=4 1412 B11R1.17 CCNCc1ccc[n]c1N Amb25069174 [0,1,0,0,0,0|3,0,0]=4 1413 B11R1.17 CCNCc1ccccc1I Amb21861742 [0,1,0,0,0,0|2,0,0]=3 1414 B11R1.17 CCOCc1[n]cccc1Br Amb25209748 [0,1,0,0,0,0|3,0,0]=4 1415 B11R1.17 CCOCc1ccc[n]c1Cl Amb18185709 [0,1,0,0,0,0|3,0,0]=4 1416 B11R1.17 CCOCc1ccc[n]c1N Amb18991377 [0,1,0,0,0,0|3,0,0]=4 1417 B11R1.17 CCOCc1ccccc1Br Amb22227882 [0,1,0,0,0,0|2,0,0]=3 1418 B11R1.17 CCOCc1ccccc1O Amb10560038 [0,1,0,0,0,0|2,0,0]=3 1419 B11R1.17 CCO\C=C/1\C=CC=CC1=O Amb24645462 [0,1,0,0,0,0|2,0,1]=4 1420 B11R1.17 CCSCc1[n]cccc1Br Amb25744248 [0,1,0,0,0,0|3,0,0]=4 1421 B11R1.17 CCSCc1ccc[n]c1Cl Amb19077089 [0,1,0,0,0,0|3,0,0]=4 1422 B11R1.17 CCSCc1ccc[n]c1N Amb18298620 [0,1,0,0,0,0|3,0,0]=4 1423 B11R1.17 CCSCc1ccccc1Br Amb22228180 [0,1,0,0,0,0|2,0,0]=3 1424 B11R1.17 CCSCc1ccccc1Cl Amb25676288 [0,1,0,0,0,0|2,0,0]=3 1425 B11R1.17 CCSCc1ccccc1O Amb18126550 [0,1,0,0,0,0|2,0,0]=3 1426 B11R1.17 CC\C=C/c1ccccc1O Amb25713551 [0,1,0,0,0,0|1,0,2]=4 1427 B11R1.17 CC\C=C\c1ccccc1N Amb22751020 [0,1,0,0,0,0|1,0,2]=4 1428 B11R1.17 CC\C=C\c1ccccc1O Amb18124914 [0,1,0,0,0,0|1,0,2]=4 1429 B11R1.17 CC\C=N\c1ccccc1N Amb24060501 [0,1,0,0,0,0|2,0,1]=4 1430 B11R1.17 CC\C=N\c1ccccc1O Amb24486452 [0,1,0,0,0,0|2,0,1]=4 1431 B11R1.17 CC\N=C\c1ccccc1Br Amb25250885 [0,1,0,0,0,0|2,0,1]=4 1432 B11R1.17 CC\N=C\c1ccccc1O Amb25793010 [0,1,0,0,0,0|2,0,1]=4 1433 B11R1.17 CN/1C=CC=C\C1=N\CCO Amb25264302 [0,1,0,0,0,0|2,0,0]=3 1434 B11R1.17 CNCCN1C=CC=CC1=O Amb18299423 [0,1,0,0,0,0|3,0,0]=4 1435 B11R1.17 CNCCc1[n]cccc1Br Amb18657771 [0,1,0,0,0,0|3,0,0]=4 1436 B11R1.17 CNCCc1[n]cccc1Cl Amb18126745 [0,1,0,0,0,0|3,0,0]=4 1437 B11R1.17 CNCCc1[n]cccc1F Amb24636895 [0,1,0,0,0,0|3,0,0]=4 1438 B11R1.17 CNCCc1c[n]ccc1Br Amb25804895 [0,1,0,0,0,0|3,0,0]=4 1439 B11R1.17 CNCCc1c[n]ccc1N Amb24436455 [0,1,0,0,0,0|3,0,0]=4 1440 B11R1.17 CNCCc1cc[n]cc1F Amb24593125 [0,1,0,0,0,0|3,0,0]=4 1441 B11R1.17 CNCCc1ccccc1Br Amb18299468 [0,1,0,0,0,0|2,0,0]=3 1442 B11R1.17 CNCCc1ccccc1N Amb24106838 [0,1,0,0,0,0|2,0,0]=3 1443 B11R1.17 CNCCc1ccccc1O Amb18560895 [0,1,0,0,0,0|2,0,0]=3 1444 B11R1.17 COCC[n+]1ccccc1Br Amb25072030 [0,1,0,0,0,0|3,0,0]=4 1445 B11R1.17 COCC[n+]1ccccc1C Amb24685943 [0,1,0,0,0,0|3,0,0]=4 1446 B11R1.17 COCCc1c[n]ccc1N Amb25209393 [0,1,0,0,0,0|3,0,0]=4 1447 B11R1.17 COCCc1cccc[n+]1[O-] Amb10573566 [0,1,0,0,0,0|3,0,0]=4 1448 B11R1.17 COCCc1ccccc1Cl Amb24518157 [0,1,0,0,0,0|2,0,0]=3 1449 B11R1.17 COCCc1ccccc1I Amb24483388 [0,1,0,0,0,0|2,0,0]=3 1450 B11R1.17 COCCc1ccccc1N Amb18992153 [0,1,0,0,0,0|2,0,0]=3 1451 B11R1.17 COCCc1ccccc1O Amb22055702 [0,1,0,0,0,0|2,0,0]=3 1452 B11R1.17 COCCn1ccccc1=O Amb10707822 [0,1,0,0,0,0|3,0,0]=4 1453 B11R1.17 COCNc1ccccc1F Amb24084241 [0,1,0,0,0,0|3,0,0]=4 1454 B11R1.17 COCOc1ccccc1Br Amb21912438 [0,1,0,0,0,0|3,0,0]=4 1455 B11R1.17 COCOc1ccccc1C Amb10559613 [0,1,0,0,0,0|3,0,0]=4 1456 B11R1.17 COCOc1ccccc1Cl Amb25840223 [0,1,0,0,0,0|3,0,0]=4 1457 B11R1.17 COCOc1ccccc1F Amb22546792 [0,1,0,0,0,0|3,0,0]=4 1458 B11R1.17 COCOc1ccccc1I Amb22284514 [0,1,0,0,0,0|3,0,0]=4 1459 B11R1.17 COCOc1ccccc1N Amb23599107 [0,1,0,0,0,0|3,0,0]=4 1460 B11R1.17 COCOc1ccccc1O Amb24486480 [0,1,0,0,0,0|3,0,0]=4 1461 B11R1.17 COCSc1ccccc1N Amb17305638 [0,1,0,0,0,0|3,0,0]=4 1462 B11R1.17 CONCc1ccccc1F Amb24725975 [0,1,0,0,0,0|3,0,0]=4 1463 B11R1.17 CONCc1ccccc1O Amb24432475 [0,1,0,0,0,0|3,0,0]=4 1464 B11R1.17 CSCCN1C=CC=CC1=O Amb24488179 [0,1,0,0,0,0|3,0,0]=4 1465 B11R1.17 CSCCc1c[n]ccc1N Amb25839494 [0,1,0,0,0,0|3,0,0]=4 1466 B11R1.17 CSCCc1ccccc1Cl Amb25222784 [0,1,0,0,0,0|2,0,0]=3 1467 B11R1.17 CSCCc1ccccc1N Amb18299122 [0,1,0,0,0,0|2,0,0]=3 1468 B11R1.17 CSCOc1ccccc1Br Amb25358756 [0,1,0,0,0,0|3,0,0]=4 1469 B11R1.17 CSCOc1ccccc1Cl Amb24459326 [0,1,0,0,0,0|3,0,0]=4 1470 B11R1.17 CSCSc1ccccc1Br Amb24516501 [0,1,0,0,0,0|3,0,0]=4 1471 B11R1.17 C[n]1ccccc1=NCCO Amb24106772 [0,1,0,0,0,0|2,0,0]=3 1472 B11R1.17 C\C=C/Cc1ccccc1O Amb25345359 [0,1,0,0,0,0|1,0,2]=4 1473 B11R1.17 C\C=C\Cc1ccccc1N Amb18644343 [0,1,0,0,0,0|1,0,2]=4 1474 B11R1.17 C\N=C\Cc1ccccc1O Amb25844316 [0,1,0,0,0,0|2,0,1]=4 1475 B11R1.17 Cc1[n]cc[n]c1CCCC Amb22234797 [0,1,0,0,0,0|3,0,0]=4 1476 B11R1.17 Cc1[n]cc[n]c1CCCN Amb18201572 [0,1,0,0,0,0|3,0,0]=4 1477 B11R1.17 Cc1[n]cc[n]c1SCCO Amb25759766 [0,1,0,0,0,0|3,0,0]=4 1478 B11R1.17 Cc1[n]cccc1CCCCl Amb25847080 [0,1,0,0,0,0|2,0,0]=3 1479 B11R1.17 Cc1[n]cccc1CCCO Amb24360630 [0,1,0,0,0,0|1,0,0]=2 1480 B11R1.17 Cc1[n]cccc1CCNC Amb24635443 [0,1,0,0,0,0|3,0,0]=4 1481 B11R1.17 Cc1[n]cccc1CNCC Amb18125202 [0,1,0,0,0,0|3,0,0]=4 1482 B11R1.17 Cc1[n]cccc1CSCC Amb25307433 [0,1,0,0,0,0|3,0,0]=4 1483 B11R1.17 Cc1[n]cccc1NCCC Amb24386233 [0,1,0,0,0,0|3,0,0]=4 1484 B11R1.17 Cc1[n]cccc1OCCBr Amb25046512 [0,1,0,0,0,0|3,0,0]=4 1485 B11R1.17 Cc1[n]cccc1OCCCl Amb24441294 [0,1,0,0,0,0|3,0,0]=4 1486 B11R1.17 Cc1[n]cccc1OCCO Amb24101976 [0,1,0,0,0,0|2,0,0]=3 1487 B11R1.17 Cc1c[n]c[n]c1CCCC Amb24091339 [0,1,0,0,0,0|3,0,0]=4 1488 B11R1.17 Cc1c[n]c[n]c1CCCN Amb18201574 [0,1,0,0,0,0|3,0,0]=4 1489 B11R1.17 Cc1c[n]ccc1CCC=C Amb24102788 [0,1,0,0,0,0|2,0,1]=4 1490 B11R1.17 Cc1c[n]ccc1CCCBr Amb24611779 [0,1,0,0,0,0|2,0,0]=3 1491 B11R1.17 Cc1c[n]ccc1CCOC Amb24577461 [0,1,0,0,0,0|3,0,0]=4 1492 B11R1.17 Cc1c[n]ccc1CNCC Amb25044148 [0,1,0,0,0,0|3,0,0]=4 1493 B11R1.17 Cc1c[n]ccc1NCCF Amb25850522 [0,1,0,0,0,0|3,0,0]=4 1494 B11R1.17 Cc1c[n]ccc1NCCO Amb24689647 [0,1,0,0,0,0|2,0,0]=3 1495 B11R1.17 Cc1c[n]ccc1OCCC Amb25829970 [0,1,0,0,0,0|3,0,0]=4 1496 B11R1.17 Cc1c[n]ccc1SCCC Amb25262403 [0,1,0,0,0,0|3,0,0]=4 1497 B11R1.17 Cc1c[n]ccc1SCCCl Amb25305371 [0,1,0,0,0,0|3,0,0]=4 1498 B11R1.17 Cc1c[n]ccc1\C=C\CO Amb25262595 [0,1,0,0,0,0|1,0,2]=4 1499 B11R1.17 Cc1cc[n]cc1C#CCO Amb24472696 [0,1,0,0,0,0|1,0,2]=4 1500 B11R1.17 Cc1cc[n]cc1CCCBr Amb25089629 [0,1,0,0,0,0|2,0,0]=3 1501 B11R1.17 Cc1cc[n]cc1CCCC Amb25075221 [0,1,0,0,0,0|2,0,0]=3 1502 B11R1.17 Cc1cc[n]cc1CCCO Amb25717118 [0,1,0,0,0,0|1,0,0]=2 1503 B11R1.17 Cc1cc[n]cc1CNCC Amb18125201 [0,1,0,0,0,0|3,0,0]=4 1504 B11R1.17 Cc1ccc[n]c1CCC#N Amb24085237 [0,1,0,0,0,0|2,0,1]=4 1505 B11R1.17 Cc1ccc[n]c1CCC=C Amb24100504 [0,1,0,0,0,0|2,0,1]=4 1506 B11R1.17 Cc1ccc[n]c1CCCC Amb24062201 [0,1,0,0,0,0|2,0,0]=3 1507 B11R1.17 Cc1ccc[n]c1CCCN Amb22886485 [0,1,0,0,0,0|2,0,0]=3 1508 B11R1.17 Cc1ccc[n]c1CCCO Amb24685021 [0,1,0,0,0,0|1,0,0]=2 1509 B11R1.17 Cc1ccc[n]c1CCNC Amb18125193 [0,1,0,0,0,0|3,0,0]=4 1510 B11R1.17 Cc1ccc[n]c1CNCC Amb18296368 [0,1,0,0,0,0|3,0,0]=4 1511 B11R1.17 Cc1ccc[n]c1CSCC Amb25092589 [0,1,0,0,0,0|3,0,0]=4 1512 B11R1.17 Cc1ccc[n]c1NCCC Amb18987728 [0,1,0,0,0,0|3,0,0]=4 1513 B11R1.17 Cc1ccc[n]c1NCCF Amb25152259 [0,1,0,0,0,0|3,0,0]=4 1514 B11R1.17 Cc1ccc[n]c1NCCO Amb18987733 [0,1,0,0,0,0|2,0,0]=3 1515 B11R1.17 Cc1ccc[n]c1OCCN Amb18988881 [0,1,0,0,0,0|3,0,0]=4 1516 B11R1.17 Cc1ccc[n]c1OCCO Amb24102036 [0,1,0,0,0,0|2,0,0]=3 1517 B11R1.17 Cc1ccc[n]c1SCCCl Amb18329822 [0,1,0,0,0,0|3,0,0]=4 1518 B11R1.17 Cc1ccc[n]c1SCCF Amb25668642 [0,1,0,0,0,0|3,0,0]=4 1519 B11R1.17 Cc1ccc[n]c1SCCN Amb18908765 [0,1,0,0,0,0|3,0,0]=4 1520 B11R1.17 Cc1ccc[n]c1SCCO Amb18185610 [0,1,0,0,0,0|2,0,0]=3 1521 B11R1.17 Cc1ccccc1C#CCBr Amb25032502 [0,1,0,0,0,0|1,0,2]=4 1522 B11R1.17 Cc1ccccc1C#CCCl Amb18792614 [0,1,0,0,0,0|1,0,2]=4 1523 B11R1.17 Cc1ccccc1C#CCF Amb25026923 [0,1,0,0,0,0|1,0,2]=4 1524 B11R1.17 Cc1ccccc1C#CCN Amb18949803 [0,1,0,0,0,0|1,0,2]=4 1525 B11R1.17 Cc1ccccc1C#CCO Amb25117588 [0,1,0,0,0,0|0,0,2]=3 1526 B11R1.17 Cc1ccccc1CCC#C Amb18636111 [0,1,0,0,0,0|1,0,1]=3 1527 B11R1.17 Cc1ccccc1CCCC Amb25825024 [0,1,0,0,0,0|1,0,0]=2 1528 B11R1.17 Cc1ccccc1CCNC Amb19959980 [0,1,0,0,0,0|2,0,0]=3 1529 B11R1.17 Cc1ccccc1CC[Zn]Br Amb22000497 [0,1,0,0,0,0|2,0,0]=3 1530 B11R1.17 Cc1ccccc1CNC=O Amb21859038 [0,1,0,0,0,0|1,0,2]=4 1531 B11R1.17 Cc1ccccc1COC=O Amb17778964 [0,1,0,0,0,0|1,0,2]=4 1532 B11R1.17 Cc1ccccc1COCCl Amb24352480 [0,1,0,0,0,0|2,0,0]=3 1533 B11R1.17 Cc1ccccc1CSC#N Amb17778963 [0,1,0,0,0,0|2,0,1]=4 1534 B11R1.17 Cc1ccccc1CSCC Amb24690023 [0,1,0,0,0,0|2,0,0]=3 1535 B11R1.17 Cc1ccccc1C\C=C\Cl Amb25109327 [0,1,0,0,0,0|1,0,2]=4 1536 B11R1.17 Cc1ccccc1NCC#C Amb25677805 [0,1,0,0,0,0|2,0,1]=4 1537 B11R1.17 Cc1ccccc1NCCF Amb24560861 [0,1,0,0,0,0|2,0,0]=3 1538 B11R1.17 Cc1ccccc1NCOC Amb25690923 [0,1,0,0,0,0|3,0,0]=4 1539 B11R1.17 Cc1ccccc1OCC#C Amb19373366 [0,1,0,0,0,0|2,0,1]=4 1540 B11R1.17 Cc1ccccc1SCC#C Amb18788142 [0,1,0,0,0,0|2,0,1]=4 1541 B11R1.17 Cc1ccccc1SCC#N Amb18792512 [0,1,0,0,0,0|2,0,1]=4 1542 B11R1.17 Cc1ccccc1SCC=C Amb25231651 [0,1,0,0,0,0|2,0,1]=4 1543 B11R1.17 Cc1ccccc1SCC=O Amb18183536 [0,1,0,0,0,0|1,0,2]=4 1544 B11R1.17 Cc1ccccc1SCCC Amb24674923 [0,1,0,0,0,0|2,0,0]=3 1545 B11R1.17 Cc1ccccc1SCCCl Amb19059017 [0,1,0,0,0,0|2,0,0]=3 1546 B11R1.17 Cc1ccccc1SCCN Amb18992759 [0,1,0,0,0,0|2,0,0]=3 1547 B11R1.17 Cc1ccccc1SCCO Amb18180155 [0,1,0,0,0,0|1,0,0]=2 1548 B11R1.17 Cc1ccccc1SCSC Amb24631994 [0,1,0,0,0,0|3,0,0]=4 1549 B11R1.17 Cc1ccccc1\C=C\CBr Amb25169542 [0,1,0,0,0,0|1,0,2]=4 1550 B11R1.17 Cc1ccccc1\C=C\CN Amb18065178 [0,1,0,0,0,0|1,0,2]=4 1551 B11R1.17 Cc1ccccc1\C=C\CO Amb23442935 [0,1,0,0,0,0|0,0,2]=3 1552 B11R1.17 ClCCCc1[n]cccc1Br Amb25089986 [0,1,0,0,0,0|2,0,0]=3 1553 B11R1.17 ClCCCc1ccccc1C Amb17104525 [0,1,0,0,0,0|1,0,0]=2 1554 B11R1.17 ClCCCc1ccccc1Cl Amb17104533 [0,1,0,0,0,0|1,0,0]=2 1555 B11R1.17 ClCCCc1ccccc1F Amb17104528 [0,1,0,0,0,0|1,0,0]=2 1556 B11R1.17 ClCCCc1ccccc1N Amb17477710 [0,1,0,0,0,0|1,0,0]=2 1557 B11R1.17 ClCCCc1ccccc1O Amb17477721 [0,1,0,0,0,0|1,0,0]=2 1558 B11R1.17 ClCCCn1cccnc1=O Amb1139467 [0,1,0,0,0,0|3,0,0]=4 1559 B11R1.17 ClCCNc1[n]cccc1Br Amb25846546 [0,1,0,0,0,0|3,0,0]=4 1560 B11R1.17 ClCCNc1ccccc1Br Amb17346196 [0,1,0,0,0,0|2,0,0]=3 1561 B11R1.17 ClCCNc1ccccc1C Amb17334785 [0,1,0,0,0,0|2,0,0]=3 1562 B11R1.17 ClCCNc1ccccc1Cl Amb17336180 [0,1,0,0,0,0|2,0,0]=3 1563 B11R1.17 ClCCNc1ccccc1F Amb17334964 [0,1,0,0,0,0|2,0,0]=3 1564 B11R1.17 ClCCSc1ccccc1F Amb1154202 [0,1,0,0,0,0|2,0,0]=3 1565 B11R1.17 ClCOCc1ccccc1Br Amb25679464 [0,1,0,0,0,0|2,0,0]=3 1566 B11R1.17 Clc1c[n]ccc1CCCBr Amb25851696 [0,1,0,0,0,0|2,0,0]=3 1567 B11R1.17 Clc1c[n]ccc1CCCCl Amb25344160 [0,1,0,0,0,0|2,0,0]=3 1568 B11R1.17 Clc1c[n]ccc1NCCCl Amb25225122 [0,1,0,0,0,0|3,0,0]=4 1569 B11R1.17 Clc1ccc[n]c1NCCCl Amb25144899 [0,1,0,0,0,0|3,0,0]=4 1570 B11R1.17 Clc1ccccc1C#CCCl Amb18319857 [0,1,0,0,0,0|1,0,2]=4 1571 B11R1.17 Clc1ccccc1C#CCI Amb24447633 [0,1,0,0,0,0|1,0,2]=4 1572 B11R1.17 Clc1ccccc1CC[Zn]Br Amb22898141 [0,1,0,0,0,0|2,0,0]=3 1573 B11R1.17 Clc1ccccc1CC[Zn]Cl Amb22897727 [0,1,0,0,0,0|2,0,0]=3 1574 B11R1.17 FCC#Cc1ccccc1Br Amb25252787 [0,1,0,0,0,0|1,0,2]=4 1575 B11R1.17 FCC#Cc1ccccc1Cl Amb25330678 [0,1,0,0,0,0|1,0,2]=4 1576 B11R1.17 FCC#Cc1ccccc1I Amb25027319 [0,1,0,0,0,0|1,0,2]=4 1577 B11R1.17 FCCSc1[n]cccc1Br Amb24370858 [0,1,0,0,0,0|3,0,0]=4 1578 B11R1.17 FCCSc1[n]cccc1Cl Amb24440047 [0,1,0,0,0,0|3,0,0]=4 1579 B11R1.17 FCCSc1ccccc1Br Amb22227854 [0,1,0,0,0,0|2,0,0]=3 1580 B11R1.17 Fc1[n]cccc1OCCF Amb25120849 [0,1,0,0,0,0|3,0,0]=4 1581 B11R1.17 Fc1c[n]ccc1CCCBr Amb24486812 [0,1,0,0,0,0|2,0,0]=3 1582 B11R1.17 Fc1ccc[n]c1NCCF Amb24425884 [0,1,0,0,0,0|3,0,0]=4 1583 B11R1.17 Fc1ccc[n]c1SCCCl Amb18325303 [0,1,0,0,0,0|3,0,0]=4 1584 B11R1.17 Fc1ccccc1C#CCCl Amb18185585 [0,1,0,0,0,0|1,0,2]=4 1585 B11R1.17 Fc1ccccc1OCCF Amb25692641 [0,1,0,0,0,0|2,0,0]=3 1586 B11R1.17 Fc1ccccc1OCCI Amb25151268 [0,1,0,0,0,0|2,0,0]=3 1587 B11R1.17 Fc1ccccc1\C=C\CBr Amb24374006 [0,1,0,0,0,0|1,0,2]=4 1588 B11R1.17 Ic1ccccc1C#CCI Amb24509627 [0,1,0,0,0,0|1,0,2]=4 1589 B11R1.17 N#CCCN1C=CC=CC1=O Amb18542616 [0,1,0,0,0,0|2,0,1]=4 1590 B11R1.17 N#CCCc1cccc[n+]1[O-] Amb24740142 [0,1,0,0,0,0|2,0,1]=4 1591 B11R1.17 N#CCCc1ccccc1Br Amb17204424 [0,1,0,0,0,0|1,0,1]=3 1592 B11R1.17 N#CCCc1ccccc1C Amb17204295 [0,1,0,0,0,0|1,0,1]=3 1593 B11R1.17 N#CCCc1ccccc1F Amb17204298 [0,1,0,0,0,0|1,0,1]=3 1594 B11R1.17 N#CCCc1ccccc1O Amb17509008 [0,1,0,0,0,0|1,0,1]=3 1595 B11R1.17 N#CCSc1ccccc1O Amb18177810 [0,1,0,0,0,0|2,0,1]=4 1596 B11R1.17 N#CNCc1ccccc1Br Amb25045111 [0,1,0,0,0,0|2,0,1]=4 1597 B11R1.17 N#CNCc1ccccc1C Amb16186975 [0,1,0,0,0,0|2,0,1]=4 1598 B11R1.17 N#CNCc1ccccc1Cl Amb16186973 [0,1,0,0,0,0|2,0,1]=4 1599 B11R1.17 N#CNCc1ccccc1F Amb16186971 [0,1,0,0,0,0|2,0,1]=4 1600 B11R1.17 N#CSCc1ccccc1Br Amb21959350 [0,1,0,0,0,0|2,0,1]=4 1601 B11R1.17 N#CSCc1ccccc1Cl Amb19889456 [0,1,0,0,0,0|2,0,1]=4 1602 B11R1.17 N#CSCc1ccccc1F Amb10789221 [0,1,0,0,0,0|2,0,1]=4 1603 B11R1.17 N=C=NCc1ccccc1O Amb24486464 [0,1,0,0,0,0|2,0,1]=4 1604 B11R1.17 NCC#Cc1ccccc1Br Amb25727777 [0,1,0,0,0,0|1,0,2]=4 1605 B11R1.17 NCC#Cc1ccccc1Cl Amb18281655 [0,1,0,0,0,0|1,0,2]=4 1606 B11R1.17 NCC#Cc1ccccc1F Amb18962138 [0,1,0,0,0,0|1,0,2]=4 1607 B11R1.17 NCC#Cc1ccccc1I Amb24454628 [0,1,0,0,0,0|1,0,2]=4 1608 B11R1.17 NCC#Cc1ccccc1O Amb25304022 [0,1,0,0,0,0|1,0,2]=4 1609 B11R1.17 NCCCN1C=CC=CC1=O Amb18535490 [0,1,0,0,0,0|2,0,0]=3 1610 B11R1.17 NCCCN1C=CC=CC1=O Amb19514396 [0,1,0,0,0,0|2,0,0]=3 1611 B11R1.17 NCCCN1C=CC=NC1=O Amb18540352 [0,1,0,0,0,0|3,0,0]=4 1612 B11R1.17 NCCCN1N=CC=CC1=O Amb18998096 [0,1,0,0,0,0|3,0,0]=4 1613 B11R1.17 NCCCc1[n]cccc1Br Amb25771023 [0,1,0,0,0,0|2,0,0]=3 1614 B11R1.17 NCCCc1[n]cccc1F Amb25032548 [0,1,0,0,0,0|2,0,0]=3 1615 B11R1.17 NCCCc1[n]cccc1O Amb25111600 [0,1,0,0,0,0|2,0,0]=3 1616 B11R1.17 NCCCc1cc[n]cc1Cl Amb23596508 [0,1,0,0,0,0|2,0,0]=3 1617 B11R1.17 NCCCc1cc[n]cc1F Amb25111554 [0,1,0,0,0,0|2,0,0]=3 1618 B11R1.17 NCCCc1ccccc1Cl Amb1090913 [0,1,0,0,0,0|1,0,0]=2 1619 B11R1.17 NCCCc1ccccc1Cl Amb19373405 [0,1,0,0,0,0|1,0,0]=2 1620 B11R1.17 NCCCc1ccccc1F Amb13949158 [0,1,0,0,0,0|1,0,0]=2 1621 B11R1.17 NCCCc1ccccc1N Amb17477695 [0,1,0,0,0,0|1,0,0]=2 1622 B11R1.17 NCCNc1[n]cccc1Br Amb18979379 [0,1,0,0,0,0|3,0,0]=4 1623 B11R1.17 NCCNc1[n]cccc1F Amb18996005 [0,1,0,0,0,0|3,0,0]=4 1624 B11R1.17 NCCNc1cc[n]cc1Br Amb24768461 [0,1,0,0,0,0|3,0,0]=4 1625 B11R1.17 NCCNc1cc[n]cc1F Amb24739193 [0,1,0,0,0,0|3,0,0]=4 1626 B11R1.17 NCCNc1ccc[n]c1Br Amb24729303 [0,1,0,0,0,0|3,0,0]=4 1627 B11R1.17 NCCNc1ccc[n]c1Cl Amb25187389 [0,1,0,0,0,0|3,0,0]=4 1628 B11R1.17 NCCNc1cccc[n+]1[O-] Amb24726506 [0,1,0,0,0,0|3,0,0]=4 1629 B11R1.17 NCCNc1ccccc1Br Amb17091073 [0,1,0,0,0,0|2,0,0]=3 1630 B11R1.17 NCCNc1ccccc1C Amb17057744 [0,1,0,0,0,0|2,0,0]=3 1631 B11R1.17 NCCNc1ccccc1Cl Amb17057749 [0,1,0,0,0,0|2,0,0]=3 1632 B11R1.17 NCCNc1ccccc1F Amb17057747 [0,1,0,0,0,0|2,0,0]=3 1633 B11R1.17 NCCNc1ccccc1N Amb1397489 [0,1,0,0,0,0|2,0,0]=3 1634 B11R1.17 NCCNc1ccccc1O Amb18251377 [0,1,0,0,0,0|2,0,0]=3 1635 B11R1.17 NCCNc1ncccc1C Amb10607838 [0,1,0,0,0,0|3,0,0]=4 1636 B11R1.17 NCCOc1[n]cccc1Br Amb18988886 [0,1,0,0,0,0|3,0,0]=4 1637 B11R1.17 NCCOc1[n]cccc1Cl Amb18988869 [0,1,0,0,0,0|3,0,0]=4 1638 B11R1.17 NCCOc1[n]cccc1Cl Amb20631069 [0,1,0,0,0,0|3,0,0]=4 1639 B11R1.17 NCCOc1[n]cccc1F Amb18996066 [0,1,0,0,0,0|3,0,0]=4 1640 B11R1.17 NCCOc1[n]cccc1I Amb25208739 [0,1,0,0,0,0|3,0,0]=4 1641 B11R1.17 NCCOc1cc[n]cc1Br Amb24353235 [0,1,0,0,0,0|3,0,0]=4 1642 B11R1.17 NCCOc1ccccc1Br Amb10609932 [0,1,0,0,0,0|2,0,0]=3 1643 B11R1.17 NCCOc1ccccc1C Amb1098984 [0,1,0,0,0,0|2,0,0]=3 1644 B11R1.17 NCCOc1ccccc1C Amb2052283 [0,1,0,0,0,0|2,0,0]=3 1645 B11R1.17 NCCOc1ccccc1Cl Amb2137131 [0,1,0,0,0,0|2,0,0]=3 1646 B11R1.17 NCCOc1ccccc1F Amb1105167 [0,1,0,0,0,0|2,0,0]=3 1647 B11R1.17 NCCOc1ccccc1O Amb17615721 [0,1,0,0,0,0|2,0,0]=3 1648 B11R1.17 NCCSc1[n]cccc1Cl Amb18252966 [0,1,0,0,0,0|3,0,0]=4 1649 B11R1.17 NCCSc1ccccc1O Amb18984794 [0,1,0,0,0,0|2,0,0]=3 1650 B11R1.17 NC\C=C\c1ccccc1Br Amb18569373 [0,1,0,0,0,0|1,0,2]=4 1651 B11R1.17 NC\C=C\c1ccccc1Cl Amb18065473 [0,1,0,0,0,0|1,0,2]=4 1652 B11R1.17 NC\C=C\c1ccccc1F Amb18065347 [0,1,0,0,0,0|1,0,2]=4 1653 B11R1.17 NNCCN1C=CC=CC1=O Amb24421929 [0,1,0,0,0,0|3,0,0]=4 1654 B11R1.17 NNCCc1ccccc1Br Amb24701935 [0,1,0,0,0,0|2,0,0]=3 1655 B11R1.17 NNCCc1ccccc1F Amb20668135 [0,1,0,0,0,0|2,0,0]=3 1656 B11R1.17 NOCCN1C=CC=CC1=O Amb22364493 [0,1,0,0,0,0|3,0,0]=4 1657 B11R1.17 NOCCc1ccccc1Br Amb18657908 [0,1,0,0,0,0|2,0,0]=3 1658 B11R1.17 NOCCc1ccccc1Cl Amb18647570 [0,1,0,0,0,0|2,0,0]=3 1659 B11R1.17 NOCCc1ccccc1F Amb22896629 [0,1,0,0,0,0|2,0,0]=3 1660 B11R1.17 Nc1[n]cccc1CCC=O Amb25244379 [0,1,0,0,0,0|1,0,2]=4 1661 B11R1.17 Nc1[n]cccc1CCCBr Amb25763348 [0,1,0,0,0,0|2,0,0]=3 1662 B11R1.17 Nc1[n]cccc1CCCCl Amb24486006 [0,1,0,0,0,0|2,0,0]=3 1663 B11R1.17 Nc1[n]cccc1CCNN Amb25841161 [0,1,0,0,0,0|3,0,0]=4 1664 B11R1.17 Nc1[n]cccc1NCCF Amb25744595 [0,1,0,0,0,0|3,0,0]=4 1665 B11R1.17 Nc1[n]cccc1NCCN Amb24486768 [0,1,0,0,0,0|3,0,0]=4 1666 B11R1.17 Nc1c[n]ccc1NCCF Amb24406413 [0,1,0,0,0,0|3,0,0]=4 1667 B11R1.17 Nc1c[n]ccc1NCCN Amb18991504 [0,1,0,0,0,0|3,0,0]=4 1668 B11R1.17 Nc1c[n]ccc1SCCCl Amb24532971 [0,1,0,0,0,0|3,0,0]=4 1669 B11R1.17 Nc1c[n]ccc1SCCF Amb24624556 [0,1,0,0,0,0|3,0,0]=4 1670 B11R1.17 Nc1c[n]ccc1SCCN Amb18291318 [0,1,0,0,0,0|3,0,0]=4 1671 B11R1.17 Nc1cc[n]cc1CCC=O Amb25742213 [0,1,0,0,0,0|1,0,2]=4 1672 B11R1.17 Nc1cc[n]cc1CCCO Amb24355779 [0,1,0,0,0,0|1,0,0]=2 1673 B11R1.17 Nc1cc[n]cc1NCCN Amb25682895 [0,1,0,0,0,0|3,0,0]=4 1674 B11R1.17 Nc1cc[n]cc1SCCO Amb24414275 [0,1,0,0,0,0|2,0,0]=3 1675 B11R1.17 Nc1ccc[n]c1NCCN Amb18991500 [0,1,0,0,0,0|3,0,0]=4 1676 B11R1.17 Nc1ccc[n]c1OCCN Amb25858100 [0,1,0,0,0,0|3,0,0]=4 1677 B11R1.17 Nc1ccc[n]c1SCCN Amb18291324 [0,1,0,0,0,0|3,0,0]=4 1678 B11R1.17 Nc1ccccc1C#CCCl Amb24462871 [0,1,0,0,0,0|1,0,2]=4 1679 B11R1.17 Nc1ccccc1C#CCF Amb24509437 [0,1,0,0,0,0|1,0,2]=4 1680 B11R1.17 Nc1ccccc1C#CCO Amb22228947 [0,1,0,0,0,0|0,0,2]=3 1681 B11R1.17 Nc1ccccc1CCC#N Amb18124793 [0,1,0,0,0,0|1,0,1]=3 1682 B11R1.17 Nc1ccccc1CCC=O Amb25208520 [0,1,0,0,0,0|0,0,2]=3 1683 B11R1.17 Nc1ccccc1CCCBr Amb22228093 [0,1,0,0,0,0|1,0,0]=2 1684 B11R1.17 Nc1ccccc1CCCBr Amb25217893 [0,1,0,0,0,0|1,0,0]=2 1685 B11R1.17 Nc1ccccc1CNC=O Amb24096445 [0,1,0,0,0,0|1,0,2]=4 1686 B11R1.17 Nc1ccccc1OCCF Amb23579999 [0,1,0,0,0,0|2,0,0]=3 1687 B11R1.17 Nc1ccccc1OCCN Amb18251366 [0,1,0,0,0,0|2,0,0]=3 1688 B11R1.17 Nc1ccccc1SCCCl Amb18129706 [0,1,0,0,0,0|2,0,0]=3 1689 B11R1.17 Nc1ccccc1SCCF Amb24533142 [0,1,0,0,0,0|2,0,0]=3 1690 B11R1.17 Nc1ccccc1SCCN Amb18291073 [0,1,0,0,0,0|2,0,0]=3 1691 B11R1.17 Nc1ccccc1\C=C\CO Amb25353301 [0,1,0,0,0,0|0,0,2]=3 1692 B11R1.17 Nc1ncccc1CCCO Amb13890002 [0,1,0,0,0,0|1,0,0]=2 1693 B11R1.17 O=C1C=CC=CN1CCCCl Amb18183682 [0,1,0,0,0,0|2,0,0]=3 1694 B11R1.17 O=C1C=CC=CN1OCCBr Amb24743344 [0,1,0,0,0,0|3,0,0]=4 1695 B11R1.17 O=C1C=CC=NN1CCCCl Amb18180386 [0,1,0,0,0,0|3,0,0]=4 1696 B11R1.17 O=C1C=CC=NN1CCCS Amb25051796 [0,1,0,0,0,0|2,1,0]=4 1697 B11R1.17 O=C1C=CN=CN1CCCF Amb24488195 [0,1,0,0,0,0|3,0,0]=4 1698 B11R1.17 O=C1C=CN=CN1CCCS Amb25792193 [0,1,0,0,0,0|2,1,0]=4 1699 B11R1.17 O=C1C=NC=CN1CCCBr Amb25287010 [0,1,0,0,0,0|3,0,0]=4 1700 B11R1.17 O=C1N=CC=CN1CCCF Amb24671030 [0,1,0,0,0,0|3,0,0]=4 1701 B11R1.17 O=C=NCc1ccccc1Br Amb25251434 [0,1,0,0,0,0|1,0,2]=4 1702 B11R1.17 O=CCCN1C=CC=CC1=O Amb18177171 [0,1,0,0,0,0|1,0,2]=4 1703 B11R1.17 O=CCCc1[n]cccc1Cl Amb25336372 [0,1,0,0,0,0|1,0,2]=4 1704 B11R1.17 O=CCCc1cc[n]cc1F Amb25677089 [0,1,0,0,0,0|1,0,2]=4 1705 B11R1.17 O=CCCc1ccccc1Br Amb22498060 [0,1,0,0,0,0|0,0,2]=3 1706 B11R1.17 O=CCCc1ccccc1Cl Amb17081678 [0,1,0,0,0,0|0,0,2]=3 1707 B11R1.17 O=CCCc1ccccc1F Amb10602147 [0,1,0,0,0,0|0,0,2]=3 1708 B11R1.17 O=CCCc1ccccc1I Amb24093007 [0,1,0,0,0,0|0,0,2]=3 1709 B11R1.17 O=CCCc1ccccc1S Amb25325144 [0,1,0,0,0,0|0,0,2]=3 1710 B11R1.17 O=CCOc1ccccc1Br Amb17099950 [0,1,0,0,0,0|1,0,2]=4 1711 B11R1.17 O=CCOc1ccccc1F Amb18182892 [0,1,0,0,0,0|1,0,2]=4 1712 B11R1.17 O=CCSc1ccccc1Cl Amb19075897 [0,1,0,0,0,0|1,0,2]=4 1713 B11R1.17 O=CCSc1ccccc1F Amb18185632 [0,1,0,0,0,0|1,0,2]=4 1714 B11R1.17 O=CNCc1ccccc1Cl Amb19871473 [0,1,0,0,0,0|1,0,2]=4 1715 B11R1.17 O=CNCc1ccccc1F Amb25369873 [0,1,0,0,0,0|1,0,2]=4 1716 B11R1.17 OCC#Cc1ccccc1I Amb24731810 [0,1,0,0,0,0|0,0,2]=3 1717 B11R1.17 OCC#Cc1cnccc1Cl Amb13889957 [0,1,0,0,0,0|1,0,2]=4 1718 B11R1.17 OCC=Cc1ccccc1F Amb22228953 [0,1,0,0,0,0|0,0,2]=3 1719 B11R1.17 OCCCC1=CCCCC1=O Amb24456610 [0,1,0,0,0,0|0,0,3]=4 1720 B11R1.17 OCCCN1C=CC=CC1=O Amb18041289 [0,1,0,0,0,0|1,0,0]=2 1721 B11R1.17 OCCCN1C=CC=NC1=O Amb18177313 [0,1,0,0,0,0|2,0,0]=3 1722 B11R1.17 OCCCN1C=NC=CC1=O Amb25771228 [0,1,0,0,0,0|2,0,0]=3 1723 B11R1.17 OCCCN1N=CC=CC1=O Amb18179507 [0,1,0,0,0,0|2,0,0]=3 1724 B11R1.17 OCCCc1[n]cccc1Br Amb25273165 [0,1,0,0,0,0|1,0,0]=2 1725 B11R1.17 OCCCc1cc[n]cc1Cl Amb23596495 [0,1,0,0,0,0|1,0,0]=2 1726 B11R1.17 OCCCc1cc[n]cc1F Amb25825625 [0,1,0,0,0,0|1,0,0]=2 1727 B11R1.17 OCCCc1ccccc1Br Amb15692692 [0,1,0,0,0,0|0,0,0]=1 1728 B11R1.17 OCCCc1ccccc1C Amb17089494 [0,1,0,0,0,0|0,0,0]=1 1729 B11R1.17 OCCCc1ccccc1Cl Amb17089499 [0,1,0,0,0,0|0,0,0]=1 1730 B11R1.17 OCCCc1ccccc1F Amb17089496 [0,1,0,0,0,0|0,0,0]=1 1731 B11R1.17 OCCCc1ccccc1N Amb17477702 [0,1,0,0,0,0|0,0,0]=1 1732 B11R1.17 OCCCc1ccccc1O Amb17477714 [0,1,0,0,0,0|0,0,0]=1 1733 B11R1.17 OCCCc1ccncc1C Amb10573523 [0,1,0,0,0,0|1,0,0]=2 1734 B11R1.17 OCCNc1[n]c[n]cc1Br Amb25131996 [0,1,0,0,0,0|3,0,0]=4 1735 B11R1.17 OCCNc1[n]c[n]cc1I Amb25149249 [0,1,0,0,0,0|3,0,0]=4 1736 B11R1.17 OCCNc1[n]cccc1Br Amb18292072 [0,1,0,0,0,0|2,0,0]=3 1737 B11R1.17 OCCNc1[n]cccc1F Amb18300634 [0,1,0,0,0,0|2,0,0]=3 1738 B11R1.17 OCCNc1ncccc1I Amb10844707 [0,1,0,0,0,0|2,0,0]=3 1739 B11R1.17 OCCOc1[n]c[n]cc1Br Amb25149255 [0,1,0,0,0,0|3,0,0]=4 1740 B11R1.17 OCCOc1[n]cc[n]c1Cl Amb18183884 [0,1,0,0,0,0|3,0,0]=4 1741 B11R1.17 OCCOc1[n]cccc1Br Amb23598436 [0,1,0,0,0,0|2,0,0]=3 1742 B11R1.17 OCCOc1[n]cccc1Cl Amb23598430 [0,1,0,0,0,0|2,0,0]=3 1743 B11R1.17 OCCOc1cc[n]cc1Br Amb24703549 [0,1,0,0,0,0|2,0,0]=3 1744 B11R1.17 OCCOc1ccc[n]c1Br Amb22493971 [0,1,0,0,0,0|2,0,0]=3 1745 B11R1.17 OCCOc1ccc[n]c1Cl Amb24486639 [0,1,0,0,0,0|2,0,0]=3 1746 B11R1.17 OCCOc1ccccc1C Amb2209345 [0,1,0,0,0,0|1,0,0]=2 1747 B11R1.17 OCCOc1ccccc1Cl Amb2209355 [0,1,0,0,0,0|1,0,0]=2 1748 B11R1.17 OCCOc1ccccc1I Amb25761613 [0,1,0,0,0,0|1,0,0]=2 1749 B11R1.17 OCCOc1ccccc1O Amb1144452 [0,1,0,0,0,0|1,0,0]=2 1750 B11R1.17 OCCOc1ncccc1O Amb13889705 [0,1,0,0,0,0|2,0,0]=3 1751 B11R1.17 OCCSC1=NC=CNC1=O Amb25235802 [0,1,0,0,0,0|3,0,0]=4 1752 B11R1.17 OCCSc1[n]c[n]cc1Cl Amb25188801 [0,1,0,0,0,0|3,0,0]=4 1753 B11R1.17 OCCSc1[n]cc[n]c1Cl Amb18325156 [0,1,0,0,0,0|3,0,0]=4 1754 B11R1.17 OCCSc1[n]cccc1Br Amb25702235 [0,1,0,0,0,0|2,0,0]=3 1755 B11R1.17 OCCSc1[n]cccc1F Amb18803328 [0,1,0,0,0,0|2,0,0]=3 1756 B11R1.17 OCCSc1cc[n]cc1Br Amb25333968 [0,1,0,0,0,0|2,0,0]=3 1757 B11R1.17 OC\C=C\c1ccccc1Br Amb25149289 [0,1,0,0,0,0|0,0,2]=3 1758 B11R1.17 OC\C=C\c1ccccc1F Amb23442840 [0,1,0,0,0,0|0,0,2]=3 1759 B11R1.17 O\N=C/Cc1ccccc1F Amb24100286 [0,1,0,0,0,0|1,0,1]=3 1760 B11R1.17 O\N=C\Cc1ccccc1F Amb25206635 [0,1,0,0,0,0|1,0,1]=3 1761 B11R1.17 Oc1[n]cccc1OCCO Amb25106031 [0,1,0,0,0,0|2,0,0]=3 1762 B11R1.17 Oc1ccc[n]c1CCCO Amb18125538 [0,1,0,0,0,0|1,0,0]=2 1763 B11R1.17 Oc1ccc[n]c1SCCO Amb18126792 [0,1,0,0,0,0|2,0,0]=3 1764 B11R1.17 Oc1ccccc1C#CCO Amb23412359 [0,1,0,0,0,0|0,0,2]=3 1765 B11R1.17 Oc1ccccc1CCC=O Amb22228954 [0,1,0,0,0,0|0,0,2]=3 1766 B11R1.17 Oc1ccccc1CCCF Amb24100539 [0,1,0,0,0,0|1,0,0]=2 1767 B11R1.17 Oc1ccccc1C\C=C/Cl Amb24578313 [0,1,0,0,0,0|1,0,2]=4 1768 B11R1.17 Oc1ccccc1C\C=C\Cl Amb18647090 [0,1,0,0,0,0|1,0,2]=4 1769 B11R1.17 Oc1ccccc1NCC=O Amb24096359 [0,1,0,0,0,0|1,0,2]=4 1770 B11R1.17 Oc1ccccc1NCCO Amb18644558 [0,1,0,0,0,0|1,0,0]=2 1771 B11R1.17 Oc1ccccc1OCCBr Amb25189201 [0,1,0,0,0,0|2,0,0]=3 1772 B11R1.17 Oc1ccccc1SCC=O Amb25290203 [0,1,0,0,0,0|1,0,2]=4 1773 B11R1.17 Oc1ccccc1SCCO Amb18177935 [0,1,0,0,0,0|1,0,0]=2 1774 B11R1.17 Oc1ccccc1\C=C/CCl Amb24401534 [0,1,0,0,0,0|1,0,2]=4 1775 B11R1.17 Oc1ccccc1\C=C/CO Amb18125107 [0,1,0,0,0,0|0,0,2]=3 1776 B11R1.17 Oc1ccccc1\C=C\CBr Amb25225899 [0,1,0,0,0,0|1,0,2]=4 1777 B11R1.17 Oc1ccccc1\C=C\CO Amb25300470 [0,1,0,0,0,0|0,0,2]=3 1778 B11R1.17 Oc1ccncc1CCCO Amb13889999 [0,1,0,0,0,0|1,0,0]=2 1779 B11R1.17 S=C=NCc1ccccc1Br Amb24402120 [0,1,0,0,0,0|1,1,1]=4 1780 B11R1.17 SCCCc1ccccc1Br Amb18070447 [0,1,0,0,0,0|0,1,0]=2 1781 B11R1.17 SCCCc1ccccc1C Amb17400218 [0,1,0,0,0,0|0,1,0]=2 1782 B11R1.17 SCCCc1ccccc1Cl Amb17401095 [0,1,0,0,0,0|0,1,0]=2 1783 B11R1.17 SCCCc1ccccc1F Amb17400332 [0,1,0,0,0,0|0,1,0]=2 1784 B11R1.17 SCCOc1ccccc1Br Amb17250554 [0,1,0,0,0,0|1,1,0]=3 1785 B11R1.17 SCCSc1[n]cccc1Br Amb24363354 [0,1,0,0,0,0|2,1,0]=4 1786 B11R1.17 SCCSc1[n]cccc1Cl Amb25191223 [0,1,0,0,0,0|2,1,0]=4 1787 B11R1.17 SCCSc1ccccc1Br Amb25306099 [0,1,0,0,0,0|1,1,0]=3 1788 B11R1.17 Sc1ccccc1CCCBr Amb25196016 [0,1,0,0,0,0|1,0,0]=2 1789 B11R1.17 Sc1ccccc1NCCS Amb25118736 [0,1,0,0,0,0|1,1,0]=3 1790 B11R1.17 [C-]#[N+]CCc1ccccc1O Amb24644224 [0,1,0,0,0,0|2,0,0]=3 1791 B11R1.17 [O-][n+]1ccccc1OCCF Amb24464395 [0,1,0,0,0,0|3,0,0]=4 1792 B11R1.17 [O-][n+]1ccccc1OCCO Amb25279652 [0,1,0,0,0,0|2,0,0]=3 1793 B11R1.17 [O-][n+]1ccccc1SCCO Amb25380962 [0,1,0,0,0,0|2,0,0]=3 1794 B11R1.24 BrCC#Cc1cc(I)ccc1 Amb25308173 [0,1,0,0,0,0|1,0,2]=4 1795 B11R1.24 BrCCCc1cccc(c1)Br Amb17104576 [0,1,0,0,0,0|1,0,0]=2 1796 B11R1.24 BrCCCc1cccc(c1)C Amb17104553 [0,1,0,0,0,0|1,0,0]=2 1797 B11R1.24 BrCCCc1cccc(c1)Cl Amb17104561 [0,1,0,0,0,0|1,0,0]=2 1798 B11R1.24 BrCCOc1cccc(c1)Br Amb1150981 [0,1,0,0,0,0|2,0,0]=3 1799 B11R1.24 BrCCOc1cccc(c1)C Amb1643479 [0,1,0,0,0,0|2,0,0]=3 1800 B11R1.24 BrCCOc1cccc(c1)Cl Amb1152965 [0,1,0,0,0,0|2,0,0]=3 1801 B11R1.24 Br[Zn]CCc1cccc(c1)Br Amb13890856 [0,1,0,0,0,0|2,0,0]=3 1802 B11R1.24 Brc1cc(ccc1)C#CCI Amb24447534 [0,1,0,0,0,0|1,0,2]=4 1803 B11R1.24 Brc1cc(ccc1)OCCI Amb25151269 [0,1,0,0,0,0|2,0,0]=3 1804 B11R1.24 C#CCCc1cccc(Cl)c1 Amb18116942 [0,1,0,0,0,0|1,0,1]=3 1805 B11R1.24 C#CCCc1cccc(F)c1 Amb18118085 [0,1,0,0,0,0|1,0,1]=3 1806 B11R1.24 C#CCNc1cccc(Cl)c1 Amb18800989 [0,1,0,0,0,0|2,0,1]=4 1807 B11R1.24 C#CCNc1cccc(F)c1 Amb24102181 [0,1,0,0,0,0|2,0,1]=4 1808 B11R1.24 C#CCNc1cccc(I)c1 Amb25312865 [0,1,0,0,0,0|2,0,1]=4 1809 B11R1.24 C#CCNc1cccc(O)c1 Amb25138473 [0,1,0,0,0,0|2,0,1]=4 1810 B11R1.24 C#CCOc1cccc(Cl)c1 Amb18183541 [0,1,0,0,0,0|2,0,1]=4 1811 B11R1.24 C#CCOc1cccc(F)c1 Amb18182728 [0,1,0,0,0,0|2,0,1]=4 1812 B11R1.24 C#CCOc1cccc(c1)N Amb13783680 [0,1,0,0,0,0|2,0,1]=4 1813 B11R1.24 C#CCSc1cccc(Cl)c1 Amb19068162 [0,1,0,0,0,0|2,0,1]=4 1814 B11R1.24 C#CCSc1cccc(N)c1 Amb25675317 [0,1,0,0,0,0|2,0,1]=4 1815 B11R1.24 C#CCSc1cccc(O)c1 Amb24657054 [0,1,0,0,0,0|2,0,1]=4 1816 B11R1.24 C=CCCC1=CC=CC(=O)N1 Amb25849768 [0,1,0,0,0,0|2,0,1]=4 1817 B11R1.24 C=CCCc1cc[n]c(N)c1 Amb24378060 [0,1,0,0,0,0|2,0,1]=4 1818 B11R1.24 C=CCCc1cccc(N)[n]1 Amb25189109 [0,1,0,0,0,0|2,0,1]=4 1819 B11R1.24 C=CCCc1cccc(O)c1 Amb25275934 [0,1,0,0,0,0|1,0,1]=3 1820 B11R1.24 C=CCNc1cccc(c1)Br Amb17306222 [0,1,0,0,0,0|2,0,1]=4 1821 B11R1.24 C=CCNc1cccc(c1)C Amb17306547 [0,1,0,0,0,0|2,0,1]=4 1822 B11R1.24 C=CCNc1cccc(c1)Cl Amb17307127 [0,1,0,0,0,0|2,0,1]=4 1823 B11R1.24 C=CCNc1cccc(c1)F Amb17306228 [0,1,0,0,0,0|2,0,1]=4 1824 B11R1.24 C=CCOc1cccc(F)c1 Amb24649594 [0,1,0,0,0,0|2,0,1]=4 1825 B11R1.24 C=CCOc1cccc(I)c1 Amb22896684 [0,1,0,0,0,0|2,0,1]=4 1826 B11R1.24 C=CCOc1cccc(c1)N Amb2094493 [0,1,0,0,0,0|2,0,1]=4 1827 B11R1.24 C=CCSc1cccc(N)c1 Amb24707774 [0,1,0,0,0,0|2,0,1]=4 1828 B11R1.24 CCC#Cc1cc(O)ccc1 Amb25139990 [0,1,0,0,0,0|1,0,2]=4 1829 B11R1.24 CCCCC1=CC=CC(=S)N1 Amb25720838 [0,1,0,0,0,0|2,0,0]=3 1830 B11R1.24 CCCCC1C=C(C)C=CN1 Amb24104097 [0,1,0,0,0,0|2,0,1]=4 1831 B11R1.24 CCCCC1C=CC=C(C)N1 Amb24104099 [0,1,0,0,0,0|2,0,1]=4 1832 B11R1.24 CCCCC=1C=CNC(=S)N1 Amb25161966 [0,1,0,0,0,0|3,0,0]=4 1833 B11R1.24 CCCCC=1C=NNC(=O)C1 Amb25693299 [0,1,0,0,0,0|3,0,0]=4 1834 B11R1.24 CCCCC=1C=NNC(=S)C1 Amb25162595 [0,1,0,0,0,0|3,0,0]=4 1835 B11R1.24 CCCC[n+]1cc(C)ccc1 Amb22047356 [0,1,0,0,0,0|2,0,0]=3 1836 B11R1.24 CCCC[n+]1cc(C)ccc1 Amb22264602 [0,1,0,0,0,0|2,0,0]=3 1837 B11R1.24 CCCC[n+]1cc(C)ccc1 Amb22411627 [0,1,0,0,0,0|2,0,0]=3 1838 B11R1.24 CCCC[n+]1cc(C)ccc1 Amb24323548 [0,1,0,0,0,0|2,0,0]=3 1839 B11R1.24 CCCCc1[n]c(Cl)cc[n]1 Amb24116455 [0,1,0,0,0,0|3,0,0]=4 1840 B11R1.24 CCCCc1[n]c(N)cc[n]1 Amb25149167 [0,1,0,0,0,0|3,0,0]=4 1841 B11R1.24 CCCCc1c[n]cc(N)c1 Amb24757999 [0,1,0,0,0,0|2,0,0]=3 1842 B11R1.24 CCCCc1cc(Br)cc[n]1 Amb24083005 [0,1,0,0,0,0|2,0,0]=3 1843 B11R1.24 CCCCc1cc(O)cc[n]1 Amb25109626 [0,1,0,0,0,0|2,0,0]=3 1844 B11R1.24 CCCCc1cc[n]c(Cl)[n]1 Amb25117967 [0,1,0,0,0,0|3,0,0]=4 1845 B11R1.24 CCCCc1cc[n]c(N)[n]1 Amb25059121 [0,1,0,0,0,0|3,0,0]=4 1846 B11R1.24 CCCCc1cc[n]c(N)c1 Amb24629138 [0,1,0,0,0,0|2,0,0]=3 1847 B11R1.24 CCCCc1cc[n]c(O)c1 Amb22749775 [0,1,0,0,0,0|2,0,0]=3 1848 B11R1.24 CCCCc1cccc(Br)c1 Amb19944057 [0,1,0,0,0,0|1,0,0]=2 1849 B11R1.24 CCCCc1cccc(I)c1 Amb19944046 [0,1,0,0,0,0|1,0,0]=2 1850 B11R1.24 CCCCc1cccc(N)[n]1 Amb18644442 [0,1,0,0,0,0|2,0,0]=3 1851 B11R1.24 CCCCc1cccc(S)c1 Amb24415059 [0,1,0,0,0,0|1,0,0]=2 1852 B11R1.24 CCCCc1cccc(c1)N Amb17593719 [0,1,0,0,0,0|1,0,0]=2 1853 B11R1.24 CCCNc1cc(Br)c[n]c1 Amb23450119 [0,1,0,0,0,0|3,0,0]=4 1854 B11R1.24 CCCNc1cc(Br)cc[n]1 Amb19959557 [0,1,0,0,0,0|3,0,0]=4 1855 B11R1.24 CCCNc1cc(Cl)c[n]c1 Amb25312529 [0,1,0,0,0,0|3,0,0]=4 1856 B11R1.24 CCCNc1cc(F)c[n]c1 Amb25151999 [0,1,0,0,0,0|3,0,0]=4 1857 B11R1.24 CCCNc1cc(N)[n]cc1 Amb25341378 [0,1,0,0,0,0|3,0,0]=4 1858 B11R1.24 CCCNc1cc(N)c[n]c1 Amb24468291 [0,1,0,0,0,0|3,0,0]=4 1859 B11R1.24 CCCNc1cc(N)ccn1 Amb17334314 [0,1,0,0,0,0|3,0,0]=4 1860 B11R1.24 CCCNc1cc(O)cc[n]1 Amb25678446 [0,1,0,0,0,0|3,0,0]=4 1861 B11R1.24 CCCNc1cccc(Br)[n]1 Amb22831396 [0,1,0,0,0,0|3,0,0]=4 1862 B11R1.24 CCCNc1cccc(Br)[n]1 Amb25145786 [0,1,0,0,0,0|3,0,0]=4 1863 B11R1.24 CCCNc1cccc(Cl)[n]1 Amb21958678 [0,1,0,0,0,0|3,0,0]=4 1864 B11R1.24 CCCNc1cccc(F)[n]1 Amb18973532 [0,1,0,0,0,0|3,0,0]=4 1865 B11R1.24 CCCNc1cccc(O)[n]1 Amb25850757 [0,1,0,0,0,0|3,0,0]=4 1866 B11R1.24 CCCOC1=CC(=O)NC=C1 Amb25729079 [0,1,0,0,0,0|3,0,0]=4 1867 B11R1.24 CCCOc1c[n]cc(Br)c1 Amb19959579 [0,1,0,0,0,0|3,0,0]=4 1868 B11R1.24 CCCOc1c[n]cc(N)c1 Amb24320310 [0,1,0,0,0,0|3,0,0]=4 1869 B11R1.24 CCCOc1cc(Br)ccn1 Amb10599830 [0,1,0,0,0,0|3,0,0]=4 1870 B11R1.24 CCCOc1cc(Cl)[n]cc1 Amb24065113 [0,1,0,0,0,0|3,0,0]=4 1871 B11R1.24 CCCOc1cc(Cl)cc[n]1 Amb22276515 [0,1,0,0,0,0|3,0,0]=4 1872 B11R1.24 CCCOc1cc(Cl)ccc1 Amb25787001 [0,1,0,0,0,0|2,0,0]=3 1873 B11R1.24 CCCOc1cc(F)[n]cc1 Amb24084203 [0,1,0,0,0,0|3,0,0]=4 1874 B11R1.24 CCCOc1cc(F)ccc1 Amb25700428 [0,1,0,0,0,0|2,0,0]=3 1875 B11R1.24 CCCOc1cc(I)cc[n]1 Amb25352720 [0,1,0,0,0,0|3,0,0]=4 1876 B11R1.24 CCCOc1cc(N)[n]cc1 Amb20617625 [0,1,0,0,0,0|3,0,0]=4 1877 B11R1.24 CCCOc1cc(N)cc[n]1 Amb18981543 [0,1,0,0,0,0|3,0,0]=4 1878 B11R1.24 CCCOc1cccc(Cl)[n]1 Amb25757082 [0,1,0,0,0,0|3,0,0]=4 1879 B11R1.24 CCCOc1cccc(F)[n]1 Amb18787563 [0,1,0,0,0,0|3,0,0]=4 1880 B11R1.24 CCCOc1cccc(c1)C Amb10573406 [0,1,0,0,0,0|2,0,0]=3 1881 B11R1.24 CCCOc1cccc(c1)N Amb1138945 [0,1,0,0,0,0|2,0,0]=3 1882 B11R1.24 CCCOc1cccc(n1)Br Amb10599306 [0,1,0,0,0,0|3,0,0]=4 1883 B11R1.24 CCCOc1ccnc(c1)Br Amb10599900 [0,1,0,0,0,0|3,0,0]=4 1884 B11R1.24 CCCSc1cc(Br)ccc1 Amb24538191 [0,1,0,0,0,0|2,0,0]=3 1885 B11R1.24 CCCSc1cc(Cl)cc[n]1 Amb22276429 [0,1,0,0,0,0|3,0,0]=4 1886 B11R1.24 CCCSc1cc(Cl)ccc1 Amb25801816 [0,1,0,0,0,0|2,0,0]=3 1887 B11R1.24 CCCSc1cc(F)[n]cc1 Amb25338743 [0,1,0,0,0,0|3,0,0]=4 1888 B11R1.24 CCCSc1cc(F)ccc1 Amb25806371 [0,1,0,0,0,0|2,0,0]=3 1889 B11R1.24 CCCSc1cc(N)cc[n]1 Amb18293405 [0,1,0,0,0,0|3,0,0]=4 1890 B11R1.24 CCCSc1cc(N)ccc1 Amb18289141 [0,1,0,0,0,0|2,0,0]=3 1891 B11R1.24 CCCSc1cc(O)ccc1 Amb18126556 [0,1,0,0,0,0|2,0,0]=3 1892 B11R1.24 CCCSc1cccc(Br)[n]1 Amb25134245 [0,1,0,0,0,0|3,0,0]=4 1893 B11R1.24 CCCSc1cccc(F)[n]1 Amb18177984 [0,1,0,0,0,0|3,0,0]=4 1894 B11R1.24 CCCSc1cccc(O)[n]1 Amb18126626 [0,1,0,0,0,0|3,0,0]=4 1895 B11R1.24 CCNCC1=CC=CC(=O)N1 Amb25148033 [0,1,0,0,0,0|3,0,0]=4 1896 B11R1.24 CCNCc1cc(Br)[n]cc1 Amb20618633 [0,1,0,0,0,0|3,0,0]=4 1897 B11R1.24 CCNCc1cc(Cl)[n]cc1 Amb24379058 [0,1,0,0,0,0|3,0,0]=4 1898 B11R1.24 CCNCc1cc(Cl)c[n]c1 Amb25760921 [0,1,0,0,0,0|3,0,0]=4 1899 B11R1.24 CCNCc1cc(F)c[n]c1 Amb25728604 [0,1,0,0,0,0|3,0,0]=4 1900 B11R1.24 CCNCc1cc(I)ccc1 Amb24066806 [0,1,0,0,0,0|2,0,0]=3 1901 B11R1.24 CCNCc1cc(I)ccc1 Amb24066807 [0,1,0,0,0,0|2,0,0]=3 1902 B11R1.24 CCNCc1cc(N)ccc1 Amb18290000 [0,1,0,0,0,0|2,0,0]=3 1903 B11R1.24 CCNCc1cc(S)ccc1 Amb25705598 [0,1,0,0,0,0|2,0,0]=3 1904 B11R1.24 CCNCc1cccc(Br)[n]1 Amb25778040 [0,1,0,0,0,0|3,0,0]=4 1905 B11R1.24 CCNCc1cccc(c1)Br Amb13949217 [0,1,0,0,0,0|2,0,0]=3 1906 B11R1.24 CCOCc1cc(Br)[n]cc1 Amb20618632 [0,1,0,0,0,0|3,0,0]=4 1907 B11R1.24 CCOCc1cc(Br)ccc1 Amb23512545 [0,1,0,0,0,0|2,0,0]=3 1908 B11R1.24 CCOCc1cc(Cl)[n]cc1 Amb18185710 [0,1,0,0,0,0|3,0,0]=4 1909 B11R1.24 CCOCc1cc(Cl)ccc1 Amb24486866 [0,1,0,0,0,0|2,0,0]=3 1910 B11R1.24 CCOCc1cc(N)[n]cc1 Amb18298616 [0,1,0,0,0,0|3,0,0]=4 1911 B11R1.24 CCOCc1cc(O)ccc1 Amb23443319 [0,1,0,0,0,0|2,0,0]=3 1912 B11R1.24 CCSCc1cc(Br)ccc1 Amb24476579 [0,1,0,0,0,0|2,0,0]=3 1913 B11R1.24 CCSCc1cc(Cl)[n]cc1 Amb19077090 [0,1,0,0,0,0|3,0,0]=4 1914 B11R1.24 CCSCc1cc(N)[n]cc1 Amb18298621 [0,1,0,0,0,0|3,0,0]=4 1915 B11R1.24 CCSCc1cc(N)cc[n]1 Amb25260319 [0,1,0,0,0,0|3,0,0]=4 1916 B11R1.24 CCSCc1cc(O)ccc1 Amb18126555 [0,1,0,0,0,0|2,0,0]=3 1917 B11R1.24 CCSCc1cccc(Cl)[n]1 Amb25846378 [0,1,0,0,0,0|3,0,0]=4 1918 B11R1.24 CC\C=C\c1cccc(Br)c1 Amb25132907 [0,1,0,0,0,0|1,0,2]=4 1919 B11R1.24 CC\C=C\c1cccc(c1)O Amb16231489 [0,1,0,0,0,0|1,0,2]=4 1920 B11R1.24 CC\N=C\c1cccc(O)c1 Amb24662288 [0,1,0,0,0,0|2,0,1]=4 1921 B11R1.24 CNCCC=1C=CNC(=O)C1 Amb24759313 [0,1,0,0,0,0|3,0,0]=4 1922 B11R1.24 CNCCc1c[n]cc(Br)c1 Amb25149055 [0,1,0,0,0,0|3,0,0]=4 1923 B11R1.24 CNCCc1c[n]cc(F)c1 Amb18993612 [0,1,0,0,0,0|3,0,0]=4 1924 B11R1.24 CNCCc1cc(Cl)cc[n]1 Amb25163179 [0,1,0,0,0,0|3,0,0]=4 1925 B11R1.24 CNCCc1cc[n]c(Cl)c1 Amb24407156 [0,1,0,0,0,0|3,0,0]=4 1926 B11R1.24 CNCCc1cccc(Br)[n]1 Amb25324918 [0,1,0,0,0,0|3,0,0]=4 1927 B11R1.24 CNCCc1cccc(Cl)[n]1 Amb24679236 [0,1,0,0,0,0|3,0,0]=4 1928 B11R1.24 CNCCc1cccc(F)[n]1 Amb24596710 [0,1,0,0,0,0|3,0,0]=4 1929 B11R1.24 CNCCc1cccc(I)c1 Amb25187651 [0,1,0,0,0,0|2,0,0]=3 1930 B11R1.24 CNCCc1cccc(N)c1 Amb18550411 [0,1,0,0,0,0|2,0,0]=3 1931 B11R1.24 CNCCc1cccc(O)c1 Amb18560894 [0,1,0,0,0,0|2,0,0]=3 1932 B11R1.24 CNCCc1cccc(c1)Br Amb16230486 [0,1,0,0,0,0|2,0,0]=3 1933 B11R1.24 CNCCc1cccc(c1)C Amb16230487 [0,1,0,0,0,0|2,0,0]=3 1934 B11R1.24 CNNCc1cccc(Cl)c1 Amb22469834 [0,1,0,0,0,0|3,0,0]=4 1935 B11R1.24 COCCC1=CC=CC(=O)N1 Amb24485973 [0,1,0,0,0,0|3,0,0]=4 1936 B11R1.24 COCC[n+]1cc(C)ccc1 Amb25127531 [0,1,0,0,0,0|3,0,0]=4 1937 B11R1.24 COCC[n+]1cc(O)ccc1 Amb25822049 [0,1,0,0,0,0|3,0,0]=4 1938 B11R1.24 COCCc1c[n]cc(N)c1 Amb23570649 [0,1,0,0,0,0|3,0,0]=4 1939 B11R1.24 COCCc1cc(Br)cc[n]1 Amb25735992 [0,1,0,0,0,0|3,0,0]=4 1940 B11R1.24 COCCc1cccc(Br)[n]1 Amb25194969 [0,1,0,0,0,0|3,0,0]=4 1941 B11R1.24 COCCc1cccc(N)c1 Amb24373231 [0,1,0,0,0,0|2,0,0]=3 1942 B11R1.24 COCCc1cccc(O)c1 Amb22055706 [0,1,0,0,0,0|2,0,0]=3 1943 B11R1.24 COCCc1nccc(c1)C Amb10573767 [0,1,0,0,0,0|3,0,0]=4 1944 B11R1.24 COCNc1cccc(F)c1 Amb24102182 [0,1,0,0,0,0|3,0,0]=4 1945 B11R1.24 COCOc1cc(Br)ccc1 Amb25810590 [0,1,0,0,0,0|3,0,0]=4 1946 B11R1.24 COCOc1cc(Cl)ccc1 Amb24551706 [0,1,0,0,0,0|3,0,0]=4 1947 B11R1.24 COCOc1cc(F)ccc1 Amb21858121 [0,1,0,0,0,0|3,0,0]=4 1948 B11R1.24 COCOc1cc(N)ccc1 Amb25096531 [0,1,0,0,0,0|3,0,0]=4 1949 B11R1.24 COCSc1cccc(Cl)c1 Amb24706398 [0,1,0,0,0,0|3,0,0]=4 1950 B11R1.24 COCSc1cccc(N)c1 Amb24532948 [0,1,0,0,0,0|3,0,0]=4 1951 B11R1.24 CONCc1cccc(I)c1 Amb25719180 [0,1,0,0,0,0|3,0,0]=4 1952 B11R1.24 CSCCc1cccc(N)c1 Amb25364016 [0,1,0,0,0,0|2,0,0]=3 1953 B11R1.24 CSCOc1cccc(Cl)c1 Amb24516553 [0,1,0,0,0,0|3,0,0]=4 1954 B11R1.24 CSCSc1cc(Cl)ccc1 Amb24631399 [0,1,0,0,0,0|3,0,0]=4 1955 B11R1.24 Cc1[n]c(CCCN)cc[n]1 Amb18981849 [0,1,0,0,0,0|3,0,0]=4 1956 B11R1.24 Cc1[n]c(cc[n]1)NCCO Amb18997333 [0,1,0,0,0,0|3,0,0]=4 1957 B11R1.24 Cc1[n]c(cc[n]1)SCCO Amb18183600 [0,1,0,0,0,0|3,0,0]=4 1958 B11R1.24 Cc1c[n]cc(CCCC)c1 Amb24062203 [0,1,0,0,0,0|2,0,0]=3 1959 B11R1.24 Cc1c[n]cc(CNCC)c1 Amb18831277 [0,1,0,0,0,0|3,0,0]=4 1960 B11R1.24 Cc1c[n]cc(NCCO)[n]1 Amb24476282 [0,1,0,0,0,0|3,0,0]=4 1961 B11R1.24 Cc1cc(CCC#N)[n]cc1 Amb18124805 [0,1,0,0,0,0|2,0,1]=4 1962 B11R1.24 Cc1cc(CCC=C)[n]cc1 Amb24104089 [0,1,0,0,0,0|2,0,1]=4 1963 B11R1.24 Cc1cc(CCCC)[n]c[n]1 Amb24091342 [0,1,0,0,0,0|3,0,0]=4 1964 B11R1.24 Cc1cc(CCCCl)c[n]c1 Amb24538216 [0,1,0,0,0,0|2,0,0]=3 1965 B11R1.24 Cc1cc(CCCN)[n]c[n]1 Amb18201567 [0,1,0,0,0,0|3,0,0]=4 1966 B11R1.24 Cc1cc(CCCN)[n]cc1 Amb18201862 [0,1,0,0,0,0|2,0,0]=3 1967 B11R1.24 Cc1cc(CCCN)[n]cc1 Amb22886487 [0,1,0,0,0,0|2,0,0]=3 1968 B11R1.24 Cc1cc(CCCN)c[n]c1 Amb24509275 [0,1,0,0,0,0|2,0,0]=3 1969 B11R1.24 Cc1cc(CCCN)cc[n]1 Amb18201861 [0,1,0,0,0,0|2,0,0]=3 1970 B11R1.24 Cc1cc(CCON)ccc1 Amb25704227 [0,1,0,0,0,0|2,0,0]=3 1971 B11R1.24 Cc1cc(CNC#N)ccc1 Amb25782843 [0,1,0,0,0,0|2,0,1]=4 1972 B11R1.24 Cc1cc(CNCC)cc[n]1 Amb18201773 [0,1,0,0,0,0|3,0,0]=4 1973 B11R1.24 Cc1cc(COCCl)ccc1 Amb24443129 [0,1,0,0,0,0|2,0,0]=3 1974 B11R1.24 Cc1cc(CSCCl)ccc1 Amb25732759 [0,1,0,0,0,0|2,0,0]=3 1975 B11R1.24 Cc1cc(NCCBr)[n]cc1 Amb25798519 [0,1,0,0,0,0|3,0,0]=4 1976 B11R1.24 Cc1cc(NCCCl)[n]cc1 Amb25374118 [0,1,0,0,0,0|3,0,0]=4 1977 B11R1.24 Cc1cc(NCCN)ncc1 Amb10607842 [0,1,0,0,0,0|3,0,0]=4 1978 B11R1.24 Cc1cc(NCCO)[n]cc1 Amb18981411 [0,1,0,0,0,0|2,0,0]=3 1979 B11R1.24 Cc1cc(NCCO)[n]cc1 Amb19374562 [0,1,0,0,0,0|2,0,0]=3 1980 B11R1.24 Cc1cc(NCCS)[n]cc1 Amb25189649 [0,1,0,0,0,0|2,1,0]=4 1981 B11R1.24 Cc1cc([n][n]c1)SCCO Amb24397096 [0,1,0,0,0,0|3,0,0]=4 1982 B11R1.24 Cc1cc([n]c[n]1)SCCO Amb18177938 [0,1,0,0,0,0|3,0,0]=4 1983 B11R1.24 Cc1cc([n]cc1)OCCN Amb18988887 [0,1,0,0,0,0|3,0,0]=4 1984 B11R1.24 Cc1cc([n]cc1)SCCCl Amb19071517 [0,1,0,0,0,0|3,0,0]=4 1985 B11R1.24 Cc1cc([n]cc1)SCCN Amb18908763 [0,1,0,0,0,0|3,0,0]=4 1986 B11R1.24 Cc1cc([n]cc1)SCCO Amb18801394 [0,1,0,0,0,0|2,0,0]=3 1987 B11R1.24 Cc1cc(\C=C\CBr)ccc1 Amb25068031 [0,1,0,0,0,0|1,0,2]=4 1988 B11R1.24 Cc1cc(\C=C\CN)ccc1 Amb18065182 [0,1,0,0,0,0|1,0,2]=4 1989 B11R1.24 Cc1cc(\C=C\CO)ccc1 Amb23442940 [0,1,0,0,0,0|0,0,2]=3 1990 B11R1.24 Cc1cc(c[n]c1)C#CCO Amb25251691 [0,1,0,0,0,0|1,0,2]=4 1991 B11R1.24 Cc1cc(c[n]c1)NCCN Amb24731510 [0,1,0,0,0,0|3,0,0]=4 1992 B11R1.24 Cc1cc(cc[n]1)NCCF Amb25152258 [0,1,0,0,0,0|3,0,0]=4 1993 B11R1.24 Cc1cc(cc[n]1)NCCN Amb24383516 [0,1,0,0,0,0|3,0,0]=4 1994 B11R1.24 Cc1cc(cc[n]1)SCCO Amb25712261 [0,1,0,0,0,0|2,0,0]=3 1995 B11R1.24 Cc1cc(ccc1)C#CCCl Amb18792611 [0,1,0,0,0,0|1,0,2]=4 1996 B11R1.24 Cc1cc(ccc1)C#CCI Amb25260706 [0,1,0,0,0,0|1,0,2]=4 1997 B11R1.24 Cc1cc(ccc1)C#CCN Amb18949797 [0,1,0,0,0,0|1,0,2]=4 1998 B11R1.24 Cc1cc(ccc1)OCC#C Amb19373318 [0,1,0,0,0,0|2,0,1]=4 1999 B11R1.24 Cc1cc(ccc1)OCC=C Amb25688938 [0,1,0,0,0,0|2,0,1]=4 2000 B11R1.24 Cc1cc(ccc1)OCCF Amb25711593 [0,1,0,0,0,0|2,0,0]=3 2001 B11R1.24 Cc1cc(ccc1)SCC#C Amb18788143 [0,1,0,0,0,0|2,0,1]=4 2002 B11R1.24 Cc1cc(ccc1)SCC#N Amb18788233 [0,1,0,0,0,0|2,0,1]=4 2003 B11R1.24 Cc1cc(ccc1)SCCBr Amb24753608 [0,1,0,0,0,0|2,0,0]=3 2004 B11R1.24 Cc1cc(ccc1)SCCCl Amb18316731 [0,1,0,0,0,0|2,0,0]=3 2005 B11R1.24 Cc1cc(ccc1)SCCF Amb25307210 [0,1,0,0,0,0|2,0,0]=3 2006 B11R1.24 Cc1cc[n]c(CCCC)c1 Amb24065447 [0,1,0,0,0,0|2,0,0]=3 2007 B11R1.24 Cc1cc[n]c(CCCN)[n]1 Amb18064067 [0,1,0,0,0,0|3,0,0]=4 2008 B11R1.24 Cc1cc[n]c(CCNC)c1 Amb18125194 [0,1,0,0,0,0|3,0,0]=4 2009 B11R1.24 Cc1cc[n]c(CNCC)c1 Amb24422936 [0,1,0,0,0,0|3,0,0]=4 2010 B11R1.24 Cc1cc[n]c(NCCO)[n]1 Amb19000715 [0,1,0,0,0,0|3,0,0]=4 2011 B11R1.24 Cc1cc[n]c([n]1)OCCO Amb25221475 [0,1,0,0,0,0|3,0,0]=4 2012 B11R1.24 Cc1cc[n]c([n]1)SCCO Amb18185639 [0,1,0,0,0,0|3,0,0]=4 2013 B11R1.24 Cc1cc[n]c(c1)NCCC Amb18293521 [0,1,0,0,0,0|3,0,0]=4 2014 B11R1.24 Cc1cccc(C#CCO)[n]1 Amb25169280 [0,1,0,0,0,0|1,0,2]=4 2015 B11R1.24 Cc1cccc(CCC#N)[n]1 Amb24085300 [0,1,0,0,0,0|2,0,1]=4 2016 B11R1.24 Cc1cccc(CCC=C)[n]1 Amb24100506 [0,1,0,0,0,0|2,0,1]=4 2017 B11R1.24 Cc1cccc(CCCC)[n]1 Amb24065450 [0,1,0,0,0,0|2,0,0]=3 2018 B11R1.24 Cc1cccc(CCCC)c1 Amb22730119 [0,1,0,0,0,0|1,0,0]=2 2019 B11R1.24 Cc1cccc(CCNC)[n]1 Amb18125196 [0,1,0,0,0,0|3,0,0]=4 2020 B11R1.24 Cc1cccc(CNOC)c1 Amb25362893 [0,1,0,0,0,0|3,0,0]=4 2021 B11R1.24 Cc1cccc(CSCC)c1 Amb25838308 [0,1,0,0,0,0|2,0,0]=3 2022 B11R1.24 Cc1cccc(NCCCl)[n]1 Amb25846545 [0,1,0,0,0,0|3,0,0]=4 2023 B11R1.24 Cc1cccc(NCCF)[n]1 Amb25274531 [0,1,0,0,0,0|3,0,0]=4 2024 B11R1.24 Cc1cccc(NCCN)[n]1 Amb18970380 [0,1,0,0,0,0|3,0,0]=4 2025 B11R1.24 Cc1cccc(NCCN)[n]1 Amb19440303 [0,1,0,0,0,0|3,0,0]=4 2026 B11R1.24 Cc1cccc(NCCO)[n]1 Amb18290373 [0,1,0,0,0,0|2,0,0]=3 2027 B11R1.24 Cc1cccc(NCCS)[n]1 Amb25065548 [0,1,0,0,0,0|2,1,0]=4 2028 B11R1.24 Cc1cccc([n]1)OCCC Amb25097663 [0,1,0,0,0,0|3,0,0]=4 2029 B11R1.24 Cc1cccc([n]1)OCCN Amb18296490 [0,1,0,0,0,0|3,0,0]=4 2030 B11R1.24 Cc1cccc([n]1)OCCO Amb22900069 [0,1,0,0,0,0|2,0,0]=3 2031 B11R1.24 Cc1cccc([n]1)SCCCl Amb19059627 [0,1,0,0,0,0|3,0,0]=4 2032 B11R1.24 Cc1cccc([n]1)SCCN Amb18908762 [0,1,0,0,0,0|3,0,0]=4 2033 B11R1.24 Cc1cccc([n]1)SCCO Amb18180212 [0,1,0,0,0,0|2,0,0]=3 2034 B11R1.24 Cc1cccc(c1)SCOC Amb25235859 [0,1,0,0,0,0|3,0,0]=4 2035 B11R1.24 ClCC#Cc1cc(Br)ccc1 Amb25132294 [0,1,0,0,0,0|1,0,2]=4 2036 B11R1.24 ClCC#Cc1cc(I)ccc1 Amb25282204 [0,1,0,0,0,0|1,0,2]=4 2037 B11R1.24 ClCCCc1cccc(I)c1 Amb25239109 [0,1,0,0,0,0|1,0,0]=2 2038 B11R1.24 ClCCCc1cccc(c1)Br Amb17104548 [0,1,0,0,0,0|1,0,0]=2 2039 B11R1.24 ClCCCc1cccc(c1)C Amb17104526 [0,1,0,0,0,0|1,0,0]=2 2040 B11R1.24 ClCCCc1cccc(c1)Cl Amb17104534 [0,1,0,0,0,0|1,0,0]=2 2041 B11R1.24 ClCCCc1cccc(c1)N Amb17477709 [0,1,0,0,0,0|1,0,0]=2 2042 B11R1.24 ClCCCc1cccc(c1)O Amb17477723 [0,1,0,0,0,0|1,0,0]=2 2043 B11R1.24 ClCCNc1cccc(c1)Br Amb17346197 [0,1,0,0,0,0|2,0,0]=3 2044 B11R1.24 ClCCNc1cccc(c1)C Amb17334786 [0,1,0,0,0,0|2,0,0]=3 2045 B11R1.24 ClCCNc1cccc(c1)Cl Amb17336181 [0,1,0,0,0,0|2,0,0]=3 2046 B11R1.24 ClCCNc1cccc(c1)F Amb17334966 [0,1,0,0,0,0|2,0,0]=3 2047 B11R1.24 ClCCOc1cccc(c1)N Amb10608112 [0,1,0,0,0,0|2,0,0]=3 2048 B11R1.24 ClC\C=C\c1cccc(Br)c1 Amb25149089 [0,1,0,0,0,0|1,0,2]=4 2049 B11R1.24 Clc1cc(\C=C\CBr)ccc1 Amb25117084 [0,1,0,0,0,0|1,0,2]=4 2050 B11R1.24 Clc1cc(ccc1)C#CCBr Amb24437476 [0,1,0,0,0,0|1,0,2]=4 2051 B11R1.24 Clc1cc(ccc1)C#CCCl Amb19067004 [0,1,0,0,0,0|1,0,2]=4 2052 B11R1.24 Clc1cc(ccc1)OCCI Amb25334122 [0,1,0,0,0,0|2,0,0]=3 2053 B11R1.24 Clc1cccc(c1)SCCCl Amb25857042 [0,1,0,0,0,0|2,0,0]=3 2054 B11R1.24 Clc1cccc(c1)\C=C\CCl Amb25858073 [0,1,0,0,0,0|1,0,2]=4 2055 B11R1.24 FCC#Cc1cc(I)ccc1 Amb25342342 [0,1,0,0,0,0|1,0,2]=4 2056 B11R1.24 FCCNc1cc(Br)cc[n]1 Amb25852545 [0,1,0,0,0,0|3,0,0]=4 2057 B11R1.24 FCCNc1cc(Br)ccc1 Amb25307539 [0,1,0,0,0,0|2,0,0]=3 2058 B11R1.24 FCCNc1cc(Cl)ccc1 Amb24427077 [0,1,0,0,0,0|2,0,0]=3 2059 B11R1.24 FCCOc1cc(Br)cc[n]1 Amb24458653 [0,1,0,0,0,0|3,0,0]=4 2060 B11R1.24 FCCOc1cc(Br)ccc1 Amb22227889 [0,1,0,0,0,0|2,0,0]=3 2061 B11R1.24 FCCOc1cc(Cl)ccc1 Amb24659046 [0,1,0,0,0,0|2,0,0]=3 2062 B11R1.24 FCCSc1cc(Cl)ccc1 Amb25266256 [0,1,0,0,0,0|2,0,0]=3 2063 B11R1.24 Fc1cc(CCCBr)ccc1 Amb22886712 [0,1,0,0,0,0|1,0,0]=2 2064 B11R1.24 Fc1cc(CCCCl)c[n]c1 Amb24486007 [0,1,0,0,0,0|2,0,0]=3 2065 B11R1.24 Fc1cc(CCCCl)ccc1 Amb18803316 [0,1,0,0,0,0|1,0,0]=2 2066 B11R1.24 Fc1cc(CCCS)ccc1 Amb18065480 [0,1,0,0,0,0|0,1,0]=2 2067 B11R1.24 Fc1cc(CC[Zn]Br)ccc1 Amb22000496 [0,1,0,0,0,0|2,0,0]=3 2068 B11R1.24 Fc1cc(\C=C\CCl)ccc1 Amb25103585 [0,1,0,0,0,0|1,0,2]=4 2069 B11R1.24 Fc1cc(c[n]c1)OCCBr Amb25088521 [0,1,0,0,0,0|3,0,0]=4 2070 B11R1.24 Fc1cc(c[n]c1)OCCCl Amb24425626 [0,1,0,0,0,0|3,0,0]=4 2071 B11R1.24 Fc1cc(c[n]c1)OCCS Amb24651743 [0,1,0,0,0,0|2,1,0]=4 2072 B11R1.24 Fc1cc(ccc1)C#CCCl Amb18180185 [0,1,0,0,0,0|1,0,2]=4 2073 B11R1.24 Fc1cc(ccc1)C#CCI Amb25797661 [0,1,0,0,0,0|1,0,2]=4 2074 B11R1.24 Fc1cc(ccc1)NCCBr Amb25311264 [0,1,0,0,0,0|2,0,0]=3 2075 B11R1.24 Fc1cc(ccc1)SCCCl Amb25779976 [0,1,0,0,0,0|2,0,0]=3 2076 B11R1.24 Fc1cccc(NCCF)[n]1 Amb24501811 [0,1,0,0,0,0|3,0,0]=4 2077 B11R1.24 Fc1cccc(c1)OCCF Amb22232794 [0,1,0,0,0,0|2,0,0]=3 2078 B11R1.24 Ic1cc(ccc1)C#CCI Amb24729732 [0,1,0,0,0,0|1,0,2]=4 2079 B11R1.24 N#CCCc1cccc(I)c1 Amb25312666 [0,1,0,0,0,0|1,0,1]=3 2080 B11R1.24 N#CCCc1cccc(c1)C Amb17204296 [0,1,0,0,0,0|1,0,1]=3 2081 B11R1.24 N#CCCc1cccc(c1)Cl Amb17204310 [0,1,0,0,0,0|1,0,1]=3 2082 B11R1.24 N#CCCc1cccc(c1)F Amb10841716 [0,1,0,0,0,0|1,0,1]=3 2083 B11R1.24 N#CCSc1cccc(Br)c1 Amb20642031 [0,1,0,0,0,0|2,0,1]=4 2084 B11R1.24 N#CCSc1cccc(Cl)c1 Amb18324763 [0,1,0,0,0,0|2,0,1]=4 2085 B11R1.24 N#CCSc1cccc(O)c1 Amb25748990 [0,1,0,0,0,0|2,0,1]=4 2086 B11R1.24 N#CNCc1cccc(Cl)c1 Amb18183546 [0,1,0,0,0,0|2,0,1]=4 2087 B11R1.24 N#CNCc1cccc(F)c1 Amb18799358 [0,1,0,0,0,0|2,0,1]=4 2088 B11R1.24 N#CSCc1cccc(Br)c1 Amb21959351 [0,1,0,0,0,0|2,0,1]=4 2089 B11R1.24 N#CSCc1cccc(Cl)c1 Amb19889457 [0,1,0,0,0,0|2,0,1]=4 2090 B11R1.24 N#CSCc1cccc(c1)F Amb10789220 [0,1,0,0,0,0|2,0,1]=4 2091 B11R1.24 NCC#Cc1cc(Cl)ccc1 Amb18957240 [0,1,0,0,0,0|1,0,2]=4 2092 B11R1.24 NCC#Cc1cc(F)ccc1 Amb18949810 [0,1,0,0,0,0|1,0,2]=4 2093 B11R1.24 NCC#Cc1cc(O)ccc1 Amb25084990 [0,1,0,0,0,0|1,0,2]=4 2094 B11R1.24 NCCCc1[n]c(O)cc[n]1 Amb18224336 [0,1,0,0,0,0|3,0,0]=4 2095 B11R1.24 NCCCc1c[n]cc(Br)c1 Amb25277365 [0,1,0,0,0,0|2,0,0]=3 2096 B11R1.24 NCCCc1c[n]cc(Cl)c1 Amb25793558 [0,1,0,0,0,0|2,0,0]=3 2097 B11R1.24 NCCCc1c[n]cc(F)c1 Amb25204369 [0,1,0,0,0,0|2,0,0]=3 2098 B11R1.24 NCCCc1cc(Cl)cc[n]1 Amb24432795 [0,1,0,0,0,0|2,0,0]=3 2099 B11R1.24 NCCCc1cc(O)[n]c[n]1 Amb18224337 [0,1,0,0,0,0|3,0,0]=4 2100 B11R1.24 NCCCc1cc[n]c(Br)c1 Amb25686087 [0,1,0,0,0,0|2,0,0]=3 2101 B11R1.24 NCCCc1cc[n]c(Cl)c1 Amb25340473 [0,1,0,0,0,0|2,0,0]=3 2102 B11R1.24 NCCCc1cc[n]c(S)[n]1 Amb18199035 [0,1,0,0,0,0|3,0,0]=4 2103 B11R1.24 NCCCc1cccc(Br)[n]1 Amb25055843 [0,1,0,0,0,0|2,0,0]=3 2104 B11R1.24 NCCCc1cccc(Br)c1 Amb19373503 [0,1,0,0,0,0|1,0,0]=2 2105 B11R1.24 NCCCc1cccc(c1)Cl Amb13951536 [0,1,0,0,0,0|1,0,0]=2 2106 B11R1.24 NCCCc1cccc(c1)F Amb13949159 [0,1,0,0,0,0|1,0,0]=2 2107 B11R1.24 NCCCc1cccc(c1)N Amb17477694 [0,1,0,0,0,0|1,0,0]=2 2108 B11R1.24 NCCCc1cccc(c1)O Amb17101314 [0,1,0,0,0,0|1,0,0]=2 2109 B11R1.24 NCCNc1cc(Br)c[n]c1 Amb24440030 [0,1,0,0,0,0|3,0,0]=4 2110 B11R1.24 NCCNc1cc(F)c[n]c1 Amb18999334 [0,1,0,0,0,0|3,0,0]=4 2111 B11R1.24 NCCNc1cccc(F)[n]1 Amb24072626 [0,1,0,0,0,0|3,0,0]=4 2112 B11R1.24 NCCNc1cccc(c1)Br Amb17091074 [0,1,0,0,0,0|2,0,0]=3 2113 B11R1.24 NCCNc1cccc(c1)C Amb17057745 [0,1,0,0,0,0|2,0,0]=3 2114 B11R1.24 NCCNc1cccc(c1)Cl Amb17057750 [0,1,0,0,0,0|2,0,0]=3 2115 B11R1.24 NCCNc1cccc(c1)F Amb17057748 [0,1,0,0,0,0|2,0,0]=3 2116 B11R1.24 NCCOc1c[n]cc(Br)c1 Amb22275981 [0,1,0,0,0,0|3,0,0]=4 2117 B11R1.24 NCCOc1c[n]cc(Br)c1 Amb22275982 [0,1,0,0,0,0|3,0,0]=4 2118 B11R1.24 NCCOc1cc(Br)cc[n]1 Amb24334875 [0,1,0,0,0,0|3,0,0]=4 2119 B11R1.24 NCCOc1cc(Cl)cc[n]1 Amb22236327 [0,1,0,0,0,0|3,0,0]=4 2120 B11R1.24 NCCOc1cc(O)ccc1 Amb24085157 [0,1,0,0,0,0|2,0,0]=3 2121 B11R1.24 NCCOc1cccc(c1)Br Amb10609758 [0,1,0,0,0,0|2,0,0]=3 2122 B11R1.24 NCCOc1cccc(c1)Br Amb1111484 [0,1,0,0,0,0|2,0,0]=3 2123 B11R1.24 NCCOc1cccc(c1)C Amb1098983 [0,1,0,0,0,0|2,0,0]=3 2124 B11R1.24 NCCOc1cccc(c1)Cl Amb1098576 [0,1,0,0,0,0|2,0,0]=3 2125 B11R1.24 NCCOc1cccc(c1)F Amb1126100 [0,1,0,0,0,0|2,0,0]=3 2126 B11R1.24 NCCSc1cc(Br)ccc1 Amb18998111 [0,1,0,0,0,0|2,0,0]=3 2127 B11R1.24 NCCSc1cc(Cl)[n]cc1 Amb24533119 [0,1,0,0,0,0|3,0,0]=4 2128 B11R1.24 NCCSc1cc(F)ccc1 Amb21861531 [0,1,0,0,0,0|2,0,0]=3 2129 B11R1.24 NCCSc1cccc(c1)C Amb17083043 [0,1,0,0,0,0|2,0,0]=3 2130 B11R1.24 NCCSc1cccc(c1)Cl Amb17083052 [0,1,0,0,0,0|2,0,0]=3 2131 B11R1.24 NC\C=C\c1cccc(Br)c1 Amb18066633 [0,1,0,0,0,0|1,0,2]=4 2132 B11R1.24 NC\C=C\c1cccc(Cl)c1 Amb18065474 [0,1,0,0,0,0|1,0,2]=4 2133 B11R1.24 NC\C=C\c1cccc(F)c1 Amb18065349 [0,1,0,0,0,0|1,0,2]=4 2134 B11R1.24 NNCCc1cccc(Cl)c1 Amb24064170 [0,1,0,0,0,0|2,0,0]=3 2135 B11R1.24 NNCCc1cccc(c1)Br Amb17404394 [0,1,0,0,0,0|2,0,0]=3 2136 B11R1.24 NNCCc1cccc(c1)C Amb17399915 [0,1,0,0,0,0|2,0,0]=3 2137 B11R1.24 NNCCc1cccc(c1)Cl Amb17400340 [0,1,0,0,0,0|2,0,0]=3 2138 B11R1.24 NOCCc1cccc(Cl)c1 Amb25152729 [0,1,0,0,0,0|2,0,0]=3 2139 B11R1.24 NOCCc1cccc(F)c1 Amb22896630 [0,1,0,0,0,0|2,0,0]=3 2140 B11R1.24 Nc1[n]c(cc[n]1)NCCO Amb25780024 [0,1,0,0,0,0|3,0,0]=4 2141 B11R1.24 Nc1[n]c(cc[n]1)OCCO Amb24101939 [0,1,0,0,0,0|3,0,0]=4 2142 B11R1.24 Nc1[n]c(cc[n]1)SCCO Amb25304642 [0,1,0,0,0,0|3,0,0]=4 2143 B11R1.24 Nc1c[n]cc(NCCO)[n]1 Amb25060539 [0,1,0,0,0,0|3,0,0]=4 2144 B11R1.24 Nc1c[n]cc([n]1)SCCO Amb25360755 [0,1,0,0,0,0|3,0,0]=4 2145 B11R1.24 Nc1cc(CCC=O)cc[n]1 Amb25052314 [0,1,0,0,0,0|1,0,2]=4 2146 B11R1.24 Nc1cc(CCC=O)ccc1 Amb24486988 [0,1,0,0,0,0|0,0,2]=3 2147 B11R1.24 Nc1cc(CCNN)cc[n]1 Amb25288641 [0,1,0,0,0,0|3,0,0]=4 2148 B11R1.24 Nc1cc(CNC#N)ccc1 Amb25148290 [0,1,0,0,0,0|2,0,1]=4 2149 B11R1.24 Nc1cc(NCCF)[n]cc1 Amb24501789 [0,1,0,0,0,0|3,0,0]=4 2150 B11R1.24 Nc1cc(NCCO)[n]cc1 Amb18981464 [0,1,0,0,0,0|2,0,0]=3 2151 B11R1.24 Nc1cc([n]c[n]1)OCCO Amb24106711 [0,1,0,0,0,0|3,0,0]=4 2152 B11R1.24 Nc1cc([n]cc1)OCCO Amb18293320 [0,1,0,0,0,0|2,0,0]=3 2153 B11R1.24 Nc1cc([n]cc1)SCCO Amb18293590 [0,1,0,0,0,0|2,0,0]=3 2154 B11R1.24 Nc1cc(\C=C\CO)ccc1 Amb24462850 [0,1,0,0,0,0|0,0,2]=3 2155 B11R1.24 Nc1cc(c[n]c1)NCCO Amb24347580 [0,1,0,0,0,0|2,0,0]=3 2156 B11R1.24 Nc1cc(cc[n]1)SCCO Amb24543690 [0,1,0,0,0,0|2,0,0]=3 2157 B11R1.24 Nc1cc(ccc1)C#CCCl Amb25229635 [0,1,0,0,0,0|1,0,2]=4 2158 B11R1.24 Nc1cc(ccc1)C#CCI Amb25213585 [0,1,0,0,0,0|1,0,2]=4 2159 B11R1.24 Nc1cc(ccc1)C#CCO Amb22228962 [0,1,0,0,0,0|0,0,2]=3 2160 B11R1.24 Nc1cc(ccc1)OCCCl Amb22587140 [0,1,0,0,0,0|2,0,0]=3 2161 B11R1.24 Nc1cc(ccc1)OCCF Amb20669100 [0,1,0,0,0,0|2,0,0]=3 2162 B11R1.24 Nc1cc(ccc1)SCCO Amb18289366 [0,1,0,0,0,0|1,0,0]=2 2163 B11R1.24 Nc1cc[n]c(c1)NCCN Amb18298681 [0,1,0,0,0,0|3,0,0]=4 2164 B11R1.24 Nc1cccc(CCC#N)[n]1 Amb24085292 [0,1,0,0,0,0|2,0,1]=4 2165 B11R1.24 Nc1cccc(CCCN)[n]1 Amb24411537 [0,1,0,0,0,0|2,0,0]=3 2166 B11R1.24 Nc1cccc(NCCCl)[n]1 Amb25060780 [0,1,0,0,0,0|3,0,0]=4 2167 B11R1.24 Nc1cccc(NCCO)[n]1 Amb25771408 [0,1,0,0,0,0|2,0,0]=3 2168 B11R1.24 Nc1cccc([n]1)SCCO Amb24626988 [0,1,0,0,0,0|2,0,0]=3 2169 B11R1.24 Nc1cccc(c1)NCCN Amb18991498 [0,1,0,0,0,0|2,0,0]=3 2170 B11R1.24 Nc1cccc(c1)OCCN Amb18251365 [0,1,0,0,0,0|2,0,0]=3 2171 B11R1.24 Nc1cccc(c1)SCCN Amb25149157 [0,1,0,0,0,0|2,0,0]=3 2172 B11R1.24 O=C1C=CC=C(CCCBr)N1 Amb25679555 [0,1,0,0,0,0|2,0,0]=3 2173 B11R1.24 O=C1C=CC=C(CCCCl)O1 Amb25279515 [0,1,0,0,0,0|2,0,0]=3 2174 B11R1.24 O=C=NCc1cccc(c1)Br Amb17090280 [0,1,0,0,0,0|1,0,2]=4 2175 B11R1.24 O=C=NCc1cccc(c1)Cl Amb17090264 [0,1,0,0,0,0|1,0,2]=4 2176 B11R1.24 O=C=NCc1cccc(c1)O Amb17090279 [0,1,0,0,0,0|1,0,2]=4 2177 B11R1.24 O=CCCc1cc[n]c(Cl)c1 Amb24619570 [0,1,0,0,0,0|1,0,2]=4 2178 B11R1.24 O=CCCc1cccc(Cl)[n]1 Amb24511743 [0,1,0,0,0,0|1,0,2]=4 2179 B11R1.24 O=CCCc1cccc(I)c1 Amb24637998 [0,1,0,0,0,0|0,0,2]=3 2180 B11R1.24 O=CCCc1cccc(S)c1 Amb24615973 [0,1,0,0,0,0|0,0,2]=3 2181 B11R1.24 O=CCCc1cccc(c1)Br Amb17081695 [0,1,0,0,0,0|0,0,2]=3 2182 B11R1.24 O=CCCc1cccc(c1)O Amb17081694 [0,1,0,0,0,0|0,0,2]=3 2183 B11R1.24 O=CCOc1cccc(Cl)c1 Amb18806821 [0,1,0,0,0,0|1,0,2]=4 2184 B11R1.24 O=CCOc1cccc(F)c1 Amb18182893 [0,1,0,0,0,0|1,0,2]=4 2185 B11R1.24 O=CCOc1cccc(c1)Br Amb17099951 [0,1,0,0,0,0|1,0,2]=4 2186 B11R1.24 O=CCSc1cccc(c1)C Amb17082932 [0,1,0,0,0,0|1,0,2]=4 2187 B11R1.24 O=CCSc1cccc(c1)Cl Amb17082942 [0,1,0,0,0,0|1,0,2]=4 2188 B11R1.24 O=CNCc1cccc(Cl)c1 Amb24544518 [0,1,0,0,0,0|1,0,2]=4 2189 B11R1.24 O=CNCc1cccc(F)c1 Amb19958743 [0,1,0,0,0,0|1,0,2]=4 2190 B11R1.24 OCC#Cc1c[n]cc(F)c1 Amb18179385 [0,1,0,0,0,0|1,0,2]=4 2191 B11R1.24 OCC#Cc1cc(I)ccc1 Amb25742450 [0,1,0,0,0,0|0,0,2]=3 2192 B11R1.24 OCCCC1CC=CC(=O)O1 Amb25204203 [0,1,0,0,0,0|1,0,2]=4 2193 B11R1.24 OCCC[C@@H]1CC=CC(=O)O1 Amb24340466 [0,1,0,0,0,0|1,0,2]=4 2194 B11R1.24 OCCCc1cc[n]c(Br)c1 Amb24763525 [0,1,0,0,0,0|1,0,0]=2 2195 B11R1.24 OCCCc1cccc(F)[n]1 Amb24546387 [0,1,0,0,0,0|1,0,0]=2 2196 B11R1.24 OCCCc1cccc(I)c1 Amb25075756 [0,1,0,0,0,0|0,0,0]=1 2197 B11R1.24 OCCCc1cccc(c1)Br Amb17089515 [0,1,0,0,0,0|0,0,0]=1 2198 B11R1.24 OCCCc1cccc(c1)C Amb17089495 [0,1,0,0,0,0|0,0,0]=1 2199 B11R1.24 OCCCc1cccc(c1)Cl Amb17089500 [0,1,0,0,0,0|0,0,0]=1 2200 B11R1.24 OCCCc1cccc(c1)F Amb17605781 [0,1,0,0,0,0|0,0,0]=1 2201 B11R1.24 OCCCc1cccc(c1)N Amb17477701 [0,1,0,0,0,0|0,0,0]=1 2202 B11R1.24 OCCCc1cccc(c1)O Amb17089514 [0,1,0,0,0,0|0,0,0]=1 2203 B11R1.24 OCCNC=1C=CNC(=S)N1 Amb25375753 [0,1,0,0,0,0|3,0,0]=4 2204 B11R1.24 OCCNC=1C=NNC(=O)C1 Amb25048056 [0,1,0,0,0,0|3,0,0]=4 2205 B11R1.24 OCCNc1[n]c(Cl)cc[n]1 Amb25275738 [0,1,0,0,0,0|3,0,0]=4 2206 B11R1.24 OCCNc1c[n]cc(Cl)[n]1 Amb18292859 [0,1,0,0,0,0|3,0,0]=4 2207 B11R1.24 OCCNc1cc(Br)c[n]c1 Amb23744553 [0,1,0,0,0,0|2,0,0]=3 2208 B11R1.24 OCCNc1cc(Br)cc[n]1 Amb24429841 [0,1,0,0,0,0|2,0,0]=3 2209 B11R1.24 OCCNc1cc(Cl)cc[n]1 Amb25191172 [0,1,0,0,0,0|2,0,0]=3 2210 B11R1.24 OCCNc1cc(F)[n]c[n]1 Amb25799261 [0,1,0,0,0,0|3,0,0]=4 2211 B11R1.24 OCCNc1cccc(Cl)[n]1 Amb21958722 [0,1,0,0,0,0|2,0,0]=3 2212 B11R1.24 OCCNc1cccc(F)[n]1 Amb18973531 [0,1,0,0,0,0|2,0,0]=3 2213 B11R1.24 OCCOC1=CC=NC(=O)N1 Amb25270319 [0,1,0,0,0,0|3,0,0]=4 2214 B11R1.24 OCCOc1[n]c(Cl)cc[n]1 Amb25195613 [0,1,0,0,0,0|3,0,0]=4 2215 B11R1.24 OCCOc1c[n]cc(Cl)c1 Amb25151315 [0,1,0,0,0,0|2,0,0]=3 2216 B11R1.24 OCCOc1c[n]cc(F)c1 Amb25274170 [0,1,0,0,0,0|2,0,0]=3 2217 B11R1.24 OCCOc1cc(Br)[n]c[n]1 Amb25362958 [0,1,0,0,0,0|3,0,0]=4 2218 B11R1.24 OCCOc1cc(Cl)[n]c[n]1 Amb18178158 [0,1,0,0,0,0|3,0,0]=4 2219 B11R1.24 OCCOc1cc(Cl)[n]cc1 Amb22059320 [0,1,0,0,0,0|2,0,0]=3 2220 B11R1.24 OCCOc1cc(F)[n]cc1 Amb24487065 [0,1,0,0,0,0|2,0,0]=3 2221 B11R1.24 OCCOc1cc[n]c(Cl)[n]1 Amb18804288 [0,1,0,0,0,0|3,0,0]=4 2222 B11R1.24 OCCOc1cccc(F)[n]1 Amb18787672 [0,1,0,0,0,0|2,0,0]=3 2223 B11R1.24 OCCOc1cccc(c1)C Amb2209346 [0,1,0,0,0,0|1,0,0]=2 2224 B11R1.24 OCCSc1c[n]cc(Br)c1 Amb24582105 [0,1,0,0,0,0|2,0,0]=3 2225 B11R1.24 OCCSc1cc(Br)ccc1 Amb21861665 [0,1,0,0,0,0|1,0,0]=2 2226 B11R1.24 OCCSc1cc(Cl)[n]c[n]1 Amb18330226 [0,1,0,0,0,0|3,0,0]=4 2227 B11R1.24 OCCSc1cc(F)[n]c[n]1 Amb24356835 [0,1,0,0,0,0|3,0,0]=4 2228 B11R1.24 OCCSc1cc[n]c(Cl)[n]1 Amb18330225 [0,1,0,0,0,0|3,0,0]=4 2229 B11R1.24 OCCSc1cccc(Br)[n]1 Amb24458936 [0,1,0,0,0,0|2,0,0]=3 2230 B11R1.24 OCCSc1cccc(Cl)[n]1 Amb24477644 [0,1,0,0,0,0|2,0,0]=3 2231 B11R1.24 OCCSc1cccc(F)[n]1 Amb18789953 [0,1,0,0,0,0|2,0,0]=3 2232 B11R1.24 OC\C=C\c1c[n]cc(Br)c1 Amb25065053 [0,1,0,0,0,0|1,0,2]=4 2233 B11R1.24 OC\C=C\c1cccc(Br)[n]1 Amb20248560 [0,1,0,0,0,0|1,0,2]=4 2234 B11R1.24 OC\C=C\c1cccc(Br)c1 Amb19516160 [0,1,0,0,0,0|0,0,2]=3 2235 B11R1.24 OC\C=C\c1cccc(Cl)c1 Amb23442783 [0,1,0,0,0,0|0,0,2]=3 2236 B11R1.24 OC\C=C\c1cccc(F)c1 Amb23442888 [0,1,0,0,0,0|0,0,2]=3 2237 B11R1.24 Oc1cc(CCCBr)ccc1 Amb18657769 [0,1,0,0,0,0|1,0,0]=2 2238 B11R1.24 Oc1cc(CNC=O)ccc1 Amb18179387 [0,1,0,0,0,0|1,0,2]=4 2239 B11R1.24 Oc1cc(ccc1)C#CCBr Amb24471318 [0,1,0,0,0,0|1,0,2]=4 2240 B11R1.24 Oc1cc(ccc1)C#CCF Amb24427468 [0,1,0,0,0,0|1,0,2]=4 2241 B11R1.24 Oc1cc(ccc1)C#CCI Amb25793030 [0,1,0,0,0,0|1,0,2]=4 2242 B11R1.24 Oc1cc(ccc1)C#CCO Amb24085233 [0,1,0,0,0,0|0,0,2]=3 2243 B11R1.24 Oc1cc(ccc1)OCCF Amb24484451 [0,1,0,0,0,0|2,0,0]=3 2244 B11R1.24 Oc1cc(ccc1)SCCF Amb24486779 [0,1,0,0,0,0|2,0,0]=3 2245 B11R1.24 Oc1cccc(c1)\C=C\CO Amb18125120 [0,1,0,0,0,0|0,0,2]=3 2246 B11R1.24 SCCCc1cccc(c1)Br Amb17407561 [0,1,0,0,0,0|0,1,0]=2 2247 B11R1.24 SCCCc1cccc(c1)C Amb17400219 [0,1,0,0,0,0|0,1,0]=2 2248 B11R1.24 SCCCc1cccc(c1)Cl Amb17401096 [0,1,0,0,0,0|0,1,0]=2 2249 B11R1.24 SCCOc1cc(I)ccc1 Amb25189185 [0,1,0,0,0,0|1,1,0]=3 2250 B11R1.24 SCCOc1cccc(c1)C Amb17232680 [0,1,0,0,0,0|1,1,0]=3 2251 B11R1.24 SCCOc1cccc(c1)F Amb17232867 [0,1,0,0,0,0|1,1,0]=3 2252 B11R1.24 SCCOc1cccc(c1)N Amb17504035 [0,1,0,0,0,0|1,1,0]=3 2253 B11R1.24 SCCSc1cc(Br)ccc1 Amb25058330 [0,1,0,0,0,0|1,1,0]=3 2254 B11R1.24 [N-]=[N+]=NCc1cccc(O)c1 Amb24447426 [0,1,0,0,0,0|3,0,0]=4 2255 B11R1.24 [NH3+]c1cc(ccc1)OCCF Amb22455032 [0,1,0,0,0,0|2,0,0]=3 2256 B11R1.28 BrCC=C=Cc1ccccc1 Amb24624052 [0,1,0,0,0,0|1,0,2]=4 2257 B11R1.28 BrCCCCc1cc[n]cc1 Amb24102841 [0,1,0,0,0,0|2,0,0]=3 2258 B11R1.28 BrCCCOc1c[n]ccc1 Amb22900113 [0,1,0,0,0,0|2,0,0]=3 2259 B11R1.28 BrCCCOc1ccccc1 Amb1154134 [0,1,0,0,0,0|1,0,0]=2 2260 B11R1.28 BrCCNCc1ccccc1 Amb18131678 [0,1,0,0,0,0|1,0,0]=2 2261 B11R1.28 BrCC\C=C\c1ccccc1 Amb17140564 [0,1,0,0,0,0|1,0,1]=3 2262 B11R1.28 BrCC\N=C\c1ccccc1 Amb25076253 [0,1,0,0,0,0|1,0,1]=3 2263 B11R1.28 BrC\C=C\Cc1ccccc1 Amb25039914 [0,1,0,0,0,0|1,0,1]=3 2264 B11R1.28 Br[Zn]CCCc1ccccc1 Amb22000503 [0,1,0,0,0,0|1,0,0]=2 2265 B11R1.28 Br\C=C/CNc1ccccc1 Amb25063133 [0,1,0,0,0,0|1,0,2]=4 2266 B11R1.28 C#CCC#Cc1ccccc1 Amb16233222 [0,1,0,0,0,0|1,0,2]=4 2267 B11R1.28 C#CCCCc1[n]ccc[n]1 Amb24100716 [0,1,0,0,0,0|3,0,0]=4 2268 B11R1.28 C#CCCCc1ccccc1 Amb10071067 [0,1,0,0,0,0|1,0,0]=2 2269 B11R1.28 C#CCCNc1cccc[n]1 Amb25189260 [0,1,0,0,0,0|2,0,1]=4 2270 B11R1.28 C#CCCNc1ccccc1 Amb25063678 [0,1,0,0,0,0|1,0,1]=3 2271 B11R1.28 C#CCCOc1c[n]ccc1 Amb25151770 [0,1,0,0,0,0|2,0,1]=4 2272 B11R1.28 C#CCCSc1cccc[n]1 Amb25783289 [0,1,0,0,0,0|2,0,1]=4 2273 B11R1.28 C#CCCSc1ccccc1 Amb24477610 [0,1,0,0,0,0|1,0,1]=3 2274 B11R1.28 C#CCNCc1ccccc1 Amb21972217 [0,1,0,0,0,0|1,0,1]=3 2275 B11R1.28 C#CCOCc1cccc[n]1 Amb24101369 [0,1,0,0,0,0|2,0,1]=4 2276 B11R1.28 C#CCSCc1c[n]ccc1 Amb25741316 [0,1,0,0,0,0|2,0,1]=4 2277 B11R1.28 C#CCSCc1ccccc1 Amb18800670 [0,1,0,0,0,0|1,0,1]=3 2278 B11R1.28 C#CC\N=C\c1ccccc1 Amb17609064 [0,1,0,0,0,0|1,0,2]=4 2279 B11R1.28 C/C=C/CCc1ccccc1 Amb17940149 [0,1,0,0,0,0|1,0,1]=3 2280 B11R1.28 C=CCC#Cc1ccccc1 Amb10571530 [0,1,0,0,0,0|1,0,2]=4 2281 B11R1.28 C=CCCCc1ccccc1 Amb24062985 [0,1,0,0,0,0|1,0,0]=2 2282 B11R1.28 C=CCCNc1cc[n]cc1 Amb25853434 [0,1,0,0,0,0|2,0,1]=4 2283 B11R1.28 C=CCCOc1c[n]ccc1 Amb24085225 [0,1,0,0,0,0|2,0,1]=4 2284 B11R1.28 C=CCCOc1cc[n]cc1 Amb24750926 [0,1,0,0,0,0|2,0,1]=4 2285 B11R1.28 C=CCNCc1c[n]ccc1 Amb19890377 [0,1,0,0,0,0|2,0,1]=4 2286 B11R1.28 C=CCNCc1c[n]ccc1 Amb19891174 [0,1,0,0,0,0|2,0,1]=4 2287 B11R1.28 C=CCNCc1cc[n]cc1 Amb19890311 [0,1,0,0,0,0|2,0,1]=4 2288 B11R1.28 C=CCNCc1cc[n]cc1 Amb19890811 [0,1,0,0,0,0|2,0,1]=4 2289 B11R1.28 C=CCNCc1cccc[n]1 Amb19890291 [0,1,0,0,0,0|2,0,1]=4 2290 B11R1.28 C=CCNCc1cccc[n]1 Amb19891173 [0,1,0,0,0,0|2,0,1]=4 2291 B11R1.28 C=CCOCc1cc[n]cc1 Amb24103231 [0,1,0,0,0,0|2,0,1]=4 2292 B11R1.28 C=CCOCc1cccc[n]1 Amb24106728 [0,1,0,0,0,0|2,0,1]=4 2293 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [0,1,0,0,0,0|1,0,1]=3 2294 B11R1.28 C=CCSCc1ccccc1 Amb17799426 [0,1,0,0,0,0|1,0,1]=3 2295 B11R1.28 C=CC\C=N\c1ccccc1 Amb10574759 [0,1,0,0,0,0|1,0,2]=4 2296 B11R1.28 C=CC\N=C/c1ccccc1 Amb24108502 [0,1,0,0,0,0|1,0,2]=4 2297 B11R1.28 C=NCCNc1ccccc1 Amb24486057 [0,1,0,0,0,0|2,0,0]=3 2298 B11R1.28 CC#CCNc1ccccc1 Amb21953777 [0,1,0,0,0,0|1,0,2]=4 2299 B11R1.28 CC#CCOc1ccccc1 Amb25119404 [0,1,0,0,0,0|1,0,2]=4 2300 B11R1.28 CC=CCCc1cccc[n]1 Amb24100575 [0,1,0,0,0,0|2,0,1]=4 2301 B11R1.28 CC=CCCc1ccccc1 Amb24062987 [0,1,0,0,0,0|1,0,1]=3 2302 B11R1.28 CCCC#Cc1cccc[n]1 Amb24070018 [0,1,0,0,0,0|2,0,1]=4 2303 B11R1.28 CCCC=Cc1cc[n]cc1 Amb24073920 [0,1,0,0,0,0|2,0,1]=4 2304 B11R1.28 CCCCC[n+]1ccccc1 Amb24754723 [0,1,0,0,0,0|2,0,0]=3 2305 B11R1.28 CCCCCc1[n]ccc[n]1 Amb24084930 [0,1,0,0,0,0|3,0,0]=4 2306 B11R1.28 CCCCCc1c[n]c[n]c1 Amb24071640 [0,1,0,0,0,0|3,0,0]=4 2307 B11R1.28 CCCCCc1cccnc1 Amb17672949 [0,1,0,0,0,0|2,0,0]=3 2308 B11R1.28 CCCCCc1ccncc1 Amb17672950 [0,1,0,0,0,0|2,0,0]=3 2309 B11R1.28 CCCCNc1cc[n]c[n]1 Amb19011499 [0,1,0,0,0,0|3,0,0]=4 2310 B11R1.28 CCCCNc1ccc[n][n]1 Amb18311413 [0,1,0,0,0,0|3,0,0]=4 2311 B11R1.28 CCCCOc1c[n]ccc1 Amb25382997 [0,1,0,0,0,0|2,0,0]=3 2312 B11R1.28 CCCCOc1cc[n]cc1 Amb25383158 [0,1,0,0,0,0|2,0,0]=3 2313 B11R1.28 CCCCSc1cccc[n]1 Amb25383894 [0,1,0,0,0,0|2,0,0]=3 2314 B11R1.28 CCCNCc1[n]ccc[n]1 Amb19028643 [0,1,0,0,0,0|3,0,0]=4 2315 B11R1.28 CCCNCc1c[n]c[n]c1 Amb18313855 [0,1,0,0,0,0|3,0,0]=4 2316 B11R1.28 CCCNCc1c[n]ccc1 Amb19890575 [0,1,0,0,0,0|2,0,0]=3 2317 B11R1.28 CCCNCc1cc[n]c[n]1 Amb18314599 [0,1,0,0,0,0|3,0,0]=4 2318 B11R1.28 CCCNCc1cc[n]cc1 Amb19890591 [0,1,0,0,0,0|2,0,0]=3 2319 B11R1.28 CCCNCc1cccc[n]1 Amb19890306 [0,1,0,0,0,0|2,0,0]=3 2320 B11R1.28 CCCNCc1cccc[n]1 Amb19890563 [0,1,0,0,0,0|2,0,0]=3 2321 B11R1.28 CCCNCc1ccccc1 Amb1105937 [0,1,0,0,0,0|1,0,0]=2 2322 B11R1.28 CCCSSc1ccccc1 Amb25383743 [0,1,0,0,0,0|2,0,0]=3 2323 B11R1.28 CCC\C=C/c1cccc[n]1 Amb24101905 [0,1,0,0,0,0|2,0,1]=4 2324 B11R1.28 CCC\C=C\c1cc[n]cc1 Amb24103147 [0,1,0,0,0,0|2,0,1]=4 2325 B11R1.28 CCC\C=C\c1cccc[n]1 Amb22170161 [0,1,0,0,0,0|2,0,1]=4 2326 B11R1.28 CCC\C=N\c1ccccc1 Amb16231172 [0,1,0,0,0,0|1,0,1]=3 2327 B11R1.28 CCNCC[n+]1ccccc1 Amb25383240 [0,1,0,0,0,0|2,0,0]=3 2328 B11R1.28 CCNCCc1[n]ccc[n]1 Amb19028710 [0,1,0,0,0,0|3,0,0]=4 2329 B11R1.28 CCNCCc1c[n]c[n]c1 Amb18312962 [0,1,0,0,0,0|3,0,0]=4 2330 B11R1.28 CCNCCc1c[n]cc[n]1 Amb24750672 [0,1,0,0,0,0|3,0,0]=4 2331 B11R1.28 CCNCCc1c[n]ccc1 Amb18303850 [0,1,0,0,0,0|2,0,0]=3 2332 B11R1.28 CCNCCc1ccccc1 Amb2119468 [0,1,0,0,0,0|1,0,0]=2 2333 B11R1.28 CCOCC[n+]1ccccc1 Amb24762647 [0,1,0,0,0,0|2,0,0]=3 2334 B11R1.28 CCOCNc1ccccc1 Amb25856976 [0,1,0,0,0,0|2,0,0]=3 2335 B11R1.28 CCOCOc1c[n]ccc1 Amb25383033 [0,1,0,0,0,0|3,0,0]=4 2336 B11R1.28 CCOCSc1cc[n]cc1 Amb24762594 [0,1,0,0,0,0|3,0,0]=4 2337 B11R1.28 CCOCSc1cccc[n]1 Amb24762592 [0,1,0,0,0,0|3,0,0]=4 2338 B11R1.28 CCOCSc1ccccc1 Amb24762591 [0,1,0,0,0,0|2,0,0]=3 2339 B11R1.28 CCONCc1ccccc1 Amb25151184 [0,1,0,0,0,0|2,0,0]=3 2340 B11R1.28 CCO\N=C\c1ccccc1 Amb25712631 [0,1,0,0,0,0|2,0,1]=4 2341 B11R1.28 CCSCSc1ccccc1 Amb25380606 [0,1,0,0,0,0|2,0,0]=3 2342 B11R1.28 CC\C=C/Cc1cc[n]cc1 Amb24103208 [0,1,0,0,0,0|2,0,1]=4 2343 B11R1.28 CC\N=C\Nc1ccccc1 Amb24384245 [0,1,0,0,0,0|2,0,1]=4 2344 B11R1.28 CNCC#Cc1ccccc1 Amb18296119 [0,1,0,0,0,0|1,0,2]=4 2345 B11R1.28 CNCCCc1c[n]ccc1 Amb23442716 [0,1,0,0,0,0|2,0,0]=3 2346 B11R1.28 CNCCCc1cc[n]cc1 Amb19025185 [0,1,0,0,0,0|2,0,0]=3 2347 B11R1.28 CNCCCc1cccc[n]1 Amb18312462 [0,1,0,0,0,0|2,0,0]=3 2348 B11R1.28 CNCCCc1ccccc1 Amb21954280 [0,1,0,0,0,0|1,0,0]=2 2349 B11R1.28 CNCCNc1cc[n]cc1 Amb18313323 [0,1,0,0,0,0|3,0,0]=4 2350 B11R1.28 CNCCNc1cccc[n]1 Amb18313466 [0,1,0,0,0,0|3,0,0]=4 2351 B11R1.28 CNCCOc1c[n]ccc1 Amb18312519 [0,1,0,0,0,0|3,0,0]=4 2352 B11R1.28 CNCCOc1cc[n]cc1 Amb19020798 [0,1,0,0,0,0|3,0,0]=4 2353 B11R1.28 CNCCOc1cccc[n]1 Amb19020802 [0,1,0,0,0,0|3,0,0]=4 2354 B11R1.28 CNCCOc1ccccc1 Amb1105525 [0,1,0,0,0,0|2,0,0]=3 2355 B11R1.28 CNCCSc1cccc[n]1 Amb19024669 [0,1,0,0,0,0|3,0,0]=4 2356 B11R1.28 CNCCSc1ccccc1 Amb10608735 [0,1,0,0,0,0|2,0,0]=3 2357 B11R1.28 CNCCSc1ccccc1 Amb17622507 [0,1,0,0,0,0|2,0,0]=3 2358 B11R1.28 CNC\C=C\c1ccccc1 Amb2114273 [0,1,0,0,0,0|1,0,2]=4 2359 B11R1.28 COCC#Cc1cccc[n]1 Amb24100550 [0,1,0,0,0,0|1,0,2]=4 2360 B11R1.28 COCC#Cc1ccccc1 Amb25308232 [0,1,0,0,0,0|0,0,2]=3 2361 B11R1.28 COCCCc1c[n]ccc1 Amb25382996 [0,1,0,0,0,0|1,0,0]=2 2362 B11R1.28 COCCCc1cc[n]c[n]1 Amb23453461 [0,1,0,0,0,0|2,0,0]=3 2363 B11R1.28 COCCCc1cccc[n]1 Amb25383067 [0,1,0,0,0,0|1,0,0]=2 2364 B11R1.28 COCCNc1c[n]c[n]c1 Amb18268244 [0,1,0,0,0,0|3,0,0]=4 2365 B11R1.28 COCCNc1c[n]ccc1 Amb18268638 [0,1,0,0,0,0|2,0,0]=3 2366 B11R1.28 COCCNc1cc[n]c[n]1 Amb18305870 [0,1,0,0,0,0|3,0,0]=4 2367 B11R1.28 COCCNc1ccc[n][n]1 Amb19023323 [0,1,0,0,0,0|3,0,0]=4 2368 B11R1.28 COCCOc1c[n]ccc1 Amb25383068 [0,1,0,0,0,0|2,0,0]=3 2369 B11R1.28 COCCOc1cc[n]cc1 Amb25383069 [0,1,0,0,0,0|2,0,0]=3 2370 B11R1.28 COCCOc1cccc[n]1 Amb24070160 [0,1,0,0,0,0|2,0,0]=3 2371 B11R1.28 COCCSc1ccccn1 Amb17760116 [0,1,0,0,0,0|2,0,0]=3 2372 B11R1.28 COCCSc1ncccn1 Amb17740914 [0,1,0,0,0,0|3,0,0]=4 2373 B11R1.28 COCNCc1ccccc1 Amb25053350 [0,1,0,0,0,0|1,0,0]=2 2374 B11R1.28 COC\C=C\c1cccc[n]1 Amb24101883 [0,1,0,0,0,0|1,0,2]=4 2375 B11R1.28 CONCCc1cccc[n]1 Amb24763045 [0,1,0,0,0,0|2,0,0]=3 2376 B11R1.28 CONCCc1ccccc1 Amb22897018 [0,1,0,0,0,0|1,0,0]=2 2377 B11R1.28 CONCOc1ccccc1 Amb24096695 [0,1,0,0,0,0|2,0,0]=3 2378 B11R1.28 CO\C=C/Oc1ccccc1 Amb24069136 [0,1,0,0,0,0|1,0,2]=4 2379 B11R1.28 CO\C=C\Oc1ccccc1 Amb24069134 [0,1,0,0,0,0|1,0,2]=4 2380 B11R1.28 CSCCCc1cc[n]cc1 Amb25382938 [0,1,0,0,0,0|1,1,0]=3 2381 B11R1.28 CSCCCc1ccccc1 Amb25383748 [0,1,0,0,0,0|0,1,0]=2 2382 B11R1.28 CSCCNc1ccccc1 Amb17307504 [0,1,0,0,0,0|1,1,0]=3 2383 B11R1.28 CSCSCc1ccccc1 Amb25380610 [0,1,0,0,0,0|1,1,0]=3 2384 B11R1.28 C\C=C\CCc1cc[n]cc1 Amb25830692 [0,1,0,0,0,0|2,0,1]=4 2385 B11R1.28 C\C=N\OCc1ccccc1 Amb24334870 [0,1,0,0,0,0|2,0,1]=4 2386 B11R1.28 ClCC#CCc1cc[n]cc1 Amb25217480 [0,1,0,0,0,0|2,0,1]=4 2387 B11R1.28 ClCC#CCc1cccc[n]1 Amb25172829 [0,1,0,0,0,0|2,0,1]=4 2388 B11R1.28 ClCC#CCc1ccccc1 Amb24453719 [0,1,0,0,0,0|1,0,1]=3 2389 B11R1.28 ClCC#CSc1ccccc1 Amb24660042 [0,1,0,0,0,0|1,0,2]=4 2390 B11R1.28 ClCCC#Cc1c[n]ccc1 Amb18792718 [0,1,0,0,0,0|2,0,1]=4 2391 B11R1.28 ClCCC#Cc1cccc[n]1 Amb25073108 [0,1,0,0,0,0|2,0,1]=4 2392 B11R1.28 ClCCC#Cc1ccccc1 Amb18792613 [0,1,0,0,0,0|1,0,1]=3 2393 B11R1.28 ClCCCCc1c[n]c[n]c1 Amb24070756 [0,1,0,0,0,0|3,0,0]=4 2394 B11R1.28 ClCCCCc1c[n]ccc1 Amb24762958 [0,1,0,0,0,0|2,0,0]=3 2395 B11R1.28 ClCCCCc1cc[n]cc1 Amb20622009 [0,1,0,0,0,0|2,0,0]=3 2396 B11R1.28 ClCCCCc1cc[n]cc1 Amb21962609 [0,1,0,0,0,0|2,0,0]=3 2397 B11R1.28 ClCCCCc1cccc[n]1 Amb24762960 [0,1,0,0,0,0|2,0,0]=3 2398 B11R1.28 ClCCCNc1[n]ccc[n]1 Amb24749931 [0,1,0,0,0,0|3,0,0]=4 2399 B11R1.28 ClCCCNc1c[n]cc[n]1 Amb25688134 [0,1,0,0,0,0|3,0,0]=4 2400 B11R1.28 ClCCCNc1cc[n]cc1 Amb25246119 [0,1,0,0,0,0|2,0,0]=3 2401 B11R1.28 ClCCCNc1ccc[n][n]1 Amb24387151 [0,1,0,0,0,0|3,0,0]=4 2402 B11R1.28 ClCCCOc1ccccc1 Amb1128627 [0,1,0,0,0,0|1,0,0]=2 2403 B11R1.28 ClCCCSc1cc[n]cc1 Amb25386236 [0,1,0,0,0,0|2,0,0]=3 2404 B11R1.28 ClCCCSc1ccccc1 Amb1132759 [0,1,0,0,0,0|1,0,0]=2 2405 B11R1.28 ClCCNCc1[n]ccc[n]1 Amb24754667 [0,1,0,0,0,0|3,0,0]=4 2406 B11R1.28 ClCCNCc1ccccn1 Amb17334832 [0,1,0,0,0,0|2,0,0]=3 2407 B11R1.28 ClCCNCc1cccnc1 Amb17334833 [0,1,0,0,0,0|2,0,0]=3 2408 B11R1.28 ClCCNCc1ccncc1 Amb17334834 [0,1,0,0,0,0|2,0,0]=3 2409 B11R1.28 ClCC\C=C\c1ccccc1 Amb17232628 [0,1,0,0,0,0|1,0,1]=3 2410 B11R1.28 ClCO\N=C\c1ccccc1 Amb25838175 [0,1,0,0,0,0|2,0,1]=4 2411 B11R1.28 ClCSC#Cc1ccccc1 Amb17670553 [0,1,0,0,0,0|1,0,2]=4 2412 B11R1.28 ClC\C=C\Cc1ccccc1 Amb24462747 [0,1,0,0,0,0|1,0,1]=3 2413 B11R1.28 ClC\C=C\Oc1ccccc1 Amb24548862 [0,1,0,0,0,0|1,0,2]=4 2414 B11R1.28 Cl[Mg]CCCc1ccccc1 Amb19928784 [0,1,0,0,0,0|1,0,0]=2 2415 B11R1.28 Cl[Zn]C\C=C\c1ccccc1 Amb22897734 [0,1,0,0,0,0|1,0,2]=4 2416 B11R1.28 Cl\C=C/CNc1ccccc1 Amb25241241 [0,1,0,0,0,0|1,0,2]=4 2417 B11R1.28 Cl\C=C\CNc1ccccc1 Amb25148081 [0,1,0,0,0,0|1,0,2]=4 2418 B11R1.28 FCCCNc1cc[n]c[n]1 Amb25708009 [0,1,0,0,0,0|3,0,0]=4 2419 B11R1.28 FCCCOc1c[n]ccc1 Amb25379590 [0,1,0,0,0,0|2,0,0]=3 2420 B11R1.28 FCCCOc1cccc[n]1 Amb24762368 [0,1,0,0,0,0|2,0,0]=3 2421 B11R1.28 FCCCOc1ccccc1 Amb22008296 [0,1,0,0,0,0|1,0,0]=2 2422 B11R1.28 FCCCSc1[n]ccc[n]1 Amb25382659 [0,1,0,0,0,0|3,0,0]=4 2423 B11R1.28 FCCCSc1c[n]cc[n]1 Amb25382658 [0,1,0,0,0,0|3,0,0]=4 2424 B11R1.28 FCCCSc1cc[n]cc1 Amb25382657 [0,1,0,0,0,0|2,0,0]=3 2425 B11R1.28 FCCCSc1ccc[n][n]1 Amb25382656 [0,1,0,0,0,0|3,0,0]=4 2426 B11R1.28 FCCCSc1cccc[n]1 Amb25382655 [0,1,0,0,0,0|2,0,0]=3 2427 B11R1.28 FCCCSc1ccccc1 Amb25382654 [0,1,0,0,0,0|1,0,0]=2 2428 B11R1.28 FCCNCc1[n]ccc[n]1 Amb24755098 [0,1,0,0,0,0|3,0,0]=4 2429 B11R1.28 FCCNCc1c[n]c[n]c1 Amb24755122 [0,1,0,0,0,0|3,0,0]=4 2430 B11R1.28 FCCNCc1c[n]cc[n]1 Amb24755106 [0,1,0,0,0,0|3,0,0]=4 2431 B11R1.28 FCCNCc1ccccc1 Amb24611358 [0,1,0,0,0,0|1,0,0]=2 2432 B11R1.28 ICCCCc1ccccc1 Amb25380384 [0,1,0,0,0,0|1,0,0]=2 2433 B11R1.28 ICCNCc1ccccc1 Amb25188796 [0,1,0,0,0,0|1,0,0]=2 2434 B11R1.28 ICCOCc1ccccc1 Amb16191915 [0,1,0,0,0,0|1,0,0]=2 2435 B11R1.28 N#CCC#Cc1ccccc1 Amb25705489 [0,1,0,0,0,0|1,0,2]=4 2436 B11R1.28 N#CCCC[n+]1ccccc1 Amb22339033 [0,1,0,0,0,0|2,0,0]=3 2437 B11R1.28 N#CCCCc1c[n]ccc1 Amb18124797 [0,1,0,0,0,0|2,0,0]=3 2438 B11R1.28 N#CCCCc1cc[n]cc1 Amb24083114 [0,1,0,0,0,0|2,0,0]=3 2439 B11R1.28 N#CCCCc1ccccn1 Amb1102455 [0,1,0,0,0,0|2,0,0]=3 2440 B11R1.28 N#CCCNc1c[n]ccc1 Amb24085246 [0,1,0,0,0,0|2,0,1]=4 2441 B11R1.28 N#CCCNc1ccccc1 Amb1645915 [0,1,0,0,0,0|1,0,1]=3 2442 B11R1.28 N#CCCOc1ccccc1 Amb1202508 [0,1,0,0,0,0|1,0,1]=3 2443 B11R1.28 N#CCNCc1ccccc1 Amb22491357 [0,1,0,0,0,0|1,0,1]=3 2444 B11R1.28 N#CCOCc1c[n]ccc1 Amb24068451 [0,1,0,0,0,0|2,0,1]=4 2445 B11R1.28 N#CCOCc1cccc[n]1 Amb24100494 [0,1,0,0,0,0|2,0,1]=4 2446 B11R1.28 N#CC[NH2+]Cc1ccccc1 Amb24113886 [0,1,0,0,0,0|1,0,1]=3 2447 B11R1.28 N#CNCCc1c[n]ccc1 Amb25821764 [0,1,0,0,0,0|2,0,1]=4 2448 B11R1.28 N#CNCCc1cc[n]cc1 Amb25851038 [0,1,0,0,0,0|2,0,1]=4 2449 B11R1.28 N=N=NCSc1ccccc1 Amb22360722 [0,1,0,0,0,0|3,0,0]=4 2450 B11R1.28 NCC#CCc1c[n]ccc1 Amb24553113 [0,1,0,0,0,0|2,0,1]=4 2451 B11R1.28 NCC#CCc1ccccc1 Amb25104593 [0,1,0,0,0,0|1,0,1]=3 2452 B11R1.28 NCC#CSc1ccccc1 Amb24468721 [0,1,0,0,0,0|1,0,2]=4 2453 B11R1.28 NCCC#Cc1c[n]ccc1 Amb24484386 [0,1,0,0,0,0|2,0,1]=4 2454 B11R1.28 NCCC#Cc1ccccc1 Amb18993041 [0,1,0,0,0,0|1,0,1]=3 2455 B11R1.28 NCCCCc1[n]ccc[n]1 Amb25385067 [0,1,0,0,0,0|3,0,0]=4 2456 B11R1.28 NCCCCc1c[n]c[n]c1 Amb18125322 [0,1,0,0,0,0|3,0,0]=4 2457 B11R1.28 NCCCCc1c[n]cc[n]1 Amb25385068 [0,1,0,0,0,0|3,0,0]=4 2458 B11R1.28 NCCCCc1cc[n]c[n]1 Amb18831236 [0,1,0,0,0,0|3,0,0]=4 2459 B11R1.28 NCCCCc1cc[n]cc1 Amb17991253 [0,1,0,0,0,0|2,0,0]=3 2460 B11R1.28 NCCCCc1ccc[n][n]1 Amb18201561 [0,1,0,0,0,0|3,0,0]=4 2461 B11R1.28 NCCCCc1ccccc1 Amb1227740 [0,1,0,0,0,0|1,0,0]=2 2462 B11R1.28 NCCCCc1ccccc1 Amb19929939 [0,1,0,0,0,0|1,0,0]=2 2463 B11R1.28 NCCCCc1ccccn1 Amb1102767 [0,1,0,0,0,0|2,0,0]=3 2464 B11R1.28 NCCCNc1c[n]c[n]c1 Amb19023659 [0,1,0,0,0,0|3,0,0]=4 2465 B11R1.28 NCCCNc1cc[n]c[n]1 Amb18305869 [0,1,0,0,0,0|3,0,0]=4 2466 B11R1.28 NCCCNc1ccc[n][n]1 Amb19023321 [0,1,0,0,0,0|3,0,0]=4 2467 B11R1.28 NCCCNc1ccccc1 Amb10086594 [0,1,0,0,0,0|1,0,0]=2 2468 B11R1.28 NCCCNc1cccnc1 Amb10607841 [0,1,0,0,0,0|2,0,0]=3 2469 B11R1.28 NCCCOc1[n]ccc[n]1 Amb18308494 [0,1,0,0,0,0|3,0,0]=4 2470 B11R1.28 NCCCOc1c[n]cc[n]1 Amb18308518 [0,1,0,0,0,0|3,0,0]=4 2471 B11R1.28 NCCCOc1cc[n]c[n]1 Amb18308503 [0,1,0,0,0,0|3,0,0]=4 2472 B11R1.28 NCCCOc1cc[n]cc1 Amb18308513 [0,1,0,0,0,0|2,0,0]=3 2473 B11R1.28 NCCCOc1ccc[n][n]1 Amb18311417 [0,1,0,0,0,0|3,0,0]=4 2474 B11R1.28 NCCCOc1cccc[n]1 Amb19020881 [0,1,0,0,0,0|2,0,0]=3 2475 B11R1.28 NCCCOc1ccccc1 Amb1108619 [0,1,0,0,0,0|1,0,0]=2 2476 B11R1.28 NCCCSc1ccccc1 Amb1089343 [0,1,0,0,0,0|1,0,0]=2 2477 B11R1.28 NCCCSc1ccccc1 Amb2099802 [0,1,0,0,0,0|1,0,0]=2 2478 B11R1.28 NCCCSc1ncccn1 Amb2012644 [0,1,0,0,0,0|3,0,0]=4 2479 B11R1.28 NCCNCc1[n]ccc[n]1 Amb19028574 [0,1,0,0,0,0|3,0,0]=4 2480 B11R1.28 NCCNCc1c[n]c[n]c1 Amb19032084 [0,1,0,0,0,0|3,0,0]=4 2481 B11R1.28 NCCNCc1c[n]cc[n]1 Amb19030094 [0,1,0,0,0,0|3,0,0]=4 2482 B11R1.28 NCCNCc1cc[n]c[n]1 Amb19030352 [0,1,0,0,0,0|3,0,0]=4 2483 B11R1.28 NCCNCc1ccccn1 Amb17091028 [0,1,0,0,0,0|2,0,0]=3 2484 B11R1.28 NCCNCc1cccnc1 Amb17091029 [0,1,0,0,0,0|2,0,0]=3 2485 B11R1.28 NCCNCc1ccncc1 Amb17091030 [0,1,0,0,0,0|2,0,0]=3 2486 B11R1.28 NCCNNc1ccccc1 Amb24763429 [0,1,0,0,0,0|2,0,0]=3 2487 B11R1.28 NCCOCc1[n]ccc[n]1 Amb19028700 [0,1,0,0,0,0|3,0,0]=4 2488 B11R1.28 NCCOCc1c[n]ccc1 Amb18307736 [0,1,0,0,0,0|2,0,0]=3 2489 B11R1.28 NCCOCc1cc[n]cc1 Amb19020767 [0,1,0,0,0,0|2,0,0]=3 2490 B11R1.28 NCCOCc1cccc[n]1 Amb18181726 [0,1,0,0,0,0|2,0,0]=3 2491 B11R1.28 NCCOCc1ccccc1 Amb1081962 [0,1,0,0,0,0|1,0,0]=2 2492 B11R1.28 NCCOCc1ccccc1 Amb2137059 [0,1,0,0,0,0|1,0,0]=2 2493 B11R1.28 NCCSCc1[n]ccc[n]1 Amb19028691 [0,1,0,0,0,0|3,0,0]=4 2494 B11R1.28 NCCSCc1ccc[n][n]1 Amb25385198 [0,1,0,0,0,0|3,0,0]=4 2495 B11R1.28 NCCSSc1cc[n]cc1 Amb24764696 [0,1,0,0,0,0|3,0,0]=4 2496 B11R1.28 NCCSSc1cccc[n]1 Amb22523455 [0,1,0,0,0,0|3,0,0]=4 2497 B11R1.28 NCCSSc1ccccn1 Amb17619715 [0,1,0,0,0,0|3,0,0]=4 2498 B11R1.28 NCC\C=C\c1c[n]ccc1 Amb25061778 [0,1,0,0,0,0|2,0,1]=4 2499 B11R1.28 NCC\C=C\c1cc[n]cc1 Amb24678309 [0,1,0,0,0,0|2,0,1]=4 2500 B11R1.28 NCC\C=C\c1cccc[n]1 Amb24383569 [0,1,0,0,0,0|2,0,1]=4 2501 B11R1.28 NCC\C=C\c1ccccc1 Amb17138419 [0,1,0,0,0,0|1,0,1]=3 2502 B11R1.28 NCC\N=C\c1cc[n]cc1 Amb24486118 [0,1,0,0,0,0|2,0,1]=4 2503 B11R1.28 NCNCCc1ccccc1 Amb25385258 [0,1,0,0,0,0|1,0,0]=2 2504 B11R1.28 NC\C=C\Cc1ccccc1 Amb24351087 [0,1,0,0,0,0|1,0,1]=3 2505 B11R1.28 NNCCCc1c[n]ccc1 Amb18125323 [0,1,0,0,0,0|2,0,0]=3 2506 B11R1.28 NNCCCc1ccccc1 Amb19373221 [0,1,0,0,0,0|1,0,0]=2 2507 B11R1.28 NNCCSc1ccccc1 Amb18126564 [0,1,0,0,0,0|2,0,0]=3 2508 B11R1.28 NNC\C=C\c1ccccc1 Amb24563952 [0,1,0,0,0,0|1,0,2]=4 2509 B11R1.28 NNNCNc1ccccc1 Amb25251558 [0,1,0,0,0,0|3,0,0]=4 2510 B11R1.28 NOCC#Cc1c[n]ccc1 Amb24085699 [0,1,0,0,0,0|1,0,2]=4 2511 B11R1.28 NOCC#Cc1cccc[n]1 Amb22896641 [0,1,0,0,0,0|1,0,2]=4 2512 B11R1.28 NOCC#Cc1cccc[n]1 Amb24600127 [0,1,0,0,0,0|1,0,2]=4 2513 B11R1.28 NOCCCc1ccccc1 Amb22231356 [0,1,0,0,0,0|0,0,0]=1 2514 B11R1.28 NOCCCc1ccccn1 Amb17089546 [0,1,0,0,0,0|1,0,0]=2 2515 B11R1.28 NOCCCc1cccnc1 Amb17089547 [0,1,0,0,0,0|1,0,0]=2 2516 B11R1.28 NOCCCc1ccncc1 Amb17089548 [0,1,0,0,0,0|1,0,0]=2 2517 B11R1.28 NOCCNc1ccccc1 Amb24486573 [0,1,0,0,0,0|1,0,0]=2 2518 B11R1.28 NOCCOc1ccccc1 Amb17088287 [0,1,0,0,0,0|1,0,0]=2 2519 B11R1.28 NOCCOc1ccccc1 Amb19894640 [0,1,0,0,0,0|1,0,0]=2 2520 B11R1.28 NOCCSc1[n]ccc[n]1 Amb24762884 [0,1,0,0,0,0|3,0,0]=4 2521 B11R1.28 NOCCSc1c[n]cc[n]1 Amb24762811 [0,1,0,0,0,0|3,0,0]=4 2522 B11R1.28 NOCCSc1cc[n]c[n]1 Amb24762817 [0,1,0,0,0,0|3,0,0]=4 2523 B11R1.28 NOCCSc1cc[n]cc1 Amb24762878 [0,1,0,0,0,0|2,0,0]=3 2524 B11R1.28 NOCCSc1cccc[n]1 Amb24762881 [0,1,0,0,0,0|2,0,0]=3 2525 B11R1.28 NOCOCc1ccccc1 Amb10606697 [0,1,0,0,0,0|1,0,0]=2 2526 B11R1.28 NOC\C=C\c1c[n]ccc1 Amb24085612 [0,1,0,0,0,0|1,0,2]=4 2527 B11R1.28 NOC\C=C\c1ccccc1 Amb18124997 [0,1,0,0,0,0|0,0,2]=3 2528 B11R1.28 O=C=NCCc1cc[n]cc1 Amb24477613 [0,1,0,0,0,0|1,0,2]=4 2529 B11R1.28 O=C=NCCc1cccc[n]1 Amb24390560 [0,1,0,0,0,0|1,0,2]=4 2530 B11R1.28 O=C=NCCc1ccccc1 Amb2092802 [0,1,0,0,0,0|0,0,2]=3 2531 B11R1.28 O=C=NCCc1cccnc1 Amb17232038 [0,1,0,0,0,0|1,0,2]=4 2532 B11R1.28 O=C=NCOc1ccccc1 Amb20668487 [0,1,0,0,0,0|1,0,2]=4 2533 B11R1.28 O=CC#CCc1ccccc1 Amb25189233 [0,1,0,0,0,0|0,0,3]=4 2534 B11R1.28 O=CCCCc1[n]ccc[n]1 Amb24061342 [0,1,0,0,0,0|2,0,1]=4 2535 B11R1.28 O=CCCCc1c[n]c[n]c1 Amb24063015 [0,1,0,0,0,0|2,0,1]=4 2536 B11R1.28 O=CCCCc1c[n]ccc1 Amb24099514 [0,1,0,0,0,0|1,0,1]=3 2537 B11R1.28 O=CCCCc1cc[n]c[n]1 Amb24099617 [0,1,0,0,0,0|2,0,1]=4 2538 B11R1.28 O=CCCCc1cc[n]cc1 Amb24099515 [0,1,0,0,0,0|1,0,1]=3 2539 B11R1.28 O=CCCCc1cccc[n]1 Amb22897023 [0,1,0,0,0,0|1,0,1]=3 2540 B11R1.28 O=CCCOc1cccc[n]1 Amb24762999 [0,1,0,0,0,0|1,0,2]=4 2541 B11R1.28 O=CCCSc1cccc[n]1 Amb18177861 [0,1,0,0,0,0|1,0,2]=4 2542 B11R1.28 O=CCCSc1ccccc1 Amb17082943 [0,1,0,0,0,0|0,0,2]=3 2543 B11R1.28 O=CCNCc1ccccc1 Amb19886524 [0,1,0,0,0,0|0,0,2]=3 2544 B11R1.28 O=CCONc1ccccc1 Amb24434643 [0,1,0,0,0,0|1,0,2]=4 2545 B11R1.28 O=CCSCc1cc[n]cc1 Amb25383559 [0,1,0,0,0,0|1,0,2]=4 2546 B11R1.28 O=CCSCc1ccccc1 Amb18801121 [0,1,0,0,0,0|0,0,2]=3 2547 B11R1.28 O=CC\C=C\c1ccccc1 Amb18644267 [0,1,0,0,0,0|0,0,3]=4 2548 B11R1.28 O=CNCCc1c[n]ccc1 Amb24592209 [0,1,0,0,0,0|1,0,2]=4 2549 B11R1.28 O=CNCCc1cc[n]cc1 Amb24371433 [0,1,0,0,0,0|1,0,2]=4 2550 B11R1.28 O=CNCCc1ccccc1 Amb10559023 [0,1,0,0,0,0|0,0,2]=3 2551 B11R1.28 O=CNCSc1ccccc1 Amb24382608 [0,1,0,0,0,0|1,0,2]=4 2552 B11R1.28 O=C\C=C\Cc1ccccc1 Amb18124787 [0,1,0,0,0,0|0,0,3]=4 2553 B11R1.28 OCC#CCc1c[n]ccc1 Amb24651956 [0,1,0,0,0,0|1,0,1]=3 2554 B11R1.28 OCC#CCc1cc[n]cc1 Amb25771948 [0,1,0,0,0,0|1,0,1]=3 2555 B11R1.28 OCC#COc1ccccc1 Amb25058509 [0,1,0,0,0,0|0,0,2]=3 2556 B11R1.28 OCC=C=Cc1ccccc1 Amb24398063 [0,1,0,0,0,0|0,0,2]=3 2557 B11R1.28 OCCC#Cc1[n]ccc[n]1 Amb25374912 [0,1,0,0,0,0|2,0,1]=4 2558 B11R1.28 OCCC#Cc1c[n]ccc1 Amb22749317 [0,1,0,0,0,0|1,0,1]=3 2559 B11R1.28 OCCC#Cc1cc[n]cc1 Amb22749294 [0,1,0,0,0,0|1,0,1]=3 2560 B11R1.28 OCCC#Cc1cccc[n]1 Amb22749318 [0,1,0,0,0,0|1,0,1]=3 2561 B11R1.28 OCCCCc1c[n]c[n]c1 Amb25383777 [0,1,0,0,0,0|2,0,0]=3 2562 B11R1.28 OCCCCc1c[n]ccc1 Amb22732495 [0,1,0,0,0,0|1,0,0]=2 2563 B11R1.28 OCCCCc1cccc[n]1 Amb21520414 [0,1,0,0,0,0|1,0,0]=2 2564 B11R1.28 OCCCCc1ccncc1 Amb17740015 [0,1,0,0,0,0|1,0,0]=2 2565 B11R1.28 OCCCNc1c[n]c[n]c1 Amb18267814 [0,1,0,0,0,0|2,0,0]=3 2566 B11R1.28 OCCCNc1c[n]ccc1 Amb18267758 [0,1,0,0,0,0|1,0,0]=2 2567 B11R1.28 OCCCNc1cc[n]c[n]1 Amb18305868 [0,1,0,0,0,0|2,0,0]=3 2568 B11R1.28 OCCCNc1ccc[n][n]1 Amb19023330 [0,1,0,0,0,0|2,0,0]=3 2569 B11R1.28 OCCCNc1ccccc1 Amb17307125 [0,1,0,0,0,0|0,0,0]=1 2570 B11R1.28 OCCCNc1ccccc1 Amb17772314 [0,1,0,0,0,0|0,0,0]=1 2571 B11R1.28 OCCCOc1cccc[n]1 Amb25383036 [0,1,0,0,0,0|1,0,0]=2 2572 B11R1.28 OCCC\C=C\1/C=CCCO1 Amb24719775 [0,1,0,0,0,0|1,0,2]=4 2573 B11R1.28 OCCN=Cc1ccccc1 Amb24065097 [0,1,0,0,0,0|0,0,1]=2 2574 B11R1.28 OCCNCc1[n]ccc[n]1 Amb18313677 [0,1,0,0,0,0|2,0,0]=3 2575 B11R1.28 OCCNCc1c[n]c[n]c1 Amb19030147 [0,1,0,0,0,0|2,0,0]=3 2576 B11R1.28 OCCNCc1c[n]cc[n]1 Amb18314235 [0,1,0,0,0,0|2,0,0]=3 2577 B11R1.28 OCCNCc1cc[n]c[n]1 Amb18314306 [0,1,0,0,0,0|2,0,0]=3 2578 B11R1.28 OCCNCc1cccc[n]1 Amb21955286 [0,1,0,0,0,0|1,0,0]=2 2579 B11R1.28 OCCNCc1ccccc1 Amb1835287 [0,1,0,0,0,0|0,0,0]=1 2580 B11R1.28 OCCSCc1[n]ccc[n]1 Amb18183594 [0,1,0,0,0,0|2,0,0]=3 2581 B11R1.28 OCC\C=C\c1cc[n]cc1 Amb24666733 [0,1,0,0,0,0|1,0,1]=3 2582 B11R1.28 OCC\C=C\c1cccc[n]1 Amb25233577 [0,1,0,0,0,0|1,0,1]=3 2583 B11R1.28 OCC\C=C\c1ccccc1 Amb24756581 [0,1,0,0,0,0|0,0,1]=2 2584 B11R1.28 OCC\N=C/c1cc[n]cc1 Amb24106776 [0,1,0,0,0,0|1,0,1]=3 2585 B11R1.28 OCC\N=C\c1ccccc1 Amb20622247 [0,1,0,0,0,0|0,0,1]=2 2586 B11R1.28 OC\C=C\Cc1ccccc1 Amb25074433 [0,1,0,0,0,0|0,0,1]=2 2587 B11R1.28 OC\C=C\Nc1ccccc1 Amb25228349 [0,1,0,0,0,0|0,0,2]=3 2588 B11R1.28 OC\C=C\Oc1ccccc1 Amb25283274 [0,1,0,0,0,0|0,0,2]=3 2589 B11R1.28 OC\C=C\Sc1cccc[n]1 Amb24719685 [0,1,0,0,0,0|1,0,2]=4 2590 B11R1.28 OC\C=N\Nc1ccccc1 Amb25801902 [0,1,0,0,0,0|1,0,1]=3 2591 B11R1.28 ONCCOc1ccccc1 Amb17088413 [0,1,0,0,0,0|1,0,0]=2 2592 B11R1.28 O\N=C\C=C/c1ccccc1 Amb24668019 [0,1,0,0,0,0|0,0,3]=4 2593 B11R1.28 O\N=C\CNc1ccccc1 Amb25211715 [0,1,0,0,0,0|1,0,1]=3 2594 B11R1.28 O\N=C\N=N\c1ccccc1 Amb2228038 [0,1,0,0,0,0|2,0,1]=4 2595 B11R1.28 S=C=NCCc1c[n]ccc1 Amb18035937 [0,1,0,0,0,0|1,1,1]=4 2596 B11R1.28 S=C=NCCc1cc[n]cc1 Amb18792582 [0,1,0,0,0,0|1,1,1]=4 2597 B11R1.28 SCCCCc1c[n]ccc1 Amb18563823 [0,1,0,0,0,0|1,1,0]=3 2598 B11R1.28 SCCCCc1cc[n]cc1 Amb18065469 [0,1,0,0,0,0|1,1,0]=3 2599 B11R1.28 SCCCCc1cccc[n]1 Amb18563822 [0,1,0,0,0,0|1,1,0]=3 2600 B11R1.28 SCCCCc1ccccc1 Amb17400224 [0,1,0,0,0,0|0,1,0]=2 2601 B11R1.28 SCCCNc1[n]ccc[n]1 Amb19514994 [0,1,0,0,0,0|2,1,0]=4 2602 B11R1.28 SCCCNc1c[n]ccc1 Amb25059157 [0,1,0,0,0,0|1,1,0]=3 2603 B11R1.28 SCC\C=C\c1ccccc1 Amb24390438 [0,1,0,0,0,0|0,1,1]=3 2604 B11R1.28 [N-]=[N+]=NCCc1cccc[n]1 Amb24476581 [0,1,0,0,0,0|3,0,0]=4 2605 B11R1.28 [N-]=[N+]=NCCc1ccccc1 Amb19149244 [0,1,0,0,0,0|2,0,0]=3 2606 B11R1.28 [N-]=[N+]=NCSc1ccccc1 Amb22735141 [0,1,0,0,0,0|3,0,0]=4 2607 B11R1.28 [NH3+]CCCCc1ccccc1 Amb22733934 [0,1,0,0,0,0|1,0,0]=2 2608 B11R1.28 [NH3+]OCCOc1ccccc1 Amb2420800 [0,1,0,0,0,0|1,0,0]=2 2609 B11R1.40 BrC(Cc1ccccc1)C#N Amb1154191 [0,1,0,0,0,0|1,0,1]=3 2610 B11R1.40 BrCC(=O)Cc1ccccc1 Amb17569850 [0,1,0,0,0,0|1,0,1]=3 2611 B11R1.40 BrCC(=O)Nc1ccccc1 Amb2222053 [0,1,0,0,0,0|2,0,1]=4 2612 B11R1.40 BrCC(C[n+]1ccccc1)Br Amb1154041 [0,1,0,0,0,0|2,0,0]=3 2613 B11R1.40 BrCC(Cc1ccccc1)O Amb17595843 [0,1,0,0,0,0|1,0,0]=2 2614 B11R1.40 BrCC(Oc1ccccc1)C Amb17241866 [0,1,0,0,0,0|2,0,0]=3 2615 B11R1.40 C#CC(=O)Cc1ccccc1 Amb22059749 [0,1,0,0,0,0|1,0,2]=4 2616 B11R1.40 C#CC(Cl)Cc1ccccc1 Amb24398624 [0,1,0,0,0,0|1,0,1]=3 2617 B11R1.40 C#CC(N)Cc1c[n]ccc1 Amb25132596 [0,1,0,0,0,0|2,0,1]=4 2618 B11R1.40 C#CC(N)Cc1cccc[n]1 Amb25340965 [0,1,0,0,0,0|2,0,1]=4 2619 B11R1.40 C#CC(N)Cc1ccccc1 Amb24699229 [0,1,0,0,0,0|1,0,1]=3 2620 B11R1.40 C#CC(O)Cc1c[n]ccc1 Amb24704924 [0,1,0,0,0,0|2,0,1]=4 2621 B11R1.40 C#CC(O)Nc1ccccc1 Amb24561876 [0,1,0,0,0,0|2,0,1]=4 2622 B11R1.40 C#C[C@@H](O)Cc1ccccc1 Amb25056589 [0,1,0,0,0,0|1,0,1]=3 2623 B11R1.40 C=C(Cc1ccccc1)CCl Amb25185403 [0,1,0,0,0,0|1,0,1]=3 2624 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [0,1,0,0,0,0|1,0,2]=4 2625 B11R1.40 C=CC(Cl)Oc1ccccc1 Amb25363210 [0,1,0,0,0,0|2,0,1]=4 2626 B11R1.40 C=CC(N)Cc1cccc[n]1 Amb25077646 [0,1,0,0,0,0|2,0,1]=4 2627 B11R1.40 C=CC(N)Cc1ccccc1 Amb25064298 [0,1,0,0,0,0|1,0,1]=3 2628 B11R1.40 C=CC(O)Cc1c[n]ccc1 Amb25097959 [0,1,0,0,0,0|2,0,1]=4 2629 B11R1.40 C=CC(O)Cc1cccc[n]1 Amb25241001 [0,1,0,0,0,0|2,0,1]=4 2630 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [0,1,0,0,0,0|1,0,1]=3 2631 B11R1.40 C=C[C@H](Cc1ccccc1)N Amb10982592 [0,1,0,0,0,0|1,0,1]=3 2632 B11R1.40 C=C[C@H](N)Cc1ccccc1 Amb19929662 [0,1,0,0,0,0|1,0,1]=3 2633 B11R1.40 C=C[C@H](O)Cc1cccc[n]1 Amb25806691 [0,1,0,0,0,0|2,0,1]=4 2634 B11R1.40 CC(C#N)Sc1ccccc1 Amb18800724 [0,1,0,0,0,0|2,0,1]=4 2635 B11R1.40 CC(C=C)Nc1ccccc1 Amb24122661 [0,1,0,0,0,0|2,0,1]=4 2636 B11R1.40 CC(C=C)Oc1ccccc1 Amb25151239 [0,1,0,0,0,0|2,0,1]=4 2637 B11R1.40 CC(C=C)Sc1ccccc1 Amb25787941 [0,1,0,0,0,0|2,0,1]=4 2638 B11R1.40 CC(C=O)Oc1ccccc1 Amb22011729 [0,1,0,0,0,0|1,0,2]=4 2639 B11R1.40 CC(C=O)Sc1ccccc1 Amb18646621 [0,1,0,0,0,0|1,0,2]=4 2640 B11R1.40 CC(CBr)Cc1c[n]c[n]c1 Amb25257267 [0,1,0,0,0,0|3,0,0]=4 2641 B11R1.40 CC(CBr)Cc1c[n]cc[n]1 Amb25734539 [0,1,0,0,0,0|3,0,0]=4 2642 B11R1.40 CC(CBr)Cc1c[n]ccc1 Amb25345425 [0,1,0,0,0,0|2,0,0]=3 2643 B11R1.40 CC(CBr)Cc1ccccc1 Amb25151397 [0,1,0,0,0,0|1,0,0]=2 2644 B11R1.40 CC(CCl)Cc1c[n]cc[n]1 Amb24523053 [0,1,0,0,0,0|3,0,0]=4 2645 B11R1.40 CC(CCl)Nc1cc[n]cc1 Amb24420964 [0,1,0,0,0,0|3,0,0]=4 2646 B11R1.40 CC(CCl)Sc1cccc[n]1 Amb25122218 [0,1,0,0,0,0|3,0,0]=4 2647 B11R1.40 CC(CCl)Sc1ccccc1 Amb25772834 [0,1,0,0,0,0|2,0,0]=3 2648 B11R1.40 CC(CN)Cc1c[n]cc[n]1 Amb25136575 [0,1,0,0,0,0|3,0,0]=4 2649 B11R1.40 CC(CN)Cc1ccccc1 Amb18010535 [0,1,0,0,0,0|1,0,0]=2 2650 B11R1.40 CC(CN)Nc1cc[n]cc1 Amb18908422 [0,1,0,0,0,0|3,0,0]=4 2651 B11R1.40 CC(CN)Nc1cccc[n]1 Amb24477483 [0,1,0,0,0,0|3,0,0]=4 2652 B11R1.40 CC(CN)Nc1ccccc1 Amb18644448 [0,1,0,0,0,0|2,0,0]=3 2653 B11R1.40 CC(CN)Oc1cccc[n]1 Amb22522747 [0,1,0,0,0,0|3,0,0]=4 2654 B11R1.40 CC(CN)Sc1cc[n]cc1 Amb18252034 [0,1,0,0,0,0|3,0,0]=4 2655 B11R1.40 CC(CN)Sc1cccc[n]1 Amb18992825 [0,1,0,0,0,0|3,0,0]=4 2656 B11R1.40 CC(CO)Cc1c[n]c[n]c1 Amb25731190 [0,1,0,0,0,0|2,0,0]=3 2657 B11R1.40 CC(CO)Cc1c[n]cc[n]1 Amb25728470 [0,1,0,0,0,0|2,0,0]=3 2658 B11R1.40 CC(CO)Cc1cc[n]cc1 Amb25374015 [0,1,0,0,0,0|1,0,0]=2 2659 B11R1.40 CC(CO)Nc1cc[n]c[n]1 Amb18290773 [0,1,0,0,0,0|3,0,0]=4 2660 B11R1.40 CC(CO)Nc1ccc[n][n]1 Amb18991550 [0,1,0,0,0,0|3,0,0]=4 2661 B11R1.40 CC(CO)Nc1ccccc1 Amb18971804 [0,1,0,0,0,0|1,0,0]=2 2662 B11R1.40 CC(CO)Sc1[n]ccc[n]1 Amb24486923 [0,1,0,0,0,0|3,0,0]=4 2663 B11R1.40 CC(CO)Sc1c[n]cc[n]1 Amb25139648 [0,1,0,0,0,0|3,0,0]=4 2664 B11R1.40 CC(CO)Sc1cc[n]c[n]1 Amb24397457 [0,1,0,0,0,0|3,0,0]=4 2665 B11R1.40 CC(CO)Sc1ccc[n][n]1 Amb24742809 [0,1,0,0,0,0|3,0,0]=4 2666 B11R1.40 CC(CO)Sc1cccc[n]1 Amb24486922 [0,1,0,0,0,0|2,0,0]=3 2667 B11R1.40 CC(CO)Sc1ccccc1 Amb23449852 [0,1,0,0,0,0|1,0,0]=2 2668 B11R1.40 CC(Cc1c[n]ccc1)NN Amb25341062 [0,1,0,0,0,0|3,0,0]=4 2669 B11R1.40 CC(Cc1ccccc1)=[N+]=[N-] Amb25173943 [0,1,0,0,0,0|2,0,1]=4 2670 B11R1.40 CC(Cc1ccccc1)C#N Amb24402121 [0,1,0,0,0,0|1,0,1]=3 2671 B11R1.40 CC(Cc1ccccc1)C=C Amb25850978 [0,1,0,0,0,0|1,0,1]=3 2672 B11R1.40 CC(Cc1ccccc1)NN Amb22487303 [0,1,0,0,0,0|2,0,0]=3 2673 B11R1.40 CC(Cc1ccccc1)[Mg]Br Amb22897350 [0,1,0,0,0,0|2,0,0]=3 2674 B11R1.40 CC(Cc1ccccc1)[Zn]Br Amb22897866 [0,1,0,0,0,0|2,0,0]=3 2675 B11R1.40 CC(Nc1ccccc1)C#N Amb17399903 [0,1,0,0,0,0|2,0,1]=4 2676 B11R1.40 CCC(=O)Cc1cccnc1 Amb17477730 [0,1,0,0,0,0|2,0,1]=4 2677 B11R1.40 CCC(=O)Cc1ccncc1 Amb17477729 [0,1,0,0,0,0|2,0,1]=4 2678 B11R1.40 CCC(=S)Nc1ccccc1 Amb24757738 [0,1,0,0,0,0|2,0,1]=4 2679 B11R1.40 CCC(Br)Cc1cc[n]cc1 Amb24353281 [0,1,0,0,0,0|2,0,0]=3 2680 B11R1.40 CCC(Br)Cc1ccccc1 Amb25189250 [0,1,0,0,0,0|1,0,0]=2 2681 B11R1.40 CCC(C)Cc1c[n]ccc1 Amb24085206 [0,1,0,0,0,0|2,0,0]=3 2682 B11R1.40 CCC(C)Cc1cccc[n]1 Amb24089681 [0,1,0,0,0,0|2,0,0]=3 2683 B11R1.40 CCC(C)Oc1ccccc1 Amb24350256 [0,1,0,0,0,0|2,0,0]=3 2684 B11R1.40 CCC(C)Sc1cccc[n]1 Amb25822094 [0,1,0,0,0,0|3,0,0]=4 2685 B11R1.40 CCC(C)Sc1ccccc1 Amb25698974 [0,1,0,0,0,0|2,0,0]=3 2686 B11R1.40 CCC(Cc1ccccn1)Cl Amb17477711 [0,1,0,0,0,0|2,0,0]=3 2687 B11R1.40 CCC(Cc1ccccn1)O Amb17477703 [0,1,0,0,0,0|2,0,0]=3 2688 B11R1.40 CCC(Cc1cccnc1)Cl Amb17477713 [0,1,0,0,0,0|2,0,0]=3 2689 B11R1.40 CCC(Cc1cccnc1)O Amb17477705 [0,1,0,0,0,0|2,0,0]=3 2690 B11R1.40 CCC(Cc1ccncc1)Cl Amb17477712 [0,1,0,0,0,0|2,0,0]=3 2691 B11R1.40 CCC(Cc1ccncc1)O Amb17477704 [0,1,0,0,0,0|2,0,0]=3 2692 B11R1.40 CCC(Cl)Cc1ccccc1 Amb18177890 [0,1,0,0,0,0|1,0,0]=2 2693 B11R1.40 CCC(N)Cc1[n]ccc[n]1 Amb24753573 [0,1,0,0,0,0|3,0,0]=4 2694 B11R1.40 CCC(N)Cc1c[n]c[n]c1 Amb18301363 [0,1,0,0,0,0|3,0,0]=4 2695 B11R1.40 CCC(N)Cc1c[n]cc[n]1 Amb18996437 [0,1,0,0,0,0|3,0,0]=4 2696 B11R1.40 CCC(N)Cc1cc[n]c[n]1 Amb18300694 [0,1,0,0,0,0|3,0,0]=4 2697 B11R1.40 CCN(C)Cc1c[n]ccc1 Amb25133981 [0,1,0,0,0,0|3,0,0]=4 2698 B11R1.40 CCN(Cc1ccccc1)C Amb10807414 [0,1,0,0,0,0|2,0,0]=3 2699 B11R1.40 CCN(Cc1ccccc1)N Amb17232076 [0,1,0,0,0,0|2,0,0]=3 2700 B11R1.40 CCP(=O)Oc1ccccc1 Amb21963209 [0,1,0,0,0,0|3,0,0]=4 2701 B11R1.40 CCS(=O)Cc1cc[n]cc1 Amb24690059 [0,1,0,0,0,0|3,0,0]=4 2702 B11R1.40 CCS(=O)Cc1ccccc1 Amb24485048 [0,1,0,0,0,0|2,0,0]=3 2703 B11R1.40 CCS(=O)Nc1ccccc1 Amb24752666 [0,1,0,0,0,0|3,0,0]=4 2704 B11R1.40 CC[C@@H](Br)Cc1ccccc1 Amb25770013 [0,1,0,0,0,0|1,0,0]=2 2705 B11R1.40 CC[C@@H](Cl)Cc1ccccc1 Amb24710145 [0,1,0,0,0,0|1,0,0]=2 2706 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb22748727 [0,1,0,0,0,0|1,0,0]=2 2707 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb25141525 [0,1,0,0,0,0|1,0,0]=2 2708 B11R1.40 CC[C@@H](O)Cc1ccccc1 Amb19375372 [0,1,0,0,0,0|1,0,0]=2 2709 B11R1.40 CC[C@H](Cl)Cc1ccccc1 Amb25765719 [0,1,0,0,0,0|1,0,0]=2 2710 B11R1.40 CC[C@H](N)Cc1cccc[n]1 Amb24432851 [0,1,0,0,0,0|2,0,0]=3 2711 B11R1.40 CC[C@H](N)Cc1ccccc1 Amb19929690 [0,1,0,0,0,0|1,0,0]=2 2712 B11R1.40 CC\C(\I)=C/c1ccccc1 Amb22641702 [0,1,0,0,0,0|1,0,2]=4 2713 B11R1.40 CC\C(\N)=N\c1ccccc1 Amb24453266 [0,1,0,0,0,0|2,0,1]=4 2714 B11R1.40 CN(CCl)Cc1ccccc1 Amb25324443 [0,1,0,0,0,0|2,0,0]=3 2715 B11R1.40 CN(CO)Cc1ccccc1 Amb24555500 [0,1,0,0,0,0|1,0,0]=2 2716 B11R1.40 CN(Cc1ccccc1)C#N Amb25072835 [0,1,0,0,0,0|2,0,1]=4 2717 B11R1.40 CN(Cc1ccccc1)C=S Amb25793091 [0,1,0,0,0,0|1,1,1]=4 2718 B11R1.40 CN(Cc1ccccc1)N=O Amb24074071 [0,1,0,0,0,0|2,0,1]=4 2719 B11R1.40 CNC(=S)Cc1ccccc1 Amb24559245 [0,1,0,0,0,0|2,0,1]=4 2720 B11R1.40 CNC(Cc1ccccc1)C Amb17616872 [0,1,0,0,0,0|2,0,0]=3 2721 B11R1.40 CNC(Cc1ccccn1)C Amb1995150 [0,1,0,0,0,0|3,0,0]=4 2722 B11R1.40 CN[C@H](Cc1ccccc1)C Amb17616868 [0,1,0,0,0,0|2,0,0]=3 2723 B11R1.40 COC(=N)Cc1ccccc1 Amb17673180 [0,1,0,0,0,0|2,0,1]=4 2724 B11R1.40 COC(=N)Cc1ccccc1 Amb22366095 [0,1,0,0,0,0|2,0,1]=4 2725 B11R1.40 COC(C)Cc1cc[n]cc1 Amb24485830 [0,1,0,0,0,0|3,0,0]=4 2726 B11R1.40 COC(Cl)Cc1ccccc1 Amb24711453 [0,1,0,0,0,0|2,0,0]=3 2727 B11R1.40 COC(O)Cc1ccccc1 Amb24659514 [0,1,0,0,0,0|2,0,0]=3 2728 B11R1.40 CO[SiH](C)Cc1ccccc1 Amb19893555 [0,1,0,0,0,0|2,1,0]=4 2729 B11R1.40 CSC(=N)Cc1ccccc1 Amb25211803 [0,1,0,0,0,0|2,0,1]=4 2730 B11R1.40 CSC(=O)Cc1ccccc1 Amb25293907 [0,1,0,0,0,0|2,0,1]=4 2731 B11R1.40 C[C@@H](C=O)Nc1ccccc1 Amb25836355 [0,1,0,0,0,0|1,0,2]=4 2732 B11R1.40 C[C@@H](C=O)Oc1ccccc1 Amb24504931 [0,1,0,0,0,0|1,0,2]=4 2733 B11R1.40 C[C@@H](CN)Cc1ccccc1 Amb24615612 [0,1,0,0,0,0|1,0,0]=2 2734 B11R1.40 C[C@@H](CO)Nc1cc[n]c[n]1 Amb24676486 [0,1,0,0,0,0|3,0,0]=4 2735 B11R1.40 C[C@@H](CO)Nc1cccc[n]1 Amb25205329 [0,1,0,0,0,0|2,0,0]=3 2736 B11R1.40 C[C@@H](CO)Sc1ccccc1 Amb25043604 [0,1,0,0,0,0|1,0,0]=2 2737 B11R1.40 C[C@@H](Cc1cc[n]cc1)C=O Amb24608169 [0,1,0,0,0,0|1,0,2]=4 2738 B11R1.40 C[C@H](CN)Cc1cc[n]cc1 Amb24745496 [0,1,0,0,0,0|2,0,0]=3 2739 B11R1.40 C[C@H](CO)Cc1ccccc1 Amb25266388 [0,1,0,0,0,0|0,0,0]=1 2740 B11R1.40 C[C@H](CO)Nc1cccc[n]1 Amb25275075 [0,1,0,0,0,0|2,0,0]=3 2741 B11R1.40 C[C@H](Cc1ccccc1)C=O Amb25255421 [0,1,0,0,0,0|0,0,2]=3 2742 B11R1.40 C\C(\CBr)=C/c1ccccc1 Amb24605004 [0,1,0,0,0,0|1,0,2]=4 2743 B11R1.40 C\C(\CC)=C\c1ccccc1 Amb22546773 [0,1,0,0,0,0|1,0,2]=4 2744 B11R1.40 C\C(\CN)=C/c1ccccc1 Amb25076849 [0,1,0,0,0,0|1,0,2]=4 2745 B11R1.40 C\C(\CN)=C\c1ccccc1 Amb24634730 [0,1,0,0,0,0|1,0,2]=4 2746 B11R1.40 C\C(\CO)=C/c1cccc[n]1 Amb25060585 [0,1,0,0,0,0|1,0,2]=4 2747 B11R1.40 C\C(\CO)=C\c1ccc[n]c1 Amb24730218 [0,1,0,0,0,0|1,0,2]=4 2748 B11R1.40 C\C(\CO)=C\c1cccc[n]1 Amb25149286 [0,1,0,0,0,0|1,0,2]=4 2749 B11R1.40 C\C(\Cc1cc[n]cc1)=N/O Amb24630186 [0,1,0,0,0,0|2,0,1]=4 2750 B11R1.40 C\C(\Cc1cc[n]cc1)=N\O Amb24417230 [0,1,0,0,0,0|2,0,1]=4 2751 B11R1.40 C\C(\Cc1ccccc1)=C\Cl Amb24718044 [0,1,0,0,0,0|1,0,2]=4 2752 B11R1.40 C\C(\Cc1ccccc1)=N\N Amb24501436 [0,1,0,0,0,0|2,0,1]=4 2753 B11R1.40 C\N=C(\N)/Cc1ccccc1 Amb23569051 [0,1,0,0,0,0|2,0,1]=4 2754 B11R1.40 ClC(Cc1ccccc1)C#N Amb1103676 [0,1,0,0,0,0|1,0,1]=3 2755 B11R1.40 ClCC(=O)Cc1ccccc1 Amb2371529 [0,1,0,0,0,0|1,0,1]=3 2756 B11R1.40 ClCC(=O)Oc1ccccc1 Amb1914503 [0,1,0,0,0,0|2,0,1]=4 2757 B11R1.40 ClCC(Cc1ccccc1)C Amb17477588 [0,1,0,0,0,0|1,0,0]=2 2758 B11R1.40 ClCC(Cl)Cc1ccccc1 Amb25061392 [0,1,0,0,0,0|1,0,0]=2 2759 B11R1.40 ClCC(Cl)Oc1ccccc1 Amb24358073 [0,1,0,0,0,0|2,0,0]=3 2760 B11R1.40 ClCC(Cl)Sc1ccccc1 Amb24653564 [0,1,0,0,0,0|2,0,0]=3 2761 B11R1.40 ClCC(Oc1ccccc1)C Amb17232796 [0,1,0,0,0,0|2,0,0]=3 2762 B11R1.40 ClC\C(\Br)=C\c1ccccc1 Amb25283246 [0,1,0,0,0,0|1,0,2]=4 2763 B11R1.40 Cl\C(\CCl)=C/c1ccccc1 Amb25362063 [0,1,0,0,0,0|1,0,2]=4 2764 B11R1.40 FC(CCl)Sc1ccccc1 Amb24390863 [0,1,0,0,0,0|2,0,0]=3 2765 B11R1.40 FCC(Br)Cc1ccccc1 Amb24611243 [0,1,0,0,0,0|1,0,0]=2 2766 B11R1.40 FCC(Cc1ccccc1)N Amb17614462 [0,1,0,0,0,0|1,0,0]=2 2767 B11R1.40 FCC(F)Cc1ccccc1 Amb22641518 [0,1,0,0,0,0|1,0,0]=2 2768 B11R1.40 F\C(\CBr)=C\c1ccccc1 Amb24745736 [0,1,0,0,0,0|1,0,2]=4 2769 B11R1.40 N#CC(F)Sc1ccccc1 Amb24323242 [0,1,0,0,0,0|2,0,1]=4 2770 B11R1.40 N#CC(O)Cc1c[n]ccc1 Amb24062544 [0,1,0,0,0,0|2,0,1]=4 2771 B11R1.40 N#CC(O)Cc1cccc[n]1 Amb25722520 [0,1,0,0,0,0|2,0,1]=4 2772 B11R1.40 N#C[C@@H](O)Cc1ccccc1 Amb24715921 [0,1,0,0,0,0|1,0,1]=3 2773 B11R1.40 N#C[C@H](O)Cc1ccccc1 Amb25846935 [0,1,0,0,0,0|1,0,1]=3 2774 B11R1.40 N=C(CS)Nc1ccccc1 Amb25194642 [0,1,0,0,0,0|1,1,1]=4 2775 B11R1.40 N=C(Cc1ccccc1)NO Amb20671380 [0,1,0,0,0,0|1,0,1]=3 2776 B11R1.40 NC(CBr)Cc1ccccc1 Amb22489725 [0,1,0,0,0,0|1,0,0]=2 2777 B11R1.40 NC(CO)Cc1cc[n]c[n]1 Amb24099661 [0,1,0,0,0,0|2,0,0]=3 2778 B11R1.40 NC(Cc1c[n]ccc1)C#N Amb23557154 [0,1,0,0,0,0|2,0,1]=4 2779 B11R1.40 NC(Cc1cc[n]cc1)C#N Amb23557155 [0,1,0,0,0,0|2,0,1]=4 2780 B11R1.40 NC(Cc1cccc[n]1)C#N Amb23557153 [0,1,0,0,0,0|2,0,1]=4 2781 B11R1.40 NC(Cc1ccccc1)=S=O Amb25053951 [0,1,0,0,0,0|1,0,2]=4 2782 B11R1.40 NC(Cc1ccccc1)C#N Amb1127111 [0,1,0,0,0,0|1,0,1]=3 2783 B11R1.40 NC(Cc1ccccc1)NO Amb25047325 [0,1,0,0,0,0|1,0,0]=2 2784 B11R1.40 NC(Nc1ccccc1)=NO Amb18799378 [0,1,0,0,0,0|2,0,1]=4 2785 B11R1.40 NCC(=N)Nc1ccccc1 Amb24746458 [0,1,0,0,0,0|2,0,1]=4 2786 B11R1.40 NCC(=O)Cc1c[n]ccc1 Amb18251321 [0,1,0,0,0,0|2,0,1]=4 2787 B11R1.40 NCC(=O)Cc1cc[n]cc1 Amb18201930 [0,1,0,0,0,0|2,0,1]=4 2788 B11R1.40 NCC(=O)Cc1cccc[n]1 Amb18908409 [0,1,0,0,0,0|2,0,1]=4 2789 B11R1.40 NCC(=O)Cc1ccccc1 Amb18202084 [0,1,0,0,0,0|1,0,1]=3 2790 B11R1.40 NCC(=O)Cc1ccccc1 Amb19516183 [0,1,0,0,0,0|1,0,1]=3 2791 B11R1.40 NCC(=O)Nc1ccccc1 Amb10609338 [0,1,0,0,0,0|2,0,1]=4 2792 B11R1.40 NCC(=O)Oc1ccccc1 Amb17334310 [0,1,0,0,0,0|2,0,1]=4 2793 B11R1.40 NCC(=S)Nc1ccccc1 Amb25128037 [0,1,0,0,0,0|2,0,1]=4 2794 B11R1.40 NCC(Cc1cccnc1)O Amb17232103 [0,1,0,0,0,0|2,0,0]=3 2795 B11R1.40 NCC(Cl)Cc1ccccc1 Amb24740670 [0,1,0,0,0,0|1,0,0]=2 2796 B11R1.40 NCC(F)Cc1c[n]ccc1 Amb25757490 [0,1,0,0,0,0|2,0,0]=3 2797 B11R1.40 NCC(F)Cc1ccccc1 Amb24434017 [0,1,0,0,0,0|1,0,0]=2 2798 B11R1.40 NCC(O)Cc1cc[n]cc1 Amb18201350 [0,1,0,0,0,0|2,0,0]=3 2799 B11R1.40 NCC(O)Cc1cccc[n]1 Amb18201349 [0,1,0,0,0,0|2,0,0]=3 2800 B11R1.40 NCC(O)Cc1cccc[n]1 Amb22898917 [0,1,0,0,0,0|2,0,0]=3 2801 B11R1.40 NCC(S)Cc1ccccc1 Amb18251941 [0,1,0,0,0,0|1,0,0]=2 2802 B11R1.40 NCC(Sc1ccccc1)C Amb17485971 [0,1,0,0,0,0|2,0,0]=3 2803 B11R1.40 NC[C@@H](Cc1ccccc1)N Amb17619359 [0,1,0,0,0,0|1,0,0]=2 2804 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb22746804 [0,1,0,0,0,0|1,0,0]=2 2805 B11R1.40 NC[C@H](Cc1ccccc1)N Amb17619360 [0,1,0,0,0,0|1,0,0]=2 2806 B11R1.40 NC[C@H](O)Cc1ccccc1 Amb24538166 [0,1,0,0,0,0|1,0,0]=2 2807 B11R1.40 NC\C(\Cl)=C\c1ccccc1 Amb25259250 [0,1,0,0,0,0|1,0,2]=4 2808 B11R1.40 NNC(=O)Cc1ccccc1 Amb24081244 [0,1,0,0,0,0|2,0,1]=4 2809 B11R1.40 NNC(=S)Cc1ccccc1 Amb24377114 [0,1,0,0,0,0|2,0,1]=4 2810 B11R1.40 N[C@@H](CBr)Cc1ccccc1 Amb22747782 [0,1,0,0,0,0|1,0,0]=2 2811 B11R1.40 N[C@@H](CCl)Cc1ccccc1 Amb24758237 [0,1,0,0,0,0|1,0,0]=2 2812 B11R1.40 N[C@@H](CF)Cc1ccccc1 Amb24484482 [0,1,0,0,0,0|1,0,0]=2 2813 B11R1.40 N[C@@H](CO)Cc1ccccc1 Amb20242871 [0,1,0,0,0,0|0,0,0]=1 2814 B11R1.40 N[C@@H](CS)Cc1ccccc1 Amb25073967 [0,1,0,0,0,0|0,1,0]=2 2815 B11R1.40 N[C@@H](Cc1ccccc1)C#N Amb17399902 [0,1,0,0,0,0|1,0,1]=3 2816 B11R1.40 N[C@H](CCl)Cc1ccccc1 Amb24533056 [0,1,0,0,0,0|1,0,0]=2 2817 B11R1.40 N[C@H](CF)Cc1ccccc1 Amb25151303 [0,1,0,0,0,0|1,0,0]=2 2818 B11R1.40 N[C@H](CS)Cc1ccccc1 Amb25765677 [0,1,0,0,0,0|0,1,0]=2 2819 B11R1.40 N[C@H](Cc1ccccc1)C=O Amb24746755 [0,1,0,0,0,0|0,0,2]=3 2820 B11R1.40 N\C(\Cc1ccccc1)=C\O Amb25152159 [0,1,0,0,0,0|0,0,2]=3 2821 B11R1.40 N\C(\Cc1ccccc1)=N/N Amb17933233 [0,1,0,0,0,0|2,0,1]=4 2822 B11R1.40 N\C(\Cc1ccccc1)=N\Cl Amb25689858 [0,1,0,0,0,0|2,0,1]=4 2823 B11R1.40 N\N=C(\Cl)/Cc1ccccc1 Amb25188651 [0,1,0,0,0,0|2,0,1]=4 2824 B11R1.40 O=C(CBr)C[n+]1ccccc1 Amb24641641 [0,1,0,0,0,0|2,0,1]=4 2825 B11R1.40 O=C(CBr)Sc1ccccc1 Amb24730786 [0,1,0,0,0,0|2,0,1]=4 2826 B11R1.40 O=C(CCl)Sc1ccccc1 Amb24712200 [0,1,0,0,0,0|2,0,1]=4 2827 B11R1.40 O=C(CF)Nc1ccccc1 Amb20246909 [0,1,0,0,0,0|2,0,1]=4 2828 B11R1.40 O=C(CI)Nc1ccccc1 Amb21964671 [0,1,0,0,0,0|2,0,1]=4 2829 B11R1.40 O=C(CP)Nc1ccccc1 Amb25032359 [0,1,0,0,0,0|2,0,1]=4 2830 B11R1.40 O=C(Cc1cc[n]cc1)CCl Amb22494556 [0,1,0,0,0,0|2,0,1]=4 2831 B11R1.40 O=C(Cc1ccccc1)CF Amb22234964 [0,1,0,0,0,0|1,0,1]=3 2832 B11R1.40 O=C(Cc1ccccc1)CS Amb25294429 [0,1,0,0,0,0|0,1,1]=3 2833 B11R1.40 O=C(Cc1ccccc1)O[Ag] Amb22359200 [0,1,0,0,0,0|2,0,1]=4 2834 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [0,1,0,0,0,0|0,0,3]=4 2835 B11R1.40 O=CC(Br)Cc1c[n]ccc1 Amb25365114 [0,1,0,0,0,0|1,0,2]=4 2836 B11R1.40 O=CC(Br)Cc1ccccc1 Amb18657408 [0,1,0,0,0,0|0,0,2]=3 2837 B11R1.40 O=CC(Cc1ccccc1)Cl Amb17204312 [0,1,0,0,0,0|0,0,2]=3 2838 B11R1.40 O=CC(F)Cc1cc[n]cc1 Amb25053677 [0,1,0,0,0,0|1,0,2]=4 2839 B11R1.40 O=CC(F)Cc1ccccc1 Amb24714702 [0,1,0,0,0,0|0,0,2]=3 2840 B11R1.40 O=C[C@@H](Br)Cc1ccccc1 Amb24461614 [0,1,0,0,0,0|0,0,2]=3 2841 B11R1.40 O=C[C@@H](F)Cc1ccccc1 Amb24724556 [0,1,0,0,0,0|0,0,2]=3 2842 B11R1.40 O=C[C@H](Br)Cc1ccccc1 Amb25778238 [0,1,0,0,0,0|0,0,2]=3 2843 B11R1.40 O=NC(Cc1ccccn1)C Amb10549352 [0,1,0,0,0,0|2,0,1]=4 2844 B11R1.40 O=S(CCl)Cc1ccccc1 Amb24373167 [0,1,0,0,0,0|2,0,0]=3 2845 B11R1.40 OC(CBr)Oc1ccccc1 Amb24724811 [0,1,0,0,0,0|2,0,0]=3 2846 B11R1.40 OC(CBr)Sc1ccccc1 Amb24065441 [0,1,0,0,0,0|2,0,0]=3 2847 B11R1.40 OC(CCl)C[n+]1ccccc1 Amb22346544 [0,1,0,0,0,0|2,0,0]=3 2848 B11R1.40 OC(CCl)Cc1c[n]c[n]c1 Amb24366154 [0,1,0,0,0,0|3,0,0]=4 2849 B11R1.40 OC(CCl)Cc1c[n]ccc1 Amb25189476 [0,1,0,0,0,0|2,0,0]=3 2850 B11R1.40 OC(CCl)Oc1ccccc1 Amb24635839 [0,1,0,0,0,0|2,0,0]=3 2851 B11R1.40 OC(CF)Cc1ccccc1 Amb24733743 [0,1,0,0,0,0|1,0,0]=2 2852 B11R1.40 OC(CS)Cc1ccccc1 Amb25740621 [0,1,0,0,0,0|0,1,0]=2 2853 B11R1.40 OC(Cc1c[n]ccc1)C=O Amb24533570 [0,1,0,0,0,0|1,0,2]=4 2854 B11R1.40 OC(Cc1cc[n]cc1)C=O Amb24751695 [0,1,0,0,0,0|1,0,2]=4 2855 B11R1.40 OC(Cc1ccccc1)C=O Amb25065752 [0,1,0,0,0,0|0,0,2]=3 2856 B11R1.40 OCC(=O)Cc1ccccc1 Amb18182729 [0,1,0,0,0,0|0,0,1]=2 2857 B11R1.40 OCC(=O)Nc1ccccc1 Amb1110212 [0,1,0,0,0,0|1,0,1]=3 2858 B11R1.40 OCC(=O)Oc1ccccc1 Amb25149728 [0,1,0,0,0,0|1,0,1]=3 2859 B11R1.40 OCC(Cc1ccccc1)C Amb17477578 [0,1,0,0,0,0|0,0,0]=1 2860 B11R1.40 OCC(Cc1ccccc1)O Amb17593786 [0,1,0,0,0,0|0,0,0]=1 2861 B11R1.40 OCC(Cc1ccccn1)N Amb17062682 [0,1,0,0,0,0|1,0,0]=2 2862 B11R1.40 OCC(Cc1cccnc1)N Amb17062683 [0,1,0,0,0,0|1,0,0]=2 2863 B11R1.40 OCC(Cc1ccncc1)N Amb17062684 [0,1,0,0,0,0|1,0,0]=2 2864 B11R1.40 OCC(Cl)Cc1ccccc1 Amb24373181 [0,1,0,0,0,0|0,0,0]=1 2865 B11R1.40 OCC(F)Cc1ccccc1 Amb25225922 [0,1,0,0,0,0|0,0,0]=1 2866 B11R1.40 OCC(O)Cc1cc[n]c[n]1 Amb24353125 [0,1,0,0,0,0|2,0,0]=3 2867 B11R1.40 OCC(O)Nc1ccccc1 Amb25369775 [0,1,0,0,0,0|1,0,0]=2 2868 B11R1.40 OCC(Oc1ccccc1)C Amb17232100 [0,1,0,0,0,0|1,0,0]=2 2869 B11R1.40 OC[C@@H](O)Cc1ccccc1 Amb25204361 [0,1,0,0,0,0|0,0,0]=1 2870 B11R1.40 OC[C@H](Br)Cc1ccccc1 Amb24639076 [0,1,0,0,0,0|0,0,0]=1 2871 B11R1.40 OC[C@H](O)Cc1ccccc1 Amb24392862 [0,1,0,0,0,0|0,0,0]=1 2872 B11R1.40 OC\C(\Br)=C\c1ccccc1 Amb25187542 [0,1,0,0,0,0|0,0,2]=3 2873 B11R1.40 OC\C(\F)=C\c1cccc[n]1 Amb24354427 [0,1,0,0,0,0|1,0,2]=4 2874 B11R1.40 ON=C(Cc1ccccn1)N Amb13994155 [0,1,0,0,0,0|2,0,1]=4 2875 B11R1.40 ONC(=O)Cc1ccc[n]c1 Amb25052392 [0,1,0,0,0,0|2,0,1]=4 2876 B11R1.40 ONC(=O)Oc1ccccc1 Amb22493600 [0,1,0,0,0,0|2,0,1]=4 2877 B11R1.40 O[C@@H](CCl)Cc1ccccc1 Amb19929327 [0,1,0,0,0,0|1,0,0]=2 2878 B11R1.40 O[C@H](CBr)Cc1ccccc1 Amb24392488 [0,1,0,0,0,0|1,0,0]=2 2879 B11R1.40 O[C@H](CCl)Cc1ccccc1 Amb19929332 [0,1,0,0,0,0|1,0,0]=2 2880 B11R1.40 O[C@H](Cc1ccccc1)C=O Amb25683436 [0,1,0,0,0,0|0,0,2]=3 2881 B11R1.40 O\C(\Cc1ccccc1)=N/O Amb19986986 [0,1,0,0,0,0|1,0,1]=3 2882 B11R1.40 O\N=C(/Cc1ccccc1)\N Amb1106303 [0,1,0,0,0,0|1,0,1]=3 2883 B11R1.40 O\N=C(\Cc1ccccc1)/N Amb1159399 [0,1,0,0,0,0|1,0,1]=3 2884 B11R1.40 O\N=C(\Cl)/Cc1ccccc1 Amb25721012 [0,1,0,0,0,0|1,0,1]=3 2885 B11R1.40 SCC(=O)Nc1ccccc1 Amb1349645 [0,1,0,0,0,0|1,1,1]=4 2886 B11R1.91 C=C(Br)CSc1ccccc1 Amb24458275 [0,1,0,0,0,0|2,0,1]=4 2887 B11R1.91 C=C(Cl)CNc1ccccc1 Amb18289308 [0,1,0,0,0,0|2,0,1]=4 2888 B11R1.91 CC(=C)COc1ccccc1 Amb10601706 [0,1,0,0,0,0|2,0,1]=4 2889 B11R1.91 CC(=C)OCc1ccccc1 Amb22731238 [0,1,0,0,0,0|2,0,1]=4 2890 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [0,1,0,0,0,0|2,0,1]=4 2891 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [0,1,0,0,0,0|2,0,1]=4 2892 B11R1.91 CC(=NCc1ccccc1)C Amb10568469 [0,1,0,0,0,0|2,0,1]=4 2893 B11R1.91 CC(=O)CCc1ccccn1 Amb17507163 [0,1,0,0,0,0|1,0,2]=4 2894 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [0,1,0,0,0,0|1,0,2]=4 2895 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [0,1,0,0,0,0|1,0,2]=4 2896 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [0,1,0,0,0,0|1,0,2]=4 2897 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [0,1,0,0,0,0|1,0,2]=4 2898 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [0,1,0,0,0,0|1,1,1]=4 2899 B11R1.91 CC(=S)OCc1ccccc1 Amb22168133 [0,1,0,0,0,0|1,1,1]=4 2900 B11R1.91 CC(Br)C#Cc1ccccc1 Amb25827119 [0,1,0,0,0,0|1,0,2]=4 2901 B11R1.91 CC(Br)CCc1c[n]cc[n]1 Amb24388666 [0,1,0,0,0,0|3,0,0]=4 2902 B11R1.91 CC(Br)COc1ccccc1 Amb25278262 [0,1,0,0,0,0|2,0,0]=3 2903 B11R1.91 CC(C#Cc1ccccn1)O Amb1039303 [0,1,0,0,0,0|1,0,2]=4 2904 B11R1.91 CC(C)CCc1cc[n]c[n]1 Amb24102818 [0,1,0,0,0,0|3,0,0]=4 2905 B11R1.91 CC(C)COc1cc[n]cc1 Amb24377931 [0,1,0,0,0,0|3,0,0]=4 2906 B11R1.91 CC(C)CSc1cc[n]cc1 Amb25163189 [0,1,0,0,0,0|3,0,0]=4 2907 B11R1.91 CC(C)CSc1cccc[n]1 Amb25091920 [0,1,0,0,0,0|3,0,0]=4 2908 B11R1.91 CC(C)NCc1cc[n]cc1 Amb20673476 [0,1,0,0,0,0|3,0,0]=4 2909 B11R1.91 CC(C)NCc1cccc[n]1 Amb20673475 [0,1,0,0,0,0|3,0,0]=4 2910 B11R1.91 CC(C)NNc1ccccc1 Amb24586606 [0,1,0,0,0,0|3,0,0]=4 2911 B11R1.91 CC(C)OCc1cc[n]cc1 Amb24649842 [0,1,0,0,0,0|3,0,0]=4 2912 B11R1.91 CC(C)OCc1cccc[n]1 Amb24485831 [0,1,0,0,0,0|3,0,0]=4 2913 B11R1.91 CC(C)\C=C/c1ccccc1 Amb22546593 [0,1,0,0,0,0|1,0,2]=4 2914 B11R1.91 CC(C)\N=C\c1ccccc1 Amb22734192 [0,1,0,0,0,0|2,0,1]=4 2915 B11R1.91 CC(CCc1ccccn1)N Amb17507327 [0,1,0,0,0,0|2,0,0]=3 2916 B11R1.91 CC(CCc1ccccn1)O Amb17507263 [0,1,0,0,0,0|1,0,0]=2 2917 B11R1.91 CC(CCc1cccnc1)N Amb17507328 [0,1,0,0,0,0|2,0,0]=3 2918 B11R1.91 CC(CCc1cccnc1)O Amb17507264 [0,1,0,0,0,0|1,0,0]=2 2919 B11R1.91 CC(CCc1ccncc1)N Amb17507329 [0,1,0,0,0,0|2,0,0]=3 2920 B11R1.91 CC(CCc1ccncc1)O Amb17507265 [0,1,0,0,0,0|1,0,0]=2 2921 B11R1.91 CC(CNc1ccccn1)C Amb1843155 [0,1,0,0,0,0|3,0,0]=4 2922 B11R1.91 CC(CNc1cnccn1)O Amb2445430 [0,1,0,0,0,0|3,0,0]=4 2923 B11R1.91 CC(COc1ccccc1)N Amb10609380 [0,1,0,0,0,0|2,0,0]=3 2924 B11R1.91 CC(COc1ccccc1)N Amb1126967 [0,1,0,0,0,0|2,0,0]=3 2925 B11R1.91 CC(Cl)CCc1c[n]c[n]c1 Amb24486008 [0,1,0,0,0,0|3,0,0]=4 2926 B11R1.91 CC(Cl)CCc1c[n]cc[n]1 Amb25317855 [0,1,0,0,0,0|3,0,0]=4 2927 B11R1.91 CC(Cl)CCc1c[n]ccc1 Amb24486010 [0,1,0,0,0,0|2,0,0]=3 2928 B11R1.91 CC(Cl)CCc1cc[n]cc1 Amb24369393 [0,1,0,0,0,0|2,0,0]=3 2929 B11R1.91 CC(Cl)COc1ccccc1 Amb20248050 [0,1,0,0,0,0|2,0,0]=3 2930 B11R1.91 CC(Cl)CSc1ccccc1 Amb25361088 [0,1,0,0,0,0|2,0,0]=3 2931 B11R1.91 CC(N)C=Cc1ccccc1 Amb23536549 [0,1,0,0,0,0|1,0,2]=4 2932 B11R1.91 CC(N)CCc1c[n]c[n]c1 Amb18125321 [0,1,0,0,0,0|3,0,0]=4 2933 B11R1.91 CC(N)CCc1c[n]cc[n]1 Amb25691782 [0,1,0,0,0,0|3,0,0]=4 2934 B11R1.91 CC(N)CCc1cc[n]c[n]1 Amb18201527 [0,1,0,0,0,0|3,0,0]=4 2935 B11R1.91 CC(N)CNc1cc[n]cc1 Amb25288005 [0,1,0,0,0,0|3,0,0]=4 2936 B11R1.91 CC(N)CNc1cccc[n]1 Amb18125324 [0,1,0,0,0,0|3,0,0]=4 2937 B11R1.91 CC(N)CNc1ccccc1 Amb18972362 [0,1,0,0,0,0|2,0,0]=3 2938 B11R1.91 CC(N)CSc1cccc[n]1 Amb22642666 [0,1,0,0,0,0|3,0,0]=4 2939 B11R1.91 CC(N)CSc1ccccc1 Amb18065472 [0,1,0,0,0,0|2,0,0]=3 2940 B11R1.91 CC(N)CSc1ccccc1 Amb21988436 [0,1,0,0,0,0|2,0,0]=3 2941 B11R1.91 CC(N)OCc1cccc[n]1 Amb24432123 [0,1,0,0,0,0|3,0,0]=4 2942 B11R1.91 CC(N)\C=C\c1ccccc1 Amb18124854 [0,1,0,0,0,0|1,0,2]=4 2943 B11R1.91 CC(N)\C=C\c1ccccc1 Amb21961471 [0,1,0,0,0,0|1,0,2]=4 2944 B11R1.91 CC(NCc1ccccc1)C Amb2118435 [0,1,0,0,0,0|2,0,0]=3 2945 B11R1.91 CC(NCc1ccccn1)C Amb2118825 [0,1,0,0,0,0|3,0,0]=4 2946 B11R1.91 CC(NCc1cccnc1)C Amb11012655 [0,1,0,0,0,0|3,0,0]=4 2947 B11R1.91 CC(NCc1cccnc1)C Amb2118449 [0,1,0,0,0,0|3,0,0]=4 2948 B11R1.91 CC(NCc1ccncc1)C Amb2118447 [0,1,0,0,0,0|3,0,0]=4 2949 B11R1.91 CC(O)C#Cc1ccccc1 Amb24101080 [0,1,0,0,0,0|0,0,2]=3 2950 B11R1.91 CC(O)CNc1c[n]c[n]c1 Amb18270237 [0,1,0,0,0,0|3,0,0]=4 2951 B11R1.91 CC(O)CNc1c[n]ccc1 Amb18933159 [0,1,0,0,0,0|2,0,0]=3 2952 B11R1.91 CC(O)CNc1cc[n]c[n]1 Amb18973902 [0,1,0,0,0,0|3,0,0]=4 2953 B11R1.91 CC(O)CNc1ccc[n][n]1 Amb18991549 [0,1,0,0,0,0|3,0,0]=4 2954 B11R1.91 CC(O)COc1c[n]ccc1 Amb24538290 [0,1,0,0,0,0|2,0,0]=3 2955 B11R1.91 CC(O)CSc1[n]ccc[n]1 Amb18180264 [0,1,0,0,0,0|3,0,0]=4 2956 B11R1.91 CC(O)CSc1cccc[n]1 Amb18180213 [0,1,0,0,0,0|2,0,0]=3 2957 B11R1.91 CC(O)CSc1ccccc1 Amb18793066 [0,1,0,0,0,0|1,0,0]=2 2958 B11R1.91 CC(O)OCc1ccccc1 Amb25070837 [0,1,0,0,0,0|1,0,0]=2 2959 B11R1.91 CC(O)\C=C\c1c[n]ccc1 Amb25847379 [0,1,0,0,0,0|1,0,2]=4 2960 B11R1.91 CC(S)CNc1ccccc1 Amb25701720 [0,1,0,0,0,0|1,1,0]=3 2961 B11R1.91 CC(\C=C\c1ccccc1)O Amb17593695 [0,1,0,0,0,0|0,0,2]=3 2962 B11R1.91 CN(C)CCc1cc[n]cc1 Amb24073816 [0,1,0,0,0,0|3,0,0]=4 2963 B11R1.91 CN(C)CCc1ccccc1 Amb22350299 [0,1,0,0,0,0|2,0,0]=3 2964 B11R1.91 CN(C)OCc1ccccc1 Amb24735469 [0,1,0,0,0,0|3,0,0]=4 2965 B11R1.91 CN(N)CCc1cccc[n]1 Amb25725193 [0,1,0,0,0,0|3,0,0]=4 2966 B11R1.91 CN(N)CCc1ccccc1 Amb18064284 [0,1,0,0,0,0|2,0,0]=3 2967 B11R1.91 CN(O)CCc1cc[n]cc1 Amb25684228 [0,1,0,0,0,0|2,0,0]=3 2968 B11R1.91 CN(O)N=Nc1ccccc1 Amb24064881 [0,1,0,0,0,0|3,0,0]=4 2969 B11R1.91 C[C@@H](COc1ccccc1)N Amb17232092 [0,1,0,0,0,0|2,0,0]=3 2970 B11R1.91 C[C@@H](N)CCc1cc[n]cc1 Amb24551017 [0,1,0,0,0,0|2,0,0]=3 2971 B11R1.91 C[C@@H](N)CCc1cccc[n]1 Amb25076768 [0,1,0,0,0,0|2,0,0]=3 2972 B11R1.91 C[C@@H](N)CNc1cccc[n]1 Amb25320231 [0,1,0,0,0,0|3,0,0]=4 2973 B11R1.91 C[C@@H](N)CNc1ccccc1 Amb24392348 [0,1,0,0,0,0|2,0,0]=3 2974 B11R1.91 C[C@@H](N)COc1ccccc1 Amb18538481 [0,1,0,0,0,0|2,0,0]=3 2975 B11R1.91 C[C@@H](N)CSc1cccc[n]1 Amb24488293 [0,1,0,0,0,0|3,0,0]=4 2976 B11R1.91 C[C@@H](N)CSc1ccccc1 Amb24692771 [0,1,0,0,0,0|2,0,0]=3 2977 B11R1.91 C[C@@H](N)\C=C\c1ccccc1 Amb24359903 [0,1,0,0,0,0|1,0,2]=4 2978 B11R1.91 C[C@@H](O)C#Cc1cccc[n]1 Amb25299246 [0,1,0,0,0,0|1,0,2]=4 2979 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [0,1,0,0,0,0|0,0,0]=1 2980 B11R1.91 C[C@@H](O)CNc1[n]ccc[n]1 Amb24369939 [0,1,0,0,0,0|3,0,0]=4 2981 B11R1.91 C[C@@H](O)CNc1c[n]cc[n]1 Amb24631782 [0,1,0,0,0,0|3,0,0]=4 2982 B11R1.91 C[C@@H](O)CNc1cc[n]cc1 Amb24422164 [0,1,0,0,0,0|2,0,0]=3 2983 B11R1.91 C[C@@H](O)CNc1ccc[n][n]1 Amb24484066 [0,1,0,0,0,0|3,0,0]=4 2984 B11R1.91 C[C@@H](O)CNc1cccc[n]1 Amb24633004 [0,1,0,0,0,0|2,0,0]=3 2985 B11R1.91 C[C@@H](O)CSc1c[n]cc[n]1 Amb24739282 [0,1,0,0,0,0|3,0,0]=4 2986 B11R1.91 C[C@@H](O)CSc1c[n]ccc1 Amb25306432 [0,1,0,0,0,0|2,0,0]=3 2987 B11R1.91 C[C@@H](O)CSc1cc[n]c[n]1 Amb25782462 [0,1,0,0,0,0|3,0,0]=4 2988 B11R1.91 C[C@@H](O)CSc1cc[n]cc1 Amb25374733 [0,1,0,0,0,0|2,0,0]=3 2989 B11R1.91 C[C@@H](O)CSc1ccccc1 Amb25148170 [0,1,0,0,0,0|1,0,0]=2 2990 B11R1.91 C[C@@H](O)\C=C\c1c[n]ccc1 Amb24698684 [0,1,0,0,0,0|1,0,2]=4 2991 B11R1.91 C[C@H](N)C#Cc1ccccc1 Amb24408567 [0,1,0,0,0,0|1,0,2]=4 2992 B11R1.91 C[C@H](N)CCc1cc[n]cc1 Amb24715801 [0,1,0,0,0,0|2,0,0]=3 2993 B11R1.91 C[C@H](N)CNc1cccc[n]1 Amb24620429 [0,1,0,0,0,0|3,0,0]=4 2994 B11R1.91 C[C@H](N)CNc1ccccc1 Amb24423922 [0,1,0,0,0,0|2,0,0]=3 2995 B11R1.91 C[C@H](N)CSc1cc[n]cc1 Amb25051842 [0,1,0,0,0,0|3,0,0]=4 2996 B11R1.91 C[C@H](N)CSc1cccc[n]1 Amb24488292 [0,1,0,0,0,0|3,0,0]=4 2997 B11R1.91 C[C@H](N)CSc1ccccc1 Amb24486596 [0,1,0,0,0,0|2,0,0]=3 2998 B11R1.91 C[C@H](N)\C=C\c1ccccc1 Amb25809484 [0,1,0,0,0,0|1,0,2]=4 2999 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [0,1,0,0,0,0|0,0,0]=1 3000 B11R1.91 C[C@H](O)CNc1c[n]cc[n]1 Amb25318452 [0,1,0,0,0,0|3,0,0]=4 3001 B11R1.91 C[C@H](O)CNc1cc[n]cc1 Amb25838422 [0,1,0,0,0,0|2,0,0]=3 3002 B11R1.91 C[C@H](O)CNc1ccc[n][n]1 Amb24448830 [0,1,0,0,0,0|3,0,0]=4 3003 B11R1.91 C[C@H](O)CNc1cccc[n]1 Amb25698310 [0,1,0,0,0,0|2,0,0]=3 3004 B11R1.91 C[C@H](O)CNc1ccccc1 Amb25060992 [0,1,0,0,0,0|1,0,0]=2 3005 B11R1.91 C[C@H](O)COc1c[n]ccc1 Amb25148164 [0,1,0,0,0,0|2,0,0]=3 3006 B11R1.91 C[C@H](O)COc1ccccc1 Amb25786939 [0,1,0,0,0,0|1,0,0]=2 3007 B11R1.91 C[C@H](O)CSc1[n]ccc[n]1 Amb25675970 [0,1,0,0,0,0|3,0,0]=4 3008 B11R1.91 C[C@H](O)CSc1cc[n]c[n]1 Amb25211625 [0,1,0,0,0,0|3,0,0]=4 3009 B11R1.91 C[C@H](O)CSc1cc[n]cc1 Amb25073090 [0,1,0,0,0,0|2,0,0]=3 3010 B11R1.91 C[C@H](O)CSc1ccccc1 Amb25852129 [0,1,0,0,0,0|1,0,0]=2 3011 B11R1.91 C[SiH](C)CCc1ccccc1 Amb22338692 [0,1,0,0,0,0|1,1,0]=3 3012 B11R1.91 ClC(Cl)CNc1ccccc1 Amb24720107 [0,1,0,0,0,0|2,0,0]=3 3013 B11R1.91 ClC(Cl)COc1ccccc1 Amb24417608 [0,1,0,0,0,0|2,0,0]=3 3014 B11R1.91 ClC(Cl)CSc1cccc[n]1 Amb25717407 [0,1,0,0,0,0|3,0,0]=4 3015 B11R1.91 ClC(Cl)\C=C\c1ccccc1 Amb24634340 [0,1,0,0,0,0|1,0,2]=4 3016 B11R1.91 ClP(Cl)OCc1ccccc1 Amb22054434 [0,1,0,0,0,0|3,0,0]=4 3017 B11R1.91 FC(Cl)C#Cc1ccccc1 Amb24538299 [0,1,0,0,0,0|1,0,2]=4 3018 B11R1.91 FC(F)CNc1cccc[n]1 Amb24374282 [0,1,0,0,0,0|3,0,0]=4 3019 B11R1.91 FC(F)CNc1ccccc1 Amb18791799 [0,1,0,0,0,0|2,0,0]=3 3020 B11R1.91 FC(F)CNc1ccccc1 Amb20623918 [0,1,0,0,0,0|2,0,0]=3 3021 B11R1.91 FC(F)COc1c[n]ccc1 Amb24607865 [0,1,0,0,0,0|3,0,0]=4 3022 B11R1.91 FC(F)COc1cc[n]cc1 Amb24350681 [0,1,0,0,0,0|3,0,0]=4 3023 B11R1.91 FC(F)COc1ccccc1 Amb22008298 [0,1,0,0,0,0|2,0,0]=3 3024 B11R1.91 FC(F)CSc1cc[n]cc1 Amb24423058 [0,1,0,0,0,0|3,0,0]=4 3025 B11R1.91 FC(F)CSc1ccccc1 Amb25668847 [0,1,0,0,0,0|2,0,0]=3 3026 B11R1.91 N=C(/N)\SCc1ccccc1 Amb20655654 [0,1,0,0,0,0|2,0,1]=4 3027 B11R1.91 N=C([NH3+])SCc1ccccc1 Amb24113839 [0,1,0,0,0,0|2,0,1]=4 3028 B11R1.91 NC(=N)CCc1cccc[n]1 Amb22304703 [0,1,0,0,0,0|2,0,1]=4 3029 B11R1.91 NC(=N)CNc1ccccc1 Amb24426634 [0,1,0,0,0,0|2,0,1]=4 3030 B11R1.91 NC(=N)NCc1ccccc1 Amb21955695 [0,1,0,0,0,0|2,0,1]=4 3031 B11R1.91 NC(=N)NCc1ccccc1 Amb22370878 [0,1,0,0,0,0|2,0,1]=4 3032 B11R1.91 NC(=N)SCc1ccccc1 Amb20676044 [0,1,0,0,0,0|2,0,1]=4 3033 B11R1.91 NC(=N)[NH2+]Cc1ccccc1 Amb22269907 [0,1,0,0,0,0|2,0,1]=4 3034 B11R1.91 NC(=NCc1ccccc1)N Amb16231121 [0,1,0,0,0,0|2,0,1]=4 3035 B11R1.91 NC(=O)CCc1ccccn1 Amb17399914 [0,1,0,0,0,0|1,0,2]=4 3036 B11R1.91 NC(=O)CCc1ccncc1 Amb10553007 [0,1,0,0,0,0|1,0,2]=4 3037 B11R1.91 NC(=O)NCc1ccccc1 Amb2435042 [0,1,0,0,0,0|1,0,2]=4 3038 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [0,1,0,0,0,0|0,1,1]=3 3039 B11R1.91 NC(=S)CCc1cccnc1 Amb17232623 [0,1,0,0,0,0|1,1,1]=4 3040 B11R1.91 NC(=S)CCc1ccncc1 Amb17400216 [0,1,0,0,0,0|1,1,1]=4 3041 B11R1.91 NC(=S)CNc1ccccc1 Amb17232624 [0,1,0,0,0,0|1,1,1]=4 3042 B11R1.91 NC(=S)COc1ccccc1 Amb1155418 [0,1,0,0,0,0|1,1,1]=4 3043 B11R1.91 NC(=S)NCc1ccccc1 Amb1207502 [0,1,0,0,0,0|1,1,1]=4 3044 B11R1.91 NC(=S)SCc1ccccc1 Amb19999447 [0,1,0,0,0,0|1,1,1]=4 3045 B11R1.91 NC(=[NH2+])NCc1ccccc1 Amb22730911 [0,1,0,0,0,0|2,0,1]=4 3046 B11R1.91 NC(=[NH2+])SCc1ccccc1 Amb2407328 [0,1,0,0,0,0|2,0,1]=4 3047 B11R1.91 NC(N)=NCc1ccccc1 Amb19374239 [0,1,0,0,0,0|2,0,1]=4 3048 B11R1.91 O=C(Cl)CCc1ccc[n]c1 Amb24077445 [0,1,0,0,0,0|1,0,2]=4 3049 B11R1.91 O=C(Cl)NCc1ccccc1 Amb25772230 [0,1,0,0,0,0|1,0,2]=4 3050 B11R1.91 O=C(S)CCc1ccccc1 Amb24733716 [0,1,0,0,0,0|0,0,2]=3 3051 B11R1.91 O=S(Cl)CCc1ccccc1 Amb25371638 [0,1,0,0,0,0|1,0,1]=3 3052 B11R1.91 OB(CCc1ccccc1)O Amb2456045 [0,1,0,0,0,0|1,0,0]=2 3053 B11R1.91 OB(O)C#Cc1ccccc1 Amb25151882 [0,1,0,0,0,0|1,0,2]=4 3054 B11R1.91 OB(O)CCc1c[n]ccc1 Amb25259201 [0,1,0,0,0,0|2,0,0]=3 3055 B11R1.91 OB(O)CCc1cccc[n]1 Amb24392967 [0,1,0,0,0,0|2,0,0]=3 3056 B11R1.91 OB(O)CSc1cccc[n]1 Amb22388601 [0,1,0,0,0,0|3,0,0]=4 3057 B11R1.91 OB(O)O[Hg]c1ccccc1 Amb22345921 [0,1,0,0,0,0|3,0,0]=4 3058 B11R1.91 OB(O)\C=C/c1ccccc1 Amb24117859 [0,1,0,0,0,0|1,0,2]=4 3059 B11R1.91 OB(\C=C\c1ccccc1)O Amb2447227 [0,1,0,0,0,0|1,0,2]=4 3060 B11R1.91 OC(=O)CCc1c[n]c[n]c1 Amb18201449 [0,1,0,0,0,0|2,0,1]=4 3061 B11R1.91 OC(=O)CCc1cc[n][n]c1 Amb22499259 [0,1,0,0,0,0|2,0,1]=4 3062 B11R1.91 OC(=O)CCc1ccc[n][n]1 Amb23592184 [0,1,0,0,0,0|2,0,1]=4 3063 B11R1.91 OC(=O)CCc1ccccc1 Amb22366916 [0,1,0,0,0,0|0,0,1]=2 3064 B11R1.91 OC(=O)CCc1ccccn1 Amb1102533 [0,1,0,0,0,0|1,0,1]=3 3065 B11R1.91 OC(=O)CCc1cccnc1 Amb1214870 [0,1,0,0,0,0|1,0,1]=3 3066 B11R1.91 OC(=O)CCc1ccncc1 Amb1090849 [0,1,0,0,0,0|1,0,1]=3 3067 B11R1.91 OC(=O)CNc1cc[n]cc1 Amb21955325 [0,1,0,0,0,0|2,0,1]=4 3068 B11R1.91 OC(=O)CNc1ccc[n]c1 Amb22035240 [0,1,0,0,0,0|2,0,1]=4 3069 B11R1.91 OC(=O)CNc1cccc[nH+]1 Amb10564534 [0,1,0,0,0,0|2,0,1]=4 3070 B11R1.91 OC(=O)CNc1cccc[n]1 Amb22495404 [0,1,0,0,0,0|2,0,1]=4 3071 B11R1.91 OC(=O)CNc1cccnc1 Amb17593781 [0,1,0,0,0,0|2,0,1]=4 3072 B11R1.91 OC(=O)COc1c[n]ccc1 Amb22738612 [0,1,0,0,0,0|2,0,1]=4 3073 B11R1.91 OC(=O)COc1cc[n]cc1 Amb18125520 [0,1,0,0,0,0|2,0,1]=4 3074 B11R1.91 OC(=O)COc1ccc[nH+]c1 Amb22370885 [0,1,0,0,0,0|2,0,1]=4 3075 B11R1.91 OC(=O)COc1ccccc1 Amb1213413 [0,1,0,0,0,0|1,0,1]=3 3076 B11R1.91 OC(=O)COc1ccccc1 Amb22274444 [0,1,0,0,0,0|1,0,1]=3 3077 B11R1.91 OC(=O)CPc1ccccc1 Amb24487808 [0,1,0,0,0,0|1,0,1]=3 3078 B11R1.91 OC(=O)CSc1cc[n]cc1 Amb24053001 [0,1,0,0,0,0|2,0,1]=4 3079 B11R1.91 OC(=O)CSc1ccc[n]c1 Amb24692785 [0,1,0,0,0,0|2,0,1]=4 3080 B11R1.91 OC(=O)CSc1ccccc1 Amb1038999 [0,1,0,0,0,0|1,0,1]=3 3081 B11R1.91 OC(=O)CSc1ccccn1 Amb1130490 [0,1,0,0,0,0|2,0,1]=4 3082 B11R1.91 OC(=O)NCc1ccccc1 Amb10603977 [0,1,0,0,0,0|1,0,1]=3 3083 B11R1.91 OC(=O)[13CH2][13CH2]c1ccccc1 Amb22336575 [0,1,0,0,0,0|0,0,1]=2 3084 B11R1.91 OC(=O)\C=C\c1ccccc1 Amb22366387 [0,1,0,0,0,0|0,0,3]=4 3085 B11R1.91 OC(=O)\C=N\c1ccccc1 Amb25243930 [0,1,0,0,0,0|1,0,2]=4 3086 B11R1.91 OC(O)CCc1ccccc1 Amb25829695 [0,1,0,0,0,0|0,0,0]=1 3087 B11R1.91 OS(=O)CCc1cc[n]cc1 Amb24546017 [0,1,0,0,0,0|2,0,0]=3 3088 B11R1.91 OS(=O)CNc1ccccc1 Amb25798133 [0,1,0,0,0,0|2,0,0]=3 3089 B11R1.91 O[13C](=O)[13CH2][13CH2]c1ccccc1 Amb22336771 [0,1,0,0,0,0|0,0,1]=2 3090 B11R1.91 SC(=S)CCc1ccccc1 Amb24439493 [0,1,0,0,0,0|0,1,1]=3 3091 B11R1.91 SC(=S)OCc1ccccc1 Amb10553124 [0,1,0,0,0,0|1,1,1]=4 3092 B11R1.91 SC(=S)OCc1ccccc1 Amb25721135 [0,1,0,0,0,0|1,1,1]=4 3093 B11R1.91 [O-]C(=O)CCc1ccccc1 Amb22233349 [0,1,0,0,0,0|0,0,2]=3 3094 B11R1.91 [O-]C(=O)CNc1ccccc1 Amb21520409 [0,1,0,0,0,0|1,0,2]=4 3095 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22167530 [0,1,0,0,0,0|1,0,2]=4 3096 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22734447 [0,1,0,0,0,0|1,0,2]=4 3097 B11R1.91 [O-]P(=O)OCc1ccccc1 Amb22461723 [0,1,0,0,0,0|2,0,1]=4 3098 B11R1.91 [O-]S(=O)NCc1ccccc1 Amb22641608 [0,1,0,0,0,0|2,0,1]=4 3099 B11R1.91 [O-][N+](=O)CCc1ccccc1 Amb16192705 [0,1,0,0,0,0|1,0,1]=3 3100 B11R1.91 [O-][N+](=O)CCc1ccccn1 Amb17399924 [0,1,0,0,0,0|2,0,1]=4 3101 B11R1.91 [O-][N+](=O)CCc1cccnc1 Amb17399925 [0,1,0,0,0,0|2,0,1]=4 3102 B11R1.91 [O-][N+](=O)CCc1ccncc1 Amb17399926 [0,1,0,0,0,0|2,0,1]=4 3103 B11R1.91 [O-][N+](=O)CSc1ccccc1 Amb25689622 [0,1,0,0,0,0|2,0,1]=4 3104 B9R0.18 C=CCCC(=C)CCCN Amb24444742 [0,0,1,0,0,0|1,0,2]=4 3105 B9R0.18 C=CCCC(=O)\C=C\C=C Amb24583790 [0,0,1,0,0,0|2,0,1]=4 3106 B9R0.18 C=CCOC(=O)CCCO Amb25297452 [0,0,1,0,0,0|2,0,1]=4 3107 B9R0.18 CCCCC(=C)\C=C\C=O Amb18124519 [0,0,1,0,0,0|2,0,0]=3 3108 B9R0.18 CCCCC(=O)\C=C/C=O Amb25299416 [0,0,1,0,0,0|3,0,0]=4 3109 B9R0.18 CCCCC(=O)\C=C\C=C Amb25338203 [0,0,1,0,0,0|2,0,0]=3 3110 B9R0.18 CCCCC(O)\C=C\C=C Amb24671823 [0,0,1,0,0,0|2,0,1]=4 3111 B9R0.18 OCCCC(=O)NCC=C Amb17231960 [0,0,1,0,0,0|2,0,1]=4 3112 B9R0.40 C=CC(CCCO)CC=C Amb24613508 [0,0,1,0,0,0|0,0,2]=3 3113 B9R0.40 C=C\C(\CCCCl)=C/C=O Amb24478178 [0,0,1,0,0,0|2,0,0]=3 3114 B9R0.40 C=C\C(\CCCCl)=C/CO Amb24657325 [0,0,1,0,0,0|2,0,1]=4 3115 B9R0.45 C=CC=CC=CC=CCO Amb25052157 [0,0,1,0,0,0|0,0,2]=3 3116 B9R0.45 C=CCC\C=C\CCCCl Amb24515097 [0,0,1,0,0,0|1,0,2]=4 3117 B9R0.45 C=CCO\N=C\CCCO Amb25043835 [0,0,1,0,0,0|2,0,1]=4 3118 B9R0.45 C=C\C=C\C#CCCCCl Amb24746779 [0,0,1,0,0,0|1,0,2]=4 3119 B9R0.45 CC=CC=CC=CCCO Amb25129709 [0,0,1,0,0,0|0,0,2]=3 3120 B9R0.45 CC=CC=CC=NCCO Amb24442192 [0,0,1,0,0,0|1,0,1]=3 3121 B9R0.45 CC=CC=CCCCCO Amb22231339 [0,0,1,0,0,0|0,0,2]=3 3122 B9R0.45 CCCCC=CC=CCO Amb22228348 [0,0,1,0,0,0|2,0,1]=4 3123 B9R0.45 CCCCCC\C=C/C=C Amb22641680 [0,0,1,0,0,0|1,0,2]=4 3124 B9R0.45 CCCCC\C=C\C=CCl Amb24561711 [0,0,1,0,0,0|2,0,1]=4 3125 B9R0.45 CCCCC\C=C\C=CN Amb25224315 [0,0,1,0,0,0|2,0,1]=4 3126 B9R0.45 CCCCNC\C=C\C=C Amb24621855 [0,0,1,0,0,0|2,0,1]=4 3127 B9R0.45 CCCC\C=C/C=C/C=O Amb25770096 [0,0,1,0,0,0|2,0,0]=3 3128 B9R0.45 CCCC\C=C\C=C\CO Amb22732540 [0,0,1,0,0,0|2,0,1]=4 3129 B9R0.45 CC\C=C/C=C/CCCBr Amb24597283 [0,0,1,0,0,0|1,0,2]=4 3130 B9R0.45 CC\C=C\C=CCCCBr Amb24656034 [0,0,1,0,0,0|1,0,2]=4 3131 B9R0.45 CC\C=C\C=CCCCO Amb24466260 [0,0,1,0,0,0|0,0,2]=3 3132 B9R0.45 C\C=C/C=C\CCCCC Amb22641684 [0,0,1,0,0,0|1,0,2]=4 3133 B9R0.45 C\C=C\C=C/C=C/CCC Amb22641677 [0,0,1,0,0,0|1,0,2]=4 3134 B9R0.45 C\C=C\C=C=CCCCO Amb25058490 [0,0,1,0,0,0|0,0,2]=3 3135 B9R0.45 C\C=C\C=CCCCCBr Amb25206214 [0,0,1,0,0,0|1,0,2]=4 3136 B9R0.45 C\C=C\C=CCCCCO Amb25238019 [0,0,1,0,0,0|0,0,2]=3 3137 B9R0.45 C\C=C\C=COCCCO Amb24474136 [0,0,1,0,0,0|1,0,1]=3 3138 B9R0.45 C\C=C\CC=CCCCBr Amb25339661 [0,0,1,0,0,0|1,0,2]=4 3139 B9R0.45 C\C=C\C\C=C/CCCBr Amb24713632 [0,0,1,0,0,0|1,0,2]=4 3140 B11R2.1 BN1CCc2ccccc12 Amb25180693 [0,0,0,1,0,0|2,0,0]=3 3141 B11R2.1 BrC1C=Cc2ccccc21 Amb25101590 [0,0,0,1,0,0|1,0,2]=4 3142 B11R2.1 BrC1N=Nc2ccccc21 Amb20246825 [0,0,0,1,0,0|3,0,0]=4 3143 B11R2.1 BrC1NCc2ccccc21 Amb22500144 [0,0,0,1,0,0|2,0,0]=3 3144 B11R2.1 C=C1CCc2ccccc21 Amb24458532 [0,0,0,1,0,0|1,0,1]=3 3145 B11R2.1 CC1=CCc2ccccc12 Amb17778909 [0,0,0,1,0,0|1,0,2]=4 3146 B11R2.1 CC1C=Cc2ccccc12 Amb17844052 [0,0,0,1,0,0|1,0,2]=4 3147 B11R2.1 CC1CCc2[n]cccc21 Amb24071595 [0,0,0,1,0,0|2,0,0]=3 3148 B11R2.1 CC1CCc2c[n]ccc21 Amb25691244 [0,0,0,1,0,0|2,0,0]=3 3149 B11R2.1 CC1CNc2ccccc21 Amb20241016 [0,0,0,1,0,0|2,0,0]=3 3150 B11R2.1 CC1COc2ccc[n]c21 Amb24102372 [0,0,0,1,0,0|3,0,0]=4 3151 B11R2.1 CC1CSc2ccccc12 Amb17939280 [0,0,0,1,0,0|2,0,0]=3 3152 B11R2.1 CC1NCc2ccccc21 Amb20623497 [0,0,0,1,0,0|2,0,0]=3 3153 B11R2.1 CC1OCc2cc[n]cc21 Amb24102361 [0,0,0,1,0,0|3,0,0]=4 3154 B11R2.1 CC1SCc2ccccc21 Amb24092837 [0,0,0,1,0,0|2,0,0]=3 3155 B11R2.1 CN1CC[n+]2c1cccc2 Amb10565842 [0,0,0,1,0,0|3,0,0]=4 3156 B11R2.1 CN1CCc2c1cccc2 Amb15691717 [0,0,0,1,0,0|2,0,0]=3 3157 B11R2.1 CN1CCc2c[n]ccc12 Amb25836379 [0,0,0,1,0,0|3,0,0]=4 3158 B11R2.1 CN1CNc2ccccc12 Amb25260683 [0,0,0,1,0,0|3,0,0]=4 3159 B11R2.1 C[C@@H]1CNc2ccccc21 Amb25069285 [0,0,0,1,0,0|2,0,0]=3 3160 B11R2.1 C[C@@H]1NCc2ccccc21 Amb25353679 [0,0,0,1,0,0|2,0,0]=3 3161 B11R2.1 C[N+]1=CCc2c1cccc2 Amb10553677 [0,0,0,1,0,0|2,0,1]=4 3162 B11R2.1 C[SiH]1CCc2ccccc12 Amb24065297 [0,0,0,1,0,0|1,1,0]=3 3163 B11R2.1 ClC1C=Nc2ccccc21 Amb24078935 [0,0,0,1,0,0|2,0,1]=4 3164 B11R2.1 ClC1CCc2[n]cccc21 Amb25321724 [0,0,0,1,0,0|2,0,0]=3 3165 B11R2.1 Cl[C@@H]1C=Cc2ccccc21 Amb24518031 [0,0,0,1,0,0|1,0,2]=4 3166 B11R2.1 Cl[C@H]1C=Cc2ccccc21 Amb25783948 [0,0,0,1,0,0|1,0,2]=4 3167 B11R2.1 FC1CCc2ccccc21 Amb25311534 [0,0,0,1,0,0|1,0,0]=2 3168 B11R2.1 FC1CNc2ccccc21 Amb20242176 [0,0,0,1,0,0|2,0,0]=3 3169 B11R2.1 FC1NCc2ccccc21 Amb22504231 [0,0,0,1,0,0|2,0,0]=3 3170 B11R2.1 N=S1CNc2ccccc12 Amb24465157 [0,0,0,1,0,0|3,0,0]=4 3171 B11R2.1 NC1C=Cc2c1cccc2 Amb17470367 [0,0,0,1,0,0|1,0,2]=4 3172 B11R2.1 NC1CCc2[n]cccc21 Amb21858247 [0,0,0,1,0,0|2,0,0]=3 3173 B11R2.1 NC1CCc2[n]cccc21 Amb22490383 [0,0,0,1,0,0|2,0,0]=3 3174 B11R2.1 NC1CCc2c1cccc2 Amb1158023 [0,0,0,1,0,0|1,0,0]=2 3175 B11R2.1 NC1CCc2c1cccc2 Amb16233857 [0,0,0,1,0,0|1,0,0]=2 3176 B11R2.1 NC1CCc2c[n]c[n]c21 Amb18203097 [0,0,0,1,0,0|3,0,0]=4 3177 B11R2.1 NC1CCc2c[n]ccc21 Amb22900659 [0,0,0,1,0,0|2,0,0]=3 3178 B11R2.1 NC1CCc2cc[n]cc21 Amb24738463 [0,0,0,1,0,0|2,0,0]=3 3179 B11R2.1 NC1CCc2ccc[n]c21 Amb21858242 [0,0,0,1,0,0|2,0,0]=3 3180 B11R2.1 NC1CCc2ccc[n]c21 Amb22436792 [0,0,0,1,0,0|2,0,0]=3 3181 B11R2.1 NC1CCc2ccccc21 Amb24078253 [0,0,0,1,0,0|1,0,0]=2 3182 B11R2.1 NC1CNc2ccccc21 Amb24555894 [0,0,0,1,0,0|2,0,0]=3 3183 B11R2.1 NC1COc2[n]cccc21 Amb25324317 [0,0,0,1,0,0|3,0,0]=4 3184 B11R2.1 NC1COc2c1cccc2 Amb13951643 [0,0,0,1,0,0|2,0,0]=3 3185 B11R2.1 NC1COc2c1cccc2 Amb2383232 [0,0,0,1,0,0|2,0,0]=3 3186 B11R2.1 N[C@@H]1CCc2c1cccc2 Amb16233854 [0,0,0,1,0,0|1,0,0]=2 3187 B11R2.1 N[C@@H]1CCc2ccc[n]c21 Amb22748121 [0,0,0,1,0,0|2,0,0]=3 3188 B11R2.1 N[C@@H]1COc2ccccc21 Amb23440344 [0,0,0,1,0,0|2,0,0]=3 3189 B11R2.1 N[C@@H]1COc2ccccc21 Amb24426876 [0,0,0,1,0,0|2,0,0]=3 3190 B11R2.1 N[C@H]1CCc2cc[n]cc21 Amb24502269 [0,0,0,1,0,0|2,0,0]=3 3191 B11R2.1 N[C@H]1CCc2ccccc21 Amb20242239 [0,0,0,1,0,0|1,0,0]=2 3192 B11R2.1 N[C@H]1COc2ccccc21 Amb25147252 [0,0,0,1,0,0|2,0,0]=3 3193 B11R2.1 O=C1CCc2[n]cccc21 Amb22275948 [0,0,0,1,0,0|1,0,2]=4 3194 B11R2.1 O=C1CCc2c1nccc2 Amb10602809 [0,0,0,1,0,0|1,0,2]=4 3195 B11R2.1 O=C1CCc2c[n]ccc21 Amb22235532 [0,0,0,1,0,0|1,0,2]=4 3196 B11R2.1 O=C1CCc2cc[n]cc21 Amb22491415 [0,0,0,1,0,0|1,0,2]=4 3197 B11R2.1 O=C1CNc2c1cccc2 Amb17593399 [0,0,0,1,0,0|1,0,2]=4 3198 B11R2.1 O=C1CNc2ccccc21 Amb22899450 [0,0,0,1,0,0|1,0,2]=4 3199 B11R2.1 O=C1COc2c1cccc2 Amb2383539 [0,0,0,1,0,0|1,0,2]=4 3200 B11R2.1 O=C1SCc2c1cccc2 Amb2421358 [0,0,0,1,0,0|1,0,2]=4 3201 B11R2.1 O=S1CNc2ccccc12 Amb24091032 [0,0,0,1,0,0|2,0,1]=4 3202 B11R2.1 OB1COc2ccccc21 Amb25132941 [0,0,0,1,0,0|2,0,0]=3 3203 B11R2.1 OB1OCc2c1cccc2 Amb1027843 [0,0,0,1,0,0|2,0,0]=3 3204 B11R2.1 OB1OCc2c1ccnc2 Amb13887161 [0,0,0,1,0,0|3,0,0]=4 3205 B11R2.1 OC1C=Cc2ccccc21 Amb24479258 [0,0,0,1,0,0|0,0,2]=3 3206 B11R2.1 OC1CCc2[n]cc[n]c21 Amb25285703 [0,0,0,1,0,0|2,0,0]=3 3207 B11R2.1 OC1CCc2c1cccn2 Amb16231393 [0,0,0,1,0,0|1,0,0]=2 3208 B11R2.1 OC1CCc2ccc[n]c21 Amb19958431 [0,0,0,1,0,0|1,0,0]=2 3209 B11R2.1 OC1COc2[n]cccc21 Amb21963377 [0,0,0,1,0,0|2,0,0]=3 3210 B11R2.1 OC1COc2c[n]ccc21 Amb24101551 [0,0,0,1,0,0|2,0,0]=3 3211 B11R2.1 OC1COc2ccc[n]c21 Amb24101560 [0,0,0,1,0,0|2,0,0]=3 3212 B11R2.1 OC1COc2ccccc21 Amb24104532 [0,0,0,1,0,0|1,0,0]=2 3213 B11R2.1 OC1OCc2ccc[n]c21 Amb25266798 [0,0,0,1,0,0|2,0,0]=3 3214 B11R2.1 OC1OCc2ccccc21 Amb21858794 [0,0,0,1,0,0|1,0,0]=2 3215 B11R2.1 O[C@@H]1CCc2[n]cccc21 Amb24511690 [0,0,0,1,0,0|1,0,0]=2 3216 B11R2.1 O[C@@H]1CCc2c1cccc2 Amb13953023 [0,0,0,1,0,0|0,0,0]=1 3217 B11R2.1 O[C@@H]1CCc2ccc[n]c21 Amb22745812 [0,0,0,1,0,0|1,0,0]=2 3218 B11R2.1 O[C@H]1C=Cc2ccccc21 Amb24748284 [0,0,0,1,0,0|0,0,2]=3 3219 B11R2.1 O[C@H]1CCc2c1cccc2 Amb13953022 [0,0,0,1,0,0|0,0,0]=1 3220 B11R2.1 O[C@H]1CSc2ccccc21 Amb25356604 [0,0,0,1,0,0|1,0,0]=2 3221 B11R2.1 O[n+]1c[nH]c2ccccc12 Amb24729556 [0,0,0,1,0,0|2,0,1]=4 3222 B11R2.1 Oc1[n][s]c2ccccc21 Amb22166851 [0,0,0,1,0,0|2,0,1]=4 3223 B11R2.1 Oc1[s][n]c2ccccc21 Amb22059084 [0,0,0,1,0,0|2,0,1]=4 3224 B11R2.1 Oc1coc2ccccc21 Amb24097480 [0,0,0,1,0,0|1,0,2]=4 3225 B11R2.1 On1nnc2c1cccc2 Amb1151367 [0,0,0,1,0,0|3,0,0]=4 3226 B11R2.1 S=C1NCc2ccccc21 Amb24662530 [0,0,0,1,0,0|1,1,1]=4 3227 B11R2.1 SC1CCc2ccc[n]c21 Amb24071779 [0,0,0,1,0,0|1,1,0]=3 3228 B11R2.1 [NH3+]C1=NCc2c1cccc2 Amb2540026 [0,0,0,1,0,0|2,0,1]=4 3229 B11R2.1 [O-][N+]1=CCc2ccccc12 Amb25338460 [0,0,0,1,0,0|1,0,2]=4 3230 B11R2.1 [Ti+3]C1C=Cc2ccccc21 Amb22053615 [0,0,0,1,0,0|1,0,2]=4 3231 B11R2.4 BrC1CC1c2cc[n]c[n]2 Amb24649167 [0,0,0,1,0,0|3,0,0]=4 3232 B11R2.4 BrC1CC1c2ccc[n]c2 Amb24411334 [0,0,0,1,0,0|2,0,0]=3 3233 B11R2.4 BrC1CC1c2ccccc2 Amb23454923 [0,0,0,1,0,0|1,0,0]=2 3234 B11R2.4 Br[C@@H]1C[C@H]1c2cc[n]cc2 Amb24673977 [0,0,0,1,0,0|2,0,0]=3 3235 B11R2.4 Br[C@@H]1C[C@H]1c2cccc[n]2 Amb25840547 [0,0,0,1,0,0|2,0,0]=3 3236 B11R2.4 Br[C@@H]1C[C@H]1c2ccccc2 Amb25791511 [0,0,0,1,0,0|1,0,0]=2 3237 B11R2.4 C=C1CC1c2ccccc2 Amb22733871 [0,0,0,1,0,0|1,0,1]=3 3238 B11R2.4 CC1CC1c2ccccc2 Amb16236859 [0,0,0,1,0,0|1,0,0]=2 3239 B11R2.4 CC1NC1c2ccccc2 Amb24056775 [0,0,0,1,0,0|2,0,0]=3 3240 B11R2.4 CC1OC1c2ccccc2 Amb1129298 [0,0,0,1,0,0|2,0,0]=3 3241 B11R2.4 CN1NC1c2ccccc2 Amb25766657 [0,0,0,1,0,0|3,0,0]=4 3242 B11R2.4 C[C@@H]1O[C@H]1c2ccccc2 Amb22367029 [0,0,0,1,0,0|2,0,0]=3 3243 B11R2.4 C[C@H]1O[C@@H]1c2ccccc2 Amb22224838 [0,0,0,1,0,0|2,0,0]=3 3244 B11R2.4 ClC1OC1c2ccccc2 Amb24372881 [0,0,0,1,0,0|2,0,0]=3 3245 B11R2.4 FC1CC1c2ccccc2 Amb25267358 [0,0,0,1,0,0|1,0,0]=2 3246 B11R2.4 F[C@@H]1C[C@@H]1c2ccccc2 Amb24600206 [0,0,0,1,0,0|1,0,0]=2 3247 B11R2.4 F[C@@H]1C[C@H]1c2ccccc2 Amb24538986 [0,0,0,1,0,0|1,0,0]=2 3248 B11R2.4 NC1CC1c2ccccc2 Amb19514914 [0,0,0,1,0,0|1,0,0]=2 3249 B11R2.4 NC1CC1c2ccccc2 Amb22729761 [0,0,0,1,0,0|1,0,0]=2 3250 B11R2.4 NC1OC1c2ccccc2 Amb25724793 [0,0,0,1,0,0|2,0,0]=3 3251 B11R2.4 NN1CC1c2ccccc2 Amb17593419 [0,0,0,1,0,0|2,0,0]=3 3252 B11R2.4 N[C@@H]1CC1c2ccccc2 Amb25077262 [0,0,0,1,0,0|1,0,0]=2 3253 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24183509 [0,0,0,1,0,0|1,0,0]=2 3254 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24579866 [0,0,0,1,0,0|1,0,0]=2 3255 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb22231696 [0,0,0,1,0,0|1,0,0]=2 3256 B11R2.4 N[C@H]1C[C@@H]1c2ccc[n]c2 Amb24604839 [0,0,0,1,0,0|2,0,0]=3 3257 B11R2.4 N[C@H]1C[C@@H]1c2ccccc2 Amb22735917 [0,0,0,1,0,0|1,0,0]=2 3258 B11R2.4 O=C1CC1c2ccccc2 Amb25689197 [0,0,0,1,0,0|0,0,2]=3 3259 B11R2.4 OC1CC1c2ccccc2 Amb17593413 [0,0,0,1,0,0|0,0,0]=1 3260 B11R2.4 O[C@H]1C[C@@H]1c2ccccc2 Amb17689138 [0,0,0,1,0,0|0,0,0]=1 3261 B11R2.20 B1OCc2ccccc2O1 Amb25185117 [0,0,0,1,0,0|2,0,0]=3 3262 B11R2.20 C1=Cc2c(CC1)cccc2 Amb1162229 [0,0,0,1,0,0|1,0,1]=3 3263 B11R2.20 C1=Cc2c(NC1)cccc2 Amb17593383 [0,0,0,1,0,0|1,0,2]=4 3264 B11R2.20 C1=Nc2c(CN1)cccc2 Amb10552960 [0,0,0,1,0,0|2,0,1]=4 3265 B11R2.20 C1=Nc2c(NC1)cccc2 Amb10174686 [0,0,0,1,0,0|2,0,1]=4 3266 B11R2.20 C1=Nc2c(SC1)cccc2 Amb10976509 [0,0,0,1,0,0|1,1,1]=4 3267 B11R2.20 C1C=CCC=2CCCCC21 Amb22364730 [0,0,0,1,0,0|1,0,2]=4 3268 B11R2.20 C1C=CNc2ccccc21 Amb24700458 [0,0,0,1,0,0|1,0,2]=4 3269 B11R2.20 C1C=COC=2CCCCC21 Amb24671211 [0,0,0,1,0,0|2,0,1]=4 3270 B11R2.20 C1C=COc2[n]cccc21 Amb25793536 [0,0,0,1,0,0|1,0,2]=4 3271 B11R2.20 C1C=COc2c[n]ccc21 Amb24390776 [0,0,0,1,0,0|1,0,2]=4 3272 B11R2.20 C1C=COc2ccccc21 Amb24715811 [0,0,0,1,0,0|0,0,2]=3 3273 B11R2.20 C1C=CSc2ccccc21 Amb25349026 [0,0,0,1,0,0|0,1,2]=4 3274 B11R2.20 C1C=Cc2[n]cccc2O1 Amb22896485 [0,0,0,1,0,0|1,0,2]=4 3275 B11R2.20 C1C=Cc2c[n]ccc2O1 Amb24665756 [0,0,0,1,0,0|1,0,2]=4 3276 B11R2.20 C1C=Cc2cc[n]cc2O1 Amb24065645 [0,0,0,1,0,0|1,0,2]=4 3277 B11R2.20 C1C=Nc2[n]cccc2O1 Amb25707817 [0,0,0,1,0,0|2,0,1]=4 3278 B11R2.20 C1CC=C2C=NC=CC2=C1 Amb24612787 [0,0,0,1,0,0|2,0,1]=4 3279 B11R2.20 C1CC=Cc2[n]cccc21 Amb25837322 [0,0,0,1,0,0|2,0,1]=4 3280 B11R2.20 C1CC=Cc2c[n]ccc21 Amb25064667 [0,0,0,1,0,0|2,0,1]=4 3281 B11R2.20 C1CCCc2[n][n]ccc21 Amb22752027 [0,0,0,1,0,0|3,0,0]=4 3282 B11R2.20 C1CCCc2[n]c[n]cc21 Amb19515985 [0,0,0,1,0,0|3,0,0]=4 3283 B11R2.20 C1CCCc2ccccc21 Amb22351371 [0,0,0,1,0,0|1,0,0]=2 3284 B11R2.20 C1CCN2C=CC=CC2=N1 Amb22055140 [0,0,0,1,0,0|2,0,0]=3 3285 B11R2.20 C1CCNc2[n]c[n]cc21 Amb18832493 [0,0,0,1,0,0|3,0,0]=4 3286 B11R2.20 C1CCNc2[n]cc[n]c21 Amb18832490 [0,0,0,1,0,0|3,0,0]=4 3287 B11R2.20 C1CCNc2c[n][n]cc21 Amb25189782 [0,0,0,1,0,0|3,0,0]=4 3288 B11R2.20 C1CCNc2c[n]c[n]c21 Amb18203099 [0,0,0,1,0,0|3,0,0]=4 3289 B11R2.20 C1CCNc2c[n]ccc21 Amb21864834 [0,0,0,1,0,0|2,0,0]=3 3290 B11R2.20 C1CCNc2c[n]ccc21 Amb22491315 [0,0,0,1,0,0|2,0,0]=3 3291 B11R2.20 C1CCNc2c[n]ccc21 Amb22751690 [0,0,0,1,0,0|2,0,0]=3 3292 B11R2.20 C1CCOc2[n]cccc21 Amb22753924 [0,0,0,1,0,0|1,0,0]=2 3293 B11R2.20 C1CCc2c(C1)nccc2 Amb2390042 [0,0,0,1,0,0|2,0,0]=3 3294 B11R2.20 C1CCc2c(N1)cccc2 Amb10072811 [0,0,0,1,0,0|1,0,0]=2 3295 B11R2.20 C1CCc2c(N1)cccc2 Amb1869492 [0,0,0,1,0,0|1,0,0]=2 3296 B11R2.20 C1CCc2c(S1)cccc2 Amb2237019 [0,0,0,1,0,0|0,1,0]=2 3297 B11R2.20 C1CNNc2ccccc21 Amb24564127 [0,0,0,1,0,0|2,0,0]=3 3298 B11R2.20 C1CNc2c(C1)cccn2 Amb15692065 [0,0,0,1,0,0|2,0,0]=3 3299 B11R2.20 C1CNc2c(N1)nccc2 Amb10603351 [0,0,0,1,0,0|3,0,0]=4 3300 B11R2.20 C1CNc2c(O1)cccc2 Amb2371970 [0,0,0,1,0,0|1,0,0]=2 3301 B11R2.20 C1CNc2c(S1)cccc2 Amb1104964 [0,0,0,1,0,0|1,1,0]=3 3302 B11R2.20 C1CNc2c[n]ccc2N1 Amb20622788 [0,0,0,1,0,0|3,0,0]=4 3303 B11R2.20 C1COc2[n]cc[n]c2N1 Amb24520491 [0,0,0,1,0,0|3,0,0]=4 3304 B11R2.20 C1COc2c(C1)cncc2 Amb13889664 [0,0,0,1,0,0|1,0,0]=2 3305 B11R2.20 C1COc2c(C1)nccc2 Amb13889663 [0,0,0,1,0,0|1,0,0]=2 3306 B11R2.20 C1COc2c(N1)cccn2 Amb13890253 [0,0,0,1,0,0|2,0,0]=3 3307 B11R2.20 C1COc2c(N1)ccnc2 Amb13890252 [0,0,0,1,0,0|2,0,0]=3 3308 B11R2.20 C1COc2c(O1)nccc2 Amb13889670 [0,0,0,1,0,0|2,0,0]=3 3309 B11R2.20 C1COc2c[n]c[n]c2N1 Amb25097976 [0,0,0,1,0,0|3,0,0]=4 3310 B11R2.20 C1COc2cc[n]cc2N1 Amb20622566 [0,0,0,1,0,0|2,0,0]=3 3311 B11R2.20 C1COc2ccccc2N1 Amb18090793 [0,0,0,1,0,0|1,0,0]=2 3312 B11R2.20 C1CSC2=CC=CNC2=N1 Amb24423182 [0,0,0,1,0,0|2,1,0]=4 3313 B11R2.20 C1CSc2[n]cccc2N1 Amb19148121 [0,0,0,1,0,0|2,1,0]=4 3314 B11R2.20 C1CSc2cc[n]cc2N1 Amb20667582 [0,0,0,1,0,0|2,1,0]=4 3315 B11R2.20 C1CSc2ccccc2O1 Amb19374957 [0,0,0,1,0,0|1,0,0]=2 3316 B11R2.20 C1C[NH+]=Cc2ccccc21 Amb23569648 [0,0,0,1,0,0|2,0,0]=3 3317 B11R2.20 C1N=CNc2ccccc21 Amb19374085 [0,0,0,1,0,0|2,0,1]=4 3318 B11R2.20 C1N=Cc2[n]cccc2O1 Amb24424648 [0,0,0,1,0,0|2,0,1]=4 3319 B11R2.20 C1NCCc2[n]cccc21 Amb19373278 [0,0,0,1,0,0|3,0,0]=4 3320 B11R2.20 C1NCCc2[n]cccc21 Amb19958501 [0,0,0,1,0,0|3,0,0]=4 3321 B11R2.20 C1NCCc2[n]cccc21 Amb22002369 [0,0,0,1,0,0|3,0,0]=4 3322 B11R2.20 C1NCCc2c[n]ccc21 Amb18124435 [0,0,0,1,0,0|3,0,0]=4 3323 B11R2.20 C1NCCc2c[n]ccc21 Amb20075877 [0,0,0,1,0,0|3,0,0]=4 3324 B11R2.20 C1NCCc2c[n]ccc21 Amb22752076 [0,0,0,1,0,0|3,0,0]=4 3325 B11R2.20 C1NCCc2cc[n]cc21 Amb19958148 [0,0,0,1,0,0|3,0,0]=4 3326 B11R2.20 C1NCCc2cc[n]cc21 Amb21858409 [0,0,0,1,0,0|3,0,0]=4 3327 B11R2.20 C1NCCc2ccc[n]c21 Amb21858385 [0,0,0,1,0,0|3,0,0]=4 3328 B11R2.20 C1NCCc2ccc[n]c21 Amb22436767 [0,0,0,1,0,0|3,0,0]=4 3329 B11R2.20 C1NCNc2[n]cccc21 Amb24746456 [0,0,0,1,0,0|3,0,0]=4 3330 B11R2.20 C1NCNc2ccccc21 Amb25147572 [0,0,0,1,0,0|2,0,0]=3 3331 B11R2.20 C1NCOc2ccccc21 Amb24087478 [0,0,0,1,0,0|1,0,0]=2 3332 B11R2.20 C1NCc2c(C1)nccc2 Amb10608993 [0,0,0,1,0,0|3,0,0]=4 3333 B11R2.20 C1NNCc2ccccc21 Amb22497223 [0,0,0,1,0,0|3,0,0]=4 3334 B11R2.20 C1Nc2ccccc2C=N1 Amb25147432 [0,0,0,1,0,0|2,0,1]=4 3335 B11R2.20 C1OCCc2ccc[n]c21 Amb24070918 [0,0,0,1,0,0|3,0,0]=4 3336 B11R2.20 C1OCOc2[n]c[n]cc21 Amb24079204 [0,0,0,1,0,0|3,0,0]=4 3337 B11R2.20 C1OCOc2[n]cccc21 Amb24079202 [0,0,0,1,0,0|2,0,0]=3 3338 B11R2.20 C1OCOc2c[n]c[n]c21 Amb24079205 [0,0,0,1,0,0|3,0,0]=4 3339 B11R2.20 C1OCOc2c[n]ccc21 Amb24079203 [0,0,0,1,0,0|2,0,0]=3 3340 B11R2.20 C1OCOc2ccccc21 Amb24066080 [0,0,0,1,0,0|1,0,0]=2 3341 B11R2.20 C1ON=Cc2ccccc21 Amb25217160 [0,0,0,1,0,0|3,0,0]=4 3342 B11R2.20 C1Oc2ccccc2C=C1 Amb17844055 [0,0,0,1,0,0|0,0,2]=3 3343 B11R2.20 C1PCNc2ccccc21 Amb25737691 [0,0,0,1,0,0|2,0,0]=3 3344 B11R2.20 C1SC=Cc2ccccc21 Amb25231190 [0,0,0,1,0,0|2,0,1]=4 3345 B11R2.20 C1SCCc2ccccc21 Amb24085482 [0,0,0,1,0,0|2,0,0]=3 3346 B11R2.20 C1SSCc2ccccc21 Amb25839327 [0,0,0,1,0,0|3,0,0]=4 3347 B11R2.20 N1CCc2c(C1)cccc2 Amb2383348 [0,0,0,1,0,0|2,0,0]=3 3348 B11R2.20 c1ccc2c(c1)C=NCC2 Amb10603654 [0,0,0,1,0,0|2,0,0]=3 3349 B11R2.20 c1ccc2c(c1)C=[NH+]CC2 Amb10553686 [0,0,0,1,0,0|2,0,0]=3 3350 B11R2.238 C(C1CC1)c2ccccc2 Amb22490220 [0,0,0,1,0,0|1,0,0]=2 3351 B11R2.238 C(c1c[n]ccc1)N2CC2 Amb24085109 [0,0,0,1,0,0|3,0,0]=4 3352 B11R2.238 C1CC1=Cc2ccccc2 Amb19515480 [0,0,0,1,0,0|1,0,2]=4 3353 B11R2.238 C1CC1C[n+]2ccccc2 Amb10554474 [0,0,0,1,0,0|2,0,0]=3 3354 B11R2.238 C1CC1C[n+]2ccccc2 Amb10554486 [0,0,0,1,0,0|2,0,0]=3 3355 B11R2.238 C1CC1Nc2c[n]ccc2 Amb18270523 [0,0,0,1,0,0|3,0,0]=4 3356 B11R2.238 C1CC1Nc2ccccc2 Amb18270529 [0,0,0,1,0,0|2,0,0]=3 3357 B11R2.238 C1CC1Oc2cccc[n]2 Amb25697005 [0,0,0,1,0,0|3,0,0]=4 3358 B11R2.238 C1N=C1Cc2ccccc2 Amb22498074 [0,0,0,1,0,0|1,0,1]=3 3359 B11R2.238 C1OC1Cc2c[n]c[n]c2 Amb24426064 [0,0,0,1,0,0|2,0,0]=3 3360 B11R2.238 C1OC1Cc2cc[n]cc2 Amb24677560 [0,0,0,1,0,0|1,0,0]=2 3361 B11R2.238 C1OC1Cc2cccc[n]2 Amb24649901 [0,0,0,1,0,0|1,0,0]=2 3362 B11R2.238 C1OC1Oc2cc[n]cc2 Amb24102767 [0,0,0,1,0,0|2,0,0]=3 3363 B11R2.238 N1CC1Cc2ccccc2 Amb10072810 [0,0,0,1,0,0|1,0,0]=2 3364 B11R2.238 N1C[C@@H]1Cc2ccccc2 Amb15690958 [0,0,0,1,0,0|1,0,0]=2 3365 B11R2.238 N1C[C@H]1Cc2ccccc2 Amb10603217 [0,0,0,1,0,0|1,0,0]=2 3366 B11R2.239 C1CC(N1)c2cc[n]c[n]2 Amb25274242 [0,0,0,1,0,0|3,0,0]=4 3367 B11R2.239 C1CC(N1)c2ccc[n][n]2 Amb25229662 [0,0,0,1,0,0|3,0,0]=4 3368 B11R2.239 C1CC(N1)c2cccc[n]2 Amb25849292 [0,0,0,1,0,0|2,0,0]=3 3369 B11R2.239 C1CC(O1)c2ccccc2 Amb22298601 [0,0,0,1,0,0|0,0,0]=1 3370 B11R2.239 C1CC=C1c2cccc[n]2 Amb24069951 [0,0,0,1,0,0|2,0,1]=4 3371 B11R2.239 C1CCC1c2cc[n]cc2 Amb22898826 [0,0,0,1,0,0|2,0,0]=3 3372 B11R2.239 C1CCN1c2cccc[n]2 Amb24069933 [0,0,0,1,0,0|3,0,0]=4 3373 B11R2.239 C1C[C@@H](N1)c2c[n]cc[n]2 Amb24657231 [0,0,0,1,0,0|3,0,0]=4 3374 B11R2.239 C1C[C@@H](N1)c2cc[n]cc2 Amb25761359 [0,0,0,1,0,0|2,0,0]=3 3375 B11R2.239 C1C[C@@H](O1)c2ccccc2 Amb24479262 [0,0,0,1,0,0|0,0,0]=1 3376 B11R2.239 C1C[C@H](N1)c2c[n]cc[n]2 Amb25791186 [0,0,0,1,0,0|3,0,0]=4 3377 B11R2.239 C1C[C@H](N1)c2cccc[n]2 Amb24732378 [0,0,0,1,0,0|2,0,0]=3 3378 B11R2.239 C1C[C@H](O1)c2ccccc2 Amb25721124 [0,0,0,1,0,0|0,0,0]=1 3379 B11R2.239 C1NCC1c2c[n]ccc2 Amb19516797 [0,0,0,1,0,0|3,0,0]=4 3380 B11R2.239 C1NCC1c2c[n]ccc2 Amb20620349 [0,0,0,1,0,0|3,0,0]=4 3381 B11R2.239 C1NCC1c2cc[n]cc2 Amb19516821 [0,0,0,1,0,0|3,0,0]=4 3382 B11R2.239 C1NCC1c2cc[n]cc2 Amb20620350 [0,0,0,1,0,0|3,0,0]=4 3383 B11R2.239 C1NCC1c2cc[n]cc2 Amb22749029 [0,0,0,1,0,0|3,0,0]=4 3384 B11R2.239 C1NCC1c2cccc[n]2 Amb19516701 [0,0,0,1,0,0|3,0,0]=4 3385 B11R2.239 C1OCC1c2cccc[n]2 Amb24100566 [0,0,0,1,0,0|3,0,0]=4 3386 B11R2.239 C1OCC1c2ccccc2 Amb21963191 [0,0,0,1,0,0|2,0,0]=3 3387 B11R2.239 N1CC(C1)c2ccccc2 Amb10603719 [0,0,0,1,0,0|2,0,0]=3 3388 B11R2.239 N1CC(C1)c2ccccn2 Amb15695195 [0,0,0,1,0,0|3,0,0]=4 3389 B11R2.988 C=CC1Cc2ccccc12 Amb17778869 [0,0,0,1,0,0|1,0,1]=3 3390 B11R2.988 CCC1Cc2ccccc21 Amb24647895 [0,0,0,1,0,0|1,0,0]=2 3391 B11R2.988 COC1Cc2ccccc21 Amb24455687 [0,0,0,1,0,0|2,0,0]=3 3392 B11R2.988 ClCC1Cc2ccccc21 Amb24588110 [0,0,0,1,0,0|1,0,0]=2 3393 B11R2.988 ICC1Cc2ccccc21 Amb24354685 [0,0,0,1,0,0|1,0,0]=2 3394 B11R2.988 NCC1=Cc2ccccc21 Amb24596883 [0,0,0,1,0,0|1,0,2]=4 3395 B11R2.988 NCC1Cc2c1cccc2 Amb10609227 [0,0,0,1,0,0|1,0,0]=2 3396 B11R2.988 NC[C@@H]1Cc2ccccc21 Amb24182000 [0,0,0,1,0,0|1,0,0]=2 3397 B11R2.988 NNC1Cc2ccccc21 Amb25326415 [0,0,0,1,0,0|2,0,0]=3 3398 B11R2.988 O=CC1Cc2c1cccc2 Amb16230472 [0,0,0,1,0,0|0,0,2]=3 3399 B11R2.988 OCC1=Cc2c1cccc2 Amb15691967 [0,0,0,1,0,0|0,0,2]=3 3400 B11R2.1037 C1COc2cc[n]c([n]2)O1 Amb24093493 [0,0,0,1,0,0|3,0,0]=4 3401 B11R2.1261 C1CCCC12C=CNC=C2 Amb24539673 [0,0,0,1,0,0|2,0,1]=4 3402 B9R1.12 BrCCC[n]1c[n]cc1 Amb19515253 [0,0,0,0,1,0|3,0,0]=4 3403 B9R1.12 BrCCCc1c[nH][n]c1 Amb19065557 [0,0,0,0,1,0|3,0,0]=4 3404 B9R1.12 BrCCCc1c[nH]c[n]1 Amb22370130 [0,0,0,0,1,0|3,0,0]=4 3405 B9R1.12 BrCCCc1c[n]oc1 Amb18327732 [0,0,0,0,1,0|3,0,0]=4 3406 B9R1.12 BrCCCc1c[s]c[n]1 Amb24376114 [0,0,0,0,1,0|3,0,0]=4 3407 B9R1.12 BrCCCc1ccco1 Amb17104550 [0,0,0,0,1,0|2,0,0]=3 3408 B9R1.12 BrCCCc1cccs1 Amb17104551 [0,0,0,0,1,0|2,0,0]=3 3409 B9R1.12 BrCCCc1cocc1 Amb24593084 [0,0,0,0,1,0|2,0,0]=3 3410 B9R1.12 BrCCCn1cccc1 Amb10608810 [0,0,0,0,1,0|2,0,0]=3 3411 B9R1.12 BrCCOc1c[s]cc1 Amb25698109 [0,0,0,0,1,0|3,0,0]=4 3412 B9R1.12 C=CCCC=1C=CCC1 Amb24596038 [0,0,0,0,1,0|1,0,2]=4 3413 B9R1.12 C=CCCc1ccc[nH]1 Amb25858739 [0,0,0,0,1,0|2,0,1]=4 3414 B9R1.12 CCCCC1C=CC=C1 Amb21962871 [0,0,0,0,1,0|1,0,1]=3 3415 B9R1.12 CCCCc1c[nH][n]c1 Amb25348386 [0,0,0,0,1,0|3,0,0]=4 3416 B9R1.12 CCCCc1c[nH]cc1 Amb25771565 [0,0,0,0,1,0|2,0,0]=3 3417 B9R1.12 CCCCc1c[n]c[s]1 Amb25743706 [0,0,0,0,1,0|3,0,0]=4 3418 B9R1.12 CCCCc1cc[nH][n]1 Amb24524215 [0,0,0,0,1,0|3,0,0]=4 3419 B9R1.12 CCCCc1ccco1 Amb10070290 [0,0,0,0,1,0|2,0,0]=3 3420 B9R1.12 CCCCc1ccsc1 Amb17779303 [0,0,0,0,1,0|2,0,0]=3 3421 B9R1.12 CCCOc1c[s]cc1 Amb25268417 [0,0,0,0,1,0|3,0,0]=4 3422 B9R1.12 CCCSc1c[s]cc1 Amb25352161 [0,0,0,0,1,0|3,0,0]=4 3423 B9R1.12 CCCSc1ccc[nH]1 Amb24453201 [0,0,0,0,1,0|3,0,0]=4 3424 B9R1.12 CCCSc1ccco1 Amb25249856 [0,0,0,0,1,0|3,0,0]=4 3425 B9R1.12 CCNCc1c[nH]cc1 Amb18062213 [0,0,0,0,1,0|3,0,0]=4 3426 B9R1.12 CCNCc1c[s]cc1 Amb21972194 [0,0,0,0,1,0|3,0,0]=4 3427 B9R1.12 CCNCc1ccc[nH]1 Amb17142855 [0,0,0,0,1,0|3,0,0]=4 3428 B9R1.12 CCNCc1ccc[s]1 Amb22283900 [0,0,0,0,1,0|3,0,0]=4 3429 B9R1.12 CCNCc1ccco1 Amb1137312 [0,0,0,0,1,0|3,0,0]=4 3430 B9R1.12 CCNCc1cccs1 Amb1088620 [0,0,0,0,1,0|3,0,0]=4 3431 B9R1.12 CCOCc1c[s]cc1 Amb24708417 [0,0,0,0,1,0|3,0,0]=4 3432 B9R1.12 CCOCc1ccc[nH]1 Amb25190159 [0,0,0,0,1,0|3,0,0]=4 3433 B9R1.12 CCOCc1ccc[s]1 Amb25217999 [0,0,0,0,1,0|3,0,0]=4 3434 B9R1.12 CCOCc1ccco1 Amb22234292 [0,0,0,0,1,0|3,0,0]=4 3435 B9R1.12 CCSCc1ccc[s]1 Amb24478825 [0,0,0,0,1,0|3,0,0]=4 3436 B9R1.12 CNCCC=1CC=CC1 Amb25755843 [0,0,0,0,1,0|2,0,1]=4 3437 B9R1.12 CNCC[n]1cccc1 Amb18994357 [0,0,0,0,1,0|3,0,0]=4 3438 B9R1.12 CNCCc1c[nH]cc1 Amb18062858 [0,0,0,0,1,0|3,0,0]=4 3439 B9R1.12 CNCCc1ccc[s]1 Amb21959880 [0,0,0,0,1,0|3,0,0]=4 3440 B9R1.12 CNCCc1ccco1 Amb17399803 [0,0,0,0,1,0|3,0,0]=4 3441 B9R1.12 CNCCc1cocc1 Amb25682417 [0,0,0,0,1,0|3,0,0]=4 3442 B9R1.12 COCCc1ccc[s]1 Amb25147094 [0,0,0,0,1,0|3,0,0]=4 3443 B9R1.12 COCCc1ccco1 Amb25147016 [0,0,0,0,1,0|3,0,0]=4 3444 B9R1.12 CSCC[n]1cccc1 Amb24501482 [0,0,0,0,1,0|3,0,0]=4 3445 B9R1.12 CSCCc1c[s]cc1 Amb24394930 [0,0,0,0,1,0|3,0,0]=4 3446 B9R1.12 ClCCC[n]1c[n]cc1 Amb21961562 [0,0,0,0,1,0|3,0,0]=4 3447 B9R1.12 ClCCC[n]1ccc[n]1 Amb22587111 [0,0,0,0,1,0|3,0,0]=4 3448 B9R1.12 ClCCC[n]1cccc1 Amb21912596 [0,0,0,0,1,0|2,0,0]=3 3449 B9R1.12 ClCCCc1[n]cc[s]1 Amb24715677 [0,0,0,0,1,0|3,0,0]=4 3450 B9R1.12 ClCCCc1c[nH][n]c1 Amb19374605 [0,0,0,0,1,0|3,0,0]=4 3451 B9R1.12 ClCCCc1c[nH][n]c1 Amb20618908 [0,0,0,0,1,0|3,0,0]=4 3452 B9R1.12 ClCCCc1c[nH]c[n]1 Amb24376423 [0,0,0,0,1,0|3,0,0]=4 3453 B9R1.12 ClCCCc1c[n]c[s]1 Amb24447750 [0,0,0,0,1,0|3,0,0]=4 3454 B9R1.12 ClCCCc1c[s]c[n]1 Amb25260872 [0,0,0,0,1,0|3,0,0]=4 3455 B9R1.12 ClCCCc1c[s]cc1 Amb18797934 [0,0,0,0,1,0|2,0,0]=3 3456 B9R1.12 ClCCCc1cc[nH][n]1 Amb24699023 [0,0,0,0,1,0|3,0,0]=4 3457 B9R1.12 ClCCCc1cc[n][s]1 Amb24562522 [0,0,0,0,1,0|3,0,0]=4 3458 B9R1.12 ClCCCc1ccc[nH]1 Amb24502221 [0,0,0,0,1,0|2,0,0]=3 3459 B9R1.12 ClCCCc1cccs1 Amb17104524 [0,0,0,0,1,0|2,0,0]=3 3460 B9R1.12 ClCCCc1cocc1 Amb25720433 [0,0,0,0,1,0|2,0,0]=3 3461 B9R1.12 ClCCCn1cccn1 Amb1127280 [0,0,0,0,1,0|3,0,0]=4 3462 B9R1.12 ClCCCn1cncc1 Amb1125249 [0,0,0,0,1,0|3,0,0]=4 3463 B9R1.12 ClCCOc1ccc[s]1 Amb24674144 [0,0,0,0,1,0|3,0,0]=4 3464 B9R1.12 ClCSCc1ccco1 Amb25265779 [0,0,0,0,1,0|3,0,0]=4 3465 B9R1.12 FCCC[n]1c[n]cc1 Amb25775324 [0,0,0,0,1,0|3,0,0]=4 3466 B9R1.12 FCCC[n]1ccc[n]1 Amb23449149 [0,0,0,0,1,0|3,0,0]=4 3467 B9R1.12 FCCC[n]1cccc1 Amb24659970 [0,0,0,0,1,0|2,0,0]=3 3468 B9R1.12 FCCNc1c[s]cc1 Amb24339309 [0,0,0,0,1,0|3,0,0]=4 3469 B9R1.12 ICCC[n]1c[n]cc1 Amb25844683 [0,0,0,0,1,0|3,0,0]=4 3470 B9R1.12 ICCOc1c[s]cc1 Amb24727505 [0,0,0,0,1,0|3,0,0]=4 3471 B9R1.12 N#CCCc1c[nH]cc1 Amb18221693 [0,0,0,0,1,0|2,0,1]=4 3472 B9R1.12 N#CCCc1c[s]cc1 Amb24524148 [0,0,0,0,1,0|2,0,1]=4 3473 B9R1.12 N#CCCc1ccc[nH]1 Amb24424952 [0,0,0,0,1,0|2,0,1]=4 3474 B9R1.12 N#CCCc1ccco1 Amb20623925 [0,0,0,0,1,0|2,0,1]=4 3475 B9R1.12 N#CCCc1cccs1 Amb17226709 [0,0,0,0,1,0|2,0,1]=4 3476 B9R1.12 N#CCCc1cocc1 Amb25146999 [0,0,0,0,1,0|2,0,1]=4 3477 B9R1.12 NCCCc1[nH]cc[n]1 Amb21961564 [0,0,0,0,1,0|3,0,0]=4 3478 B9R1.12 NCCCc1[n]cc[s]1 Amb19351883 [0,0,0,0,1,0|3,0,0]=4 3479 B9R1.12 NCCCc1[n]cco1 Amb18061835 [0,0,0,0,1,0|3,0,0]=4 3480 B9R1.12 NCCCc1c[nH][n]c1 Amb21955238 [0,0,0,0,1,0|3,0,0]=4 3481 B9R1.12 NCCCc1c[nH][n]c1 Amb24053252 [0,0,0,0,1,0|3,0,0]=4 3482 B9R1.12 NCCCc1c[nH]c[n]1 Amb18642332 [0,0,0,0,1,0|3,0,0]=4 3483 B9R1.12 NCCCc1c[nH]cc1 Amb18560456 [0,0,0,0,1,0|2,0,0]=3 3484 B9R1.12 NCCCc1c[nH]nc1 Amb1995198 [0,0,0,0,1,0|3,0,0]=4 3485 B9R1.12 NCCCc1c[n]c[s]1 Amb18831614 [0,0,0,0,1,0|3,0,0]=4 3486 B9R1.12 NCCCc1c[s]c[n]1 Amb18523794 [0,0,0,0,1,0|3,0,0]=4 3487 B9R1.12 NCCCc1c[s]cc1 Amb19373237 [0,0,0,0,1,0|2,0,0]=3 3488 B9R1.12 NCCCc1cc[nH][n]1 Amb18832795 [0,0,0,0,1,0|3,0,0]=4 3489 B9R1.12 NCCCc1cc[n][nH]1 Amb24117990 [0,0,0,0,1,0|3,0,0]=4 3490 B9R1.12 NCCCc1cc[n][s]1 Amb25367273 [0,0,0,0,1,0|3,0,0]=4 3491 B9R1.12 NCCCc1cc[n]o1 Amb18832760 [0,0,0,0,1,0|3,0,0]=4 3492 B9R1.12 NCCCc1cc[s][n]1 Amb18202563 [0,0,0,0,1,0|3,0,0]=4 3493 B9R1.12 NCCCc1ccc[nH]1 Amb25076791 [0,0,0,0,1,0|2,0,0]=3 3494 B9R1.12 NCCCc1ccc[s]1 Amb24094214 [0,0,0,0,1,0|2,0,0]=3 3495 B9R1.12 NCCCc1coc[n]1 Amb18832743 [0,0,0,0,1,0|3,0,0]=4 3496 B9R1.12 NCCCc1cocc1 Amb25789662 [0,0,0,0,1,0|2,0,0]=3 3497 B9R1.12 NCCCn1cccn1 Amb10549338 [0,0,0,0,1,0|3,0,0]=4 3498 B9R1.12 NCCCn1cccn1 Amb1136640 [0,0,0,0,1,0|3,0,0]=4 3499 B9R1.12 NCCNc1c[s]cc1 Amb25794987 [0,0,0,0,1,0|3,0,0]=4 3500 B9R1.12 NCCNc1ccc[s]1 Amb18299161 [0,0,0,0,1,0|3,0,0]=4 3501 B9R1.12 NNCCc1cocc1 Amb25100152 [0,0,0,0,1,0|3,0,0]=4 3502 B9R1.12 NOCCc1c[s]cc1 Amb25799465 [0,0,0,0,1,0|3,0,0]=4 3503 B9R1.12 NOCCc1ccc[nH]1 Amb25280155 [0,0,0,0,1,0|3,0,0]=4 3504 B9R1.12 NOCCc1ccc[s]1 Amb25130652 [0,0,0,0,1,0|3,0,0]=4 3505 B9R1.12 NOCCc1ccco1 Amb25208726 [0,0,0,0,1,0|3,0,0]=4 3506 B9R1.12 O=CCC[n]1cccc1 Amb24062842 [0,0,0,0,1,0|1,0,2]=4 3507 B9R1.12 O=CCCc1ccc[nH]1 Amb24760290 [0,0,0,0,1,0|1,0,2]=4 3508 B9R1.12 O=CCCc1ccco1 Amb17081672 [0,0,0,0,1,0|1,0,2]=4 3509 B9R1.12 O=CCCc1cccs1 Amb17081673 [0,0,0,0,1,0|1,0,2]=4 3510 B9R1.12 OCC#Cc1c[s]cc1 Amb24709250 [0,0,0,0,1,0|1,0,2]=4 3511 B9R1.12 OCCCC=1CC=CC1 Amb25851384 [0,0,0,0,1,0|0,0,1]=2 3512 B9R1.12 OCCCC=1CCCC1 Amb24457013 [0,0,0,0,1,0|0,0,3]=4 3513 B9R1.12 OCCCC=1COCC1 Amb25676732 [0,0,0,0,1,0|1,0,2]=4 3514 B9R1.12 OCCCN1CC=CC1 Amb25744772 [0,0,0,0,1,0|1,0,2]=4 3515 B9R1.12 OCCC[n]1[n]cc[n]1 Amb25317470 [0,0,0,0,1,0|3,0,0]=4 3516 B9R1.12 OCCCc1c[nH][n]c1 Amb22279568 [0,0,0,0,1,0|2,0,0]=3 3517 B9R1.12 OCCCc1c[nH]c[n]1 Amb19316315 [0,0,0,0,1,0|2,0,0]=3 3518 B9R1.12 OCCCc1c[nH]cc1 Amb18222128 [0,0,0,0,1,0|1,0,0]=2 3519 B9R1.12 OCCCc1c[n][n][nH]1 Amb23570465 [0,0,0,0,1,0|3,0,0]=4 3520 B9R1.12 OCCCc1c[n]c[nH]1 Amb22899104 [0,0,0,0,1,0|2,0,0]=3 3521 B9R1.12 OCCCc1c[s][n][n]1 Amb24700420 [0,0,0,0,1,0|3,0,0]=4 3522 B9R1.12 OCCCc1c[s]c[n]1 Amb24099813 [0,0,0,0,1,0|2,0,0]=3 3523 B9R1.12 OCCCc1cc[nH][n]1 Amb25132262 [0,0,0,0,1,0|2,0,0]=3 3524 B9R1.12 OCCCc1ccc[nH]1 Amb24428704 [0,0,0,0,1,0|1,0,0]=2 3525 B9R1.12 OCCCc1cccs1 Amb17089493 [0,0,0,0,1,0|1,0,0]=2 3526 B9R1.12 OCCCc1cscc1 Amb17605794 [0,0,0,0,1,0|1,0,0]=2 3527 B9R1.12 OCCCn1cccc1 Amb17593298 [0,0,0,0,1,0|1,0,0]=2 3528 B9R1.12 OCCCn1cncc1 Amb11012596 [0,0,0,0,1,0|2,0,0]=3 3529 B9R1.12 OCCN[n]1cccc1 Amb25756597 [0,0,0,0,1,0|2,0,0]=3 3530 B9R1.12 OCCNc1c[nH][n]c1 Amb24477676 [0,0,0,0,1,0|3,0,0]=4 3531 B9R1.12 OCCNc1c[nH]c[n]1 Amb24733354 [0,0,0,0,1,0|3,0,0]=4 3532 B9R1.12 OCCNc1c[nH]cc1 Amb24472507 [0,0,0,0,1,0|2,0,0]=3 3533 B9R1.12 OCCNc1ccc[nH]1 Amb24704389 [0,0,0,0,1,0|2,0,0]=3 3534 B9R1.12 OCCOc1[n]cc[s]1 Amb24069917 [0,0,0,0,1,0|3,0,0]=4 3535 B9R1.12 OCCOc1c[nH]cc1 Amb25309374 [0,0,0,0,1,0|2,0,0]=3 3536 B9R1.12 OCOC[n]1cccc1 Amb25788107 [0,0,0,0,1,0|2,0,0]=3 3537 B9R1.12 OC\C=C/c1ccc[nH]1 Amb24744418 [0,0,0,0,1,0|1,0,2]=4 3538 B9R1.12 OC\C=C\c1c[nH]cc1 Amb24454320 [0,0,0,0,1,0|1,0,2]=4 3539 B9R1.12 OC\C=C\c1c[s]cc1 Amb25315908 [0,0,0,0,1,0|1,0,2]=4 3540 B9R1.12 OC\C=C\c1ccc[nH]1 Amb25090739 [0,0,0,0,1,0|1,0,2]=4 3541 B9R1.12 OC\C=C\c1ccc[s]1 Amb23555588 [0,0,0,0,1,0|1,0,2]=4 3542 B9R1.12 OC\C=C\c1cocc1 Amb25177010 [0,0,0,0,1,0|1,0,2]=4 3543 B9R1.12 ONCCc1c[n]c[nH]1 Amb25178668 [0,0,0,0,1,0|3,0,0]=4 3544 B9R1.12 SCCC[n]1c[n]cc1 Amb20624011 [0,0,0,0,1,0|2,1,0]=4 3545 B9R1.12 SCCCc1c[s]cc1 Amb25180709 [0,0,0,0,1,0|1,1,0]=3 3546 B9R1.12 SCCCc1ccc[nH]1 Amb24722505 [0,0,0,0,1,0|1,1,0]=3 3547 B9R1.12 SCCCc1ccco1 Amb17399874 [0,0,0,0,1,0|1,1,0]=3 3548 B9R1.12 SCCCc1cccs1 Amb17400036 [0,0,0,0,1,0|1,1,0]=3 3549 B9R1.12 SCCSc1ccc[s]1 Amb25031295 [0,0,0,0,1,0|2,1,0]=4 3550 B9R1.12 [C-]#[N+]CCc1ccco1 Amb24743086 [0,0,0,0,1,0|3,0,0]=4 3551 B11R1.203 ClCCCC=1C=CCCCC1 Amb24509106 [0,0,0,0,0,1|1,0,2]=4 3552 B11R1.203 NCCCC1=CNC=CC=C1 Amb25114442 [0,0,0,0,0,1|1,0,0]=2 3553 B11R1.203 OCCCC1CCC=CC=C1 Amb25058570 [0,0,0,0,0,1|0,0,2]=3 3554 B11R1.203 OCCOC=1C=CNC=CC1 Amb24069979 [0,0,0,0,0,1|1,0,0]=2 3555 B8R0.1 C=CCC(=O)CCCO Amb24633875 [1,0,1,0,0,0|1,0,1]=4 3556 B8R0.1 CC(CCO)\C=C\C=C Amb24404810 [1,0,1,0,0,0|0,0,2]=4 3557 B8R0.1 CCCC(=C)\C=C\CN Amb24612251 [1,0,1,0,0,0|1,0,1]=4 3558 B8R0.1 CCCC(=O)\C=C\C=C Amb25233730 [1,0,1,0,0,0|1,0,0]=3 3559 B8R0.1 CCCC(=O)\C=C\C=O Amb24741850 [1,0,1,0,0,0|2,0,0]=4 3560 B8R0.1 CCCCC(=C)\C=C/Br Amb24480295 [1,0,1,0,0,0|2,0,0]=4 3561 B8R0.1 CCCCC(=C)\C=C\Br Amb24540792 [1,0,1,0,0,0|2,0,0]=4 3562 B8R0.1 CCC\C(\Br)=C\CC=C Amb24572866 [1,0,1,0,0,0|1,0,1]=4 3563 B8R0.1 CCOC(=O)\C=C\C=C Amb10552844 [1,0,1,0,0,0|2,0,0]=4 3564 B8R0.1 COCC(=O)\C=C\C=C Amb25272934 [1,0,1,0,0,0|2,0,0]=4 3565 B8R0.1 C\C(\CCCO)=C\C=C Amb24718346 [1,0,1,0,0,0|0,0,1]=3 3566 B8R0.1 C\C(\CCO)=C/C=C/Br Amb25162309 [1,0,1,0,0,0|1,0,1]=4 3567 B8R0.1 C\C(\CCO)=C\C=CCl Amb24635144 [1,0,1,0,0,0|1,0,1]=4 3568 B8R0.1 OCCC(=O)\C=C\C=O Amb24668888 [1,0,1,0,0,0|2,0,0]=4 3569 B8R0.4 C=CC\C=C\CCCBr Amb25241221 [1,0,1,0,0,0|1,0,1]=4 3570 B8R0.4 C=CC\C=C\CCCCl Amb24584660 [1,0,1,0,0,0|1,0,1]=4 3571 B8R0.4 C=CC\C=C\CCCO Amb25845279 [1,0,1,0,0,0|0,0,1]=3 3572 B8R0.4 C=C\C=C\C#CCCO Amb25788123 [1,0,1,0,0,0|0,0,2]=4 3573 B8R0.4 C=C\C=C\CCCCBr Amb24693997 [1,0,1,0,0,0|1,0,1]=4 3574 B8R0.4 C=C\C=C\CCCCCl Amb25107305 [1,0,1,0,0,0|1,0,1]=4 3575 B8R0.4 C=C\C=C\CCCCN Amb18642357 [1,0,1,0,0,0|1,0,1]=4 3576 B8R0.4 C=C\C=C\OCCCO Amb25332487 [1,0,1,0,0,0|1,0,0]=3 3577 B8R0.4 CC=CC=CC=CCO Amb25741427 [1,0,1,0,0,0|0,0,2]=4 3578 B8R0.4 CC=CC=CCCCC Amb22228349 [1,0,1,0,0,0|0,0,2]=4 3579 B8R0.4 CC=C\C=C\CCCC Amb24558323 [1,0,1,0,0,0|0,0,2]=4 3580 B8R0.4 CCCCC\C=C\C=C Amb22641683 [1,0,1,0,0,0|0,0,2]=4 3581 B8R0.4 CCCC\C=C\C=C/Br Amb24480294 [1,0,1,0,0,0|1,0,1]=4 3582 B8R0.4 CCCC\C=C\C=CBr Amb24580369 [1,0,1,0,0,0|1,0,1]=4 3583 B8R0.4 CCCC\C=C\C=C\Cl Amb24479953 [1,0,1,0,0,0|1,0,1]=4 3584 B8R0.4 CCC\C=C\C=C/CN Amb10560986 [1,0,1,0,0,0|1,0,1]=4 3585 B8R0.4 CCC\C=C\C=CCBr Amb24739824 [1,0,1,0,0,0|1,0,1]=4 3586 B8R0.4 CCC\C=C\C=CCCl Amb24529177 [1,0,1,0,0,0|1,0,1]=4 3587 B8R0.4 CCC\C=C\C=CCO Amb24539762 [1,0,1,0,0,0|1,0,1]=4 3588 B8R0.4 CCC\C=C\C=C\C=C Amb22641675 [1,0,1,0,0,0|0,0,0]=2 3589 B8R0.4 CCC\C=C\C=C\CO Amb22053869 [1,0,1,0,0,0|1,0,1]=4 3590 B8R0.4 CCO\C=C\C=CC=O Amb24587787 [1,0,1,0,0,0|2,0,0]=4 3591 B8R0.4 CCO\C=C\C=C\C=O Amb25054124 [1,0,1,0,0,0|2,0,0]=4 3592 B8R0.4 CC\C=C\C=CCCO Amb24576345 [1,0,1,0,0,0|0,0,2]=4 3593 B8R0.4 C\C=C\C=CCCCBr Amb24697800 [1,0,1,0,0,0|1,0,1]=4 3594 B8R0.4 C\C=C\C=CCCCN Amb25261065 [1,0,1,0,0,0|1,0,1]=4 3595 B8R0.4 C\C=C\C=C\CCCC Amb24477896 [1,0,1,0,0,0|0,0,2]=4 3596 B8R0.4 C\C=C\C=C\CCCO Amb17593323 [1,0,1,0,0,0|0,0,1]=3 3597 B8R0.4 OCC=CC=CC=CBr Amb24565670 [1,0,1,0,0,0|1,0,1]=4 3598 B8R0.4 OCC=C\C=C\CCO Amb25106338 [1,0,1,0,0,0|1,0,1]=4 3599 B8R0.4 OC\C=C\C=C\C=C\Br Amb25092806 [1,0,1,0,0,0|1,0,1]=4 3600 B8R0.11 C=CC(=CCCN)C=C Amb25368455 [1,0,1,0,0,0|1,0,1]=4 3601 B8R0.11 C\C=C(/CCCO)\C=O Amb18642662 [1,0,1,0,0,0|1,0,1]=4 3602 B8R0.11 N\C=C(\CCCO)/C=O Amb25307863 [1,0,1,0,0,0|2,0,0]=4 3603 B8R0.22 C=CC\C(\CCO)=C/Br Amb24480219 [1,0,1,0,0,0|1,0,1]=4 3604 B8R0.22 CC=C(CCO)\C=C\C Amb24354337 [1,0,1,0,0,0|0,0,2]=4 3605 B8R0.22 CCCC(C=O)=CC=O Amb25238475 [1,0,1,0,0,0|2,0,0]=4 3606 B8R0.22 CCC\C(\C=O)=C/C=O Amb25240095 [1,0,1,0,0,0|2,0,0]=4 3607 B8R0.22 C\C=C(/CC=C)\CCO Amb25098644 [1,0,1,0,0,0|0,0,2]=4 3608 B8R1.2 BrC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367404 [2,0,0,0,0,0|1,0,0]=3 3609 B8R1.2 BrC[13c]1ccccc1 Amb22367396 [2,0,0,0,0,0|1,0,0]=3 3610 B8R1.2 BrCc1cc[n]cc1 Amb22753071 [2,0,0,0,0,0|2,0,0]=4 3611 B8R1.2 BrCc1cccc[n]1 Amb22751621 [2,0,0,0,0,0|2,0,0]=4 3612 B8R1.2 Br[13CH2]c1ccccc1 Amb22366910 [2,0,0,0,0,0|1,0,0]=3 3613 B8R1.2 Br[Hg]c1ccccc1 Amb22369231 [2,0,0,0,0,0|2,0,0]=4 3614 B8R1.2 C#[13C]c1ccccc1 Amb22367126 [2,0,0,0,0,0|0,0,2]=4 3615 B8R1.2 C=Cc1ccccc1 Amb22337033 [2,0,0,0,0,0|0,0,2]=4 3616 B8R1.2 C=Cc1ccccc1 Amb22337871 [2,0,0,0,0,0|0,0,2]=4 3617 B8R1.2 C=Cc1ccccc1 Amb22337937 [2,0,0,0,0,0|0,0,2]=4 3618 B8R1.2 C=Cc1ccccc1 Amb22338204 [2,0,0,0,0,0|0,0,2]=4 3619 B8R1.2 C=Cc1ccccc1 Amb22338475 [2,0,0,0,0,0|0,0,2]=4 3620 B8R1.2 C=Cc1ccccc1 Amb22351316 [2,0,0,0,0,0|0,0,2]=4 3621 B8R1.2 C=Cc1ccccc1 Amb22731028 [2,0,0,0,0,0|0,0,2]=4 3622 B8R1.2 C=Cc1ccccc1 Amb22733123 [2,0,0,0,0,0|0,0,2]=4 3623 B8R1.2 C=Nc1ccccc1 Amb24605672 [2,0,0,0,0,0|1,0,1]=4 3624 B8R1.2 CCC1=CCC=CN1 Amb24524490 [2,0,0,0,0,0|1,0,1]=4 3625 B8R1.2 CCC=1CC=CCC1 Amb22227940 [2,0,0,0,0,0|0,0,2]=4 3626 B8R1.2 CC[n+]1ccccc1 Amb22739693 [2,0,0,0,0,0|1,0,0]=3 3627 B8R1.2 CCc1[n]ccc[n]1 Amb24095641 [2,0,0,0,0,0|2,0,0]=4 3628 B8R1.2 CCc1c[n]c[n]c1 Amb24097063 [2,0,0,0,0,0|2,0,0]=4 3629 B8R1.2 CCc1c[n]cc[n]1 Amb20620291 [2,0,0,0,0,0|2,0,0]=4 3630 B8R1.2 CCc1cc[n]c[n]1 Amb20242304 [2,0,0,0,0,0|2,0,0]=4 3631 B8R1.2 CCc1ccccc1 Amb22336270 [2,0,0,0,0,0|0,0,0]=2 3632 B8R1.2 CCc1ccccc1 Amb22366965 [2,0,0,0,0,0|0,0,0]=2 3633 B8R1.2 CCc1ccccc1 Amb2447474 [2,0,0,0,0,0|0,0,0]=2 3634 B8R1.2 CO[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17608460 [2,0,0,0,0,0|1,0,0]=3 3635 B8R1.2 CO[13c]1ccccc1 Amb22362658 [2,0,0,0,0,0|1,0,0]=3 3636 B8R1.2 CO[n+]1ccccc1 Amb10552605 [2,0,0,0,0,0|2,0,0]=4 3637 B8R1.2 COc1cc[n]cc1 Amb24079672 [2,0,0,0,0,0|2,0,0]=4 3638 B8R1.2 COc1cccnc1 Amb10573360 [2,0,0,0,0,0|2,0,0]=4 3639 B8R1.2 CPc1ccccc1 Amb25341327 [2,0,0,0,0,0|1,0,0]=3 3640 B8R1.2 CSc1c[n]ccc1 Amb24087396 [2,0,0,0,0,0|2,0,0]=4 3641 B8R1.2 CSc1cc[n]cc1 Amb24103013 [2,0,0,0,0,0|2,0,0]=4 3642 B8R1.2 CSc1cccc[n]1 Amb24081200 [2,0,0,0,0,0|2,0,0]=4 3643 B8R1.2 C[13CH2]c1ccccc1 Amb22362696 [2,0,0,0,0,0|0,0,0]=2 3644 B8R1.2 C[SiH2]c1ccccc1 Amb19893954 [2,0,0,0,0,0|0,1,0]=3 3645 B8R1.2 ClC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367253 [2,0,0,0,0,0|1,0,0]=3 3646 B8R1.2 ClCc1cccc[n]1 Amb22489454 [2,0,0,0,0,0|2,0,0]=4 3647 B8R1.2 ClCc1ccccc1 Amb22363332 [2,0,0,0,0,0|1,0,0]=3 3648 B8R1.2 ClCc1ccncc1 Amb1933717 [2,0,0,0,0,0|2,0,0]=4 3649 B8R1.2 ClSc1ccccc1 Amb10575597 [2,0,0,0,0,0|2,0,0]=4 3650 B8R1.2 Cl[13CH2]c1ccccc1 Amb22351323 [2,0,0,0,0,0|1,0,0]=3 3651 B8R1.2 Cl[SiH2]c1ccccc1 Amb22351128 [2,0,0,0,0,0|1,1,0]=4 3652 B8R1.2 FCc1c[n]ccc1 Amb25259171 [2,0,0,0,0,0|2,0,0]=4 3653 B8R1.2 FCc1cc[n]cc1 Amb22372287 [2,0,0,0,0,0|2,0,0]=4 3654 B8R1.2 FCc1cccc[n]1 Amb24093657 [2,0,0,0,0,0|2,0,0]=4 3655 B8R1.2 FCc1ccccc1 Amb10838335 [2,0,0,0,0,0|1,0,0]=3 3656 B8R1.2 FSc1ccccc1 Amb25198589 [2,0,0,0,0,0|2,0,0]=4 3657 B8R1.2 ICc1cc[n]cc1 Amb22489735 [2,0,0,0,0,0|2,0,0]=4 3658 B8R1.2 ICc1cc[n]cc1 Amb22748952 [2,0,0,0,0,0|2,0,0]=4 3659 B8R1.2 ICc1cccnc1 Amb10602162 [2,0,0,0,0,0|2,0,0]=4 3660 B8R1.2 I[Hg]c1ccccc1 Amb22347346 [2,0,0,0,0,0|2,0,0]=4 3661 B8R1.2 I[Mg]c1ccccc1 Amb22730124 [2,0,0,0,0,0|2,0,0]=4 3662 B8R1.2 I[Se]c1ccccc1 Amb10601593 [2,0,0,0,0,0|2,0,0]=4 3663 B8R1.2 N#Cc1ccccc1 Amb21864642 [2,0,0,0,0,0|1,0,1]=4 3664 B8R1.2 N#Cc1ccccc1 Amb22167299 [2,0,0,0,0,0|1,0,1]=4 3665 B8R1.2 N#[N+]c1ccccc1 Amb10564805 [2,0,0,0,0,0|2,0,0]=4 3666 B8R1.2 NC[n+]1ccccc1 Amb24716810 [2,0,0,0,0,0|2,0,0]=4 3667 B8R1.2 NCc1cc[n]cc1 Amb20620293 [2,0,0,0,0,0|2,0,0]=4 3668 B8R1.2 NCc1cc[n]cc1 Amb20622010 [2,0,0,0,0,0|2,0,0]=4 3669 B8R1.2 NCc1cccc[n]1 Amb20620292 [2,0,0,0,0,0|2,0,0]=4 3670 B8R1.2 NCc1cccc[n]1 Amb22274458 [2,0,0,0,0,0|2,0,0]=4 3671 B8R1.2 NCc1ccccc1 Amb19958612 [2,0,0,0,0,0|1,0,0]=3 3672 B8R1.2 NCc1ccccc1 Amb22052549 [2,0,0,0,0,0|1,0,0]=3 3673 B8R1.2 NCc1ccccc1 Amb23459863 [2,0,0,0,0,0|1,0,0]=3 3674 B8R1.2 NCc1ccccc1 Amb24325406 [2,0,0,0,0,0|1,0,0]=3 3675 B8R1.2 NCc1cccnc1 Amb1481403 [2,0,0,0,0,0|2,0,0]=4 3676 B8R1.2 NCc1cccnc1 Amb2189172 [2,0,0,0,0,0|2,0,0]=4 3677 B8R1.2 NCc1ccncc1 Amb1156526 [2,0,0,0,0,0|2,0,0]=4 3678 B8R1.2 NNc1ccccc1 Amb22002446 [2,0,0,0,0,0|2,0,0]=4 3679 B8R1.2 NNc1ccccc1 Amb22166856 [2,0,0,0,0,0|2,0,0]=4 3680 B8R1.2 NNc1ccccc1 Amb22731573 [2,0,0,0,0,0|2,0,0]=4 3681 B8R1.2 NOc1ccccc1 Amb18123833 [2,0,0,0,0,0|2,0,0]=4 3682 B8R1.2 NOc1ccccc1 Amb22231364 [2,0,0,0,0,0|2,0,0]=4 3683 B8R1.2 O=Bc1ccccc1 Amb25221658 [2,0,0,0,0,0|1,0,1]=4 3684 B8R1.2 O=C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367549 [2,0,0,0,0,0|0,0,2]=4 3685 B8R1.2 O=[13CH]c1ccccc1 Amb22349200 [2,0,0,0,0,0|0,0,2]=4 3686 B8R1.2 O=[I]c1ccccc1 Amb15692855 [2,0,0,0,0,0|1,0,1]=4 3687 B8R1.2 OCC1=CCNC=C1 Amb25662609 [2,0,0,0,0,0|1,0,1]=4 3688 B8R1.2 OCN1C=CNC=C1 Amb17938355 [2,0,0,0,0,0|2,0,0]=4 3689 B8R1.2 OC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367395 [2,0,0,0,0,0|0,0,0]=2 3690 B8R1.2 OCc1c[n][n]cc1 Amb21856410 [2,0,0,0,0,0|2,0,0]=4 3691 B8R1.2 OCc1c[n]ccc1 Amb20622013 [2,0,0,0,0,0|1,0,0]=3 3692 B8R1.2 OCc1c[n]ccc1 Amb22434305 [2,0,0,0,0,0|1,0,0]=3 3693 B8R1.2 OCc1cc[n]cc1 Amb24183964 [2,0,0,0,0,0|1,0,0]=3 3694 B8R1.2 OCc1ccccn1 Amb16231923 [2,0,0,0,0,0|1,0,0]=3 3695 B8R1.2 OCc1ccncc1 Amb16231990 [2,0,0,0,0,0|1,0,0]=3 3696 B8R1.2 ONc1cccc[n]1 Amb25057797 [2,0,0,0,0,0|2,0,0]=4 3697 B8R1.2 ONc1ccccc1 Amb17672282 [2,0,0,0,0,0|1,0,0]=3 3698 B8R1.2 ONc1ccccc1 Amb22445293 [2,0,0,0,0,0|1,0,0]=3 3699 B8R1.2 OSc1cccc[n]1 Amb24061294 [2,0,0,0,0,0|2,0,0]=4 3700 B8R1.2 OSc1ccccc1 Amb25200260 [2,0,0,0,0,0|1,0,0]=3 3701 B8R1.2 O[13CH2]c1ccccc1 Amb22363258 [2,0,0,0,0,0|0,0,0]=2 3702 B8R1.2 O[14CH2]c1ccccc1 Amb22733558 [2,0,0,0,0,0|0,0,0]=2 3703 B8R1.2 O[Hg]c1ccccc1 Amb17940723 [2,0,0,0,0,0|1,0,0]=3 3704 B8R1.2 SCc1c[n]ccc1 Amb21984718 [2,0,0,0,0,0|1,1,0]=4 3705 B8R1.2 SCc1cc[n]cc1 Amb22008603 [2,0,0,0,0,0|1,1,0]=4 3706 B8R1.2 SCc1cccc[n]1 Amb20622005 [2,0,0,0,0,0|1,1,0]=4 3707 B8R1.2 [13CH3]Cc1ccccc1 Amb22353602 [2,0,0,0,0,0|0,0,0]=2 3708 B8R1.2 [15NH2]Cc1ccccc1 Amb22351500 [2,0,0,0,0,0|1,0,0]=3 3709 B8R1.2 [C-]#Cc1ccccc1 Amb22731283 [2,0,0,0,0,0|0,0,2]=4 3710 B8R1.2 [C-]#Cc1ccccc1 Amb22731714 [2,0,0,0,0,0|0,0,2]=4 3711 B8R1.2 [C-]#Cc1ccccc1 Amb22733589 [2,0,0,0,0,0|0,0,2]=4 3712 B8R1.2 [C-]#[N+]c1ccccc1 Amb1107613 [2,0,0,0,0,0|1,0,1]=4 3713 B8R1.2 [Li]Sc1ccccc1 Amb17939763 [2,0,0,0,0,0|2,0,0]=4 3714 B8R1.2 [Mg+]Cc1ccccc1 Amb22043988 [2,0,0,0,0,0|1,0,0]=3 3715 B8R1.2 [NH3+]Cc1ccccc1 Amb10555897 [2,0,0,0,0,0|1,0,0]=3 3716 B8R1.2 [NH3+]Oc1ccccc1 Amb10552602 [2,0,0,0,0,0|2,0,0]=4 3717 B8R1.2 [Na]Sc1ccccc1 Amb22353443 [2,0,0,0,0,0|2,0,0]=4 3718 B8R1.2 [O-]Cc1ccccc1 Amb22367041 [2,0,0,0,0,0|0,0,1]=3 3719 B8R1.2 [SiH3]Cc1ccccc1 Amb22347052 [2,0,0,0,0,0|0,1,0]=3 3720 B8R1.2 [Tl]Sc1ccccc1 Amb22366489 [2,0,0,0,0,0|2,0,0]=4 3721 B10R0.71 CCCCCC=CC=CC=O Amb24056155 [0,1,1,0,0,0|1,0,1]=4 3722 B10R0.71 CCCCC\C=C/C=CC=C Amb22336558 [0,1,1,0,0,0|1,0,0]=3 3723 B10R0.71 CCCCC\C=C\C=C/C=C Amb22546765 [0,1,1,0,0,0|1,0,0]=3 3724 B10R0.71 CCCCC\C=C\C=C\C=C Amb22730166 [0,1,1,0,0,0|1,0,0]=3 3725 B10R1.1 BrCC[n+]1ccc(cc1)C Amb2228343 [1,1,0,0,0,0|2,0,0]=4 3726 B10R1.1 BrCCc1ccc(I)cc1 Amb25266376 [1,1,0,0,0,0|1,0,0]=3 3727 B10R1.1 BrCCc1ccc(cc1)N Amb17595296 [1,1,0,0,0,0|1,0,0]=3 3728 B10R1.1 Br[Zn]Cc1ccc(I)cc1 Amb22000470 [1,1,0,0,0,0|2,0,0]=4 3729 B10R1.1 Brc1ccc(CCBr)[n]c1 Amb25187280 [1,1,0,0,0,0|2,0,0]=4 3730 B10R1.1 Brc1ccc(CCI)cc1 Amb22002540 [1,1,0,0,0,0|1,0,0]=3 3731 B10R1.1 Brc1ccc(C[Mg]Br)cc1 Amb22000536 [1,1,0,0,0,0|2,0,0]=4 3732 B10R1.1 Brc1ccc(C[Zn]Br)cc1 Amb22000432 [1,1,0,0,0,0|2,0,0]=4 3733 B10R1.1 C#CCc1ccc(F)cc1 Amb25679386 [1,1,0,0,0,0|0,0,2]=4 3734 B10R1.1 C=CCc1ccc(O)cc1 Amb18124422 [1,1,0,0,0,0|0,0,2]=4 3735 B10R1.1 CC#Cc1ccc(Br)cc1 Amb24524445 [1,1,0,0,0,0|0,0,2]=4 3736 B10R1.1 CC#Cc1ccc(N)cc1 Amb24102696 [1,1,0,0,0,0|0,0,2]=4 3737 B10R1.1 CC#Cc1ccc(O)cc1 Amb24102701 [1,1,0,0,0,0|0,0,2]=4 3738 B10R1.1 CCCC=1C=CC(=O)NN1 Amb25692630 [1,1,0,0,0,0|2,0,0]=4 3739 B10R1.1 CCCN1C=CC(=N)C=C1 Amb19805039 [1,1,0,0,0,0|1,0,0]=3 3740 B10R1.1 CCCN1C=CC(=N)C=C1 Amb21922068 [1,1,0,0,0,0|1,0,0]=3 3741 B10R1.1 CCCN1C=CC(=[NH2+])C=C1 Amb22553587 [1,1,0,0,0,0|1,0,0]=3 3742 B10R1.1 CCC[n+]1ccc(C)cc1 Amb22346436 [1,1,0,0,0,0|1,0,0]=3 3743 B10R1.1 CCC[n+]1ccc(N)cc1 Amb25292318 [1,1,0,0,0,0|1,0,0]=3 3744 B10R1.1 CCCc1c[n]c(Br)[n]c1 Amb20617951 [1,1,0,0,0,0|2,0,0]=4 3745 B10R1.1 CCCc1c[n]c(N)[n]c1 Amb20617938 [1,1,0,0,0,0|2,0,0]=4 3746 B10R1.1 CCCc1c[n]c(O)[n]c1 Amb18643254 [1,1,0,0,0,0|2,0,0]=4 3747 B10R1.1 CCCc1ccc(Br)c[n]1 Amb24321438 [1,1,0,0,0,0|1,0,0]=3 3748 B10R1.1 CCCc1ccc(Cl)[n][n]1 Amb24099956 [1,1,0,0,0,0|2,0,0]=4 3749 B10R1.1 CCCc1ccc(cc1)F Amb10845722 [1,1,0,0,0,0|0,0,0]=2 3750 B10R1.1 CCCc1ccc(cn1)N Amb10600808 [1,1,0,0,0,0|1,0,0]=3 3751 B10R1.1 CCCc1ccc(cn1)O Amb10553035 [1,1,0,0,0,0|1,0,0]=3 3752 B10R1.1 CCCc1ccc(nc1)Br Amb10600786 [1,1,0,0,0,0|1,0,0]=3 3753 B10R1.1 CCCc1ccc(nc1)N Amb10600788 [1,1,0,0,0,0|1,0,0]=3 3754 B10R1.1 CCCc1ccc(nc1)O Amb10600789 [1,1,0,0,0,0|1,0,0]=3 3755 B10R1.1 CCCc1ccc(nn1)Br Amb10599697 [1,1,0,0,0,0|2,0,0]=4 3756 B10R1.1 CCCc1ccc(nn1)N Amb10599699 [1,1,0,0,0,0|2,0,0]=4 3757 B10R1.1 CCCc1cnc(cn1)Br Amb10599465 [1,1,0,0,0,0|2,0,0]=4 3758 B10R1.1 CCCc1cnc(cn1)N Amb10599467 [1,1,0,0,0,0|2,0,0]=4 3759 B10R1.1 CCCc1cnc(cn1)O Amb10599468 [1,1,0,0,0,0|2,0,0]=4 3760 B10R1.1 CCCc1cnc(nc1)S Amb16232234 [1,1,0,0,0,0|2,0,0]=4 3761 B10R1.1 CCCc1ncc(cn1)Br Amb13884676 [1,1,0,0,0,0|2,0,0]=4 3762 B10R1.1 CCCc1ncc(cn1)O Amb13884797 [1,1,0,0,0,0|2,0,0]=4 3763 B10R1.1 CCNC=1C=CC(=O)NC1 Amb24472745 [1,1,0,0,0,0|2,0,0]=4 3764 B10R1.1 CCNc1ccc(Br)cc1 Amb19959109 [1,1,0,0,0,0|1,0,0]=3 3765 B10R1.1 CCNc1ccc(Cl)[n]c1 Amb24672881 [1,1,0,0,0,0|2,0,0]=4 3766 B10R1.1 CCNc1ccc(F)[n]c1 Amb25073571 [1,1,0,0,0,0|2,0,0]=4 3767 B10R1.1 CCNc1ccc(F)c[n]1 Amb18281102 [1,1,0,0,0,0|2,0,0]=4 3768 B10R1.1 CCNc1ccc(I)c[n]1 Amb24636305 [1,1,0,0,0,0|2,0,0]=4 3769 B10R1.1 CCNc1ccc(N)c[n]1 Amb22295808 [1,1,0,0,0,0|2,0,0]=4 3770 B10R1.1 CCNc1ccc(N)c[n]1 Amb22737072 [1,1,0,0,0,0|2,0,0]=4 3771 B10R1.1 CCNc1ccc(cc1)F Amb1214999 [1,1,0,0,0,0|1,0,0]=3 3772 B10R1.1 CCNc1ccc(cn1)N Amb1117844 [1,1,0,0,0,0|2,0,0]=4 3773 B10R1.1 CCOc1cc[n+](cc1)C Amb10553055 [1,1,0,0,0,0|2,0,0]=4 3774 B10R1.1 CCOc1cc[n+](cc1)[O-] Amb10552815 [1,1,0,0,0,0|2,0,0]=4 3775 B10R1.1 CCOc1ccc(F)c[n]1 Amb21857676 [1,1,0,0,0,0|2,0,0]=4 3776 B10R1.1 CCOc1ccc(I)[n]c1 Amb24690931 [1,1,0,0,0,0|2,0,0]=4 3777 B10R1.1 CCOc1ccc(O)c[n]1 Amb18643366 [1,1,0,0,0,0|2,0,0]=4 3778 B10R1.1 CCOc1ccc(S)c[n]1 Amb24062572 [1,1,0,0,0,0|2,0,0]=4 3779 B10R1.1 CCOc1ccc(cc1)N Amb1235495 [1,1,0,0,0,0|1,0,0]=3 3780 B10R1.1 CCOc1ccc(cc1)O Amb1808385 [1,1,0,0,0,0|1,0,0]=3 3781 B10R1.1 CCOc1ccc(cn1)I Amb10844711 [1,1,0,0,0,0|2,0,0]=4 3782 B10R1.1 CCOc1ccc(cn1)N Amb1132257 [1,1,0,0,0,0|2,0,0]=4 3783 B10R1.1 CCOc1ccc(nc1)Br Amb10070294 [1,1,0,0,0,0|2,0,0]=4 3784 B10R1.1 CCOc1ccc(nc1)Cl Amb15691050 [1,1,0,0,0,0|2,0,0]=4 3785 B10R1.1 CCSC=1C=CC(=O)NC1 Amb25232467 [1,1,0,0,0,0|2,0,0]=4 3786 B10R1.1 CCSc1cc[n+](C)cc1 Amb24553014 [1,1,0,0,0,0|2,0,0]=4 3787 B10R1.1 CCSc1ccc(Br)c[n]1 Amb20628984 [1,1,0,0,0,0|2,0,0]=4 3788 B10R1.1 CCSc1ccc(F)cc1 Amb24621814 [1,1,0,0,0,0|1,0,0]=3 3789 B10R1.1 CCSc1ccc(cc1)N Amb13949222 [1,1,0,0,0,0|1,0,0]=3 3790 B10R1.1 CCSc1ccc(cc1)N Amb2099645 [1,1,0,0,0,0|1,0,0]=3 3791 B10R1.1 CCSc1ccc(cc1)O Amb17202382 [1,1,0,0,0,0|1,0,0]=3 3792 B10R1.1 CNC=C1C=CC(=O)C=C1 Amb24459841 [1,1,0,0,0,0|1,0,1]=4 3793 B10R1.1 CNCc1ccc(Br)[n]c1 Amb21861666 [1,1,0,0,0,0|2,0,0]=4 3794 B10R1.1 CNCc1ccc(Br)[n]c1 Amb22271476 [1,1,0,0,0,0|2,0,0]=4 3795 B10R1.1 CNCc1ccc(Br)cc1 Amb17739893 [1,1,0,0,0,0|1,0,0]=3 3796 B10R1.1 CNCc1ccc(Cl)[n]c1 Amb19893050 [1,1,0,0,0,0|2,0,0]=4 3797 B10R1.1 CNCc1ccc(Cl)[n]c1 Amb22293911 [1,1,0,0,0,0|2,0,0]=4 3798 B10R1.1 CNCc1ccc(Cl)c[n]1 Amb22500681 [1,1,0,0,0,0|2,0,0]=4 3799 B10R1.1 CNCc1ccc(Cl)cc1 Amb17935917 [1,1,0,0,0,0|1,0,0]=3 3800 B10R1.1 CNCc1ccc(F)[n]c1 Amb24062505 [1,1,0,0,0,0|2,0,0]=4 3801 B10R1.1 CNCc1ccc(F)c[n]1 Amb25294948 [1,1,0,0,0,0|2,0,0]=4 3802 B10R1.1 CNCc1ccc(I)[n]c1 Amb23446986 [1,1,0,0,0,0|2,0,0]=4 3803 B10R1.1 CNCc1ccc(I)cc1 Amb23569028 [1,1,0,0,0,0|1,0,0]=3 3804 B10R1.1 CNCc1ccc(N)[n]c1 Amb23446332 [1,1,0,0,0,0|2,0,0]=4 3805 B10R1.1 CNCc1ccc(O)[n]c1 Amb23446663 [1,1,0,0,0,0|2,0,0]=4 3806 B10R1.1 CNCc1ccc(S)[n]c1 Amb23446730 [1,1,0,0,0,0|2,0,0]=4 3807 B10R1.1 CNCc1ccc(cc1)Br Amb1209641 [1,1,0,0,0,0|1,0,0]=3 3808 B10R1.1 CNCc1ccc(cc1)C Amb1241142 [1,1,0,0,0,0|1,0,0]=3 3809 B10R1.1 CNCc1ccc(cc1)Cl Amb1648458 [1,1,0,0,0,0|1,0,0]=3 3810 B10R1.1 CNCc1ccc(cc1)F Amb1105922 [1,1,0,0,0,0|1,0,0]=3 3811 B10R1.1 CNCc1ccc(cc1)O Amb1116278 [1,1,0,0,0,0|1,0,0]=3 3812 B10R1.1 COCN1C=CC(=O)C=C1 Amb24659071 [1,1,0,0,0,0|2,0,0]=4 3813 B10R1.1 COCc1cc[n+](C)cc1 Amb25189318 [1,1,0,0,0,0|2,0,0]=4 3814 B10R1.1 COCc1ccc(Br)[n]c1 Amb20618626 [1,1,0,0,0,0|2,0,0]=4 3815 B10R1.1 COCc1ccc(Br)c[n]1 Amb24320752 [1,1,0,0,0,0|2,0,0]=4 3816 B10R1.1 COCc1ccc(Br)cc1 Amb18320178 [1,1,0,0,0,0|1,0,0]=3 3817 B10R1.1 COCc1ccc(Cl)cc1 Amb22497336 [1,1,0,0,0,0|1,0,0]=3 3818 B10R1.1 COCc1ccc(F)cc1 Amb24064703 [1,1,0,0,0,0|1,0,0]=3 3819 B10R1.1 COCc1ccc(I)cc1 Amb22234050 [1,1,0,0,0,0|1,0,0]=3 3820 B10R1.1 COCc1ccc(N)[n]c1 Amb18281954 [1,1,0,0,0,0|2,0,0]=4 3821 B10R1.1 COCc1ccc(O)c[n]1 Amb24664312 [1,1,0,0,0,0|2,0,0]=4 3822 B10R1.1 COCc1ccc(S)cc1 Amb19149369 [1,1,0,0,0,0|1,0,0]=3 3823 B10R1.1 COCc1ccc(cc1)N Amb1137167 [1,1,0,0,0,0|1,0,0]=3 3824 B10R1.1 CONc1ccc(N)cc1 Amb25823742 [1,1,0,0,0,0|2,0,0]=4 3825 B10R1.1 CSCc1ccc(Br)cc1 Amb19373540 [1,1,0,0,0,0|1,0,0]=3 3826 B10R1.1 CSCc1ccc(I)cc1 Amb25799869 [1,1,0,0,0,0|1,0,0]=3 3827 B10R1.1 CSCc1ccc(N)[n]c1 Amb18284372 [1,1,0,0,0,0|2,0,0]=4 3828 B10R1.1 CSCc1ccc(N)cc1 Amb18544980 [1,1,0,0,0,0|1,0,0]=3 3829 B10R1.1 CSCc1ccc(O)cc1 Amb18644673 [1,1,0,0,0,0|1,0,0]=3 3830 B10R1.1 CSCc1ccc(cc1)C Amb16185125 [1,1,0,0,0,0|1,0,0]=3 3831 B10R1.1 CSCc1ccc(nc1)Cl Amb15701444 [1,1,0,0,0,0|2,0,0]=4 3832 B10R1.1 CSSc1ccc(N)cc1 Amb25264019 [1,1,0,0,0,0|2,0,0]=4 3833 B10R1.1 C\C=C\c1ccc(Br)cc1 Amb25698766 [1,1,0,0,0,0|0,0,2]=4 3834 B10R1.1 C\C=C\c1ccc(O)cc1 Amb18124423 [1,1,0,0,0,0|0,0,2]=4 3835 B10R1.1 C\N=C\c1ccc(O)cc1 Amb25179792 [1,1,0,0,0,0|1,0,1]=4 3836 B10R1.1 Cc1[n]cc(CCC)c[n]1 Amb24084805 [1,1,0,0,0,0|2,0,0]=4 3837 B10R1.1 Cc1c[n]c(CCO)c[n]1 Amb25077347 [1,1,0,0,0,0|2,0,0]=4 3838 B10R1.1 Cc1cc[n+](CC[O-])cc1 Amb24509510 [1,1,0,0,0,0|1,0,1]=4 3839 B10R1.1 Cc1ccc(CCBr)c[n]1 Amb24066233 [1,1,0,0,0,0|2,0,0]=4 3840 B10R1.1 Cc1ccc(CCC)cc1 Amb22227992 [1,1,0,0,0,0|0,0,0]=2 3841 B10R1.1 Cc1ccc(CCCl)[n]c1 Amb24479231 [1,1,0,0,0,0|2,0,0]=4 3842 B10R1.1 Cc1ccc(CCCl)c[n]1 Amb24658933 [1,1,0,0,0,0|2,0,0]=4 3843 B10R1.1 Cc1ccc(CCF)cc1 Amb24659769 [1,1,0,0,0,0|1,0,0]=3 3844 B10R1.1 Cc1ccc(CCI)cc1 Amb25096362 [1,1,0,0,0,0|1,0,0]=3 3845 B10R1.1 Cc1ccc(CCN)[n]c1 Amb24065042 [1,1,0,0,0,0|2,0,0]=4 3846 B10R1.1 Cc1ccc(CCN)cc1 Amb19261118 [1,1,0,0,0,0|1,0,0]=3 3847 B10R1.1 Cc1ccc(CCS)c[n]1 Amb24583128 [1,1,0,0,0,0|1,1,0]=4 3848 B10R1.1 Cc1ccc(CNC)[n]c1 Amb25280564 [1,1,0,0,0,0|2,0,0]=4 3849 B10R1.1 Cc1ccc(CNN)cc1 Amb19890079 [1,1,0,0,0,0|2,0,0]=4 3850 B10R1.1 Cc1ccc(CNN)cc1 Amb21954052 [1,1,0,0,0,0|2,0,0]=4 3851 B10R1.1 Cc1ccc(CNO)[n]c1 Amb25145636 [1,1,0,0,0,0|2,0,0]=4 3852 B10R1.1 Cc1ccc(CNO)c[n]1 Amb25305252 [1,1,0,0,0,0|2,0,0]=4 3853 B10R1.1 Cc1ccc(CNO)cc1 Amb25798742 [1,1,0,0,0,0|1,0,0]=3 3854 B10R1.1 Cc1ccc(COC)c[n]1 Amb24408974 [1,1,0,0,0,0|2,0,0]=4 3855 B10R1.1 Cc1ccc(CON)cc1 Amb21929103 [1,1,0,0,0,0|2,0,0]=4 3856 B10R1.1 Cc1ccc(CSC)[n]c1 Amb25838372 [1,1,0,0,0,0|2,0,0]=4 3857 B10R1.1 Cc1ccc(C[Mg]Cl)cc1 Amb19928780 [1,1,0,0,0,0|2,0,0]=4 3858 B10R1.1 Cc1ccc(C[Zn]Cl)cc1 Amb22000457 [1,1,0,0,0,0|2,0,0]=4 3859 B10R1.1 Cc1ccc([n]c1)OCC Amb24524393 [1,1,0,0,0,0|2,0,0]=4 3860 B10R1.1 Cc1ccc([n]c1)SCC Amb25762078 [1,1,0,0,0,0|2,0,0]=4 3861 B10R1.1 Cc1ccc(\C=N\C)cc1 Amb24589231 [1,1,0,0,0,0|1,0,1]=4 3862 B10R1.1 Cc1ccc(c[n]1)OCC Amb24057171 [1,1,0,0,0,0|2,0,0]=4 3863 B10R1.1 Cc1ccc(cc1)C[N+]#[C-] Amb1981066 [1,1,0,0,0,0|1,0,1]=4 3864 B10R1.1 Cc1ccc(cc1)NCO Amb24745213 [1,1,0,0,0,0|1,0,0]=3 3865 B10R1.1 Cc1ccc(cc1)OCCl Amb24620445 [1,1,0,0,0,0|2,0,0]=4 3866 B10R1.1 Cc1ccc(cc1)PCCl Amb24538070 [1,1,0,0,0,0|2,0,0]=4 3867 B10R1.1 ClCSc1ccc(Br)cc1 Amb25237152 [1,1,0,0,0,0|2,0,0]=4 3868 B10R1.1 Clc1ccc(CCBr)c[n]1 Amb24741687 [1,1,0,0,0,0|2,0,0]=4 3869 B10R1.1 Clc1ccc(CCCl)c[n]1 Amb25144552 [1,1,0,0,0,0|2,0,0]=4 3870 B10R1.1 Clc1ccc(CCI)cc1 Amb25363991 [1,1,0,0,0,0|1,0,0]=3 3871 B10R1.1 Clc1ccc(C[Zn]Cl)cc1 Amb22000429 [1,1,0,0,0,0|2,0,0]=4 3872 B10R1.1 Clc1ccc(cc1)C[N+]#[C-] Amb2235910 [1,1,0,0,0,0|1,0,1]=4 3873 B10R1.1 Clc1ccc(cc1)SCBr Amb24658657 [1,1,0,0,0,0|2,0,0]=4 3874 B10R1.1 Clc1ccc(cc1)SCCl Amb22351380 [1,1,0,0,0,0|2,0,0]=4 3875 B10R1.1 FCCc1ccc(Br)cc1 Amb25047426 [1,1,0,0,0,0|1,0,0]=3 3876 B10R1.1 Fc1ccc(C[Mg]Cl)cc1 Amb17938181 [1,1,0,0,0,0|2,0,0]=4 3877 B10R1.1 Fc1ccc(C[Zn]Cl)cc1 Amb17938179 [1,1,0,0,0,0|2,0,0]=4 3878 B10R1.1 Fc1ccc(cc1)C[N+]#[C-] Amb1981065 [1,1,0,0,0,0|1,0,1]=4 3879 B10R1.1 Fc1ccc(cc1)OCCl Amb24538040 [1,1,0,0,0,0|2,0,0]=4 3880 B10R1.1 N#CCc1ccc(S)cc1 Amb24509708 [1,1,0,0,0,0|1,0,1]=4 3881 B10R1.1 N#CCc1ccc(cc1)Br Amb1130758 [1,1,0,0,0,0|1,0,1]=4 3882 B10R1.1 N#CCc1ccc(cc1)Cl Amb1883007 [1,1,0,0,0,0|1,0,1]=4 3883 B10R1.1 N#CCc1ccc(cc1)F Amb1154069 [1,1,0,0,0,0|1,0,1]=4 3884 B10R1.1 N#CCc1ccc(cc1)N Amb1215260 [1,1,0,0,0,0|1,0,1]=4 3885 B10R1.1 N#CCc1ccc(cc1)O Amb1154109 [1,1,0,0,0,0|1,0,1]=4 3886 B10R1.1 NCCC=1C=CC(=O)NC1 Amb18908312 [1,1,0,0,0,0|2,0,0]=4 3887 B10R1.1 NCCN1C=CC(=O)C=C1 Amb18534867 [1,1,0,0,0,0|2,0,0]=4 3888 B10R1.1 NCCc1cc[n+]([O-])cc1 Amb24471141 [1,1,0,0,0,0|2,0,0]=4 3889 B10R1.1 NCCc1ccc(Br)[n]c1 Amb22233813 [1,1,0,0,0,0|2,0,0]=4 3890 B10R1.1 NCCc1ccc(Br)c[n]1 Amb22751436 [1,1,0,0,0,0|2,0,0]=4 3891 B10R1.1 NCCc1ccc(Cl)[n]c1 Amb19516101 [1,1,0,0,0,0|2,0,0]=4 3892 B10R1.1 NCCc1ccc(Cl)c[n]1 Amb22751421 [1,1,0,0,0,0|2,0,0]=4 3893 B10R1.1 NCCc1ccc(Cl)c[n]1 Amb22899099 [1,1,0,0,0,0|2,0,0]=4 3894 B10R1.1 NCCc1ccc(Cl)c[n]1 Amb22899100 [1,1,0,0,0,0|2,0,0]=4 3895 B10R1.1 NCCc1ccc(Cl)cc1 Amb22497649 [1,1,0,0,0,0|1,0,0]=3 3896 B10R1.1 NCCc1ccc(F)[n]c1 Amb25678845 [1,1,0,0,0,0|2,0,0]=4 3897 B10R1.1 NCCc1ccc(F)c[n]1 Amb22899431 [1,1,0,0,0,0|2,0,0]=4 3898 B10R1.1 NCCc1ccc(I)cc1 Amb19516023 [1,1,0,0,0,0|1,0,0]=3 3899 B10R1.1 NCCc1ccc(N)cc1 Amb17772211 [1,1,0,0,0,0|1,0,0]=3 3900 B10R1.1 NCCc1ccc(O)cc1 Amb17778990 [1,1,0,0,0,0|1,0,0]=3 3901 B10R1.1 NCCc1ccc(S)cc1 Amb25700837 [1,1,0,0,0,0|1,0,0]=3 3902 B10R1.1 NCCc1ccc(cc1)Br Amb10808111 [1,1,0,0,0,0|1,0,0]=3 3903 B10R1.1 NCCc1ccc(cc1)C Amb1129454 [1,1,0,0,0,0|1,0,0]=3 3904 B10R1.1 NCCc1ccc(cc1)Cl Amb1212558 [1,1,0,0,0,0|1,0,0]=3 3905 B10R1.1 NCCc1ccc(cc1)F Amb1215262 [1,1,0,0,0,0|1,0,0]=3 3906 B10R1.1 NCCc1ccc(nc1)C Amb10610554 [1,1,0,0,0,0|2,0,0]=4 3907 B10R1.1 NCNc1ccc(cc1)C Amb17117016 [1,1,0,0,0,0|2,0,0]=4 3908 B10R1.1 NNCc1ccc(Br)cc1 Amb19893264 [1,1,0,0,0,0|2,0,0]=4 3909 B10R1.1 NNCc1ccc(Br)cc1 Amb23439145 [1,1,0,0,0,0|2,0,0]=4 3910 B10R1.1 NNCc1ccc(Cl)cc1 Amb19890158 [1,1,0,0,0,0|2,0,0]=4 3911 B10R1.1 NNCc1ccc(Cl)cc1 Amb20668069 [1,1,0,0,0,0|2,0,0]=4 3912 B10R1.1 NNCc1ccc(Cl)cc1 Amb21954056 [1,1,0,0,0,0|2,0,0]=4 3913 B10R1.1 NNCc1ccc(F)cc1 Amb19893258 [1,1,0,0,0,0|2,0,0]=4 3914 B10R1.1 NNCc1ccc(I)cc1 Amb25794991 [1,1,0,0,0,0|2,0,0]=4 3915 B10R1.1 NNCc1ccc(cc1)Br Amb1114984 [1,1,0,0,0,0|2,0,0]=4 3916 B10R1.1 NNCc1ccc(cc1)C Amb1112560 [1,1,0,0,0,0|2,0,0]=4 3917 B10R1.1 NNCc1ccc(cc1)Cl Amb1121233 [1,1,0,0,0,0|2,0,0]=4 3918 B10R1.1 NNCc1ccc(cc1)F Amb10841872 [1,1,0,0,0,0|2,0,0]=4 3919 B10R1.1 NNCc1ccc(cc1)F Amb1112880 [1,1,0,0,0,0|2,0,0]=4 3920 B10R1.1 NOCc1ccc(Br)cc1 Amb22234858 [1,1,0,0,0,0|2,0,0]=4 3921 B10R1.1 NOCc1ccc(Cl)cc1 Amb19889791 [1,1,0,0,0,0|2,0,0]=4 3922 B10R1.1 NOCc1ccc(F)cc1 Amb19883929 [1,1,0,0,0,0|2,0,0]=4 3923 B10R1.1 NOCc1ccc(cc1)C Amb1946246 [1,1,0,0,0,0|2,0,0]=4 3924 B10R1.1 NOCc1ccc(cc1)Cl Amb10607411 [1,1,0,0,0,0|2,0,0]=4 3925 B10R1.1 NOCc1ccc(cc1)F Amb17091427 [1,1,0,0,0,0|2,0,0]=4 3926 B10R1.1 Nc1ccc(CC=O)cc1 Amb22831156 [1,1,0,0,0,0|0,0,2]=4 3927 B10R1.1 Nc1ccc(CCBr)cc1 Amb24066884 [1,1,0,0,0,0|1,0,0]=3 3928 B10R1.1 Nc1ccc(CCCl)cc1 Amb18125908 [1,1,0,0,0,0|1,0,0]=3 3929 B10R1.1 Nc1ccc(CCF)cc1 Amb24655949 [1,1,0,0,0,0|1,0,0]=3 3930 B10R1.1 Nc1ccc(CCO)[n]c1 Amb24593512 [1,1,0,0,0,0|1,0,0]=3 3931 B10R1.1 Nc1ccc(CCO)c[n]1 Amb23446333 [1,1,0,0,0,0|1,0,0]=3 3932 B10R1.1 Nc1ccc(CNO)cc1 Amb25835653 [1,1,0,0,0,0|1,0,0]=3 3933 B10R1.1 Nc1ccc(C[PH2]=O)cc1 Amb25118632 [1,1,0,0,0,0|1,0,1]=4 3934 B10R1.1 Nc1ccc(cc1)SCCl Amb25281595 [1,1,0,0,0,0|2,0,0]=4 3935 B10R1.1 O=C1C=CC(CCCl)=CN1 Amb25060213 [1,1,0,0,0,0|2,0,0]=4 3936 B10R1.1 O=C1C=CN(CCCl)C=C1 Amb18177573 [1,1,0,0,0,0|2,0,0]=4 3937 B10R1.1 O=C1C=CN(CCF)C=C1 Amb25713562 [1,1,0,0,0,0|2,0,0]=4 3938 B10R1.1 O=CCc1ccc(I)cc1 Amb24079622 [1,1,0,0,0,0|0,0,2]=4 3939 B10R1.1 O=CCc1ccc(cc1)Br Amb16230450 [1,1,0,0,0,0|0,0,2]=4 3940 B10R1.1 O=CCc1ccc(cc1)Cl Amb10603161 [1,1,0,0,0,0|0,0,2]=4 3941 B10R1.1 O=CCc1ccc(cc1)F Amb16230451 [1,1,0,0,0,0|0,0,2]=4 3942 B10R1.1 OCCN1C=CC(=O)C=C1 Amb18041230 [1,1,0,0,0,0|1,0,0]=3 3943 B10R1.1 OCCN1C=CC(=S)C=C1 Amb25739794 [1,1,0,0,0,0|1,0,0]=3 3944 B10R1.1 OCCc1[n]cc(Br)c[n]1 Amb22896759 [1,1,0,0,0,0|2,0,0]=4 3945 B10R1.1 OCCc1c[n]c(Cl)[n]c1 Amb25211893 [1,1,0,0,0,0|2,0,0]=4 3946 B10R1.1 OCCc1ccc(Br)[n]c1 Amb23569407 [1,1,0,0,0,0|1,0,0]=3 3947 B10R1.1 OCCc1ccc(Br)c[n]1 Amb21858814 [1,1,0,0,0,0|1,0,0]=3 3948 B10R1.1 OCCc1ccc(Cl)[n]c1 Amb22752853 [1,1,0,0,0,0|1,0,0]=3 3949 B10R1.1 OCCc1ccc(F)[n]c1 Amb25063775 [1,1,0,0,0,0|1,0,0]=3 3950 B10R1.1 OCCc1ccc(F)c[n]1 Amb24426849 [1,1,0,0,0,0|1,0,0]=3 3951 B10R1.1 OCCc1ccc(I)[n]c1 Amb23446988 [1,1,0,0,0,0|1,0,0]=3 3952 B10R1.1 OCCc1ccc(I)cc1 Amb19668873 [1,1,0,0,0,0|0,0,0]=2 3953 B10R1.1 OCCc1ccc(S)[n]c1 Amb23446733 [1,1,0,0,0,0|1,0,0]=3 3954 B10R1.1 OCCc1ccc(S)cc1 Amb24379931 [1,1,0,0,0,0|0,0,0]=2 3955 B10R1.1 OCCc1ccc(nc1)C Amb10603991 [1,1,0,0,0,0|1,0,0]=3 3956 B10R1.1 OCCc1ncc(cn1)S Amb1971491 [1,1,0,0,0,0|2,0,0]=4 3957 B10R1.1 OCNc1ccc(Cl)cc1 Amb24702524 [1,1,0,0,0,0|1,0,0]=3 3958 B10R1.1 ONCc1ccc(Br)cc1 Amb23449447 [1,1,0,0,0,0|1,0,0]=3 3959 B10R1.1 ONCc1ccc(Cl)cc1 Amb25145635 [1,1,0,0,0,0|1,0,0]=3 3960 B10R1.1 ONCc1ccc(F)cc1 Amb22157298 [1,1,0,0,0,0|1,0,0]=3 3961 B10R1.1 ONCc1ccc(I)cc1 Amb24529167 [1,1,0,0,0,0|1,0,0]=3 3962 B10R1.1 O\N=C\c1ccc(cc1)Br Amb1152409 [1,1,0,0,0,0|1,0,1]=4 3963 B10R1.1 O\N=C\c1ccc(cc1)C Amb1152459 [1,1,0,0,0,0|1,0,1]=4 3964 B10R1.1 O\N=C\c1ccc(cc1)Cl Amb1152205 [1,1,0,0,0,0|1,0,1]=4 3965 B10R1.1 O\N=C\c1ccc(cc1)F Amb1152218 [1,1,0,0,0,0|1,0,1]=4 3966 B10R1.1 Oc1c[n]c(CCO)[n]c1 Amb22886930 [1,1,0,0,0,0|2,0,0]=4 3967 B10R1.1 Oc1ccc(CCCl)cc1 Amb25709371 [1,1,0,0,0,0|1,0,0]=3 3968 B10R1.1 Oc1ccc(CCF)cc1 Amb25735077 [1,1,0,0,0,0|1,0,0]=3 3969 B10R1.1 Oc1ccc(CCI)cc1 Amb24094233 [1,1,0,0,0,0|1,0,0]=3 3970 B10R1.1 Oc1ccc(CCO)c[n]1 Amb23446664 [1,1,0,0,0,0|1,0,0]=3 3971 B10R1.1 Oc1ccc(CCS)cc1 Amb25767004 [1,1,0,0,0,0|0,1,0]=3 3972 B10R1.1 Oc1ccc(CNO)cc1 Amb23449449 [1,1,0,0,0,0|1,0,0]=3 3973 B10R1.1 Oc1ccc(cc1)SCO Amb24631003 [1,1,0,0,0,0|1,0,0]=3 3974 B10R1.1 SCCc1ccc(cc1)Br Amb17404679 [1,1,0,0,0,0|0,1,0]=3 3975 B10R1.1 SCCc1ccc(cc1)C Amb16183304 [1,1,0,0,0,0|0,1,0]=3 3976 B10R1.1 SCCc1ccc(cc1)Cl Amb17400376 [1,1,0,0,0,0|0,1,0]=3 3977 B10R1.1 SCCc1ccc(cc1)F Amb17400005 [1,1,0,0,0,0|0,1,0]=3 3978 B10R1.1 Sc1ccc(CCBr)cc1 Amb24428628 [1,1,0,0,0,0|1,0,0]=3 3979 B10R1.1 Sc1ccc(CCCl)cc1 Amb24482361 [1,1,0,0,0,0|1,0,0]=3 3980 B10R1.1 [NH3+]OCc1ccc(cc1)Cl Amb2427236 [1,1,0,0,0,0|2,0,0]=4 3981 B10R1.1 [NH3+]OCc1ccc(cc1)F Amb2420803 [1,1,0,0,0,0|2,0,0]=4 3982 B10R1.1 [O-][n+]1ccc(CCO)cc1 Amb25236037 [1,1,0,0,0,0|1,0,0]=3 3983 B10R1.4 Bc1ccccc1CCN Amb24629754 [1,1,0,0,0,0|1,0,0]=3 3984 B10R1.4 BrCCc1ccccc1I Amb25742518 [1,1,0,0,0,0|1,0,0]=3 3985 B10R1.4 Brc1ccccc1CCBr Amb19515770 [1,1,0,0,0,0|1,0,0]=3 3986 B10R1.4 Brc1ccccc1CCI Amb25255595 [1,1,0,0,0,0|1,0,0]=3 3987 B10R1.4 Brc1ccccc1C[Mg]Br Amb22000538 [1,1,0,0,0,0|2,0,0]=4 3988 B10R1.4 Brc1ccccc1C[Zn]Br Amb22000430 [1,1,0,0,0,0|2,0,0]=4 3989 B10R1.4 C#CCc1ccccc1O Amb24478360 [1,1,0,0,0,0|0,0,2]=4 3990 B10R1.4 C=CCc1ccccc1N Amb18642928 [1,1,0,0,0,0|0,0,2]=4 3991 B10R1.4 C=CCc1ccccc1O Amb1971446 [1,1,0,0,0,0|0,0,2]=4 3992 B10R1.4 CC#Cc1ccccc1N Amb24070024 [1,1,0,0,0,0|0,0,2]=4 3993 B10R1.4 CC#Cc1ccccc1O Amb25706906 [1,1,0,0,0,0|0,0,2]=4 3994 B10R1.4 CCCC1=CC=NNC1=O Amb25340428 [1,1,0,0,0,0|2,0,0]=4 3995 B10R1.4 CCCN1C=CC=CC1=O Amb22730334 [1,1,0,0,0,0|1,0,0]=3 3996 B10R1.4 CCCN1C=CC=CC1=S Amb24480486 [1,1,0,0,0,0|1,0,0]=3 3997 B10R1.4 CCCN1C=NC=CC1=O Amb24453560 [1,1,0,0,0,0|2,0,0]=4 3998 B10R1.4 CCC[n+]1ccccc1C Amb25326000 [1,1,0,0,0,0|1,0,0]=3 3999 B10R1.4 CCCc1[n]c[n]cc1N Amb18832321 [1,1,0,0,0,0|2,0,0]=4 4000 B10R1.4 CCCc1[n]c[n]cc1O Amb25091036 [1,1,0,0,0,0|2,0,0]=4 4001 B10R1.4 CCCc1[n]cc[n]c1O Amb18643252 [1,1,0,0,0,0|2,0,0]=4 4002 B10R1.4 CCCc1[n]cccc1Br Amb24320669 [1,1,0,0,0,0|1,0,0]=3 4003 B10R1.4 CCCc1[n]cccc1F Amb25716946 [1,1,0,0,0,0|1,0,0]=3 4004 B10R1.4 CCCc1[n]cccc1N Amb18832434 [1,1,0,0,0,0|1,0,0]=3 4005 B10R1.4 CCCc1[n]cccc1O Amb24320670 [1,1,0,0,0,0|1,0,0]=3 4006 B10R1.4 CCCc1c[n]c[n]c1Br Amb24323117 [1,1,0,0,0,0|2,0,0]=4 4007 B10R1.4 CCCc1c[n]c[n]c1N Amb25756869 [1,1,0,0,0,0|2,0,0]=4 4008 B10R1.4 CCCc1c[n]ccc1Br Amb20617515 [1,1,0,0,0,0|1,0,0]=3 4009 B10R1.4 CCCc1c[n]ccc1N Amb22522169 [1,1,0,0,0,0|1,0,0]=3 4010 B10R1.4 CCCc1cc[n]cc1Br Amb24320559 [1,1,0,0,0,0|1,0,0]=3 4011 B10R1.4 CCCc1cc[n]cc1N Amb18203088 [1,1,0,0,0,0|1,0,0]=3 4012 B10R1.4 CCCc1cc[n]cc1O Amb24398292 [1,1,0,0,0,0|1,0,0]=3 4013 B10R1.4 CCCc1ccc[n]c1Br Amb24319271 [1,1,0,0,0,0|1,0,0]=3 4014 B10R1.4 CCCc1ccc[n]c1Cl Amb24319272 [1,1,0,0,0,0|1,0,0]=3 4015 B10R1.4 CCCc1ccc[n]c1F Amb25054844 [1,1,0,0,0,0|1,0,0]=3 4016 B10R1.4 CCCc1ccc[n]c1O Amb24319273 [1,1,0,0,0,0|1,0,0]=3 4017 B10R1.4 CCCc1ccccc1I Amb20622716 [1,1,0,0,0,0|0,0,0]=2 4018 B10R1.4 CCCc1cncnc1Cl Amb10607977 [1,1,0,0,0,0|2,0,0]=4 4019 B10R1.4 CCCc1ncncc1Br Amb10068152 [1,1,0,0,0,0|2,0,0]=4 4020 B10R1.4 CCNC1=CC=CNC1=O Amb25063603 [1,1,0,0,0,0|2,0,0]=4 4021 B10R1.4 CCNc1[n]cccc1Br Amb18955277 [1,1,0,0,0,0|2,0,0]=4 4022 B10R1.4 CCNc1[n]cccc1F Amb18963791 [1,1,0,0,0,0|2,0,0]=4 4023 B10R1.4 CCNc1[n]cccc1I Amb24352750 [1,1,0,0,0,0|2,0,0]=4 4024 B10R1.4 CCNc1c[n]ccc1N Amb17933377 [1,1,0,0,0,0|2,0,0]=4 4025 B10R1.4 CCNc1cc[n]cc1Cl Amb25839408 [1,1,0,0,0,0|2,0,0]=4 4026 B10R1.4 CCNc1cc[n]cc1O Amb24744478 [1,1,0,0,0,0|2,0,0]=4 4027 B10R1.4 CCNc1ccc[n]c1N Amb23557979 [1,1,0,0,0,0|2,0,0]=4 4028 B10R1.4 CCNc1ccccc1O Amb18643152 [1,1,0,0,0,0|1,0,0]=3 4029 B10R1.4 CCNc1ccccc1P Amb24563425 [1,1,0,0,0,0|1,0,0]=3 4030 B10R1.4 CCNc1ccccc1S Amb24382138 [1,1,0,0,0,0|1,0,0]=3 4031 B10R1.4 CCNc1ncccc1N Amb10609970 [1,1,0,0,0,0|2,0,0]=4 4032 B10R1.4 CCOC1=CC=CNC1=O Amb18537475 [1,1,0,0,0,0|2,0,0]=4 4033 B10R1.4 CCOC1=COC=CC1=O Amb24454331 [1,1,0,0,0,0|2,0,0]=4 4034 B10R1.4 CCON1C=CC=CC1=S Amb25257642 [1,1,0,0,0,0|2,0,0]=4 4035 B10R1.4 CCOc1[n]cccc1Br Amb20242466 [1,1,0,0,0,0|2,0,0]=4 4036 B10R1.4 CCOc1[n]cccc1F Amb21857675 [1,1,0,0,0,0|2,0,0]=4 4037 B10R1.4 CCOc1[n]cccc1O Amb19895105 [1,1,0,0,0,0|2,0,0]=4 4038 B10R1.4 CCOc1c[n]ccc1Br Amb23402582 [1,1,0,0,0,0|2,0,0]=4 4039 B10R1.4 CCOc1c[n]ccc1Cl Amb20242807 [1,1,0,0,0,0|2,0,0]=4 4040 B10R1.4 CCOc1c[n]ccc1N Amb21857560 [1,1,0,0,0,0|2,0,0]=4 4041 B10R1.4 CCOc1cc[n]cc1Cl Amb25829530 [1,1,0,0,0,0|2,0,0]=4 4042 B10R1.4 CCOc1cc[n]cc1F Amb22495229 [1,1,0,0,0,0|2,0,0]=4 4043 B10R1.4 CCOc1cc[n]cc1I Amb24536249 [1,1,0,0,0,0|2,0,0]=4 4044 B10R1.4 CCOc1cc[n]cc1O Amb24454081 [1,1,0,0,0,0|2,0,0]=4 4045 B10R1.4 CCOc1ccc[n]c1I Amb25681793 [1,1,0,0,0,0|2,0,0]=4 4046 B10R1.4 CCOc1ccc[n]c1S Amb24478413 [1,1,0,0,0,0|2,0,0]=4 4047 B10R1.4 CCOc1cccc[n+]1[O-] Amb25116884 [1,1,0,0,0,0|2,0,0]=4 4048 B10R1.4 CCOc1ccccc1I Amb19888234 [1,1,0,0,0,0|1,0,0]=3 4049 B10R1.4 CCOc1ccccc1N Amb22733118 [1,1,0,0,0,0|1,0,0]=3 4050 B10R1.4 CCOc1ccccc1S Amb20242711 [1,1,0,0,0,0|1,0,0]=3 4051 B10R1.4 CCOc1cccnc1N Amb1102343 [1,1,0,0,0,0|2,0,0]=4 4052 B10R1.4 CCOc1cnccc1Br Amb15691031 [1,1,0,0,0,0|2,0,0]=4 4053 B10R1.4 CCOc1ncccc1N Amb1136817 [1,1,0,0,0,0|2,0,0]=4 4054 B10R1.4 CCSC1=CC=CNC1=O Amb24478310 [1,1,0,0,0,0|2,0,0]=4 4055 B10R1.4 CCSc1[n]cccc1Br Amb25075348 [1,1,0,0,0,0|2,0,0]=4 4056 B10R1.4 CCSc1[n]cccc1Cl Amb24403624 [1,1,0,0,0,0|2,0,0]=4 4057 B10R1.4 CCSc1c[n]ccc1Cl Amb24549425 [1,1,0,0,0,0|2,0,0]=4 4058 B10R1.4 CCSc1ccc[n]c1Cl Amb25837979 [1,1,0,0,0,0|2,0,0]=4 4059 B10R1.4 CCSc1ccc[n]c1F Amb24085371 [1,1,0,0,0,0|2,0,0]=4 4060 B10R1.4 CCSc1ccccc1Br Amb20242712 [1,1,0,0,0,0|1,0,0]=3 4061 B10R1.4 CCSc1ccccc1F Amb24480376 [1,1,0,0,0,0|1,0,0]=3 4062 B10R1.4 CCSc1ccccc1N Amb10609429 [1,1,0,0,0,0|1,0,0]=3 4063 B10R1.4 CCSc1ncccc1O Amb10552831 [1,1,0,0,0,0|2,0,0]=4 4064 B10R1.4 CNCC1=CC=CNC1=O Amb18260767 [1,1,0,0,0,0|2,0,0]=4 4065 B10R1.4 CNCC1=CNC=CC1=O Amb25343315 [1,1,0,0,0,0|2,0,0]=4 4066 B10R1.4 CNCc1cc[n]cc1Br Amb23412258 [1,1,0,0,0,0|2,0,0]=4 4067 B10R1.4 CNCc1cc[n]cc1F Amb24398098 [1,1,0,0,0,0|2,0,0]=4 4068 B10R1.4 CNCc1cc[n]cc1N Amb22751232 [1,1,0,0,0,0|2,0,0]=4 4069 B10R1.4 CNCc1ccc[n]c1Br Amb25747185 [1,1,0,0,0,0|2,0,0]=4 4070 B10R1.4 CNCc1ccc[n]c1Cl Amb21967911 [1,1,0,0,0,0|2,0,0]=4 4071 B10R1.4 CNCc1ccccc1Br Amb1210073 [1,1,0,0,0,0|1,0,0]=3 4072 B10R1.4 CNCc1ccccc1C Amb1648007 [1,1,0,0,0,0|1,0,0]=3 4073 B10R1.4 CNCc1ccccc1Cl Amb1694838 [1,1,0,0,0,0|1,0,0]=3 4074 B10R1.4 CNCc1ccccc1F Amb10609411 [1,1,0,0,0,0|1,0,0]=3 4075 B10R1.4 CNCc1ccccc1F Amb1675335 [1,1,0,0,0,0|1,0,0]=3 4076 B10R1.4 CNCc1ccccc1I Amb21861741 [1,1,0,0,0,0|1,0,0]=3 4077 B10R1.4 CNCc1ccccc1O Amb1113119 [1,1,0,0,0,0|1,0,0]=3 4078 B10R1.4 CNCc1ccccc1O Amb19930187 [1,1,0,0,0,0|1,0,0]=3 4079 B10R1.4 CNCc1cccnc1Cl Amb10975541 [1,1,0,0,0,0|2,0,0]=4 4080 B10R1.4 CNCc1ccncc1C Amb10607510 [1,1,0,0,0,0|2,0,0]=4 4081 B10R1.4 CNNc1ccccc1Cl Amb22469809 [1,1,0,0,0,0|2,0,0]=4 4082 B10R1.4 CNNc1ccccc1N Amb24654786 [1,1,0,0,0,0|2,0,0]=4 4083 B10R1.4 CN\C=C/1\C=CC=CC1=N Amb24392543 [1,1,0,0,0,0|1,0,1]=4 4084 B10R1.4 COCN1C=CC=CC1=S Amb24417796 [1,1,0,0,0,0|2,0,0]=4 4085 B10R1.4 COCc1[n]cccc1Br Amb24390407 [1,1,0,0,0,0|2,0,0]=4 4086 B10R1.4 COCc1[n]cccc1O Amb24062577 [1,1,0,0,0,0|2,0,0]=4 4087 B10R1.4 COCc1c[n]ccc1N Amb25058708 [1,1,0,0,0,0|2,0,0]=4 4088 B10R1.4 COCc1cc[n]cc1Br Amb24479286 [1,1,0,0,0,0|2,0,0]=4 4089 B10R1.4 COCc1ccc[n]c1Cl Amb18799910 [1,1,0,0,0,0|2,0,0]=4 4090 B10R1.4 COCc1ccc[n]c1F Amb24084163 [1,1,0,0,0,0|2,0,0]=4 4091 B10R1.4 COCc1ccc[n]c1N Amb18961776 [1,1,0,0,0,0|2,0,0]=4 4092 B10R1.4 COCc1ccccc1I Amb19373361 [1,1,0,0,0,0|1,0,0]=3 4093 B10R1.4 COCc1ccccc1O Amb22751673 [1,1,0,0,0,0|1,0,0]=3 4094 B10R1.4 CO\N=C/1\C=CC=CC1=O Amb25340128 [1,1,0,0,0,0|2,0,0]=4 4095 B10R1.4 CO\N=C\1/C=CC=CC1=O Amb25146545 [1,1,0,0,0,0|2,0,0]=4 4096 B10R1.4 CSCN1C=CC=CC1=S Amb24502171 [1,1,0,0,0,0|2,0,0]=4 4097 B10R1.4 CSCc1c[n]ccc1N Amb24459131 [1,1,0,0,0,0|2,0,0]=4 4098 B10R1.4 CSCc1cc[n]cc1Cl Amb25688708 [1,1,0,0,0,0|2,0,0]=4 4099 B10R1.4 CSCc1ccc[n]c1Cl Amb18185616 [1,1,0,0,0,0|2,0,0]=4 4100 B10R1.4 CSCc1ccc[n]c1F Amb24084168 [1,1,0,0,0,0|2,0,0]=4 4101 B10R1.4 CSCc1ccc[n]c1N Amb18284856 [1,1,0,0,0,0|2,0,0]=4 4102 B10R1.4 CSCc1ccccc1N Amb18951025 [1,1,0,0,0,0|1,0,0]=3 4103 B10R1.4 CSCc1ccccc1O Amb18125792 [1,1,0,0,0,0|1,0,0]=3 4104 B10R1.4 C[n+]1ccccc1CCF Amb24667673 [1,1,0,0,0,0|2,0,0]=4 4105 B10R1.4 C\C=C/c1ccccc1O Amb24422361 [1,1,0,0,0,0|0,0,2]=4 4106 B10R1.4 C\C=C\c1ccccc1Cl Amb22054732 [1,1,0,0,0,0|0,0,2]=4 4107 B10R1.4 C\C=C\c1ccccc1N Amb18642929 [1,1,0,0,0,0|0,0,2]=4 4108 B10R1.4 C\C=N\c1ccccc1N Amb24715815 [1,1,0,0,0,0|1,0,1]=4 4109 B10R1.4 C\C=N\c1ccccc1O Amb25296771 [1,1,0,0,0,0|1,0,1]=4 4110 B10R1.4 C\N=C\c1ccccc1O Amb25179640 [1,1,0,0,0,0|1,0,1]=4 4111 B10R1.4 C\N=N\c1ccccc1N Amb25316282 [1,1,0,0,0,0|2,0,0]=4 4112 B10R1.4 Cc1[n]c[n]cc1CCC Amb24070523 [1,1,0,0,0,0|2,0,0]=4 4113 B10R1.4 Cc1[n]c[n]cc1CCO Amb24063133 [1,1,0,0,0,0|2,0,0]=4 4114 B10R1.4 Cc1[n]cccc1CCC Amb24724101 [1,1,0,0,0,0|1,0,0]=3 4115 B10R1.4 Cc1[n]cccc1CCCl Amb24085167 [1,1,0,0,0,0|2,0,0]=4 4116 B10R1.4 Cc1[n]cccc1CCCl Amb25087825 [1,1,0,0,0,0|2,0,0]=4 4117 B10R1.4 Cc1[n]cccc1CCN Amb18203091 [1,1,0,0,0,0|2,0,0]=4 4118 B10R1.4 Cc1[n]cccc1CCO Amb24061576 [1,1,0,0,0,0|1,0,0]=3 4119 B10R1.4 Cc1[n]cccc1CNC Amb18216945 [1,1,0,0,0,0|2,0,0]=4 4120 B10R1.4 Cc1[n]cccc1COC Amb24085384 [1,1,0,0,0,0|2,0,0]=4 4121 B10R1.4 Cc1[n]cccc1OCC Amb24057152 [1,1,0,0,0,0|2,0,0]=4 4122 B10R1.4 Cc1c[n][n]cc1CCC Amb25253656 [1,1,0,0,0,0|2,0,0]=4 4123 B10R1.4 Cc1c[n]ccc1CCBr Amb24548352 [1,1,0,0,0,0|2,0,0]=4 4124 B10R1.4 Cc1c[n]ccc1CCI Amb24560492 [1,1,0,0,0,0|2,0,0]=4 4125 B10R1.4 Cc1c[n]ccc1CCN Amb22059435 [1,1,0,0,0,0|2,0,0]=4 4126 B10R1.4 Cc1c[n]ccc1CCS Amb25197336 [1,1,0,0,0,0|1,1,0]=4 4127 B10R1.4 Cc1c[n]ccc1OCC Amb24062205 [1,1,0,0,0,0|2,0,0]=4 4128 B10R1.4 Cc1cc[n]cc1CCBr Amb24693233 [1,1,0,0,0,0|2,0,0]=4 4129 B10R1.4 Cc1cc[n]cc1CCN Amb18832435 [1,1,0,0,0,0|2,0,0]=4 4130 B10R1.4 Cc1cc[n]cc1CNO Amb25135601 [1,1,0,0,0,0|2,0,0]=4 4131 B10R1.4 Cc1cc[n]cc1CSC Amb24632979 [1,1,0,0,0,0|2,0,0]=4 4132 B10R1.4 Cc1ccc[n]c1CCBr Amb24641164 [1,1,0,0,0,0|2,0,0]=4 4133 B10R1.4 Cc1ccc[n]c1NCC Amb18959725 [1,1,0,0,0,0|2,0,0]=4 4134 B10R1.4 Cc1ccc[n]c1OCC Amb25198320 [1,1,0,0,0,0|2,0,0]=4 4135 B10R1.4 Cc1cccc[n+]1CCF Amb25048247 [1,1,0,0,0,0|2,0,0]=4 4136 B10R1.4 Cc1ccccc1C#CC Amb24092689 [1,1,0,0,0,0|0,0,2]=4 4137 B10R1.4 Cc1ccccc1C=NO Amb24084825 [1,1,0,0,0,0|1,0,1]=4 4138 B10R1.4 Cc1ccccc1CCC Amb22227985 [1,1,0,0,0,0|0,0,0]=2 4139 B10R1.4 Cc1ccccc1CCN Amb20622598 [1,1,0,0,0,0|1,0,0]=3 4140 B10R1.4 Cc1ccccc1CNN Amb21954057 [1,1,0,0,0,0|2,0,0]=4 4141 B10R1.4 Cc1ccccc1CNO Amb25343987 [1,1,0,0,0,0|1,0,0]=3 4142 B10R1.4 Cc1ccccc1CSC Amb24370548 [1,1,0,0,0,0|1,0,0]=3 4143 B10R1.4 Cc1ccccc1C[Mg]Cl Amb22000539 [1,1,0,0,0,0|2,0,0]=4 4144 B10R1.4 Cc1ccccc1C[Zn]Cl Amb22000455 [1,1,0,0,0,0|2,0,0]=4 4145 B10R1.4 ClCCc1ccccc1Br Amb24644893 [1,1,0,0,0,0|1,0,0]=3 4146 B10R1.4 ClCCc1ccccc1I Amb24742826 [1,1,0,0,0,0|1,0,0]=3 4147 B10R1.4 Clc1c[n]ccc1CCBr Amb25076266 [1,1,0,0,0,0|2,0,0]=4 4148 B10R1.4 Clc1ccccc1CCI Amb25048390 [1,1,0,0,0,0|1,0,0]=3 4149 B10R1.4 Clc1ccccc1C[Mg]Cl Amb19928783 [1,1,0,0,0,0|2,0,0]=4 4150 B10R1.4 Clc1ccccc1C[Zn]Cl Amb22000427 [1,1,0,0,0,0|2,0,0]=4 4151 B10R1.4 Clc1ccccc1OCCl Amb22227923 [1,1,0,0,0,0|2,0,0]=4 4152 B10R1.4 FCCc1ccccc1Br Amb24754179 [1,1,0,0,0,0|1,0,0]=3 4153 B10R1.4 FCCc1ccccc1I Amb22739042 [1,1,0,0,0,0|1,0,0]=3 4154 B10R1.4 Fc1c[n]ccc1CCBr Amb25172854 [1,1,0,0,0,0|2,0,0]=4 4155 B10R1.4 Fc1ccccc1C[Zn]Cl Amb17672035 [1,1,0,0,0,0|2,0,0]=4 4156 B10R1.4 Fc1ccccc1OCCl Amb25356820 [1,1,0,0,0,0|2,0,0]=4 4157 B10R1.4 N#CCc1ccccc1Br Amb1140623 [1,1,0,0,0,0|1,0,1]=4 4158 B10R1.4 N#CCc1ccccc1C Amb1651450 [1,1,0,0,0,0|1,0,1]=4 4159 B10R1.4 N#CCc1ccccc1Cl Amb1644930 [1,1,0,0,0,0|1,0,1]=4 4160 B10R1.4 N#CCc1ccccc1N Amb17607888 [1,1,0,0,0,0|1,0,1]=4 4161 B10R1.4 N#CCc1ccccc1O Amb18642921 [1,1,0,0,0,0|1,0,1]=4 4162 B10R1.4 N=C1C=CC=CN1CCO Amb18548415 [1,1,0,0,0,0|1,0,0]=3 4163 B10R1.4 N=C1N=CC=CN1CCO Amb25294330 [1,1,0,0,0,0|2,0,0]=4 4164 B10R1.4 NCCC1=CC=CCC1=S Amb24664855 [1,1,0,0,0,0|1,0,1]=4 4165 B10R1.4 NCCN1C=CC=CC1=O Amb18535437 [1,1,0,0,0,0|2,0,0]=4 4166 B10R1.4 NCCN1C=CC=CC1=O Amb19514535 [1,1,0,0,0,0|2,0,0]=4 4167 B10R1.4 NCCN1C=CC=CC1=O Amb20668789 [1,1,0,0,0,0|2,0,0]=4 4168 B10R1.4 NCCc1[n]cccc1Br Amb24183541 [1,1,0,0,0,0|2,0,0]=4 4169 B10R1.4 NCCc1[n]cccc1Cl Amb18200051 [1,1,0,0,0,0|2,0,0]=4 4170 B10R1.4 NCCc1c[n]ccc1F Amb25721852 [1,1,0,0,0,0|2,0,0]=4 4171 B10R1.4 NCCc1cc[n]cc1Cl Amb23596506 [1,1,0,0,0,0|2,0,0]=4 4172 B10R1.4 NCCc1cc[n]cc1F Amb24383725 [1,1,0,0,0,0|2,0,0]=4 4173 B10R1.4 NCCc1cc[n]cc1O Amb24357020 [1,1,0,0,0,0|2,0,0]=4 4174 B10R1.4 NCCc1ccc[n]c1Br Amb25190186 [1,1,0,0,0,0|2,0,0]=4 4175 B10R1.4 NCCc1ccc[n]c1Cl Amb24551153 [1,1,0,0,0,0|2,0,0]=4 4176 B10R1.4 NCCc1ccc[n]c1F Amb24062493 [1,1,0,0,0,0|2,0,0]=4 4177 B10R1.4 NCCc1ccccc1Br Amb22395128 [1,1,0,0,0,0|1,0,0]=3 4178 B10R1.4 NCCc1ccccc1C Amb1212557 [1,1,0,0,0,0|1,0,0]=3 4179 B10R1.4 NCCc1ccccc1Cl Amb22490604 [1,1,0,0,0,0|1,0,0]=3 4180 B10R1.4 NCCc1ccccc1F Amb22039505 [1,1,0,0,0,0|1,0,0]=3 4181 B10R1.4 NCCc1ccccc1O Amb10609215 [1,1,0,0,0,0|1,0,0]=3 4182 B10R1.4 NCCc1ccccc1S Amb25831177 [1,1,0,0,0,0|1,0,0]=3 4183 B10R1.4 NCCc1ncccc1C Amb1995200 [1,1,0,0,0,0|2,0,0]=4 4184 B10R1.4 NCOc1ccccc1O Amb24502152 [1,1,0,0,0,0|2,0,0]=4 4185 B10R1.4 NNCc1ccccc1Br Amb1116234 [1,1,0,0,0,0|2,0,0]=4 4186 B10R1.4 NNCc1ccccc1Br Amb19893262 [1,1,0,0,0,0|2,0,0]=4 4187 B10R1.4 NNCc1ccccc1C Amb1118964 [1,1,0,0,0,0|2,0,0]=4 4188 B10R1.4 NNCc1ccccc1Cl Amb21959997 [1,1,0,0,0,0|2,0,0]=4 4189 B10R1.4 NNCc1ccccc1F Amb19893256 [1,1,0,0,0,0|2,0,0]=4 4190 B10R1.4 NNCc1ccccc1O Amb24681968 [1,1,0,0,0,0|2,0,0]=4 4191 B10R1.4 NOCc1ccccc1Br Amb17091454 [1,1,0,0,0,0|2,0,0]=4 4192 B10R1.4 NOCc1ccccc1Br Amb21929112 [1,1,0,0,0,0|2,0,0]=4 4193 B10R1.4 NOCc1ccccc1C Amb17091424 [1,1,0,0,0,0|2,0,0]=4 4194 B10R1.4 NOCc1ccccc1Cl Amb19889789 [1,1,0,0,0,0|2,0,0]=4 4195 B10R1.4 NOCc1ccccc1F Amb19894376 [1,1,0,0,0,0|2,0,0]=4 4196 B10R1.4 NOCc1ccccc1I Amb22235087 [1,1,0,0,0,0|2,0,0]=4 4197 B10R1.4 NOCc1ccccc1O Amb24502260 [1,1,0,0,0,0|2,0,0]=4 4198 B10R1.4 Nc1[n]cccc1CCN Amb25714008 [1,1,0,0,0,0|2,0,0]=4 4199 B10R1.4 Nc1[n]cccc1CCO Amb21858404 [1,1,0,0,0,0|1,0,0]=3 4200 B10R1.4 Nc1c[n]ccc1CCN Amb22491934 [1,1,0,0,0,0|2,0,0]=4 4201 B10R1.4 Nc1c[n]ccc1CCO Amb25291562 [1,1,0,0,0,0|1,0,0]=3 4202 B10R1.4 Nc1cc[n]cc1CCCl Amb25027844 [1,1,0,0,0,0|2,0,0]=4 4203 B10R1.4 Nc1cc[n]cc1CCN Amb25063861 [1,1,0,0,0,0|2,0,0]=4 4204 B10R1.4 Nc1cc[n]cc1CCO Amb24062498 [1,1,0,0,0,0|1,0,0]=3 4205 B10R1.4 Nc1ccccc1CCBr Amb24079731 [1,1,0,0,0,0|1,0,0]=3 4206 B10R1.4 Nc1ccccc1CCBr Amb24573051 [1,1,0,0,0,0|1,0,0]=3 4207 B10R1.4 Nc1ccccc1CCF Amb24554505 [1,1,0,0,0,0|1,0,0]=3 4208 B10R1.4 Nc1ccccc1CCN Amb20670599 [1,1,0,0,0,0|1,0,0]=3 4209 B10R1.4 Nc1ccccc1CCP Amb25808564 [1,1,0,0,0,0|1,0,0]=3 4210 B10R1.4 Nc1ccccc1CCS Amb25114690 [1,1,0,0,0,0|0,1,0]=3 4211 B10R1.4 Nc1ccccc1CNN Amb25294794 [1,1,0,0,0,0|2,0,0]=4 4212 B10R1.4 Nc1ccccc1CNO Amb25345206 [1,1,0,0,0,0|1,0,0]=3 4213 B10R1.4 Nc1ccccc1OCF Amb25112317 [1,1,0,0,0,0|2,0,0]=4 4214 B10R1.4 Nc1ccccc1SCCl Amb25720293 [1,1,0,0,0,0|2,0,0]=4 4215 B10R1.4 O=C1C=CC=CN1CCBr Amb19514604 [1,1,0,0,0,0|2,0,0]=4 4216 B10R1.4 O=C1C=CC=CN1CCCl Amb18787739 [1,1,0,0,0,0|2,0,0]=4 4217 B10R1.4 O=CCc1ccccc1Br Amb18634182 [1,1,0,0,0,0|0,0,2]=4 4218 B10R1.4 O=CCc1ccccc1C Amb10844840 [1,1,0,0,0,0|0,0,2]=4 4219 B10R1.4 O=CCc1ccccc1Cl Amb16230448 [1,1,0,0,0,0|0,0,2]=4 4220 B10R1.4 O=CCc1ccccc1F Amb10844839 [1,1,0,0,0,0|0,0,2]=4 4221 B10R1.4 O=CCc1ccccc1I Amb25377055 [1,1,0,0,0,0|0,0,2]=4 4222 B10R1.4 O=c1cccc[n]1CCCl Amb22274576 [1,1,0,0,0,0|2,0,0]=4 4223 B10R1.4 OCCN1C=CC=CC1=O Amb18041231 [1,1,0,0,0,0|1,0,0]=3 4224 B10R1.4 OCCN1C=CC=CC1=S Amb25065240 [1,1,0,0,0,0|1,0,0]=3 4225 B10R1.4 OCCN1C=NC=CC1=O Amb25263218 [1,1,0,0,0,0|2,0,0]=4 4226 B10R1.4 OCCN1N=CC=CC1=O Amb24591459 [1,1,0,0,0,0|2,0,0]=4 4227 B10R1.4 OCCc1[n]cccc1Br Amb22896751 [1,1,0,0,0,0|1,0,0]=3 4228 B10R1.4 OCCc1c[n]ccc1Cl Amb24364650 [1,1,0,0,0,0|1,0,0]=3 4229 B10R1.4 OCCc1cc[n]cc1Br Amb24482101 [1,1,0,0,0,0|1,0,0]=3 4230 B10R1.4 OCCc1cc[n]cc1F Amb25776747 [1,1,0,0,0,0|1,0,0]=3 4231 B10R1.4 OCCc1ccc[n]c1F Amb24513826 [1,1,0,0,0,0|1,0,0]=3 4232 B10R1.4 OCCc1ccccc1I Amb22753529 [1,1,0,0,0,0|0,0,0]=2 4233 B10R1.4 OCCc1ccccc1S Amb24672563 [1,1,0,0,0,0|0,0,0]=2 4234 B10R1.4 ONCc1ccc[n]c1Cl Amb21847006 [1,1,0,0,0,0|2,0,0]=4 4235 B10R1.4 ONCc1ccccc1Br Amb23449448 [1,1,0,0,0,0|1,0,0]=3 4236 B10R1.4 ONCc1ccccc1Cl Amb25729506 [1,1,0,0,0,0|1,0,0]=3 4237 B10R1.4 O\N=C/c1ccccc1Br Amb25247795 [1,1,0,0,0,0|1,0,1]=4 4238 B10R1.4 O\N=C\c1ccccc1Br Amb1152031 [1,1,0,0,0,0|1,0,1]=4 4239 B10R1.4 O\N=C\c1ccccc1C Amb1647706 [1,1,0,0,0,0|1,0,1]=4 4240 B10R1.4 O\N=C\c1ccccc1Cl Amb1152026 [1,1,0,0,0,0|1,0,1]=4 4241 B10R1.4 O\N=C\c1ccccc1F Amb1152952 [1,1,0,0,0,0|1,0,1]=4 4242 B10R1.4 O\N=C\c1ccccc1I Amb1782090 [1,1,0,0,0,0|1,0,1]=4 4243 B10R1.4 O\N=C\c1ccccc1O Amb1159212 [1,1,0,0,0,0|1,0,1]=4 4244 B10R1.4 Oc1[n]c[n]cc1CCO Amb24063132 [1,1,0,0,0,0|2,0,0]=4 4245 B10R1.4 Oc1ccc[n]c1CCO Amb24062095 [1,1,0,0,0,0|1,0,0]=3 4246 B10R1.4 Oc1ccccc1CCBr Amb18130684 [1,1,0,0,0,0|1,0,0]=3 4247 B10R1.4 Oc1ccccc1CCCl Amb25790019 [1,1,0,0,0,0|1,0,0]=3 4248 B10R1.4 Oc1ccccc1CCF Amb25768394 [1,1,0,0,0,0|1,0,0]=3 4249 B10R1.4 Oc1ccccc1CCI Amb25208761 [1,1,0,0,0,0|1,0,0]=3 4250 B10R1.4 Oc1ccccc1CCS Amb24362789 [1,1,0,0,0,0|0,1,0]=3 4251 B10R1.4 Oc1ccccc1CNO Amb25128279 [1,1,0,0,0,0|1,0,0]=3 4252 B10R1.4 Oc1ccccc1OCS Amb25070463 [1,1,0,0,0,0|1,1,0]=4 4253 B10R1.4 SCCc1ccccc1Br Amb25851259 [1,1,0,0,0,0|0,1,0]=3 4254 B10R1.4 SCCc1ccccc1C Amb17399938 [1,1,0,0,0,0|0,1,0]=3 4255 B10R1.4 SCCc1ccccc1Cl Amb17400374 [1,1,0,0,0,0|0,1,0]=3 4256 B10R1.4 SCCc1ccccc1F Amb17400004 [1,1,0,0,0,0|0,1,0]=3 4257 B10R1.4 SCCc1ccccc1I Amb24089655 [1,1,0,0,0,0|0,1,0]=3 4258 B10R1.4 [NH3+]OCc1ccccc1Br Amb2414824 [1,1,0,0,0,0|2,0,0]=4 4259 B10R1.4 [NH3+]OCc1ccccc1Cl Amb2437206 [1,1,0,0,0,0|2,0,0]=4 4260 B10R1.10 BrCCc1cc(I)ccc1 Amb25137377 [1,1,0,0,0,0|1,0,0]=3 4261 B10R1.10 Br[Zn]Cc1cccc(I)c1 Amb22000468 [1,1,0,0,0,0|2,0,0]=4 4262 B10R1.10 Brc1c[n]cc(CCBr)c1 Amb25147780 [1,1,0,0,0,0|2,0,0]=4 4263 B10R1.10 Brc1cccc(CCBr)c1 Amb18048758 [1,1,0,0,0,0|1,0,0]=3 4264 B10R1.10 Brc1cccc(C[Mg]Br)c1 Amb22000537 [1,1,0,0,0,0|2,0,0]=4 4265 B10R1.10 Brc1cccc(C[Zn]Br)c1 Amb22000431 [1,1,0,0,0,0|2,0,0]=4 4266 B10R1.10 C=CCc1cccc(N)c1 Amb25147344 [1,1,0,0,0,0|0,0,2]=4 4267 B10R1.10 C=CCc1cccc(O)c1 Amb22735821 [1,1,0,0,0,0|0,0,2]=4 4268 B10R1.10 CC#Cc1cc(Br)ccc1 Amb22491725 [1,1,0,0,0,0|0,0,2]=4 4269 B10R1.10 CC#Cc1cc(N)ccc1 Amb24085142 [1,1,0,0,0,0|0,0,2]=4 4270 B10R1.10 CC#Cc1cc(O)ccc1 Amb24102493 [1,1,0,0,0,0|0,0,2]=4 4271 B10R1.10 CCCC1=CC(=O)C=CO1 Amb25262571 [1,1,0,0,0,0|1,0,0]=3 4272 B10R1.10 CCCC1=CC(=O)NC=N1 Amb20259665 [1,1,0,0,0,0|2,0,0]=4 4273 B10R1.10 CCCC1=CC=CC(=S)N1 Amb25081453 [1,1,0,0,0,0|1,0,0]=3 4274 B10R1.10 CCC[n+]1cc(C)ccc1 Amb24451271 [1,1,0,0,0,0|1,0,0]=3 4275 B10R1.10 CCC[n+]1cc(O)ccc1 Amb25134204 [1,1,0,0,0,0|1,0,0]=3 4276 B10R1.10 CCCc1cc(Br)c[n]c1 Amb20617637 [1,1,0,0,0,0|1,0,0]=3 4277 B10R1.10 CCCc1cc(Br)ccc1 Amb25736130 [1,1,0,0,0,0|0,0,0]=2 4278 B10R1.10 CCCc1cc(Br)ccn1 Amb10599773 [1,1,0,0,0,0|1,0,0]=3 4279 B10R1.10 CCCc1cc(Br)ncn1 Amb10600013 [1,1,0,0,0,0|2,0,0]=4 4280 B10R1.10 CCCc1cc(Cl)c[n]c1 Amb20620848 [1,1,0,0,0,0|1,0,0]=3 4281 B10R1.10 CCCc1cc(Cl)cc[n]1 Amb22756169 [1,1,0,0,0,0|1,0,0]=3 4282 B10R1.10 CCCc1cc(F)cc[n]1 Amb24318797 [1,1,0,0,0,0|1,0,0]=3 4283 B10R1.10 CCCc1cc(F)ccc1 Amb22235098 [1,1,0,0,0,0|0,0,0]=2 4284 B10R1.10 CCCc1cc(I)[n]c[n]1 Amb24632348 [1,1,0,0,0,0|2,0,0]=4 4285 B10R1.10 CCCc1cc(N)[n]cc1 Amb22491555 [1,1,0,0,0,0|1,0,0]=3 4286 B10R1.10 CCCc1cc(N)c[n]c1 Amb18832432 [1,1,0,0,0,0|1,0,0]=3 4287 B10R1.10 CCCc1cc(N)ccc1 Amb18643014 [1,1,0,0,0,0|0,0,0]=2 4288 B10R1.10 CCCc1cc(N)ccn1 Amb10599774 [1,1,0,0,0,0|1,0,0]=3 4289 B10R1.10 CCCc1cc(N)ncn1 Amb10600014 [1,1,0,0,0,0|2,0,0]=4 4290 B10R1.10 CCCc1cc(O)c[n]c1 Amb20617709 [1,1,0,0,0,0|1,0,0]=3 4291 B10R1.10 CCCc1cc(O)ccn1 Amb10599775 [1,1,0,0,0,0|1,0,0]=3 4292 B10R1.10 CCCc1cc(S)[n]c[n]1 Amb18787529 [1,1,0,0,0,0|2,0,0]=4 4293 B10R1.10 CCCc1cccc(F)[n]1 Amb24319133 [1,1,0,0,0,0|1,0,0]=3 4294 B10R1.10 CCCc1cccc(n1)Br Amb10600122 [1,1,0,0,0,0|1,0,0]=3 4295 B10R1.10 CCCc1cccc(n1)O Amb10600153 [1,1,0,0,0,0|1,0,0]=3 4296 B10R1.10 CCCc1ccnc(c1)Br Amb10599856 [1,1,0,0,0,0|1,0,0]=3 4297 B10R1.10 CCCc1ccnc(c1)O Amb10599858 [1,1,0,0,0,0|1,0,0]=3 4298 B10R1.10 CCCc1ccnc(n1)Br Amb13884146 [1,1,0,0,0,0|2,0,0]=4 4299 B10R1.10 CCCc1ccnc(n1)Cl Amb10068234 [1,1,0,0,0,0|2,0,0]=4 4300 B10R1.10 CCCc1ccnc(n1)N Amb13884387 [1,1,0,0,0,0|2,0,0]=4 4301 B10R1.10 CCCc1ccnc(n1)O Amb13884388 [1,1,0,0,0,0|2,0,0]=4 4302 B10R1.10 CCCc1cncc(n1)Br Amb10600317 [1,1,0,0,0,0|2,0,0]=4 4303 B10R1.10 CCCc1cncc(n1)N Amb10600319 [1,1,0,0,0,0|2,0,0]=4 4304 B10R1.10 CCCc1cncc(n1)O Amb10600320 [1,1,0,0,0,0|2,0,0]=4 4305 B10R1.10 CCCc1nccc(n1)Br Amb10599367 [1,1,0,0,0,0|2,0,0]=4 4306 B10R1.10 CCCc1nccc(n1)N Amb10599369 [1,1,0,0,0,0|2,0,0]=4 4307 B10R1.10 CCCc1nccc(n1)O Amb10599370 [1,1,0,0,0,0|2,0,0]=4 4308 B10R1.10 CCNc1c[n]cc(Br)c1 Amb23450116 [1,1,0,0,0,0|2,0,0]=4 4309 B10R1.10 CCNc1c[n]cc(F)c1 Amb25357603 [1,1,0,0,0,0|2,0,0]=4 4310 B10R1.10 CCNc1c[n]cc(N)c1 Amb25331613 [1,1,0,0,0,0|2,0,0]=4 4311 B10R1.10 CCNc1cc(Cl)ccn1 Amb15692076 [1,1,0,0,0,0|2,0,0]=4 4312 B10R1.10 CCNc1cc(F)cc[n]1 Amb24703961 [1,1,0,0,0,0|2,0,0]=4 4313 B10R1.10 CCNc1cc(N)ccn1 Amb17334158 [1,1,0,0,0,0|2,0,0]=4 4314 B10R1.10 CCNc1cc(O)ccc1 Amb22168804 [1,1,0,0,0,0|1,0,0]=3 4315 B10R1.10 CCNc1cc[n]c(Br)c1 Amb24534676 [1,1,0,0,0,0|2,0,0]=4 4316 B10R1.10 CCNc1cc[n]c(F)c1 Amb25107899 [1,1,0,0,0,0|2,0,0]=4 4317 B10R1.10 CCNc1cccc(Br)[n]1 Amb22271124 [1,1,0,0,0,0|2,0,0]=4 4318 B10R1.10 CCNc1cccc(Br)[n]1 Amb22411595 [1,1,0,0,0,0|2,0,0]=4 4319 B10R1.10 CCNc1cccc(Cl)[n]1 Amb21956629 [1,1,0,0,0,0|2,0,0]=4 4320 B10R1.10 CCNc1cccc(F)[n]1 Amb18951804 [1,1,0,0,0,0|2,0,0]=4 4321 B10R1.10 CCNc1cccc(N)[n]1 Amb25147360 [1,1,0,0,0,0|2,0,0]=4 4322 B10R1.10 CCNc1cccc(c1)F Amb10609458 [1,1,0,0,0,0|1,0,0]=3 4323 B10R1.10 CCNc1cccc(n1)C Amb10553057 [1,1,0,0,0,0|2,0,0]=4 4324 B10R1.10 CCNc1ccnc(c1)Cl Amb13952186 [1,1,0,0,0,0|2,0,0]=4 4325 B10R1.10 CCOc1c[n+]([O-])ccc1 Amb25206359 [1,1,0,0,0,0|2,0,0]=4 4326 B10R1.10 CCOc1c[n]cc(Cl)c1 Amb20242819 [1,1,0,0,0,0|2,0,0]=4 4327 B10R1.10 CCOc1c[n]cc(F)c1 Amb24085977 [1,1,0,0,0,0|2,0,0]=4 4328 B10R1.10 CCOc1c[n]cc(O)c1 Amb23455720 [1,1,0,0,0,0|2,0,0]=4 4329 B10R1.10 CCOc1cc(Br)ccn1 Amb10576613 [1,1,0,0,0,0|2,0,0]=4 4330 B10R1.10 CCOc1cc(Cl)cc[n]1 Amb19957988 [1,1,0,0,0,0|2,0,0]=4 4331 B10R1.10 CCOc1cc(F)cc[n]1 Amb24317829 [1,1,0,0,0,0|2,0,0]=4 4332 B10R1.10 CCOc1cc(I)cc[n]1 Amb22498330 [1,1,0,0,0,0|2,0,0]=4 4333 B10R1.10 CCOc1cc(O)cc[n]1 Amb21857254 [1,1,0,0,0,0|2,0,0]=4 4334 B10R1.10 CCOc1cccc(Cl)c1 Amb20242486 [1,1,0,0,0,0|1,0,0]=3 4335 B10R1.10 CCOc1cccc(F)[n]1 Amb22641531 [1,1,0,0,0,0|2,0,0]=4 4336 B10R1.10 CCOc1cccc(I)[n]1 Amb25725603 [1,1,0,0,0,0|2,0,0]=4 4337 B10R1.10 CCOc1cccc(I)c1 Amb19196001 [1,1,0,0,0,0|1,0,0]=3 4338 B10R1.10 CCOc1cccc(c1)N Amb1124598 [1,1,0,0,0,0|1,0,0]=3 4339 B10R1.10 CCOc1cccc(c1)S Amb10070967 [1,1,0,0,0,0|1,0,0]=3 4340 B10R1.10 CCOc1ccnc(c1)F Amb15691032 [1,1,0,0,0,0|2,0,0]=4 4341 B10R1.10 CCOc1cncc(c1)Br Amb15691049 [1,1,0,0,0,0|2,0,0]=4 4342 B10R1.10 CCSc1cc(Cl)cc[n]1 Amb22276362 [1,1,0,0,0,0|2,0,0]=4 4343 B10R1.10 CCSc1cc(N)cc[n]1 Amb18956447 [1,1,0,0,0,0|2,0,0]=4 4344 B10R1.10 CCSc1cc[n]c(Br)c1 Amb25178860 [1,1,0,0,0,0|2,0,0]=4 4345 B10R1.10 CCSc1cc[n]c(Cl)c1 Amb19149189 [1,1,0,0,0,0|2,0,0]=4 4346 B10R1.10 CCSc1cc[n]c(N)c1 Amb25065714 [1,1,0,0,0,0|2,0,0]=4 4347 B10R1.10 CCSc1cccc(Cl)[n]1 Amb24476954 [1,1,0,0,0,0|2,0,0]=4 4348 B10R1.10 CCSc1cccc(F)[n]1 Amb18787681 [1,1,0,0,0,0|2,0,0]=4 4349 B10R1.10 CCSc1cccc(F)c1 Amb25063729 [1,1,0,0,0,0|1,0,0]=3 4350 B10R1.10 CCSc1cccc(I)c1 Amb25162722 [1,1,0,0,0,0|1,0,0]=3 4351 B10R1.10 CCSc1cccc(N)c1 Amb18950176 [1,1,0,0,0,0|1,0,0]=3 4352 B10R1.10 CCSc1cccc(O)[n]1 Amb18644748 [1,1,0,0,0,0|2,0,0]=4 4353 B10R1.10 CCSc1cccc(O)c1 Amb18644674 [1,1,0,0,0,0|1,0,0]=3 4354 B10R1.10 CCSc1cccc(c1)Br Amb10067418 [1,1,0,0,0,0|1,0,0]=3 4355 B10R1.10 CNCC=1C=CNC(=O)C1 Amb24480892 [1,1,0,0,0,0|2,0,0]=4 4356 B10R1.10 CNCc1c[n]cc(Cl)c1 Amb25794074 [1,1,0,0,0,0|2,0,0]=4 4357 B10R1.10 CNCc1c[n]cc(F)c1 Amb25146397 [1,1,0,0,0,0|2,0,0]=4 4358 B10R1.10 CNCc1cc(Br)cc[n]1 Amb22388571 [1,1,0,0,0,0|2,0,0]=4 4359 B10R1.10 CNCc1cc(Cl)cc[n]1 Amb22728627 [1,1,0,0,0,0|2,0,0]=4 4360 B10R1.10 CNCc1cc(F)cc[n]1 Amb25749043 [1,1,0,0,0,0|2,0,0]=4 4361 B10R1.10 CNCc1cc(N)cc[n]1 Amb25062940 [1,1,0,0,0,0|2,0,0]=4 4362 B10R1.10 CNCc1cc[n]c(Br)c1 Amb21861694 [1,1,0,0,0,0|2,0,0]=4 4363 B10R1.10 CNCc1cc[n]c(Br)c1 Amb22293882 [1,1,0,0,0,0|2,0,0]=4 4364 B10R1.10 CNCc1cc[n]c(N)c1 Amb24099580 [1,1,0,0,0,0|2,0,0]=4 4365 B10R1.10 CNCc1cccc(Br)c1 Amb17935918 [1,1,0,0,0,0|1,0,0]=3 4366 B10R1.10 CNCc1cccc(Cl)[n]1 Amb24340482 [1,1,0,0,0,0|2,0,0]=4 4367 B10R1.10 CNCc1cccc(Cl)c1 Amb19958745 [1,1,0,0,0,0|1,0,0]=3 4368 B10R1.10 CNCc1cccc(I)c1 Amb23569027 [1,1,0,0,0,0|1,0,0]=3 4369 B10R1.10 CNCc1cccc(O)c1 Amb19115406 [1,1,0,0,0,0|1,0,0]=3 4370 B10R1.10 CNCc1cccc(c1)Br Amb1114712 [1,1,0,0,0,0|1,0,0]=3 4371 B10R1.10 CNCc1cccc(c1)C Amb1116082 [1,1,0,0,0,0|1,0,0]=3 4372 B10R1.10 CNCc1cccc(c1)Cl Amb1648830 [1,1,0,0,0,0|1,0,0]=3 4373 B10R1.10 CNCc1cccc(c1)F Amb1647905 [1,1,0,0,0,0|1,0,0]=3 4374 B10R1.10 CNCc1cccc(c1)O Amb1131158 [1,1,0,0,0,0|1,0,0]=3 4375 B10R1.10 CNCc1ccnc(c1)C Amb10607835 [1,1,0,0,0,0|2,0,0]=4 4376 B10R1.10 CNCc1nccc(c1)C Amb16230499 [1,1,0,0,0,0|2,0,0]=4 4377 B10R1.10 COCc1c[n]cc(Br)c1 Amb22235600 [1,1,0,0,0,0|2,0,0]=4 4378 B10R1.10 COCc1c[n]cc(N)c1 Amb24083192 [1,1,0,0,0,0|2,0,0]=4 4379 B10R1.10 COCc1cc(Br)cc[n]1 Amb24320753 [1,1,0,0,0,0|2,0,0]=4 4380 B10R1.10 COCc1cc(O)cc[n]1 Amb18643363 [1,1,0,0,0,0|2,0,0]=4 4381 B10R1.10 COCc1cc[n]c(Br)c1 Amb20618631 [1,1,0,0,0,0|2,0,0]=4 4382 B10R1.10 COCc1cc[n]c(Cl)c1 Amb18799911 [1,1,0,0,0,0|2,0,0]=4 4383 B10R1.10 COCc1cc[n]c(N)c1 Amb18961777 [1,1,0,0,0,0|2,0,0]=4 4384 B10R1.10 COCc1cccc(Br)[n]1 Amb24320754 [1,1,0,0,0,0|2,0,0]=4 4385 B10R1.10 COCc1cccc(Br)c1 Amb18320155 [1,1,0,0,0,0|1,0,0]=3 4386 B10R1.10 COCc1cccc(Cl)[n]1 Amb24587891 [1,1,0,0,0,0|2,0,0]=4 4387 B10R1.10 COCc1cccc(Cl)c1 Amb24092696 [1,1,0,0,0,0|1,0,0]=3 4388 B10R1.10 COCc1cccc(F)c1 Amb20241023 [1,1,0,0,0,0|1,0,0]=3 4389 B10R1.10 COCc1cccc(I)c1 Amb24478076 [1,1,0,0,0,0|1,0,0]=3 4390 B10R1.10 COCc1cccc(N)[n]1 Amb24375965 [1,1,0,0,0,0|2,0,0]=4 4391 B10R1.10 COCc1cccc(O)c1 Amb19301751 [1,1,0,0,0,0|1,0,0]=3 4392 B10R1.10 CSCc1c[n]cc(Br)c1 Amb25146928 [1,1,0,0,0,0|2,0,0]=4 4393 B10R1.10 CSCc1c[n]cc(F)c1 Amb25712657 [1,1,0,0,0,0|2,0,0]=4 4394 B10R1.10 CSCc1cc[n]c(Br)c1 Amb25237261 [1,1,0,0,0,0|2,0,0]=4 4395 B10R1.10 CSCc1cc[n]c(Cl)c1 Amb18185802 [1,1,0,0,0,0|2,0,0]=4 4396 B10R1.10 CSCc1cc[n]c(N)c1 Amb18284923 [1,1,0,0,0,0|2,0,0]=4 4397 B10R1.10 CSCc1cccc(Br)c1 Amb22058705 [1,1,0,0,0,0|1,0,0]=3 4398 B10R1.10 CSCc1cccc(F)[n]1 Amb25267924 [1,1,0,0,0,0|2,0,0]=4 4399 B10R1.10 CSCc1cccc(N)c1 Amb18951026 [1,1,0,0,0,0|1,0,0]=3 4400 B10R1.10 CSCc1cccc(O)c1 Amb23443323 [1,1,0,0,0,0|1,0,0]=3 4401 B10R1.10 CSSc1cc(O)ccc1 Amb25102858 [1,1,0,0,0,0|2,0,0]=4 4402 B10R1.10 C[n+]1cc(CCF)ccc1 Amb24759041 [1,1,0,0,0,0|2,0,0]=4 4403 B10R1.10 C\C=C\c1cccc(O)c1 Amb18124427 [1,1,0,0,0,0|0,0,2]=4 4404 B10R1.10 C\N=C\c1cccc(O)c1 Amb19115409 [1,1,0,0,0,0|1,0,1]=4 4405 B10R1.10 Cc1[n]c(CCC)cc[n]1 Amb24084783 [1,1,0,0,0,0|2,0,0]=4 4406 B10R1.10 Cc1[n]c(CCO)cc[n]1 Amb25857537 [1,1,0,0,0,0|2,0,0]=4 4407 B10R1.10 Cc1c[n+](CCF)ccc1 Amb25762734 [1,1,0,0,0,0|2,0,0]=4 4408 B10R1.10 Cc1c[n]cc(CNC)c1 Amb24353440 [1,1,0,0,0,0|2,0,0]=4 4409 B10R1.10 Cc1c[n]cc(CSC)c1 Amb25086272 [1,1,0,0,0,0|2,0,0]=4 4410 B10R1.10 Cc1c[n]cc(c1)NCC Amb24480940 [1,1,0,0,0,0|2,0,0]=4 4411 B10R1.10 Cc1c[n]cc(c1)OCC Amb24350527 [1,1,0,0,0,0|2,0,0]=4 4412 B10R1.10 Cc1cc(CCBr)c[n]c1 Amb24562207 [1,1,0,0,0,0|2,0,0]=4 4413 B10R1.10 Cc1cc(CCCl)[n]cc1 Amb24098630 [1,1,0,0,0,0|2,0,0]=4 4414 B10R1.10 Cc1cc(CCCl)c[n]c1 Amb25032253 [1,1,0,0,0,0|2,0,0]=4 4415 B10R1.10 Cc1cc(CCCl)ccc1 Amb18181942 [1,1,0,0,0,0|1,0,0]=3 4416 B10R1.10 Cc1cc(CCN)[n]cc1 Amb22899172 [1,1,0,0,0,0|2,0,0]=4 4417 B10R1.10 Cc1cc(CCN)c[n]c1 Amb18203095 [1,1,0,0,0,0|2,0,0]=4 4418 B10R1.10 Cc1cc(CCN)cc[n]1 Amb18203094 [1,1,0,0,0,0|2,0,0]=4 4419 B10R1.10 Cc1cc(CCN)ncc1 Amb1995201 [1,1,0,0,0,0|2,0,0]=4 4420 B10R1.10 Cc1cc(CCO)[n]cc1 Amb25679639 [1,1,0,0,0,0|1,0,0]=3 4421 B10R1.10 Cc1cc(CCO)cc[n]1 Amb24568116 [1,1,0,0,0,0|1,0,0]=3 4422 B10R1.10 Cc1cc(CNN)ccc1 Amb19890111 [1,1,0,0,0,0|2,0,0]=4 4423 B10R1.10 Cc1cc(CNO)ccc1 Amb25784359 [1,1,0,0,0,0|1,0,0]=3 4424 B10R1.10 Cc1cc(C[Zn]Cl)ccc1 Amb22000456 [1,1,0,0,0,0|2,0,0]=4 4425 B10R1.10 Cc1cc(\C=N\O)ccc1 Amb18041948 [1,1,0,0,0,0|1,0,1]=4 4426 B10R1.10 Cc1cc(cc[n]1)NCC Amb25110541 [1,1,0,0,0,0|2,0,0]=4 4427 B10R1.10 Cc1cc(cc[n]1)OCC Amb24687076 [1,1,0,0,0,0|2,0,0]=4 4428 B10R1.10 Cc1cc(ccc1)SCCl Amb24423887 [1,1,0,0,0,0|2,0,0]=4 4429 B10R1.10 Cc1cc[n]c(CCC)c1 Amb25844521 [1,1,0,0,0,0|1,0,0]=3 4430 B10R1.10 Cc1cc[n]c(c1)NCC Amb18283607 [1,1,0,0,0,0|2,0,0]=4 4431 B10R1.10 Cc1cc[n]c(c1)SCC Amb24480868 [1,1,0,0,0,0|2,0,0]=4 4432 B10R1.10 Cc1cccc(CCC)[n]1 Amb24065788 [1,1,0,0,0,0|1,0,0]=3 4433 B10R1.10 Cc1cccc(CCC)c1 Amb22232362 [1,1,0,0,0,0|0,0,0]=2 4434 B10R1.10 Cc1cccc(CCCl)[n]1 Amb24090268 [1,1,0,0,0,0|2,0,0]=4 4435 B10R1.10 Cc1cccc(CCCl)[n]1 Amb24480495 [1,1,0,0,0,0|2,0,0]=4 4436 B10R1.10 Cc1cccc(CCS)[n]1 Amb24388552 [1,1,0,0,0,0|1,1,0]=4 4437 B10R1.10 Cc1cccc(CNC)[n]1 Amb19374864 [1,1,0,0,0,0|2,0,0]=4 4438 B10R1.10 Cc1cccc(COC)[n]1 Amb22345867 [1,1,0,0,0,0|2,0,0]=4 4439 B10R1.10 Cc1cccc(CSC)c1 Amb24416576 [1,1,0,0,0,0|1,0,0]=3 4440 B10R1.10 Cc1cccc([n]1)SCC Amb24105686 [1,1,0,0,0,0|2,0,0]=4 4441 B10R1.10 Cc1cccc(c1)C#CC Amb24092690 [1,1,0,0,0,0|0,0,2]=4 4442 B10R1.10 Cc1cccc(c1)SCC Amb25328608 [1,1,0,0,0,0|1,0,0]=3 4443 B10R1.10 Cc1cccc(c1)\C=N\C Amb24524529 [1,1,0,0,0,0|1,0,1]=4 4444 B10R1.10 Cc1cccc(n1)CCN Amb1995202 [1,1,0,0,0,0|2,0,0]=4 4445 B10R1.10 ClCCc1cc(Br)ccc1 Amb24502263 [1,1,0,0,0,0|1,0,0]=3 4446 B10R1.10 ClCOc1cccc(I)c1 Amb25272062 [1,1,0,0,0,0|2,0,0]=4 4447 B10R1.10 ClCSc1cccc(Br)c1 Amb24479383 [1,1,0,0,0,0|2,0,0]=4 4448 B10R1.10 Clc1cccc(CCCl)c1 Amb18185798 [1,1,0,0,0,0|1,0,0]=3 4449 B10R1.10 Clc1cccc(C[Mg]Cl)c1 Amb19928782 [1,1,0,0,0,0|2,0,0]=4 4450 B10R1.10 Clc1cccc(C[Zn]Cl)c1 Amb22000428 [1,1,0,0,0,0|2,0,0]=4 4451 B10R1.10 Clc1cccc(c1)OCCl Amb24482267 [1,1,0,0,0,0|2,0,0]=4 4452 B10R1.10 FCCc1cccc(Br)[n]1 Amb25228145 [1,1,0,0,0,0|2,0,0]=4 4453 B10R1.10 Fc1cc(CCBr)c[n]c1 Amb25210409 [1,1,0,0,0,0|2,0,0]=4 4454 B10R1.10 Fc1cc(CCCl)c[n]c1 Amb18797759 [1,1,0,0,0,0|2,0,0]=4 4455 B10R1.10 Fc1cc(CCI)ccc1 Amb25766475 [1,1,0,0,0,0|1,0,0]=3 4456 B10R1.10 Fc1cc(ccc1)OCCl Amb24401502 [1,1,0,0,0,0|2,0,0]=4 4457 B10R1.10 Fc1cccc(C[Mg]Cl)c1 Amb17672020 [1,1,0,0,0,0|2,0,0]=4 4458 B10R1.10 Fc1cccc(C[Zn]Cl)c1 Amb17938200 [1,1,0,0,0,0|2,0,0]=4 4459 B10R1.10 N#CCc1cccc(c1)Br Amb1138679 [1,1,0,0,0,0|1,0,1]=4 4460 B10R1.10 N#CCc1cccc(c1)Cl Amb1651451 [1,1,0,0,0,0|1,0,1]=4 4461 B10R1.10 N#CCc1cccc(c1)N Amb1215231 [1,1,0,0,0,0|1,0,1]=4 4462 B10R1.10 NCCC1=CC(=O)NC=C1 Amb22277083 [1,1,0,0,0,0|2,0,0]=4 4463 B10R1.10 NCCC1=CC(=O)NC=C1 Amb22490205 [1,1,0,0,0,0|2,0,0]=4 4464 B10R1.10 NCCC1=CC(=O)NC=C1 Amb22899249 [1,1,0,0,0,0|2,0,0]=4 4465 B10R1.10 NCCC1=CC=CC(=O)N1 Amb22492307 [1,1,0,0,0,0|2,0,0]=4 4466 B10R1.10 NCCC1=CC=CC(=O)N1 Amb22587551 [1,1,0,0,0,0|2,0,0]=4 4467 B10R1.10 NCC[n+]1cc(O)ccc1 Amb24427344 [1,1,0,0,0,0|2,0,0]=4 4468 B10R1.10 NCCc1c[n](=O)ccc1 Amb20621202 [1,1,0,0,0,0|2,0,0]=4 4469 B10R1.10 NCCc1cc(Br)cc[n]1 Amb25839315 [1,1,0,0,0,0|2,0,0]=4 4470 B10R1.10 NCCc1cc(Br)ccc1 Amb22900947 [1,1,0,0,0,0|1,0,0]=3 4471 B10R1.10 NCCc1cc(Cl)[n]cc1 Amb22751657 [1,1,0,0,0,0|2,0,0]=4 4472 B10R1.10 NCCc1cc(Cl)ccc1 Amb22490605 [1,1,0,0,0,0|1,0,0]=3 4473 B10R1.10 NCCc1cc(F)c[n]c1 Amb18286591 [1,1,0,0,0,0|2,0,0]=4 4474 B10R1.10 NCCc1cc(I)ccc1 Amb25096322 [1,1,0,0,0,0|1,0,0]=3 4475 B10R1.10 NCCc1cc(O)c[n]c1 Amb25744014 [1,1,0,0,0,0|2,0,0]=4 4476 B10R1.10 NCCc1cc(O)cc[n]1 Amb24479633 [1,1,0,0,0,0|2,0,0]=4 4477 B10R1.10 NCCc1cccc(Br)[n]1 Amb21856983 [1,1,0,0,0,0|2,0,0]=4 4478 B10R1.10 NCCc1cccc(Br)[n]1 Amb21857736 [1,1,0,0,0,0|2,0,0]=4 4479 B10R1.10 NCCc1cccc(Cl)[n]1 Amb21857720 [1,1,0,0,0,0|2,0,0]=4 4480 B10R1.10 NCCc1cccc(Cl)[n]1 Amb21857735 [1,1,0,0,0,0|2,0,0]=4 4481 B10R1.10 NCCc1cccc(F)[n]1 Amb20669134 [1,1,0,0,0,0|2,0,0]=4 4482 B10R1.10 NCCc1cccc(c1)C Amb1126573 [1,1,0,0,0,0|1,0,0]=3 4483 B10R1.10 NCCc1cccc(c1)C Amb13952645 [1,1,0,0,0,0|1,0,0]=3 4484 B10R1.10 NCCc1cccc(c1)Cl Amb1212556 [1,1,0,0,0,0|1,0,0]=3 4485 B10R1.10 NCCc1cccc(c1)F Amb1216921 [1,1,0,0,0,0|1,0,0]=3 4486 B10R1.10 NCCc1cccc(n1)N Amb1100181 [1,1,0,0,0,0|2,0,0]=4 4487 B10R1.10 NCCc1ccnc(c1)O Amb10576299 [1,1,0,0,0,0|2,0,0]=4 4488 B10R1.10 NNCc1cccc(Br)c1 Amb19893263 [1,1,0,0,0,0|2,0,0]=4 4489 B10R1.10 NNCc1cccc(Br)c1 Amb20667747 [1,1,0,0,0,0|2,0,0]=4 4490 B10R1.10 NNCc1cccc(F)c1 Amb19893257 [1,1,0,0,0,0|2,0,0]=4 4491 B10R1.10 NNCc1cccc(F)c1 Amb20669586 [1,1,0,0,0,0|2,0,0]=4 4492 B10R1.10 NNCc1cccc(I)c1 Amb25355316 [1,1,0,0,0,0|2,0,0]=4 4493 B10R1.10 NNCc1cccc(c1)Br Amb1119246 [1,1,0,0,0,0|2,0,0]=4 4494 B10R1.10 NNCc1cccc(c1)C Amb1116333 [1,1,0,0,0,0|2,0,0]=4 4495 B10R1.10 NNCc1cccc(c1)Cl Amb1111798 [1,1,0,0,0,0|2,0,0]=4 4496 B10R1.10 NNCc1cccc(c1)Cl Amb13949121 [1,1,0,0,0,0|2,0,0]=4 4497 B10R1.10 NNCc1cccc(c1)F Amb1121411 [1,1,0,0,0,0|2,0,0]=4 4498 B10R1.10 NOCc1cccc(Br)c1 Amb22231355 [1,1,0,0,0,0|2,0,0]=4 4499 B10R1.10 NOCc1cccc(Cl)c1 Amb19889790 [1,1,0,0,0,0|2,0,0]=4 4500 B10R1.10 NOCc1cccc(F)c1 Amb19883930 [1,1,0,0,0,0|2,0,0]=4 4501 B10R1.10 NOCc1cccc(c1)Br Amb17091429 [1,1,0,0,0,0|2,0,0]=4 4502 B10R1.10 NOCc1cccc(c1)C Amb17091425 [1,1,0,0,0,0|2,0,0]=4 4503 B10R1.10 NOCc1cccc(c1)Cl Amb17091428 [1,1,0,0,0,0|2,0,0]=4 4504 B10R1.10 NOCc1cccc(c1)F Amb17091426 [1,1,0,0,0,0|2,0,0]=4 4505 B10R1.10 Nc1[n]c(CCO)cc[n]1 Amb24566497 [1,1,0,0,0,0|2,0,0]=4 4506 B10R1.10 Nc1c[n+](CCS)ccc1 Amb24695154 [1,1,0,0,0,0|1,1,0]=4 4507 B10R1.10 Nc1cc(CC#N)ccc1 Amb21857787 [1,1,0,0,0,0|1,0,1]=4 4508 B10R1.10 Nc1cc(CC=O)ccc1 Amb25147333 [1,1,0,0,0,0|0,0,2]=4 4509 B10R1.10 Nc1cc(CCCl)ccc1 Amb24748802 [1,1,0,0,0,0|1,0,0]=3 4510 B10R1.10 Nc1cc(CCN)cc[n]1 Amb25146265 [1,1,0,0,0,0|2,0,0]=4 4511 B10R1.10 Nc1cc(CCO)[n]cc1 Amb25027828 [1,1,0,0,0,0|1,0,0]=3 4512 B10R1.10 Nc1cc(CCO)cc[n]1 Amb25146377 [1,1,0,0,0,0|1,0,0]=3 4513 B10R1.10 Nc1cc(CCO)ccc1 Amb21857105 [1,1,0,0,0,0|0,0,0]=2 4514 B10R1.10 Nc1cc(CCS)ccc1 Amb22728749 [1,1,0,0,0,0|0,1,0]=3 4515 B10R1.10 Nc1cc[n]c(CCO)[n]1 Amb24583224 [1,1,0,0,0,0|2,0,0]=4 4516 B10R1.10 Nc1cccc(CCN)[n]1 Amb21959697 [1,1,0,0,0,0|2,0,0]=4 4517 B10R1.10 Nc1cccc(CCN)c1 Amb22733355 [1,1,0,0,0,0|1,0,0]=3 4518 B10R1.10 Nc1cccc(CCO)[n]1 Amb24401500 [1,1,0,0,0,0|1,0,0]=3 4519 B10R1.10 Nc1cccc(CCS)[n]1 Amb25835198 [1,1,0,0,0,0|1,1,0]=4 4520 B10R1.10 O=C1C=C(CCCl)C=CN1 Amb25097138 [1,1,0,0,0,0|2,0,0]=4 4521 B10R1.10 O=C1C=C(CCCl)C=CO1 Amb25060579 [1,1,0,0,0,0|2,0,0]=4 4522 B10R1.10 O=CCc1cccc(F)c1 Amb19929928 [1,1,0,0,0,0|0,0,2]=4 4523 B10R1.10 O=CCc1cccc(c1)Br Amb16230449 [1,1,0,0,0,0|0,0,2]=4 4524 B10R1.10 O=CCc1cccc(c1)C Amb16230453 [1,1,0,0,0,0|0,0,2]=4 4525 B10R1.10 O=CCc1cccc(c1)Cl Amb10844835 [1,1,0,0,0,0|0,0,2]=4 4526 B10R1.10 O=CCc1cccc(c1)O Amb17089543 [1,1,0,0,0,0|0,0,2]=4 4527 B10R1.10 OCCC=1C=CNC(=O)N1 Amb24639313 [1,1,0,0,0,0|2,0,0]=4 4528 B10R1.10 OCC[n+]1cc(S)ccc1 Amb25831912 [1,1,0,0,0,0|1,0,0]=3 4529 B10R1.10 OCC[n+]1cccc(c1)C Amb10553046 [1,1,0,0,0,0|1,0,0]=3 4530 B10R1.10 OCCc1cc(Br)[n]cc1 Amb25773220 [1,1,0,0,0,0|1,0,0]=3 4531 B10R1.10 OCCc1cc(Br)c[n]c1 Amb25114229 [1,1,0,0,0,0|1,0,0]=3 4532 B10R1.10 OCCc1cc(Br)cc[n]1 Amb24065849 [1,1,0,0,0,0|1,0,0]=3 4533 B10R1.10 OCCc1cc(Cl)[n]cc1 Amb22754705 [1,1,0,0,0,0|1,0,0]=3 4534 B10R1.10 OCCc1cc(F)cc[n]1 Amb25032462 [1,1,0,0,0,0|1,0,0]=3 4535 B10R1.10 OCCc1cc(I)ccc1 Amb24524319 [1,1,0,0,0,0|0,0,0]=2 4536 B10R1.10 OCCc1cccc(F)[n]1 Amb25076783 [1,1,0,0,0,0|1,0,0]=3 4537 B10R1.10 OCCc1cccc(n1)Br Amb13883481 [1,1,0,0,0,0|1,0,0]=3 4538 B10R1.10 OCNc1cccc(Cl)c1 Amb25804223 [1,1,0,0,0,0|1,0,0]=3 4539 B10R1.10 ONCc1cccc(Br)[n]1 Amb24647347 [1,1,0,0,0,0|2,0,0]=4 4540 B10R1.10 ONCc1cccc(Br)c1 Amb23449439 [1,1,0,0,0,0|1,0,0]=3 4541 B10R1.10 ONCc1cccc(Cl)c1 Amb25210787 [1,1,0,0,0,0|1,0,0]=3 4542 B10R1.10 O\N=C\c1cccc(c1)Cl Amb1776533 [1,1,0,0,0,0|1,0,1]=4 4543 B10R1.10 O\N=C\c1cccc(c1)F Amb1152958 [1,1,0,0,0,0|1,0,1]=4 4544 B10R1.10 O\N=C\c1cccc(c1)I Amb1831123 [1,1,0,0,0,0|1,0,1]=4 4545 B10R1.10 Oc1c[n]cc(CCO)c1 Amb24757058 [1,1,0,0,0,0|1,0,0]=3 4546 B10R1.10 Oc1cc(CCBr)ccc1 Amb18130690 [1,1,0,0,0,0|1,0,0]=3 4547 B10R1.10 Oc1cc(CCO)[n]c[n]1 Amb25377230 [1,1,0,0,0,0|2,0,0]=4 4548 B10R1.10 Oc1cc(ccc1)OCBr Amb24099888 [1,1,0,0,0,0|2,0,0]=4 4549 B10R1.10 Oc1cc(ccc1)SCCl Amb24368844 [1,1,0,0,0,0|2,0,0]=4 4550 B10R1.10 Oc1cc[n]c(CCO)[n]1 Amb24454001 [1,1,0,0,0,0|2,0,0]=4 4551 B10R1.10 Oc1cc[n]c(CCO)c1 Amb24544455 [1,1,0,0,0,0|1,0,0]=3 4552 B10R1.10 Oc1cccc(CNO)c1 Amb24524626 [1,1,0,0,0,0|1,0,0]=3 4553 B10R1.10 Oc1cccc(c1)OCO Amb25712897 [1,1,0,0,0,0|1,0,0]=3 4554 B10R1.10 Oc1cccc(c1)\C=N/O Amb25162781 [1,1,0,0,0,0|1,0,1]=4 4555 B10R1.10 SCCc1cccc(c1)Br Amb17404678 [1,1,0,0,0,0|0,1,0]=3 4556 B10R1.10 SCCc1cccc(c1)C Amb17399939 [1,1,0,0,0,0|0,1,0]=3 4557 B10R1.10 SCCc1cccc(c1)Cl Amb17400375 [1,1,0,0,0,0|0,1,0]=3 4558 B10R1.10 SCCc1cccc(c1)F Amb17400006 [1,1,0,0,0,0|0,1,0]=3 4559 B10R1.10 Sc1cc(CCCl)ccc1 Amb24627571 [1,1,0,0,0,0|1,0,0]=3 4560 B10R1.10 [NH3+]OCc1cccc(c1)Br Amb2444298 [1,1,0,0,0,0|2,0,0]=4 4561 B10R1.10 [NH3+]OCc1cccc(c1)Cl Amb2405661 [1,1,0,0,0,0|2,0,0]=4 4562 B10R1.10 [NH3+]OCc1cccc(c1)F Amb2424153 [1,1,0,0,0,0|2,0,0]=4 4563 B10R1.10 [O-]c1c[n+](CCO)ccc1 Amb24464239 [1,1,0,0,0,0|1,0,0]=3 4564 B10R1.15 BrCC(=O)c1ccccc1 Amb1102084 [1,1,0,0,0,0|1,0,1]=4 4565 B10R1.15 BrCC(c1ccccc1)O Amb17206105 [1,1,0,0,0,0|1,0,0]=3 4566 B10R1.15 Br[13CH2]C(Br)c1ccccc1 Amb22367266 [1,1,0,0,0,0|1,0,0]=3 4567 B10R1.15 C#CC(N)c1ccccc1 Amb23504019 [1,1,0,0,0,0|0,0,2]=4 4568 B10R1.15 C#C[C@@H](Cl)c1ccccc1 Amb25114793 [1,1,0,0,0,0|0,0,2]=4 4569 B10R1.15 C#C[C@H](N)c1ccccc1 Amb25757944 [1,1,0,0,0,0|0,0,2]=4 4570 B10R1.15 C#C[C@H](O)c1ccccc1 Amb22360907 [1,1,0,0,0,0|0,0,2]=4 4571 B10R1.15 C/C=C(\C)c1ccccc1 Amb17940650 [1,1,0,0,0,0|0,0,2]=4 4572 B10R1.15 C=C(CO)c1ccc[n]c1 Amb25829121 [1,1,0,0,0,0|1,0,1]=4 4573 B10R1.15 C=CC(N)c1ccccc1 Amb18642931 [1,1,0,0,0,0|0,0,2]=4 4574 B10R1.15 C=CC(N)c1ccccc1 Amb22584092 [1,1,0,0,0,0|0,0,2]=4 4575 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [1,1,0,0,0,0|0,0,2]=4 4576 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [1,1,0,0,0,0|0,0,2]=4 4577 B10R1.15 C=C[C@H](O)c1ccccc1 Amb22348430 [1,1,0,0,0,0|0,0,2]=4 4578 B10R1.15 CC(C#C)c1ccccc1 Amb24106607 [1,1,0,0,0,0|0,0,2]=4 4579 B10R1.15 CC(CCl)c1c[n]ccc1 Amb24085112 [1,1,0,0,0,0|2,0,0]=4 4580 B10R1.15 CC(CCl)c1cccc[n]1 Amb25791960 [1,1,0,0,0,0|2,0,0]=4 4581 B10R1.15 CC(CN)c1ccccc1 Amb19958781 [1,1,0,0,0,0|1,0,0]=3 4582 B10R1.15 CC(CO)c1[n]ccc[n]1 Amb24397210 [1,1,0,0,0,0|2,0,0]=4 4583 B10R1.15 CC(CO)c1cc[n]cc1 Amb24480432 [1,1,0,0,0,0|1,0,0]=3 4584 B10R1.15 CC(CO)c1cccc[n]1 Amb22896757 [1,1,0,0,0,0|1,0,0]=3 4585 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [1,1,0,0,0,0|2,0,0]=4 4586 B10R1.15 CC([Zn]Br)c1ccccc1 Amb22000433 [1,1,0,0,0,0|2,0,0]=4 4587 B10R1.15 CC([Zn]Cl)c1ccccc1 Amb22052836 [1,1,0,0,0,0|2,0,0]=4 4588 B10R1.15 CC(c1ccccc1)C#N Amb2387010 [1,1,0,0,0,0|1,0,1]=4 4589 B10R1.15 CC=C(F)c1ccccc1 Amb22008093 [1,1,0,0,0,0|0,0,2]=4 4590 B10R1.15 CCB(N)c1ccccc1 Amb25269618 [1,1,0,0,0,0|1,0,0]=3 4591 B10R1.15 CCB(O)c1ccccc1 Amb25174287 [1,1,0,0,0,0|1,0,0]=3 4592 B10R1.15 CCC(=C)c1cccc[n]1 Amb24467663 [1,1,0,0,0,0|1,0,1]=4 4593 B10R1.15 CCC(=C)c1ccccc1 Amb22234837 [1,1,0,0,0,0|0,0,1]=3 4594 B10R1.15 CCC(=N)c1cc[n]cc1 Amb25303409 [1,1,0,0,0,0|1,0,1]=4 4595 B10R1.15 CCC(=O)c1ccncc1 Amb10576400 [1,1,0,0,0,0|1,0,1]=4 4596 B10R1.15 CCC(=S)c1ccc[n]c1 Amb25837178 [1,1,0,0,0,0|1,0,1]=4 4597 B10R1.15 CCC(Br)c1[n]ccc[n]1 Amb24480847 [1,1,0,0,0,0|2,0,0]=4 4598 B10R1.15 CCC(Br)c1c[n]ccc1 Amb24556035 [1,1,0,0,0,0|1,0,0]=3 4599 B10R1.15 CCC(C)c1c[n]ccc1 Amb24690132 [1,1,0,0,0,0|1,0,0]=3 4600 B10R1.15 CCC(Cl)[n+]1ccccc1 Amb24365361 [1,1,0,0,0,0|1,0,0]=3 4601 B10R1.15 CCC(Cl)c1c[n]ccc1 Amb25708334 [1,1,0,0,0,0|1,0,0]=3 4602 B10R1.15 CCC(N)c1[n]ccc[n]1 Amb18949725 [1,1,0,0,0,0|2,0,0]=4 4603 B10R1.15 CCC(N)c1c[n]c[n]c1 Amb18523747 [1,1,0,0,0,0|2,0,0]=4 4604 B10R1.15 CCC(N)c1c[n]cc[n]1 Amb18281061 [1,1,0,0,0,0|2,0,0]=4 4605 B10R1.15 CCC(N)c1c[n]cc[n]1 Amb23440161 [1,1,0,0,0,0|2,0,0]=4 4606 B10R1.15 CCC(N)c1cc[n]c[n]1 Amb25274541 [1,1,0,0,0,0|2,0,0]=4 4607 B10R1.15 CCC(N)c1cccc[n]1 Amb22587075 [1,1,0,0,0,0|1,0,0]=3 4608 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [1,1,0,0,0,0|0,0,0]=2 4609 B10R1.15 CCC(O)c1c[n]cc[n]1 Amb25064709 [1,1,0,0,0,0|2,0,0]=4 4610 B10R1.15 CCC(c1ccccc1)N Amb1108026 [1,1,0,0,0,0|0,0,0]=2 4611 B10R1.15 CCC(c1ccccn1)N Amb10607917 [1,1,0,0,0,0|1,0,0]=3 4612 B10R1.15 CCC(c1cccnc1)N Amb10607957 [1,1,0,0,0,0|1,0,0]=3 4613 B10R1.15 CCC(c1cccnc1)O Amb17231904 [1,1,0,0,0,0|1,0,0]=3 4614 B10R1.15 CCC(c1ccncc1)O Amb16233288 [1,1,0,0,0,0|1,0,0]=3 4615 B10R1.15 CCN(N)c1cccc[n]1 Amb18643189 [1,1,0,0,0,0|2,0,0]=4 4616 B10R1.15 CCN(O)c1ccccc1 Amb25223262 [1,1,0,0,0,0|1,0,0]=3 4617 B10R1.15 CCS(=O)c1ccccc1 Amb22234834 [1,1,0,0,0,0|1,0,0]=3 4618 B10R1.15 CCS(=O)c1ccccc1 Amb22500370 [1,1,0,0,0,0|1,0,0]=3 4619 B10R1.15 CC[C@@H](N)c1c[n]c[n]c1 Amb24643083 [1,1,0,0,0,0|2,0,0]=4 4620 B10R1.15 CC[C@@H](N)c1c[n]cc[n]1 Amb24568287 [1,1,0,0,0,0|2,0,0]=4 4621 B10R1.15 CC[C@@H](N)c1c[n]ccc1 Amb23401519 [1,1,0,0,0,0|1,0,0]=3 4622 B10R1.15 CC[C@@H](N)c1c[n]ccc1 Amb25805543 [1,1,0,0,0,0|1,0,0]=3 4623 B10R1.15 CC[C@@H](N)c1cc[n]c[n]1 Amb24362128 [1,1,0,0,0,0|2,0,0]=4 4624 B10R1.15 CC[C@@H](N)c1cc[n]cc1 Amb23401520 [1,1,0,0,0,0|1,0,0]=3 4625 B10R1.15 CC[C@@H](N)c1cc[n]cc1 Amb24744408 [1,1,0,0,0,0|1,0,0]=3 4626 B10R1.15 CC[C@@H](N)c1cccc[n]1 Amb23440390 [1,1,0,0,0,0|1,0,0]=3 4627 B10R1.15 CC[C@@H](N)c1cccc[n]1 Amb25797820 [1,1,0,0,0,0|1,0,0]=3 4628 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [1,1,0,0,0,0|0,0,0]=2 4629 B10R1.15 CC[C@@H](O)c1c[n]cc[n]1 Amb24437441 [1,1,0,0,0,0|2,0,0]=4 4630 B10R1.15 CC[C@@H](O)c1cccc[n]1 Amb25717055 [1,1,0,0,0,0|1,0,0]=3 4631 B10R1.15 CC[C@H](C)c1cc[n]cc1 Amb24599884 [1,1,0,0,0,0|1,0,0]=3 4632 B10R1.15 CC[C@H](Cl)c1ccccc1 Amb24429104 [1,1,0,0,0,0|0,0,0]=2 4633 B10R1.15 CC[C@H](N)c1c[n]cc[n]1 Amb25084543 [1,1,0,0,0,0|2,0,0]=4 4634 B10R1.15 CC[C@H](N)c1c[n]ccc1 Amb25277011 [1,1,0,0,0,0|1,0,0]=3 4635 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [1,1,0,0,0,0|0,0,0]=2 4636 B10R1.15 CC[C@H](O)c1c[n]c[n]c1 Amb25087766 [1,1,0,0,0,0|2,0,0]=4 4637 B10R1.15 CC[C@H](O)c1c[n]cc[n]1 Amb25805910 [1,1,0,0,0,0|2,0,0]=4 4638 B10R1.15 CC[C@H](O)c1c[n]ccc1 Amb24432697 [1,1,0,0,0,0|1,0,0]=3 4639 B10R1.15 CC[C@H](O)c1cc[n]c[n]1 Amb25805907 [1,1,0,0,0,0|2,0,0]=4 4640 B10R1.15 CC[S@@](=O)c1ccccc1 Amb22747460 [1,1,0,0,0,0|1,0,0]=3 4641 B10R1.15 CN(CCl)c1ccccc1 Amb24479224 [1,1,0,0,0,0|2,0,0]=4 4642 B10R1.15 CN(CO)c1cc[n]cc1 Amb24481124 [1,1,0,0,0,0|2,0,0]=4 4643 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [1,1,0,0,0,0|1,0,1]=4 4644 B10R1.15 CNC(=O)c1ccccc1 Amb1793916 [1,1,0,0,0,0|1,0,1]=4 4645 B10R1.15 CNC(=S)c1ccccc1 Amb10552988 [1,1,0,0,0,0|1,0,1]=4 4646 B10R1.15 CNC(C)c1c[n]ccc1 Amb22587688 [1,1,0,0,0,0|2,0,0]=4 4647 B10R1.15 CNC(C)c1cc[n]cc1 Amb22492289 [1,1,0,0,0,0|2,0,0]=4 4648 B10R1.15 CNC(C)c1cc[n]cc1 Amb22587687 [1,1,0,0,0,0|2,0,0]=4 4649 B10R1.15 CNC(C)c1cccc[n]1 Amb22274428 [1,1,0,0,0,0|2,0,0]=4 4650 B10R1.15 CNC(C)c1cccc[n]1 Amb22587689 [1,1,0,0,0,0|2,0,0]=4 4651 B10R1.15 CNC(c1ccccc1)C Amb1215689 [1,1,0,0,0,0|1,0,0]=3 4652 B10R1.15 CNC(c1ccccn1)C Amb10189608 [1,1,0,0,0,0|2,0,0]=4 4653 B10R1.15 CNC(c1ccccn1)C Amb1115311 [1,1,0,0,0,0|2,0,0]=4 4654 B10R1.15 CNC(c1cccnc1)C Amb10189690 [1,1,0,0,0,0|2,0,0]=4 4655 B10R1.15 CNC(c1cccnc1)C Amb1121577 [1,1,0,0,0,0|2,0,0]=4 4656 B10R1.15 CNC(c1ccncc1)C Amb10189609 [1,1,0,0,0,0|2,0,0]=4 4657 B10R1.15 CNC(c1ccncc1)C Amb1119143 [1,1,0,0,0,0|2,0,0]=4 4658 B10R1.15 CNS(=O)c1ccccc1 Amb24606698 [1,1,0,0,0,0|2,0,0]=4 4659 B10R1.15 CN[C@@H](C)c1cccc[n]1 Amb24744532 [1,1,0,0,0,0|2,0,0]=4 4660 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [1,1,0,0,0,0|1,0,0]=3 4661 B10R1.15 CN[C@@H](C)c1ccccc1 Amb22899444 [1,1,0,0,0,0|1,0,0]=3 4662 B10R1.15 CN[C@@H](c1ccccc1)C Amb10844610 [1,1,0,0,0,0|1,0,0]=3 4663 B10R1.15 CN[C@H](C)c1c[n]ccc1 Amb25084519 [1,1,0,0,0,0|2,0,0]=4 4664 B10R1.15 CN[C@H](C)c1cc[n]cc1 Amb25114028 [1,1,0,0,0,0|2,0,0]=4 4665 B10R1.15 COC(=C)c1ccccc1 Amb10558859 [1,1,0,0,0,0|1,0,1]=4 4666 B10R1.15 COC(=S)c1ccccc1 Amb10569749 [1,1,0,0,0,0|1,0,1]=4 4667 B10R1.15 COC(=[NH2+])c1ccccc1 Amb10241351 [1,1,0,0,0,0|1,0,1]=4 4668 B10R1.15 COC(C)c1cc[n]cc1 Amb24102684 [1,1,0,0,0,0|2,0,0]=4 4669 B10R1.15 COC(C)c1ccccc1 Amb23568513 [1,1,0,0,0,0|1,0,0]=3 4670 B10R1.15 COC(Cl)c1ccccc1 Amb17940179 [1,1,0,0,0,0|1,0,0]=3 4671 B10R1.15 COC(O)c1c[n]ccc1 Amb25213606 [1,1,0,0,0,0|2,0,0]=4 4672 B10R1.15 COC(O)c1cccc[n]1 Amb25236210 [1,1,0,0,0,0|2,0,0]=4 4673 B10R1.15 COC(O)c1ccccc1 Amb25225981 [1,1,0,0,0,0|1,0,0]=3 4674 B10R1.15 CO[13C](=O)c1ccccc1 Amb22363354 [1,1,0,0,0,0|1,0,1]=4 4675 B10R1.15 CO[C@@H](Cl)c1ccccc1 Amb25108131 [1,1,0,0,0,0|1,0,0]=3 4676 B10R1.15 CPC(O)c1ccccc1 Amb25144461 [1,1,0,0,0,0|1,0,0]=3 4677 B10R1.15 CSC(=N)c1ccccc1 Amb22488568 [1,1,0,0,0,0|1,0,1]=4 4678 B10R1.15 CSC(=N)c1ccccc1 Amb24542868 [1,1,0,0,0,0|1,0,1]=4 4679 B10R1.15 CSC(=S)c1ccccc1 Amb24395059 [1,1,0,0,0,0|1,0,1]=4 4680 B10R1.15 CSC(C)c1cc[n]cc1 Amb25829904 [1,1,0,0,0,0|2,0,0]=4 4681 B10R1.15 C[C@@H](C=O)c1ccccc1 Amb24399258 [1,1,0,0,0,0|0,0,2]=4 4682 B10R1.15 C[C@@H](CBr)c1ccccc1 Amb25786304 [1,1,0,0,0,0|1,0,0]=3 4683 B10R1.15 C[C@@H](CCl)c1ccccc1 Amb24632311 [1,1,0,0,0,0|1,0,0]=3 4684 B10R1.15 C[C@@H](NN)c1ccccc1 Amb25824988 [1,1,0,0,0,0|2,0,0]=4 4685 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [1,1,0,0,0,0|1,0,0]=3 4686 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [1,1,0,0,0,0|1,0,0]=3 4687 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [1,1,0,0,0,0|2,0,0]=4 4688 B10R1.15 C[C@H](C=O)c1ccccc1 Amb24476962 [1,1,0,0,0,0|0,0,2]=4 4689 B10R1.15 C[C@H](CCl)c1ccccc1 Amb24658260 [1,1,0,0,0,0|1,0,0]=3 4690 B10R1.15 C[C@H](NO)c1cc[n]cc1 Amb24630448 [1,1,0,0,0,0|2,0,0]=4 4691 B10R1.15 C[C@H](NO)c1ccccc1 Amb20670900 [1,1,0,0,0,0|1,0,0]=3 4692 B10R1.15 C[C@H](NO)c1ccccc1 Amb22736688 [1,1,0,0,0,0|1,0,0]=3 4693 B10R1.15 C[SiH](CCl)c1ccccc1 Amb25053449 [1,1,0,0,0,0|1,1,0]=4 4694 B10R1.15 C\N=C(\Cl)/c1ccccc1 Amb25835717 [1,1,0,0,0,0|1,0,1]=4 4695 B10R1.15 ClC(C#C)c1ccccc1 Amb17670636 [1,1,0,0,0,0|0,0,2]=4 4696 B10R1.15 ClC(C=C)c1ccccc1 Amb17943120 [1,1,0,0,0,0|0,0,2]=4 4697 B10R1.15 ClC(CBr)c1ccccc1 Amb24079929 [1,1,0,0,0,0|1,0,0]=3 4698 B10R1.15 ClCC(Cl)c1cccc[n]1 Amb24652322 [1,1,0,0,0,0|2,0,0]=4 4699 B10R1.15 ClCC(c1ccccc1)C Amb17232147 [1,1,0,0,0,0|1,0,0]=3 4700 B10R1.15 ClCP(Cl)c1ccccc1 Amb25725059 [1,1,0,0,0,0|2,0,0]=4 4701 B10R1.15 ClC[C@@H](c1ccccc1)O Amb16231709 [1,1,0,0,0,0|1,0,0]=3 4702 B10R1.15 ClC[C@@H](c1cccnc1)O Amb16231938 [1,1,0,0,0,0|2,0,0]=4 4703 B10R1.15 ClC[C@H](Cl)c1ccccc1 Amb25131628 [1,1,0,0,0,0|1,0,0]=3 4704 B10R1.15 ClC[SiH](Cl)c1ccccc1 Amb25061252 [1,1,0,0,0,0|1,1,0]=4 4705 B10R1.15 FC(CBr)c1ccccc1 Amb20075900 [1,1,0,0,0,0|1,0,0]=3 4706 B10R1.15 FCC(=O)c1ccccc1 Amb10603600 [1,1,0,0,0,0|1,0,1]=4 4707 B10R1.15 FCC(Br)c1ccccc1 Amb25366148 [1,1,0,0,0,0|1,0,0]=3 4708 B10R1.15 FCC(Cl)c1ccccc1 Amb25361037 [1,1,0,0,0,0|1,0,0]=3 4709 B10R1.15 FCC(c1ccccc1)N Amb2372575 [1,1,0,0,0,0|1,0,0]=3 4710 B10R1.15 N#CC(Cl)c1ccccc1 Amb18787437 [1,1,0,0,0,0|1,0,1]=4 4711 B10R1.15 N#CC(F)c1ccccc1 Amb22747439 [1,1,0,0,0,0|1,0,1]=4 4712 B10R1.15 N#C[C@@H](Br)c1ccccc1 Amb24479015 [1,1,0,0,0,0|1,0,1]=4 4713 B10R1.15 N#C[C@@H](O)c1ccccc1 Amb22744732 [1,1,0,0,0,0|1,0,1]=4 4714 B10R1.15 N#C[C@H](O)c1ccccc1 Amb21618705 [1,1,0,0,0,0|1,0,1]=4 4715 B10R1.15 NC(CBr)c1ccccc1 Amb25690830 [1,1,0,0,0,0|1,0,0]=3 4716 B10R1.15 NC(CI)c1ccccc1 Amb24404731 [1,1,0,0,0,0|1,0,0]=3 4717 B10R1.15 NC(CO)c1c[n]cc[n]1 Amb18832035 [1,1,0,0,0,0|2,0,0]=4 4718 B10R1.15 NC(CO)c1c[n]ccc1 Amb22756404 [1,1,0,0,0,0|1,0,0]=3 4719 B10R1.15 NC(CO)c1cc[n]c[n]1 Amb25761050 [1,1,0,0,0,0|2,0,0]=4 4720 B10R1.15 NC(CO)c1cc[n]cc1 Amb18561776 [1,1,0,0,0,0|1,0,0]=3 4721 B10R1.15 NC(CO)c1cccc[n]1 Amb18560041 [1,1,0,0,0,0|1,0,0]=3 4722 B10R1.15 NC(CO)c1ccccn1 Amb17935880 [1,1,0,0,0,0|1,0,0]=3 4723 B10R1.15 NC(CO)c1ccncc1 Amb17935881 [1,1,0,0,0,0|1,0,0]=3 4724 B10R1.15 NC(CS)c1ccccc1 Amb25061358 [1,1,0,0,0,0|0,1,0]=3 4725 B10R1.15 NCC(=C)c1ccccc1 Amb10609068 [1,1,0,0,0,0|1,0,1]=4 4726 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [1,1,0,0,0,0|1,0,1]=4 4727 B10R1.15 NCC(Br)c1ccccc1 Amb19516007 [1,1,0,0,0,0|1,0,0]=3 4728 B10R1.15 NCC(F)c1cccc[n]1 Amb24473175 [1,1,0,0,0,0|2,0,0]=4 4729 B10R1.15 NCC(F)c1ccccc1 Amb23454844 [1,1,0,0,0,0|1,0,0]=3 4730 B10R1.15 NCC(N)c1cc[n]cc1 Amb18063802 [1,1,0,0,0,0|2,0,0]=4 4731 B10R1.15 NCC(N)c1ccccc1 Amb21857142 [1,1,0,0,0,0|1,0,0]=3 4732 B10R1.15 NCC(O)c1cc[n]cc1 Amb22755845 [1,1,0,0,0,0|2,0,0]=4 4733 B10R1.15 NCC(O)c1cccc[n]1 Amb20622942 [1,1,0,0,0,0|2,0,0]=4 4734 B10R1.15 NCC(O)c1ccccc1 Amb21961704 [1,1,0,0,0,0|1,0,0]=3 4735 B10R1.15 NCC(S)c1ccccc1 Amb18125608 [1,1,0,0,0,0|1,0,0]=3 4736 B10R1.15 NCC(S)c1ccccc1 Amb24106048 [1,1,0,0,0,0|1,0,0]=3 4737 B10R1.15 NCC(c1ccccc1)C Amb1085937 [1,1,0,0,0,0|1,0,0]=3 4738 B10R1.15 NCC(c1ccccc1)O Amb2383121 [1,1,0,0,0,0|1,0,0]=3 4739 B10R1.15 NCC(c1ccccn1)O Amb1109027 [1,1,0,0,0,0|2,0,0]=4 4740 B10R1.15 NCC(c1cccnc1)O Amb10068830 [1,1,0,0,0,0|2,0,0]=4 4741 B10R1.15 NCC(c1cccnc1)O Amb1108854 [1,1,0,0,0,0|2,0,0]=4 4742 B10R1.15 NCC(c1ccncc1)O Amb1108372 [1,1,0,0,0,0|2,0,0]=4 4743 B10R1.15 NC[C@@H](Cl)c1ccccc1 Amb24717355 [1,1,0,0,0,0|1,0,0]=3 4744 B10R1.15 NC[C@@H](F)c1ccccc1 Amb25279947 [1,1,0,0,0,0|1,0,0]=3 4745 B10R1.15 NC[C@@H](N)c1cccc[n]1 Amb25104764 [1,1,0,0,0,0|2,0,0]=4 4746 B10R1.15 NC[C@@H](O)c1c[n]ccc1 Amb22744742 [1,1,0,0,0,0|2,0,0]=4 4747 B10R1.15 NC[C@@H](O)c1c[n]ccc1 Amb22748405 [1,1,0,0,0,0|2,0,0]=4 4748 B10R1.15 NC[C@@H](O)c1cc[n]cc1 Amb24479579 [1,1,0,0,0,0|2,0,0]=4 4749 B10R1.15 NC[C@@H](O)c1cccc[n]1 Amb25052826 [1,1,0,0,0,0|2,0,0]=4 4750 B10R1.15 NC[C@@H](O)c1ccccc1 Amb24107154 [1,1,0,0,0,0|1,0,0]=3 4751 B10R1.15 NC[C@@H](c1ccccc1)O Amb10070626 [1,1,0,0,0,0|1,0,0]=3 4752 B10R1.15 NC[C@H](F)c1ccccc1 Amb25044881 [1,1,0,0,0,0|1,0,0]=3 4753 B10R1.15 NC[C@H](N)c1c[n]ccc1 Amb24426861 [1,1,0,0,0,0|2,0,0]=4 4754 B10R1.15 NC[C@H](N)c1ccccc1 Amb25757101 [1,1,0,0,0,0|1,0,0]=3 4755 B10R1.15 NC[C@H](O)c1c[n]ccc1 Amb23385336 [1,1,0,0,0,0|2,0,0]=4 4756 B10R1.15 NC[C@H](O)c1c[n]ccc1 Amb25127978 [1,1,0,0,0,0|2,0,0]=4 4757 B10R1.15 NC[C@H](O)c1cccc[n]1 Amb24569794 [1,1,0,0,0,0|2,0,0]=4 4758 B10R1.15 NC[C@H](c1ccccc1)C Amb10070369 [1,1,0,0,0,0|1,0,0]=3 4759 B10R1.15 NNC(O)c1ccccc1 Amb25306494 [1,1,0,0,0,0|2,0,0]=4 4760 B10R1.15 NNC(c1ccccc1)C Amb10610271 [1,1,0,0,0,0|2,0,0]=4 4761 B10R1.15 NOC(c1ccccc1)C Amb17089185 [1,1,0,0,0,0|2,0,0]=4 4762 B10R1.15 N[C@@H](C#N)c1ccccc1 Amb18039831 [1,1,0,0,0,0|1,0,1]=4 4763 B10R1.15 N[C@@H](C#N)c1ccccc1 Amb22746711 [1,1,0,0,0,0|1,0,1]=4 4764 B10R1.15 N[C@@H](CF)c1cc[n]cc1 Amb24403138 [1,1,0,0,0,0|2,0,0]=4 4765 B10R1.15 N[C@@H](CF)c1cccc[n]1 Amb25353862 [1,1,0,0,0,0|2,0,0]=4 4766 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887019 [1,1,0,0,0,0|1,0,0]=3 4767 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887020 [1,1,0,0,0,0|1,0,0]=3 4768 B10R1.15 N[C@@H](CO)c1[n]ccc[n]1 Amb24686593 [1,1,0,0,0,0|2,0,0]=4 4769 B10R1.15 N[C@@H](CO)c1c[n]c[n]c1 Amb24359874 [1,1,0,0,0,0|2,0,0]=4 4770 B10R1.15 N[C@@H](CO)c1c[n]ccc1 Amb25146409 [1,1,0,0,0,0|1,0,0]=3 4771 B10R1.15 N[C@@H](CO)c1cc[n]cc1 Amb25146410 [1,1,0,0,0,0|1,0,0]=3 4772 B10R1.15 N[C@@H](CO)c1ccc[n][n]1 Amb25341315 [1,1,0,0,0,0|2,0,0]=4 4773 B10R1.15 N[C@@H](CO)c1cccc[n]1 Amb22756435 [1,1,0,0,0,0|1,0,0]=3 4774 B10R1.15 N[C@@H](CS)c1ccccc1 Amb25689822 [1,1,0,0,0,0|0,1,0]=3 4775 B10R1.15 N[C@@H](c1ccccc1)C#N Amb17399826 [1,1,0,0,0,0|1,0,1]=4 4776 B10R1.15 N[C@H](CBr)c1ccccc1 Amb24391587 [1,1,0,0,0,0|1,0,0]=3 4777 B10R1.15 N[C@H](CF)c1c[n]ccc1 Amb24509342 [1,1,0,0,0,0|2,0,0]=4 4778 B10R1.15 N[C@H](CF)c1cc[n]cc1 Amb25677477 [1,1,0,0,0,0|2,0,0]=4 4779 B10R1.15 N[C@H](CF)c1cccc[n]1 Amb25840493 [1,1,0,0,0,0|2,0,0]=4 4780 B10R1.15 N[C@H](CO)c1[n]ccc[n]1 Amb24478499 [1,1,0,0,0,0|2,0,0]=4 4781 B10R1.15 N[C@H](CO)c1c[n]c[n]c1 Amb24333346 [1,1,0,0,0,0|2,0,0]=4 4782 B10R1.15 N[C@H](CO)c1c[n]ccc1 Amb24712243 [1,1,0,0,0,0|1,0,0]=3 4783 B10R1.15 N[C@H](CO)c1cc[n]c[n]1 Amb24504962 [1,1,0,0,0,0|2,0,0]=4 4784 B10R1.15 N[C@H](CO)c1cc[n]cc1 Amb24714739 [1,1,0,0,0,0|1,0,0]=3 4785 B10R1.15 N[C@H](CS)c1ccccc1 Amb25111122 [1,1,0,0,0,0|0,1,0]=3 4786 B10R1.15 N\C(=C\O)\c1ccccc1 Amb25675946 [1,1,0,0,0,0|0,0,2]=4 4787 B10R1.15 O/C=C(\O)c1ccccc1 Amb17943089 [1,1,0,0,0,0|0,0,2]=4 4788 B10R1.15 O/N=C(/O)c1ccccc1 Amb17843421 [1,1,0,0,0,0|1,0,1]=4 4789 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [1,1,0,0,0,0|1,0,1]=4 4790 B10R1.15 O=CC(Br)c1ccccc1 Amb18130512 [1,1,0,0,0,0|0,0,2]=4 4791 B10R1.15 O=CC(Cl)c1ccccc1 Amb18644699 [1,1,0,0,0,0|0,0,2]=4 4792 B10R1.15 O=CC(F)c1ccccc1 Amb24117053 [1,1,0,0,0,0|0,0,2]=4 4793 B10R1.15 O=CC(c1ccccc1)O Amb17593446 [1,1,0,0,0,0|0,0,2]=4 4794 B10R1.15 O=C[C@@H](F)c1ccccc1 Amb24564571 [1,1,0,0,0,0|0,0,2]=4 4795 B10R1.15 O=P(CCl)c1ccccc1 Amb25053604 [1,1,0,0,0,0|2,0,0]=4 4796 B10R1.15 O=S(CF)c1ccccc1 Amb22723398 [1,1,0,0,0,0|2,0,0]=4 4797 B10R1.15 OC(CBr)c1c[n]ccc1 Amb24641581 [1,1,0,0,0,0|2,0,0]=4 4798 B10R1.15 OC(CBr)c1cc[n]cc1 Amb24099591 [1,1,0,0,0,0|2,0,0]=4 4799 B10R1.15 OC(CF)c1cccc[n]1 Amb25136249 [1,1,0,0,0,0|2,0,0]=4 4800 B10R1.15 OC(CF)c1ccccc1 Amb22731897 [1,1,0,0,0,0|1,0,0]=3 4801 B10R1.15 OCC(=C)c1ccccn1 Amb10552982 [1,1,0,0,0,0|1,0,1]=4 4802 B10R1.15 OCC(=O)c1cc[n]cc1 Amb18063686 [1,1,0,0,0,0|1,0,1]=4 4803 B10R1.15 OCC(=O)c1ccc[n]c1 Amb18063681 [1,1,0,0,0,0|1,0,1]=4 4804 B10R1.15 OCC(=O)c1cccc[n]1 Amb18063640 [1,1,0,0,0,0|1,0,1]=4 4805 B10R1.15 OCC(F)c1cccc[n]1 Amb24518945 [1,1,0,0,0,0|1,0,0]=3 4806 B10R1.15 OCC(F)c1ccccc1 Amb24105399 [1,1,0,0,0,0|0,0,0]=2 4807 B10R1.15 OCC(O)c1c[n]ccc1 Amb23538717 [1,1,0,0,0,0|1,0,0]=3 4808 B10R1.15 OCC(O)c1cc[n]cc1 Amb23538718 [1,1,0,0,0,0|1,0,0]=3 4809 B10R1.15 OCC(S)c1ccccc1 Amb25333535 [1,1,0,0,0,0|0,0,0]=2 4810 B10R1.15 OC[C@@H](Br)c1ccccc1 Amb25770108 [1,1,0,0,0,0|0,0,0]=2 4811 B10R1.15 OC[C@@H](Cl)c1ccccc1 Amb24417788 [1,1,0,0,0,0|0,0,0]=2 4812 B10R1.15 OC[C@@H](F)c1ccccc1 Amb25320636 [1,1,0,0,0,0|0,0,0]=2 4813 B10R1.15 OC[C@@H](S)c1ccccc1 Amb24504991 [1,1,0,0,0,0|0,0,0]=2 4814 B10R1.15 OC[C@H](O)c1c[n]ccc1 Amb24433399 [1,1,0,0,0,0|1,0,0]=3 4815 B10R1.15 OC[C@H](O)c1cc[n]cc1 Amb25831641 [1,1,0,0,0,0|1,0,0]=3 4816 B10R1.15 ONC(=N)c1ccccc1 Amb17231893 [1,1,0,0,0,0|1,0,1]=4 4817 B10R1.15 ONC(=O)c1ccccc1 Amb1645521 [1,1,0,0,0,0|1,0,1]=4 4818 B10R1.15 ONC(c1ccccc1)C Amb10605006 [1,1,0,0,0,0|1,0,0]=3 4819 B10R1.15 ONC(c1ccccn1)C Amb10605008 [1,1,0,0,0,0|2,0,0]=4 4820 B10R1.15 ONC(c1cccnc1)C Amb10605009 [1,1,0,0,0,0|2,0,0]=4 4821 B10R1.15 ONC(c1ccncc1)C Amb10605014 [1,1,0,0,0,0|2,0,0]=4 4822 B10R1.15 OOC(=O)c1ccccc1 Amb17672281 [1,1,0,0,0,0|1,0,1]=4 4823 B10R1.15 O[C@@H](CBr)c1cc[n]cc1 Amb24479572 [1,1,0,0,0,0|2,0,0]=4 4824 B10R1.15 O[C@@H](CBr)c1ccccc1 Amb19929326 [1,1,0,0,0,0|1,0,0]=3 4825 B10R1.15 O[C@@H](CCl)c1cc[n]cc1 Amb24479576 [1,1,0,0,0,0|2,0,0]=4 4826 B10R1.15 O[C@@H](CF)c1ccccc1 Amb24389146 [1,1,0,0,0,0|1,0,0]=3 4827 B10R1.15 O[C@@H](CI)c1ccccc1 Amb25738089 [1,1,0,0,0,0|1,0,0]=3 4828 B10R1.15 O[C@@H](c1ccccc1)C#C Amb10844978 [1,1,0,0,0,0|0,0,2]=4 4829 B10R1.15 O[C@H](CBr)c1c[n]ccc1 Amb24419839 [1,1,0,0,0,0|2,0,0]=4 4830 B10R1.15 O[C@H](CBr)c1cc[n]cc1 Amb24467759 [1,1,0,0,0,0|2,0,0]=4 4831 B10R1.15 O[C@H](CBr)c1ccccc1 Amb19929329 [1,1,0,0,0,0|1,0,0]=3 4832 B10R1.15 O[C@H](CCl)c1cccc[n]1 Amb24462750 [1,1,0,0,0,0|2,0,0]=4 4833 B10R1.15 O[C@H](CF)c1ccccc1 Amb24437736 [1,1,0,0,0,0|1,0,0]=3 4834 B10R1.15 O\C=C(\Cl)/c1ccccc1 Amb25332181 [1,1,0,0,0,0|0,0,2]=4 4835 B10R1.15 O\N=C(/c1ccccc1)\N Amb2226909 [1,1,0,0,0,0|1,0,1]=4 4836 B10R1.15 O\N=C(\c1ccccc1)/C Amb2387477 [1,1,0,0,0,0|1,0,1]=4 4837 B10R1.15 O\N=C(\c1ccccc1)/Cl Amb10563288 [1,1,0,0,0,0|1,0,1]=4 4838 B10R1.15 O\N=C(\c1ccccc1)/N Amb1149046 [1,1,0,0,0,0|1,0,1]=4 4839 B10R1.15 SCC(=O)c1ccccc1 Amb16192503 [1,1,0,0,0,0|0,1,1]=4 4840 B10R1.15 SCC(c1ccccc1)O Amb10608997 [1,1,0,0,0,0|0,1,0]=3 4841 B10R1.18 BrC(Br)[Hg]c1ccccc1 Amb22345487 [1,1,0,0,0,0|2,0,0]=4 4842 B10R1.18 C=[N+]([O-])Cc1ccccc1 Amb24708106 [1,1,0,0,0,0|1,0,1]=4 4843 B10R1.18 CC(=C)Nc1ccccc1 Amb25269461 [1,1,0,0,0,0|1,0,1]=4 4844 B10R1.18 CC(=N)Cc1cccc[n]1 Amb25315666 [1,1,0,0,0,0|1,0,1]=4 4845 B10R1.18 CC(=N)Nc1ccccc1 Amb1086198 [1,1,0,0,0,0|1,0,1]=4 4846 B10R1.18 CC(=O)C[n+]1ccccc1 Amb1102043 [1,1,0,0,0,0|1,0,1]=4 4847 B10R1.18 CC(=O)Cc1ccc[n]c1 Amb22587708 [1,1,0,0,0,0|1,0,1]=4 4848 B10R1.18 CC(=O)Cc1ccccn1 Amb1995147 [1,1,0,0,0,0|1,0,1]=4 4849 B10R1.18 CC(=O)Cc1cccnc1 Amb10608569 [1,1,0,0,0,0|1,0,1]=4 4850 B10R1.18 CC(=O)Cc1ccncc1 Amb17935754 [1,1,0,0,0,0|1,0,1]=4 4851 B10R1.18 CC(=O)N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17607311 [1,1,0,0,0,0|1,0,1]=4 4852 B10R1.18 CC(=O)Oc1ccccc1 Amb22367025 [1,1,0,0,0,0|1,0,1]=4 4853 B10R1.18 CC(=O)Sc1ccccc1 Amb10575810 [1,1,0,0,0,0|1,0,1]=4 4854 B10R1.18 CC(=O)[15NH]c1ccccc1 Amb22338649 [1,1,0,0,0,0|1,0,1]=4 4855 B10R1.18 CC(Br)Cc1cc[n]cc1 Amb25208255 [1,1,0,0,0,0|1,0,0]=3 4856 B10R1.18 CC(C)Cc1c[n]ccc1 Amb22043313 [1,1,0,0,0,0|1,0,0]=3 4857 B10R1.18 CC(C)Cc1cc[n]c[n]1 Amb24070388 [1,1,0,0,0,0|2,0,0]=4 4858 B10R1.18 CC(C)Cc1cc[n]cc1 Amb22353758 [1,1,0,0,0,0|1,0,0]=3 4859 B10R1.18 CC(C)Oc1c[n]ccc1 Amb22898896 [1,1,0,0,0,0|2,0,0]=4 4860 B10R1.18 CC(C)Oc1cc[n]cc1 Amb20242496 [1,1,0,0,0,0|2,0,0]=4 4861 B10R1.18 CC(C)Oc1cccc[n]1 Amb22304705 [1,1,0,0,0,0|2,0,0]=4 4862 B10R1.18 CC(C)Sc1cc[n]cc1 Amb24380560 [1,1,0,0,0,0|2,0,0]=4 4863 B10R1.18 CC(C)Sc1cccc[n]1 Amb25130337 [1,1,0,0,0,0|2,0,0]=4 4864 B10R1.18 CC(Cc1ccccc1)N Amb17608372 [1,1,0,0,0,0|0,0,0]=2 4865 B10R1.18 CC(Cc1ccccn1)C Amb15691003 [1,1,0,0,0,0|1,0,0]=3 4866 B10R1.18 CC(Cc1ccccn1)Cl Amb17477796 [1,1,0,0,0,0|1,0,0]=3 4867 B10R1.18 CC(Cc1ccccn1)N Amb1995149 [1,1,0,0,0,0|1,0,0]=3 4868 B10R1.18 CC(Cc1ccccn1)O Amb1995148 [1,1,0,0,0,0|1,0,0]=3 4869 B10R1.18 CC(Cc1cccnc1)Cl Amb17477798 [1,1,0,0,0,0|1,0,0]=3 4870 B10R1.18 CC(Cc1cccnc1)O Amb17477790 [1,1,0,0,0,0|1,0,0]=3 4871 B10R1.18 CC(Cc1ccncc1)Cl Amb17477797 [1,1,0,0,0,0|1,0,0]=3 4872 B10R1.18 CC(Cc1ccncc1)O Amb17477789 [1,1,0,0,0,0|1,0,0]=3 4873 B10R1.18 CC(Cc1cnccn1)N Amb1995174 [1,1,0,0,0,0|2,0,0]=4 4874 B10R1.18 CC(Cc1cnccn1)O Amb1995175 [1,1,0,0,0,0|2,0,0]=4 4875 B10R1.18 CC(Cc1nccnc1)N Amb10609115 [1,1,0,0,0,0|2,0,0]=4 4876 B10R1.18 CC(Cc1nccnc1)N Amb10609131 [1,1,0,0,0,0|2,0,0]=4 4877 B10R1.18 CC(Cl)Cc1ccccc1 Amb18787554 [1,1,0,0,0,0|0,0,0]=2 4878 B10R1.18 CC(Cl)Oc1ccccc1 Amb17689404 [1,1,0,0,0,0|1,0,0]=3 4879 B10R1.18 CC(Cl)Sc1ccccc1 Amb17673697 [1,1,0,0,0,0|1,0,0]=3 4880 B10R1.18 CC(I)Cc1ccccc1 Amb24616287 [1,1,0,0,0,0|0,0,0]=2 4881 B10R1.18 CC(N)=Pc1ccccc1 Amb25351589 [1,1,0,0,0,0|1,0,1]=4 4882 B10R1.18 CC(N)CC=1C=CCCC1 Amb21962869 [1,1,0,0,0,0|0,0,2]=4 4883 B10R1.18 CC(N)Cc1[n]ccc[n]1 Amb18064016 [1,1,0,0,0,0|2,0,0]=4 4884 B10R1.18 CC(N)Cc1c[n]ccc1 Amb21972219 [1,1,0,0,0,0|1,0,0]=3 4885 B10R1.18 CC(N)Cc1cc[n]c[n]1 Amb18285236 [1,1,0,0,0,0|2,0,0]=4 4886 B10R1.18 CC(N)Cc1cc[n]cc1 Amb21972220 [1,1,0,0,0,0|1,0,0]=3 4887 B10R1.18 CC(N)Cc1ccccc1 Amb22346639 [1,1,0,0,0,0|0,0,0]=2 4888 B10R1.18 CC(N)Cc1ccccc1 Amb22352196 [1,1,0,0,0,0|0,0,0]=2 4889 B10R1.18 CC(N)Oc1ccccc1 Amb25830517 [1,1,0,0,0,0|1,0,0]=3 4890 B10R1.18 CC(Nc1ccccn1)C Amb1104052 [1,1,0,0,0,0|2,0,0]=4 4891 B10R1.18 CC(Nc1cccnc1)C Amb16231494 [1,1,0,0,0,0|2,0,0]=4 4892 B10R1.18 CC(Nc1cccnc1)C Amb2382996 [1,1,0,0,0,0|2,0,0]=4 4893 B10R1.18 CC(Nc1ccncc1)C Amb16231495 [1,1,0,0,0,0|2,0,0]=4 4894 B10R1.18 CC(Nc1ccncc1)C Amb2383009 [1,1,0,0,0,0|2,0,0]=4 4895 B10R1.18 CC(O)Nc1cccc[n]1 Amb24478972 [1,1,0,0,0,0|2,0,0]=4 4896 B10R1.18 CC(O)Sc1ccccc1 Amb25045636 [1,1,0,0,0,0|1,0,0]=3 4897 B10R1.18 CC(S)Cc1ccccc1 Amb18177239 [1,1,0,0,0,0|0,0,0]=2 4898 B10R1.18 CN(C)Cc1cc[n]cc1 Amb20247602 [1,1,0,0,0,0|2,0,0]=4 4899 B10R1.18 CN(C)Cc1ccccc1 Amb22359464 [1,1,0,0,0,0|1,0,0]=3 4900 B10R1.18 CN(C)Nc1ccccc1 Amb25810299 [1,1,0,0,0,0|2,0,0]=4 4901 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [1,1,0,0,0,0|1,0,0]=3 4902 B10R1.18 C[13C](=O)N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367563 [1,1,0,0,0,0|1,0,1]=4 4903 B10R1.18 C[C@@H](Cc1ccccc1)O Amb10068519 [1,1,0,0,0,0|0,0,0]=2 4904 B10R1.18 C[C@@H](N)Cc1c[n]cc[n]1 Amb25127231 [1,1,0,0,0,0|2,0,0]=4 4905 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb19130510 [1,1,0,0,0,0|0,0,0]=2 4906 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb22745694 [1,1,0,0,0,0|0,0,0]=2 4907 B10R1.18 C[C@@H](O)Cc1c[n]ccc1 Amb22896922 [1,1,0,0,0,0|1,0,0]=3 4908 B10R1.18 C[C@@H](O)Cc1ccccc1 Amb17938083 [1,1,0,0,0,0|0,0,0]=2 4909 B10R1.18 C[C@H](Cc1ccccc1)N Amb17608368 [1,1,0,0,0,0|0,0,0]=2 4910 B10R1.18 C[C@H](N)Cc1c[n]cc[n]1 Amb24360532 [1,1,0,0,0,0|2,0,0]=4 4911 B10R1.18 C[C@H](N)Cc1cccc[n]1 Amb24451425 [1,1,0,0,0,0|1,0,0]=3 4912 B10R1.18 C[SiH](C)Cc1ccccc1 Amb19893554 [1,1,0,0,0,0|0,1,0]=3 4913 B10R1.18 C[Si](C)Cc1ccccc1 Amb24527863 [1,1,0,0,0,0|0,1,0]=3 4914 B10R1.18 C\C(\O)=C/c1ccccc1 Amb24095309 [1,1,0,0,0,0|0,0,2]=4 4915 B10R1.18 ClB(Cl)Cc1ccccc1 Amb25832795 [1,1,0,0,0,0|2,0,0]=4 4916 B10R1.18 ClC(Cl)Cc1ccccc1 Amb25783924 [1,1,0,0,0,0|1,0,0]=3 4917 B10R1.18 ClC(Cl)Sc1ccccc1 Amb24389589 [1,1,0,0,0,0|2,0,0]=4 4918 B10R1.18 ClC(Cl)[SiH2]c1ccccc1 Amb22167700 [1,1,0,0,0,0|1,1,0]=4 4919 B10R1.18 ClP(Cl)Cc1ccccc1 Amb25838123 [1,1,0,0,0,0|2,0,0]=4 4920 B10R1.18 FC(F)Cc1ccccc1 Amb19894546 [1,1,0,0,0,0|1,0,0]=3 4921 B10R1.18 FC(Sc1ccccc1)F Amb17232315 [1,1,0,0,0,0|2,0,0]=4 4922 B10R1.18 N=C(O)Nc1ccccc1 Amb19516159 [1,1,0,0,0,0|1,0,1]=4 4923 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [1,1,0,0,0,0|0,0,2]=4 4924 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [1,1,0,0,0,0|0,1,1]=4 4925 B10R1.18 NC(O)Cc1ccccc1 Amb25348475 [1,1,0,0,0,0|0,0,0]=2 4926 B10R1.18 NS(=N)Cc1ccccc1 Amb25258845 [1,1,0,0,0,0|2,0,0]=4 4927 B10R1.18 N[C@@H](O)Cc1ccccc1 Amb25790547 [1,1,0,0,0,0|0,0,0]=2 4928 B10R1.18 N[C@H](O)Cc1ccccc1 Amb24444592 [1,1,0,0,0,0|0,0,0]=2 4929 B10R1.18 OB(Cc1ccccc1)O Amb10071580 [1,1,0,0,0,0|1,0,0]=3 4930 B10R1.18 OB(O)Cc1c[n]ccc1 Amb24699248 [1,1,0,0,0,0|2,0,0]=4 4931 B10R1.18 OB(O)Cc1cc[n]cc1 Amb24105357 [1,1,0,0,0,0|2,0,0]=4 4932 B10R1.18 OC(=O)C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22353637 [1,1,0,0,0,0|0,0,1]=3 4933 B10R1.18 OC(=O)C[N]1=CC=CC=C1 Amb17836439 [1,1,0,0,0,0|1,0,1]=4 4934 B10R1.18 OC(=O)C[n+]1ccccc1 Amb10552774 [1,1,0,0,0,0|1,0,1]=4 4935 B10R1.18 OC(=O)C[n+]1ccccc1 Amb23468426 [1,1,0,0,0,0|1,0,1]=4 4936 B10R1.18 OC(=O)Cc1cc[nH+]cc1 Amb24113836 [1,1,0,0,0,0|1,0,1]=4 4937 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb10807486 [1,1,0,0,0,0|1,0,1]=4 4938 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb24113838 [1,1,0,0,0,0|1,0,1]=4 4939 B10R1.18 OC(=O)[13CH2]c1ccccc1 Amb22351854 [1,1,0,0,0,0|0,0,1]=3 4940 B10R1.18 OC(=S)Cc1cc[n]cc1 Amb24099577 [1,1,0,0,0,0|1,0,1]=4 4941 B10R1.18 OC(=S)Cc1ccccc1 Amb22262974 [1,1,0,0,0,0|0,0,1]=3 4942 B10R1.18 OC(=S)Nc1ccccc1 Amb24669066 [1,1,0,0,0,0|1,0,1]=4 4943 B10R1.18 OC(F)Cc1ccccc1 Amb25147731 [1,1,0,0,0,0|0,0,0]=2 4944 B10R1.18 OC(O)C[n+]1ccccc1 Amb25149726 [1,1,0,0,0,0|1,0,0]=3 4945 B10R1.18 OC(O)Cc1ccccc1 Amb24639712 [1,1,0,0,0,0|0,0,0]=2 4946 B10R1.18 OP(=O)Cc1cccc[n]1 Amb25787147 [1,1,0,0,0,0|2,0,0]=4 4947 B10R1.18 OP(=O)Cc1ccccc1 Amb24617740 [1,1,0,0,0,0|1,0,0]=3 4948 B10R1.18 OP(=O)Oc1ccccc1 Amb24520486 [1,1,0,0,0,0|2,0,0]=4 4949 B10R1.18 O[13C](=O)Cc1ccccc1 Amb22363120 [1,1,0,0,0,0|0,0,1]=3 4950 B10R1.18 O[13C](=O)[13CH2]c1ccccc1 Amb22351754 [1,1,0,0,0,0|0,0,1]=3 4951 B10R1.18 O[14C](=O)Cc1ccccc1 Amb22337596 [1,1,0,0,0,0|0,0,1]=3 4952 B10R1.18 SC(=O)Cc1ccccc1 Amb10561701 [1,1,0,0,0,0|0,0,2]=4 4953 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20240609 [1,1,0,0,0,0|0,0,2]=4 4954 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20246797 [1,1,0,0,0,0|0,0,2]=4 4955 B10R1.18 [O-][N+](=O)Cc1ccccc1 Amb10606416 [1,1,0,0,0,0|1,0,1]=4 4956 B10R1.18 [O-]\[N+](=C/c1ccccc1)\C Amb2420785 [1,1,0,0,0,0|1,0,1]=4 4957 B10R1.11 BrCCC(c1cccs1)C Amb17243542 [0,1,0,0,1,0|2,0,0]=4 4958 B10R1.11 CC(CCN)[n]1cccc1 Amb18985726 [0,1,0,0,1,0|2,0,0]=4 4959 B10R1.11 CC(CCN)c1c[nH]cc1 Amb18893407 [0,1,0,0,1,0|2,0,0]=4 4960 B10R1.11 CC(CCO)=C1C=CC=C1 Amb25050337 [0,1,0,0,1,0|0,0,1]=3 4961 B10R1.11 CC(CCO)[n]1cccc1 Amb24703202 [0,1,0,0,1,0|1,0,0]=3 4962 B10R1.11 CC(CCO)c1c[s]cc1 Amb25676863 [0,1,0,0,1,0|1,0,0]=3 4963 B10R1.11 CC(CCO)c1ccc[nH]1 Amb24753765 [0,1,0,0,1,0|1,0,0]=3 4964 B10R1.11 CC(CCS)c1ccc[s]1 Amb25694227 [0,1,0,0,1,0|1,1,0]=4 4965 B10R1.11 CCCC(Br)c1ccc[s]1 Amb24513708 [0,1,0,0,1,0|2,0,0]=4 4966 B10R1.11 CCCC(Cl)c1c[s]cc1 Amb24758359 [0,1,0,0,1,0|2,0,0]=4 4967 B10R1.11 CCCC(Cl)c1ccc[nH]1 Amb25104421 [0,1,0,0,1,0|2,0,0]=4 4968 B10R1.11 CCCC(N)c1c[s]cc1 Amb18294779 [0,1,0,0,1,0|2,0,0]=4 4969 B10R1.11 CCCC(N)c1ccc[nH]1 Amb18203001 [0,1,0,0,1,0|2,0,0]=4 4970 B10R1.11 CCCC(N)c1ccco1 Amb18991109 [0,1,0,0,1,0|2,0,0]=4 4971 B10R1.11 CCCC(N)c1cocc1 Amb18832008 [0,1,0,0,1,0|2,0,0]=4 4972 B10R1.11 CCCC(O)c1c[nH]cc1 Amb24476783 [0,1,0,0,1,0|2,0,0]=4 4973 B10R1.11 CCCC(O)c1c[s]cc1 Amb18791762 [0,1,0,0,1,0|2,0,0]=4 4974 B10R1.11 CCCC(O)c1ccc[nH]1 Amb24679736 [0,1,0,0,1,0|2,0,0]=4 4975 B10R1.11 CCCC(O)c1cocc1 Amb24418353 [0,1,0,0,1,0|2,0,0]=4 4976 B10R1.11 CCCC(c1ccco1)Cl Amb17138479 [0,1,0,0,1,0|2,0,0]=4 4977 B10R1.11 CCCC(c1cccs1)Cl Amb17138753 [0,1,0,0,1,0|2,0,0]=4 4978 B10R1.11 CCCC(c1cccs1)N Amb17622125 [0,1,0,0,1,0|2,0,0]=4 4979 B10R1.11 CCC[C@@H](N)c1c[nH]cc1 Amb24478487 [0,1,0,0,1,0|2,0,0]=4 4980 B10R1.11 CCC[C@@H](N)c1ccc[s]1 Amb24446604 [0,1,0,0,1,0|2,0,0]=4 4981 B10R1.11 CCC[C@@H](N)c1cocc1 Amb25083076 [0,1,0,0,1,0|2,0,0]=4 4982 B10R1.11 CCC[C@@H](O)c1c[s]cc1 Amb25043988 [0,1,0,0,1,0|2,0,0]=4 4983 B10R1.11 CCC[C@@H](O)c1ccc[s]1 Amb25226068 [0,1,0,0,1,0|2,0,0]=4 4984 B10R1.11 CCC[C@@H](O)c1ccco1 Amb24371424 [0,1,0,0,1,0|2,0,0]=4 4985 B10R1.11 CCC[C@H](N)c1c[s]cc1 Amb25757407 [0,1,0,0,1,0|2,0,0]=4 4986 B10R1.11 CCC[C@H](N)c1ccc[s]1 Amb25062513 [0,1,0,0,1,0|2,0,0]=4 4987 B10R1.11 CCC[C@H](N)c1ccco1 Amb24627831 [0,1,0,0,1,0|2,0,0]=4 4988 B10R1.11 CCC[C@H](O)c1c[s]cc1 Amb24358455 [0,1,0,0,1,0|2,0,0]=4 4989 B10R1.11 CCC[C@H](O)c1cocc1 Amb24358352 [0,1,0,0,1,0|2,0,0]=4 4990 B10R1.11 CN(CCO)c1c[s]cc1 Amb24481266 [0,1,0,0,1,0|2,0,0]=4 4991 B10R1.11 CN(CCO)c1ccc[s]1 Amb24481267 [0,1,0,0,1,0|2,0,0]=4 4992 B10R1.11 C[C@H](CCO)c1ccco1 Amb25788895 [0,1,0,0,1,0|1,0,0]=3 4993 B10R1.11 ClCCC(c1cccs1)C Amb17233057 [0,1,0,0,1,0|2,0,0]=4 4994 B10R1.11 NC(CCO)c1c[nH]cc1 Amb18563233 [0,1,0,0,1,0|1,0,0]=3 4995 B10R1.11 NC(CCO)c1c[n]c[s]1 Amb24436231 [0,1,0,0,1,0|2,0,0]=4 4996 B10R1.11 NC(CCO)c1ccc[nH]1 Amb24611803 [0,1,0,0,1,0|1,0,0]=3 4997 B10R1.11 NC(CCO)c1ccco1 Amb18120550 [0,1,0,0,1,0|1,0,0]=3 4998 B10R1.11 NCCC(F)c1c[s]cc1 Amb25786606 [0,1,0,0,1,0|2,0,0]=4 4999 B10R1.11 NCCC(F)c1ccc[nH]1 Amb25118038 [0,1,0,0,1,0|2,0,0]=4 5000 B10R1.11 NCCC(F)c1ccc[s]1 Amb25050095 [0,1,0,0,1,0|2,0,0]=4 5001 B10R1.11 NCCC(F)c1cocc1 Amb25721824 [0,1,0,0,1,0|2,0,0]=4 5002 B10R1.11 NCCC(N)c1cocc1 Amb24562958 [0,1,0,0,1,0|2,0,0]=4 5003 B10R1.11 NCCC(O)c1c[nH]cc1 Amb18563185 [0,1,0,0,1,0|2,0,0]=4 5004 B10R1.11 NCCC(O)c1c[s]cc1 Amb18251534 [0,1,0,0,1,0|2,0,0]=4 5005 B10R1.11 NCCC(O)c1cocc1 Amb22642024 [0,1,0,0,1,0|2,0,0]=4 5006 B10R1.11 NCCC(c1ccco1)C Amb17226683 [0,1,0,0,1,0|2,0,0]=4 5007 B10R1.11 NCCC(c1ccco1)O Amb17079150 [0,1,0,0,1,0|2,0,0]=4 5008 B10R1.11 NCCC(c1cccs1)O Amb17079131 [0,1,0,0,1,0|2,0,0]=4 5009 B10R1.11 NCC[C@@H](N)c1c[s]cc1 Amb24561706 [0,1,0,0,1,0|2,0,0]=4 5010 B10R1.11 NCC[C@@H](N)c1cocc1 Amb25201751 [0,1,0,0,1,0|2,0,0]=4 5011 B10R1.11 NCC[C@H](N)c1ccco1 Amb24655060 [0,1,0,0,1,0|2,0,0]=4 5012 B10R1.11 N[C@@H](CCO)c1c[s]c[n]1 Amb25835584 [0,1,0,0,1,0|2,0,0]=4 5013 B10R1.11 N[C@@H](CCO)c1ccc[s]1 Amb25835841 [0,1,0,0,1,0|1,0,0]=3 5014 B10R1.11 N[C@H](CCO)c1[n]cc[s]1 Amb25117312 [0,1,0,0,1,0|2,0,0]=4 5015 B10R1.11 N[C@H](CCO)c1c[s]c[n]1 Amb24757770 [0,1,0,0,1,0|2,0,0]=4 5016 B10R1.11 N[C@H](CCO)c1c[s]cc1 Amb25679671 [0,1,0,0,1,0|1,0,0]=3 5017 B10R1.11 N[C@H](CCO)c1ccc[nH]1 Amb24763735 [0,1,0,0,1,0|1,0,0]=3 5018 B10R1.11 N[C@H](CCO)c1cocc1 Amb25254635 [0,1,0,0,1,0|1,0,0]=3 5019 B10R1.11 OC(CCCl)c1c[s]cc1 Amb24742403 [0,1,0,0,1,0|2,0,0]=4 5020 B10R1.11 OC(CCCl)c1ccco1 Amb25685618 [0,1,0,0,1,0|2,0,0]=4 5021 B10R1.11 OC(CCI)c1ccc[s]1 Amb24424574 [0,1,0,0,1,0|2,0,0]=4 5022 B10R1.11 OCCC(=O)c1cc[nH]c1 Amb18064961 [0,1,0,0,1,0|1,0,1]=4 5023 B10R1.11 OCCC(=O)c1ccc[nH]1 Amb25780948 [0,1,0,0,1,0|1,0,1]=4 5024 B10R1.11 OCCC(=O)c1ccc[s]1 Amb18563468 [0,1,0,0,1,0|1,0,1]=4 5025 B10R1.11 OCCC(=O)c1ccco1 Amb25234271 [0,1,0,0,1,0|1,0,1]=4 5026 B10R1.11 OCCC(O)c1c[nH]cc1 Amb18563435 [0,1,0,0,1,0|1,0,0]=3 5027 B10R1.11 OCCC(O)c1c[s]cc1 Amb22298358 [0,1,0,0,1,0|1,0,0]=3 5028 B10R1.11 OCCC(O)c1ccc[s]1 Amb18065453 [0,1,0,0,1,0|1,0,0]=3 5029 B10R1.11 OCCC(c1cccs1)C Amb17232175 [0,1,0,0,1,0|1,0,0]=3 5030 B10R1.11 OCCC(c1cccs1)N Amb2408105 [0,1,0,0,1,0|1,0,0]=3 5031 B10R1.11 OCCC(c1cscc1)N Amb2408152 [0,1,0,0,1,0|1,0,0]=3 5032 B10R1.11 ONCC(c1ccco1)O Amb17334210 [0,1,0,0,1,0|2,0,0]=4 5033 B10R1.11 ONCC(c1cccs1)O Amb17334462 [0,1,0,0,1,0|2,0,0]=4 5034 B10R1.16 Brc1ccc(CCCBr)o1 Amb25234702 [0,1,0,0,1,0|2,0,0]=4 5035 B10R1.16 CCCCc1c[s]c(Br)c1 Amb25180502 [0,1,0,0,1,0|2,0,0]=4 5036 B10R1.16 CCCCc1cc(I)c[s]1 Amb25223962 [0,1,0,0,1,0|2,0,0]=4 5037 B10R1.16 CCCCc1ccc(I)o1 Amb25127159 [0,1,0,0,1,0|2,0,0]=4 5038 B10R1.16 CCCCc1ccc(s1)C Amb10807431 [0,1,0,0,1,0|2,0,0]=4 5039 B10R1.16 C[n]1c[n]c(CCCO)c1 Amb25343793 [0,1,0,0,1,0|2,0,0]=4 5040 B10R1.16 C[n]1cc(CCCN)cc1 Amb18562123 [0,1,0,0,1,0|2,0,0]=4 5041 B10R1.16 C[n]1cc(CCCO)cc1 Amb18223708 [0,1,0,0,1,0|1,0,0]=3 5042 B10R1.16 Cc1[n]cc(CCCO)[s]1 Amb24693717 [0,1,0,0,1,0|2,0,0]=4 5043 B10R1.16 Cc1[n]cc(CCCO)o1 Amb25257131 [0,1,0,0,1,0|2,0,0]=4 5044 B10R1.16 Cc1c[nH]c(CCCC)c1 Amb25147477 [0,1,0,0,1,0|2,0,0]=4 5045 B10R1.16 Cc1c[n](CCCO)cc1 Amb24749638 [0,1,0,0,1,0|1,0,0]=3 5046 B10R1.16 Cc1cc(CCCCl)c[s]1 Amb25312736 [0,1,0,0,1,0|2,0,0]=4 5047 B10R1.16 Cc1cc(CCCN)[s]c1 Amb18830842 [0,1,0,0,1,0|2,0,0]=4 5048 B10R1.16 Cc1cc(CCCN)c[nH]1 Amb18202991 [0,1,0,0,1,0|2,0,0]=4 5049 B10R1.16 Cc1cc(CCCN)c[s]1 Amb24367192 [0,1,0,0,1,0|2,0,0]=4 5050 B10R1.16 Cc1cc(CCCN)co1 Amb18832018 [0,1,0,0,1,0|2,0,0]=4 5051 B10R1.16 Cc1cc(CCCO)[nH][n]1 Amb25332188 [0,1,0,0,1,0|2,0,0]=4 5052 B10R1.16 Cc1cc(CCCO)[s][n]1 Amb25027017 [0,1,0,0,1,0|2,0,0]=4 5053 B10R1.16 Cc1cc(CCCO)c[s]1 Amb25797741 [0,1,0,0,1,0|1,0,0]=3 5054 B10R1.16 Cc1ccc(CCCBr)[s]1 Amb25285158 [0,1,0,0,1,0|2,0,0]=4 5055 B10R1.16 Cc1ccc(CCCC)[nH]1 Amb25278176 [0,1,0,0,1,0|2,0,0]=4 5056 B10R1.16 Cc1ccc(CCCCl)[s]1 Amb25783969 [0,1,0,0,1,0|2,0,0]=4 5057 B10R1.16 Cc1ccc(CCCN)[s]1 Amb18830839 [0,1,0,0,1,0|2,0,0]=4 5058 B10R1.16 Cc1ccc(o1)CCCCl Amb17477784 [0,1,0,0,1,0|2,0,0]=4 5059 B10R1.16 Cc1ccc(o1)CCCN Amb17477776 [0,1,0,0,1,0|2,0,0]=4 5060 B10R1.16 Cc1ccc(o1)CCCO Amb17477780 [0,1,0,0,1,0|1,0,0]=3 5061 B10R1.16 Cc1ccc(o1)SCCO Amb25078018 [0,1,0,0,1,0|2,0,0]=4 5062 B10R1.16 Cc1ccc(s1)CCCO Amb17605793 [0,1,0,0,1,0|1,0,0]=3 5063 B10R1.16 Cc1cnc(o1)CCCO Amb17087664 [0,1,0,0,1,0|2,0,0]=4 5064 B10R1.16 ClCCCc1coc(Br)c1 Amb24504782 [0,1,0,0,1,0|2,0,0]=4 5065 B10R1.16 Clc1ccc(CCCCl)[s]1 Amb19062471 [0,1,0,0,1,0|2,0,0]=4 5066 B10R1.16 Cn1ccc(n1)CCCO Amb1971494 [0,1,0,0,1,0|2,0,0]=4 5067 B10R1.16 NCCCc1c[s]c(Cl)c1 Amb25707183 [0,1,0,0,1,0|2,0,0]=4 5068 B10R1.16 NCCCc1cc(Br)c[s]1 Amb18991742 [0,1,0,0,1,0|2,0,0]=4 5069 B10R1.16 NCCCc1ccc(Cl)o1 Amb24744527 [0,1,0,0,1,0|2,0,0]=4 5070 B10R1.16 NCCCc1ccc(I)o1 Amb25706348 [0,1,0,0,1,0|2,0,0]=4 5071 B10R1.16 NCCCc1coc(Br)c1 Amb25370396 [0,1,0,0,1,0|2,0,0]=4 5072 B10R1.16 Nc1[n]cc(CCCO)[s]1 Amb22497848 [0,1,0,0,1,0|2,0,0]=4 5073 B10R1.16 Nc1c[n](cc1)NCCO Amb25147631 [0,1,0,0,1,0|2,0,0]=4 5074 B10R1.16 Nc1c[n][n](CCCO)c1 Amb18980779 [0,1,0,0,1,0|2,0,0]=4 5075 B10R1.16 Nc1c[n][n](CCCO)c1 Amb22371252 [0,1,0,0,1,0|2,0,0]=4 5076 B10R1.16 Nc1cc(CCCCl)c[s]1 Amb25714488 [0,1,0,0,1,0|2,0,0]=4 5077 B10R1.16 Nc1cc[n](CCCO)[n]1 Amb18293281 [0,1,0,0,1,0|2,0,0]=4 5078 B10R1.16 OCCCC1C=CC(=O)O1 Amb25027983 [0,1,0,0,1,0|1,0,1]=4 5079 B10R1.16 OCCC[n]1cc(I)c[n]1 Amb23449627 [0,1,0,0,1,0|2,0,0]=4 5080 B10R1.16 OCCCc1c[n]c(Br)[s]1 Amb22497849 [0,1,0,0,1,0|2,0,0]=4 5081 B10R1.16 OCCCc1cc(Br)c[s]1 Amb23537991 [0,1,0,0,1,0|1,0,0]=3 5082 B10R1.16 OCCCc1ccc(Br)[s]1 Amb25054989 [0,1,0,0,1,0|1,0,0]=3 5083 B10R1.16 OCCCc1ccc(Br)o1 Amb25800149 [0,1,0,0,1,0|1,0,0]=3 5084 B10R1.16 OCCCc1ccc(Cl)[s]1 Amb18804618 [0,1,0,0,1,0|1,0,0]=3 5085 B10R1.16 OCCCn1cc(cn1)Br Amb1995280 [0,1,0,0,1,0|2,0,0]=4 5086 B10R1.16 OCCNc1ccc(Br)[s]1 Amb25041822 [0,1,0,0,1,0|2,0,0]=4 5087 B10R1.16 OCCNc1ccc(Cl)[s]1 Amb24524684 [0,1,0,0,1,0|2,0,0]=4 5088 B10R1.16 SCCCc1ccc(Cl)[s]1 Amb24643995 [0,1,0,0,1,0|1,1,0]=4 5089 B10R1.21 BrCCCCc1ccc[s]1 Amb25085582 [0,1,0,0,1,0|2,0,0]=4 5090 B10R1.21 BrCCCCc1ccco1 Amb24477250 [0,1,0,0,1,0|2,0,0]=4 5091 B10R1.21 BrCCCCc1cocc1 Amb25187235 [0,1,0,0,1,0|2,0,0]=4 5092 B10R1.21 BrCCNCc1c[s]cc1 Amb25859026 [0,1,0,0,1,0|2,0,0]=4 5093 B10R1.21 BrCCNCc1ccco1 Amb24431688 [0,1,0,0,1,0|2,0,0]=4 5094 B10R1.21 BrCCOCc1ccc[s]1 Amb24395674 [0,1,0,0,1,0|2,0,0]=4 5095 B10R1.21 Br[Mg]CCC[n]1cccc1 Amb22897352 [0,1,0,0,1,0|2,0,0]=4 5096 B10R1.21 Br[Zn]CCC[n]1cccc1 Amb22897868 [0,1,0,0,1,0|2,0,0]=4 5097 B10R1.21 C=CCCCc1c[nH]cc1 Amb24477245 [0,1,0,0,1,0|2,0,0]=4 5098 B10R1.21 CCCCCc1c[s]cc1 Amb20621787 [0,1,0,0,1,0|2,0,0]=4 5099 B10R1.21 CCCCSc1ccc[nH]1 Amb24482046 [0,1,0,0,1,0|2,0,0]=4 5100 B10R1.21 CCCCSc1ccc[s]1 Amb24105710 [0,1,0,0,1,0|2,0,0]=4 5101 B10R1.21 CCCNCc1c[nH]cc1 Amb18064300 [0,1,0,0,1,0|2,0,0]=4 5102 B10R1.21 CCCNCc1ccc[s]1 Amb19890386 [0,1,0,0,1,0|2,0,0]=4 5103 B10R1.21 CCCNCc1ccco1 Amb1127967 [0,1,0,0,1,0|2,0,0]=4 5104 B10R1.21 CCCNCc1ccco1 Amb19890265 [0,1,0,0,1,0|2,0,0]=4 5105 B10R1.21 CCCSCc1ccco1 Amb24430614 [0,1,0,0,1,0|2,0,0]=4 5106 B10R1.21 CCNCC[n]1cccc1 Amb18313349 [0,1,0,0,1,0|2,0,0]=4 5107 B10R1.21 CCNCCc1c[nH]cc1 Amb18893405 [0,1,0,0,1,0|2,0,0]=4 5108 B10R1.21 CNCCCC1C=CC=C1 Amb25791562 [0,1,0,0,1,0|1,0,1]=4 5109 B10R1.21 CNCCCC=1C=CCC1 Amb24478907 [0,1,0,0,1,0|1,0,1]=4 5110 B10R1.21 CNCCC[n]1cccc1 Amb18306565 [0,1,0,0,1,0|2,0,0]=4 5111 B10R1.21 CNCCCc1c[nH]cc1 Amb18064240 [0,1,0,0,1,0|2,0,0]=4 5112 B10R1.21 CNCCCc1c[s]cc1 Amb19025786 [0,1,0,0,1,0|2,0,0]=4 5113 B10R1.21 CNCCCc1cccs1 Amb17104498 [0,1,0,0,1,0|2,0,0]=4 5114 B10R1.21 COCCC[n]1c[n]cc1 Amb25111380 [0,1,0,0,1,0|2,0,0]=4 5115 B10R1.21 COCCC[n]1ccc[n]1 Amb25146301 [0,1,0,0,1,0|2,0,0]=4 5116 B10R1.21 COCCCc1c[nH]c[n]1 Amb24391221 [0,1,0,0,1,0|2,0,0]=4 5117 B10R1.21 COCCN[n]1cccc1 Amb25705486 [0,1,0,0,1,0|2,0,0]=4 5118 B10R1.21 COCOCc1ccc[s]1 Amb24571900 [0,1,0,0,1,0|2,0,0]=4 5119 B10R1.21 COCSCc1ccco1 Amb25185188 [0,1,0,0,1,0|2,0,0]=4 5120 B10R1.21 CSCCCc1c[s]cc1 Amb25260627 [0,1,0,0,1,0|1,1,0]=4 5121 B10R1.21 ClCCCC[n]1cccc1 Amb24480449 [0,1,0,0,1,0|2,0,0]=4 5122 B10R1.21 ClCCCCc1ccco1 Amb17138477 [0,1,0,0,1,0|2,0,0]=4 5123 B10R1.21 ClCCNCc1c[s]cc1 Amb25725584 [0,1,0,0,1,0|2,0,0]=4 5124 B10R1.21 ClCCNCc1ccc[s]1 Amb25769669 [0,1,0,0,1,0|2,0,0]=4 5125 B10R1.21 ClCCNCc1ccco1 Amb17334486 [0,1,0,0,1,0|2,0,0]=4 5126 B10R1.21 ClCCOCc1ccc[s]1 Amb18795876 [0,1,0,0,1,0|2,0,0]=4 5127 B10R1.21 ClCCSCc1ccc[s]1 Amb25781105 [0,1,0,0,1,0|2,0,0]=4 5128 B10R1.21 FCCCC[n]1cccc1 Amb25760766 [0,1,0,0,1,0|2,0,0]=4 5129 B10R1.21 FCCCN[n]1cccc1 Amb25098798 [0,1,0,0,1,0|2,0,0]=4 5130 B10R1.21 FCCCNc1c[s]cc1 Amb24385814 [0,1,0,0,1,0|2,0,0]=4 5131 B10R1.21 FCCCSc1ccc[s]1 Amb25071327 [0,1,0,0,1,0|2,0,0]=4 5132 B10R1.21 FCCNCc1ccc[s]1 Amb25685945 [0,1,0,0,1,0|2,0,0]=4 5133 B10R1.21 FCCNCc1ccco1 Amb25312860 [0,1,0,0,1,0|2,0,0]=4 5134 B10R1.21 FCCNCc1cocc1 Amb25101394 [0,1,0,0,1,0|2,0,0]=4 5135 B10R1.21 ICCNCc1ccc[s]1 Amb25363872 [0,1,0,0,1,0|2,0,0]=4 5136 B10R1.21 N#CCCC[n]1cccc1 Amb24060826 [0,1,0,0,1,0|2,0,0]=4 5137 B10R1.21 N#CCCCc1c[nH]cc1 Amb18223064 [0,1,0,0,1,0|2,0,0]=4 5138 B10R1.21 N#CCCCc1ccc[nH]1 Amb24358331 [0,1,0,0,1,0|2,0,0]=4 5139 B10R1.21 N#CCCCc1ccco1 Amb24509706 [0,1,0,0,1,0|2,0,0]=4 5140 B10R1.21 N#CCCCc1cccs1 Amb17232095 [0,1,0,0,1,0|2,0,0]=4 5141 B10R1.21 NCCCCc1c[nH]cc1 Amb18562443 [0,1,0,0,1,0|2,0,0]=4 5142 B10R1.21 NCCCCc1c[s]cc1 Amb25765310 [0,1,0,0,1,0|2,0,0]=4 5143 B10R1.21 NCCCN[n]1cccc1 Amb25682202 [0,1,0,0,1,0|2,0,0]=4 5144 B10R1.21 NCCCNc1ccc[s]1 Amb18312077 [0,1,0,0,1,0|2,0,0]=4 5145 B10R1.21 NCCNCc1c[s]cc1 Amb18307074 [0,1,0,0,1,0|2,0,0]=4 5146 B10R1.21 NCCNCc1ccc[nH]1 Amb19021350 [0,1,0,0,1,0|2,0,0]=4 5147 B10R1.21 NCCNCc1ccc[s]1 Amb18523821 [0,1,0,0,1,0|2,0,0]=4 5148 B10R1.21 NCCNCc1ccco1 Amb17091023 [0,1,0,0,1,0|2,0,0]=4 5149 B10R1.21 NCCNCc1cocc1 Amb18310661 [0,1,0,0,1,0|2,0,0]=4 5150 B10R1.21 NCCOCc1c[s]cc1 Amb19020781 [0,1,0,0,1,0|2,0,0]=4 5151 B10R1.21 NCCOCc1ccc[s]1 Amb19033621 [0,1,0,0,1,0|2,0,0]=4 5152 B10R1.21 NCCOCc1ccco1 Amb1138811 [0,1,0,0,1,0|2,0,0]=4 5153 B10R1.21 NCCOCc1cocc1 Amb24381340 [0,1,0,0,1,0|2,0,0]=4 5154 B10R1.21 NCCSCc1cocc1 Amb25102901 [0,1,0,0,1,0|2,0,0]=4 5155 B10R1.21 NCCSCc1cscc1 Amb2371320 [0,1,0,0,1,0|2,0,0]=4 5156 B10R1.21 NNCCCc1ccc[s]1 Amb24385929 [0,1,0,0,1,0|2,0,0]=4 5157 B10R1.21 NOCCCc1ccco1 Amb17089544 [0,1,0,0,1,0|1,0,0]=3 5158 B10R1.21 NOCCCc1cccs1 Amb17089545 [0,1,0,0,1,0|1,0,0]=3 5159 B10R1.21 NOCCSc1ccc[s]1 Amb25176001 [0,1,0,0,1,0|2,0,0]=4 5160 B10R1.21 O=CCCC[n]1cccc1 Amb24060824 [0,1,0,0,1,0|1,0,1]=4 5161 B10R1.21 O=CCCCc1c[nH]cc1 Amb18223326 [0,1,0,0,1,0|1,0,1]=4 5162 B10R1.21 O=CCCCc1c[s]cc1 Amb24415638 [0,1,0,0,1,0|1,0,1]=4 5163 B10R1.21 O=CCCCc1cccs1 Amb17089166 [0,1,0,0,1,0|1,0,1]=4 5164 B10R1.21 O=CCCCc1cocc1 Amb25684248 [0,1,0,0,1,0|1,0,1]=4 5165 B10R1.21 OCCC#Cc1c[s]cc1 Amb25301200 [0,1,0,0,1,0|1,0,1]=4 5166 B10R1.21 OCCC#Cc1ccc[s]1 Amb18179446 [0,1,0,0,1,0|1,0,1]=4 5167 B10R1.21 OCCC#Cc1ccco1 Amb24622475 [0,1,0,0,1,0|1,0,1]=4 5168 B10R1.21 OCCC#Cc1cocc1 Amb25709229 [0,1,0,0,1,0|1,0,1]=4 5169 B10R1.21 OCCCCC=1CC=CC1 Amb25353203 [0,1,0,0,1,0|0,0,1]=3 5170 B10R1.21 OCCCC[n]1cccc1 Amb25369054 [0,1,0,0,1,0|1,0,0]=3 5171 B10R1.21 OCCCCc1[nH]cc[n]1 Amb25856952 [0,1,0,0,1,0|2,0,0]=4 5172 B10R1.21 OCCCCc1c[nH]c[n]1 Amb24073802 [0,1,0,0,1,0|2,0,0]=4 5173 B10R1.21 OCCCCc1c[nH]cc1 Amb18223719 [0,1,0,0,1,0|1,0,0]=3 5174 B10R1.21 OCCCCc1c[s]c[n]1 Amb24099729 [0,1,0,0,1,0|2,0,0]=4 5175 B10R1.21 OCCCCc1ccco1 Amb17106038 [0,1,0,0,1,0|1,0,0]=3 5176 B10R1.21 OCCCCc1cocc1 Amb24475135 [0,1,0,0,1,0|1,0,0]=3 5177 B10R1.21 OCCCNc1c[s]cc1 Amb25268977 [0,1,0,0,1,0|1,0,0]=3 5178 B10R1.21 OCCCOc1[n]cc[s]1 Amb24480394 [0,1,0,0,1,0|2,0,0]=4 5179 B10R1.21 OCCCOc1c[s]cc1 Amb24511524 [0,1,0,0,1,0|1,0,0]=3 5180 B10R1.21 OCCCOc1ccc[s]1 Amb25226266 [0,1,0,0,1,0|1,0,0]=3 5181 B10R1.21 OCCCSc1[n]cc[s]1 Amb18178214 [0,1,0,0,1,0|2,0,0]=4 5182 B10R1.21 OCCNCc1[nH]cc[n]1 Amb18307826 [0,1,0,0,1,0|2,0,0]=4 5183 B10R1.21 OCCNCc1c[nH]c[n]1 Amb18311230 [0,1,0,0,1,0|2,0,0]=4 5184 B10R1.21 OCCNCc1c[nH]cc1 Amb18862446 [0,1,0,0,1,0|1,0,0]=3 5185 B10R1.21 OCCNCc1c[n]c[s]1 Amb18314301 [0,1,0,0,1,0|2,0,0]=4 5186 B10R1.21 OCCNCc1c[n]co1 Amb24389713 [0,1,0,0,1,0|2,0,0]=4 5187 B10R1.21 OCCNCc1c[s]c[n]1 Amb18523819 [0,1,0,0,1,0|2,0,0]=4 5188 B10R1.21 OCCNCc1ccc[nH]1 Amb17142860 [0,1,0,0,1,0|1,0,0]=3 5189 B10R1.21 OCCNCc1ccc[s]1 Amb21972158 [0,1,0,0,1,0|1,0,0]=3 5190 B10R1.21 OCCNCc1cco[n]1 Amb25097080 [0,1,0,0,1,0|2,0,0]=4 5191 B10R1.21 OCCNCc1coc[n]1 Amb25252008 [0,1,0,0,1,0|2,0,0]=4 5192 B10R1.21 OCCNCc1cocc1 Amb25797936 [0,1,0,0,1,0|1,0,0]=3 5193 B10R1.21 OCCNCc1cscc1 Amb13951827 [0,1,0,0,1,0|1,0,0]=3 5194 B10R1.21 OCCNCc1nccs1 Amb10607367 [0,1,0,0,1,0|2,0,0]=4 5195 B10R1.21 OCCNCc1nccs1 Amb13948968 [0,1,0,0,1,0|2,0,0]=4 5196 B10R1.21 OCCOCc1[nH]cc[n]1 Amb24718033 [0,1,0,0,1,0|2,0,0]=4 5197 B10R1.21 OCCOCc1[n]cc[s]1 Amb24069916 [0,1,0,0,1,0|2,0,0]=4 5198 B10R1.21 OCCOCc1c[s]cc1 Amb24651730 [0,1,0,0,1,0|1,0,0]=3 5199 B10R1.21 OCCOCc1cc[n][nH]1 Amb24354382 [0,1,0,0,1,0|2,0,0]=4 5200 B10R1.21 OCCOCc1ccco1 Amb25853996 [0,1,0,0,1,0|1,0,0]=3 5201 B10R1.21 OCCSC[n]1ccc[n]1 Amb24362885 [0,1,0,0,1,0|2,0,0]=4 5202 B10R1.21 OCCSCc1c[n]c[s]1 Amb24479436 [0,1,0,0,1,0|2,0,0]=4 5203 B10R1.21 OCCSCc1cocc1 Amb25308434 [0,1,0,0,1,0|1,0,0]=3 5204 B10R1.21 OCC\C=C\c1ccco1 Amb25060312 [0,1,0,0,1,0|1,0,1]=4 5205 B10R1.21 OCC\N=C\c1ccco1 Amb17593526 [0,1,0,0,1,0|1,0,1]=4 5206 B10R1.21 OC\C=C\Cc1ccco1 Amb25261764 [0,1,0,0,1,0|1,0,1]=4 5207 B10R1.21 SCCCCc1c[nH]cc1 Amb18563466 [0,1,0,0,1,0|1,1,0]=4 5208 B10R1.21 SCCCCc1ccco1 Amb18563472 [0,1,0,0,1,0|1,1,0]=4 5209 B10R1.21 SCCCCc1cccs1 Amb17400373 [0,1,0,0,1,0|1,1,0]=4 5210 B10R1.21 SCCNCc1ccc[s]1 Amb25691004 [0,1,0,0,1,0|1,1,0]=4 5211 B10R1.21 SCCNCc1ccco1 Amb18644955 [0,1,0,0,1,0|1,1,0]=4 5212 B10R1.21 SCCOCc1ccco1 Amb25144979 [0,1,0,0,1,0|1,1,0]=4 5213 B10R1.27 CC(CBr)Cc1ccc[nH]1 Amb25225279 [0,1,0,0,1,0|2,0,0]=4 5214 B10R1.27 CC(CBr)Cc1cocc1 Amb24413150 [0,1,0,0,1,0|2,0,0]=4 5215 B10R1.27 CC(CCl)Cc1c[s]cc1 Amb25055098 [0,1,0,0,1,0|2,0,0]=4 5216 B10R1.27 CC(CCl)Cc1ccc[nH]1 Amb25843387 [0,1,0,0,1,0|2,0,0]=4 5217 B10R1.27 CC(CCl)Cc1ccc[s]1 Amb25083926 [0,1,0,0,1,0|2,0,0]=4 5218 B10R1.27 CC(CCl)Cc1cocc1 Amb25779914 [0,1,0,0,1,0|2,0,0]=4 5219 B10R1.27 CC(CN)C[n]1cccc1 Amb18299860 [0,1,0,0,1,0|2,0,0]=4 5220 B10R1.27 CC(CN)Cc1c[s]cc1 Amb18992229 [0,1,0,0,1,0|2,0,0]=4 5221 B10R1.27 CC(CN)Cc1cocc1 Amb25730383 [0,1,0,0,1,0|2,0,0]=4 5222 B10R1.27 CC(CO)C[n]1c[n]cc1 Amb25675048 [0,1,0,0,1,0|2,0,0]=4 5223 B10R1.27 CC(CO)C[n]1cccc1 Amb25852261 [0,1,0,0,1,0|1,0,0]=3 5224 B10R1.27 CC(CO)Cc1cc[n][s]1 Amb25229666 [0,1,0,0,1,0|2,0,0]=4 5225 B10R1.27 CC(CO)Cc1cc[s][n]1 Amb25351358 [0,1,0,0,1,0|2,0,0]=4 5226 B10R1.27 CC(CO)Cc1coc[n]1 Amb25686409 [0,1,0,0,1,0|2,0,0]=4 5227 B10R1.27 CC(CO)Sc1ccc[s]1 Amb25776410 [0,1,0,0,1,0|2,0,0]=4 5228 B10R1.27 CC(Cc1ccc[s]1)NO Amb24756454 [0,1,0,0,1,0|2,0,0]=4 5229 B10R1.27 CC(Cc1ccco1)NO Amb24615522 [0,1,0,0,1,0|2,0,0]=4 5230 B10R1.27 CCC(Br)Cc1c[s]cc1 Amb24461792 [0,1,0,0,1,0|2,0,0]=4 5231 B10R1.27 CCC(Cc1cccs1)Cl Amb17477786 [0,1,0,0,1,0|2,0,0]=4 5232 B10R1.27 CCC(Cc1cccs1)O Amb17477783 [0,1,0,0,1,0|2,0,0]=4 5233 B10R1.27 CCC(Cl)Cc1c[s]cc1 Amb18178029 [0,1,0,0,1,0|2,0,0]=4 5234 B10R1.27 CCC(Cl)Cc1ccco1 Amb25086398 [0,1,0,0,1,0|2,0,0]=4 5235 B10R1.27 CCC(Cl)Cc1cocc1 Amb24662853 [0,1,0,0,1,0|2,0,0]=4 5236 B10R1.27 CCC(N)Cc1ccc[nH]1 Amb18985469 [0,1,0,0,1,0|2,0,0]=4 5237 B10R1.27 CCC(O)Cc1c[s]cc1 Amb18182141 [0,1,0,0,1,0|2,0,0]=4 5238 B10R1.27 C[C@@H](CO)Cc1ccco1 Amb24403930 [0,1,0,0,1,0|1,0,0]=3 5239 B10R1.27 C[C@@H](CO)Cc1coc[n]1 Amb24481170 [0,1,0,0,1,0|2,0,0]=4 5240 B10R1.27 C[C@H](CO)Cc1c[s]cc1 Amb25852894 [0,1,0,0,1,0|1,0,0]=3 5241 B10R1.27 C[C@H](CO)Cc1coc[n]1 Amb25801261 [0,1,0,0,1,0|2,0,0]=4 5242 B10R1.27 ClCC(Cc1cccs1)O Amb17594499 [0,1,0,0,1,0|2,0,0]=4 5243 B10R1.27 NC(CO)Cc1[n]cc[s]1 Amb25684115 [0,1,0,0,1,0|2,0,0]=4 5244 B10R1.27 NC(CO)Cc1c[n]c[s]1 Amb24104437 [0,1,0,0,1,0|2,0,0]=4 5245 B10R1.27 NC(CO)Cc1c[s]c[n]1 Amb24697508 [0,1,0,0,1,0|2,0,0]=4 5246 B10R1.27 NC(CO)Cc1ccc[nH]1 Amb25293337 [0,1,0,0,1,0|1,0,0]=3 5247 B10R1.27 NC(CO)Cc1cnc[nH]1 Amb17593572 [0,1,0,0,1,0|2,0,0]=4 5248 B10R1.27 NC(CO)Cc1cocc1 Amb24627260 [0,1,0,0,1,0|1,0,0]=3 5249 B10R1.27 NCC(Cc1ccco1)O Amb17231928 [0,1,0,0,1,0|2,0,0]=4 5250 B10R1.27 NCC(Cc1cccs1)O Amb17232229 [0,1,0,0,1,0|2,0,0]=4 5251 B10R1.27 NCC(F)C[n]1cccc1 Amb25292870 [0,1,0,0,1,0|2,0,0]=4 5252 B10R1.27 NCC(F)Cc1c[s]cc1 Amb25708968 [0,1,0,0,1,0|2,0,0]=4 5253 B10R1.27 NCC(F)Cc1ccco1 Amb24617369 [0,1,0,0,1,0|2,0,0]=4 5254 B10R1.27 NCC(N)Cc1ccc[s]1 Amb25072784 [0,1,0,0,1,0|2,0,0]=4 5255 B10R1.27 N[C@@H](CO)Cc1c[s]cc1 Amb24547320 [0,1,0,0,1,0|1,0,0]=3 5256 B10R1.27 N[C@H](CO)Cc1ccc[s]1 Amb25306299 [0,1,0,0,1,0|1,0,0]=3 5257 B10R1.27 OC(CCl)C[n]1cccc1 Amb24480551 [0,1,0,0,1,0|2,0,0]=4 5258 B10R1.27 OC(CCl)Cc1c[s]cc1 Amb25733649 [0,1,0,0,1,0|2,0,0]=4 5259 B10R1.27 OC(CCl)Cc1ccc[nH]1 Amb25213066 [0,1,0,0,1,0|2,0,0]=4 5260 B10R1.27 OC(CCl)Cc1ccco1 Amb25278037 [0,1,0,0,1,0|2,0,0]=4 5261 B10R1.27 OCC(=O)Cc1c[s]cc1 Amb25096464 [0,1,0,0,1,0|1,0,1]=4 5262 B10R1.27 OCC(=O)Cc1ccc[s]1 Amb24636460 [0,1,0,0,1,0|1,0,1]=4 5263 B10R1.27 OCC(Cc1ccco1)N Amb17062680 [0,1,0,0,1,0|1,0,0]=3 5264 B10R1.27 OCC(Cc1cccs1)N Amb17062681 [0,1,0,0,1,0|1,0,0]=3 5265 B10R1.27 OCC(O)C[n]1c[n]cc1 Amb24183800 [0,1,0,0,1,0|2,0,0]=4 5266 B10R1.27 OCC(O)C[n]1ccc[n]1 Amb24183806 [0,1,0,0,1,0|2,0,0]=4 5267 B10R1.27 OCC(O)C[n]1cccc1 Amb25066900 [0,1,0,0,1,0|1,0,0]=3 5268 B10R1.27 OCC(O)Cc1[nH]cc[n]1 Amb25737284 [0,1,0,0,1,0|2,0,0]=4 5269 B10R1.27 OCC(O)Cc1ccco1 Amb25308846 [0,1,0,0,1,0|1,0,0]=3 5270 B10R1.27 OC[C@@H](Cl)Cc1c[n]c[nH]1 Amb25088441 [0,1,0,0,1,0|2,0,0]=4 5271 B10R1.27 OC[C@@H](O)C[n]1c[n]cc1 Amb25831144 [0,1,0,0,1,0|2,0,0]=4 5272 B10R1.27 OC[C@@H](O)Cc1cco[n]1 Amb25106046 [0,1,0,0,1,0|2,0,0]=4 5273 B10R1.27 OC[C@H](O)Cc1[nH]cc[n]1 Amb24538060 [0,1,0,0,1,0|2,0,0]=4 5274 B10R1.29 Brc1c[s]cc1CCCBr Amb24669721 [0,1,0,0,1,0|2,0,0]=4 5275 B10R1.29 Brc1ccoc1CCCBr Amb24413629 [0,1,0,0,1,0|2,0,0]=4 5276 B10R1.29 CCCCc1[nH]ccc1F Amb25062122 [0,1,0,0,1,0|2,0,0]=4 5277 B10R1.29 CCCCc1[s]ccc1Br Amb25301567 [0,1,0,0,1,0|2,0,0]=4 5278 B10R1.29 CCCCc1c[s]cc1S Amb25301568 [0,1,0,0,1,0|2,0,0]=4 5279 B10R1.29 CCCCc1cc[s]c1Br Amb19958946 [0,1,0,0,1,0|2,0,0]=4 5280 B10R1.29 CCCCc1cocc1Cl Amb24743688 [0,1,0,0,1,0|2,0,0]=4 5281 B10R1.29 C[n]1cccc1CCCN Amb18202993 [0,1,0,0,1,0|2,0,0]=4 5282 B10R1.29 C[n]1cccc1CCCO Amb24446322 [0,1,0,0,1,0|1,0,0]=3 5283 B10R1.29 Cc1[n]c[nH]c1CCCO Amb25744526 [0,1,0,0,1,0|2,0,0]=4 5284 B10R1.29 Cc1[n]c[s]c1CCCO Amb22832090 [0,1,0,0,1,0|2,0,0]=4 5285 B10R1.29 Cc1[n]cc[n]1CCCO Amb21959604 [0,1,0,0,1,0|2,0,0]=4 5286 B10R1.29 Cc1[s]ccc1CCCN Amb18830831 [0,1,0,0,1,0|2,0,0]=4 5287 B10R1.29 Cc1c[nH]cc1CCCC Amb24380934 [0,1,0,0,1,0|2,0,0]=4 5288 B10R1.29 Cc1c[s]cc1CCCN Amb24558433 [0,1,0,0,1,0|2,0,0]=4 5289 B10R1.29 Cc1c[s]cc1NCCO Amb24564545 [0,1,0,0,1,0|2,0,0]=4 5290 B10R1.29 Cc1cc[nH]c1CCCC Amb25703049 [0,1,0,0,1,0|2,0,0]=4 5291 B10R1.29 Cc1cc[s]c1CCCBr Amb25332880 [0,1,0,0,1,0|2,0,0]=4 5292 B10R1.29 Cc1cocc1CCCCl Amb24580110 [0,1,0,0,1,0|2,0,0]=4 5293 B10R1.29 Cc1occc1CCCN Amb18832013 [0,1,0,0,1,0|2,0,0]=4 5294 B10R1.29 Cc1occc1SCCO Amb25042974 [0,1,0,0,1,0|2,0,0]=4 5295 B10R1.29 ClCCCc1[s]ccc1Br Amb25856509 [0,1,0,0,1,0|2,0,0]=4 5296 B10R1.29 ClCCCc1c[s]cc1Br Amb24556580 [0,1,0,0,1,0|2,0,0]=4 5297 B10R1.29 ClCCCc1cc[s]c1Br Amb24554079 [0,1,0,0,1,0|2,0,0]=4 5298 B10R1.29 ClCCCc1occc1Br Amb24471186 [0,1,0,0,1,0|2,0,0]=4 5299 B10R1.29 ClCCCc1sccc1C Amb17477785 [0,1,0,0,1,0|2,0,0]=4 5300 B10R1.29 Clc1cc[s]c1CCCCl Amb25831723 [0,1,0,0,1,0|2,0,0]=4 5301 B10R1.29 NCCCC1=CC=CC1[Na] Amb24712533 [0,1,0,0,1,0|1,0,1]=4 5302 B10R1.29 NCCCc1[s]ccc1Br Amb18301839 [0,1,0,0,1,0|2,0,0]=4 5303 B10R1.29 NCCCc1occc1Br Amb24365636 [0,1,0,0,1,0|2,0,0]=4 5304 B10R1.29 NCCCc1sccc1C Amb17477777 [0,1,0,0,1,0|2,0,0]=4 5305 B10R1.29 Nc1[nH][n]cc1CCCO Amb19514842 [0,1,0,0,1,0|2,0,0]=4 5306 B10R1.29 Nc1[n]occ1CCCO Amb24460333 [0,1,0,0,1,0|2,0,0]=4 5307 B10R1.29 Nc1cc[n][n]1CCCO Amb24524512 [0,1,0,0,1,0|2,0,0]=4 5308 B10R1.29 Nc1o[n]cc1CCCO Amb25802226 [0,1,0,0,1,0|2,0,0]=4 5309 B10R1.29 OCCCN1OC=CC1=O Amb25305137 [0,1,0,0,1,0|2,0,0]=4 5310 B10R1.29 OCCCc1[s]ccc1Br Amb24495718 [0,1,0,0,1,0|1,0,0]=3 5311 B10R1.29 OCCCc1c[s]cc1Br Amb24392551 [0,1,0,0,1,0|1,0,0]=3 5312 B10R1.29 OCCCc1cc[s]c1Br Amb25187302 [0,1,0,0,1,0|1,0,0]=3 5313 B10R1.29 OCCCc1cc[s]c1Cl Amb25772720 [0,1,0,0,1,0|1,0,0]=3 5314 B10R1.29 OCCCc1sccc1C Amb17477781 [0,1,0,0,1,0|1,0,0]=3 5315 B10R1.29 Oc1[nH][n]cc1CCCO Amb24386396 [0,1,0,0,1,0|2,0,0]=4 5316 B10R1.66 CC(Br)CCc1ccc[nH]1 Amb24452941 [0,1,0,0,1,0|2,0,0]=4 5317 B10R1.66 CC(Br)CCc1ccco1 Amb24529291 [0,1,0,0,1,0|2,0,0]=4 5318 B10R1.66 CC(Br)CCc1cocc1 Amb24360839 [0,1,0,0,1,0|2,0,0]=4 5319 B10R1.66 CC(CCc1ccco1)N Amb1080929 [0,1,0,0,1,0|2,0,0]=4 5320 B10R1.66 CC(CCc1cccs1)O Amb17507262 [0,1,0,0,1,0|1,0,0]=3 5321 B10R1.66 CC(Cl)CCc1c[s]cc1 Amb18808609 [0,1,0,0,1,0|2,0,0]=4 5322 B10R1.66 CC(Cl)CCc1ccc[nH]1 Amb25086421 [0,1,0,0,1,0|2,0,0]=4 5323 B10R1.66 CC(Cl)CCc1ccc[s]1 Amb18808608 [0,1,0,0,1,0|2,0,0]=4 5324 B10R1.66 CC(Cl)CCc1cocc1 Amb25257246 [0,1,0,0,1,0|2,0,0]=4 5325 B10R1.66 CC(N)CC[n]1cccc1 Amb24476813 [0,1,0,0,1,0|2,0,0]=4 5326 B10R1.66 CC(N)CCc1c[nH]cc1 Amb18223143 [0,1,0,0,1,0|2,0,0]=4 5327 B10R1.66 CC(O)CC[n]1ccc[n]1 Amb24271123 [0,1,0,0,1,0|2,0,0]=4 5328 B10R1.66 CC(O)CC[n]1cccc1 Amb24368946 [0,1,0,0,1,0|1,0,0]=3 5329 B10R1.66 CC(O)CCc1c[n]c[s]1 Amb25700591 [0,1,0,0,1,0|2,0,0]=4 5330 B10R1.66 CC(O)CCc1c[s]c[n]1 Amb24701386 [0,1,0,0,1,0|2,0,0]=4 5331 B10R1.66 CC(O)CCc1c[s]cc1 Amb18799744 [0,1,0,0,1,0|1,0,0]=3 5332 B10R1.66 CC(O)CCc1cc[n][s]1 Amb24586093 [0,1,0,0,1,0|2,0,0]=4 5333 B10R1.66 CC(O)CCc1cocc1 Amb25766119 [0,1,0,0,1,0|1,0,0]=3 5334 B10R1.66 CC(O)CN[n]1cccc1 Amb24731421 [0,1,0,0,1,0|2,0,0]=4 5335 B10R1.66 CC(O)CSc1c[s]cc1 Amb25048604 [0,1,0,0,1,0|2,0,0]=4 5336 B10R1.66 CC(O)CSc1ccc[s]1 Amb18180455 [0,1,0,0,1,0|2,0,0]=4 5337 B10R1.66 C[C@@H](O)CN[n]1cccc1 Amb25083744 [0,1,0,0,1,0|2,0,0]=4 5338 B10R1.66 C[C@@H](O)CNc1c[s]cc1 Amb25849372 [0,1,0,0,1,0|2,0,0]=4 5339 B10R1.66 C[C@@H](O)CSc1ccc[s]1 Amb24645865 [0,1,0,0,1,0|2,0,0]=4 5340 B10R1.66 C[C@H](O)CSc1ccc[s]1 Amb24545704 [0,1,0,0,1,0|2,0,0]=4 5341 B10R1.66 OB(O)CCc1ccc[s]1 Amb25700463 [0,1,0,0,1,0|2,0,0]=4 5342 B10R1.66 OC(=O)CCC=1CC=CC1 Amb25264551 [0,1,0,0,1,0|0,0,2]=4 5343 B10R1.66 OC(=O)CCc1cc[nH]c1 Amb18562783 [0,1,0,0,1,0|1,0,1]=4 5344 B10R1.66 OC(=O)CCc1ccc[nH]1 Amb10602142 [0,1,0,0,1,0|1,0,1]=4 5345 B10R1.66 OC(=O)CCc1ccco1 Amb1153073 [0,1,0,0,1,0|1,0,1]=4 5346 B10R1.66 OC(=O)CCc1cccs1 Amb1154297 [0,1,0,0,1,0|1,0,1]=4 5347 B10R1.66 OC(=O)CCc1ccoc1 Amb18643489 [0,1,0,0,1,0|1,0,1]=4 5348 B10R1.66 OC(=O)CCc1cscc1 Amb1153814 [0,1,0,0,1,0|1,0,1]=4 5349 B10R1.66 OC(=O)CCn1cccc1 Amb1130611 [0,1,0,0,1,0|1,0,1]=4 5350 B12R1.18 CCCC[C@@H]1C=CC=CNC1=O Amb25161373 [0,1,0,0,0,1|1,0,1]=4 5351 B12R1.18 CCCOC1=CC=CC=CC1=O Amb24722754 [0,1,0,0,0,1|2,0,0]=4 5352 B12R1.18 O=C1C=CC=CC=C1CCCCl Amb25151144 [0,1,0,0,0,1|1,0,0]=3 5353 B12R1.18 OCCOC1=CC=CC=CC1=O Amb24706831 [0,1,0,0,0,1|1,0,0]=3 5354 B12R1.18 OCCO[C@H]1CC=CC=CC1=O Amb25358903 [0,1,0,0,0,1|1,0,1]=4 5355 B12R1.348 CCCCC1CC=CC(=O)C=C1 Amb25092911 [0,1,0,0,0,1|1,0,1]=4 5356 B12R1.348 CCCCC=1C=CC(=O)C=CC1 Amb25767136 [0,1,0,0,0,1|1,0,0]=3 5357 B12R1.1414 CCCCNC=1CC=CC=CN1 Amb25272598 [0,1,0,0,0,1|1,0,1]=4 5358 B12R1.1 BrCCCC[NH+]1C=CC(=O)C=C1 Amb10553727 [0,2,0,0,0,0|2,0,0]=4 5359 B12R1.1 BrCCCOc1ccc(cc1)Cl Amb1154145 [0,2,0,0,0,0|1,0,0]=3 5360 B12R1.1 BrCCCOc1ccc(cc1)N Amb16230364 [0,2,0,0,0,0|1,0,0]=3 5361 B12R1.1 BrCC\C=C\c1ccc(cc1)Br Amb17175754 [0,2,0,0,0,0|1,0,1]=4 5362 B12R1.1 BrCC\C=C\c1ccc(cc1)C Amb17142004 [0,2,0,0,0,0|1,0,1]=4 5363 B12R1.1 BrCC\C=C\c1ccc(cc1)Cl Amb17159818 [0,2,0,0,0,0|1,0,1]=4 5364 B12R1.1 BrCC\C=C\c1ccc(cc1)F Amb17142520 [0,2,0,0,0,0|1,0,1]=4 5365 B12R1.1 C#CCCCN1C=CC(=O)C=C1 Amb24456572 [0,2,0,0,0,0|2,0,0]=4 5366 B12R1.1 C#CCCC[n+]1ccc(N)cc1 Amb24488876 [0,2,0,0,0,0|2,0,0]=4 5367 B12R1.1 C#CCCCc1ccc(O)cc1 Amb25370648 [0,2,0,0,0,0|1,0,0]=3 5368 B12R1.1 C#CCCNc1ccc(Cl)cc1 Amb25137648 [0,2,0,0,0,0|1,0,1]=4 5369 B12R1.1 C#CCCNc1ccc(I)cc1 Amb24483374 [0,2,0,0,0,0|1,0,1]=4 5370 B12R1.1 C#CCCOc1ccc(F)cc1 Amb24354706 [0,2,0,0,0,0|1,0,1]=4 5371 B12R1.1 C#CCCOc1ccc(N)cc1 Amb18290034 [0,2,0,0,0,0|1,0,1]=4 5372 B12R1.1 C#CCCSc1ccc(Cl)cc1 Amb25148456 [0,2,0,0,0,0|1,0,1]=4 5373 B12R1.1 C#CCCSc1ccc(F)cc1 Amb25757679 [0,2,0,0,0,0|1,0,1]=4 5374 B12R1.1 C#CCCSc1ccc(O)cc1 Amb18180838 [0,2,0,0,0,0|1,0,1]=4 5375 B12R1.1 C#CCNCc1ccc(Br)cc1 Amb21969141 [0,2,0,0,0,0|1,0,1]=4 5376 B12R1.1 C#CCNCc1ccc(Cl)cc1 Amb21979448 [0,2,0,0,0,0|1,0,1]=4 5377 B12R1.1 C#CCNCc1ccc(cc1)F Amb13951349 [0,2,0,0,0,0|1,0,1]=4 5378 B12R1.1 C#CCOCc1ccc(N)cc1 Amb18298742 [0,2,0,0,0,0|1,0,1]=4 5379 B12R1.1 C#CCOCc1ccc(O)cc1 Amb25092905 [0,2,0,0,0,0|1,0,1]=4 5380 B12R1.1 C#CCSCc1ccc(cc1)N Amb17499003 [0,2,0,0,0,0|1,0,1]=4 5381 B12R1.1 C=CCCCc1ccc(cc1)C Amb13890670 [0,2,0,0,0,0|1,0,0]=3 5382 B12R1.1 C=CCCCc1ccc(cc1)Cl Amb13890658 [0,2,0,0,0,0|1,0,0]=3 5383 B12R1.1 C=CCCCc1ccc(cc1)F Amb13890682 [0,2,0,0,0,0|1,0,0]=3 5384 B12R1.1 C=CCCNc1ccc(Br)cc1 Amb24364913 [0,2,0,0,0,0|1,0,1]=4 5385 B12R1.1 C=CCCNc1ccc(F)cc1 Amb25152653 [0,2,0,0,0,0|1,0,1]=4 5386 B12R1.1 C=CCCNc1ccc(I)cc1 Amb25087539 [0,2,0,0,0,0|1,0,1]=4 5387 B12R1.1 C=CCCNc1ccc(N)cc1 Amb24620212 [0,2,0,0,0,0|1,0,1]=4 5388 B12R1.1 C=CCCNc1ccc(cc1)C Amb10559134 [0,2,0,0,0,0|1,0,1]=4 5389 B12R1.1 C=CCCOc1ccc(N)cc1 Amb24102791 [0,2,0,0,0,0|1,0,1]=4 5390 B12R1.1 C=CCNCc1ccc(O)cc1 Amb19890782 [0,2,0,0,0,0|1,0,1]=4 5391 B12R1.1 C=CCNCc1ccc(cc1)Br Amb1923349 [0,2,0,0,0,0|1,0,1]=4 5392 B12R1.1 C=CCNCc1ccc(cc1)Cl Amb1923348 [0,2,0,0,0,0|1,0,1]=4 5393 B12R1.1 C=CCSCc1ccc(cc1)N Amb17498006 [0,2,0,0,0,0|1,0,1]=4 5394 B12R1.1 CCCC#Cc1ccc(Br)cc1 Amb25704153 [0,2,0,0,0,0|1,0,1]=4 5395 B12R1.1 CCCC#Cc1ccc(O)cc1 Amb25282857 [0,2,0,0,0,0|1,0,1]=4 5396 B12R1.1 CCCCCN1C=CC(=N)C=C1 Amb21922130 [0,2,0,0,0,0|2,0,0]=4 5397 B12R1.1 CCCCCN1C=CC(=N)C=C1 Amb21950891 [0,2,0,0,0,0|2,0,0]=4 5398 B12R1.1 CCCCCN1C=CC(=[NH2+])C=C1 Amb22555229 [0,2,0,0,0,0|2,0,0]=4 5399 B12R1.1 CCCCCc1ccc(cc1)Br Amb2413171 [0,2,0,0,0,0|1,0,0]=3 5400 B12R1.1 CCCCCc1ccc(nc1)C Amb10573556 [0,2,0,0,0,0|2,0,0]=4 5401 B12R1.1 CCCCNC=1C=CC(=O)NC1 Amb24759820 [0,2,0,0,0,0|2,0,0]=4 5402 B12R1.1 CCCCNc1ccc(F)[n]c1 Amb25276099 [0,2,0,0,0,0|2,0,0]=4 5403 B12R1.1 CCCCNc1ccc(F)c[n]1 Amb19012852 [0,2,0,0,0,0|2,0,0]=4 5404 B12R1.1 CCCCOc1ccc(Br)c[n]1 Amb20242025 [0,2,0,0,0,0|2,0,0]=4 5405 B12R1.1 CCCCOc1ccc(I)cc1 Amb19929171 [0,2,0,0,0,0|1,0,0]=3 5406 B12R1.1 CCCCOc1ccc(S)cc1 Amb19887938 [0,2,0,0,0,0|1,0,0]=3 5407 B12R1.1 CCCCOc1ccc(cc1)N Amb1127017 [0,2,0,0,0,0|1,0,0]=3 5408 B12R1.1 CCCCSc1ccc(Br)cc1 Amb22227904 [0,2,0,0,0,0|1,0,0]=3 5409 B12R1.1 CCCNCc1ccc(Br)[n]c1 Amb23541102 [0,2,0,0,0,0|2,0,0]=4 5410 B12R1.1 CCCNCc1ccc(Br)cc1 Amb19890387 [0,2,0,0,0,0|1,0,0]=3 5411 B12R1.1 CCCNCc1ccc(Cl)[n]c1 Amb21988426 [0,2,0,0,0,0|2,0,0]=4 5412 B12R1.1 CCCNCc1ccc(cc1)C Amb1215690 [0,2,0,0,0,0|1,0,0]=3 5413 B12R1.1 CCCNCc1ccc(cc1)Cl Amb10782093 [0,2,0,0,0,0|1,0,0]=3 5414 B12R1.1 CCCNCc1ccc(cc1)O Amb2445168 [0,2,0,0,0,0|1,0,0]=3 5415 B12R1.1 CCCSNc1ccc(N)cc1 Amb25780327 [0,2,0,0,0,0|2,0,0]=4 5416 B12R1.1 CCC\C=C/c1ccc(O)cc1 Amb24706851 [0,2,0,0,0,0|1,0,1]=4 5417 B12R1.1 CCC\C=C\c1ccc(F)cc1 Amb24439442 [0,2,0,0,0,0|1,0,1]=4 5418 B12R1.1 CCC\C=C\c1ccc(O)cc1 Amb24604844 [0,2,0,0,0,0|1,0,1]=4 5419 B12R1.1 CCC\C=C\c1ccc(cc1)Cl Amb10566844 [0,2,0,0,0,0|1,0,1]=4 5420 B12R1.1 CCC\C=N\c1ccc(O)cc1 Amb24736219 [0,2,0,0,0,0|1,0,1]=4 5421 B12R1.1 CCC\N=C\c1ccc(F)cc1 Amb24518468 [0,2,0,0,0,0|1,0,1]=4 5422 B12R1.1 CCC\N=C\c1ccc(cc1)O Amb2445167 [0,2,0,0,0,0|1,0,1]=4 5423 B12R1.1 CCNCCc1ccc(cc1)O Amb15694900 [0,2,0,0,0,0|1,0,0]=3 5424 B12R1.1 CCOCCc1ccc(Br)cc1 Amb23443758 [0,2,0,0,0,0|1,0,0]=3 5425 B12R1.1 CC\C=C\Cc1ccc(O)cc1 Amb24612459 [0,2,0,0,0,0|1,0,1]=4 5426 B12R1.1 CNCCCc1ccc(cc1)Br Amb17104523 [0,2,0,0,0,0|1,0,0]=3 5427 B12R1.1 CNCCCc1ccc(cc1)C Amb17104501 [0,2,0,0,0,0|1,0,0]=3 5428 B12R1.1 CNCCCc1ccc(cc1)Cl Amb17104509 [0,2,0,0,0,0|1,0,0]=3 5429 B12R1.1 CNCCCc1ccc(cc1)F Amb17104503 [0,2,0,0,0,0|1,0,0]=3 5430 B12R1.1 CNCCNc1ccc(Br)cc1 Amb19025288 [0,2,0,0,0,0|2,0,0]=4 5431 B12R1.1 CNCCNc1ccc(Cl)cc1 Amb19025281 [0,2,0,0,0,0|2,0,0]=4 5432 B12R1.1 CNCCNc1ccc(F)cc1 Amb18312613 [0,2,0,0,0,0|2,0,0]=4 5433 B12R1.1 CNCCOc1ccc(O)cc1 Amb19507657 [0,2,0,0,0,0|2,0,0]=4 5434 B12R1.1 CNCCOc1ccc(cc1)Br Amb22166 [0,2,0,0,0,0|2,0,0]=4 5435 B12R1.1 CNCCOc1ccc(cc1)C Amb1670236 [0,2,0,0,0,0|2,0,0]=4 5436 B12R1.1 CNCCOc1ccc(cc1)C Amb2140580 [0,2,0,0,0,0|2,0,0]=4 5437 B12R1.1 CNCCOc1ccc(cc1)F Amb1156338 [0,2,0,0,0,0|2,0,0]=4 5438 B12R1.1 CNCCOc1ccc(cc1)F Amb2094492 [0,2,0,0,0,0|2,0,0]=4 5439 B12R1.1 CNCCOc1ccc(cc1)N Amb17232615 [0,2,0,0,0,0|2,0,0]=4 5440 B12R1.1 CNCCSc1ccc(Cl)cc1 Amb19024601 [0,2,0,0,0,0|2,0,0]=4 5441 B12R1.1 CNCCSc1ccc(cc1)C Amb10608765 [0,2,0,0,0,0|2,0,0]=4 5442 B12R1.1 COCC#Cc1ccc(F)cc1 Amb25830550 [0,2,0,0,0,0|0,0,2]=4 5443 B12R1.1 COCCNc1ccc(F)c[n]1 Amb18306369 [0,2,0,0,0,0|2,0,0]=4 5444 B12R1.1 COCCNc1ccc(cc1)N Amb10610074 [0,2,0,0,0,0|1,0,0]=3 5445 B12R1.1 COCCNc1ccc(cn1)N Amb1116735 [0,2,0,0,0,0|2,0,0]=4 5446 B12R1.1 COCCOc1ccc(Br)c[n]1 Amb19349908 [0,2,0,0,0,0|2,0,0]=4 5447 B12R1.1 COCCOc1ccc(F)c[n]1 Amb19959844 [0,2,0,0,0,0|2,0,0]=4 5448 B12R1.1 COCCOc1ccc(cc1)N Amb1995318 [0,2,0,0,0,0|1,0,0]=3 5449 B12R1.1 COCCOc1ccc(cc1)N Amb2189147 [0,2,0,0,0,0|1,0,0]=3 5450 B12R1.1 COCSCc1ccc(cc1)N Amb17498310 [0,2,0,0,0,0|1,0,0]=3 5451 B12R1.1 COC\C=C\c1ccc(O)cc1 Amb25205735 [0,2,0,0,0,0|0,0,2]=4 5452 B12R1.1 CSCCNc1ccc(Br)cc1 Amb25725440 [0,2,0,0,0,0|1,1,0]=4 5453 B12R1.1 CSCCNc1ccc(F)cc1 Amb18312643 [0,2,0,0,0,0|1,1,0]=4 5454 B12R1.1 CSCCNc1ccc(cc1)C Amb17307505 [0,2,0,0,0,0|1,1,0]=4 5455 B12R1.1 CSCCOc1ccc(cc1)N Amb17504112 [0,2,0,0,0,0|1,1,0]=4 5456 B12R1.1 Cc1c[n]c(NCCCO)[n]c1 Amb25300816 [0,2,0,0,0,0|2,0,0]=4 5457 B12R1.1 Cc1ccc(C=C=CCO)cc1 Amb25045789 [0,2,0,0,0,0|0,0,2]=4 5458 B12R1.1 Cc1ccc(CCCCN)c[n]1 Amb18828702 [0,2,0,0,0,0|2,0,0]=4 5459 B12R1.1 Cc1ccc(CCNCC)c[n]1 Amb24066811 [0,2,0,0,0,0|2,0,0]=4 5460 B12R1.1 Cc1ccc(CNCCC)cc1 Amb19890384 [0,2,0,0,0,0|1,0,0]=3 5461 B12R1.1 Cc1ccc(COCC#C)cc1 Amb25092109 [0,2,0,0,0,0|1,0,1]=4 5462 B12R1.1 Cc1ccc(COCC#N)cc1 Amb25201451 [0,2,0,0,0,0|1,0,1]=4 5463 B12R1.1 Cc1ccc(CSCC#C)cc1 Amb25734271 [0,2,0,0,0,0|1,0,1]=4 5464 B12R1.1 Cc1ccc(CSCCCl)cc1 Amb21988400 [0,2,0,0,0,0|1,0,0]=3 5465 B12R1.1 Cc1ccc(C\C=C\CCl)cc1 Amb24652329 [0,2,0,0,0,0|1,0,1]=4 5466 B12R1.1 Cc1ccc(NCCCCl)[n]c1 Amb24485410 [0,2,0,0,0,0|2,0,0]=4 5467 B12R1.1 Cc1ccc(NCCCO)[n][n]1 Amb18306355 [0,2,0,0,0,0|2,0,0]=4 5468 B12R1.1 Cc1ccc(c[n]1)NCCCN Amb24402648 [0,2,0,0,0,0|2,0,0]=4 5469 B12R1.1 Cc1ccc(c[n]1)OCCOC Amb23455914 [0,2,0,0,0,0|2,0,0]=4 5470 B12R1.1 Cc1ccc(cc1)C#CCCCl Amb18796083 [0,2,0,0,0,0|1,0,1]=4 5471 B12R1.1 Cc1ccc(cc1)C#CCCN Amb25722543 [0,2,0,0,0,0|1,0,1]=4 5472 B12R1.1 Cc1ccc(cc1)C#CCCO Amb18792225 [0,2,0,0,0,0|0,0,1]=3 5473 B12R1.1 Cc1ccc(cc1)NCCCCl Amb24443028 [0,2,0,0,0,0|1,0,0]=3 5474 B12R1.1 Cc1ccc(cc1)NCCNC Amb19025280 [0,2,0,0,0,0|2,0,0]=4 5475 B12R1.1 Cc1ccc(cc1)SCCC#C Amb25378502 [0,2,0,0,0,0|1,0,1]=4 5476 B12R1.1 Cc1ccc(cc1)SCCCN Amb21984206 [0,2,0,0,0,0|1,0,0]=3 5477 B12R1.1 Cc1ccc(cc1)SCCNC Amb19892872 [0,2,0,0,0,0|2,0,0]=4 5478 B12R1.1 Cc1ccc(cc1)S\C=C\CO Amb25740678 [0,2,0,0,0,0|0,0,2]=4 5479 B12R1.1 ClCCCCc1ccc(cc1)Br Amb17160233 [0,2,0,0,0,0|1,0,0]=3 5480 B12R1.1 ClCCCCc1ccc(cc1)C Amb17139047 [0,2,0,0,0,0|1,0,0]=3 5481 B12R1.1 ClCCCCc1ccc(cc1)Cl Amb17139904 [0,2,0,0,0,0|1,0,0]=3 5482 B12R1.1 ClCCCCc1ccc(cc1)F Amb17139159 [0,2,0,0,0,0|1,0,0]=3 5483 B12R1.1 ClCCCOc1ccc(cc1)Br Amb1127124 [0,2,0,0,0,0|1,0,0]=3 5484 B12R1.1 ClCCCOc1ccc(cc1)Cl Amb1138390 [0,2,0,0,0,0|1,0,0]=3 5485 B12R1.1 ClCCCOc1ccc(cc1)F Amb1152973 [0,2,0,0,0,0|1,0,0]=3 5486 B12R1.1 ClCCNCc1ccc(cc1)C Amb17335658 [0,2,0,0,0,0|1,0,0]=3 5487 B12R1.1 ClCCOCc1ccc(cc1)Cl Amb2421038 [0,2,0,0,0,0|1,0,0]=3 5488 B12R1.1 ClCC\C=C\c1ccc(cc1)Br Amb17258088 [0,2,0,0,0,0|1,0,1]=4 5489 B12R1.1 ClCC\C=C\c1ccc(cc1)C Amb17233776 [0,2,0,0,0,0|1,0,1]=4 5490 B12R1.1 ClCC\C=C\c1ccc(cc1)Cl Amb17237225 [0,2,0,0,0,0|1,0,1]=4 5491 B12R1.1 ClCC\C=C\c1ccc(cc1)F Amb17234149 [0,2,0,0,0,0|1,0,1]=4 5492 B12R1.1 ClCNCNc1ccc(cc1)I Amb16224771 [0,2,0,0,0,0|2,0,0]=4 5493 B12R1.1 Clc1ccc(CCC[Mg]Cl)cc1 Amb22897276 [0,2,0,0,0,0|1,0,0]=3 5494 B12R1.1 Clc1ccc(CCC[Zn]Cl)cc1 Amb22897731 [0,2,0,0,0,0|1,0,0]=3 5495 B12R1.1 Clc1ccc(CSCCCl)cc1 Amb22346452 [0,2,0,0,0,0|1,0,0]=3 5496 B12R1.1 Clc1ccc(NCCCCl)[n]c1 Amb25847141 [0,2,0,0,0,0|2,0,0]=4 5497 B12R1.1 Clc1ccc(\C=N\CCCl)cc1 Amb24557149 [0,2,0,0,0,0|1,0,1]=4 5498 B12R1.1 Clc1ccc(c[n]1)NCCCCl Amb24423329 [0,2,0,0,0,0|2,0,0]=4 5499 B12R1.1 Clc1ccc(cc1)C#CCCCl Amb18322032 [0,2,0,0,0,0|1,0,1]=4 5500 B12R1.1 Clc1ccc(cc1)NCCCCl Amb25780138 [0,2,0,0,0,0|1,0,0]=3 5501 B12R1.1 FCCCNc1ccc(Cl)c[n]1 Amb24364494 [0,2,0,0,0,0|2,0,0]=4 5502 B12R1.1 FCCCNc1ccc(Cl)cc1 Amb24452998 [0,2,0,0,0,0|1,0,0]=3 5503 B12R1.1 FCCCNc1ccc(I)cc1 Amb25705819 [0,2,0,0,0,0|1,0,0]=3 5504 B12R1.1 FCCCOc1ccc(Br)cc1 Amb22008308 [0,2,0,0,0,0|1,0,0]=3 5505 B12R1.1 Fc1ccc(CCCCBr)cc1 Amb20671699 [0,2,0,0,0,0|1,0,0]=3 5506 B12R1.1 Fc1ccc(CSCCCl)cc1 Amb21988508 [0,2,0,0,0,0|1,0,0]=3 5507 B12R1.1 Fc1ccc(cc1)C#CCCCl Amb19057037 [0,2,0,0,0,0|1,0,1]=4 5508 B12R1.1 Fc1ccc(cc1)NCCCF Amb24669915 [0,2,0,0,0,0|1,0,0]=3 5509 B12R1.1 ICCCC[NH+]1C=CC(=O)C=C1 Amb10553744 [0,2,0,0,0,0|2,0,0]=4 5510 B12R1.1 N#CCCCN1C=CC(=O)C=C1 Amb18041799 [0,2,0,0,0,0|2,0,0]=4 5511 B12R1.1 N#CCCCc1ccc(O)cc1 Amb18645494 [0,2,0,0,0,0|1,0,0]=3 5512 B12R1.1 N#CCCCc1ccc(cc1)Br Amb17246438 [0,2,0,0,0,0|1,0,0]=3 5513 B12R1.1 N#CCCCc1ccc(cc1)C Amb17232302 [0,2,0,0,0,0|1,0,0]=3 5514 B12R1.1 N#CCCCc1ccc(cc1)Cl Amb17233649 [0,2,0,0,0,0|1,0,0]=3 5515 B12R1.1 N#CCCCc1ccc(cc1)F Amb17232424 [0,2,0,0,0,0|1,0,0]=3 5516 B12R1.1 N#CCCNc1ccc(cc1)Br Amb1149927 [0,2,0,0,0,0|1,0,1]=4 5517 B12R1.1 N#CCCNc1ccc(cc1)C Amb1643630 [0,2,0,0,0,0|1,0,1]=4 5518 B12R1.1 N#CCCNc1ccc(cc1)Cl Amb1647287 [0,2,0,0,0,0|1,0,1]=4 5519 B12R1.1 N#CCCNc1ccc(cc1)F Amb1103894 [0,2,0,0,0,0|1,0,1]=4 5520 B12R1.1 N#CCCNc1ccc(cc1)O Amb17142901 [0,2,0,0,0,0|1,0,1]=4 5521 B12R1.1 N#CCCOc1ccc(O)cc1 Amb25735175 [0,2,0,0,0,0|1,0,1]=4 5522 B12R1.1 N#CCCSc1ccc(cc1)C Amb1634502 [0,2,0,0,0,0|1,0,1]=4 5523 B12R1.1 N#CCNCc1ccc(Br)cc1 Amb18977451 [0,2,0,0,0,0|1,0,1]=4 5524 B12R1.1 N#CCNCc1ccc(O)cc1 Amb25154257 [0,2,0,0,0,0|1,0,1]=4 5525 B12R1.1 N#CCNCc1ccc(cc1)F Amb2416263 [0,2,0,0,0,0|1,0,1]=4 5526 B12R1.1 N#CCOCc1ccc(Br)cc1 Amb24649568 [0,2,0,0,0,0|1,0,1]=4 5527 B12R1.1 N#CCSCc1ccc(cc1)Br Amb17501726 [0,2,0,0,0,0|1,0,1]=4 5528 B12R1.1 N#CCSCc1ccc(cc1)C Amb17501722 [0,2,0,0,0,0|1,0,1]=4 5529 B12R1.1 N#CCSCc1ccc(cc1)F Amb17501725 [0,2,0,0,0,0|1,0,1]=4 5530 B12R1.1 N#CCSCc1ccc(cc1)N Amb17498135 [0,2,0,0,0,0|1,0,1]=4 5531 B12R1.1 N#CNCCc1ccc(Cl)cc1 Amb18809456 [0,2,0,0,0,0|1,0,1]=4 5532 B12R1.1 N#CNCCc1ccc(F)cc1 Amb18800778 [0,2,0,0,0,0|1,0,1]=4 5533 B12R1.1 NCCCCN1C=CC(=O)C=C1 Amb18534870 [0,2,0,0,0,0|2,0,0]=4 5534 B12R1.1 NCCCCc1ccc(Cl)cc1 Amb18015291 [0,2,0,0,0,0|1,0,0]=3 5535 B12R1.1 NCCCCc1ccc(O)cc1 Amb18828233 [0,2,0,0,0,0|1,0,0]=3 5536 B12R1.1 NCCCCc1ccc(O)cc1 Amb24117946 [0,2,0,0,0,0|1,0,0]=3 5537 B12R1.1 NCCCCc1ccc(cc1)Br Amb17195656 [0,2,0,0,0,0|1,0,0]=3 5538 B12R1.1 NCCCNc1ccc(Cl)[n]c1 Amb25336512 [0,2,0,0,0,0|2,0,0]=4 5539 B12R1.1 NCCCNc1ccc(F)c[n]1 Amb18306367 [0,2,0,0,0,0|2,0,0]=4 5540 B12R1.1 NCCCNc1ccc(cc1)Br Amb17057730 [0,2,0,0,0,0|1,0,0]=3 5541 B12R1.1 NCCCNc1ccc(cc1)C Amb17057723 [0,2,0,0,0,0|1,0,0]=3 5542 B12R1.1 NCCCNc1ccc(cc1)Cl Amb17057729 [0,2,0,0,0,0|1,0,0]=3 5543 B12R1.1 NCCCNc1ccc(cc1)F Amb17057726 [0,2,0,0,0,0|1,0,0]=3 5544 B12R1.1 NCCCNc1ccc(cn1)C Amb13949182 [0,2,0,0,0,0|2,0,0]=4 5545 B12R1.1 NCCCNc1ccc(cn1)N Amb17305771 [0,2,0,0,0,0|2,0,0]=4 5546 B12R1.1 NCCCNc1ccc(nc1)N Amb17305770 [0,2,0,0,0,0|2,0,0]=4 5547 B12R1.1 NCCCOc1ccc(cc1)C Amb1108458 [0,2,0,0,0,0|1,0,0]=3 5548 B12R1.1 NCCCOc1ccc(cc1)F Amb1108272 [0,2,0,0,0,0|1,0,0]=3 5549 B12R1.1 NCCCSc1ccc(Cl)cc1 Amb21984207 [0,2,0,0,0,0|1,0,0]=3 5550 B12R1.1 NCCCSc1ccc(cc1)F Amb162071 [0,2,0,0,0,0|1,0,0]=3 5551 B12R1.1 NCCCSc1ccc(cc1)F Amb2370740 [0,2,0,0,0,0|1,0,0]=3 5552 B12R1.1 NCCNCc1ccc(Br)cc1 Amb19012729 [0,2,0,0,0,0|1,0,0]=3 5553 B12R1.1 NCCNCc1ccc(Cl)[n]c1 Amb18129568 [0,2,0,0,0,0|2,0,0]=4 5554 B12R1.1 NCCNCc1ccc(cc1)Cl Amb10075508 [0,2,0,0,0,0|1,0,0]=3 5555 B12R1.1 NCCNCc1ccc(cc1)F Amb10075507 [0,2,0,0,0,0|1,0,0]=3 5556 B12R1.1 NCCOCc1ccc(cc1)Br Amb17061822 [0,2,0,0,0,0|1,0,0]=3 5557 B12R1.1 NCCOCc1ccc(cc1)C Amb17061816 [0,2,0,0,0,0|1,0,0]=3 5558 B12R1.1 NCCOCc1ccc(cc1)F Amb17061819 [0,2,0,0,0,0|1,0,0]=3 5559 B12R1.1 NCCSCc1ccc(cc1)Cl Amb1214895 [0,2,0,0,0,0|1,0,0]=3 5560 B12R1.1 NCC\C=C\c1ccc(I)cc1 Amb24493312 [0,2,0,0,0,0|1,0,1]=4 5561 B12R1.1 NCC\C=C\c1ccc(cc1)Br Amb17142136 [0,2,0,0,0,0|1,0,1]=4 5562 B12R1.1 NCC\C=C\c1ccc(cc1)C Amb17138533 [0,2,0,0,0,0|1,0,1]=4 5563 B12R1.1 NCC\C=C\c1ccc(cc1)Cl Amb17139018 [0,2,0,0,0,0|1,0,1]=4 5564 B12R1.1 NCC\C=C\c1ccc(cc1)F Amb17138587 [0,2,0,0,0,0|1,0,1]=4 5565 B12R1.1 NCC\N=C\c1ccc(Cl)cc1 Amb25238653 [0,2,0,0,0,0|1,0,1]=4 5566 B12R1.1 NNCCOc1ccc(cc1)Br Amb17407555 [0,2,0,0,0,0|2,0,0]=4 5567 B12R1.1 NNCCOc1ccc(cc1)C Amb1117290 [0,2,0,0,0,0|2,0,0]=4 5568 B12R1.1 NNCCOc1ccc(cc1)Cl Amb2282443 [0,2,0,0,0,0|2,0,0]=4 5569 B12R1.1 NNCCOc1ccc(cc1)Cl Amb2370789 [0,2,0,0,0,0|2,0,0]=4 5570 B12R1.1 NNCCOc1ccc(cc1)F Amb17400323 [0,2,0,0,0,0|2,0,0]=4 5571 B12R1.1 NOCC#Cc1ccc(F)cc1 Amb24661686 [0,2,0,0,0,0|0,0,2]=4 5572 B12R1.1 NOCCCc1ccc(cc1)Br Amb17089579 [0,2,0,0,0,0|0,0,0]=2 5573 B12R1.1 NOCCCc1ccc(cc1)C Amb17089551 [0,2,0,0,0,0|0,0,0]=2 5574 B12R1.1 NOCCCc1ccc(cc1)Cl Amb17089560 [0,2,0,0,0,0|0,0,0]=2 5575 B12R1.1 NOCCCc1ccc(cc1)F Amb17089553 [0,2,0,0,0,0|0,0,0]=2 5576 B12R1.1 NOCCCc1ccc(cc1)O Amb17089576 [0,2,0,0,0,0|0,0,0]=2 5577 B12R1.1 NOCCOc1ccc(cc1)Br Amb17088299 [0,2,0,0,0,0|1,0,0]=3 5578 B12R1.1 NOCCOc1ccc(cc1)C Amb17088290 [0,2,0,0,0,0|1,0,0]=3 5579 B12R1.1 NOCCOc1ccc(cc1)Cl Amb17088296 [0,2,0,0,0,0|1,0,0]=3 5580 B12R1.1 NOCCOc1ccc(cc1)F Amb17088293 [0,2,0,0,0,0|1,0,0]=3 5581 B12R1.1 N\N=C\CCc1ccc(F)cc1 Amb25854847 [0,2,0,0,0,0|1,0,1]=4 5582 B12R1.1 Nc1[n]cc(CNCCO)c[n]1 Amb23567607 [0,2,0,0,0,0|2,0,0]=4 5583 B12R1.1 Nc1c[n]c(NCCCO)[n]c1 Amb19010056 [0,2,0,0,0,0|2,0,0]=4 5584 B12R1.1 Nc1ccc(CCCC#N)cc1 Amb18645390 [0,2,0,0,0,0|1,0,0]=3 5585 B12R1.1 Nc1ccc(CCCCO)cc1 Amb18828232 [0,2,0,0,0,0|0,0,0]=2 5586 B12R1.1 Nc1ccc(NCCCO)[n][n]1 Amb25135758 [0,2,0,0,0,0|2,0,0]=4 5587 B12R1.1 Nc1ccc(c[n]1)NCCCF Amb24493654 [0,2,0,0,0,0|2,0,0]=4 5588 B12R1.1 Nc1ccc(cc1)OCCC#N Amb18290036 [0,2,0,0,0,0|1,0,1]=4 5589 B12R1.1 Nc1ccc(cc1)OCCCF Amb22008519 [0,2,0,0,0,0|1,0,0]=3 5590 B12R1.1 Nc1ccc(cc1)SCCC#N Amb25151005 [0,2,0,0,0,0|1,0,1]=4 5591 B12R1.1 Nc1ccc(cc1)S\C=C\CO Amb24623670 [0,2,0,0,0,0|0,0,2]=4 5592 B12R1.1 O=C=NCCc1ccc(cc1)Br Amb17089357 [0,2,0,0,0,0|0,0,2]=4 5593 B12R1.1 O=C=NCCc1ccc(cc1)C Amb17089349 [0,2,0,0,0,0|0,0,2]=4 5594 B12R1.1 O=C=NCCc1ccc(cc1)F Amb17089356 [0,2,0,0,0,0|0,0,2]=4 5595 B12R1.1 O=CCCCc1ccc(cc1)Br Amb17089176 [0,2,0,0,0,0|0,0,1]=3 5596 B12R1.1 O=CCCCc1ccc(cc1)C Amb17089167 [0,2,0,0,0,0|0,0,1]=3 5597 B12R1.1 O=CCCCc1ccc(cc1)Cl Amb17089175 [0,2,0,0,0,0|0,0,1]=3 5598 B12R1.1 O=CCCCc1ccc(cc1)F Amb17089174 [0,2,0,0,0,0|0,0,1]=3 5599 B12R1.1 O=CCCSc1ccc(cc1)Br Amb17082947 [0,2,0,0,0,0|0,0,2]=4 5600 B12R1.1 O=CCCSc1ccc(cc1)C Amb17082944 [0,2,0,0,0,0|0,0,2]=4 5601 B12R1.1 O=CCCSc1ccc(cc1)Cl Amb17082946 [0,2,0,0,0,0|0,0,2]=4 5602 B12R1.1 O=CCCSc1ccc(cc1)F Amb17082945 [0,2,0,0,0,0|0,0,2]=4 5603 B12R1.1 O=CNCCc1ccc(I)cc1 Amb25736857 [0,2,0,0,0,0|0,0,2]=4 5604 B12R1.1 OCC#CCc1ccc(Cl)cc1 Amb24671401 [0,2,0,0,0,0|0,0,1]=3 5605 B12R1.1 OCC=C=Cc1ccc(Cl)cc1 Amb24475143 [0,2,0,0,0,0|0,0,2]=4 5606 B12R1.1 OCCC#Cc1ccc(Br)c[n]1 Amb24517180 [0,2,0,0,0,0|1,0,1]=4 5607 B12R1.1 OCCC#Cc1ccc(Cl)cc1 Amb18796382 [0,2,0,0,0,0|0,0,1]=3 5608 B12R1.1 OCCC#Cc1ccc(F)cc1 Amb18792544 [0,2,0,0,0,0|0,0,1]=3 5609 B12R1.1 OCCC=Cc1ccc(F)cc1 Amb20671698 [0,2,0,0,0,0|0,0,1]=3 5610 B12R1.1 OCCCCc1ccc(cc1)Br Amb17089159 [0,2,0,0,0,0|0,0,0]=2 5611 B12R1.1 OCCCCc1ccc(cc1)C Amb16183285 [0,2,0,0,0,0|0,0,0]=2 5612 B12R1.1 OCCCCc1ccc(cc1)Cl Amb17089158 [0,2,0,0,0,0|0,0,0]=2 5613 B12R1.1 OCCCCc1ccc(cc1)F Amb17089157 [0,2,0,0,0,0|0,0,0]=2 5614 B12R1.1 OCCCNc1[n]cc(F)c[n]1 Amb24544506 [0,2,0,0,0,0|2,0,0]=4 5615 B12R1.1 OCCCNc1ccc(Br)[n]c1 Amb25188079 [0,2,0,0,0,0|1,0,0]=3 5616 B12R1.1 OCCCNc1ccc(F)c[n]1 Amb18306372 [0,2,0,0,0,0|1,0,0]=3 5617 B12R1.1 OCCCNc1ccc(cc1)Br Amb17306798 [0,2,0,0,0,0|0,0,0]=2 5618 B12R1.1 OCCCNc1ccc(cc1)C Amb17306885 [0,2,0,0,0,0|0,0,0]=2 5619 B12R1.1 OCCCNc1ccc(cc1)Cl Amb17307252 [0,2,0,0,0,0|0,0,0]=2 5620 B12R1.1 OCCCNc1ccc(cc1)F Amb17306196 [0,2,0,0,0,0|0,0,0]=2 5621 B12R1.1 OCCCNc1ccc(cc1)I Amb17306250 [0,2,0,0,0,0|0,0,0]=2 5622 B12R1.1 OCCCOc1ccc(cc1)F Amb1109753 [0,2,0,0,0,0|0,0,0]=2 5623 B12R1.1 OCCNCc1ccc(Br)[n]c1 Amb21861807 [0,2,0,0,0,0|1,0,0]=3 5624 B12R1.1 OCCNCc1ccc(Br)c[n]1 Amb24080720 [0,2,0,0,0,0|1,0,0]=3 5625 B12R1.1 OCCNCc1ccc(Cl)[n][n]1 Amb21862217 [0,2,0,0,0,0|2,0,0]=4 5626 B12R1.1 OCCNCc1ccc(Cl)[n]c1 Amb21861815 [0,2,0,0,0,0|1,0,0]=3 5627 B12R1.1 OCCNCc1ccc(Cl)[n]c1 Amb21988407 [0,2,0,0,0,0|1,0,0]=3 5628 B12R1.1 OCCOCc1ccc(cc1)Cl Amb2421036 [0,2,0,0,0,0|0,0,0]=2 5629 B12R1.1 OCC\C=C\c1ccc(F)cc1 Amb24763739 [0,2,0,0,0,0|0,0,1]=3 5630 B12R1.1 OCC\N=C\c1ccc(F)cc1 Amb24475878 [0,2,0,0,0,0|0,0,1]=3 5631 B12R1.1 ONCCOc1ccc(cc1)Br Amb17088425 [0,2,0,0,0,0|1,0,0]=3 5632 B12R1.1 ONCCOc1ccc(cc1)C Amb17088416 [0,2,0,0,0,0|1,0,0]=3 5633 B12R1.1 ONCCOc1ccc(cc1)Cl Amb17088422 [0,2,0,0,0,0|1,0,0]=3 5634 B12R1.1 ONCCOc1ccc(cc1)F Amb17088419 [0,2,0,0,0,0|1,0,0]=3 5635 B12R1.1 Oc1ccc(CCN=C=O)cc1 Amb25376148 [0,2,0,0,0,0|0,0,2]=4 5636 B12R1.1 Oc1ccc(CC\C=N\O)cc1 Amb24598916 [0,2,0,0,0,0|0,0,1]=3 5637 B12R1.1 Oc1ccc(NCCCO)[n][n]1 Amb21984449 [0,2,0,0,0,0|2,0,0]=4 5638 B12R1.1 Oc1ccc(cc1)C#CCCO Amb25271024 [0,2,0,0,0,0|0,0,1]=3 5639 B12R1.1 Oc1ccc(cc1)NCCCF Amb22008518 [0,2,0,0,0,0|1,0,0]=3 5640 B12R1.1 Oc1ccc(cc1)OCCCBr Amb18135328 [0,2,0,0,0,0|1,0,0]=3 5641 B12R1.1 Oc1ccc(cc1)OCCCF Amb22008282 [0,2,0,0,0,0|1,0,0]=3 5642 B12R1.1 S=C=NCCc1ccc(cc1)Br Amb17255961 [0,2,0,0,0,0|0,1,1]=4 5643 B12R1.1 S=CNCCc1ccc(Cl)cc1 Amb24558852 [0,2,0,0,0,0|0,1,1]=4 5644 B12R1.1 SCCCCc1ccc(cc1)Br Amb17411242 [0,2,0,0,0,0|0,1,0]=3 5645 B12R1.1 SCCCCc1ccc(cc1)C Amb17400847 [0,2,0,0,0,0|0,1,0]=3 5646 B12R1.1 SCCCCc1ccc(cc1)Cl Amb17402392 [0,2,0,0,0,0|0,1,0]=3 5647 B12R1.1 SCCCCc1ccc(cc1)F Amb17401040 [0,2,0,0,0,0|0,1,0]=3 5648 B12R1.1 SCCCOc1ccc(cc1)Br Amb17258959 [0,2,0,0,0,0|0,1,0]=3 5649 B12R1.1 SCCCOc1ccc(cc1)C Amb10813402 [0,2,0,0,0,0|0,1,0]=3 5650 B12R1.1 SCCCOc1ccc(cc1)N Amb17504082 [0,2,0,0,0,0|0,1,0]=3 5651 B12R1.1 [C-]#[N+]CCCc1ccc(C)cc1 Amb24610675 [0,2,0,0,0,0|1,0,0]=3 5652 B12R1.1 [C-]#[N+]CCOc1ccc(O)cc1 Amb25178460 [0,2,0,0,0,0|2,0,0]=4 5653 B12R1.1 [C-]#[N+]CCSc1ccc(C)cc1 Amb24686207 [0,2,0,0,0,0|2,0,0]=4 5654 B12R1.1 [N-]=[N+]=NCCc1ccc(F)cc1 Amb25780260 [0,2,0,0,0,0|2,0,0]=4 5655 B12R1.1 [N-]=[N+]=NCCc1ccc(N)cc1 Amb24419918 [0,2,0,0,0,0|2,0,0]=4 5656 B12R1.16 BrCCC(=O)c1ccc(cc1)Br Amb17437866 [0,2,0,0,0,0|1,0,1]=4 5657 B12R1.16 BrCCC(=O)c1ccc(cc1)F Amb17437867 [0,2,0,0,0,0|1,0,1]=4 5658 B12R1.16 BrCCC(c1ccc(cc1)Br)C Amb17290540 [0,2,0,0,0,0|1,0,0]=3 5659 B12R1.16 BrCCC(c1ccc(cc1)Cl)C Amb17259616 [0,2,0,0,0,0|1,0,0]=3 5660 B12R1.16 BrCCC(c1ccc(cc1)F)C Amb17249285 [0,2,0,0,0,0|1,0,0]=3 5661 B12R1.16 Brc1ccc(cc1)C(Br)CCBr Amb21864681 [0,2,0,0,0,0|1,0,0]=3 5662 B12R1.16 C#CCC(N)c1ccc(Cl)cc1 Amb18809277 [0,2,0,0,0,0|1,0,1]=4 5663 B12R1.16 C#CCC(N)c1ccc(F)cc1 Amb18959767 [0,2,0,0,0,0|1,0,1]=4 5664 B12R1.16 C#CCC(O)c1ccc(Cl)cc1 Amb18186756 [0,2,0,0,0,0|1,0,1]=4 5665 B12R1.16 C#CCC(O)c1ccc(F)cc1 Amb18800772 [0,2,0,0,0,0|1,0,1]=4 5666 B12R1.16 C#CCC(O)c1ccc(O)cc1 Amb18117920 [0,2,0,0,0,0|1,0,1]=4 5667 B12R1.16 C#CC[C@@H](O)c1ccc(F)cc1 Amb24100212 [0,2,0,0,0,0|1,0,1]=4 5668 B12R1.16 C#CC[C@H](N)c1ccc(Br)cc1 Amb24688092 [0,2,0,0,0,0|1,0,1]=4 5669 B12R1.16 C#CC[C@H](N)c1ccc(F)cc1 Amb24388527 [0,2,0,0,0,0|1,0,1]=4 5670 B12R1.16 C#CC[C@H](O)c1ccc(Cl)cc1 Amb24705595 [0,2,0,0,0,0|1,0,1]=4 5671 B12R1.16 C#CC[C@H](O)c1ccc(F)cc1 Amb25136315 [0,2,0,0,0,0|1,0,1]=4 5672 B12R1.16 C=C(CCO)c1ccc(Cl)cc1 Amb25760753 [0,2,0,0,0,0|0,0,1]=3 5673 B12R1.16 C=CCC(Cl)c1ccc(Cl)cc1 Amb25039265 [0,2,0,0,0,0|1,0,1]=4 5674 B12R1.16 C=CCC(N)c1ccc(Br)cc1 Amb18977585 [0,2,0,0,0,0|1,0,1]=4 5675 B12R1.16 C=CCC(N)c1ccc(F)cc1 Amb18977583 [0,2,0,0,0,0|1,0,1]=4 5676 B12R1.16 C=CCC(N)c1ccc(F)cc1 Amb19889920 [0,2,0,0,0,0|1,0,1]=4 5677 B12R1.16 C=CCC(N)c1ccc(S)cc1 Amb24744499 [0,2,0,0,0,0|1,0,1]=4 5678 B12R1.16 C=CCC(O)c1ccc(F)cc1 Amb18788452 [0,2,0,0,0,0|1,0,1]=4 5679 B12R1.16 C=CCC(O)c1ccc(I)cc1 Amb24384870 [0,2,0,0,0,0|1,0,1]=4 5680 B12R1.16 C=CCC(O)c1ccc(O)cc1 Amb18646044 [0,2,0,0,0,0|1,0,1]=4 5681 B12R1.16 C=CCC(c1ccc(cc1)Cl)N Amb17226689 [0,2,0,0,0,0|1,0,1]=4 5682 B12R1.16 C=CC[C@@H](N)c1ccc(Br)cc1 Amb22831742 [0,2,0,0,0,0|1,0,1]=4 5683 B12R1.16 C=CC[C@@H](N)c1ccc(Cl)cc1 Amb22831187 [0,2,0,0,0,0|1,0,1]=4 5684 B12R1.16 C=CC[C@@H](N)c1ccc(F)cc1 Amb22831777 [0,2,0,0,0,0|1,0,1]=4 5685 B12R1.16 C=CC[C@@H](N)c1ccc(F)cc1 Amb23440406 [0,2,0,0,0,0|1,0,1]=4 5686 B12R1.16 C=CC[C@@H](N)c1ccc(O)cc1 Amb25113869 [0,2,0,0,0,0|1,0,1]=4 5687 B12R1.16 C=CC[C@@H](N)c1ccc(S)cc1 Amb25127949 [0,2,0,0,0,0|1,0,1]=4 5688 B12R1.16 C=CC[C@H](N)c1ccc(Br)cc1 Amb24682606 [0,2,0,0,0,0|1,0,1]=4 5689 B12R1.16 C=CC[C@H](N)c1ccc(Cl)cc1 Amb25698455 [0,2,0,0,0,0|1,0,1]=4 5690 B12R1.16 C=CC[C@H](N)c1ccc(O)cc1 Amb25737463 [0,2,0,0,0,0|1,0,1]=4 5691 B12R1.16 C=CC[C@H](O)c1ccc(Cl)cc1 Amb25114679 [0,2,0,0,0,0|1,0,1]=4 5692 B12R1.16 C=CC[C@H](O)c1ccc(O)cc1 Amb24532744 [0,2,0,0,0,0|1,0,1]=4 5693 B12R1.16 CC(CC#N)c1ccc(Br)cc1 Amb25794629 [0,2,0,0,0,0|1,0,1]=4 5694 B12R1.16 CC(CCN)c1ccc(Cl)cc1 Amb22034632 [0,2,0,0,0,0|1,0,0]=3 5695 B12R1.16 CC(CCN)c1ccc(N)cc1 Amb25856793 [0,2,0,0,0,0|1,0,0]=3 5696 B12R1.16 CC(CCO)c1ccc(N)cc1 Amb24553218 [0,2,0,0,0,0|0,0,0]=2 5697 B12R1.16 CC(CCS)c1ccc(N)cc1 Amb24442941 [0,2,0,0,0,0|0,1,0]=3 5698 B12R1.16 CCCC(=C)c1ccc(N)cc1 Amb25258551 [0,2,0,0,0,0|1,0,1]=4 5699 B12R1.16 CCCC(=O)c1ccc(cc1)Br Amb2567820 [0,2,0,0,0,0|1,0,1]=4 5700 B12R1.16 CCCC(=O)c1ccc(cc1)Cl Amb1679791 [0,2,0,0,0,0|1,0,1]=4 5701 B12R1.16 CCCC(=O)c1ccc(cc1)O Amb1033062 [0,2,0,0,0,0|1,0,1]=4 5702 B12R1.16 CCCC(Br)c1ccc(Cl)cc1 Amb25281165 [0,2,0,0,0,0|1,0,0]=3 5703 B12R1.16 CCCC(C)c1ccc(N)cc1 Amb18126395 [0,2,0,0,0,0|1,0,0]=3 5704 B12R1.16 CCCC(N)c1c[n]c(Cl)cc1 Amb25041595 [0,2,0,0,0,0|2,0,0]=4 5705 B12R1.16 CCCC(N)c1c[n]c(N)cc1 Amb24504676 [0,2,0,0,0,0|2,0,0]=4 5706 B12R1.16 CCCC(N)c1c[n]c(O)cc1 Amb24487260 [0,2,0,0,0,0|2,0,0]=4 5707 B12R1.16 CCCC(N)c1ccc(Cl)c[n]1 Amb25082356 [0,2,0,0,0,0|2,0,0]=4 5708 B12R1.16 CCCC(N)c1ccc(Cl)cc1 Amb20626143 [0,2,0,0,0,0|1,0,0]=3 5709 B12R1.16 CCCC(N)c1ccc(F)c[n]1 Amb25368372 [0,2,0,0,0,0|2,0,0]=4 5710 B12R1.16 CCCC(N)c1ccc(I)cc1 Amb25118824 [0,2,0,0,0,0|1,0,0]=3 5711 B12R1.16 CCCC(N)c1ccc(O)c[n]1 Amb25326909 [0,2,0,0,0,0|2,0,0]=4 5712 B12R1.16 CCCC(N)c1ccc(O)cc1 Amb18939625 [0,2,0,0,0,0|1,0,0]=3 5713 B12R1.16 CCCC(O)c1c[n]c(N)cc1 Amb24532792 [0,2,0,0,0,0|2,0,0]=4 5714 B12R1.16 CCCC(O)c1ccc(Cl)c[n]1 Amb25152356 [0,2,0,0,0,0|2,0,0]=4 5715 B12R1.16 CCCC(O)c1ccc(F)c[n]1 Amb24417756 [0,2,0,0,0,0|2,0,0]=4 5716 B12R1.16 CCCC(O)c1ccc(N)cc1 Amb24619836 [0,2,0,0,0,0|1,0,0]=3 5717 B12R1.16 CCCC(c1ccc(cc1)Br)Cl Amb17160235 [0,2,0,0,0,0|1,0,0]=3 5718 B12R1.16 CCCC(c1ccc(cc1)C)Cl Amb17139051 [0,2,0,0,0,0|1,0,0]=3 5719 B12R1.16 CCCC(c1ccc(cc1)Cl)Cl Amb17139906 [0,2,0,0,0,0|1,0,0]=3 5720 B12R1.16 CCCC(c1ccc(cc1)F)Cl Amb17139162 [0,2,0,0,0,0|1,0,0]=3 5721 B12R1.16 CCCC(c1ccc(cc1)O)C Amb17594074 [0,2,0,0,0,0|1,0,0]=3 5722 B12R1.16 CCCS(=O)c1ccc(N)cc1 Amb18977331 [0,2,0,0,0,0|2,0,0]=4 5723 B12R1.16 CCC[C@@H](N)c1c[n]c(Cl)cc1 Amb25824629 [0,2,0,0,0,0|2,0,0]=4 5724 B12R1.16 CCC[C@@H](N)c1c[n]c(F)cc1 Amb24657257 [0,2,0,0,0,0|2,0,0]=4 5725 B12R1.16 CCC[C@@H](N)c1c[n]c(I)cc1 Amb24714642 [0,2,0,0,0,0|2,0,0]=4 5726 B12R1.16 CCC[C@@H](N)c1c[n]c(N)cc1 Amb24702941 [0,2,0,0,0,0|2,0,0]=4 5727 B12R1.16 CCC[C@@H](N)c1c[n]c(O)cc1 Amb24436481 [0,2,0,0,0,0|2,0,0]=4 5728 B12R1.16 CCC[C@@H](N)c1ccc(Br)cc1 Amb24729386 [0,2,0,0,0,0|1,0,0]=3 5729 B12R1.16 CCC[C@@H](N)c1ccc(Cl)c[n]1 Amb25148611 [0,2,0,0,0,0|2,0,0]=4 5730 B12R1.16 CCC[C@@H](N)c1ccc(Cl)cc1 Amb25043269 [0,2,0,0,0,0|1,0,0]=3 5731 B12R1.16 CCC[C@@H](N)c1ccc(F)c[n]1 Amb24488505 [0,2,0,0,0,0|2,0,0]=4 5732 B12R1.16 CCC[C@@H](N)c1ccc(F)cc1 Amb22298535 [0,2,0,0,0,0|1,0,0]=3 5733 B12R1.16 CCC[C@@H](N)c1ccc(F)cc1 Amb22744980 [0,2,0,0,0,0|1,0,0]=3 5734 B12R1.16 CCC[C@@H](N)c1ccc(I)cc1 Amb25195840 [0,2,0,0,0,0|1,0,0]=3 5735 B12R1.16 CCC[C@@H](N)c1ccc(N)c[n]1 Amb25112711 [0,2,0,0,0,0|2,0,0]=4 5736 B12R1.16 CCC[C@@H](N)c1ccc(N)cc1 Amb22288661 [0,2,0,0,0,0|1,0,0]=3 5737 B12R1.16 CCC[C@@H](N)c1ccc(N)cc1 Amb25149895 [0,2,0,0,0,0|1,0,0]=3 5738 B12R1.16 CCC[C@@H](N)c1ccc(O)c[n]1 Amb25703124 [0,2,0,0,0,0|2,0,0]=4 5739 B12R1.16 CCC[C@@H](N)c1ccc(O)cc1 Amb22288662 [0,2,0,0,0,0|1,0,0]=3 5740 B12R1.16 CCC[C@@H](N)c1ccc(O)cc1 Amb25063010 [0,2,0,0,0,0|1,0,0]=3 5741 B12R1.16 CCC[C@@H](O)c1ccc(Br)cc1 Amb25069849 [0,2,0,0,0,0|1,0,0]=3 5742 B12R1.16 CCC[C@@H](O)c1ccc(Cl)c[n]1 Amb25047962 [0,2,0,0,0,0|2,0,0]=4 5743 B12R1.16 CCC[C@@H](O)c1ccc(F)c[n]1 Amb25795724 [0,2,0,0,0,0|2,0,0]=4 5744 B12R1.16 CCC[C@@H](O)c1ccc(F)cc1 Amb24404009 [0,2,0,0,0,0|1,0,0]=3 5745 B12R1.16 CCC[C@H](N)c1c[n]c(Cl)cc1 Amb24680920 [0,2,0,0,0,0|2,0,0]=4 5746 B12R1.16 CCC[C@H](N)c1c[n]c(I)cc1 Amb24537710 [0,2,0,0,0,0|2,0,0]=4 5747 B12R1.16 CCC[C@H](N)c1c[n]c(O)cc1 Amb24745589 [0,2,0,0,0,0|2,0,0]=4 5748 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb22298578 [0,2,0,0,0,0|1,0,0]=3 5749 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb24700451 [0,2,0,0,0,0|1,0,0]=3 5750 B12R1.16 CCC[C@H](N)c1ccc(I)cc1 Amb25337897 [0,2,0,0,0,0|1,0,0]=3 5751 B12R1.16 CCC[C@H](N)c1ccc(N)c[n]1 Amb25150954 [0,2,0,0,0,0|2,0,0]=4 5752 B12R1.16 CCC[C@H](N)c1ccc(N)cc1 Amb22288706 [0,2,0,0,0,0|1,0,0]=3 5753 B12R1.16 CCC[C@H](N)c1ccc(O)c[n]1 Amb25751435 [0,2,0,0,0,0|2,0,0]=4 5754 B12R1.16 CCC[C@H](N)c1ccc(O)cc1 Amb22288707 [0,2,0,0,0,0|1,0,0]=3 5755 B12R1.16 CCC[C@H](N)c1ccc(S)cc1 Amb24341710 [0,2,0,0,0,0|1,0,0]=3 5756 B12R1.16 CCC[C@H](O)c1ccc(Cl)cc1 Amb24483363 [0,2,0,0,0,0|1,0,0]=3 5757 B12R1.16 CCC[C@H](O)c1ccc(F)cc1 Amb24576719 [0,2,0,0,0,0|1,0,0]=3 5758 B12R1.16 CCNC(c1ccc(cc1)Br)C Amb1095032 [0,2,0,0,0,0|2,0,0]=4 5759 B12R1.16 CCNC(c1ccc(cc1)F)C Amb10188230 [0,2,0,0,0,0|2,0,0]=4 5760 B12R1.16 CCN[C@@H](C)c1ccc(Cl)cc1 Amb25138514 [0,2,0,0,0,0|2,0,0]=4 5761 B12R1.16 CCN[C@H](C)c1ccc(Br)cc1 Amb25788596 [0,2,0,0,0,0|2,0,0]=4 5762 B12R1.16 CCN[C@H](C)c1ccc(Cl)cc1 Amb24383514 [0,2,0,0,0,0|2,0,0]=4 5763 B12R1.16 CCOC(C)c1ccc(Br)cc1 Amb23443733 [0,2,0,0,0,0|2,0,0]=4 5764 B12R1.16 CCOC(C)c1ccc(N)cc1 Amb18974004 [0,2,0,0,0,0|2,0,0]=4 5765 B12R1.16 CCOC(C)c1ccc(S)cc1 Amb23568732 [0,2,0,0,0,0|2,0,0]=4 5766 B12R1.16 CCSC(C)c1ccc(N)cc1 Amb18974009 [0,2,0,0,0,0|2,0,0]=4 5767 B12R1.16 CN(CCBr)c1ccc(F)cc1 Amb24450490 [0,2,0,0,0,0|2,0,0]=4 5768 B12R1.16 CN(CCCl)c1ccc(O)cc1 Amb25321957 [0,2,0,0,0,0|2,0,0]=4 5769 B12R1.16 CN(CCF)c1ccc(N)cc1 Amb25093879 [0,2,0,0,0,0|2,0,0]=4 5770 B12R1.16 CN(CCI)c1ccc(F)cc1 Amb24555424 [0,2,0,0,0,0|2,0,0]=4 5771 B12R1.16 CN(CCN)c1ccc(N)cc1 Amb18251776 [0,2,0,0,0,0|2,0,0]=4 5772 B12R1.16 CN(CCN)c1ccc(O)cc1 Amb18251791 [0,2,0,0,0,0|2,0,0]=4 5773 B12R1.16 CN(CCO)N1C=CC(=S)C=C1 Amb25057822 [0,2,0,0,0,0|2,0,0]=4 5774 B12R1.16 CN(CCO)c1ccc(Cl)c[n]1 Amb19058993 [0,2,0,0,0,0|2,0,0]=4 5775 B12R1.16 CN(CCO)c1ccc(F)c[n]1 Amb18177924 [0,2,0,0,0,0|2,0,0]=4 5776 B12R1.16 CN(CCO)c1ccc(O)cc1 Amb25202702 [0,2,0,0,0,0|1,0,0]=3 5777 B12R1.16 CNCC(C)c1ccc(N)cc1 Amb24355889 [0,2,0,0,0,0|2,0,0]=4 5778 B12R1.16 CNCC(O)c1ccc(F)cc1 Amb19373245 [0,2,0,0,0,0|2,0,0]=4 5779 B12R1.16 CNCC(O)c1ccc(I)cc1 Amb25742345 [0,2,0,0,0,0|2,0,0]=4 5780 B12R1.16 CNCC(O)c1ccc(N)cc1 Amb19888327 [0,2,0,0,0,0|2,0,0]=4 5781 B12R1.16 CNCC(O)c1ccc(O)cc1 Amb22166782 [0,2,0,0,0,0|2,0,0]=4 5782 B12R1.16 CNCC(O)c1ccc(O)cc1 Amb22346160 [0,2,0,0,0,0|2,0,0]=4 5783 B12R1.16 CNCC(c1ccc(cc1)Br)C Amb17248095 [0,2,0,0,0,0|2,0,0]=4 5784 B12R1.16 CNCC(c1ccc(cc1)Br)O Amb17142608 [0,2,0,0,0,0|2,0,0]=4 5785 B12R1.16 CNCC(c1ccc(cc1)C)C Amb17232442 [0,2,0,0,0,0|2,0,0]=4 5786 B12R1.16 CNCC(c1ccc(cc1)Cl)C Amb17234045 [0,2,0,0,0,0|2,0,0]=4 5787 B12R1.16 CNCC(c1ccc(cc1)F)C Amb17232642 [0,2,0,0,0,0|2,0,0]=4 5788 B12R1.16 CNC[C@@H](N)c1ccc(Cl)cc1 Amb25693381 [0,2,0,0,0,0|2,0,0]=4 5789 B12R1.16 CNC[C@@H](O)c1ccc(Cl)cc1 Amb25152551 [0,2,0,0,0,0|2,0,0]=4 5790 B12R1.16 CNC[C@@H](O)c1ccc(O)cc1 Amb25764531 [0,2,0,0,0,0|2,0,0]=4 5791 B12R1.16 CNC[C@H](O)c1ccc(Br)cc1 Amb25845203 [0,2,0,0,0,0|2,0,0]=4 5792 B12R1.16 CNC[C@H](O)c1ccc(Cl)cc1 Amb24423892 [0,2,0,0,0,0|2,0,0]=4 5793 B12R1.16 COCC(C)c1ccc(N)cc1 Amb25362017 [0,2,0,0,0,0|2,0,0]=4 5794 B12R1.16 COCC(F)c1ccc(O)cc1 Amb25845176 [0,2,0,0,0,0|2,0,0]=4 5795 B12R1.16 COCC(N)c1ccc(Br)cc1 Amb18070171 [0,2,0,0,0,0|2,0,0]=4 5796 B12R1.16 COCC(N)c1ccc(Cl)cc1 Amb18979034 [0,2,0,0,0,0|2,0,0]=4 5797 B12R1.16 COCC(N)c1ccc(F)cc1 Amb19375549 [0,2,0,0,0,0|2,0,0]=4 5798 B12R1.16 COCC(N)c1ccc(I)cc1 Amb24648633 [0,2,0,0,0,0|2,0,0]=4 5799 B12R1.16 COCC(N)c1ccc(O)cc1 Amb24581245 [0,2,0,0,0,0|2,0,0]=4 5800 B12R1.16 COCC(N)c1ccc(S)cc1 Amb24393366 [0,2,0,0,0,0|2,0,0]=4 5801 B12R1.16 COCC(O)c1ccc(Cl)cc1 Amb19058986 [0,2,0,0,0,0|2,0,0]=4 5802 B12R1.16 COCC(O)c1ccc(F)cc1 Amb18793595 [0,2,0,0,0,0|2,0,0]=4 5803 B12R1.16 COCC(O)c1ccc(I)cc1 Amb25680763 [0,2,0,0,0,0|2,0,0]=4 5804 B12R1.16 COCC(O)c1ccc(N)cc1 Amb18987938 [0,2,0,0,0,0|2,0,0]=4 5805 B12R1.16 COCC(c1ccc(cc1)C)N Amb1127416 [0,2,0,0,0,0|2,0,0]=4 5806 B12R1.16 COCC(c1ccc(cc1)F)N Amb1139881 [0,2,0,0,0,0|2,0,0]=4 5807 B12R1.16 COC[C@@H](N)c1ccc(Cl)cc1 Amb25709133 [0,2,0,0,0,0|2,0,0]=4 5808 B12R1.16 COC[C@@H](N)c1ccc(N)cc1 Amb24585135 [0,2,0,0,0,0|2,0,0]=4 5809 B12R1.16 COC[C@@H](N)c1ccc(S)cc1 Amb25340455 [0,2,0,0,0,0|2,0,0]=4 5810 B12R1.16 COC[C@H](N)c1ccc(Cl)cc1 Amb25128001 [0,2,0,0,0,0|2,0,0]=4 5811 B12R1.16 COC[C@H](N)c1ccc(N)cc1 Amb25756886 [0,2,0,0,0,0|2,0,0]=4 5812 B12R1.16 COC[C@H](N)c1ccc(O)cc1 Amb24452863 [0,2,0,0,0,0|2,0,0]=4 5813 B12R1.16 COC[C@H](O)c1ccc(Cl)cc1 Amb25158166 [0,2,0,0,0,0|2,0,0]=4 5814 B12R1.16 CSCC(N)c1ccc(Cl)cc1 Amb18995345 [0,2,0,0,0,0|2,0,0]=4 5815 B12R1.16 CSCC(N)c1ccc(F)cc1 Amb18300300 [0,2,0,0,0,0|2,0,0]=4 5816 B12R1.16 CSCC(O)c1ccc(Cl)cc1 Amb24488689 [0,2,0,0,0,0|2,0,0]=4 5817 B12R1.16 CSCC(O)c1ccc(F)cc1 Amb19070006 [0,2,0,0,0,0|2,0,0]=4 5818 B12R1.16 CSCC(O)c1ccc(N)cc1 Amb18987939 [0,2,0,0,0,0|2,0,0]=4 5819 B12R1.16 C[15NH][13CH2][13CH](c1ccc(cc1)O)O Amb17620274 [0,2,0,0,0,0|2,0,0]=4 5820 B12R1.16 C[C@@H](CCBr)c1ccc(Cl)cc1 Amb24667919 [0,2,0,0,0,0|1,0,0]=3 5821 B12R1.16 C[C@@H](CCO)c1ccc(Cl)cc1 Amb25832765 [0,2,0,0,0,0|0,0,0]=2 5822 B12R1.16 C[C@@H](CCO)c1ccc(F)cc1 Amb25317656 [0,2,0,0,0,0|0,0,0]=2 5823 B12R1.16 C[C@H](CC=O)c1ccc(Cl)cc1 Amb25039267 [0,2,0,0,0,0|0,0,2]=4 5824 B12R1.16 C\C(=C\CO)\c1ccc(Br)cc1 Amb24579789 [0,2,0,0,0,0|0,0,2]=4 5825 B12R1.16 C\C(=C\CO)\c1ccc(F)cc1 Amb25848827 [0,2,0,0,0,0|0,0,2]=4 5826 B12R1.16 Cc1ccc([n]c1)C(N)CCO Amb25743140 [0,2,0,0,0,0|1,0,0]=3 5827 B12R1.16 Cc1ccc([n]c1)C(O)CCC Amb24412250 [0,2,0,0,0,0|2,0,0]=4 5828 B12R1.16 Cc1ccc([n]c1)N(C)CCO Amb18792799 [0,2,0,0,0,0|2,0,0]=4 5829 B12R1.16 Cc1ccc([n]c1)[C@@H](N)CCC Amb25189382 [0,2,0,0,0,0|2,0,0]=4 5830 B12R1.16 Cc1ccc([n]c1)[C@@H](N)CCO Amb25719468 [0,2,0,0,0,0|1,0,0]=3 5831 B12R1.16 Cc1ccc([n]c1)[C@H](N)CCC Amb25340368 [0,2,0,0,0,0|2,0,0]=4 5832 B12R1.16 Cc1ccc(c[n]1)C(C)CCN Amb24525060 [0,2,0,0,0,0|2,0,0]=4 5833 B12R1.16 Cc1ccc(c[n]1)C(O)CCC Amb25683800 [0,2,0,0,0,0|2,0,0]=4 5834 B12R1.16 Cc1ccc(c[n]1)[C@@H](N)CCC Amb24488506 [0,2,0,0,0,0|2,0,0]=4 5835 B12R1.16 Cc1ccc(c[n]1)[C@@H](N)CCO Amb24597642 [0,2,0,0,0,0|1,0,0]=3 5836 B12R1.16 Cc1ccc(c[n]1)[C@H](N)CCO Amb25324270 [0,2,0,0,0,0|1,0,0]=3 5837 B12R1.16 Cc1ccc(cc1)C(=O)CCO Amb18563614 [0,2,0,0,0,0|0,0,1]=3 5838 B12R1.16 Cc1ccc(cc1)C(=O)CNO Amb25140702 [0,2,0,0,0,0|1,0,1]=4 5839 B12R1.16 Cc1ccc(cc1)C(=S)NCO Amb25751184 [0,2,0,0,0,0|1,0,1]=4 5840 B12R1.16 Cc1ccc(cc1)C(Br)CCBr Amb23456168 [0,2,0,0,0,0|1,0,0]=3 5841 B12R1.16 Cc1ccc(cc1)C(Br)CCCl Amb24544004 [0,2,0,0,0,0|1,0,0]=3 5842 B12R1.16 Cc1ccc(cc1)C(C)CC=C Amb24556400 [0,2,0,0,0,0|1,0,1]=4 5843 B12R1.16 Cc1ccc(cc1)C(C)CC=O Amb18645706 [0,2,0,0,0,0|0,0,2]=4 5844 B12R1.16 Cc1ccc(cc1)C(Cl)CC=C Amb25772787 [0,2,0,0,0,0|1,0,1]=4 5845 B12R1.16 Cc1ccc(cc1)C(Cl)CCO Amb24552889 [0,2,0,0,0,0|0,0,0]=2 5846 B12R1.16 Cc1ccc(cc1)C(Cl)CSC Amb25805205 [0,2,0,0,0,0|2,0,0]=4 5847 B12R1.16 Cc1ccc(cc1)C(N)CC#C Amb18800158 [0,2,0,0,0,0|1,0,1]=4 5848 B12R1.16 Cc1ccc(cc1)C(N)CC#N Amb18563500 [0,2,0,0,0,0|1,0,1]=4 5849 B12R1.16 Cc1ccc(cc1)C(N)CC=C Amb18977589 [0,2,0,0,0,0|1,0,1]=4 5850 B12R1.16 Cc1ccc(cc1)C(N)CCN Amb18646152 [0,2,0,0,0,0|1,0,0]=3 5851 B12R1.16 Cc1ccc(cc1)C(N)CSC Amb18995350 [0,2,0,0,0,0|2,0,0]=4 5852 B12R1.16 Cc1ccc(cc1)C(O)CC#C Amb18800361 [0,2,0,0,0,0|1,0,1]=4 5853 B12R1.16 Cc1ccc(cc1)C(O)CC=C Amb18177785 [0,2,0,0,0,0|1,0,1]=4 5854 B12R1.16 Cc1ccc(cc1)C(O)CC=O Amb24391927 [0,2,0,0,0,0|0,0,2]=4 5855 B12R1.16 Cc1ccc(cc1)C(O)CCO Amb18563722 [0,2,0,0,0,0|0,0,0]=2 5856 B12R1.16 Cc1ccc(cc1)C(O)COC Amb18792767 [0,2,0,0,0,0|2,0,0]=4 5857 B12R1.16 Cc1ccc(cc1)C(O)CSC Amb19061295 [0,2,0,0,0,0|2,0,0]=4 5858 B12R1.16 Cc1ccc(cc1)C(S)CCN Amb25112044 [0,2,0,0,0,0|1,0,0]=3 5859 B12R1.16 Cc1ccc(cc1)N(C)CCC Amb25154383 [0,2,0,0,0,0|2,0,0]=4 5860 B12R1.16 Cc1ccc(cc1)N(C)CCF Amb25355436 [0,2,0,0,0,0|2,0,0]=4 5861 B12R1.16 Cc1ccc(cc1)N(C)CCS Amb25858637 [0,2,0,0,0,0|1,1,0]=4 5862 B12R1.16 Cc1ccc(cc1)N(N)CCO Amb25755524 [0,2,0,0,0,0|1,0,0]=3 5863 B12R1.16 Cc1ccc(cc1)S(=O)CCN Amb18290917 [0,2,0,0,0,0|2,0,0]=4 5864 B12R1.16 Cc1ccc(cc1)S(=O)CCO Amb24578332 [0,2,0,0,0,0|1,0,0]=3 5865 B12R1.16 Cc1ccc(cc1)[C@@H](C)CCO Amb25058547 [0,2,0,0,0,0|0,0,0]=2 5866 B12R1.16 Cc1ccc(cc1)[C@@H](C)NCC Amb24425911 [0,2,0,0,0,0|2,0,0]=4 5867 B12R1.16 Cc1ccc(cc1)[C@@H](N)CC=C Amb22831227 [0,2,0,0,0,0|1,0,1]=4 5868 B12R1.16 Cc1ccc(cc1)[C@@H](N)CCC Amb22298580 [0,2,0,0,0,0|1,0,0]=3 5869 B12R1.16 Cc1ccc(cc1)[C@@H](N)CCO Amb19888370 [0,2,0,0,0,0|0,0,0]=2 5870 B12R1.16 Cc1ccc(cc1)[C@@H](N)CCO Amb23399704 [0,2,0,0,0,0|0,0,0]=2 5871 B12R1.16 Cc1ccc(cc1)[C@@H](O)CC#C Amb25706066 [0,2,0,0,0,0|1,0,1]=4 5872 B12R1.16 Cc1ccc(cc1)[C@@H](O)CC#N Amb24706705 [0,2,0,0,0,0|1,0,1]=4 5873 B12R1.16 Cc1ccc(cc1)[C@@H](O)CCC Amb24364768 [0,2,0,0,0,0|1,0,0]=3 5874 B12R1.16 Cc1ccc(cc1)[C@H](C)CC=O Amb24697433 [0,2,0,0,0,0|0,0,2]=4 5875 B12R1.16 Cc1ccc(cc1)[C@H](C)CCO Amb24671505 [0,2,0,0,0,0|0,0,0]=2 5876 B12R1.16 Cc1ccc(cc1)[C@H](C)NCC Amb24415678 [0,2,0,0,0,0|2,0,0]=4 5877 B12R1.16 Cc1ccc(cc1)[C@H](N)CCC Amb22298537 [0,2,0,0,0,0|1,0,0]=3 5878 B12R1.16 Cc1ccc(cc1)[C@H](N)CCO Amb19887704 [0,2,0,0,0,0|0,0,0]=2 5879 B12R1.16 Cc1ccc(cc1)[C@H](N)COC Amb24734357 [0,2,0,0,0,0|2,0,0]=4 5880 B12R1.16 Cc1ccc(cc1)[C@H](O)CCC Amb24709228 [0,2,0,0,0,0|1,0,0]=3 5881 B12R1.16 Cc1ccc(cc1)[C@H](O)CCCl Amb25361013 [0,2,0,0,0,0|1,0,0]=3 5882 B12R1.16 ClC(CCBr)c1ccc(Br)cc1 Amb21864682 [0,2,0,0,0,0|1,0,0]=3 5883 B12R1.16 ClCCC(=O)c1ccc(cc1)F Amb1233062 [0,2,0,0,0,0|1,0,1]=4 5884 B12R1.16 ClCCC(=O)c1ccc(cc1)N Amb17202006 [0,2,0,0,0,0|1,0,1]=4 5885 B12R1.16 ClCCC(c1ccc(cc1)Br)C Amb17259618 [0,2,0,0,0,0|1,0,0]=3 5886 B12R1.16 ClCCC(c1ccc(cc1)Br)O Amb17196599 [0,2,0,0,0,0|1,0,0]=3 5887 B12R1.16 ClCCC(c1ccc(cc1)C)C Amb17233970 [0,2,0,0,0,0|1,0,0]=3 5888 B12R1.16 ClCCC(c1ccc(cc1)C)O Amb17194565 [0,2,0,0,0,0|1,0,0]=3 5889 B12R1.16 ClCCC(c1ccc(cc1)Cl)C Amb17237597 [0,2,0,0,0,0|1,0,0]=3 5890 B12R1.16 ClCCC(c1ccc(cc1)Cl)O Amb17194897 [0,2,0,0,0,0|1,0,0]=3 5891 B12R1.16 ClCCC(c1ccc(cc1)F)C Amb17234366 [0,2,0,0,0,0|1,0,0]=3 5892 B12R1.16 ClCCC(c1ccc(cc1)F)O Amb17194592 [0,2,0,0,0,0|1,0,0]=3 5893 B12R1.16 ClCCN(c1ccc(cc1)Br)C Amb17351918 [0,2,0,0,0,0|2,0,0]=4 5894 B12R1.16 ClCCN(c1ccc(cc1)C)C Amb17335672 [0,2,0,0,0,0|2,0,0]=4 5895 B12R1.16 ClCCN(c1ccc(cc1)Cl)C Amb17338057 [0,2,0,0,0,0|2,0,0]=4 5896 B12R1.16 ClCCN(c1ccc(cc1)F)C Amb17335952 [0,2,0,0,0,0|2,0,0]=4 5897 B12R1.16 Clc1ccc(cc1)C(Br)CCBr Amb22001093 [0,2,0,0,0,0|1,0,0]=3 5898 B12R1.16 Clc1ccc(cc1)C(Br)CCCl Amb25089461 [0,2,0,0,0,0|1,0,0]=3 5899 B12R1.16 Fc1ccc(cc1)C(Br)CCCl Amb24741485 [0,2,0,0,0,0|1,0,0]=3 5900 B12R1.16 ICC[C@@H](c1ccc(cc1)F)O Amb16233257 [0,2,0,0,0,0|1,0,0]=3 5901 B12R1.16 N#CCC(O)c1ccc(Br)cc1 Amb18134741 [0,2,0,0,0,0|1,0,1]=4 5902 B12R1.16 N#CC[C@H](O)c1ccc(F)cc1 Amb24683357 [0,2,0,0,0,0|1,0,1]=4 5903 B12R1.16 NC(CC#N)c1ccc(Br)cc1 Amb18069916 [0,2,0,0,0,0|1,0,1]=4 5904 B12R1.16 NC(CC#N)c1ccc(Cl)cc1 Amb18564160 [0,2,0,0,0,0|1,0,1]=4 5905 B12R1.16 NC(CC#N)c1ccc(F)cc1 Amb18563605 [0,2,0,0,0,0|1,0,1]=4 5906 B12R1.16 NC(CCO)c1c[n]c(F)cc1 Amb24760895 [0,2,0,0,0,0|1,0,0]=3 5907 B12R1.16 NC(CCO)c1c[n]c(I)cc1 Amb24399872 [0,2,0,0,0,0|1,0,0]=3 5908 B12R1.16 NC(CCO)c1cc[n+]([O-])cc1 Amb25291128 [0,2,0,0,0,0|1,0,0]=3 5909 B12R1.16 NC(CCO)c1ccc(Br)c[n]1 Amb24540520 [0,2,0,0,0,0|1,0,0]=3 5910 B12R1.16 NC(CCO)c1ccc(Cl)cc1 Amb19888463 [0,2,0,0,0,0|0,0,0]=2 5911 B12R1.16 NC(CCO)c1ccc(F)c[n]1 Amb24713297 [0,2,0,0,0,0|1,0,0]=3 5912 B12R1.16 NC(CCO)c1ccc(F)cc1 Amb22490662 [0,2,0,0,0,0|0,0,0]=2 5913 B12R1.16 NC(CCO)c1ccc(I)c[n]1 Amb24375489 [0,2,0,0,0,0|1,0,0]=3 5914 B12R1.16 NC(CCO)c1ccc(O)[n]c1 Amb24561642 [0,2,0,0,0,0|1,0,0]=3 5915 B12R1.16 NC(CCO)c1ccc(O)c[n]1 Amb24668525 [0,2,0,0,0,0|1,0,0]=3 5916 B12R1.16 NCCC(=O)c1ccc(cc1)Br Amb17195655 [0,2,0,0,0,0|1,0,1]=4 5917 B12R1.16 NCCC(=O)c1ccc(cc1)C Amb17194471 [0,2,0,0,0,0|1,0,1]=4 5918 B12R1.16 NCCC(=O)c1ccc(cc1)Cl Amb17194559 [0,2,0,0,0,0|1,0,1]=4 5919 B12R1.16 NCCC(=O)c1ccc(cc1)F Amb17108934 [0,2,0,0,0,0|1,0,1]=4 5920 B12R1.16 NCCC(F)c1ccc(Br)cc1 Amb25255565 [0,2,0,0,0,0|1,0,0]=3 5921 B12R1.16 NCCC(N)c1ccc(Br)cc1 Amb24655128 [0,2,0,0,0,0|1,0,0]=3 5922 B12R1.16 NCCC(N)c1ccc(F)cc1 Amb18646990 [0,2,0,0,0,0|1,0,0]=3 5923 B12R1.16 NCCC(N)c1ccc(I)cc1 Amb25339716 [0,2,0,0,0,0|1,0,0]=3 5924 B12R1.16 NCCC(O)c1ccc(Cl)cc1 Amb21984559 [0,2,0,0,0,0|1,0,0]=3 5925 B12R1.16 NCCC(O)c1ccc(F)c[n]1 Amb24536213 [0,2,0,0,0,0|2,0,0]=4 5926 B12R1.16 NCCC(O)c1ccc(F)cc1 Amb21984558 [0,2,0,0,0,0|1,0,0]=3 5927 B12R1.16 NCCC(c1ccc(cc1)Br)O Amb17079141 [0,2,0,0,0,0|1,0,0]=3 5928 B12R1.16 NCCC(c1ccc(cc1)C)O Amb17079132 [0,2,0,0,0,0|1,0,0]=3 5929 B12R1.16 NCCC(c1ccc(cc1)Cl)O Amb17079140 [0,2,0,0,0,0|1,0,0]=3 5930 B12R1.16 NCCC(c1ccc(cc1)F)O Amb17079139 [0,2,0,0,0,0|1,0,0]=3 5931 B12R1.16 NCCN(c1ccc(cc1)Br)C Amb17059648 [0,2,0,0,0,0|2,0,0]=4 5932 B12R1.16 NCCN(c1ccc(cc1)C)C Amb13893182 [0,2,0,0,0,0|2,0,0]=4 5933 B12R1.16 NCCN(c1ccc(cc1)Cl)C Amb17059647 [0,2,0,0,0,0|2,0,0]=4 5934 B12R1.16 NCCN(c1ccc(cc1)F)C Amb17059644 [0,2,0,0,0,0|2,0,0]=4 5935 B12R1.16 NCCS(=O)c1ccc(Br)cc1 Amb18290919 [0,2,0,0,0,0|2,0,0]=4 5936 B12R1.16 NCCS(=O)c1ccc(Cl)cc1 Amb18974515 [0,2,0,0,0,0|2,0,0]=4 5937 B12R1.16 NCCS(=O)c1ccc(F)cc1 Amb18974517 [0,2,0,0,0,0|2,0,0]=4 5938 B12R1.16 NCCS(=O)c1ccc(I)cc1 Amb25315872 [0,2,0,0,0,0|2,0,0]=4 5939 B12R1.16 NCC[C@@H](N)c1ccc(Br)[n]c1 Amb24610157 [0,2,0,0,0,0|2,0,0]=4 5940 B12R1.16 NCC[C@@H](N)c1ccc(Br)cc1 Amb24655137 [0,2,0,0,0,0|1,0,0]=3 5941 B12R1.16 NCC[C@@H](N)c1ccc(F)cc1 Amb24549962 [0,2,0,0,0,0|1,0,0]=3 5942 B12R1.16 NCC[C@@H](O)c1ccc(F)cc1 Amb25148762 [0,2,0,0,0,0|1,0,0]=3 5943 B12R1.16 NCC[C@H](N)c1ccc(Br)cc1 Amb24617766 [0,2,0,0,0,0|1,0,0]=3 5944 B12R1.16 NCC[C@H](N)c1ccc(F)cc1 Amb25314561 [0,2,0,0,0,0|1,0,0]=3 5945 B12R1.16 NCC[C@H](O)c1ccc(Cl)cc1 Amb24727053 [0,2,0,0,0,0|1,0,0]=3 5946 B12R1.16 NCC[C@H](O)c1ccc(F)cc1 Amb25148765 [0,2,0,0,0,0|1,0,0]=3 5947 B12R1.16 NNCC(c1ccc(cc1)Br)O Amb17249280 [0,2,0,0,0,0|2,0,0]=4 5948 B12R1.16 NNCC(c1ccc(cc1)C)O Amb17232610 [0,2,0,0,0,0|2,0,0]=4 5949 B12R1.16 NNCC(c1ccc(cc1)Cl)O Amb17234362 [0,2,0,0,0,0|2,0,0]=4 5950 B12R1.16 NNCC(c1ccc(cc1)F)O Amb17232743 [0,2,0,0,0,0|2,0,0]=4 5951 B12R1.16 NOCC(c1ccc(cc1)Br)O Amb17345008 [0,2,0,0,0,0|2,0,0]=4 5952 B12R1.16 NOCC(c1ccc(cc1)C)O Amb17334705 [0,2,0,0,0,0|2,0,0]=4 5953 B12R1.16 NOCC(c1ccc(cc1)Cl)O Amb17335950 [0,2,0,0,0,0|2,0,0]=4 5954 B12R1.16 NOCC(c1ccc(cc1)F)O Amb17334839 [0,2,0,0,0,0|2,0,0]=4 5955 B12R1.16 N[C@@H](CC#N)c1ccc(Cl)cc1 Amb25679689 [0,2,0,0,0,0|1,0,1]=4 5956 B12R1.16 N[C@@H](CC#N)c1ccc(F)cc1 Amb24458202 [0,2,0,0,0,0|1,0,1]=4 5957 B12R1.16 N[C@@H](CC#N)c1ccc(O)cc1 Amb25107906 [0,2,0,0,0,0|1,0,1]=4 5958 B12R1.16 N[C@@H](CC#N)c1ccc(S)cc1 Amb25359865 [0,2,0,0,0,0|1,0,1]=4 5959 B12R1.16 N[C@@H](CCO)c1c[n]c(Cl)[n]c1 Amb24403312 [0,2,0,0,0,0|2,0,0]=4 5960 B12R1.16 N[C@@H](CCO)c1c[n]c(Cl)cc1 Amb24361595 [0,2,0,0,0,0|1,0,0]=3 5961 B12R1.16 N[C@@H](CCO)c1c[n]c(F)cc1 Amb24370788 [0,2,0,0,0,0|1,0,0]=3 5962 B12R1.16 N[C@@H](CCO)c1c[n]c(I)cc1 Amb25323952 [0,2,0,0,0,0|1,0,0]=3 5963 B12R1.16 N[C@@H](CCO)c1ccc(Br)c[n]1 Amb24399312 [0,2,0,0,0,0|1,0,0]=3 5964 B12R1.16 N[C@@H](CCO)c1ccc(Cl)c[n]1 Amb25368193 [0,2,0,0,0,0|1,0,0]=3 5965 B12R1.16 N[C@@H](CCO)c1ccc(Cl)cc1 Amb19888405 [0,2,0,0,0,0|0,0,0]=2 5966 B12R1.16 N[C@@H](CCO)c1ccc(Cl)cc1 Amb22747365 [0,2,0,0,0,0|0,0,0]=2 5967 B12R1.16 N[C@@H](CCO)c1ccc(F)c[n]1 Amb24411448 [0,2,0,0,0,0|1,0,0]=3 5968 B12R1.16 N[C@@H](CCO)c1ccc(F)cc1 Amb19888378 [0,2,0,0,0,0|0,0,0]=2 5969 B12R1.16 N[C@@H](CCO)c1ccc(O)[n]c1 Amb24487168 [0,2,0,0,0,0|1,0,0]=3 5970 B12R1.16 N[C@@H](CCO)c1ccc(O)c[n]1 Amb25324318 [0,2,0,0,0,0|1,0,0]=3 5971 B12R1.16 N[C@@H](CCO)c1ccc(O)cc1 Amb24446583 [0,2,0,0,0,0|0,0,0]=2 5972 B12R1.16 N[C@H](CC#N)c1ccc(Cl)cc1 Amb25149820 [0,2,0,0,0,0|1,0,1]=4 5973 B12R1.16 N[C@H](CC#N)c1ccc(F)cc1 Amb25092307 [0,2,0,0,0,0|1,0,1]=4 5974 B12R1.16 N[C@H](CC#N)c1ccc(S)cc1 Amb24485695 [0,2,0,0,0,0|1,0,1]=4 5975 B12R1.16 N[C@H](CCO)c1c[n]c(Br)cc1 Amb24759936 [0,2,0,0,0,0|1,0,0]=3 5976 B12R1.16 N[C@H](CCO)c1c[n]c(Cl)cc1 Amb25722664 [0,2,0,0,0,0|1,0,0]=3 5977 B12R1.16 N[C@H](CCO)c1c[n]c(F)cc1 Amb24715237 [0,2,0,0,0,0|1,0,0]=3 5978 B12R1.16 N[C@H](CCO)c1c[n]c(I)cc1 Amb25118710 [0,2,0,0,0,0|1,0,0]=3 5979 B12R1.16 N[C@H](CCO)c1ccc(Br)c[n]1 Amb25035262 [0,2,0,0,0,0|1,0,0]=3 5980 B12R1.16 N[C@H](CCO)c1ccc(Br)cc1 Amb19887638 [0,2,0,0,0,0|0,0,0]=2 5981 B12R1.16 N[C@H](CCO)c1ccc(Cl)c[n]1 Amb25859241 [0,2,0,0,0,0|1,0,0]=3 5982 B12R1.16 N[C@H](CCO)c1ccc(Cl)cc1 Amb19887657 [0,2,0,0,0,0|0,0,0]=2 5983 B12R1.16 N[C@H](CCO)c1ccc(F)c[n]1 Amb24587759 [0,2,0,0,0,0|1,0,0]=3 5984 B12R1.16 N[C@H](CCO)c1ccc(F)cc1 Amb19887667 [0,2,0,0,0,0|0,0,0]=2 5985 B12R1.16 N[C@H](CCO)c1ccc(O)cc1 Amb25339383 [0,2,0,0,0,0|0,0,0]=2 5986 B12R1.16 N[C@H](CCO)c1ccc(S)cc1 Amb25824151 [0,2,0,0,0,0|0,0,0]=2 5987 B12R1.16 Nc1ccc([n]c1)[C@H](N)CCO Amb24393367 [0,2,0,0,0,0|1,0,0]=3 5988 B12R1.16 Nc1ccc(c[n]1)[C@@H](N)CCO Amb24657316 [0,2,0,0,0,0|1,0,0]=3 5989 B12R1.16 Nc1ccc(cc1)C(=O)CCN Amb24550545 [0,2,0,0,0,0|1,0,1]=4 5990 B12R1.16 Nc1ccc(cc1)C(N)CCO Amb19887602 [0,2,0,0,0,0|0,0,0]=2 5991 B12R1.16 Nc1ccc(cc1)[C@@H](N)CC#N Amb24703347 [0,2,0,0,0,0|1,0,1]=4 5992 B12R1.16 Nc1ccc(cc1)[C@H](N)CCO Amb19887604 [0,2,0,0,0,0|0,0,0]=2 5993 B12R1.16 O=C(CCCl)c1ccc(I)cc1 Amb24417846 [0,2,0,0,0,0|1,0,1]=4 5994 B12R1.16 O=S(CCCl)c1ccc(F)cc1 Amb24536748 [0,2,0,0,0,0|2,0,0]=4 5995 B12R1.16 OC(CC=O)c1ccc(Cl)cc1 Amb25094341 [0,2,0,0,0,0|0,0,2]=4 5996 B12R1.16 OC(CC=O)c1ccc(F)cc1 Amb25053144 [0,2,0,0,0,0|0,0,2]=4 5997 B12R1.16 OC(CCI)c1ccc(F)cc1 Amb24537939 [0,2,0,0,0,0|1,0,0]=3 5998 B12R1.16 OC(c1ccc(cc1)C)CC#N Amb17232362 [0,2,0,0,0,0|1,0,1]=4 5999 B12R1.16 OC(c1ccc(cc1)F)CC#N Amb17232518 [0,2,0,0,0,0|1,0,1]=4 6000 B12R1.16 OCCC(=O)c1ccc(Br)cc1 Amb18069914 [0,2,0,0,0,0|0,0,1]=3 6001 B12R1.16 OCCC(=O)c1ccc(Cl)cc1 Amb18564305 [0,2,0,0,0,0|0,0,1]=3 6002 B12R1.16 OCCC(=O)c1ccc(cc1)F Amb1111123 [0,2,0,0,0,0|0,0,1]=3 6003 B12R1.16 OCCC(Cl)c1ccc(Cl)cc1 Amb24752170 [0,2,0,0,0,0|0,0,0]=2 6004 B12R1.16 OCCC(F)c1ccc(F)cc1 Amb25158049 [0,2,0,0,0,0|0,0,0]=2 6005 B12R1.16 OCCC(O)c1ccc(Br)cc1 Amb18070318 [0,2,0,0,0,0|0,0,0]=2 6006 B12R1.16 OCCC(O)c1ccc(Cl)cc1 Amb18066186 [0,2,0,0,0,0|0,0,0]=2 6007 B12R1.16 OCCC(O)c1ccc(F)cc1 Amb18563926 [0,2,0,0,0,0|0,0,0]=2 6008 B12R1.16 OCCC(c1ccc(cc1)Br)C Amb17248426 [0,2,0,0,0,0|0,0,0]=2 6009 B12R1.16 OCCC(c1ccc(cc1)C)C Amb17232490 [0,2,0,0,0,0|0,0,0]=2 6010 B12R1.16 OCCC(c1ccc(cc1)C)N Amb17103955 [0,2,0,0,0,0|0,0,0]=2 6011 B12R1.16 OCCC(c1ccc(cc1)Cl)C Amb17234157 [0,2,0,0,0,0|0,0,0]=2 6012 B12R1.16 OCCC(c1ccc(cc1)Cl)N Amb1993959 [0,2,0,0,0,0|0,0,0]=2 6013 B12R1.16 OCCC(c1ccc(cc1)F)C Amb17232668 [0,2,0,0,0,0|0,0,0]=2 6014 B12R1.16 OCCN(c1ccc(cc1)Br)C Amb17344450 [0,2,0,0,0,0|1,0,0]=3 6015 B12R1.16 OCCN(c1ccc(cc1)C)C Amb17334645 [0,2,0,0,0,0|1,0,0]=3 6016 B12R1.16 OCCN(c1ccc(cc1)Cl)C Amb17335812 [0,2,0,0,0,0|1,0,0]=3 6017 B12R1.16 OCCN(c1ccc(cc1)F)C Amb17334764 [0,2,0,0,0,0|1,0,0]=3 6018 B12R1.16 OCCN(c1ccc(cn1)Br)C Amb17610089 [0,2,0,0,0,0|2,0,0]=4 6019 B12R1.16 OCCN(c1ccc(nc1)Cl)C Amb17562763 [0,2,0,0,0,0|2,0,0]=4 6020 B12R1.16 OCC[C@@H](O)c1ccc(Cl)cc1 Amb24749568 [0,2,0,0,0,0|0,0,0]=2 6021 B12R1.16 OCC[C@@H](O)c1ccc(F)cc1 Amb25070596 [0,2,0,0,0,0|0,0,0]=2 6022 B12R1.16 OCC[C@H](O)c1ccc(Cl)cc1 Amb25129763 [0,2,0,0,0,0|0,0,0]=2 6023 B12R1.16 OCC[C@H](O)c1ccc(F)cc1 Amb24601023 [0,2,0,0,0,0|0,0,0]=2 6024 B12R1.16 OCNC(=S)c1ccc(Cl)cc1 Amb25081413 [0,2,0,0,0,0|1,0,1]=4 6025 B12R1.16 OC\C=C(\F)/c1ccc(Cl)cc1 Amb24569989 [0,2,0,0,0,0|0,0,2]=4 6026 B12R1.16 ONCC(c1ccc(cc1)Br)O Amb17345007 [0,2,0,0,0,0|1,0,0]=3 6027 B12R1.16 ONCC(c1ccc(cc1)C)O Amb17334704 [0,2,0,0,0,0|1,0,0]=3 6028 B12R1.16 ONCC(c1ccc(cc1)Cl)O Amb17335949 [0,2,0,0,0,0|1,0,0]=3 6029 B12R1.16 ONCC(c1ccc(cc1)F)O Amb17334838 [0,2,0,0,0,0|1,0,0]=3 6030 B12R1.16 ONCC(c1ccc(cc1)O)O Amb17334758 [0,2,0,0,0,0|1,0,0]=3 6031 B12R1.16 O[C@@H](CCCl)c1ccc(F)cc1 Amb25073942 [0,2,0,0,0,0|1,0,0]=3 6032 B12R1.16 O[C@H](CCCl)c1ccc(F)cc1 Amb24711502 [0,2,0,0,0,0|1,0,0]=3 6033 B12R1.16 Oc1ccc(cc1)C(=O)CCCl Amb18552996 [0,2,0,0,0,0|1,0,1]=4 6034 B12R1.16 Oc1ccc(cc1)C(O)\C=N\O Amb24697867 [0,2,0,0,0,0|1,0,1]=4 6035 B12R1.16 SCCC(=O)c1ccc(cc1)Br Amb17411234 [0,2,0,0,0,0|0,1,1]=4 6036 B12R1.16 SCCC(=O)c1ccc(cc1)C Amb17400836 [0,2,0,0,0,0|0,1,1]=4 6037 B12R1.16 SCCC(=O)c1ccc(cc1)Cl Amb17402391 [0,2,0,0,0,0|0,1,1]=4 6038 B12R1.16 SCCC(=O)c1ccc(cc1)F Amb17401021 [0,2,0,0,0,0|0,1,1]=4 6039 B12R1.16 [C-]#[N+]CC(Cl)c1ccc(Cl)cc1 Amb25086191 [0,2,0,0,0,0|2,0,0]=4 6040 B12R1.21 CC(Br)CCc1ccc(Br)c[n]1 Amb25213526 [0,2,0,0,0,0|2,0,0]=4 6041 B12R1.21 CC(Br)CCc1ccc(Br)cc1 Amb25803938 [0,2,0,0,0,0|1,0,0]=3 6042 B12R1.21 CC(Br)CCc1ccc(O)cc1 Amb24532811 [0,2,0,0,0,0|1,0,0]=3 6043 B12R1.21 CC(C)CCc1ccc(N)[n]c1 Amb18199738 [0,2,0,0,0,0|2,0,0]=4 6044 B12R1.21 CC(C)CCc1ccc(N)c[n]1 Amb18828680 [0,2,0,0,0,0|2,0,0]=4 6045 B12R1.21 CC(C)CCc1ccc(S)cc1 Amb19888153 [0,2,0,0,0,0|1,0,0]=3 6046 B12R1.21 CC(C)CNc1ccc(Cl)cc1 Amb20669276 [0,2,0,0,0,0|2,0,0]=4 6047 B12R1.21 CC(C)COc1ccc(Cl)cc1 Amb25667205 [0,2,0,0,0,0|2,0,0]=4 6048 B12R1.21 CC(C)COc1ccc(I)cc1 Amb22266147 [0,2,0,0,0,0|2,0,0]=4 6049 B12R1.21 CC(C)COc1ccc(N)cc1 Amb24273093 [0,2,0,0,0,0|2,0,0]=4 6050 B12R1.21 CC(C)CSc1ccc(Cl)cc1 Amb25133783 [0,2,0,0,0,0|2,0,0]=4 6051 B12R1.21 CC(C)CSc1ccc(F)cc1 Amb24760114 [0,2,0,0,0,0|2,0,0]=4 6052 B12R1.21 CC(C)CSc1ccc(O)cc1 Amb18321683 [0,2,0,0,0,0|2,0,0]=4 6053 B12R1.21 CC(C)CSc1ccc(S)cc1 Amb24709264 [0,2,0,0,0,0|2,0,0]=4 6054 B12R1.21 CC(C)NCc1ccc(I)cc1 Amb25375987 [0,2,0,0,0,0|2,0,0]=4 6055 B12R1.21 CC(C)NCc1ccc(N)cc1 Amb17739716 [0,2,0,0,0,0|2,0,0]=4 6056 B12R1.21 CC(C)NCc1ccc(O)cc1 Amb20673450 [0,2,0,0,0,0|2,0,0]=4 6057 B12R1.21 CC(C)OCc1ccc(Br)cc1 Amb19301962 [0,2,0,0,0,0|2,0,0]=4 6058 B12R1.21 CC(C)OCc1ccc(Cl)cc1 Amb24514322 [0,2,0,0,0,0|2,0,0]=4 6059 B12R1.21 CC(C)OCc1ccc(I)cc1 Amb25695675 [0,2,0,0,0,0|2,0,0]=4 6060 B12R1.21 CC(C)SCc1ccc(Br)cc1 Amb19196493 [0,2,0,0,0,0|2,0,0]=4 6061 B12R1.21 CC(C)SCc1ccc(Cl)cc1 Amb25711799 [0,2,0,0,0,0|2,0,0]=4 6062 B12R1.21 CC(C)SCc1ccc(O)cc1 Amb25036227 [0,2,0,0,0,0|2,0,0]=4 6063 B12R1.21 CC(CCc1ccc(cc1)Br)C Amb2226924 [0,2,0,0,0,0|1,0,0]=3 6064 B12R1.21 CC(CCc1ccc(cc1)Cl)O Amb17507284 [0,2,0,0,0,0|0,0,0]=2 6065 B12R1.21 CC(CCc1ccc(cc1)F)O Amb17507285 [0,2,0,0,0,0|0,0,0]=2 6066 B12R1.21 CC(CCc1ccc(cc1)O)O Amb1110722 [0,2,0,0,0,0|0,0,0]=2 6067 B12R1.21 CC(CNc1ccc(cc1)Br)O Amb17142609 [0,2,0,0,0,0|1,0,0]=3 6068 B12R1.21 CC(CNc1ccc(cc1)C)O Amb17138594 [0,2,0,0,0,0|1,0,0]=3 6069 B12R1.21 CC(CNc1ccc(cc1)Cl)O Amb17139127 [0,2,0,0,0,0|1,0,0]=3 6070 B12R1.21 CC(CNc1ccc(cc1)F)O Amb17138651 [0,2,0,0,0,0|1,0,0]=3 6071 B12R1.21 CC(COc1ccc(cc1)Cl)N Amb17224217 [0,2,0,0,0,0|2,0,0]=4 6072 B12R1.21 CC(COc1ccc(cc1)F)N Amb10609780 [0,2,0,0,0,0|2,0,0]=4 6073 B12R1.21 CC(COc1ccc(cc1)F)N Amb1140862 [0,2,0,0,0,0|2,0,0]=4 6074 B12R1.21 CC(COc1ccc(cc1)N)C Amb1124176 [0,2,0,0,0,0|2,0,0]=4 6075 B12R1.21 CC(Cl)CCc1ccc(Br)cc1 Amb25796648 [0,2,0,0,0,0|1,0,0]=3 6076 B12R1.21 CC(Cl)CCc1ccc(Cl)cc1 Amb24488696 [0,2,0,0,0,0|1,0,0]=3 6077 B12R1.21 CC(Cl)CCc1ccc(F)cc1 Amb19076402 [0,2,0,0,0,0|1,0,0]=3 6078 B12R1.21 CC(Cl)CCc1ccc(O)cc1 Amb25715798 [0,2,0,0,0,0|1,0,0]=3 6079 B12R1.21 CC(Cl)CNc1ccc(Cl)cc1 Amb24497324 [0,2,0,0,0,0|2,0,0]=4 6080 B12R1.21 CC(Cl)COc1ccc(O)cc1 Amb25780632 [0,2,0,0,0,0|2,0,0]=4 6081 B12R1.21 CC(Cl)CSc1ccc(F)cc1 Amb25103667 [0,2,0,0,0,0|2,0,0]=4 6082 B12R1.21 CC(F)CCc1ccc(N)cc1 Amb24511306 [0,2,0,0,0,0|1,0,0]=3 6083 B12R1.21 CC(F)COc1ccc(Br)cc1 Amb24079074 [0,2,0,0,0,0|2,0,0]=4 6084 B12R1.21 CC(F)COc1ccc(N)cc1 Amb25247403 [0,2,0,0,0,0|2,0,0]=4 6085 B12R1.21 CC(F)CSc1ccc(N)cc1 Amb24654129 [0,2,0,0,0,0|2,0,0]=4 6086 B12R1.21 CC(N)CCc1ccc(Br)c[n]1 Amb25204452 [0,2,0,0,0,0|2,0,0]=4 6087 B12R1.21 CC(N)CCc1ccc(Br)cc1 Amb17991263 [0,2,0,0,0,0|1,0,0]=3 6088 B12R1.21 CC(N)CCc1ccc(Cl)cc1 Amb22461482 [0,2,0,0,0,0|1,0,0]=3 6089 B12R1.21 CC(N)CNc1ccc(F)cc1 Amb25237265 [0,2,0,0,0,0|2,0,0]=4 6090 B12R1.21 CC(N)COc1ccc(I)cc1 Amb25249613 [0,2,0,0,0,0|2,0,0]=4 6091 B12R1.21 CC(N)COc1ccc(O)cc1 Amb22446609 [0,2,0,0,0,0|2,0,0]=4 6092 B12R1.21 CC(N)CSc1ccc(Br)cc1 Amb18576934 [0,2,0,0,0,0|2,0,0]=4 6093 B12R1.21 CC(N)CSc1ccc(Cl)cc1 Amb18066330 [0,2,0,0,0,0|2,0,0]=4 6094 B12R1.21 CC(N)CSc1ccc(Cl)cc1 Amb21988434 [0,2,0,0,0,0|2,0,0]=4 6095 B12R1.21 CC(N)CSc1ccc(F)cc1 Amb18564329 [0,2,0,0,0,0|2,0,0]=4 6096 B12R1.21 CC(N)CSc1ccc(O)cc1 Amb25350095 [0,2,0,0,0,0|2,0,0]=4 6097 B12R1.21 CC(NCc1ccc(cc1)Br)C Amb2118441 [0,2,0,0,0,0|2,0,0]=4 6098 B12R1.21 CC(NCc1ccc(cc1)C)C Amb2118437 [0,2,0,0,0,0|2,0,0]=4 6099 B12R1.21 CC(NCc1ccc(cc1)Cl)C Amb2118439 [0,2,0,0,0,0|2,0,0]=4 6100 B12R1.21 CC(NCc1ccc(cc1)F)C Amb2118451 [0,2,0,0,0,0|2,0,0]=4 6101 B12R1.21 CC(O)C#Cc1ccc(O)cc1 Amb24497071 [0,2,0,0,0,0|0,0,2]=4 6102 B12R1.21 CC(O)CCN1C=CC(=O)C=C1 Amb18788585 [0,2,0,0,0,0|1,0,0]=3 6103 B12R1.21 CC(O)CCc1ccc(Br)cc1 Amb24056590 [0,2,0,0,0,0|0,0,0]=2 6104 B12R1.21 CC(O)CNc1ccc(Br)[n]c1 Amb25078767 [0,2,0,0,0,0|2,0,0]=4 6105 B12R1.21 CC(O)CNc1ccc(F)c[n]1 Amb18291208 [0,2,0,0,0,0|2,0,0]=4 6106 B12R1.21 CC(O)COc1ccc(Br)[n]c1 Amb25816228 [0,2,0,0,0,0|2,0,0]=4 6107 B12R1.21 CC(O)COc1ccc(Cl)[n]c1 Amb25292022 [0,2,0,0,0,0|2,0,0]=4 6108 B12R1.21 CC(O)COc1ccc(Cl)cc1 Amb24064341 [0,2,0,0,0,0|1,0,0]=3 6109 B12R1.21 CC(O)COc1ccc(F)[n]c1 Amb25260687 [0,2,0,0,0,0|2,0,0]=4 6110 B12R1.21 CC(O)COc1ccc(F)cc1 Amb18806455 [0,2,0,0,0,0|1,0,0]=3 6111 B12R1.21 CC(O)COc1ccc(I)cc1 Amb25115077 [0,2,0,0,0,0|1,0,0]=3 6112 B12R1.21 CC(O)COc1ccc(N)cc1 Amb18290039 [0,2,0,0,0,0|1,0,0]=3 6113 B12R1.21 CC(O)CSc1ccc(Br)c[n]1 Amb25751413 [0,2,0,0,0,0|2,0,0]=4 6114 B12R1.21 CC(O)CSc1ccc(Cl)c[n]1 Amb25700678 [0,2,0,0,0,0|2,0,0]=4 6115 B12R1.21 CC(O)CSc1ccc(F)cc1 Amb19058402 [0,2,0,0,0,0|1,0,0]=3 6116 B12R1.21 CC(O)CSc1ccc(N)[n]c1 Amb18289455 [0,2,0,0,0,0|2,0,0]=4 6117 B12R1.21 CC(O)CSc1ccc(N)c[n]1 Amb18969624 [0,2,0,0,0,0|2,0,0]=4 6118 B12R1.21 CC(O)CSc1ccc(N)cc1 Amb18969621 [0,2,0,0,0,0|1,0,0]=3 6119 B12R1.21 CC(O)CSc1ccc(O)cc1 Amb19057513 [0,2,0,0,0,0|1,0,0]=3 6120 B12R1.21 CC(O)\C=C\c1ccc(I)cc1 Amb24493262 [0,2,0,0,0,0|0,0,2]=4 6121 B12R1.21 CC(SCc1ccc(cc1)N)C Amb17073954 [0,2,0,0,0,0|2,0,0]=4 6122 B12R1.21 CN(C)CCc1ccc(Br)cc1 Amb21858668 [0,2,0,0,0,0|2,0,0]=4 6123 B12R1.21 CN(C)CCc1ccc(N)cc1 Amb22756010 [0,2,0,0,0,0|2,0,0]=4 6124 B12R1.21 CN(N)CCc1ccc(Br)cc1 Amb18070402 [0,2,0,0,0,0|2,0,0]=4 6125 B12R1.21 CN(N)CCc1ccc(Cl)cc1 Amb18564318 [0,2,0,0,0,0|2,0,0]=4 6126 B12R1.21 CN(N)CCc1ccc(F)cc1 Amb18563851 [0,2,0,0,0,0|2,0,0]=4 6127 B12R1.21 CS(=O)CCc1ccc(N)cc1 Amb18974603 [0,2,0,0,0,0|1,0,1]=4 6128 B12R1.21 CS(=O)CCc1ccc(cc1)C Amb16185126 [0,2,0,0,0,0|1,0,1]=4 6129 B12R1.21 C[C@@H](COc1ccc(cc1)Br)N Amb17248852 [0,2,0,0,0,0|2,0,0]=4 6130 B12R1.21 C[C@@H](COc1ccc(cc1)C)N Amb17232559 [0,2,0,0,0,0|2,0,0]=4 6131 B12R1.21 C[C@@H](COc1ccc(cc1)Cl)N Amb17234272 [0,2,0,0,0,0|2,0,0]=4 6132 B12R1.21 C[C@@H](COc1ccc(cc1)F)N Amb17232708 [0,2,0,0,0,0|2,0,0]=4 6133 B12R1.21 C[C@@H](N)COc1ccc(Br)cc1 Amb18036080 [0,2,0,0,0,0|2,0,0]=4 6134 B12R1.21 C[C@@H](N)COc1ccc(Cl)cc1 Amb18538520 [0,2,0,0,0,0|2,0,0]=4 6135 B12R1.21 C[C@@H](N)CSc1ccc(Cl)cc1 Amb25073658 [0,2,0,0,0,0|2,0,0]=4 6136 B12R1.21 C[C@@H](N)CSc1ccc(F)cc1 Amb25715002 [0,2,0,0,0,0|2,0,0]=4 6137 B12R1.21 C[C@@H](O)CCc1ccc(O)cc1 Amb23604212 [0,2,0,0,0,0|0,0,0]=2 6138 B12R1.21 C[C@@H](O)CNc1ccc(Cl)c[n]1 Amb25742048 [0,2,0,0,0,0|2,0,0]=4 6139 B12R1.21 C[C@@H](O)CNc1ccc(F)c[n]1 Amb25160337 [0,2,0,0,0,0|2,0,0]=4 6140 B12R1.21 C[C@@H](O)CNc1ccc(F)cc1 Amb25719811 [0,2,0,0,0,0|1,0,0]=3 6141 B12R1.21 C[C@@H](O)COc1ccc(F)cc1 Amb22351329 [0,2,0,0,0,0|1,0,0]=3 6142 B12R1.21 C[C@@H](O)COc1ccc(I)cc1 Amb25373827 [0,2,0,0,0,0|1,0,0]=3 6143 B12R1.21 C[C@@H](O)CSc1ccc(Cl)c[n]1 Amb25722457 [0,2,0,0,0,0|2,0,0]=4 6144 B12R1.21 C[C@@H](O)CSc1ccc(Cl)cc1 Amb25179956 [0,2,0,0,0,0|1,0,0]=3 6145 B12R1.21 C[C@@H](O)CSc1ccc(F)cc1 Amb25073680 [0,2,0,0,0,0|1,0,0]=3 6146 B12R1.21 C[C@@H](O)\C=C\c1ccc(Cl)cc1 Amb24497692 [0,2,0,0,0,0|0,0,2]=4 6147 B12R1.21 C[C@H](N)CCc1ccc(Cl)cc1 Amb24702508 [0,2,0,0,0,0|1,0,0]=3 6148 B12R1.21 C[C@H](N)CCc1ccc(F)cc1 Amb24624091 [0,2,0,0,0,0|1,0,0]=3 6149 B12R1.21 C[C@H](O)CNc1ccc(Br)cc1 Amb25719810 [0,2,0,0,0,0|1,0,0]=3 6150 B12R1.21 C[C@H](O)COc1ccc(F)cc1 Amb22351296 [0,2,0,0,0,0|1,0,0]=3 6151 B12R1.21 C[C@H](O)COc1ccc(I)cc1 Amb25724275 [0,2,0,0,0,0|1,0,0]=3 6152 B12R1.21 C[C@H](O)CSc1ccc(Br)cc1 Amb24636648 [0,2,0,0,0,0|1,0,0]=3 6153 B12R1.21 C[C@H](O)CSc1ccc(Cl)c[n]1 Amb25246297 [0,2,0,0,0,0|2,0,0]=4 6154 B12R1.21 C[C@H](O)CSc1ccc(F)cc1 Amb24379354 [0,2,0,0,0,0|1,0,0]=3 6155 B12R1.21 C[C@H](O)\C=C\c1ccc(Cl)cc1 Amb25051261 [0,2,0,0,0,0|0,0,2]=4 6156 B12R1.21 C[C@H](O)\C=C\c1ccc(F)cc1 Amb25052234 [0,2,0,0,0,0|0,0,2]=4 6157 B12R1.21 Cc1ccc(CCC(C)Cl)cc1 Amb19074261 [0,2,0,0,0,0|1,0,0]=3 6158 B12R1.21 Cc1ccc(CCC(C)N)[n]c1 Amb25751617 [0,2,0,0,0,0|2,0,0]=4 6159 B12R1.21 Cc1ccc(CCC(C)O)cc1 Amb18800837 [0,2,0,0,0,0|0,0,0]=2 6160 B12R1.21 Cc1ccc(CCC(N)=N)cc1 Amb18065466 [0,2,0,0,0,0|1,0,1]=4 6161 B12R1.21 Cc1ccc(CCC(O)=O)[n]c1 Amb22886574 [0,2,0,0,0,0|1,0,1]=4 6162 B12R1.21 Cc1ccc(CCC(O)=O)c[n]1 Amb18828437 [0,2,0,0,0,0|1,0,1]=4 6163 B12R1.21 Cc1ccc(CCN(C)N)cc1 Amb18563653 [0,2,0,0,0,0|2,0,0]=4 6164 B12R1.21 Cc1ccc(NC[C@@H](C)O)[n]c1 Amb24408026 [0,2,0,0,0,0|2,0,0]=4 6165 B12R1.21 Cc1ccc(NC[C@H](C)O)[n]c1 Amb25297162 [0,2,0,0,0,0|2,0,0]=4 6166 B12R1.21 Cc1ccc(\C=C\C(C)O)cc1 Amb24707156 [0,2,0,0,0,0|0,0,2]=4 6167 B12R1.21 Cc1ccc(\C=C\[C@@H](C)O)cc1 Amb25119983 [0,2,0,0,0,0|0,0,2]=4 6168 B12R1.21 Cc1ccc(cc1)CC[N+](=O)[O-] Amb17400178 [0,2,0,0,0,0|1,0,1]=4 6169 B12R1.21 Cc1ccc(cc1)NCC(C)N Amb22410806 [0,2,0,0,0,0|2,0,0]=4 6170 B12R1.21 Cc1ccc(cc1)NCC(C)S Amb24365983 [0,2,0,0,0,0|1,1,0]=4 6171 B12R1.21 Cc1ccc(cc1)NC[C@@H](C)O Amb24626471 [0,2,0,0,0,0|1,0,0]=3 6172 B12R1.21 Cc1ccc(cc1)OCC(C)C Amb25118479 [0,2,0,0,0,0|2,0,0]=4 6173 B12R1.21 Cc1ccc(cc1)OCC(C)O Amb18182640 [0,2,0,0,0,0|1,0,0]=3 6174 B12R1.21 Cc1ccc(cc1)OCC(O)O Amb24588428 [0,2,0,0,0,0|1,0,0]=3 6175 B12R1.21 Cc1ccc(cc1)OC[C@@H](C)N Amb18538493 [0,2,0,0,0,0|2,0,0]=4 6176 B12R1.21 Cc1ccc(cc1)SCC(C)N Amb18564186 [0,2,0,0,0,0|2,0,0]=4 6177 B12R1.21 Cc1ccc(cc1)SCC(C)N Amb21988435 [0,2,0,0,0,0|2,0,0]=4 6178 B12R1.21 Cc1ccc(cc1)SCC(C)O Amb19054498 [0,2,0,0,0,0|1,0,0]=3 6179 B12R1.21 Cc1ccc(cc1)SCC(F)F Amb25270900 [0,2,0,0,0,0|2,0,0]=4 6180 B12R1.21 ClC(=O)CCc1ccc(cc1)C Amb17142993 [0,2,0,0,0,0|0,0,2]=4 6181 B12R1.21 ClC(=O)CCc1ccc(cc1)Cl Amb17143273 [0,2,0,0,0,0|0,0,2]=4 6182 B12R1.21 Clc1ccc(cc1)SCC(Cl)Cl Amb24632965 [0,2,0,0,0,0|2,0,0]=4 6183 B12R1.21 FC(CNc1ccc(cc1)C)F Amb16229928 [0,2,0,0,0,0|2,0,0]=4 6184 B12R1.21 FC(F)CNc1ccc(Cl)cc1 Amb18320422 [0,2,0,0,0,0|2,0,0]=4 6185 B12R1.21 FC(F)COc1ccc(Br)cc1 Amb22008305 [0,2,0,0,0,0|2,0,0]=4 6186 B12R1.21 FC(F)COc1ccc(I)cc1 Amb24056924 [0,2,0,0,0,0|2,0,0]=4 6187 B12R1.21 Fc1ccc(cc1)NCC(F)F Amb18795535 [0,2,0,0,0,0|2,0,0]=4 6188 B12R1.21 NC(=N)CCc1ccc(Br)cc1 Amb18571448 [0,2,0,0,0,0|1,0,1]=4 6189 B12R1.21 NC(=N)CCc1ccc(Cl)cc1 Amb18564231 [0,2,0,0,0,0|1,0,1]=4 6190 B12R1.21 NC(=N)CCc1ccc(F)cc1 Amb18563719 [0,2,0,0,0,0|1,0,1]=4 6191 B12R1.21 NC(=N)CCc1ccc(cc1)O Amb13883011 [0,2,0,0,0,0|1,0,1]=4 6192 B12R1.21 NC(=O)CCc1ccc(cc1)Br Amb17407065 [0,2,0,0,0,0|0,0,2]=4 6193 B12R1.21 NC(=O)CCc1ccc(cc1)Cl Amb17142998 [0,2,0,0,0,0|0,0,2]=4 6194 B12R1.21 NC(=S)CCc1ccc(cc1)Cl Amb17237061 [0,2,0,0,0,0|0,1,1]=4 6195 B12R1.21 Nc1ccc(CCC(O)=O)[n]c1 Amb24663664 [0,2,0,0,0,0|1,0,1]=4 6196 B12R1.21 Nc1ccc(CCC(O)=O)c[n]1 Amb19958679 [0,2,0,0,0,0|1,0,1]=4 6197 B12R1.21 Nc1ccc(CCC(O)=O)c[n]1 Amb22546430 [0,2,0,0,0,0|1,0,1]=4 6198 B12R1.21 Nc1ccc(CC[N+]([O-])=O)cc1 Amb24406773 [0,2,0,0,0,0|1,0,1]=4 6199 B12R1.21 Nc1ccc(cc1)NCC(O)=O Amb18296058 [0,2,0,0,0,0|1,0,1]=4 6200 B12R1.21 Nc1ccc(cc1)NCS(O)=O Amb25732370 [0,2,0,0,0,0|2,0,0]=4 6201 B12R1.21 Nc1ccc(cc1)OCC(F)F Amb22280478 [0,2,0,0,0,0|2,0,0]=4 6202 B12R1.21 Nc1ccc(cc1)OCC(O)=O Amb22751390 [0,2,0,0,0,0|1,0,1]=4 6203 B12R1.21 Nc1ccc(cc1)SCC(F)F Amb19060393 [0,2,0,0,0,0|2,0,0]=4 6204 B12R1.21 O=C(Cl)CCc1ccc(F)cc1 Amb23440824 [0,2,0,0,0,0|0,0,2]=4 6205 B12R1.21 OB(O)CCc1ccc(Cl)cc1 Amb25667152 [0,2,0,0,0,0|1,0,0]=3 6206 B12R1.21 OB(O)CCc1ccc(F)cc1 Amb25149900 [0,2,0,0,0,0|1,0,0]=3 6207 B12R1.21 OC(=O)CCN1C=CC(=O)C=C1 Amb18534262 [0,2,0,0,0,0|1,0,1]=4 6208 B12R1.21 OC(=O)CCN1C=CC(=S)C=C1 Amb25751169 [0,2,0,0,0,0|1,0,1]=4 6209 B12R1.21 OC(=O)CC[n+]1ccc(cc1)C Amb17098177 [0,2,0,0,0,0|1,0,1]=4 6210 B12R1.21 OC(=O)CCc1ccc(Br)[n]c1 Amb22292277 [0,2,0,0,0,0|1,0,1]=4 6211 B12R1.21 OC(=O)CCc1ccc(Cl)[n]c1 Amb18649204 [0,2,0,0,0,0|1,0,1]=4 6212 B12R1.21 OC(=O)CCc1ccc(F)[n]c1 Amb22886575 [0,2,0,0,0,0|1,0,1]=4 6213 B12R1.21 OC(=O)CCc1ccc(cc1)Br Amb1220330 [0,2,0,0,0,0|0,0,1]=3 6214 B12R1.21 OC(=O)CCc1ccc(cc1)C Amb1225383 [0,2,0,0,0,0|0,0,1]=3 6215 B12R1.21 OC(=O)CCc1ccc(cc1)Cl Amb1093991 [0,2,0,0,0,0|0,0,1]=3 6216 B12R1.21 OC(=O)CCc1ccc(cc1)F Amb1214879 [0,2,0,0,0,0|0,0,1]=3 6217 B12R1.21 OC(=O)CNc1ccc(cc1)Br Amb1981434 [0,2,0,0,0,0|1,0,1]=4 6218 B12R1.21 OC(=O)CNc1ccc(cc1)C Amb1106469 [0,2,0,0,0,0|1,0,1]=4 6219 B12R1.21 OC(=O)CNc1ccc(cc1)Cl Amb1486152 [0,2,0,0,0,0|1,0,1]=4 6220 B12R1.21 OC(=O)CNc1ccc(cc1)O Amb1950558 [0,2,0,0,0,0|1,0,1]=4 6221 B12R1.21 OC(=O)COc1ccc(cc1)Cl Amb1830178 [0,2,0,0,0,0|1,0,1]=4 6222 B12R1.21 OC(=O)COc1ccc(cc1)F Amb1210357 [0,2,0,0,0,0|1,0,1]=4 6223 B12R1.21 OC(=O)COc1ccc(cc1)I Amb1152251 [0,2,0,0,0,0|1,0,1]=4 6224 B12R1.21 OC(=O)COc1ccc(cc1)N Amb1034889 [0,2,0,0,0,0|1,0,1]=4 6225 B12R1.21 OC(=O)CSc1ccc(S)cc1 Amb24341890 [0,2,0,0,0,0|1,0,1]=4 6226 B12R1.21 OC(=O)CSc1ccc(cc1)Br Amb1208368 [0,2,0,0,0,0|1,0,1]=4 6227 B12R1.21 OC(=O)CSc1ccc(cc1)C Amb1197696 [0,2,0,0,0,0|1,0,1]=4 6228 B12R1.21 OC(=O)CSc1ccc(cc1)F Amb1209262 [0,2,0,0,0,0|1,0,1]=4 6229 B12R1.21 Oc1ccc(CCC(F)F)cc1 Amb25247374 [0,2,0,0,0,0|1,0,0]=3 6230 B12R1.21 Oc1ccc(CCN(F)F)cc1 Amb25674238 [0,2,0,0,0,0|2,0,0]=4 6231 B12R1.21 Oc1ccc(cc1)NCC(F)F Amb22008480 [0,2,0,0,0,0|2,0,0]=4 6232 B12R1.21 Oc1ccc(cc1)OCC(F)F Amb18795190 [0,2,0,0,0,0|2,0,0]=4 6233 B12R1.21 Oc1ccc(cc1)OCC(O)O Amb24466979 [0,2,0,0,0,0|1,0,0]=3 6234 B12R1.21 Oc1ccc(cc1)SCC(F)F Amb18324326 [0,2,0,0,0,0|2,0,0]=4 6235 B12R1.21 Oc1ccc(cc1)SCC(O)=O Amb18291566 [0,2,0,0,0,0|1,0,1]=4 6236 B12R1.21 [O-][N+](=O)CCc1ccc(F)cc1 Amb18542361 [0,2,0,0,0,0|1,0,1]=4 6237 B12R1.49 BrC(Cc1ccc(cc1)Br)C#N Amb17376787 [0,2,0,0,0,0|1,0,1]=4 6238 B12R1.49 BrC(Cc1ccc(cc1)C)C#N Amb1655469 [0,2,0,0,0,0|1,0,1]=4 6239 B12R1.49 BrC(Cc1ccc(cc1)Cl)C#N Amb17349965 [0,2,0,0,0,0|1,0,1]=4 6240 B12R1.49 BrC(Cc1ccc(cc1)F)C#N Amb17344012 [0,2,0,0,0,0|1,0,1]=4 6241 B12R1.49 BrCC(Oc1ccc(cc1)Br)C Amb17291822 [0,2,0,0,0,0|2,0,0]=4 6242 B12R1.49 BrCC(Oc1ccc(cc1)C)C Amb17248433 [0,2,0,0,0,0|2,0,0]=4 6243 B12R1.49 BrCC(Oc1ccc(cc1)Cl)C Amb17261131 [0,2,0,0,0,0|2,0,0]=4 6244 B12R1.49 BrCC(Oc1ccc(cc1)F)C Amb17250551 [0,2,0,0,0,0|2,0,0]=4 6245 B12R1.49 C#CC(N)Cc1ccc(Br)cc1 Amb25141816 [0,2,0,0,0,0|1,0,1]=4 6246 B12R1.49 C#CC(N)Cc1ccc(F)cc1 Amb25715124 [0,2,0,0,0,0|1,0,1]=4 6247 B12R1.49 C#CC(O)Cc1ccc(Br)cc1 Amb25756870 [0,2,0,0,0,0|1,0,1]=4 6248 B12R1.49 C#CC(O)Cc1ccc(Cl)cc1 Amb25756868 [0,2,0,0,0,0|1,0,1]=4 6249 B12R1.49 C=CC(Cl)Cc1ccc(Cl)cc1 Amb25318302 [0,2,0,0,0,0|1,0,1]=4 6250 B12R1.49 C=CC(N)Cc1ccc(Br)cc1 Amb25126467 [0,2,0,0,0,0|1,0,1]=4 6251 B12R1.49 C=CC(N)Cc1ccc(Cl)cc1 Amb25148723 [0,2,0,0,0,0|1,0,1]=4 6252 B12R1.49 C=CC(N)Cc1ccc(F)cc1 Amb24695153 [0,2,0,0,0,0|1,0,1]=4 6253 B12R1.49 C=CC(O)Cc1ccc(Br)cc1 Amb24474552 [0,2,0,0,0,0|1,0,1]=4 6254 B12R1.49 C=CC(O)Cc1ccc(Cl)cc1 Amb25686541 [0,2,0,0,0,0|1,0,1]=4 6255 B12R1.49 C=CC(O)Cc1ccc(F)cc1 Amb25832059 [0,2,0,0,0,0|1,0,1]=4 6256 B12R1.49 C=CC(O)Cc1ccc(O)cc1 Amb25735226 [0,2,0,0,0,0|1,0,1]=4 6257 B12R1.49 CC(CCl)CN1C=CC(=O)C=C1 Amb25719107 [0,2,0,0,0,0|2,0,0]=4 6258 B12R1.49 CC(CN)CN1C=CC(=O)C=C1 Amb18999144 [0,2,0,0,0,0|2,0,0]=4 6259 B12R1.49 CC(CN)Cc1ccc(Br)cc1 Amb18992228 [0,2,0,0,0,0|1,0,0]=3 6260 B12R1.49 CC(CN)Cc1ccc(I)cc1 Amb25054279 [0,2,0,0,0,0|1,0,0]=3 6261 B12R1.49 CC(CN)Cc1ccc(O)cc1 Amb25738797 [0,2,0,0,0,0|1,0,0]=3 6262 B12R1.49 CC(CN)Nc1ccc(Cl)cc1 Amb18909433 [0,2,0,0,0,0|2,0,0]=4 6263 B12R1.49 CC(CN)Nc1ccc(F)cc1 Amb18908738 [0,2,0,0,0,0|2,0,0]=4 6264 B12R1.49 CC(CN)Oc1ccc(I)cc1 Amb25035111 [0,2,0,0,0,0|2,0,0]=4 6265 B12R1.49 CC(CN)Oc1ccc(O)cc1 Amb24664519 [0,2,0,0,0,0|2,0,0]=4 6266 B12R1.49 CC(CN)Sc1ccc(Br)cc1 Amb18992812 [0,2,0,0,0,0|2,0,0]=4 6267 B12R1.49 CC(CN)Sc1ccc(Br)cc1 Amb19350751 [0,2,0,0,0,0|2,0,0]=4 6268 B12R1.49 CC(CN)Sc1ccc(F)cc1 Amb18992823 [0,2,0,0,0,0|2,0,0]=4 6269 B12R1.49 CC(CN)Sc1ccc(N)cc1 Amb18909305 [0,2,0,0,0,0|2,0,0]=4 6270 B12R1.49 CC(CN)Sc1ccc(O)cc1 Amb18909348 [0,2,0,0,0,0|2,0,0]=4 6271 B12R1.49 CC(CO)Cc1ccc(Br)c[n]1 Amb24688461 [0,2,0,0,0,0|1,0,0]=3 6272 B12R1.49 CC(CO)Cc1ccc(Cl)[n]c1 Amb24353075 [0,2,0,0,0,0|1,0,0]=3 6273 B12R1.49 CC(CO)Cc1ccc(I)cc1 Amb25711706 [0,2,0,0,0,0|0,0,0]=2 6274 B12R1.49 CC(CO)Nc1ccc(Br)cc1 Amb18290179 [0,2,0,0,0,0|1,0,0]=3 6275 B12R1.49 CC(CO)Nc1ccc(Cl)cc1 Amb18290161 [0,2,0,0,0,0|1,0,0]=3 6276 B12R1.49 CC(CO)Nc1ccc(F)c[n]1 Amb18291209 [0,2,0,0,0,0|2,0,0]=4 6277 B12R1.49 CC(CO)Nc1ccc(F)cc1 Amb18290165 [0,2,0,0,0,0|1,0,0]=3 6278 B12R1.49 CC(CO)Nc1ccc(I)cc1 Amb24493605 [0,2,0,0,0,0|1,0,0]=3 6279 B12R1.49 CC(CO)Oc1ccc(I)cc1 Amb24379893 [0,2,0,0,0,0|1,0,0]=3 6280 B12R1.49 CC(CO)Sc1ccc(Br)cc1 Amb23449854 [0,2,0,0,0,0|1,0,0]=3 6281 B12R1.49 CC(CO)Sc1ccc(N)[n]c1 Amb25705394 [0,2,0,0,0,0|2,0,0]=4 6282 B12R1.49 CC(Cc1ccc(Br)cc1)C#N Amb24540446 [0,2,0,0,0,0|1,0,1]=4 6283 B12R1.49 CC(Cc1ccc(Br)cc1)C=O Amb25060263 [0,2,0,0,0,0|0,0,2]=4 6284 B12R1.49 CC(Cc1ccc(Br)cc1)CBr Amb25366059 [0,2,0,0,0,0|1,0,0]=3 6285 B12R1.49 CC(Cc1ccc(Cl)cc1)C=O Amb18648716 [0,2,0,0,0,0|0,0,2]=4 6286 B12R1.49 CC(Cc1ccc(Cl)cc1)NN Amb25152282 [0,2,0,0,0,0|2,0,0]=4 6287 B12R1.49 CC(Cc1ccc(F)cc1)C#N Amb25050633 [0,2,0,0,0,0|1,0,1]=4 6288 B12R1.49 CC(Cc1ccc(F)cc1)CBr Amb25115291 [0,2,0,0,0,0|1,0,0]=3 6289 B12R1.49 CC(Cc1ccc(F)cc1)NN Amb25709190 [0,2,0,0,0,0|2,0,0]=4 6290 B12R1.49 CC(Cc1ccc(I)cc1)NN Amb24716530 [0,2,0,0,0,0|2,0,0]=4 6291 B12R1.49 CC(Cc1ccc(O)cc1)C=O Amb18646060 [0,2,0,0,0,0|0,0,2]=4 6292 B12R1.49 CC(Cc1ccc(O)cc1)CO Amb25770294 [0,2,0,0,0,0|0,0,0]=2 6293 B12R1.49 CC(Cc1ccc(O)cc1)NN Amb25189495 [0,2,0,0,0,0|2,0,0]=4 6294 B12R1.49 CCC(=O)Cc1ccc(I)cc1 Amb25229794 [0,2,0,0,0,0|1,0,1]=4 6295 B12R1.49 CCC(=O)Cc1ccc(O)cc1 Amb18646040 [0,2,0,0,0,0|1,0,1]=4 6296 B12R1.49 CCC(=O)Cc1ccc(cc1)Br Amb17477612 [0,2,0,0,0,0|1,0,1]=4 6297 B12R1.49 CCC(=O)Cc1ccc(cc1)C Amb17138536 [0,2,0,0,0,0|1,0,1]=4 6298 B12R1.49 CCC(=O)Cc1ccc(cc1)Cl Amb17139038 [0,2,0,0,0,0|1,0,1]=4 6299 B12R1.49 CCC(=O)Cc1ccc(cc1)F Amb17138600 [0,2,0,0,0,0|1,0,1]=4 6300 B12R1.49 CCC(Br)Cc1ccc(Br)cc1 Amb18049412 [0,2,0,0,0,0|1,0,0]=3 6301 B12R1.49 CCC(C)CN1C=CC(=O)C=C1 Amb25809661 [0,2,0,0,0,0|2,0,0]=4 6302 B12R1.49 CCC(C)Cc1ccc(N)cc1 Amb25798952 [0,2,0,0,0,0|1,0,0]=3 6303 B12R1.49 CCC(C)Oc1ccc(F)cc1 Amb24568831 [0,2,0,0,0,0|2,0,0]=4 6304 B12R1.49 CCC(C)Sc1ccc(Cl)cc1 Amb25284129 [0,2,0,0,0,0|2,0,0]=4 6305 B12R1.49 CCC(C)Sc1ccc(O)cc1 Amb18321724 [0,2,0,0,0,0|2,0,0]=4 6306 B12R1.49 CCC(Cc1ccc(cc1)Br)Cl Amb17477596 [0,2,0,0,0,0|1,0,0]=3 6307 B12R1.49 CCC(Cc1ccc(cc1)Br)O Amb17477579 [0,2,0,0,0,0|1,0,0]=3 6308 B12R1.49 CCC(Cc1ccc(cc1)C)Cl Amb17477426 [0,2,0,0,0,0|1,0,0]=3 6309 B12R1.49 CCC(Cc1ccc(cc1)C)O Amb17138583 [0,2,0,0,0,0|1,0,0]=3 6310 B12R1.49 CCC(Cc1ccc(cc1)Cl)Cl Amb17477604 [0,2,0,0,0,0|1,0,0]=3 6311 B12R1.49 CCC(Cc1ccc(cc1)Cl)O Amb17139103 [0,2,0,0,0,0|1,0,0]=3 6312 B12R1.49 CCC(Cc1ccc(cc1)F)Cl Amb17477606 [0,2,0,0,0,0|1,0,0]=3 6313 B12R1.49 CCC(Cc1ccc(cc1)F)O Amb17138637 [0,2,0,0,0,0|1,0,0]=3 6314 B12R1.49 CCC(Cl)Cc1ccc(Br)c[n]1 Amb24438886 [0,2,0,0,0,0|2,0,0]=4 6315 B12R1.49 CCC(Cl)Cc1ccc(I)cc1 Amb25157799 [0,2,0,0,0,0|1,0,0]=3 6316 B12R1.49 CCC(N)CN1C=CC(=O)C=C1 Amb18542784 [0,2,0,0,0,0|2,0,0]=4 6317 B12R1.49 CCC(N)Cc1cc[n+]([O-])cc1 Amb25200150 [0,2,0,0,0,0|2,0,0]=4 6318 B12R1.49 CCC(N)Cc1ccc(Br)c[n]1 Amb25137019 [0,2,0,0,0,0|2,0,0]=4 6319 B12R1.49 CCC(N)Cc1ccc(Cl)cc1 Amb19374189 [0,2,0,0,0,0|1,0,0]=3 6320 B12R1.49 CCC(N)Cc1ccc(F)[n]c1 Amb24610250 [0,2,0,0,0,0|2,0,0]=4 6321 B12R1.49 CCC(N)Cc1ccc(I)cc1 Amb24711014 [0,2,0,0,0,0|1,0,0]=3 6322 B12R1.49 CCC(N)Cc1ccc(N)cc1 Amb24738382 [0,2,0,0,0,0|1,0,0]=3 6323 B12R1.49 CCC(O)CN1C=CC(=O)C=C1 Amb18788584 [0,2,0,0,0,0|2,0,0]=4 6324 B12R1.49 CCC(O)Nc1ccc(N)cc1 Amb25774074 [0,2,0,0,0,0|2,0,0]=4 6325 B12R1.49 CCC(Oc1ccc(cc1)N)C Amb2189169 [0,2,0,0,0,0|2,0,0]=4 6326 B12R1.49 CCN(C)Cc1ccc(Br)cc1 Amb20784350 [0,2,0,0,0,0|2,0,0]=4 6327 B12R1.49 CCN(C)Cc1ccc(F)cc1 Amb25284151 [0,2,0,0,0,0|2,0,0]=4 6328 B12R1.49 CCN(C)Cc1ccc(F)cc1 Amb25706021 [0,2,0,0,0,0|2,0,0]=4 6329 B12R1.49 CCN(C)Cc1ccc(N)cc1 Amb20622466 [0,2,0,0,0,0|2,0,0]=4 6330 B12R1.49 CCS(=O)Cc1ccc(F)cc1 Amb25160320 [0,2,0,0,0,0|2,0,0]=4 6331 B12R1.49 CCS(=O)Cc1ccc(N)cc1 Amb18974551 [0,2,0,0,0,0|2,0,0]=4 6332 B12R1.49 CC[C@@H](C)Oc1ccc(N)cc1 Amb24103201 [0,2,0,0,0,0|2,0,0]=4 6333 B12R1.49 CC[C@@H](N)Cc1ccc(Cl)cc1 Amb24357569 [0,2,0,0,0,0|1,0,0]=3 6334 B12R1.49 CC[C@H](N)Cc1ccc(Cl)cc1 Amb25313710 [0,2,0,0,0,0|1,0,0]=3 6335 B12R1.49 CNC(C)Cc1ccc(F)cc1 Amb22055302 [0,2,0,0,0,0|2,0,0]=4 6336 B12R1.49 CNC(C)Cc1ccc(N)cc1 Amb18050449 [0,2,0,0,0,0|2,0,0]=4 6337 B12R1.49 CNC(Cc1ccc(cc1)O)C Amb17619384 [0,2,0,0,0,0|2,0,0]=4 6338 B12R1.49 CN[C@@H](C)Cc1ccc(Cl)cc1 Amb25123418 [0,2,0,0,0,0|2,0,0]=4 6339 B12R1.49 CN[C@@H](C)Cc1ccc(N)cc1 Amb24710324 [0,2,0,0,0,0|2,0,0]=4 6340 B12R1.49 CN[C@@H](C)Cc1ccc(O)cc1 Amb24451652 [0,2,0,0,0,0|2,0,0]=4 6341 B12R1.49 C[C@@H](CN)Oc1ccc(Cl)cc1 Amb24701895 [0,2,0,0,0,0|2,0,0]=4 6342 B12R1.49 C[C@@H](CO)Cc1ccc(Cl)cc1 Amb25847856 [0,2,0,0,0,0|0,0,0]=2 6343 B12R1.49 C[C@@H](CO)Nc1ccc(Br)c[n]1 Amb25369644 [0,2,0,0,0,0|2,0,0]=4 6344 B12R1.49 C[C@@H](CO)Nc1ccc(Cl)c[n]1 Amb24723455 [0,2,0,0,0,0|2,0,0]=4 6345 B12R1.49 C[C@@H](CO)Oc1ccc(Cl)cc1 Amb25179930 [0,2,0,0,0,0|1,0,0]=3 6346 B12R1.49 C[C@@H](CO)Oc1ccc(F)cc1 Amb24497746 [0,2,0,0,0,0|1,0,0]=3 6347 B12R1.49 C[C@@H](Cc1ccc(O)cc1)CO Amb24647774 [0,2,0,0,0,0|0,0,0]=2 6348 B12R1.49 C[C@H](CN)Oc1ccc(Cl)cc1 Amb25697013 [0,2,0,0,0,0|2,0,0]=4 6349 B12R1.49 C[C@H](CO)Cc1ccc(F)cc1 Amb24387764 [0,2,0,0,0,0|0,0,0]=2 6350 B12R1.49 C[C@H](CO)Oc1ccc(Cl)cc1 Amb25831906 [0,2,0,0,0,0|1,0,0]=3 6351 B12R1.49 C[C@H](Cc1ccc(O)cc1)CO Amb25371827 [0,2,0,0,0,0|0,0,0]=2 6352 B12R1.49 C\C(\CO)=C\c1ccc(N)cc1 Amb24536329 [0,2,0,0,0,0|0,0,2]=4 6353 B12R1.49 C\C(\Cc1ccc(Cl)cc1)=N\O Amb25159945 [0,2,0,0,0,0|1,0,1]=4 6354 B12R1.49 C\C(\Cc1ccc(F)cc1)=N\O Amb24359271 [0,2,0,0,0,0|1,0,1]=4 6355 B12R1.49 C\C(\Cc1ccc(I)cc1)=N\O Amb25258473 [0,2,0,0,0,0|1,0,1]=4 6356 B12R1.49 C\C(\Cc1ccc(O)cc1)=N\O Amb25371887 [0,2,0,0,0,0|1,0,1]=4 6357 B12R1.49 Cc1cc[n+](CC(O)CCl)cc1 Amb22346542 [0,2,0,0,0,0|2,0,0]=4 6358 B12R1.49 Cc1ccc(CC(=O)CN)cc1 Amb18829243 [0,2,0,0,0,0|1,0,1]=4 6359 B12R1.49 Cc1ccc(CC(=O)CO)cc1 Amb18563613 [0,2,0,0,0,0|0,0,1]=3 6360 B12R1.49 Cc1ccc(CC(Br)CC)cc1 Amb24399086 [0,2,0,0,0,0|1,0,0]=3 6361 B12R1.49 Cc1ccc(CC(C)C=O)cc1 Amb18645702 [0,2,0,0,0,0|0,0,2]=4 6362 B12R1.49 Cc1ccc(CC(C)CBr)c[n]1 Amb25732861 [0,2,0,0,0,0|2,0,0]=4 6363 B12R1.49 Cc1ccc(CC(C)CBr)cc1 Amb25152481 [0,2,0,0,0,0|1,0,0]=3 6364 B12R1.49 Cc1ccc(CC(C)CC)cc1 Amb25241788 [0,2,0,0,0,0|1,0,0]=3 6365 B12R1.49 Cc1ccc(CC(C)CCl)c[n]1 Amb24389452 [0,2,0,0,0,0|2,0,0]=4 6366 B12R1.49 Cc1ccc(CC(C)CCl)cc1 Amb24390124 [0,2,0,0,0,0|1,0,0]=3 6367 B12R1.49 Cc1ccc(CC(C)CO)cc1 Amb24354502 [0,2,0,0,0,0|0,0,0]=2 6368 B12R1.49 Cc1ccc(CC(Cl)CCl)cc1 Amb24459787 [0,2,0,0,0,0|1,0,0]=3 6369 B12R1.49 Cc1ccc(CC(Cl)CN)cc1 Amb24443143 [0,2,0,0,0,0|1,0,0]=3 6370 B12R1.49 Cc1ccc(CC(F)C=O)cc1 Amb24715586 [0,2,0,0,0,0|0,0,2]=4 6371 B12R1.49 Cc1ccc(CC(N)C#C)cc1 Amb25742290 [0,2,0,0,0,0|1,0,1]=4 6372 B12R1.49 Cc1ccc(CC(N)CF)cc1 Amb24564243 [0,2,0,0,0,0|1,0,0]=3 6373 B12R1.49 Cc1ccc(CC(O)C=C)cc1 Amb25845662 [0,2,0,0,0,0|1,0,1]=4 6374 B12R1.49 Cc1ccc(CC(O)C=O)cc1 Amb24466339 [0,2,0,0,0,0|0,0,2]=4 6375 B12R1.49 Cc1ccc(CC(O)CC)[n]c1 Amb24751442 [0,2,0,0,0,0|2,0,0]=4 6376 B12R1.49 Cc1ccc(CN(C)CC)cc1 Amb25115746 [0,2,0,0,0,0|2,0,0]=4 6377 B12R1.49 Cc1ccc(CS(=O)CC)cc1 Amb25160319 [0,2,0,0,0,0|2,0,0]=4 6378 B12R1.49 Cc1ccc(C[C@@H](C)CO)cc1 Amb25687834 [0,2,0,0,0,0|0,0,0]=2 6379 B12R1.49 Cc1ccc(C[C@@H](C)NC)cc1 Amb25233407 [0,2,0,0,0,0|2,0,0]=4 6380 B12R1.49 Cc1ccc(C[C@H](C)CO)cc1 Amb25221031 [0,2,0,0,0,0|0,0,0]=2 6381 B12R1.49 Cc1ccc(C[C@H](N)CO)cc1 Amb25257357 [0,2,0,0,0,0|0,0,0]=2 6382 B12R1.49 Cc1ccc(C\C(\C)=N/O)cc1 Amb24563486 [0,2,0,0,0,0|1,0,1]=4 6383 B12R1.49 Cc1ccc(N[C@@H](C)CO)[n]c1 Amb25821290 [0,2,0,0,0,0|2,0,0]=4 6384 B12R1.49 Cc1ccc(\C=C(\C)/CO)cc1 Amb24649471 [0,2,0,0,0,0|0,0,2]=4 6385 B12R1.49 Cc1ccc(cc1)NC(C)CN Amb18646166 [0,2,0,0,0,0|2,0,0]=4 6386 B12R1.49 Cc1ccc(cc1)NC(C)CO Amb18971798 [0,2,0,0,0,0|1,0,0]=3 6387 B12R1.49 Cc1ccc(cc1)N[C@@H](C)CC Amb24635875 [0,2,0,0,0,0|2,0,0]=4 6388 B12R1.49 Cc1ccc(cc1)OC(=O)CO Amb25829911 [0,2,0,0,0,0|1,0,1]=4 6389 B12R1.49 Cc1ccc(cc1)SC(C)CO Amb24387756 [0,2,0,0,0,0|1,0,0]=3 6390 B12R1.49 Cc1ccc(cc1)SC(O)CC Amb22228345 [0,2,0,0,0,0|2,0,0]=4 6391 B12R1.49 Cc1ccc(cc1)S[C@@H](C)CO Amb24733445 [0,2,0,0,0,0|1,0,0]=3 6392 B12R1.49 Cc1ccc(cc1)S[C@H](C)CO Amb24719675 [0,2,0,0,0,0|1,0,0]=3 6393 B12R1.49 ClC(Cc1ccc(cc1)Br)C#N Amb17204670 [0,2,0,0,0,0|1,0,1]=4 6394 B12R1.49 ClC(Cc1ccc(cc1)C)C#N Amb17204321 [0,2,0,0,0,0|1,0,1]=4 6395 B12R1.49 ClC(Cc1ccc(cc1)Cl)C#N Amb17204383 [0,2,0,0,0,0|1,0,1]=4 6396 B12R1.49 ClC(Cc1ccc(cc1)F)C#N Amb17204331 [0,2,0,0,0,0|1,0,1]=4 6397 B12R1.49 ClCC(Oc1ccc(cc1)Br)C Amb17261134 [0,2,0,0,0,0|2,0,0]=4 6398 B12R1.49 ClCC(Oc1ccc(cc1)C)C Amb17234170 [0,2,0,0,0,0|2,0,0]=4 6399 B12R1.49 ClCC(Oc1ccc(cc1)Cl)C Amb17238291 [0,2,0,0,0,0|2,0,0]=4 6400 B12R1.49 ClCC(Oc1ccc(cc1)F)C Amb17234615 [0,2,0,0,0,0|2,0,0]=4 6401 B12R1.49 N#CC(O)Cc1ccc(Cl)cc1 Amb25817268 [0,2,0,0,0,0|1,0,1]=4 6402 B12R1.49 N=C(Cc1ccc(O)cc1)NO Amb22494626 [0,2,0,0,0,0|1,0,1]=4 6403 B12R1.49 NC(CF)Cc1ccc(Cl)cc1 Amb24080995 [0,2,0,0,0,0|1,0,0]=3 6404 B12R1.49 NC(CO)CC=1C=CC(=O)NC1 Amb24413449 [0,2,0,0,0,0|1,0,0]=3 6405 B12R1.49 NC(CO)Cc1ccc(Br)[n]c1 Amb25200151 [0,2,0,0,0,0|1,0,0]=3 6406 B12R1.49 NC(CO)Cc1ccc(I)cc1 Amb25140389 [0,2,0,0,0,0|0,0,0]=2 6407 B12R1.49 NC(Cc1ccc(Br)cc1)C#N Amb23590819 [0,2,0,0,0,0|1,0,1]=4 6408 B12R1.49 NC(Cc1ccc(Cl)[n]c1)CCl Amb25082717 [0,2,0,0,0,0|2,0,0]=4 6409 B12R1.49 NC(Cc1ccc(Cl)cc1)C#N Amb23557156 [0,2,0,0,0,0|1,0,1]=4 6410 B12R1.49 NC(Cc1ccc(O)cc1)C#N Amb24400599 [0,2,0,0,0,0|1,0,1]=4 6411 B12R1.49 NC(Cc1ccc(O)cc1)CF Amb25276877 [0,2,0,0,0,0|1,0,0]=3 6412 B12R1.49 NCC(=O)Cc1ccc(Br)cc1 Amb18160380 [0,2,0,0,0,0|1,0,1]=4 6413 B12R1.49 NCC(=O)Cc1ccc(Cl)cc1 Amb18823029 [0,2,0,0,0,0|1,0,1]=4 6414 B12R1.49 NCC(=O)Cc1ccc(F)cc1 Amb18827238 [0,2,0,0,0,0|1,0,1]=4 6415 B12R1.49 NCC(=O)Cc1ccc(O)cc1 Amb25369044 [0,2,0,0,0,0|1,0,1]=4 6416 B12R1.49 NCC(Cc1ccc(cc1)Br)O Amb17248849 [0,2,0,0,0,0|1,0,0]=3 6417 B12R1.49 NCC(Cc1ccc(cc1)C)O Amb17232550 [0,2,0,0,0,0|1,0,0]=3 6418 B12R1.49 NCC(Cc1ccc(cc1)Cl)O Amb17234269 [0,2,0,0,0,0|1,0,0]=3 6419 B12R1.49 NCC(Cc1ccc(cc1)F)O Amb17232703 [0,2,0,0,0,0|1,0,0]=3 6420 B12R1.49 NCC(N)Cc1ccc(Br)cc1 Amb25280308 [0,2,0,0,0,0|1,0,0]=3 6421 B12R1.49 NCC(N)Cc1ccc(Cl)cc1 Amb18649050 [0,2,0,0,0,0|1,0,0]=3 6422 B12R1.49 NCC(N)Cc1ccc(F)cc1 Amb25245193 [0,2,0,0,0,0|1,0,0]=3 6423 B12R1.49 NCC(Nc1ccc(cc1)Br)C Amb17226676 [0,2,0,0,0,0|2,0,0]=4 6424 B12R1.49 NCC(O)CN1C=CC(=O)C=C1 Amb18301811 [0,2,0,0,0,0|2,0,0]=4 6425 B12R1.49 NCC(O)Cc1ccc(Br)c[n]1 Amb24353881 [0,2,0,0,0,0|2,0,0]=4 6426 B12R1.49 NCC(Oc1ccc(cc1)F)C Amb2089060 [0,2,0,0,0,0|2,0,0]=4 6427 B12R1.49 NCC(Sc1ccc(cc1)C)C Amb17485974 [0,2,0,0,0,0|2,0,0]=4 6428 B12R1.49 NCC(Sc1ccc(cc1)Cl)C Amb17485977 [0,2,0,0,0,0|2,0,0]=4 6429 B12R1.49 NC[C@H](N)Cc1ccc(F)cc1 Amb25686081 [0,2,0,0,0,0|1,0,0]=3 6430 B12R1.49 N[C@@H](CO)Cc1ccc(Cl)cc1 Amb22225388 [0,2,0,0,0,0|0,0,0]=2 6431 B12R1.49 N[C@@H](CO)Cc1ccc(Cl)cc1 Amb22747948 [0,2,0,0,0,0|0,0,0]=2 6432 B12R1.49 N[C@@H](CO)Cc1ccc(F)cc1 Amb22746377 [0,2,0,0,0,0|0,0,0]=2 6433 B12R1.49 N[C@@H](CO)Cc1ccc(I)cc1 Amb20242327 [0,2,0,0,0,0|0,0,0]=2 6434 B12R1.49 N[C@@H](Cc1ccc(F)cc1)C#N Amb24585720 [0,2,0,0,0,0|1,0,1]=4 6435 B12R1.49 N[C@@H](Cc1ccc(I)cc1)C#N Amb22899093 [0,2,0,0,0,0|1,0,1]=4 6436 B12R1.49 N[C@@H](Cc1ccc(O)cc1)C#N Amb24435350 [0,2,0,0,0,0|1,0,1]=4 6437 B12R1.49 N[C@@H](Cc1ccc(O)cc1)C=O Amb24106989 [0,2,0,0,0,0|0,0,2]=4 6438 B12R1.49 N[C@H](CO)Cc1ccc(Br)cc1 Amb24453435 [0,2,0,0,0,0|0,0,0]=2 6439 B12R1.49 N[C@H](CO)Cc1ccc(Cl)cc1 Amb19943950 [0,2,0,0,0,0|0,0,0]=2 6440 B12R1.49 N[C@H](CO)Cc1ccc(Cl)cc1 Amb22233150 [0,2,0,0,0,0|0,0,0]=2 6441 B12R1.49 N[C@H](CO)Cc1ccc(F)cc1 Amb22233151 [0,2,0,0,0,0|0,0,0]=2 6442 B12R1.49 N[C@H](CO)Cc1ccc(I)cc1 Amb25200273 [0,2,0,0,0,0|0,0,0]=2 6443 B12R1.49 N[C@H](Cc1ccc(O)cc1)C#N Amb24357641 [0,2,0,0,0,0|1,0,1]=4 6444 B12R1.49 N\C(\Cc1ccc(I)cc1)=N\O Amb24454140 [0,2,0,0,0,0|1,0,1]=4 6445 B12R1.49 Nc1ccc(CC(=O)CBr)cc1 Amb25247650 [0,2,0,0,0,0|1,0,1]=4 6446 B12R1.49 Nc1ccc(CC(=O)NO)cc1 Amb25222304 [0,2,0,0,0,0|1,0,1]=4 6447 B12R1.49 Nc1ccc(CC(F)C=O)cc1 Amb25148624 [0,2,0,0,0,0|0,0,2]=4 6448 B12R1.49 Nc1ccc(CC(N)C=O)cc1 Amb24416655 [0,2,0,0,0,0|0,0,2]=4 6449 B12R1.49 Nc1ccc(C[C@H](N)CO)cc1 Amb22233152 [0,2,0,0,0,0|0,0,0]=2 6450 B12R1.49 Nc1ccc(cc1)OC(=O)CO Amb24730945 [0,2,0,0,0,0|1,0,1]=4 6451 B12R1.49 O=C(CF)Cc1ccc(Cl)cc1 Amb23454833 [0,2,0,0,0,0|1,0,1]=4 6452 B12R1.49 O=C(Cc1ccc(Br)cc1)CBr Amb25364120 [0,2,0,0,0,0|1,0,1]=4 6453 B12R1.49 O=C(Cc1ccc(F)cc1)CBr Amb25082934 [0,2,0,0,0,0|1,0,1]=4 6454 B12R1.49 O=CC(Cc1ccc(cc1)Br)Cl Amb17204706 [0,2,0,0,0,0|0,0,2]=4 6455 B12R1.49 O=CC(Cc1ccc(cc1)C)Cl Amb17204328 [0,2,0,0,0,0|0,0,2]=4 6456 B12R1.49 O=CC(Cc1ccc(cc1)Cl)Cl Amb17204403 [0,2,0,0,0,0|0,0,2]=4 6457 B12R1.49 O=CC(Cc1ccc(cc1)F)Cl Amb17204342 [0,2,0,0,0,0|0,0,2]=4 6458 B12R1.49 O=CC(F)Cc1ccc(Cl)cc1 Amb25369013 [0,2,0,0,0,0|0,0,2]=4 6459 B12R1.49 OC(CBr)CN1C=CC(=O)C=C1 Amb24618910 [0,2,0,0,0,0|2,0,0]=4 6460 B12R1.49 OC(CCl)CN1C=CC(=O)C=C1 Amb25780017 [0,2,0,0,0,0|2,0,0]=4 6461 B12R1.49 OC(CF)Sc1ccc(F)cc1 Amb24090066 [0,2,0,0,0,0|2,0,0]=4 6462 B12R1.49 OC(Cc1ccc(Br)cc1)C=O Amb25856500 [0,2,0,0,0,0|0,0,2]=4 6463 B12R1.49 OC(Cc1ccc(Cl)cc1)C=O Amb25205198 [0,2,0,0,0,0|0,0,2]=4 6464 B12R1.49 OC(Cc1ccc(F)cc1)C=O Amb25731164 [0,2,0,0,0,0|0,0,2]=4 6465 B12R1.49 OC(Cc1ccc(F)cc1)CCl Amb24410753 [0,2,0,0,0,0|1,0,0]=3 6466 B12R1.49 OCC(=O)Cc1ccc(Br)cc1 Amb18069830 [0,2,0,0,0,0|0,0,1]=3 6467 B12R1.49 OCC(=O)Cc1ccc(Cl)cc1 Amb18564300 [0,2,0,0,0,0|0,0,1]=3 6468 B12R1.49 OCC(=O)Cc1ccc(F)cc1 Amb18805789 [0,2,0,0,0,0|0,0,1]=3 6469 B12R1.49 OCC(=O)Nc1ccc(cc1)Br Amb1111396 [0,2,0,0,0,0|1,0,1]=4 6470 B12R1.49 OCC(=O)Nc1ccc(cc1)C Amb1109727 [0,2,0,0,0,0|1,0,1]=4 6471 B12R1.49 OCC(=O)Nc1ccc(cc1)Cl Amb1111272 [0,2,0,0,0,0|1,0,1]=4 6472 B12R1.49 OCC(=O)Nc1ccc(cc1)F Amb1110979 [0,2,0,0,0,0|1,0,1]=4 6473 B12R1.49 OCC(=O)Nc1ccc(cc1)I Amb1110138 [0,2,0,0,0,0|1,0,1]=4 6474 B12R1.49 OCC(Cc1ccc(cc1)Br)N Amb17062713 [0,2,0,0,0,0|0,0,0]=2 6475 B12R1.49 OCC(Cc1ccc(cc1)C)N Amb17062687 [0,2,0,0,0,0|0,0,0]=2 6476 B12R1.49 OCC(Cc1ccc(cc1)F)N Amb17062689 [0,2,0,0,0,0|0,0,0]=2 6477 B12R1.49 OCC(Cc1ccc(cc1)O)N Amb17062710 [0,2,0,0,0,0|0,0,0]=2 6478 B12R1.49 OCC(F)Cc1ccc(Cl)cc1 Amb25741479 [0,2,0,0,0,0|0,0,0]=2 6479 B12R1.49 OCC(O)Cc1ccc(Cl)c[n]1 Amb24475111 [0,2,0,0,0,0|1,0,0]=3 6480 B12R1.49 OCC(Oc1ccc(cc1)Br)C Amb17249278 [0,2,0,0,0,0|1,0,0]=3 6481 B12R1.49 OCC(Oc1ccc(cc1)C)C Amb17232602 [0,2,0,0,0,0|1,0,0]=3 6482 B12R1.49 OCC(Oc1ccc(cc1)Cl)C Amb17234358 [0,2,0,0,0,0|1,0,0]=3 6483 B12R1.49 OCC(Oc1ccc(cc1)F)C Amb17232741 [0,2,0,0,0,0|1,0,0]=3 6484 B12R1.49 OC[C@H](Cc1ccc(cc1)O)N Amb1157858 [0,2,0,0,0,0|0,0,0]=2 6485 B12R1.49 OC[C@H](F)Cc1ccc(F)cc1 Amb24749775 [0,2,0,0,0,0|0,0,0]=2 6486 B12R1.49 ONC(=O)Cc1ccc(I)cc1 Amb25119664 [0,2,0,0,0,0|1,0,1]=4 6487 B12R1.49 O\N=C(/Cc1ccc(cc1)O)\N Amb2224478 [0,2,0,0,0,0|1,0,1]=4 6488 B12R1.49 O\N=C(\Cc1ccc(cc1)Cl)/N Amb1114808 [0,2,0,0,0,0|1,0,1]=4 6489 B12R1.49 O\N=C(\Cc1ccc(cc1)N)/N Amb1114107 [0,2,0,0,0,0|1,0,1]=4 6490 B12R1.49 O\N=C(\Cc1ccc(cc1)O)/N Amb1113789 [0,2,0,0,0,0|1,0,1]=4 6491 B12R1.49 Oc1ccc(CC(=O)NO)cc1 Amb24686463 [0,2,0,0,0,0|1,0,1]=4 6492 B12R1.49 Oc1ccc(CC(F)C=O)cc1 Amb24341525 [0,2,0,0,0,0|0,0,2]=4 6493 B12R1.49 Oc1ccc(CC(O)CO)cc1 Amb25092907 [0,2,0,0,0,0|0,0,0]=2 6494 B12R1.49 Oc1ccc(C[C@H](O)CO)cc1 Amb24497177 [0,2,0,0,0,0|0,0,0]=2 6495 B12R1.69 BrCCOc1ccc(Br)cc1Br Amb22728681 [0,2,0,0,0,0|2,0,0]=4 6496 B12R1.69 BrCCOc1ccc(cc1Br)Cl Amb1154146 [0,2,0,0,0,0|2,0,0]=4 6497 B12R1.69 BrCCOc1ccc(cc1Cl)C Amb10608618 [0,2,0,0,0,0|2,0,0]=4 6498 B12R1.69 BrCCOc1ccc(cc1Cl)Cl Amb1152303 [0,2,0,0,0,0|2,0,0]=4 6499 B12R1.69 BrCCOc1ccc(cc1Cl)F Amb17263583 [0,2,0,0,0,0|2,0,0]=4 6500 B12R1.69 Brc1ccc(CCCBr)c(I)c1 Amb25248923 [0,2,0,0,0,0|1,0,0]=3 6501 B12R1.69 C#CCCc1ccc(Cl)cc1Cl Amb18634789 [0,2,0,0,0,0|1,0,1]=4 6502 B12R1.69 C=CCCc1ccc(Br)cc1Cl Amb24692580 [0,2,0,0,0,0|1,0,1]=4 6503 B12R1.69 C=CCCc1ccc(F)cc1Br Amb25766317 [0,2,0,0,0,0|1,0,1]=4 6504 B12R1.69 CC1=CC(=O)C(=CO1)OCCO Amb24408111 [0,2,0,0,0,0|2,0,0]=4 6505 B12R1.69 CC1=CC(=O)C(CCCO)=CO1 Amb25347586 [0,2,0,0,0,0|1,0,0]=3 6506 B12R1.69 CC1=CC(=O)N(CCCBr)C=C1 Amb24552782 [0,2,0,0,0,0|2,0,0]=4 6507 B12R1.69 CC1=CC(=O)N(CCCCl)C=C1 Amb19045938 [0,2,0,0,0,0|2,0,0]=4 6508 B12R1.69 CC1=CC(=O)N(CCCF)C=C1 Amb25680231 [0,2,0,0,0,0|2,0,0]=4 6509 B12R1.69 CC1=CC(=O)N(CCCN)C=C1 Amb18010722 [0,2,0,0,0,0|2,0,0]=4 6510 B12R1.69 CC1=CC(=O)N(CCCO)C=C1 Amb18041291 [0,2,0,0,0,0|1,0,0]=3 6511 B12R1.69 CC1=CC(=O)N(CCCO)C=N1 Amb18788758 [0,2,0,0,0,0|2,0,0]=4 6512 B12R1.69 CC=1C=CN(CCCC)C(=O)C1 Amb18403659 [0,2,0,0,0,0|2,0,0]=4 6513 B12R1.69 CC=1C=CN(CCCO)C(=O)N1 Amb24737022 [0,2,0,0,0,0|2,0,0]=4 6514 B12R1.69 CCCCN1C=CC(Br)=CC1=O Amb24645127 [0,2,0,0,0,0|2,0,0]=4 6515 B12R1.69 CCCCN1C=CC(I)=CC1=O Amb25353617 [0,2,0,0,0,0|2,0,0]=4 6516 B12R1.69 CCCCN1C=CC(O)=CC1=O Amb24405789 [0,2,0,0,0,0|2,0,0]=4 6517 B12R1.69 CCCCc1[n]cc(Br)cc1N Amb24361500 [0,2,0,0,0,0|2,0,0]=4 6518 B12R1.69 CCCCc1[n]cc(Cl)cc1N Amb24657067 [0,2,0,0,0,0|2,0,0]=4 6519 B12R1.69 CCCCc1[n]cc(F)cc1N Amb24563181 [0,2,0,0,0,0|2,0,0]=4 6520 B12R1.69 CCCCc1c[n]c(O)cc1O Amb23570643 [0,2,0,0,0,0|2,0,0]=4 6521 B12R1.69 CCCCc1ccc(Br)cc1N Amb25688839 [0,2,0,0,0,0|1,0,0]=3 6522 B12R1.69 CCCCc1ccc(Cl)cc1N Amb25212906 [0,2,0,0,0,0|1,0,0]=3 6523 B12R1.69 CCCCc1ccc(F)cc1N Amb25697644 [0,2,0,0,0,0|1,0,0]=3 6524 B12R1.69 CCCCc1ccc(N)cc1Br Amb25766211 [0,2,0,0,0,0|1,0,0]=3 6525 B12R1.69 CCCCc1ccc(N)cc1Cl Amb25858096 [0,2,0,0,0,0|1,0,0]=3 6526 B12R1.69 CCCCc1ccc(N)cc1I Amb25265964 [0,2,0,0,0,0|1,0,0]=3 6527 B12R1.69 CCCNc1ccc(N)cc1Br Amb18293593 [0,2,0,0,0,0|2,0,0]=4 6528 B12R1.69 CCCNc1ccc(N)cc1N Amb19962414 [0,2,0,0,0,0|2,0,0]=4 6529 B12R1.69 CCCOc1ccc(Br)cc1S Amb25342159 [0,2,0,0,0,0|2,0,0]=4 6530 B12R1.69 CCCOc1ccc(C)cc1C Amb24484228 [0,2,0,0,0,0|2,0,0]=4 6531 B12R1.69 CCCOc1ccc(F)cc1Cl Amb25822065 [0,2,0,0,0,0|2,0,0]=4 6532 B12R1.69 CCCOc1ccc(F)cc1S Amb24640815 [0,2,0,0,0,0|2,0,0]=4 6533 B12R1.69 CCCOc1ccc(I)cc1Br Amb25847171 [0,2,0,0,0,0|2,0,0]=4 6534 B12R1.69 CCCOc1ccc(I)cc1N Amb18057209 [0,2,0,0,0,0|2,0,0]=4 6535 B12R1.69 CCCOc1ccc(N)cc1Br Amb18293616 [0,2,0,0,0,0|2,0,0]=4 6536 B12R1.69 CCCOc1ccc(N)cc1O Amb24373151 [0,2,0,0,0,0|2,0,0]=4 6537 B12R1.69 CCCOc1ccc(N)cc1S Amb25324650 [0,2,0,0,0,0|2,0,0]=4 6538 B12R1.69 CCCOc1ccc(S)cc1Cl Amb25669642 [0,2,0,0,0,0|2,0,0]=4 6539 B12R1.69 CCCOc1ccc(S)cc1F Amb25359884 [0,2,0,0,0,0|2,0,0]=4 6540 B12R1.69 CCCOc1ccc(cc1Br)Cl Amb17261136 [0,2,0,0,0,0|2,0,0]=4 6541 B12R1.69 CCCOc1ccc(cc1Cl)N Amb1141135 [0,2,0,0,0,0|2,0,0]=4 6542 B12R1.69 CCCOc1ccc(cc1Cl)O Amb17202481 [0,2,0,0,0,0|2,0,0]=4 6543 B12R1.69 CCCOc1ccc(cc1F)Br Amb10607074 [0,2,0,0,0,0|2,0,0]=4 6544 B12R1.69 CCCSc1ccc(C)cc1C Amb25072296 [0,2,0,0,0,0|2,0,0]=4 6545 B12R1.69 CCCSc1ccc(Cl)cc1O Amb18054146 [0,2,0,0,0,0|2,0,0]=4 6546 B12R1.69 CCCSc1ccc(I)cc1N Amb25150127 [0,2,0,0,0,0|2,0,0]=4 6547 B12R1.69 CCCSc1ccc(N)cc1Br Amb24488693 [0,2,0,0,0,0|2,0,0]=4 6548 B12R1.69 CCNCc1ccc(Br)cc1Br Amb25100267 [0,2,0,0,0,0|2,0,0]=4 6549 B12R1.69 CCNCc1ccc(F)cc1I Amb25337979 [0,2,0,0,0,0|2,0,0]=4 6550 B12R1.69 CCNCc1ccc(I)cc1Cl Amb25078881 [0,2,0,0,0,0|2,0,0]=4 6551 B12R1.69 CCNCc1ccc(N)cc1O Amb24565948 [0,2,0,0,0,0|2,0,0]=4 6552 B12R1.69 CCNCc1ccc(O)cc1Cl Amb25806203 [0,2,0,0,0,0|2,0,0]=4 6553 B12R1.69 CCNCc1ccc(O)cc1F Amb25044843 [0,2,0,0,0,0|2,0,0]=4 6554 B12R1.69 CCOCc1ccc(Br)cc1F Amb22900163 [0,2,0,0,0,0|2,0,0]=4 6555 B12R1.69 CCOCc1ccc(Cl)cc1N Amb18986285 [0,2,0,0,0,0|2,0,0]=4 6556 B12R1.69 CCOCc1ccc(F)cc1Br Amb22900189 [0,2,0,0,0,0|2,0,0]=4 6557 B12R1.69 CCOCc1ccc(N)cc1Br Amb18288993 [0,2,0,0,0,0|2,0,0]=4 6558 B12R1.69 CCOCc1ccc(N)cc1Cl Amb18294632 [0,2,0,0,0,0|2,0,0]=4 6559 B12R1.69 CCOCc1ccc(N)cc1F Amb25348133 [0,2,0,0,0,0|2,0,0]=4 6560 B12R1.69 CCSCc1ccc(Br)cc1Cl Amb24650714 [0,2,0,0,0,0|2,0,0]=4 6561 B12R1.69 CCSCc1ccc(Br)cc1N Amb25847826 [0,2,0,0,0,0|2,0,0]=4 6562 B12R1.69 CCSCc1ccc(Cl)cc1Cl Amb25334440 [0,2,0,0,0,0|2,0,0]=4 6563 B12R1.69 CCSCc1ccc(Cl)cc1N Amb18295564 [0,2,0,0,0,0|2,0,0]=4 6564 B12R1.69 CCSCc1ccc(F)cc1Br Amb25128462 [0,2,0,0,0,0|2,0,0]=4 6565 B12R1.69 CCSCc1ccc(F)cc1N Amb25075891 [0,2,0,0,0,0|2,0,0]=4 6566 B12R1.69 CCSCc1ccc(N)cc1Br Amb18288995 [0,2,0,0,0,0|2,0,0]=4 6567 B12R1.69 CCSCc1ccc(N)cc1Cl Amb18984605 [0,2,0,0,0,0|2,0,0]=4 6568 B12R1.69 CNCCc1ccc(Br)cc1Cl Amb24415809 [0,2,0,0,0,0|2,0,0]=4 6569 B12R1.69 CNCCc1ccc(Cl)cc1Br Amb24364955 [0,2,0,0,0,0|2,0,0]=4 6570 B12R1.69 CNCCc1ccc(F)cc1Br Amb18299496 [0,2,0,0,0,0|2,0,0]=4 6571 B12R1.69 CNCCc1ccc(F)cc1Cl Amb18993044 [0,2,0,0,0,0|2,0,0]=4 6572 B12R1.69 CNCCc1ccc(F)cc1F Amb18299524 [0,2,0,0,0,0|2,0,0]=4 6573 B12R1.69 CNCCc1ccc(F)cc1O Amb24554759 [0,2,0,0,0,0|2,0,0]=4 6574 B12R1.69 CNCCc1ccc(O)cc1F Amb24376021 [0,2,0,0,0,0|2,0,0]=4 6575 B12R1.69 CNCCc1ccc(O)cc1O Amb18273699 [0,2,0,0,0,0|2,0,0]=4 6576 B12R1.69 CNCCc1ccc(cc1C)C Amb17400139 [0,2,0,0,0,0|2,0,0]=4 6577 B12R1.69 CNCCc1ccc(cc1F)Br Amb16230489 [0,2,0,0,0,0|2,0,0]=4 6578 B12R1.69 Cc1c[n]c(CCCC)c(N)c1 Amb24673024 [0,2,0,0,0,0|2,0,0]=4 6579 B12R1.69 Cc1c[n]c(CCCN)c(Cl)c1 Amb24402264 [0,2,0,0,0,0|2,0,0]=4 6580 B12R1.69 Cc1c[n]c(CCCN)c(F)c1 Amb24360515 [0,2,0,0,0,0|2,0,0]=4 6581 B12R1.69 Cc1c[n]c(OCCO)c(N)c1 Amb24668278 [0,2,0,0,0,0|2,0,0]=4 6582 B12R1.69 Cc1c[n]c(SCCO)c(C)c1 Amb24590353 [0,2,0,0,0,0|2,0,0]=4 6583 B12R1.69 Cc1cc(Br)c(cc1)NCCF Amb25710867 [0,2,0,0,0,0|2,0,0]=4 6584 B12R1.69 Cc1cc(Br)c(cc1)OCCS Amb25344721 [0,2,0,0,0,0|1,1,0]=4 6585 B12R1.69 Cc1cc(Br)c[n]c1NCCO Amb21958721 [0,2,0,0,0,0|2,0,0]=4 6586 B12R1.69 Cc1cc(Br)ccc1C#CCO Amb22228979 [0,2,0,0,0,0|0,0,2]=4 6587 B12R1.69 Cc1cc(Br)ccc1CCC=O Amb18070232 [0,2,0,0,0,0|0,0,2]=4 6588 B12R1.69 Cc1cc(Br)ccc1CCCC Amb24341759 [0,2,0,0,0,0|1,0,0]=3 6589 B12R1.69 Cc1cc(Br)ccc1CCCO Amb23537809 [0,2,0,0,0,0|0,0,0]=2 6590 B12R1.69 Cc1cc(Br)ccc1CCNC Amb25135302 [0,2,0,0,0,0|2,0,0]=4 6591 B12R1.69 Cc1cc(Br)ccc1OCCC Amb25323749 [0,2,0,0,0,0|2,0,0]=4 6592 B12R1.69 Cc1cc(Br)ccc1OCCCl Amb24483456 [0,2,0,0,0,0|2,0,0]=4 6593 B12R1.69 Cc1cc(Br)ccc1OCCF Amb24487619 [0,2,0,0,0,0|2,0,0]=4 6594 B12R1.69 Cc1cc(Br)ccc1OCCO Amb24483359 [0,2,0,0,0,0|1,0,0]=3 6595 B12R1.69 Cc1cc(Br)ccc1OCCS Amb24487553 [0,2,0,0,0,0|1,1,0]=4 6596 B12R1.69 Cc1cc(Br)ccc1\C=C\CO Amb25160043 [0,2,0,0,0,0|0,0,2]=4 6597 B12R1.69 Cc1cc(C)c(CCC=O)cc1 Amb18563553 [0,2,0,0,0,0|0,0,2]=4 6598 B12R1.69 Cc1cc(C)c(CCCS)cc1 Amb24497542 [0,2,0,0,0,0|0,1,0]=3 6599 B12R1.69 Cc1cc(C)c(cc1)SCCS Amb25730666 [0,2,0,0,0,0|1,1,0]=4 6600 B12R1.69 Cc1cc(Cl)c(cc1)NCCF Amb24425918 [0,2,0,0,0,0|2,0,0]=4 6601 B12R1.69 Cc1cc(Cl)c(cc1)NCCN Amb18909434 [0,2,0,0,0,0|2,0,0]=4 6602 B12R1.69 Cc1cc(Cl)c(cc1)OCCN Amb18994687 [0,2,0,0,0,0|2,0,0]=4 6603 B12R1.69 Cc1cc(Cl)c(cc1)OCCO Amb19070653 [0,2,0,0,0,0|1,0,0]=3 6604 B12R1.69 Cc1cc(Cl)c(cc1)OCCS Amb24354256 [0,2,0,0,0,0|1,1,0]=4 6605 B12R1.69 Cc1cc(Cl)c[n]c1CCCN Amb25849993 [0,2,0,0,0,0|2,0,0]=4 6606 B12R1.69 Cc1cc(Cl)ccc1C#CCO Amb25267599 [0,2,0,0,0,0|0,0,2]=4 6607 B12R1.69 Cc1cc(Cl)ccc1CCC=O Amb18564228 [0,2,0,0,0,0|0,0,2]=4 6608 B12R1.69 Cc1cc(Cl)ccc1CCNC Amb25722327 [0,2,0,0,0,0|2,0,0]=4 6609 B12R1.69 Cc1cc(Cl)ccc1NCCF Amb25210402 [0,2,0,0,0,0|2,0,0]=4 6610 B12R1.69 Cc1cc(Cl)ccc1OCCC Amb24706356 [0,2,0,0,0,0|2,0,0]=4 6611 B12R1.69 Cc1cc(Cl)ccc1OCCF Amb25219644 [0,2,0,0,0,0|2,0,0]=4 6612 B12R1.69 Cc1cc(Cl)ccc1\C=C\CO Amb25324808 [0,2,0,0,0,0|0,0,2]=4 6613 B12R1.69 Cc1cc(F)c(cc1)NCCF Amb25337401 [0,2,0,0,0,0|2,0,0]=4 6614 B12R1.69 Cc1cc(F)c(cc1)NCCN Amb18908740 [0,2,0,0,0,0|2,0,0]=4 6615 B12R1.69 Cc1cc(F)ccc1C#CCO Amb18792546 [0,2,0,0,0,0|0,0,2]=4 6616 B12R1.69 Cc1cc(F)ccc1CCC=O Amb25691957 [0,2,0,0,0,0|0,0,2]=4 6617 B12R1.69 Cc1cc(F)ccc1CCCCl Amb25840107 [0,2,0,0,0,0|1,0,0]=3 6618 B12R1.69 Cc1cc(F)ccc1CCCN Amb18295693 [0,2,0,0,0,0|1,0,0]=3 6619 B12R1.69 Cc1cc(F)ccc1CCCO Amb25148633 [0,2,0,0,0,0|0,0,0]=2 6620 B12R1.69 Cc1cc(F)ccc1CCNC Amb18301295 [0,2,0,0,0,0|2,0,0]=4 6621 B12R1.69 Cc1cc(F)ccc1CNCC Amb18295698 [0,2,0,0,0,0|2,0,0]=4 6622 B12R1.69 Cc1cc(F)ccc1NCCF Amb25685410 [0,2,0,0,0,0|2,0,0]=4 6623 B12R1.69 Cc1cc(F)ccc1NCCN Amb18992220 [0,2,0,0,0,0|2,0,0]=4 6624 B12R1.69 Cc1cc(F)ccc1OCCBr Amb25346591 [0,2,0,0,0,0|2,0,0]=4 6625 B12R1.69 Cc1cc(F)ccc1OCCC Amb25332766 [0,2,0,0,0,0|2,0,0]=4 6626 B12R1.69 Cc1cc(F)ccc1OCCCl Amb25051615 [0,2,0,0,0,0|2,0,0]=4 6627 B12R1.69 Cc1cc(F)ccc1OCCO Amb24581854 [0,2,0,0,0,0|1,0,0]=3 6628 B12R1.69 Cc1cc(F)ccc1\C=C\CO Amb23442796 [0,2,0,0,0,0|0,0,2]=4 6629 B12R1.69 Cc1cc(I)c(cc1)OCCF Amb25160462 [0,2,0,0,0,0|2,0,0]=4 6630 B12R1.69 Cc1cc(I)c(cc1)OCCO Amb25358459 [0,2,0,0,0,0|1,0,0]=3 6631 B12R1.69 Cc1cc(I)ccc1CCC#N Amb25238008 [0,2,0,0,0,0|1,0,1]=4 6632 B12R1.69 Cc1cc(I)ccc1CCC=O Amb24696627 [0,2,0,0,0,0|0,0,2]=4 6633 B12R1.69 Cc1cc(I)ccc1NCCN Amb25820325 [0,2,0,0,0,0|2,0,0]=4 6634 B12R1.69 Cc1cc(I)ccc1NCCO Amb25160361 [0,2,0,0,0,0|1,0,0]=3 6635 B12R1.69 Cc1cc(I)ccc1OCCCl Amb24559327 [0,2,0,0,0,0|2,0,0]=4 6636 B12R1.69 Cc1cc(N)c(cc1)NCCN Amb18298682 [0,2,0,0,0,0|2,0,0]=4 6637 B12R1.69 Cc1cc(N)c(cc1)SCCN Amb18291316 [0,2,0,0,0,0|2,0,0]=4 6638 B12R1.69 Cc1cc(N)c[n]c1OCCO Amb18298667 [0,2,0,0,0,0|2,0,0]=4 6639 B12R1.69 Cc1cc(N)c[n]c1SCCO Amb18298672 [0,2,0,0,0,0|2,0,0]=4 6640 B12R1.69 Cc1cc(N)ccc1CCCCl Amb24695776 [0,2,0,0,0,0|1,0,0]=3 6641 B12R1.69 Cc1cc(N)ccc1NCCN Amb18991506 [0,2,0,0,0,0|2,0,0]=4 6642 B12R1.69 Cc1cc(N)ccc1OCCC Amb21954722 [0,2,0,0,0,0|2,0,0]=4 6643 B12R1.69 Cc1cc(N)ccc1OCCF Amb25678791 [0,2,0,0,0,0|2,0,0]=4 6644 B12R1.69 Cc1cc(N)ccc1SCCN Amb18975710 [0,2,0,0,0,0|2,0,0]=4 6645 B12R1.69 Cc1cc(O)c(COCO)cc1 Amb24065149 [0,2,0,0,0,0|1,0,0]=3 6646 B12R1.69 Cc1cc(O)c(\C=C/CO)cc1 Amb25373419 [0,2,0,0,0,0|0,0,2]=4 6647 B12R1.69 Cc1cc(O)c(cc1)SCCO Amb24497015 [0,2,0,0,0,0|1,0,0]=3 6648 B12R1.69 Cc1cc(O)ccc1CCC#N Amb24708081 [0,2,0,0,0,0|1,0,1]=4 6649 B12R1.69 Cc1cc(O)ccc1CCCBr Amb24559420 [0,2,0,0,0,0|1,0,0]=3 6650 B12R1.69 Cc1cc(O)ccc1CCCC Amb24722982 [0,2,0,0,0,0|1,0,0]=3 6651 B12R1.69 Cc1cc(O)ccc1CCCN Amb18554106 [0,2,0,0,0,0|1,0,0]=3 6652 B12R1.69 Cc1cc(O)ccc1CCNC Amb24497392 [0,2,0,0,0,0|2,0,0]=4 6653 B12R1.69 Cc1cc(S)ccc1CCCCl Amb24541029 [0,2,0,0,0,0|1,0,0]=3 6654 B12R1.69 Cc1ccc(C#CCO)c(C)c1 Amb18792230 [0,2,0,0,0,0|0,0,2]=4 6655 B12R1.69 Cc1ccc(CCC=O)c(Br)c1 Amb18070227 [0,2,0,0,0,0|0,0,2]=4 6656 B12R1.69 Cc1ccc(CCC=O)c(Cl)c1 Amb24484219 [0,2,0,0,0,0|0,0,2]=4 6657 B12R1.69 Cc1ccc(CCC=O)c(F)c1 Amb25773961 [0,2,0,0,0,0|0,0,2]=4 6658 B12R1.69 Cc1ccc(CCC=O)c(I)c1 Amb24594357 [0,2,0,0,0,0|0,0,2]=4 6659 B12R1.69 Cc1ccc(CCC=O)c(N)c1 Amb25376377 [0,2,0,0,0,0|0,0,2]=4 6660 B12R1.69 Cc1ccc(CCC=O)c(O)c1 Amb25253209 [0,2,0,0,0,0|0,0,2]=4 6661 B12R1.69 Cc1ccc(CCCBr)c(Cl)c1 Amb25798590 [0,2,0,0,0,0|1,0,0]=3 6662 B12R1.69 Cc1ccc(CCCBr)c(N)c1 Amb24743622 [0,2,0,0,0,0|1,0,0]=3 6663 B12R1.69 Cc1ccc(CCCBr)c(O)c1 Amb25194824 [0,2,0,0,0,0|1,0,0]=3 6664 B12R1.69 Cc1ccc(CCCC)c(N)c1 Amb24524870 [0,2,0,0,0,0|1,0,0]=3 6665 B12R1.69 Cc1ccc(CCCC)c(O)c1 Amb24557617 [0,2,0,0,0,0|1,0,0]=3 6666 B12R1.69 Cc1ccc(CCCCl)c(N)c1 Amb24638069 [0,2,0,0,0,0|1,0,0]=3 6667 B12R1.69 Cc1ccc(CCCN)c(Cl)c1 Amb25159902 [0,2,0,0,0,0|1,0,0]=3 6668 B12R1.69 Cc1ccc(CCCN)c(F)c1 Amb25677595 [0,2,0,0,0,0|1,0,0]=3 6669 B12R1.69 Cc1ccc(CCCN)c(O)c1 Amb25776876 [0,2,0,0,0,0|1,0,0]=3 6670 B12R1.69 Cc1ccc(CCCO)c(Br)c1 Amb23537990 [0,2,0,0,0,0|0,0,0]=2 6671 B12R1.69 Cc1ccc(CCCO)c(Cl)c1 Amb25820255 [0,2,0,0,0,0|0,0,0]=2 6672 B12R1.69 Cc1ccc(CCCO)c(F)c1 Amb25135641 [0,2,0,0,0,0|0,0,0]=2 6673 B12R1.69 Cc1ccc(CCCO)c(N)c1 Amb22233216 [0,2,0,0,0,0|0,0,0]=2 6674 B12R1.69 Cc1ccc(CCNC)c(Br)c1 Amb25235798 [0,2,0,0,0,0|2,0,0]=4 6675 B12R1.69 Cc1ccc(CCNC)c(Cl)c1 Amb25850179 [0,2,0,0,0,0|2,0,0]=4 6676 B12R1.69 Cc1ccc(CCNC)c(O)c1 Amb25777142 [0,2,0,0,0,0|2,0,0]=4 6677 B12R1.69 Cc1ccc(CNCC)c(F)c1 Amb18971673 [0,2,0,0,0,0|2,0,0]=4 6678 B12R1.69 Cc1ccc(CSCC)c(O)c1 Amb25320176 [0,2,0,0,0,0|2,0,0]=4 6679 B12R1.69 Cc1ccc(NCCC)c(S)c1 Amb24355891 [0,2,0,0,0,0|2,0,0]=4 6680 B12R1.69 Cc1ccc(OCCC)c(S)c1 Amb24688543 [0,2,0,0,0,0|2,0,0]=4 6681 B12R1.69 Cc1ccc(OCCO)c(Br)[n]1 Amb22585592 [0,2,0,0,0,0|2,0,0]=4 6682 B12R1.69 Cc1ccc(OCCO)c(Cl)[n]1 Amb24421579 [0,2,0,0,0,0|2,0,0]=4 6683 B12R1.69 Cc1ccc(OCCO)c(I)[n]1 Amb25801033 [0,2,0,0,0,0|2,0,0]=4 6684 B12R1.69 Cc1ccc(OCCO)c(N)[n]1 Amb18295556 [0,2,0,0,0,0|2,0,0]=4 6685 B12R1.69 Cc1ccc(SCCC)c(O)c1 Amb18554610 [0,2,0,0,0,0|2,0,0]=4 6686 B12R1.69 ClCCCc1ccc(Br)cc1Br Amb24756782 [0,2,0,0,0,0|1,0,0]=3 6687 B12R1.69 ClCCCc1ccc(cc1Cl)Cl Amb17477748 [0,2,0,0,0,0|1,0,0]=3 6688 B12R1.69 ClCCNc1ccc(cc1Br)C Amb17351915 [0,2,0,0,0,0|2,0,0]=4 6689 B12R1.69 ClCCNc1ccc(cc1C)Br Amb17351916 [0,2,0,0,0,0|2,0,0]=4 6690 B12R1.69 ClCCNc1ccc(cc1C)C Amb17335661 [0,2,0,0,0,0|2,0,0]=4 6691 B12R1.69 ClCCNc1ccc(cc1C)Cl Amb17338053 [0,2,0,0,0,0|2,0,0]=4 6692 B12R1.69 ClCCNc1ccc(cc1Cl)Cl Amb17343163 [0,2,0,0,0,0|2,0,0]=4 6693 B12R1.69 ClCCOc1ccc(Br)cc1Br Amb25788260 [0,2,0,0,0,0|2,0,0]=4 6694 B12R1.69 ClCCOc1ccc(cc1Cl)F Amb17240164 [0,2,0,0,0,0|2,0,0]=4 6695 B12R1.69 Clc1cc(Cl)c(CCCBr)cc1 Amb24064155 [0,2,0,0,0,0|1,0,0]=3 6696 B12R1.69 Clc1cc(I)ccc1CCCBr Amb25247642 [0,2,0,0,0,0|1,0,0]=3 6697 B12R1.69 Clc1ccc(OCCI)c(Br)c1 Amb24427248 [0,2,0,0,0,0|2,0,0]=4 6698 B12R1.69 FCCNc1ccc(Cl)cc1Br Amb25284979 [0,2,0,0,0,0|2,0,0]=4 6699 B12R1.69 FCCNc1ccc(I)cc1Cl Amb25341860 [0,2,0,0,0,0|2,0,0]=4 6700 B12R1.69 FCCOc1ccc(Br)cc1Br Amb24593741 [0,2,0,0,0,0|2,0,0]=4 6701 B12R1.69 FCCOc1ccc(Br)cc1Cl Amb22470092 [0,2,0,0,0,0|2,0,0]=4 6702 B12R1.69 FCCOc1ccc(Cl)cc1Cl Amb24495908 [0,2,0,0,0,0|2,0,0]=4 6703 B12R1.69 FCCSc1ccc(F)cc1F Amb24497848 [0,2,0,0,0,0|2,0,0]=4 6704 B12R1.69 Fc1cc(Br)c(CCCBr)cc1 Amb24448383 [0,2,0,0,0,0|1,0,0]=3 6705 B12R1.69 Fc1cc(Br)ccc1CCCBr Amb20075851 [0,2,0,0,0,0|1,0,0]=3 6706 B12R1.69 Fc1cc(Br)ccc1CCCCl Amb25770333 [0,2,0,0,0,0|1,0,0]=3 6707 B12R1.69 Fc1cc(Br)ccc1NCCF Amb24535413 [0,2,0,0,0,0|2,0,0]=4 6708 B12R1.69 Fc1cc(Br)ccc1OCCF Amb24440151 [0,2,0,0,0,0|2,0,0]=4 6709 B12R1.69 Fc1cc(Cl)ccc1OCCCl Amb25231116 [0,2,0,0,0,0|2,0,0]=4 6710 B12R1.69 Fc1cc(Cl)ccc1OCCF Amb24493304 [0,2,0,0,0,0|2,0,0]=4 6711 B12R1.69 Fc1cc(Cl)ccc1OCCS Amb25789820 [0,2,0,0,0,0|1,1,0]=4 6712 B12R1.69 Fc1cc(F)c(CCCCl)cc1 Amb19073200 [0,2,0,0,0,0|1,0,0]=3 6713 B12R1.69 Fc1cc(F)c(CCCS)cc1 Amb25159701 [0,2,0,0,0,0|0,1,0]=3 6714 B12R1.69 Fc1cc(F)c(cc1)SCCS Amb24487519 [0,2,0,0,0,0|1,1,0]=4 6715 B12R1.69 Fc1cc(I)ccc1CCCBr Amb25209319 [0,2,0,0,0,0|1,0,0]=3 6716 B12R1.69 Fc1cc(S)ccc1CCCCl Amb25278657 [0,2,0,0,0,0|1,0,0]=3 6717 B12R1.69 Fc1ccc(CCCBr)c(S)c1 Amb25254870 [0,2,0,0,0,0|1,0,0]=3 6718 B12R1.69 Fc1ccc(NCCF)c(Br)c1 Amb24434276 [0,2,0,0,0,0|2,0,0]=4 6719 B12R1.69 Fc1ccc(NCCF)c(Cl)c1 Amb25124418 [0,2,0,0,0,0|2,0,0]=4 6720 B12R1.69 N#CCCc1ccc(Br)cc1F Amb24737736 [0,2,0,0,0,0|1,0,1]=4 6721 B12R1.69 N#CCCc1ccc(Br)cc1I Amb24679374 [0,2,0,0,0,0|1,0,1]=4 6722 B12R1.69 N#CCCc1ccc(F)cc1Cl Amb19045344 [0,2,0,0,0,0|1,0,1]=4 6723 B12R1.69 N#CCCc1ccc(I)cc1F Amb25207266 [0,2,0,0,0,0|1,0,1]=4 6724 B12R1.69 N#CCCc1ccc(I)cc1S Amb25230150 [0,2,0,0,0,0|1,0,1]=4 6725 B12R1.69 N#CCCc1ccc(O)cc1O Amb24742016 [0,2,0,0,0,0|1,0,1]=4 6726 B12R1.69 N#CCCc1ccc(cc1Br)C Amb17204517 [0,2,0,0,0,0|1,0,1]=4 6727 B12R1.69 N#CCCc1ccc(cc1C)Br Amb17204518 [0,2,0,0,0,0|1,0,1]=4 6728 B12R1.69 N#CCCc1ccc(cc1C)C Amb17204300 [0,2,0,0,0,0|1,0,1]=4 6729 B12R1.69 N#CCCc1ccc(cc1C)Cl Amb17204324 [0,2,0,0,0,0|1,0,1]=4 6730 B12R1.69 N#CCCc1ccc(cc1Cl)Cl Amb17204385 [0,2,0,0,0,0|1,0,1]=4 6731 B12R1.69 N#CCCc1ccc(cc1F)F Amb16193191 [0,2,0,0,0,0|1,0,1]=4 6732 B12R1.69 NCCCc1[n]cc(Cl)cc1F Amb25353752 [0,2,0,0,0,0|2,0,0]=4 6733 B12R1.69 NCCCc1c[n]c(F)cc1Cl Amb24683884 [0,2,0,0,0,0|2,0,0]=4 6734 B12R1.69 NCCCc1ccc(Cl)cc1F Amb23315399 [0,2,0,0,0,0|1,0,0]=3 6735 B12R1.69 NCCCc1ccc(Cl)cc1O Amb25084560 [0,2,0,0,0,0|1,0,0]=3 6736 B12R1.69 NCCCc1ccc(F)cc1O Amb25757889 [0,2,0,0,0,0|1,0,0]=3 6737 B12R1.69 NCCCc1ccc(O)cc1Cl Amb18556149 [0,2,0,0,0,0|1,0,0]=3 6738 B12R1.69 NCCCc1ccc(O)cc1O Amb18054814 [0,2,0,0,0,0|1,0,0]=3 6739 B12R1.69 NCCCc1ccc(cc1Br)C Amb17204537 [0,2,0,0,0,0|1,0,0]=3 6740 B12R1.69 NCCCc1ccc(cc1C)Br Amb17204538 [0,2,0,0,0,0|1,0,0]=3 6741 B12R1.69 NCCCc1ccc(cc1C)C Amb1215673 [0,2,0,0,0,0|1,0,0]=3 6742 B12R1.69 NCCCc1ccc(cc1C)Cl Amb17204337 [0,2,0,0,0,0|1,0,0]=3 6743 B12R1.69 NCCCc1ccc(cc1F)F Amb17204313 [0,2,0,0,0,0|1,0,0]=3 6744 B12R1.69 NCCNc1ccc(Br)cc1Cl Amb25062245 [0,2,0,0,0,0|2,0,0]=4 6745 B12R1.69 NCCNc1ccc(Cl)cc1F Amb18909785 [0,2,0,0,0,0|2,0,0]=4 6746 B12R1.69 NCCNc1ccc(F)cc1Cl Amb18909783 [0,2,0,0,0,0|2,0,0]=4 6747 B12R1.69 NCCNc1ccc(I)cc1Cl Amb25109686 [0,2,0,0,0,0|2,0,0]=4 6748 B12R1.69 NCCNc1ccc(cc1Br)C Amb17091075 [0,2,0,0,0,0|2,0,0]=4 6749 B12R1.69 NCCNc1ccc(cc1C)Br Amb17091076 [0,2,0,0,0,0|2,0,0]=4 6750 B12R1.69 NCCNc1ccc(cc1C)C Amb17057764 [0,2,0,0,0,0|2,0,0]=4 6751 B12R1.69 NCCNc1ccc(cc1C)Cl Amb17091059 [0,2,0,0,0,0|2,0,0]=4 6752 B12R1.69 NCCNc1ccc(cc1Cl)Cl Amb17091081 [0,2,0,0,0,0|2,0,0]=4 6753 B12R1.69 NCCNc1ccc(cc1F)F Amb17057761 [0,2,0,0,0,0|2,0,0]=4 6754 B12R1.69 NCCOc1ccc(Cl)cc1F Amb25192665 [0,2,0,0,0,0|2,0,0]=4 6755 B12R1.69 NCCOc1ccc(F)cc1F Amb19426831 [0,2,0,0,0,0|2,0,0]=4 6756 B12R1.69 NCCOc1ccc(cc1Br)Br Amb17381668 [0,2,0,0,0,0|2,0,0]=4 6757 B12R1.69 NCCOc1ccc(cc1C)C Amb1072012 [0,2,0,0,0,0|2,0,0]=4 6758 B12R1.69 NCCOc1ccc(cc1C)C Amb1215328 [0,2,0,0,0,0|2,0,0]=4 6759 B12R1.69 NCCOc1ccc(cc1Cl)F Amb2150774 [0,2,0,0,0,0|2,0,0]=4 6760 B12R1.69 NCCOc1ccc(cc1F)F Amb1139149 [0,2,0,0,0,0|2,0,0]=4 6761 B12R1.69 NCCSc1ccc(Cl)cc1Cl Amb21861547 [0,2,0,0,0,0|2,0,0]=4 6762 B12R1.69 NCCSc1ccc(cc1C)F Amb17083029 [0,2,0,0,0,0|2,0,0]=4 6763 B12R1.69 NNCCc1ccc(Br)cc1F Amb24525673 [0,2,0,0,0,0|2,0,0]=4 6764 B12R1.69 NNCCc1ccc(Cl)cc1Cl Amb19887737 [0,2,0,0,0,0|2,0,0]=4 6765 B12R1.69 NNCCc1ccc(Cl)cc1F Amb25188114 [0,2,0,0,0,0|2,0,0]=4 6766 B12R1.69 NNCCc1ccc(F)cc1Br Amb24470995 [0,2,0,0,0,0|2,0,0]=4 6767 B12R1.69 NNCCc1ccc(cc1C)C Amb17400165 [0,2,0,0,0,0|2,0,0]=4 6768 B12R1.69 NNCCc1ccc(cc1Cl)Cl Amb17402983 [0,2,0,0,0,0|2,0,0]=4 6769 B12R1.69 Nc1cc(Br)c(CCCBr)cc1 Amb25243524 [0,2,0,0,0,0|1,0,0]=3 6770 B12R1.69 Nc1cc(Br)c(cc1)NCCF Amb24391810 [0,2,0,0,0,0|2,0,0]=4 6771 B12R1.69 Nc1cc(Br)c(cc1)NCCO Amb18293614 [0,2,0,0,0,0|1,0,0]=3 6772 B12R1.69 Nc1cc(Br)c(cc1)OCCO Amb18981633 [0,2,0,0,0,0|1,0,0]=3 6773 B12R1.69 Nc1cc(Br)c(cc1)SCCO Amb18293602 [0,2,0,0,0,0|1,0,0]=3 6774 B12R1.69 Nc1cc(Br)c[n]c1OCCO Amb18973561 [0,2,0,0,0,0|2,0,0]=4 6775 B12R1.69 Nc1cc(Br)c[n]c1SCCO Amb18973564 [0,2,0,0,0,0|2,0,0]=4 6776 B12R1.69 Nc1cc(Br)ccc1CCC=O Amb24501344 [0,2,0,0,0,0|0,0,2]=4 6777 B12R1.69 Nc1cc(Br)ccc1CCCN Amb24452129 [0,2,0,0,0,0|1,0,0]=3 6778 B12R1.69 Nc1cc(Br)ccc1NCCN Amb18999459 [0,2,0,0,0,0|2,0,0]=4 6779 B12R1.69 Nc1cc(Br)ccc1OCCBr Amb22263521 [0,2,0,0,0,0|2,0,0]=4 6780 B12R1.69 Nc1cc(Br)ccc1OCCF Amb24758558 [0,2,0,0,0,0|2,0,0]=4 6781 B12R1.69 Nc1cc(Br)ccc1SCCN Amb18291323 [0,2,0,0,0,0|2,0,0]=4 6782 B12R1.69 Nc1cc(Cl)c(NCCO)[n]c1 Amb25816494 [0,2,0,0,0,0|2,0,0]=4 6783 B12R1.69 Nc1cc(Cl)c([n]c1)OCCO Amb25121631 [0,2,0,0,0,0|2,0,0]=4 6784 B12R1.69 Nc1cc(Cl)c([n]c1)SCCO Amb25121632 [0,2,0,0,0,0|2,0,0]=4 6785 B12R1.69 Nc1cc(Cl)c(cc1)NCCF Amb24712144 [0,2,0,0,0,0|2,0,0]=4 6786 B12R1.69 Nc1cc(Cl)c[n]c1SCCO Amb24370294 [0,2,0,0,0,0|2,0,0]=4 6787 B12R1.69 Nc1cc(Cl)ccc1C#CCO Amb25824714 [0,2,0,0,0,0|0,0,2]=4 6788 B12R1.69 Nc1cc(Cl)ccc1CCC#N Amb24656774 [0,2,0,0,0,0|1,0,1]=4 6789 B12R1.69 Nc1cc(Cl)ccc1CCCCl Amb24574272 [0,2,0,0,0,0|1,0,0]=3 6790 B12R1.69 Nc1cc(Cl)ccc1NCCF Amb24443635 [0,2,0,0,0,0|2,0,0]=4 6791 B12R1.69 Nc1cc(Cl)ccc1NCCN Amb18298634 [0,2,0,0,0,0|2,0,0]=4 6792 B12R1.69 Nc1cc(Cl)ccc1OCCF Amb24487547 [0,2,0,0,0,0|2,0,0]=4 6793 B12R1.69 Nc1cc(Cl)ccc1SCCF Amb25069132 [0,2,0,0,0,0|2,0,0]=4 6794 B12R1.69 Nc1cc(Cl)ccc1SCCN Amb18291311 [0,2,0,0,0,0|2,0,0]=4 6795 B12R1.69 Nc1cc(F)c(cc1)OCCF Amb25771296 [0,2,0,0,0,0|2,0,0]=4 6796 B12R1.69 Nc1cc(F)c[n]c1SCCO Amb25229318 [0,2,0,0,0,0|2,0,0]=4 6797 B12R1.69 Nc1cc(F)ccc1NCCF Amb25669799 [0,2,0,0,0,0|2,0,0]=4 6798 B12R1.69 Nc1cc(F)ccc1NCCN Amb18991501 [0,2,0,0,0,0|2,0,0]=4 6799 B12R1.69 Nc1cc(F)ccc1OCCF Amb24437013 [0,2,0,0,0,0|2,0,0]=4 6800 B12R1.69 Nc1cc(F)ccc1SCCN Amb18291317 [0,2,0,0,0,0|2,0,0]=4 6801 B12R1.69 Nc1cc(I)c(cc1)NCCF Amb25125089 [0,2,0,0,0,0|2,0,0]=4 6802 B12R1.69 Nc1cc(I)c(cc1)OCCO Amb25035161 [0,2,0,0,0,0|1,0,0]=3 6803 B12R1.69 Nc1cc(I)c(cc1)SCCO Amb25150124 [0,2,0,0,0,0|1,0,0]=3 6804 B12R1.69 Nc1cc(I)ccc1CCC=O Amb25311724 [0,2,0,0,0,0|0,0,2]=4 6805 B12R1.69 Nc1cc(I)ccc1CCCCl Amb25312276 [0,2,0,0,0,0|1,0,0]=3 6806 B12R1.69 Nc1cc(I)ccc1NCCF Amb25036430 [0,2,0,0,0,0|2,0,0]=4 6807 B12R1.69 Nc1cc(I)ccc1NCCO Amb25150077 [0,2,0,0,0,0|1,0,0]=3 6808 B12R1.69 Nc1cc(I)ccc1OCCO Amb25150025 [0,2,0,0,0,0|1,0,0]=3 6809 B12R1.69 Nc1cc(N)c(CCC=O)cc1 Amb25268463 [0,2,0,0,0,0|0,0,2]=4 6810 B12R1.69 Nc1cc(N)c(CCCCl)cc1 Amb24537154 [0,2,0,0,0,0|1,0,0]=3 6811 B12R1.69 Nc1cc(N)c(cc1)OCCO Amb22734340 [0,2,0,0,0,0|1,0,0]=3 6812 B12R1.69 Nc1cc(N)c(cc1)SCCO Amb24542857 [0,2,0,0,0,0|1,0,0]=3 6813 B12R1.69 Nc1cc(O)c(cc1)OCCO Amb25289025 [0,2,0,0,0,0|1,0,0]=3 6814 B12R1.69 Nc1cc(O)ccc1CCC=O Amb24536883 [0,2,0,0,0,0|0,0,2]=4 6815 B12R1.69 Nc1cc(S)ccc1CCC=O Amb24724099 [0,2,0,0,0,0|0,0,2]=4 6816 B12R1.69 Nc1cc(S)ccc1CCCBr Amb24695628 [0,2,0,0,0,0|1,0,0]=3 6817 B12R1.69 Nc1cc(S)ccc1CCCCl Amb24628043 [0,2,0,0,0,0|1,0,0]=3 6818 B12R1.69 Nc1ccc(CCC#N)c(Cl)c1 Amb25700092 [0,2,0,0,0,0|1,0,1]=4 6819 B12R1.69 Nc1ccc(CCC#N)c(F)c1 Amb25280190 [0,2,0,0,0,0|1,0,1]=4 6820 B12R1.69 Nc1ccc(CCC#N)c(I)c1 Amb24615894 [0,2,0,0,0,0|1,0,1]=4 6821 B12R1.69 Nc1ccc(CCCBr)c(O)c1 Amb24759204 [0,2,0,0,0,0|1,0,0]=3 6822 B12R1.69 Nc1ccc(CCCCl)c(O)c1 Amb25208686 [0,2,0,0,0,0|1,0,0]=3 6823 B12R1.69 Nc1ccc(NCCN)c(Br)c1 Amb18991524 [0,2,0,0,0,0|2,0,0]=4 6824 B12R1.69 Nc1ccc(NCCN)c(Cl)c1 Amb18298651 [0,2,0,0,0,0|2,0,0]=4 6825 B12R1.69 Nc1ccc(NCCN)c(F)c1 Amb18991505 [0,2,0,0,0,0|2,0,0]=4 6826 B12R1.69 Nc1ccc(SCCN)c(Cl)c1 Amb18975709 [0,2,0,0,0,0|2,0,0]=4 6827 B12R1.69 Nc1ccc(SCCN)c(F)c1 Amb18975707 [0,2,0,0,0,0|2,0,0]=4 6828 B12R1.69 O=CCCc1ccc(Br)cc1Cl Amb24455343 [0,2,0,0,0,0|0,0,2]=4 6829 B12R1.69 O=CCCc1ccc(Br)cc1F Amb24078525 [0,2,0,0,0,0|0,0,2]=4 6830 B12R1.69 O=CCCc1ccc(Cl)cc1Br Amb24483728 [0,2,0,0,0,0|0,0,2]=4 6831 B12R1.69 O=CCCc1ccc(Cl)cc1F Amb25149928 [0,2,0,0,0,0|0,0,2]=4 6832 B12R1.69 O=CCCc1ccc(Cl)cc1S Amb25270416 [0,2,0,0,0,0|0,0,2]=4 6833 B12R1.69 O=CCCc1ccc(F)cc1Br Amb25189497 [0,2,0,0,0,0|0,0,2]=4 6834 B12R1.69 O=CCCc1ccc(F)cc1Cl Amb19070647 [0,2,0,0,0,0|0,0,2]=4 6835 B12R1.69 O=CCCc1ccc(F)cc1F Amb18801723 [0,2,0,0,0,0|0,0,2]=4 6836 B12R1.69 O=CCCc1ccc(F)cc1I Amb25305164 [0,2,0,0,0,0|0,0,2]=4 6837 B12R1.69 O=CCCc1ccc(I)cc1F Amb24728158 [0,2,0,0,0,0|0,0,2]=4 6838 B12R1.69 O=CCCc1ccc(I)cc1I Amb25242662 [0,2,0,0,0,0|0,0,2]=4 6839 B12R1.69 O=CCCc1ccc(S)cc1S Amb24696708 [0,2,0,0,0,0|0,0,2]=4 6840 B12R1.69 O=CCCc1ccc(cc1Cl)Cl Amb17612588 [0,2,0,0,0,0|0,0,2]=4 6841 B12R1.69 OCC#Cc1ccc(cc1F)Cl Amb2423467 [0,2,0,0,0,0|0,0,2]=4 6842 B12R1.69 OCCCN1C=CC(=O)C=C1Cl Amb25043292 [0,2,0,0,0,0|1,0,0]=3 6843 B12R1.69 OCCCc1ccc(Br)cc1F Amb20171344 [0,2,0,0,0,0|0,0,0]=2 6844 B12R1.69 OCCCc1ccc(Cl)cc1F Amb25720643 [0,2,0,0,0,0|0,0,0]=2 6845 B12R1.69 OCCCc1ccc(F)cc1Br Amb24090111 [0,2,0,0,0,0|0,0,0]=2 6846 B12R1.69 OCCCc1ccc(F)cc1Cl Amb19072148 [0,2,0,0,0,0|0,0,0]=2 6847 B12R1.69 OCCCc1ccc(O)cc1O Amb18646882 [0,2,0,0,0,0|0,0,0]=2 6848 B12R1.69 OCCCc1ccc(cc1C)C Amb17400157 [0,2,0,0,0,0|0,0,0]=2 6849 B12R1.69 OCCCc1ccc(cc1Cl)Cl Amb17402981 [0,2,0,0,0,0|0,0,0]=2 6850 B12R1.69 OCCCc1ccc(cc1F)F Amb17605787 [0,2,0,0,0,0|0,0,0]=2 6851 B12R1.69 OCCNc1[n]cc(Br)cc1Br Amb24680585 [0,2,0,0,0,0|2,0,0]=4 6852 B12R1.69 OCCNc1[n]cc(Cl)cc1Br Amb24359358 [0,2,0,0,0,0|2,0,0]=4 6853 B12R1.69 OCCNc1[n]cc(Cl)cc1F Amb19959550 [0,2,0,0,0,0|2,0,0]=4 6854 B12R1.69 OCCNc1ccc(Br)cc1Br Amb24744028 [0,2,0,0,0,0|1,0,0]=3 6855 B12R1.69 OCCNc1ccc(Cl)cc1F Amb18987263 [0,2,0,0,0,0|1,0,0]=3 6856 B12R1.69 OCCNc1ccc(Cl)cc1I Amb25115225 [0,2,0,0,0,0|1,0,0]=3 6857 B12R1.69 OCCNc1ccc(I)cc1Br Amb25340858 [0,2,0,0,0,0|1,0,0]=3 6858 B12R1.69 OCCNc1ccc(I)cc1Cl Amb25697771 [0,2,0,0,0,0|1,0,0]=3 6859 B12R1.69 OCCNc1ccc(cc1C)Cl Amb17305825 [0,2,0,0,0,0|1,0,0]=3 6860 B12R1.69 OCCNc1ncc(cc1Br)N Amb17213688 [0,2,0,0,0,0|2,0,0]=4 6861 B12R1.69 OCCNc1ncc(cc1C)N Amb17210900 [0,2,0,0,0,0|2,0,0]=4 6862 B12R1.69 OCCNc1ncc(cc1N)Br Amb17209005 [0,2,0,0,0,0|2,0,0]=4 6863 B12R1.69 OCCNc1ncc(cc1N)C Amb17209059 [0,2,0,0,0,0|2,0,0]=4 6864 B12R1.69 OCCNc1ncc(cc1N)Cl Amb17208938 [0,2,0,0,0,0|2,0,0]=4 6865 B12R1.69 OCCOc1[n]cc(I)cc1Br Amb25785075 [0,2,0,0,0,0|2,0,0]=4 6866 B12R1.69 OCCOc1ccc(Br)[n]c1Cl Amb24493295 [0,2,0,0,0,0|2,0,0]=4 6867 B12R1.69 OCCOc1ccc(Br)cc1Br Amb19339973 [0,2,0,0,0,0|1,0,0]=3 6868 B12R1.69 OCCOc1ccc(I)cc1I Amb25036249 [0,2,0,0,0,0|1,0,0]=3 6869 B12R1.69 OCCOc1ccc(O)cc1O Amb25674471 [0,2,0,0,0,0|1,0,0]=3 6870 B12R1.69 OCCOc1ccc(cc1Cl)Cl Amb1050772 [0,2,0,0,0,0|1,0,0]=3 6871 B12R1.69 OCCOc1ccc(cc1Cl)F Amb17105030 [0,2,0,0,0,0|1,0,0]=3 6872 B12R1.69 OCCSc1[n]cc(Br)cc1Br Amb24645556 [0,2,0,0,0,0|2,0,0]=4 6873 B12R1.69 OCCSc1[n]cc(Br)cc1Cl Amb24407077 [0,2,0,0,0,0|2,0,0]=4 6874 B12R1.69 OCCSc1[n]cc(Cl)cc1Br Amb24556174 [0,2,0,0,0,0|2,0,0]=4 6875 B12R1.69 OCCSc1[n]cc(Cl)cc1F Amb25041989 [0,2,0,0,0,0|2,0,0]=4 6876 B12R1.69 OCCSc1[n]cc(F)cc1F Amb25035058 [0,2,0,0,0,0|2,0,0]=4 6877 B12R1.69 OC\C=C\c1ccc(Br)cc1Cl Amb25826292 [0,2,0,0,0,0|0,0,2]=4 6878 B12R1.69 OC\C=C\c1ccc(Cl)cc1Br Amb24465297 [0,2,0,0,0,0|0,0,2]=4 6879 B12R1.69 OC\C=C\c1ccc(Cl)cc1Cl Amb22499014 [0,2,0,0,0,0|0,0,2]=4 6880 B12R1.69 OC\C=C\c1ccc(Cl)cc1F Amb25697673 [0,2,0,0,0,0|0,0,2]=4 6881 B12R1.69 OC\C=C\c1ccc(F)cc1F Amb23442759 [0,2,0,0,0,0|0,0,2]=4 6882 B12R1.69 Oc1cc(Br)c[n]c1OCCO Amb21959464 [0,2,0,0,0,0|2,0,0]=4 6883 B12R1.69 Oc1cc(Cl)c[n]c1OCCO Amb21961116 [0,2,0,0,0,0|2,0,0]=4 6884 B12R1.69 Oc1cc(Cl)ccc1CCCBr Amb24743949 [0,2,0,0,0,0|1,0,0]=3 6885 B12R1.69 Oc1cc(F)ccc1CCCO Amb25106077 [0,2,0,0,0,0|0,0,0]=2 6886 B12R1.69 Oc1cc(F)ccc1OCCO Amb25838740 [0,2,0,0,0,0|1,0,0]=3 6887 B12R1.69 Oc1ccc(CCC=O)c(Br)c1 Amb25040158 [0,2,0,0,0,0|0,0,2]=4 6888 B12R1.69 Oc1ccc(CCCBr)c(I)c1 Amb24527855 [0,2,0,0,0,0|1,0,0]=3 6889 B12R1.69 Oc1ccc(CCCBr)c(S)c1 Amb25351802 [0,2,0,0,0,0|1,0,0]=3 6890 B12R1.69 Oc1ccc(CCCCl)c(S)c1 Amb25253243 [0,2,0,0,0,0|1,0,0]=3 6891 B12R1.69 Oc1ccc(CCCO)c(Cl)c1 Amb25690683 [0,2,0,0,0,0|0,0,0]=2 6892 B12R1.69 Oc1ccc(CCCO)c(F)c1 Amb25281830 [0,2,0,0,0,0|0,0,0]=2 6893 B12R1.69 SCCOc1ccc(Br)cc1Br Amb25034566 [0,2,0,0,0,0|1,1,0]=4 6894 B12R1.69 SCCOc1ccc(Br)cc1Cl Amb25120727 [0,2,0,0,0,0|1,1,0]=4 6895 B12R1.69 SCCOc1ccc(cc1C)C Amb17233944 [0,2,0,0,0,0|1,1,0]=4 6896 B12R1.69 SCCOc1ccc(cc1C)Cl Amb17237590 [0,2,0,0,0,0|1,1,0]=4 6897 B12R1.69 SCCOc1ccc(cc1Cl)F Amb17239148 [0,2,0,0,0,0|1,1,0]=4 6898 B12R1.69 SCCOc1ccc(cc1F)F Amb17234881 [0,2,0,0,0,0|1,1,0]=4 6899 B12R1.69 SCCSc1ccc(Cl)cc1Cl Amb25696682 [0,2,0,0,0,0|1,1,0]=4 6900 B12R1.69 Sc1ccc(CCCBr)c(I)c1 Amb24696766 [0,2,0,0,0,0|1,0,0]=3 6901 B12R1.70 CC1(C)CC=C(CCCO)C=C1 Amb25107658 [0,2,0,0,0,0|0,0,2]=4 6902 B12R1.71 BrCCCc1ccc(cc1)CC Amb17104557 [0,2,0,0,0,0|1,0,0]=3 6903 B12R1.71 BrCCCc1ccc(cc1)OC Amb17104559 [0,2,0,0,0,0|1,0,0]=3 6904 B12R1.71 BrCCOc1ccc(cc1)C#N Amb1107353 [0,2,0,0,0,0|2,0,0]=4 6905 B12R1.71 BrCCOc1ccc(cc1)CC Amb1353197 [0,2,0,0,0,0|2,0,0]=4 6906 B12R1.71 BrCCOc1ccc(cc1)OC Amb1151010 [0,2,0,0,0,0|2,0,0]=4 6907 B12R1.71 BrCc1ccc(CCCBr)cc1 Amb23590681 [0,2,0,0,0,0|1,0,0]=3 6908 B12R1.71 C#CCCc1ccc(CO)cc1 Amb25137369 [0,2,0,0,0,0|1,0,1]=4 6909 B12R1.71 C#CCCc1ccc(cc1)C#N Amb18114977 [0,2,0,0,0,0|1,0,1]=4 6910 B12R1.71 C#Cc1ccc(cc1)OCCCl Amb25794485 [0,2,0,0,0,0|2,0,0]=4 6911 B12R1.71 C=CCCc1ccc(C=O)cc1 Amb24102789 [0,2,0,0,0,0|1,0,1]=4 6912 B12R1.71 C=Cc1ccc(CCCBr)cc1 Amb22831998 [0,2,0,0,0,0|1,0,0]=3 6913 B12R1.71 CCCC[n+]1ccc(CN)cc1 Amb24113147 [0,2,0,0,0,0|2,0,0]=4 6914 B12R1.71 CCCCc1ccc(C#N)[n]c1 Amb18645402 [0,2,0,0,0,0|2,0,0]=4 6915 B12R1.71 CCCCc1ccc(C=O)c[n]1 Amb22755828 [0,2,0,0,0,0|2,0,0]=4 6916 B12R1.71 CCCCc1ccc(CBr)cc1 Amb24065906 [0,2,0,0,0,0|1,0,0]=3 6917 B12R1.71 CCCCc1ccc(NN)cc1 Amb17949643 [0,2,0,0,0,0|1,0,0]=3 6918 B12R1.71 CCCCc1ccc(c[n]1)C#N Amb18645392 [0,2,0,0,0,0|2,0,0]=4 6919 B12R1.71 CCCCc1ccc(cc1)NC Amb20623748 [0,2,0,0,0,0|1,0,0]=3 6920 B12R1.71 CCCCc1ccc(cc1)NN Amb2234491 [0,2,0,0,0,0|1,0,0]=3 6921 B12R1.71 CCCCc1ccc(cc1)NO Amb24091344 [0,2,0,0,0,0|1,0,0]=3 6922 B12R1.71 CCCCc1ccc(cc1)[Mg]Br Amb22000527 [0,2,0,0,0,0|1,0,0]=3 6923 B12R1.71 CCCCc1ccc(cc1)[Zn]Br Amb22898139 [0,2,0,0,0,0|1,0,0]=3 6924 B12R1.71 CCCNc1ccc(C=O)cc1 Amb25055167 [0,2,0,0,0,0|2,0,0]=4 6925 B12R1.71 CCCNc1ccc(CN)cc1 Amb18800849 [0,2,0,0,0,0|2,0,0]=4 6926 B12R1.71 CCCNc1ccc(CO)cc1 Amb25734032 [0,2,0,0,0,0|2,0,0]=4 6927 B12R1.71 CCCNc1ccc(cc1)N=O Amb25096367 [0,2,0,0,0,0|2,0,0]=4 6928 B12R1.71 CCCOc1ccc(cc1)C=O Amb1073495 [0,2,0,0,0,0|2,0,0]=4 6929 B12R1.71 CCCOc1ccc(cc1)CN Amb1136393 [0,2,0,0,0,0|2,0,0]=4 6930 B12R1.71 CCCOc1ccc(cc1)NC Amb19032018 [0,2,0,0,0,0|2,0,0]=4 6931 B12R1.71 CCCOc1ccc(cc1)NN Amb17232617 [0,2,0,0,0,0|2,0,0]=4 6932 B12R1.71 CCCOc1ccc(cc1)[Zn]Br Amb22897867 [0,2,0,0,0,0|2,0,0]=4 6933 B12R1.71 CCCSc1ccc(cc1)NC Amb18554168 [0,2,0,0,0,0|2,0,0]=4 6934 B12R1.71 CCCSc1ccc(cc1)[Zn]Br Amb22897972 [0,2,0,0,0,0|2,0,0]=4 6935 B12R1.71 CCNCc1ccc(CN)cc1 Amb19009735 [0,2,0,0,0,0|2,0,0]=4 6936 B12R1.71 CCNCc1ccc(CO)cc1 Amb19649772 [0,2,0,0,0,0|2,0,0]=4 6937 B12R1.71 CCNCc1ccc(cc1)C#C Amb25840064 [0,2,0,0,0,0|2,0,0]=4 6938 B12R1.71 CCNCc1ccc(cc1)NO Amb25348470 [0,2,0,0,0,0|2,0,0]=4 6939 B12R1.71 CCNCc1ccc(cc1)OC Amb10609135 [0,2,0,0,0,0|2,0,0]=4 6940 B12R1.71 CCNCc1ccc(cc1)SC Amb1923472 [0,2,0,0,0,0|2,0,0]=4 6941 B12R1.71 CCOCc1ccc(C=O)cc1 Amb23443710 [0,2,0,0,0,0|2,0,0]=4 6942 B12R1.71 CCOCc1ccc(cc1)CN Amb1128026 [0,2,0,0,0,0|2,0,0]=4 6943 B12R1.71 CCOCc1ccc(cc1)[Zn]Br Amb22898128 [0,2,0,0,0,0|2,0,0]=4 6944 B12R1.71 CCc1ccc(\C=C\CO)cc1 Amb23442835 [0,2,0,0,0,0|0,0,2]=4 6945 B12R1.71 CCc1ccc(cc1)C#CCO Amb18792228 [0,2,0,0,0,0|0,0,2]=4 6946 B12R1.71 CCc1ccc(cc1)CCC#N Amb17204305 [0,2,0,0,0,0|1,0,1]=4 6947 B12R1.71 CCc1ccc(cc1)CCC=O Amb17081676 [0,2,0,0,0,0|0,0,2]=4 6948 B12R1.71 CCc1ccc(cc1)CCNN Amb17400163 [0,2,0,0,0,0|2,0,0]=4 6949 B12R1.71 CCc1ccc(cc1)NCCF Amb24539836 [0,2,0,0,0,0|2,0,0]=4 6950 B12R1.71 CNCCc1ccc(cc1)CC Amb17400138 [0,2,0,0,0,0|2,0,0]=4 6951 B12R1.71 CNCCc1ccc(cc1)OC Amb22831233 [0,2,0,0,0,0|2,0,0]=4 6952 B12R1.71 CNCCc1ccc(cc1)SC Amb18243817 [0,2,0,0,0,0|2,0,0]=4 6953 B12R1.71 CNc1[n]cc(CCCO)c[n]1 Amb25129896 [0,2,0,0,0,0|2,0,0]=4 6954 B12R1.71 CNc1ccc(cc1)OCCF Amb24487620 [0,2,0,0,0,0|2,0,0]=4 6955 B12R1.71 CNc1ccc(cc1)OCCN Amb23400492 [0,2,0,0,0,0|2,0,0]=4 6956 B12R1.71 CNc1ccc(cc1)OCCO Amb19008490 [0,2,0,0,0,0|1,0,0]=3 6957 B12R1.71 COc1c[n]c(cc1)NCCO Amb24497791 [0,2,0,0,0,0|2,0,0]=4 6958 B12R1.71 COc1ccc(CCC#C)cc1 Amb18115927 [0,2,0,0,0,0|1,0,1]=4 6959 B12R1.71 COc1ccc(CCNN)cc1 Amb19515647 [0,2,0,0,0,0|2,0,0]=4 6960 B12R1.71 COc1ccc(CCNN)cc1 Amb19889396 [0,2,0,0,0,0|2,0,0]=4 6961 B12R1.71 COc1ccc(CCOC)cc1 Amb24064722 [0,2,0,0,0,0|2,0,0]=4 6962 B12R1.71 COc1ccc(CC[Mg]Cl)cc1 Amb22000545 [0,2,0,0,0,0|2,0,0]=4 6963 B12R1.71 COc1ccc(COCC)cc1 Amb22054341 [0,2,0,0,0,0|2,0,0]=4 6964 B12R1.71 COc1ccc(COCCl)cc1 Amb20242271 [0,2,0,0,0,0|2,0,0]=4 6965 B12R1.71 COc1ccc(C\C=N\O)cc1 Amb25154213 [0,2,0,0,0,0|1,0,1]=4 6966 B12R1.71 COc1ccc(\C=N\CO)cc1 Amb25057794 [0,2,0,0,0,0|1,0,1]=4 6967 B12R1.71 COc1ccc(cc1)NCCF Amb24410912 [0,2,0,0,0,0|2,0,0]=4 6968 B12R1.71 COc1ccc(cc1)SCCN Amb22051707 [0,2,0,0,0,0|2,0,0]=4 6969 B12R1.71 CSc1ccc(CCC#N)cc1 Amb18862922 [0,2,0,0,0,0|1,0,1]=4 6970 B12R1.71 CSc1ccc(CCC=O)cc1 Amb24093033 [0,2,0,0,0,0|0,0,2]=4 6971 B12R1.71 CSc1ccc(CCCN)cc1 Amb18055313 [0,2,0,0,0,0|1,0,0]=3 6972 B12R1.71 CSc1ccc(CCCO)cc1 Amb18863034 [0,2,0,0,0,0|0,0,0]=2 6973 B12R1.71 CSc1ccc(\C=C\CO)cc1 Amb25682133 [0,2,0,0,0,0|0,0,2]=4 6974 B12R1.71 CSc1ccc(cc1)C#CCO Amb25228424 [0,2,0,0,0,0|0,0,2]=4 6975 B12R1.71 CSc1ccc(cc1)NCCN Amb18243831 [0,2,0,0,0,0|2,0,0]=4 6976 B12R1.71 CSc1ccc(cc1)OCCCl Amb19148893 [0,2,0,0,0,0|2,0,0]=4 6977 B12R1.71 CSc1ccc(cc1)OCCF Amb22482423 [0,2,0,0,0,0|2,0,0]=4 6978 B12R1.71 ClCCCc1ccc(cc1)CC Amb17104530 [0,2,0,0,0,0|1,0,0]=3 6979 B12R1.71 ClCCNc1ccc(cc1)C#N Amb17335462 [0,2,0,0,0,0|2,0,0]=4 6980 B12R1.71 ClCCNc1ccc(cc1)CC Amb17335668 [0,2,0,0,0,0|2,0,0]=4 6981 B12R1.71 ClCCNc1ccc(cc1)OC Amb17335808 [0,2,0,0,0,0|2,0,0]=4 6982 B12R1.71 ClCCOc1ccc(cc1)OC Amb2446473 [0,2,0,0,0,0|2,0,0]=4 6983 B12R1.71 FCCOc1ccc(CBr)cc1 Amb23580154 [0,2,0,0,0,0|2,0,0]=4 6984 B12R1.71 N#CCCc1ccc(CBr)cc1 Amb24637117 [0,2,0,0,0,0|1,0,1]=4 6985 B12R1.71 N#CCCc1ccc(CCl)cc1 Amb25248725 [0,2,0,0,0,0|1,0,1]=4 6986 B12R1.71 N#Cc1ccc(CCC#N)cc1 Amb18644805 [0,2,0,0,0,0|1,0,1]=4 6987 B12R1.71 N#Cc1ccc(CCC=O)cc1 Amb24093122 [0,2,0,0,0,0|0,0,2]=4 6988 B12R1.71 N#Cc1ccc(CCCBr)cc1 Amb25851402 [0,2,0,0,0,0|1,0,0]=3 6989 B12R1.71 N#Cc1ccc(\C=C\CO)cc1 Amb25787543 [0,2,0,0,0,0|0,0,2]=4 6990 B12R1.71 N#Cc1ccc(c[n]1)SCCO Amb24421951 [0,2,0,0,0,0|2,0,0]=4 6991 B12R1.71 N#Cc1ccc(cc1)OCCF Amb23579957 [0,2,0,0,0,0|2,0,0]=4 6992 B12R1.71 N#Cc1ccc(cc1)SCCF Amb24473476 [0,2,0,0,0,0|2,0,0]=4 6993 B12R1.71 NCCCc1ccc(c[n]1)C#N Amb24413297 [0,2,0,0,0,0|2,0,0]=4 6994 B12R1.71 NCCCc1ccc(cc1)C#N Amb25708502 [0,2,0,0,0,0|1,0,0]=3 6995 B12R1.71 NCCCc1ccc(cc1)CO Amb17477572 [0,2,0,0,0,0|1,0,0]=3 6996 B12R1.71 NCCCc1ccc(cc1)OC Amb1092530 [0,2,0,0,0,0|1,0,0]=3 6997 B12R1.71 NCCCc1ccc(cc1)OC Amb13949143 [0,2,0,0,0,0|1,0,0]=3 6998 B12R1.71 NCCNc1ccc(CO)cc1 Amb25719187 [0,2,0,0,0,0|2,0,0]=4 6999 B12R1.71 NCCNc1ccc(cc1)CC Amb17057758 [0,2,0,0,0,0|2,0,0]=4 7000 B12R1.71 NCCNc1ccc(cc1)OC Amb10604015 [0,2,0,0,0,0|2,0,0]=4 7001 B12R1.71 NCCOc1ccc(cc1)C#N Amb17562028 [0,2,0,0,0,0|2,0,0]=4 7002 B12R1.71 NCCOc1ccc(cc1)C#N Amb19374943 [0,2,0,0,0,0|2,0,0]=4 7003 B12R1.71 NCCOc1ccc(cc1)CC Amb1138492 [0,2,0,0,0,0|2,0,0]=4 7004 B12R1.71 NCCOc1ccc(cc1)OC Amb1063468 [0,2,0,0,0,0|2,0,0]=4 7005 B12R1.71 NCCOc1ccc(cc1)SC Amb10243213 [0,2,0,0,0,0|2,0,0]=4 7006 B12R1.71 NCCSc1ccc(cc1)C#N Amb18909077 [0,2,0,0,0,0|2,0,0]=4 7007 B12R1.71 NCCSc1ccc(cc1)CC Amb17083025 [0,2,0,0,0,0|2,0,0]=4 7008 B12R1.71 NCc1c[n]c(cc1)NCCO Amb19025110 [0,2,0,0,0,0|2,0,0]=4 7009 B12R1.71 NCc1ccc(CCCN)cc1 Amb22395124 [0,2,0,0,0,0|1,0,0]=3 7010 B12R1.71 NCc1ccc(CCCO)cc1 Amb23441994 [0,2,0,0,0,0|0,0,0]=2 7011 B12R1.71 NCc1ccc(c[n]1)NCCO Amb24634838 [0,2,0,0,0,0|2,0,0]=4 7012 B12R1.71 NCc1ccc(cc1)OCCBr Amb24094298 [0,2,0,0,0,0|2,0,0]=4 7013 B12R1.71 NCc1ccc(cc1)OCCF Amb23580153 [0,2,0,0,0,0|2,0,0]=4 7014 B12R1.71 NNc1ccc(cc1)OCCBr Amb20620464 [0,2,0,0,0,0|2,0,0]=4 7015 B12R1.71 NOCCc1ccc(cc1)OC Amb17232637 [0,2,0,0,0,0|2,0,0]=4 7016 B12R1.71 O=Cc1ccc(CCC=O)cc1 Amb18645655 [0,2,0,0,0,0|0,0,2]=4 7017 B12R1.71 O=Cc1ccc(cc1)NCCF Amb25178323 [0,2,0,0,0,0|2,0,0]=4 7018 B12R1.71 O=Cc1ccc(cc1)OCCF Amb23579953 [0,2,0,0,0,0|2,0,0]=4 7019 B12R1.71 OCC#Cc1ccc(CO)cc1 Amb18792413 [0,2,0,0,0,0|0,0,2]=4 7020 B12R1.71 OCCCc1ccc(C=O)cc1 Amb18646079 [0,2,0,0,0,0|0,0,0]=2 7021 B12R1.71 OCCCc1ccc(cc1)C#N Amb13883607 [0,2,0,0,0,0|0,0,0]=2 7022 B12R1.71 OCCCc1ccc(cc1)CC Amb17089498 [0,2,0,0,0,0|0,0,0]=2 7023 B12R1.71 OCCNc1ccc(C=O)c[n]1 Amb24083497 [0,2,0,0,0,0|2,0,0]=4 7024 B12R1.71 OCCOc1ccc(cc1)CN Amb13951489 [0,2,0,0,0,0|1,0,0]=3 7025 B12R1.71 OCCOc1ccc(cc1)OC Amb2209351 [0,2,0,0,0,0|1,0,0]=3 7026 B12R1.71 OCc1ccc(cc1)NCCCl Amb25257978 [0,2,0,0,0,0|2,0,0]=4 7027 B12R1.71 OCc1ccc(cc1)OCCCl Amb24094315 [0,2,0,0,0,0|2,0,0]=4 7028 B12R1.71 OCc1ccc(cc1)OCCF Amb23580002 [0,2,0,0,0,0|2,0,0]=4 7029 B12R1.71 SCCCc1ccc(cc1)CC Amb17400844 [0,2,0,0,0,0|0,1,0]=3 7030 B12R1.71 SCCCc1ccc(cc1)OC Amb17400951 [0,2,0,0,0,0|0,1,0]=3 7031 B12R1.71 SCCOc1ccc(cc1)CC Amb17233943 [0,2,0,0,0,0|1,1,0]=4 7032 B12R1.385 BrCCCc1cc(Br)c(Br)cc1 Amb24579120 [0,2,0,0,0,0|1,0,0]=3 7033 B12R1.385 BrCCOc1ccc(c(c1)Cl)Cl Amb17274514 [0,2,0,0,0,0|2,0,0]=4 7034 B12R1.385 Brc1ccc(CCCBr)cc1I Amb24651202 [0,2,0,0,0,0|1,0,0]=3 7035 B12R1.385 C#CCCc1cc(Cl)c(Cl)cc1 Amb18636113 [0,2,0,0,0,0|1,0,1]=4 7036 B12R1.385 C=CCCc1ccc(F)c(Br)c1 Amb25375534 [0,2,0,0,0,0|1,0,1]=4 7037 B12R1.385 CC1=CC(CCCC)=CNC1=O Amb25298886 [0,2,0,0,0,0|2,0,0]=4 7038 B12R1.385 CC1=CN(CCCBr)C=CC1=O Amb25816432 [0,2,0,0,0,0|2,0,0]=4 7039 B12R1.385 CC1=CN(CCCC)C=CC1=O Amb24719034 [0,2,0,0,0,0|2,0,0]=4 7040 B12R1.385 CC1=CN(CCCCl)C=CC1=O Amb25306687 [0,2,0,0,0,0|2,0,0]=4 7041 B12R1.385 CC1=CN(CCCN)C=CC1=O Amb24412346 [0,2,0,0,0,0|2,0,0]=4 7042 B12R1.385 CC1=CN(CCCO)C=CC1=O Amb25129952 [0,2,0,0,0,0|1,0,0]=3 7043 B12R1.385 CCCC[n+]1cc(C)c(C)cc1 Amb25064723 [0,2,0,0,0,0|2,0,0]=4 7044 B12R1.385 CCCCc1cc(Br)c(Br)cc1 Amb19944055 [0,2,0,0,0,0|1,0,0]=3 7045 B12R1.385 CCCCc1cc(N)c(N)[n]c1 Amb25040102 [0,2,0,0,0,0|2,0,0]=4 7046 B12R1.385 CCCCc1cc(N)c(N)cc1 Amb18646137 [0,2,0,0,0,0|1,0,0]=3 7047 B12R1.385 CCCCc1cc(N)c(N)cc1 Amb20247546 [0,2,0,0,0,0|1,0,0]=3 7048 B12R1.385 CCCCc1cc(O)c(O)cc1 Amb22167996 [0,2,0,0,0,0|1,0,0]=3 7049 B12R1.385 CCCCc1ccc(Cl)c(Br)c1 Amb19944056 [0,2,0,0,0,0|1,0,0]=3 7050 B12R1.385 CCCCc1ccc(I)c(Br)c1 Amb19944054 [0,2,0,0,0,0|1,0,0]=3 7051 B12R1.385 CCCCc1ccc(N)c(Br)c1 Amb19944049 [0,2,0,0,0,0|1,0,0]=3 7052 B12R1.385 CCCCc1ccc(N)c(Br)c1 Amb23517949 [0,2,0,0,0,0|1,0,0]=3 7053 B12R1.385 CCCCc1ccc(N)c(F)c1 Amb25351578 [0,2,0,0,0,0|1,0,0]=3 7054 B12R1.385 CCCCc1ccc(N)c(S)c1 Amb18939301 [0,2,0,0,0,0|1,0,0]=3 7055 B12R1.385 CCCCc1ccc(O)c(Br)c1 Amb20620414 [0,2,0,0,0,0|1,0,0]=3 7056 B12R1.385 CCCCc1ccc(O)c(F)c1 Amb24091337 [0,2,0,0,0,0|1,0,0]=3 7057 B12R1.385 CCCCc1ccc(O)c(N)c1 Amb24331679 [0,2,0,0,0,0|1,0,0]=3 7058 B12R1.385 CCCNc1cc(Br)c(Cl)cc1 Amb24487633 [0,2,0,0,0,0|2,0,0]=4 7059 B12R1.385 CCCNc1cc(Br)c(I)cc1 Amb24493642 [0,2,0,0,0,0|2,0,0]=4 7060 B12R1.385 CCCNc1ccc(c(c1)Br)C Amb17142401 [0,2,0,0,0,0|2,0,0]=4 7061 B12R1.385 CCCOc1cc(Br)c(N)cc1 Amb23556483 [0,2,0,0,0,0|2,0,0]=4 7062 B12R1.385 CCCOc1cc(Cl)c(Cl)cc1 Amb24450826 [0,2,0,0,0,0|2,0,0]=4 7063 B12R1.385 CCCOc1cc(Cl)c(N)cc1 Amb18986395 [0,2,0,0,0,0|2,0,0]=4 7064 B12R1.385 CCCOc1cc(Cl)c(O)cc1 Amb18556110 [0,2,0,0,0,0|2,0,0]=4 7065 B12R1.385 CCCOc1cc(F)c(Br)cc1 Amb22490083 [0,2,0,0,0,0|2,0,0]=4 7066 B12R1.385 CCCOc1cc(F)c(F)cc1 Amb25816178 [0,2,0,0,0,0|2,0,0]=4 7067 B12R1.385 CCCOc1cc(F)c(N)cc1 Amb18980926 [0,2,0,0,0,0|2,0,0]=4 7068 B12R1.385 CCCOc1cc(N)c(Br)cc1 Amb23555865 [0,2,0,0,0,0|2,0,0]=4 7069 B12R1.385 CCCOc1cc(N)c(I)cc1 Amb23505543 [0,2,0,0,0,0|2,0,0]=4 7070 B12R1.385 CCCOc1cc(N)c(O)cc1 Amb18056091 [0,2,0,0,0,0|2,0,0]=4 7071 B12R1.385 CCCOc1cc(N)c(S)cc1 Amb18939266 [0,2,0,0,0,0|2,0,0]=4 7072 B12R1.385 CCCOc1cc(O)c(O)cc1 Amb18055901 [0,2,0,0,0,0|2,0,0]=4 7073 B12R1.385 CCCOc1cc(S)c(N)cc1 Amb18939289 [0,2,0,0,0,0|2,0,0]=4 7074 B12R1.385 CCCOc1ccc(c(c1)C)N Amb1134107 [0,2,0,0,0,0|2,0,0]=4 7075 B12R1.385 CCCOc1ccc(c(c1)N)C Amb17138590 [0,2,0,0,0,0|2,0,0]=4 7076 B12R1.385 CCCOc1ccc(c(c1)N)Cl Amb17139123 [0,2,0,0,0,0|2,0,0]=4 7077 B12R1.385 CCCSc1cc(Cl)c(F)cc1 Amb25795992 [0,2,0,0,0,0|2,0,0]=4 7078 B12R1.385 CCCSc1cc(Cl)c(N)cc1 Amb24537858 [0,2,0,0,0,0|2,0,0]=4 7079 B12R1.385 CCCSc1cc(Cl)c(O)cc1 Amb24497361 [0,2,0,0,0,0|2,0,0]=4 7080 B12R1.385 CCCSc1cc(N)c(N)cc1 Amb18648679 [0,2,0,0,0,0|2,0,0]=4 7081 B12R1.385 CCNCc1cc(Br)c(Cl)cc1 Amb24350916 [0,2,0,0,0,0|2,0,0]=4 7082 B12R1.385 CCNCc1cc(Cl)c(F)cc1 Amb18992526 [0,2,0,0,0,0|2,0,0]=4 7083 B12R1.385 CCNCc1cc(F)c(Br)cc1 Amb18981584 [0,2,0,0,0,0|2,0,0]=4 7084 B12R1.385 CCNCc1cc(F)c(Cl)cc1 Amb18980640 [0,2,0,0,0,0|2,0,0]=4 7085 B12R1.385 CCNCc1cc(F)c(N)cc1 Amb25084901 [0,2,0,0,0,0|2,0,0]=4 7086 B12R1.385 CCNCc1cc(I)c(N)cc1 Amb24758746 [0,2,0,0,0,0|2,0,0]=4 7087 B12R1.385 CCNCc1cc(N)c(Cl)cc1 Amb18972389 [0,2,0,0,0,0|2,0,0]=4 7088 B12R1.385 CCNCc1ccc(c(c1)Br)O Amb17144308 [0,2,0,0,0,0|2,0,0]=4 7089 B12R1.385 CCNCc1ccc(c(c1)C)F Amb17400236 [0,2,0,0,0,0|2,0,0]=4 7090 B12R1.385 CCNCc1ccc(c(c1)Cl)Cl Amb10609579 [0,2,0,0,0,0|2,0,0]=4 7091 B12R1.385 CCNCc1ccc(c(c1)Cl)O Amb17509695 [0,2,0,0,0,0|2,0,0]=4 7092 B12R1.385 CCNCc1ccc(c(c1)F)F Amb10609350 [0,2,0,0,0,0|2,0,0]=4 7093 B12R1.385 CCOCc1cc(Br)c(F)cc1 Amb25824962 [0,2,0,0,0,0|2,0,0]=4 7094 B12R1.385 CCOCc1cc(F)c(N)cc1 Amb25339077 [0,2,0,0,0,0|2,0,0]=4 7095 B12R1.385 CCOCc1cc(N)c(Br)cc1 Amb24446502 [0,2,0,0,0,0|2,0,0]=4 7096 B12R1.385 CCOCc1cc(N)c(O)cc1 Amb25794233 [0,2,0,0,0,0|2,0,0]=4 7097 B12R1.385 CCSCc1cc(Br)c(F)cc1 Amb24372353 [0,2,0,0,0,0|2,0,0]=4 7098 B12R1.385 CCSCc1cc(C)c(C)cc1 Amb25307266 [0,2,0,0,0,0|2,0,0]=4 7099 B12R1.385 CCSCc1cc(Cl)c(Cl)cc1 Amb24686686 [0,2,0,0,0,0|2,0,0]=4 7100 B12R1.385 CCSCc1cc(F)c(Br)cc1 Amb25816633 [0,2,0,0,0,0|2,0,0]=4 7101 B12R1.385 CCSCc1cc(F)c(N)cc1 Amb25756840 [0,2,0,0,0,0|2,0,0]=4 7102 B12R1.385 CCSCc1cc(N)c(Br)cc1 Amb25104286 [0,2,0,0,0,0|2,0,0]=4 7103 B12R1.385 CN1C=C(CCCN)C=CC1=O Amb18862670 [0,2,0,0,0,0|2,0,0]=4 7104 B12R1.385 CN1C=CC(=CC1=O)NCCO Amb25031204 [0,2,0,0,0,0|2,0,0]=4 7105 B12R1.385 CN1C=CC(=CC1=O)SCCO Amb25031196 [0,2,0,0,0,0|2,0,0]=4 7106 B12R1.385 CNCCc1cc(Br)c(Br)cc1 Amb25790141 [0,2,0,0,0,0|2,0,0]=4 7107 B12R1.385 CNCCc1cc(F)c(F)cc1 Amb18301397 [0,2,0,0,0,0|2,0,0]=4 7108 B12R1.385 CNCCc1ccc(F)c(Br)c1 Amb18299502 [0,2,0,0,0,0|2,0,0]=4 7109 B12R1.385 CNCCc1ccc(F)c(Cl)c1 Amb18893772 [0,2,0,0,0,0|2,0,0]=4 7110 B12R1.385 CNCCc1ccc(O)c(N)c1 Amb24537731 [0,2,0,0,0,0|2,0,0]=4 7111 B12R1.385 CNCCc1ccc(c(c1)C)C Amb17085511 [0,2,0,0,0,0|2,0,0]=4 7112 B12R1.385 CNCCc1ccc(c(c1)C)F Amb17400235 [0,2,0,0,0,0|2,0,0]=4 7113 B12R1.385 CNCCc1ccc(c(c1)Cl)Cl Amb17193869 [0,2,0,0,0,0|2,0,0]=4 7114 B12R1.385 CNCCc1ccc(c(c1)O)O Amb10844789 [0,2,0,0,0,0|2,0,0]=4 7115 B12R1.385 COCCc1ccc(O)c(Br)c1 Amb25767182 [0,2,0,0,0,0|2,0,0]=4 7116 B12R1.385 COCCc1ccc(O)c(I)c1 Amb25372254 [0,2,0,0,0,0|2,0,0]=4 7117 B12R1.385 COCCc1ccc(O)c(N)c1 Amb18989727 [0,2,0,0,0,0|2,0,0]=4 7118 B12R1.385 CSCCc1cc(F)c(F)cc1 Amb24476373 [0,2,0,0,0,0|2,0,0]=4 7119 B12R1.385 CSCCc1cc(O)c(O)cc1 Amb18648967 [0,2,0,0,0,0|2,0,0]=4 7120 B12R1.385 CSCCc1ccc(Br)c(F)c1 Amb24525633 [0,2,0,0,0,0|2,0,0]=4 7121 B12R1.385 Cc1[n]c(ccc1Br)OCCO Amb24746555 [0,2,0,0,0,0|2,0,0]=4 7122 B12R1.385 Cc1[n]c(ccc1Br)SCCO Amb24453711 [0,2,0,0,0,0|2,0,0]=4 7123 B12R1.385 Cc1[n]c(ccc1N)OCCO Amb25793927 [0,2,0,0,0,0|2,0,0]=4 7124 B12R1.385 Cc1[n]cc(CCCN)cc1Cl Amb25715361 [0,2,0,0,0,0|2,0,0]=4 7125 B12R1.385 Cc1[n]cc(CCCO)cc1O Amb18646741 [0,2,0,0,0,0|1,0,0]=3 7126 B12R1.385 Cc1c[n]c(CCCN)cc1Cl Amb25303923 [0,2,0,0,0,0|2,0,0]=4 7127 B12R1.385 Cc1cc(CCC#N)ccc1Cl Amb24353066 [0,2,0,0,0,0|1,0,1]=4 7128 B12R1.385 Cc1cc(CCC#N)ccc1F Amb18862582 [0,2,0,0,0,0|1,0,1]=4 7129 B12R1.385 Cc1cc(CCC#N)ccc1N Amb25217806 [0,2,0,0,0,0|1,0,1]=4 7130 B12R1.385 Cc1cc(CCC#N)ccc1O Amb20621623 [0,2,0,0,0,0|1,0,1]=4 7131 B12R1.385 Cc1cc(CCC=C)ccc1F Amb25064356 [0,2,0,0,0,0|1,0,1]=4 7132 B12R1.385 Cc1cc(CCC=O)ccc1Br Amb18070236 [0,2,0,0,0,0|0,0,2]=4 7133 B12R1.385 Cc1cc(CCC=O)ccc1C Amb18798124 [0,2,0,0,0,0|0,0,2]=4 7134 B12R1.385 Cc1cc(CCC=O)ccc1F Amb25682112 [0,2,0,0,0,0|0,0,2]=4 7135 B12R1.385 Cc1cc(CCC=O)ccc1I Amb24603486 [0,2,0,0,0,0|0,0,2]=4 7136 B12R1.385 Cc1cc(CCC=O)ccc1O Amb25838807 [0,2,0,0,0,0|0,0,2]=4 7137 B12R1.385 Cc1cc(CCCBr)ccc1C Amb24488677 [0,2,0,0,0,0|1,0,0]=3 7138 B12R1.385 Cc1cc(CCCBr)ccc1O Amb24527963 [0,2,0,0,0,0|1,0,0]=3 7139 B12R1.385 Cc1cc(CCCC)[n]cc1N Amb24390699 [0,2,0,0,0,0|2,0,0]=4 7140 B12R1.385 Cc1cc(CCCC)ccc1O Amb24403254 [0,2,0,0,0,0|1,0,0]=3 7141 B12R1.385 Cc1cc(CCCCl)ccc1Br Amb24566578 [0,2,0,0,0,0|1,0,0]=3 7142 B12R1.385 Cc1cc(CCCCl)ccc1C Amb18325208 [0,2,0,0,0,0|1,0,0]=3 7143 B12R1.385 Cc1cc(CCCCl)ccc1F Amb25841123 [0,2,0,0,0,0|1,0,0]=3 7144 B12R1.385 Cc1cc(CCCCl)ccc1I Amb24605295 [0,2,0,0,0,0|1,0,0]=3 7145 B12R1.385 Cc1cc(CCCCl)ccc1O Amb24637062 [0,2,0,0,0,0|1,0,0]=3 7146 B12R1.385 Cc1cc(CCCCl)ccc1S Amb25217669 [0,2,0,0,0,0|1,0,0]=3 7147 B12R1.385 Cc1cc(CCCN)c[n]c1C Amb25100359 [0,2,0,0,0,0|2,0,0]=4 7148 B12R1.385 Cc1cc(CCCN)c[n]c1Cl Amb24520597 [0,2,0,0,0,0|2,0,0]=4 7149 B12R1.385 Cc1cc(CCCN)c[n]c1F Amb24404985 [0,2,0,0,0,0|2,0,0]=4 7150 B12R1.385 Cc1cc(CCCN)ccc1Cl Amb18554358 [0,2,0,0,0,0|1,0,0]=3 7151 B12R1.385 Cc1cc(CCCO)c[n]c1C Amb25770809 [0,2,0,0,0,0|1,0,0]=3 7152 B12R1.385 Cc1cc(CCCO)ccc1Cl Amb24465130 [0,2,0,0,0,0|0,0,0]=2 7153 B12R1.385 Cc1cc(CCCO)ccc1F Amb18862775 [0,2,0,0,0,0|0,0,0]=2 7154 B12R1.385 Cc1cc(CCCO)ccc1O Amb24624666 [0,2,0,0,0,0|0,0,0]=2 7155 B12R1.385 Cc1cc(CCCS)ccc1C Amb25198296 [0,2,0,0,0,0|0,1,0]=3 7156 B12R1.385 Cc1cc(CCNC)ccc1Br Amb18942021 [0,2,0,0,0,0|2,0,0]=4 7157 B12R1.385 Cc1cc(CCNC)ccc1Cl Amb18552721 [0,2,0,0,0,0|2,0,0]=4 7158 B12R1.385 Cc1cc(CCNC)ccc1O Amb24385303 [0,2,0,0,0,0|2,0,0]=4 7159 B12R1.385 Cc1cc(CNCC)ccc1Br Amb18277184 [0,2,0,0,0,0|2,0,0]=4 7160 B12R1.385 Cc1cc(CNCC)ccc1Cl Amb18939964 [0,2,0,0,0,0|2,0,0]=4 7161 B12R1.385 Cc1cc(CNCC)ccc1N Amb18972386 [0,2,0,0,0,0|2,0,0]=4 7162 B12R1.385 Cc1cc(NCCO)[n]cc1Br Amb21958720 [0,2,0,0,0,0|2,0,0]=4 7163 B12R1.385 Cc1cc(NCCO)ncc1N Amb17213742 [0,2,0,0,0,0|2,0,0]=4 7164 B12R1.385 Cc1cc([n]cc1Br)OCCO Amb25779768 [0,2,0,0,0,0|2,0,0]=4 7165 B12R1.385 Cc1cc([n]cc1N)OCCO Amb24668511 [0,2,0,0,0,0|2,0,0]=4 7166 B12R1.385 Cc1cc(\C=C\CO)ccc1Br Amb25133361 [0,2,0,0,0,0|0,0,2]=4 7167 B12R1.385 Cc1cc(ccc1Br)OCCBr Amb24749067 [0,2,0,0,0,0|2,0,0]=4 7168 B12R1.385 Cc1cc(ccc1Br)OCCC Amb22001434 [0,2,0,0,0,0|2,0,0]=4 7169 B12R1.385 Cc1cc(ccc1Br)OCCF Amb25136415 [0,2,0,0,0,0|2,0,0]=4 7170 B12R1.385 Cc1cc(ccc1Br)OCCO Amb24493152 [0,2,0,0,0,0|1,0,0]=3 7171 B12R1.385 Cc1cc(ccc1Br)OCCS Amb25058697 [0,2,0,0,0,0|1,1,0]=4 7172 B12R1.385 Cc1cc(ccc1Br)SCCN Amb24354309 [0,2,0,0,0,0|2,0,0]=4 7173 B12R1.385 Cc1cc(ccc1C)C#CCO Amb18792229 [0,2,0,0,0,0|0,0,2]=4 7174 B12R1.385 Cc1cc(ccc1C)SCCF Amb25160818 [0,2,0,0,0,0|2,0,0]=4 7175 B12R1.385 Cc1cc(ccc1C)SCCS Amb24532624 [0,2,0,0,0,0|1,1,0]=4 7176 B12R1.385 Cc1cc(ccc1Cl)C#CCO Amb25715888 [0,2,0,0,0,0|0,0,2]=4 7177 B12R1.385 Cc1cc(ccc1F)C#CCO Amb18792547 [0,2,0,0,0,0|0,0,2]=4 7178 B12R1.385 Cc1cc(ccc1F)NCCC Amb18792942 [0,2,0,0,0,0|2,0,0]=4 7179 B12R1.385 Cc1cc(ccc1F)NCCF Amb25738928 [0,2,0,0,0,0|2,0,0]=4 7180 B12R1.385 Cc1cc(ccc1F)NCCN Amb18299162 [0,2,0,0,0,0|2,0,0]=4 7181 B12R1.385 Cc1cc(ccc1F)NCCO Amb18301456 [0,2,0,0,0,0|1,0,0]=3 7182 B12R1.385 Cc1cc(ccc1F)OCCF Amb24683532 [0,2,0,0,0,0|2,0,0]=4 7183 B12R1.385 Cc1cc(ccc1F)OCCN Amb18893580 [0,2,0,0,0,0|2,0,0]=4 7184 B12R1.385 Cc1cc(ccc1F)OCCS Amb25722565 [0,2,0,0,0,0|1,1,0]=4 7185 B12R1.385 Cc1cc(ccc1N)NCCF Amb24375199 [0,2,0,0,0,0|2,0,0]=4 7186 B12R1.385 Cc1cc(ccc1N)NCCN Amb18298683 [0,2,0,0,0,0|2,0,0]=4 7187 B12R1.385 Cc1cc(ccc1N)OCCF Amb23579996 [0,2,0,0,0,0|2,0,0]=4 7188 B12R1.385 Cc1cc(ccc1N)OCCN Amb18908681 [0,2,0,0,0,0|2,0,0]=4 7189 B12R1.385 Cc1cc(ccc1N)SCCF Amb25827423 [0,2,0,0,0,0|2,0,0]=4 7190 B12R1.385 Cc1cc(ccc1N)SCCN Amb24627532 [0,2,0,0,0,0|2,0,0]=4 7191 B12R1.385 Cc1cc(ccc1O)OCCC Amb18055364 [0,2,0,0,0,0|2,0,0]=4 7192 B12R1.385 Cc1ccc(CCC#N)cc1N Amb25675571 [0,2,0,0,0,0|1,0,1]=4 7193 B12R1.385 Cc1ccc(CCC#N)cc1S Amb25247589 [0,2,0,0,0,0|1,0,1]=4 7194 B12R1.385 Cc1ccc(CCC=C)cc1Cl Amb24426879 [0,2,0,0,0,0|1,0,1]=4 7195 B12R1.385 Cc1ccc(CCC=C)cc1F Amb25113932 [0,2,0,0,0,0|1,0,1]=4 7196 B12R1.385 Cc1ccc(CCC=O)cc1Br Amb18069967 [0,2,0,0,0,0|0,0,2]=4 7197 B12R1.385 Cc1ccc(CCC=O)cc1Cl Amb18564229 [0,2,0,0,0,0|0,0,2]=4 7198 B12R1.385 Cc1ccc(CCC=O)cc1F Amb24093026 [0,2,0,0,0,0|0,0,2]=4 7199 B12R1.385 Cc1ccc(CCC=O)cc1I Amb25118646 [0,2,0,0,0,0|0,0,2]=4 7200 B12R1.385 Cc1ccc(CCCBr)cc1Br Amb24339560 [0,2,0,0,0,0|1,0,0]=3 7201 B12R1.385 Cc1ccc(CCCBr)cc1Cl Amb25130714 [0,2,0,0,0,0|1,0,0]=3 7202 B12R1.385 Cc1ccc(CCCBr)cc1I Amb25207303 [0,2,0,0,0,0|1,0,0]=3 7203 B12R1.385 Cc1ccc(CCCC)cc1N Amb24071080 [0,2,0,0,0,0|1,0,0]=3 7204 B12R1.385 Cc1ccc(CCCCl)cc1Cl Amb24720204 [0,2,0,0,0,0|1,0,0]=3 7205 B12R1.385 Cc1ccc(CCCCl)cc1F Amb25152290 [0,2,0,0,0,0|1,0,0]=3 7206 B12R1.385 Cc1ccc(CCCN)[n]c1Cl Amb24623106 [0,2,0,0,0,0|2,0,0]=4 7207 B12R1.385 Cc1ccc(CCCN)cc1F Amb22395115 [0,2,0,0,0,0|1,0,0]=3 7208 B12R1.385 Cc1ccc(CCCN)cc1N Amb25269801 [0,2,0,0,0,0|1,0,0]=3 7209 B12R1.385 Cc1ccc(CCCN)cc1O Amb25159897 [0,2,0,0,0,0|1,0,0]=3 7210 B12R1.385 Cc1ccc(CCCO)cc1Br Amb24664258 [0,2,0,0,0,0|0,0,0]=2 7211 B12R1.385 Cc1ccc(CCCO)cc1F Amb25265576 [0,2,0,0,0,0|0,0,0]=2 7212 B12R1.385 Cc1ccc(CCNC)cc1F Amb25721680 [0,2,0,0,0,0|2,0,0]=4 7213 B12R1.385 Cc1ccc(CCNN)cc1Br Amb25755790 [0,2,0,0,0,0|2,0,0]=4 7214 B12R1.385 Cc1ccc(CNCC)cc1Br Amb25836455 [0,2,0,0,0,0|2,0,0]=4 7215 B12R1.385 Cc1ccc(CNCC)cc1Cl Amb25117386 [0,2,0,0,0,0|2,0,0]=4 7216 B12R1.385 Cc1ccc(CNCC)cc1N Amb18972385 [0,2,0,0,0,0|2,0,0]=4 7217 B12R1.385 Cc1ccc(COCC)cc1O Amb24380787 [0,2,0,0,0,0|2,0,0]=4 7218 B12R1.385 Cc1ccc(CSCC)cc1Br Amb25031134 [0,2,0,0,0,0|2,0,0]=4 7219 B12R1.385 Cc1ccc(\C=C\CO)cc1Br Amb25331292 [0,2,0,0,0,0|0,0,2]=4 7220 B12R1.385 Cc1ccc(cc1Br)NCCF Amb25859409 [0,2,0,0,0,0|2,0,0]=4 7221 B12R1.385 Cc1ccc(cc1Br)OCCF Amb25279224 [0,2,0,0,0,0|2,0,0]=4 7222 B12R1.385 Cc1ccc(cc1Br)OCCO Amb24738236 [0,2,0,0,0,0|1,0,0]=3 7223 B12R1.385 Cc1ccc(cc1Br)OCCS Amb24615125 [0,2,0,0,0,0|1,1,0]=4 7224 B12R1.385 Cc1ccc(cc1Cl)C#CCO Amb25251769 [0,2,0,0,0,0|0,0,2]=4 7225 B12R1.385 Cc1ccc(cc1Cl)OCCN Amb23441775 [0,2,0,0,0,0|2,0,0]=4 7226 B12R1.385 Cc1ccc(cc1F)NCCF Amb25082185 [0,2,0,0,0,0|2,0,0]=4 7227 B12R1.385 Cc1ccc(cc1F)NCCN Amb18251976 [0,2,0,0,0,0|2,0,0]=4 7228 B12R1.385 Cc1ccc(cc1F)OCCBr Amb24358276 [0,2,0,0,0,0|2,0,0]=4 7229 B12R1.385 Cc1ccc(cc1F)OCCN Amb24341985 [0,2,0,0,0,0|2,0,0]=4 7230 B12R1.385 Cc1ccc(cc1F)OCCO Amb25156896 [0,2,0,0,0,0|1,0,0]=3 7231 B12R1.385 Cc1ccc(cc1I)NCCF Amb24531465 [0,2,0,0,0,0|2,0,0]=4 7232 B12R1.385 Cc1ccc(cc1I)NCCN Amb25757086 [0,2,0,0,0,0|2,0,0]=4 7233 B12R1.385 Cc1ccc(cc1N)NCCC Amb18302069 [0,2,0,0,0,0|2,0,0]=4 7234 B12R1.385 Cc1ccc(cc1N)NCCF Amb25669796 [0,2,0,0,0,0|2,0,0]=4 7235 B12R1.385 Cc1ccc(cc1N)NCCN Amb18999842 [0,2,0,0,0,0|2,0,0]=4 7236 B12R1.385 Cc1ccc(cc1N)NCCO Amb18999456 [0,2,0,0,0,0|1,0,0]=3 7237 B12R1.385 Cc1ccc(cc1N)OCCF Amb25188189 [0,2,0,0,0,0|2,0,0]=4 7238 B12R1.385 Cc1ccc(cc1N)OCCO Amb25805340 [0,2,0,0,0,0|1,0,0]=3 7239 B12R1.385 Cc1ccc(cc1N)SCCC Amb18791356 [0,2,0,0,0,0|2,0,0]=4 7240 B12R1.385 Cc1ccc(cc1N)SCCO Amb18302073 [0,2,0,0,0,0|1,0,0]=3 7241 B12R1.385 Cc1ccc(cc1O)NCCN Amb25755404 [0,2,0,0,0,0|2,0,0]=4 7242 B12R1.385 Cc1ccc(cc1O)OCCC Amb23568451 [0,2,0,0,0,0|2,0,0]=4 7243 B12R1.385 Cc1nc(NCCO)ccc1N Amb17213811 [0,2,0,0,0,0|2,0,0]=4 7244 B12R1.385 ClCCCc1ccc(Br)c(I)c1 Amb24651203 [0,2,0,0,0,0|1,0,0]=3 7245 B12R1.385 ClCCCc1ccc(c(c1)Cl)Cl Amb17477749 [0,2,0,0,0,0|1,0,0]=3 7246 B12R1.385 ClCCCc1ccc(c(c1)N)Cl Amb17477718 [0,2,0,0,0,0|1,0,0]=3 7247 B12R1.385 ClCCCc1ccc(c(c1)N)O Amb17477706 [0,2,0,0,0,0|1,0,0]=3 7248 B12R1.385 ClCCNc1ccc(c(c1)Br)C Amb17351914 [0,2,0,0,0,0|2,0,0]=4 7249 B12R1.385 ClCCNc1ccc(c(c1)C)Br Amb17351917 [0,2,0,0,0,0|2,0,0]=4 7250 B12R1.385 ClCCNc1ccc(c(c1)C)C Amb17335663 [0,2,0,0,0,0|2,0,0]=4 7251 B12R1.385 ClCCNc1ccc(c(c1)Cl)C Amb17338054 [0,2,0,0,0,0|2,0,0]=4 7252 B12R1.385 ClCCNc1ccc(c(c1)Cl)Cl Amb17343162 [0,2,0,0,0,0|2,0,0]=4 7253 B12R1.385 ClCCNc1ccc(c(c1)Cl)F Amb17338959 [0,2,0,0,0,0|2,0,0]=4 7254 B12R1.385 ClCCOc1ccc(c(c1)Cl)Cl Amb17247124 [0,2,0,0,0,0|2,0,0]=4 7255 B12R1.385 Clc1cc(CCCCl)ccc1I Amb24591038 [0,2,0,0,0,0|1,0,0]=3 7256 B12R1.385 Clc1cc(ccc1Br)OCCBr Amb24339406 [0,2,0,0,0,0|2,0,0]=4 7257 B12R1.385 Clc1cc(ccc1Br)OCCCl Amb24741085 [0,2,0,0,0,0|2,0,0]=4 7258 B12R1.385 Clc1ccc(CCCBr)cc1I Amb25376283 [0,2,0,0,0,0|1,0,0]=3 7259 B12R1.385 Clc1ccc(CC[Mg]Br)cc1Cl Amb22000599 [0,2,0,0,0,0|2,0,0]=4 7260 B12R1.385 Clc1ccc(CC[Zn]Br)cc1Cl Amb22000519 [0,2,0,0,0,0|2,0,0]=4 7261 B12R1.385 FCCNc1cc(Br)c(Cl)cc1 Amb25297749 [0,2,0,0,0,0|2,0,0]=4 7262 B12R1.385 FCCNc1cc(F)c(F)cc1 Amb25726274 [0,2,0,0,0,0|2,0,0]=4 7263 B12R1.385 FCCOc1cc(Br)c(I)cc1 Amb24498037 [0,2,0,0,0,0|2,0,0]=4 7264 B12R1.385 FCCOc1cc(Cl)c(Br)cc1 Amb24339421 [0,2,0,0,0,0|2,0,0]=4 7265 B12R1.385 Fc1cc(CCCBr)ccc1Cl Amb25046816 [0,2,0,0,0,0|1,0,0]=3 7266 B12R1.385 Fc1cc(CCCCl)ccc1Br Amb25351929 [0,2,0,0,0,0|1,0,0]=3 7267 B12R1.385 Fc1cc(CCCCl)ccc1Cl Amb24468477 [0,2,0,0,0,0|1,0,0]=3 7268 B12R1.385 Fc1cc(CCCCl)ccc1I Amb24598653 [0,2,0,0,0,0|1,0,0]=3 7269 B12R1.385 Fc1cc(ccc1Br)NCCF Amb25086182 [0,2,0,0,0,0|2,0,0]=4 7270 B12R1.385 Fc1cc(ccc1Cl)OCCBr Amb25244280 [0,2,0,0,0,0|2,0,0]=4 7271 B12R1.385 Fc1cc(ccc1Cl)OCCCl Amb25820212 [0,2,0,0,0,0|2,0,0]=4 7272 B12R1.385 Fc1cc(ccc1F)SCCS Amb25285175 [0,2,0,0,0,0|1,1,0]=4 7273 B12R1.385 Fc1ccc(CCCBr)cc1Br Amb25699797 [0,2,0,0,0,0|1,0,0]=3 7274 B12R1.385 Fc1ccc(CCCBr)cc1Cl Amb24638891 [0,2,0,0,0,0|1,0,0]=3 7275 B12R1.385 Fc1ccc(CCCBr)cc1S Amb25209552 [0,2,0,0,0,0|1,0,0]=3 7276 B12R1.385 Fc1ccc(CCCCl)cc1Br Amb24389703 [0,2,0,0,0,0|1,0,0]=3 7277 B12R1.385 Fc1ccc(CCCCl)cc1S Amb24640781 [0,2,0,0,0,0|1,0,0]=3 7278 B12R1.385 Fc1ccc(cc1Br)OCCCl Amb25104456 [0,2,0,0,0,0|2,0,0]=4 7279 B12R1.385 Fc1ccc(cc1Cl)NCCF Amb25156652 [0,2,0,0,0,0|2,0,0]=4 7280 B12R1.385 Fc1ccc(cc1Cl)OCCCl Amb24361601 [0,2,0,0,0,0|2,0,0]=4 7281 B12R1.385 Fc1ccc(cc1Cl)OCCF Amb24495913 [0,2,0,0,0,0|2,0,0]=4 7282 B12R1.385 Fc1ccc(cc1Cl)OCCS Amb25234561 [0,2,0,0,0,0|1,1,0]=4 7283 B12R1.385 Fc1ccc(cc1Cl)SCCF Amb24497847 [0,2,0,0,0,0|2,0,0]=4 7284 B12R1.385 N#CCCc1cc(I)c(I)cc1 Amb25253155 [0,2,0,0,0,0|1,0,1]=4 7285 B12R1.385 N#CCCc1cc(O)c(O)cc1 Amb25824607 [0,2,0,0,0,0|1,0,1]=4 7286 B12R1.385 N#CCCc1ccc(Br)c(Cl)c1 Amb24656440 [0,2,0,0,0,0|1,0,1]=4 7287 B12R1.385 N#CCCc1ccc(Cl)c(O)c1 Amb25363528 [0,2,0,0,0,0|1,0,1]=4 7288 B12R1.385 N#CCCc1ccc(Cl)c(S)c1 Amb24578939 [0,2,0,0,0,0|1,0,1]=4 7289 B12R1.385 N#CCCc1ccc(F)c(I)c1 Amb24611581 [0,2,0,0,0,0|1,0,1]=4 7290 B12R1.385 N#CCCc1ccc(I)c(F)c1 Amb24572856 [0,2,0,0,0,0|1,0,1]=4 7291 B12R1.385 N#CCCc1ccc(O)c(F)c1 Amb24656436 [0,2,0,0,0,0|1,0,1]=4 7292 B12R1.385 N#CCCc1ccc(S)c(F)c1 Amb25230141 [0,2,0,0,0,0|1,0,1]=4 7293 B12R1.385 N#CCCc1ccc(c(c1)Br)C Amb17204516 [0,2,0,0,0,0|1,0,1]=4 7294 B12R1.385 N#CCCc1ccc(c(c1)C)Br Amb17204519 [0,2,0,0,0,0|1,0,1]=4 7295 B12R1.385 N#CCCc1ccc(c(c1)C)C Amb17204302 [0,2,0,0,0,0|1,0,1]=4 7296 B12R1.385 N#CCCc1ccc(c(c1)Cl)C Amb17204325 [0,2,0,0,0,0|1,0,1]=4 7297 B12R1.385 N#CCCc1ccc(c(c1)Cl)Cl Amb17204384 [0,2,0,0,0,0|1,0,1]=4 7298 B12R1.385 N#CCCc1ccc(c(c1)Cl)F Amb17204333 [0,2,0,0,0,0|1,0,1]=4 7299 B12R1.385 N#CCCc1ccc(c(c1)Cl)O Amb17509041 [0,2,0,0,0,0|1,0,1]=4 7300 B12R1.385 N#CCCc1ccc(c(c1)F)F Amb17204311 [0,2,0,0,0,0|1,0,1]=4 7301 B12R1.385 NC1=CN(CCCO)C=CC1=O Amb25141259 [0,2,0,0,0,0|1,0,0]=3 7302 B12R1.385 NCCCC1=CC(=O)C(O)=CO1 Amb24485638 [0,2,0,0,0,0|2,0,0]=4 7303 B12R1.385 NCCCc1c[n]c(Cl)c(F)c1 Amb24367908 [0,2,0,0,0,0|2,0,0]=4 7304 B12R1.385 NCCCc1c[n]c(Cl)c(O)c1 Amb24493081 [0,2,0,0,0,0|2,0,0]=4 7305 B12R1.385 NCCCc1c[n]c(F)c(Cl)c1 Amb24493022 [0,2,0,0,0,0|2,0,0]=4 7306 B12R1.385 NCCCc1c[n]c(O)c(Cl)c1 Amb24405013 [0,2,0,0,0,0|2,0,0]=4 7307 B12R1.385 NCCCc1cc(Cl)c(F)c[n]1 Amb24367666 [0,2,0,0,0,0|2,0,0]=4 7308 B12R1.385 NCCCc1cc(Cl)c(O)c[n]1 Amb25251778 [0,2,0,0,0,0|2,0,0]=4 7309 B12R1.385 NCCCc1cc(O)c(O)cc1 Amb18827195 [0,2,0,0,0,0|1,0,0]=3 7310 B12R1.385 NCCCc1cc(O)c(O)cc1 Amb19516002 [0,2,0,0,0,0|1,0,0]=3 7311 B12R1.385 NCCCc1ccc(Br)c(Cl)c1 Amb25127779 [0,2,0,0,0,0|1,0,0]=3 7312 B12R1.385 NCCCc1ccc(Cl)c(Br)c1 Amb25331909 [0,2,0,0,0,0|1,0,0]=3 7313 B12R1.385 NCCCc1ccc(Cl)c(F)[n]1 Amb25347571 [0,2,0,0,0,0|2,0,0]=4 7314 B12R1.385 NCCCc1ccc(Cl)c(F)c1 Amb18821280 [0,2,0,0,0,0|1,0,0]=3 7315 B12R1.385 NCCCc1ccc(O)c(Br)c1 Amb24483621 [0,2,0,0,0,0|1,0,0]=3 7316 B12R1.385 NCCCc1ccc(c(c1)Br)C Amb17204536 [0,2,0,0,0,0|1,0,0]=3 7317 B12R1.385 NCCCc1ccc(c(c1)C)Br Amb17204539 [0,2,0,0,0,0|1,0,0]=3 7318 B12R1.385 NCCCc1ccc(c(c1)C)F Amb17232643 [0,2,0,0,0,0|1,0,0]=3 7319 B12R1.385 NCCCc1ccc(c(c1)Cl)C Amb17204338 [0,2,0,0,0,0|1,0,0]=3 7320 B12R1.385 NCCCc1ccc(c(c1)Cl)F Amb17204345 [0,2,0,0,0,0|1,0,0]=3 7321 B12R1.385 NCCCc1ccc(c(c1)Cl)O Amb17509068 [0,2,0,0,0,0|1,0,0]=3 7322 B12R1.385 NCCCc1ccc(c(c1)F)F Amb17204314 [0,2,0,0,0,0|1,0,0]=3 7323 B12R1.385 NCCCc1ccc(c(c1)N)Cl Amb17477697 [0,2,0,0,0,0|1,0,0]=3 7324 B12R1.385 NCCCc1ccc(c(c1)N)O Amb17477692 [0,2,0,0,0,0|1,0,0]=3 7325 B12R1.385 NCCNc1cc(Br)c(Cl)cc1 Amb24414229 [0,2,0,0,0,0|2,0,0]=4 7326 B12R1.385 NCCNc1cc(Br)c(F)cc1 Amb25327051 [0,2,0,0,0,0|2,0,0]=4 7327 B12R1.385 NCCNc1cc(Cl)c(Br)cc1 Amb24416528 [0,2,0,0,0,0|2,0,0]=4 7328 B12R1.385 NCCNc1cc(Cl)c(O)cc1 Amb25094658 [0,2,0,0,0,0|2,0,0]=4 7329 B12R1.385 NCCNc1cc(F)c(Cl)cc1 Amb18909784 [0,2,0,0,0,0|2,0,0]=4 7330 B12R1.385 NCCNc1cc(F)c(O)cc1 Amb25793339 [0,2,0,0,0,0|2,0,0]=4 7331 B12R1.385 NCCNc1cc(I)c(Br)cc1 Amb24408786 [0,2,0,0,0,0|2,0,0]=4 7332 B12R1.385 NCCNc1cc(N)c(N)cc1 Amb24543629 [0,2,0,0,0,0|2,0,0]=4 7333 B12R1.385 NCCNc1ccc(c(c1)Br)C Amb17091063 [0,2,0,0,0,0|2,0,0]=4 7334 B12R1.385 NCCNc1ccc(c(c1)C)Br Amb17091077 [0,2,0,0,0,0|2,0,0]=4 7335 B12R1.385 NCCNc1ccc(c(c1)C)C Amb17091052 [0,2,0,0,0,0|2,0,0]=4 7336 B12R1.385 NCCNc1ccc(c(c1)Cl)C Amb17091060 [0,2,0,0,0,0|2,0,0]=4 7337 B12R1.385 NCCNc1ccc(c(c1)Cl)Cl Amb17091080 [0,2,0,0,0,0|2,0,0]=4 7338 B12R1.385 NCCNc1ccc(c(c1)Cl)F Amb17057760 [0,2,0,0,0,0|2,0,0]=4 7339 B12R1.385 NCCNc1ccc(c(c1)F)F Amb17057762 [0,2,0,0,0,0|2,0,0]=4 7340 B12R1.385 NCCOc1cc(Br)c(Cl)cc1 Amb25251177 [0,2,0,0,0,0|2,0,0]=4 7341 B12R1.385 NCCOc1cc(Br)c(F)cc1 Amb24385803 [0,2,0,0,0,0|2,0,0]=4 7342 B12R1.385 NCCOc1cc(Cl)c(Cl)cc1 Amb21959595 [0,2,0,0,0,0|2,0,0]=4 7343 B12R1.385 NCCOc1cc(F)c(Cl)cc1 Amb25327059 [0,2,0,0,0,0|2,0,0]=4 7344 B12R1.385 NCCOc1cc(F)c(F)cc1 Amb19345444 [0,2,0,0,0,0|2,0,0]=4 7345 B12R1.385 NCCOc1cc(O)c(Cl)cc1 Amb25101621 [0,2,0,0,0,0|2,0,0]=4 7346 B12R1.385 NCCOc1ccc(c(c1)C)Cl Amb1090468 [0,2,0,0,0,0|2,0,0]=4 7347 B12R1.385 NCCOc1ccc(c(c1)Cl)F Amb2198114 [0,2,0,0,0,0|2,0,0]=4 7348 B12R1.385 NCCSc1ccc(c(c1)C)C Amb1105388 [0,2,0,0,0,0|2,0,0]=4 7349 B12R1.385 NCCSc1ccc(c(c1)C)Cl Amb17083044 [0,2,0,0,0,0|2,0,0]=4 7350 B12R1.385 NCCSc1ccc(c(c1)C)F Amb17083028 [0,2,0,0,0,0|2,0,0]=4 7351 B12R1.385 NCCSc1ccc(c(c1)Cl)Cl Amb17083030 [0,2,0,0,0,0|2,0,0]=4 7352 B12R1.385 NNCCc1cc(Cl)c(Cl)cc1 Amb19887584 [0,2,0,0,0,0|2,0,0]=4 7353 B12R1.385 NNCCc1ccc(F)c(Br)c1 Amb24555901 [0,2,0,0,0,0|2,0,0]=4 7354 B12R1.385 NNCCc1ccc(F)c(Cl)c1 Amb25062951 [0,2,0,0,0,0|2,0,0]=4 7355 B12R1.385 NNCCc1ccc(c(c1)C)C Amb17400166 [0,2,0,0,0,0|2,0,0]=4 7356 B12R1.385 NNCCc1ccc(c(c1)C)F Amb17400254 [0,2,0,0,0,0|2,0,0]=4 7357 B12R1.385 NNCCc1ccc(c(c1)Cl)Cl Amb17402984 [0,2,0,0,0,0|2,0,0]=4 7358 B12R1.385 NNCCc1ccc(c(c1)F)F Amb17400364 [0,2,0,0,0,0|2,0,0]=4 7359 B12R1.385 NOCCc1cc(Cl)c(Cl)cc1 Amb24733703 [0,2,0,0,0,0|2,0,0]=4 7360 B12R1.385 NOCCc1cc(F)c(F)cc1 Amb24497429 [0,2,0,0,0,0|2,0,0]=4 7361 B12R1.385 Nc1cc(CCC#N)ccc1Cl Amb25848481 [0,2,0,0,0,0|1,0,1]=4 7362 B12R1.385 Nc1cc(CCC#N)ccc1F Amb24747181 [0,2,0,0,0,0|1,0,1]=4 7363 B12R1.385 Nc1cc(CCC=O)ccc1Cl Amb24759207 [0,2,0,0,0,0|0,0,2]=4 7364 B12R1.385 Nc1cc(CCCBr)ccc1N Amb24537158 [0,2,0,0,0,0|1,0,0]=3 7365 B12R1.385 Nc1cc(CCCBr)ccc1O Amb25208684 [0,2,0,0,0,0|1,0,0]=3 7366 B12R1.385 Nc1cc(CCCCl)ccc1S Amb24707954 [0,2,0,0,0,0|1,0,0]=3 7367 B12R1.385 Nc1cc(ccc1Cl)OCCCl Amb25803611 [0,2,0,0,0,0|2,0,0]=4 7368 B12R1.385 Nc1cc(ccc1F)OCCCl Amb24693887 [0,2,0,0,0,0|2,0,0]=4 7369 B12R1.385 Nc1cc(ccc1N)NCCO Amb24468320 [0,2,0,0,0,0|1,0,0]=3 7370 B12R1.385 Nc1ccc(CCC=O)cc1O Amb24536884 [0,2,0,0,0,0|0,0,2]=4 7371 B12R1.385 Nc1ccc(CCCBr)cc1F Amb24549379 [0,2,0,0,0,0|1,0,0]=3 7372 B12R1.385 Nc1ccc(CCCBr)cc1S Amb25217656 [0,2,0,0,0,0|1,0,0]=3 7373 B12R1.385 Nc1ccc(CCCCl)cc1Cl Amb24697078 [0,2,0,0,0,0|1,0,0]=3 7374 B12R1.385 Nc1ccc(CCCCl)cc1S Amb25275606 [0,2,0,0,0,0|1,0,0]=3 7375 B12R1.385 Nc1ccc([n]c1N)OCCO Amb25378486 [0,2,0,0,0,0|2,0,0]=4 7376 B12R1.385 Nc1ccc(cc1Cl)OCCO Amb18295590 [0,2,0,0,0,0|1,0,0]=3 7377 B12R1.385 Nc1ccc(cc1Cl)SCCF Amb25075487 [0,2,0,0,0,0|2,0,0]=4 7378 B12R1.385 Nc1ccc(cc1Cl)SCCN Amb25303044 [0,2,0,0,0,0|2,0,0]=4 7379 B12R1.385 Nc1ccc(cc1F)OCCF Amb25338875 [0,2,0,0,0,0|2,0,0]=4 7380 B12R1.385 Nc1ccc(cc1F)OCCO Amb18980930 [0,2,0,0,0,0|1,0,0]=3 7381 B12R1.385 Nc1ccc(cc1F)SCCN Amb24356894 [0,2,0,0,0,0|2,0,0]=4 7382 B12R1.385 O=CCCc1cc(Br)c(Br)cc1 Amb25301219 [0,2,0,0,0,0|0,0,2]=4 7383 B12R1.385 O=CCCc1cc(Cl)c(Cl)cc1 Amb24093018 [0,2,0,0,0,0|0,0,2]=4 7384 B12R1.385 O=CCCc1cc(F)c(F)cc1 Amb18563918 [0,2,0,0,0,0|0,0,2]=4 7385 B12R1.385 O=CCCc1ccc(Br)c(F)c1 Amb25733243 [0,2,0,0,0,0|0,0,2]=4 7386 B12R1.385 O=CCCc1ccc(Br)c(I)c1 Amb25301482 [0,2,0,0,0,0|0,0,2]=4 7387 B12R1.385 O=CCCc1ccc(Cl)c(Br)c1 Amb24382161 [0,2,0,0,0,0|0,0,2]=4 7388 B12R1.385 O=CCCc1ccc(Cl)c(F)c1 Amb25836345 [0,2,0,0,0,0|0,0,2]=4 7389 B12R1.385 O=CCCc1ccc(Cl)c(I)c1 Amb25690980 [0,2,0,0,0,0|0,0,2]=4 7390 B12R1.385 O=CCCc1ccc(F)c(Br)c1 Amb24093021 [0,2,0,0,0,0|0,0,2]=4 7391 B12R1.385 O=CCCc1ccc(F)c(Cl)c1 Amb18564403 [0,2,0,0,0,0|0,0,2]=4 7392 B12R1.385 O=CCCc1ccc(I)c(Cl)c1 Amb25268272 [0,2,0,0,0,0|0,0,2]=4 7393 B12R1.385 O=CCCc1ccc(I)c(S)c1 Amb24541086 [0,2,0,0,0,0|0,0,2]=4 7394 B12R1.385 O=CCCc1ccc(S)c(F)c1 Amb24603942 [0,2,0,0,0,0|0,0,2]=4 7395 B12R1.385 OCC#Cc1cc(Cl)c(F)cc1 Amb25308121 [0,2,0,0,0,0|0,0,2]=4 7396 B12R1.385 OCC#Cc1cc(F)c(Cl)cc1 Amb25728405 [0,2,0,0,0,0|0,0,2]=4 7397 B12R1.385 OCC=Cc1cc(Cl)c(Cl)cc1 Amb22488010 [0,2,0,0,0,0|0,0,2]=4 7398 B12R1.385 OCCCc1cc(F)c(F)cc1 Amb18224422 [0,2,0,0,0,0|0,0,0]=2 7399 B12R1.385 OCCCc1ccc(Cl)c(Br)c1 Amb23560508 [0,2,0,0,0,0|0,0,0]=2 7400 B12R1.385 OCCCc1ccc(F)c(Cl)c1 Amb18863384 [0,2,0,0,0,0|0,0,0]=2 7401 B12R1.385 OCCCc1ccc(c(c1)C)C Amb17605788 [0,2,0,0,0,0|0,0,0]=2 7402 B12R1.385 OCCCc1ccc(c(c1)Cl)Cl Amb17402982 [0,2,0,0,0,0|0,0,0]=2 7403 B12R1.385 OCCCc1ccc(c(c1)N)Cl Amb17477707 [0,2,0,0,0,0|0,0,0]=2 7404 B12R1.385 OCCCc1ccc(c(c1)N)O Amb17477699 [0,2,0,0,0,0|0,0,0]=2 7405 B12R1.385 OCCNc1cc(Br)c(I)cc1 Amb25310897 [0,2,0,0,0,0|1,0,0]=3 7406 B12R1.385 OCCNc1cc(F)c(Cl)cc1 Amb18294793 [0,2,0,0,0,0|1,0,0]=3 7407 B12R1.385 OCCNc1ccc(c(c1)Br)C Amb17307023 [0,2,0,0,0,0|1,0,0]=3 7408 B12R1.385 OCCNc1ccc(c(c1)Cl)F Amb17305858 [0,2,0,0,0,0|1,0,0]=3 7409 B12R1.385 OCCOC=1C=CN(O)C(=O)C1 Amb24749808 [0,2,0,0,0,0|2,0,0]=4 7410 B12R1.385 OCCOc1cc(Br)c(I)cc1 Amb25079767 [0,2,0,0,0,0|1,0,0]=3 7411 B12R1.385 OCCOc1cc(F)c(Cl)cc1 Amb24447177 [0,2,0,0,0,0|1,0,0]=3 7412 B12R1.385 OCCOc1cc(O)c(O)cc1 Amb22802397 [0,2,0,0,0,0|1,0,0]=3 7413 B12R1.385 OCCOc1ccc(c(c1)C)Cl Amb2209357 [0,2,0,0,0,0|1,0,0]=3 7414 B12R1.385 OCCOc1ccc(c(c1)Cl)Cl Amb17105031 [0,2,0,0,0,0|1,0,0]=3 7415 B12R1.385 OCCSc1cc(Cl)c(F)cc1 Amb24497956 [0,2,0,0,0,0|1,0,0]=3 7416 B12R1.385 OC\C=C/c1cc(O)c(O)cc1 Amb25271016 [0,2,0,0,0,0|0,0,2]=4 7417 B12R1.385 OC\C=C\C1=CC(=O)C(=O)C=C1 Amb24631190 [0,2,0,0,0,0|0,0,2]=4 7418 B12R1.385 OC\C=C\c1cc(Cl)c(Cl)cc1 Amb23442815 [0,2,0,0,0,0|0,0,2]=4 7419 B12R1.385 OC\C=C\c1cc(F)c(F)cc1 Amb23555608 [0,2,0,0,0,0|0,0,2]=4 7420 B12R1.385 OC\C=C\c1cc(O)c(O)cc1 Amb22583876 [0,2,0,0,0,0|0,0,2]=4 7421 B12R1.385 OC\C=C\c1ccc(Br)c(F)c1 Amb24438785 [0,2,0,0,0,0|0,0,2]=4 7422 B12R1.385 OC\C=C\c1ccc(Cl)c(Br)c1 Amb24452954 [0,2,0,0,0,0|0,0,2]=4 7423 B12R1.385 OC\C=C\c1ccc(Cl)c(F)c1 Amb25710181 [0,2,0,0,0,0|0,0,2]=4 7424 B12R1.385 Oc1cc(CCC=O)ccc1Br Amb24341987 [0,2,0,0,0,0|0,0,2]=4 7425 B12R1.385 Oc1cc(CCC=O)ccc1Cl Amb25806089 [0,2,0,0,0,0|0,0,2]=4 7426 B12R1.385 Oc1cc(CCC=O)ccc1F Amb25360910 [0,2,0,0,0,0|0,0,2]=4 7427 B12R1.385 Oc1cc(CCCBr)ccc1F Amb24640779 [0,2,0,0,0,0|1,0,0]=3 7428 B12R1.385 Oc1cc(CCCBr)ccc1O Amb25323902 [0,2,0,0,0,0|1,0,0]=3 7429 B12R1.385 Oc1cc(CCCCl)ccc1F Amb25209551 [0,2,0,0,0,0|1,0,0]=3 7430 B12R1.385 Oc1cc(CCCCl)ccc1I Amb24527864 [0,2,0,0,0,0|1,0,0]=3 7431 B12R1.385 Oc1ccc(CCC=O)cc1Cl Amb25150852 [0,2,0,0,0,0|0,0,2]=4 7432 B12R1.385 Oc1ccc(CCC=O)cc1I Amb24758933 [0,2,0,0,0,0|0,0,2]=4 7433 B12R1.385 Oc1ccc(CCCBr)cc1I Amb24598660 [0,2,0,0,0,0|1,0,0]=3 7434 B12R1.385 Oc1ccc(CCCBr)cc1S Amb25351801 [0,2,0,0,0,0|1,0,0]=3 7435 B12R1.385 Oc1ccc(CCCCl)cc1Cl Amb24638403 [0,2,0,0,0,0|1,0,0]=3 7436 B12R1.385 Oc1ccc(CCCO)cc1F Amb24378042 [0,2,0,0,0,0|0,0,0]=2 7437 B12R1.385 Oc1ccc(\C=C\CO)cc1Cl Amb18649022 [0,2,0,0,0,0|0,0,2]=4 7438 B12R1.385 Oc1ccc(\C=C\CO)cc1F Amb25274595 [0,2,0,0,0,0|0,0,2]=4 7439 B12R1.385 Oc1ccc(cc1Cl)OCCO Amb18650034 [0,2,0,0,0,0|1,0,0]=3 7440 B12R1.385 SCCOc1ccc(c(c1)C)Cl Amb17237591 [0,2,0,0,0,0|1,1,0]=4 7441 B12R1.385 SCCOc1ccc(c(c1)Cl)Cl Amb17245968 [0,2,0,0,0,0|1,1,0]=4 7442 B12R1.385 SCCOc1ccc(c(c1)F)F Amb17234882 [0,2,0,0,0,0|1,1,0]=4 7443 B12R1.385 SCCSc1cc(Cl)c(Cl)cc1 Amb24577231 [0,2,0,0,0,0|1,1,0]=4 7444 B12R1.385 Sc1cc(CCCCl)ccc1Cl Amb24610892 [0,2,0,0,0,0|1,0,0]=3 7445 B12R1.385 Sc1cc(CCCCl)ccc1S Amb25223374 [0,2,0,0,0,0|1,0,0]=3 7446 B12R1.385 Sc1ccc(CCCCl)cc1Cl Amb24591066 [0,2,0,0,0,0|1,0,0]=3 7447 B12R1.2259 CCCCC1(O)C=CC(=O)C=C1 Amb25116598 [0,2,0,0,0,0|1,0,1]=4 7448 B12R1.2259 OCCCC1(O)C=CC(=O)C=C1 Amb25768457 [0,2,0,0,0,0|0,0,1]=3 7449 B12R1.3 C#CC(CCO)c1ccccc1 Amb25369422 [0,2,0,0,0,0|0,0,0]=2 7450 B12R1.3 C#CC(c1ccccc1)CC#C Amb10072781 [0,2,0,0,0,0|1,0,1]=4 7451 B12R1.3 C#CCC(C=O)c1ccccc1 Amb24741811 [0,2,0,0,0,0|1,0,1]=4 7452 B12R1.3 C=CCC(c1ccccc1)C#N Amb17593937 [0,2,0,0,0,0|1,0,1]=4 7453 B12R1.3 C=C\C(=C\CO)\c1ccccc1 Amb24619165 [0,2,0,0,0,0|0,0,2]=4 7454 B12R1.3 CCCC(=[N+]=[N-])c1ccccc1 Amb24095317 [0,2,0,0,0,0|1,0,1]=4 7455 B12R1.3 CCCC(C#N)c1cc[n]cc1 Amb18645395 [0,2,0,0,0,0|2,0,0]=4 7456 B12R1.3 CCCC(C#N)c1cccc[n]1 Amb18645394 [0,2,0,0,0,0|2,0,0]=4 7457 B12R1.3 CCCC(CN)c1ccccc1 Amb22052580 [0,2,0,0,0,0|1,0,0]=3 7458 B12R1.3 CCCC(NC)c1cccc[n]1 Amb18792590 [0,2,0,0,0,0|2,0,0]=4 7459 B12R1.3 CCCC(c1ccccc1)C=O Amb17594046 [0,2,0,0,0,0|1,0,0]=3 7460 B12R1.3 CCCC(c1ccccc1)CBr Amb17247626 [0,2,0,0,0,0|1,0,0]=3 7461 B12R1.3 CCCC(c1ccccc1)CCl Amb17233968 [0,2,0,0,0,0|1,0,0]=3 7462 B12R1.3 CCCC(c1ccccc1)CO Amb17232487 [0,2,0,0,0,0|1,0,0]=3 7463 B12R1.3 CCCC(c1ccccc1)NO Amb10605018 [0,2,0,0,0,0|1,0,0]=3 7464 B12R1.3 CCN(CCO)c1c[n]ccc1 Amb24098213 [0,2,0,0,0,0|2,0,0]=4 7465 B12R1.3 CCN(CCO)c1cc[n]cc1 Amb18792801 [0,2,0,0,0,0|2,0,0]=4 7466 B12R1.3 CCNC(C#N)c1ccccc1 Amb22736556 [0,2,0,0,0,0|2,0,0]=4 7467 B12R1.3 CCN[C@@H](CO)c1ccccc1 Amb22745949 [0,2,0,0,0,0|2,0,0]=4 7468 B12R1.3 CC\C(=C\CO)\c1ccccc1 Amb25816528 [0,2,0,0,0,0|0,0,2]=4 7469 B12R1.3 CNC(CC#C)c1ccccc1 Amb18800161 [0,2,0,0,0,0|1,0,1]=4 7470 B12R1.3 CNC(CC#C)c1ccccc1 Amb19514703 [0,2,0,0,0,0|1,0,1]=4 7471 B12R1.3 CNC(CC#N)c1ccccc1 Amb18997456 [0,2,0,0,0,0|1,0,1]=4 7472 B12R1.3 CNC(CCO)c1c[n]cc[n]1 Amb22301219 [0,2,0,0,0,0|2,0,0]=4 7473 B12R1.3 CNC(CCO)c1ccccc1 Amb18563697 [0,2,0,0,0,0|0,0,0]=2 7474 B12R1.3 CNCC(c1ccccc1)OC Amb17605856 [0,2,0,0,0,0|2,0,0]=4 7475 B12R1.3 COC(CC#N)c1ccccc1 Amb18797978 [0,2,0,0,0,0|1,0,1]=4 7476 B12R1.3 COCC(C#N)c1ccccc1 Amb25728276 [0,2,0,0,0,0|2,0,0]=4 7477 B12R1.3 CSC(CC#N)c1ccccc1 Amb18804687 [0,2,0,0,0,0|1,0,1]=4 7478 B12R1.3 C\C=C(\CCN)/c1ccccc1 Amb25349495 [0,2,0,0,0,0|1,0,1]=4 7479 B12R1.3 C\C=C(\CCO)/c1ccccc1 Amb25256435 [0,2,0,0,0,0|0,0,1]=3 7480 B12R1.3 N#CC(CCCl)c1ccccc1 Amb18648314 [0,2,0,0,0,0|1,0,0]=3 7481 B12R1.3 N#CN(CCF)c1ccccc1 Amb25795104 [0,2,0,0,0,0|2,0,0]=4 7482 B12R1.3 N#CN(CCO)c1ccccc1 Amb24349826 [0,2,0,0,0,0|1,0,0]=3 7483 B12R1.3 NCC(c1ccccc1)OCC Amb17605997 [0,2,0,0,0,0|2,0,0]=4 7484 B12R1.3 NCCC(c1ccccc1)CN Amb1111605 [0,2,0,0,0,0|1,0,0]=3 7485 B12R1.3 NCCC(c1ccccc1)OC Amb17334641 [0,2,0,0,0,0|1,0,0]=3 7486 B12R1.3 NCCC(c1cccnc1)CN Amb17232561 [0,2,0,0,0,0|2,0,0]=4 7487 B12R1.3 NCCN(c1ccccc1)CC Amb1136918 [0,2,0,0,0,0|2,0,0]=4 7488 B12R1.3 NCC\C(=N\N)\c1ccccc1 Amb24427544 [0,2,0,0,0,0|1,0,1]=4 7489 B12R1.3 OCCC(c1ccccc1)C#N Amb17334526 [0,2,0,0,0,0|0,0,0]=2 7490 B12R1.3 OCCC(c1ccccc1)CC Amb17232488 [0,2,0,0,0,0|0,0,0]=2 7491 B12R1.3 OCCC(c1ccccn1)C#N Amb17334562 [0,2,0,0,0,0|1,0,0]=3 7492 B12R1.3 OCCC(c1cccnc1)C#N Amb17334563 [0,2,0,0,0,0|1,0,0]=3 7493 B12R1.3 OCCC(c1cccnc1)CN Amb17232607 [0,2,0,0,0,0|1,0,0]=3 7494 B12R1.3 OCCC(c1ccncc1)C#N Amb17334564 [0,2,0,0,0,0|1,0,0]=3 7495 B12R1.3 OCCN(c1ccccc1)CC Amb1208392 [0,2,0,0,0,0|1,0,0]=3 7496 B12R1.3 OCC\C(=N\O)\c1ccccc1 Amb24497634 [0,2,0,0,0,0|0,0,1]=3 7497 B12R1.3 OC\C=C(\CF)/c1ccccc1 Amb25769424 [0,2,0,0,0,0|0,0,2]=4 7498 B12R1.3 O\N=C\C(C=O)c1ccccc1 Amb25302254 [0,2,0,0,0,0|1,0,1]=4 7499 B12R1.3 SCCN(c1ccccc1)CC Amb13881733 [0,2,0,0,0,0|1,1,0]=4 7500 B12R1.3 [C-]#[N+]C(CCO)c1ccccc1 Amb24431832 [0,2,0,0,0,0|0,0,0]=2 7501 B12R1.17 BrCCC(=O)c1cccc(c1)Br Amb17437897 [0,2,0,0,0,0|1,0,1]=4 7502 B12R1.17 C#CCC(N)c1cccc(Br)c1 Amb24387869 [0,2,0,0,0,0|1,0,1]=4 7503 B12R1.17 C#CCC(N)c1cccc(Cl)c1 Amb18809278 [0,2,0,0,0,0|1,0,1]=4 7504 B12R1.17 C#CCC(N)c1cccc(F)c1 Amb18959768 [0,2,0,0,0,0|1,0,1]=4 7505 B12R1.17 C#CCC(O)c1cc(O)ccc1 Amb18117926 [0,2,0,0,0,0|1,0,1]=4 7506 B12R1.17 C#CCC(O)c1cccc(Cl)c1 Amb18186757 [0,2,0,0,0,0|1,0,1]=4 7507 B12R1.17 C#CCC(O)c1cccc(F)c1 Amb18800773 [0,2,0,0,0,0|1,0,1]=4 7508 B12R1.17 C#CCC(O)c1cccc(N)c1 Amb24650876 [0,2,0,0,0,0|1,0,1]=4 7509 B12R1.17 C#CC[C@H](O)c1cc(O)ccc1 Amb25767097 [0,2,0,0,0,0|1,0,1]=4 7510 B12R1.17 C#CC[C@H](O)c1cccc(Cl)c1 Amb25788894 [0,2,0,0,0,0|1,0,1]=4 7511 B12R1.17 C=C(CCO)c1cc(F)ccc1 Amb25098576 [0,2,0,0,0,0|0,0,1]=3 7512 B12R1.17 C=CCC(N)c1cc(N)ccc1 Amb24417276 [0,2,0,0,0,0|1,0,1]=4 7513 B12R1.17 C=CCC(N)c1cccc(Br)c1 Amb18292095 [0,2,0,0,0,0|1,0,1]=4 7514 B12R1.17 C=CCC(N)c1cccc(Cl)c1 Amb18292091 [0,2,0,0,0,0|1,0,1]=4 7515 B12R1.17 C=CCC(N)c1cccc(F)c1 Amb18977587 [0,2,0,0,0,0|1,0,1]=4 7516 B12R1.17 C=CCC(O)c1cc(O)ccc1 Amb18646052 [0,2,0,0,0,0|1,0,1]=4 7517 B12R1.17 C=CCC(O)c1cccc(F)c1 Amb18177817 [0,2,0,0,0,0|1,0,1]=4 7518 B12R1.17 C=CCC(O)c1cccc(N)c1 Amb25674950 [0,2,0,0,0,0|1,0,1]=4 7519 B12R1.17 C=CC[C@@H](N)c1cccc(Br)c1 Amb19929879 [0,2,0,0,0,0|1,0,1]=4 7520 B12R1.17 C=CC[C@@H](N)c1cccc(Br)c1 Amb22831442 [0,2,0,0,0,0|1,0,1]=4 7521 B12R1.17 C=CC[C@@H](N)c1cccc(Cl)c1 Amb22831578 [0,2,0,0,0,0|1,0,1]=4 7522 B12R1.17 C=CC[C@@H](O)c1cc(O)ccc1 Amb25352493 [0,2,0,0,0,0|1,0,1]=4 7523 B12R1.17 C=CC[C@@H](O)c1cccc(Br)c1 Amb24637865 [0,2,0,0,0,0|1,0,1]=4 7524 B12R1.17 C=CC[C@@H](O)c1cccc(S)c1 Amb25706098 [0,2,0,0,0,0|1,0,1]=4 7525 B12R1.17 C=CC[C@H](N)c1cccc(Br)c1 Amb19929880 [0,2,0,0,0,0|1,0,1]=4 7526 B12R1.17 C=CC[C@H](N)c1cccc(Br)c1 Amb25221639 [0,2,0,0,0,0|1,0,1]=4 7527 B12R1.17 C=CC[C@H](N)c1cccc(Cl)c1 Amb25775422 [0,2,0,0,0,0|1,0,1]=4 7528 B12R1.17 C=CC[C@H](N)c1cccc(I)c1 Amb25784765 [0,2,0,0,0,0|1,0,1]=4 7529 B12R1.17 C=CC[C@H](N)c1cccc(O)c1 Amb24487270 [0,2,0,0,0,0|1,0,1]=4 7530 B12R1.17 C=CC[C@H](O)c1cc(O)ccc1 Amb24525136 [0,2,0,0,0,0|1,0,1]=4 7531 B12R1.17 C=CC[C@H](O)c1cccc(Cl)c1 Amb25241128 [0,2,0,0,0,0|1,0,1]=4 7532 B12R1.17 C=CC[C@H](O)c1cccc(F)c1 Amb24524776 [0,2,0,0,0,0|1,0,1]=4 7533 B12R1.17 CC(CC#N)c1cccc(Br)c1 Amb24645330 [0,2,0,0,0,0|1,0,1]=4 7534 B12R1.17 CC(CC#N)c1cccc(F)c1 Amb24732112 [0,2,0,0,0,0|1,0,1]=4 7535 B12R1.17 CC(CC=O)c1cccc(O)c1 Amb25195457 [0,2,0,0,0,0|0,0,2]=4 7536 B12R1.17 CC(CCBr)c1cccc(Cl)c1 Amb25751472 [0,2,0,0,0,0|1,0,0]=3 7537 B12R1.17 CC(CCN)c1c[n]cc(F)c1 Amb25068199 [0,2,0,0,0,0|2,0,0]=4 7538 B12R1.17 CCCC(=O)c1cc(I)ccc1 Amb24424807 [0,2,0,0,0,0|1,0,1]=4 7539 B12R1.17 CCCC(=O)c1cc(N)ccc1 Amb22730482 [0,2,0,0,0,0|1,0,1]=4 7540 B12R1.17 CCCC(=O)c1cc(O)ccc1 Amb24736503 [0,2,0,0,0,0|1,0,1]=4 7541 B12R1.17 CCCC(=O)c1cccc(c1)Br Amb17193987 [0,2,0,0,0,0|1,0,1]=4 7542 B12R1.17 CCCC(=O)c1cccc(c1)Cl Amb17198744 [0,2,0,0,0,0|1,0,1]=4 7543 B12R1.17 CCCC(=O)c1cccc(c1)F Amb17232581 [0,2,0,0,0,0|1,0,1]=4 7544 B12R1.17 CCCC(C)c1cccc(Br)c1 Amb25281341 [0,2,0,0,0,0|1,0,0]=3 7545 B12R1.17 CCCC(Cl)c1c[n]cc(F)c1 Amb25682732 [0,2,0,0,0,0|2,0,0]=4 7546 B12R1.17 CCCC(N)c1c[n]cc(Cl)c1 Amb24487263 [0,2,0,0,0,0|2,0,0]=4 7547 B12R1.17 CCCC(N)c1c[n]cc(F)c1 Amb18978747 [0,2,0,0,0,0|2,0,0]=4 7548 B12R1.17 CCCC(N)c1c[n]cc(N)c1 Amb24523044 [0,2,0,0,0,0|2,0,0]=4 7549 B12R1.17 CCCC(N)c1cc(Br)cc[n]1 Amb24483864 [0,2,0,0,0,0|2,0,0]=4 7550 B12R1.17 CCCC(N)c1cc(O)ccc1 Amb24379131 [0,2,0,0,0,0|1,0,0]=3 7551 B12R1.17 CCCC(N)c1cccc(Br)[n]1 Amb25800145 [0,2,0,0,0,0|2,0,0]=4 7552 B12R1.17 CCCC(N)c1cccc(F)[n]1 Amb18199297 [0,2,0,0,0,0|2,0,0]=4 7553 B12R1.17 CCCC(O)c1c[n]cc(Cl)c1 Amb25104366 [0,2,0,0,0,0|2,0,0]=4 7554 B12R1.17 CCCC(O)c1c[n]cc(F)c1 Amb18180201 [0,2,0,0,0,0|2,0,0]=4 7555 B12R1.17 CCCC(O)c1cc(Cl)cc[n]1 Amb25847785 [0,2,0,0,0,0|2,0,0]=4 7556 B12R1.17 CCCC(O)c1cc(I)ccc1 Amb25310854 [0,2,0,0,0,0|1,0,0]=3 7557 B12R1.17 CCCC(O)c1cc(N)ccc1 Amb25087129 [0,2,0,0,0,0|1,0,0]=3 7558 B12R1.17 CCCC(O)c1cc(O)ccc1 Amb24706852 [0,2,0,0,0,0|1,0,0]=3 7559 B12R1.17 CCCC(O)c1cccc(Br)[n]1 Amb25706154 [0,2,0,0,0,0|2,0,0]=4 7560 B12R1.17 CCCC(c1cccc(c1)Br)O Amb17248424 [0,2,0,0,0,0|1,0,0]=3 7561 B12R1.17 CCCC(c1cccc(c1)C)N Amb17232449 [0,2,0,0,0,0|1,0,0]=3 7562 B12R1.17 CCCC(c1cccc(c1)C)O Amb17232484 [0,2,0,0,0,0|1,0,0]=3 7563 B12R1.17 CCCC(c1cccc(c1)Cl)N Amb17234050 [0,2,0,0,0,0|1,0,0]=3 7564 B12R1.17 CCCC(c1cccc(c1)Cl)O Amb17234155 [0,2,0,0,0,0|1,0,0]=3 7565 B12R1.17 CCCC(c1cccc(c1)F)N Amb17232649 [0,2,0,0,0,0|1,0,0]=3 7566 B12R1.17 CCCC(c1cccc(c1)F)O Amb17232673 [0,2,0,0,0,0|1,0,0]=3 7567 B12R1.17 CCCN(C)c1cccc(Br)c1 Amb25154384 [0,2,0,0,0,0|2,0,0]=4 7568 B12R1.17 CCCN(C)c1cccc(F)c1 Amb25285140 [0,2,0,0,0,0|2,0,0]=4 7569 B12R1.17 CCCN(C)c1cccc(O)c1 Amb18646357 [0,2,0,0,0,0|2,0,0]=4 7570 B12R1.17 CCC[C@@H](N)c1cc(Br)[n]cc1 Amb25055143 [0,2,0,0,0,0|2,0,0]=4 7571 B12R1.17 CCC[C@@H](N)c1cc(Br)cc[n]1 Amb24679998 [0,2,0,0,0,0|2,0,0]=4 7572 B12R1.17 CCC[C@@H](N)c1cc(Br)ccc1 Amb25301508 [0,2,0,0,0,0|1,0,0]=3 7573 B12R1.17 CCC[C@@H](N)c1cc(Cl)[n]cc1 Amb24446987 [0,2,0,0,0,0|2,0,0]=4 7574 B12R1.17 CCC[C@@H](N)c1cc(Cl)cc[n]1 Amb24379650 [0,2,0,0,0,0|2,0,0]=4 7575 B12R1.17 CCC[C@@H](N)c1cc(Cl)ccc1 Amb24426769 [0,2,0,0,0,0|1,0,0]=3 7576 B12R1.17 CCC[C@@H](N)c1cc(F)[n]cc1 Amb25694340 [0,2,0,0,0,0|2,0,0]=4 7577 B12R1.17 CCC[C@@H](N)c1cc(F)ccc1 Amb25709212 [0,2,0,0,0,0|1,0,0]=3 7578 B12R1.17 CCC[C@@H](N)c1cc(N)[n]cc1 Amb25674867 [0,2,0,0,0,0|2,0,0]=4 7579 B12R1.17 CCC[C@@H](N)c1cc(N)cc[n]1 Amb25286779 [0,2,0,0,0,0|2,0,0]=4 7580 B12R1.17 CCC[C@@H](N)c1cc(O)ccc1 Amb25328595 [0,2,0,0,0,0|1,0,0]=3 7581 B12R1.17 CCC[C@@H](N)c1cccc(Cl)[n]1 Amb24386087 [0,2,0,0,0,0|2,0,0]=4 7582 B12R1.17 CCC[C@@H](N)c1cccc(N)[n]1 Amb25372021 [0,2,0,0,0,0|2,0,0]=4 7583 B12R1.17 CCC[C@@H](O)c1c[n]cc(Br)c1 Amb25763374 [0,2,0,0,0,0|2,0,0]=4 7584 B12R1.17 CCC[C@@H](O)c1cc(Cl)cc[n]1 Amb25156889 [0,2,0,0,0,0|2,0,0]=4 7585 B12R1.17 CCC[C@@H](O)c1cc(Cl)ccc1 Amb25069848 [0,2,0,0,0,0|1,0,0]=3 7586 B12R1.17 CCC[C@H](N)c1c[n]cc(Br)c1 Amb24680148 [0,2,0,0,0,0|2,0,0]=4 7587 B12R1.17 CCC[C@H](N)c1c[n]cc(Cl)c1 Amb25063767 [0,2,0,0,0,0|2,0,0]=4 7588 B12R1.17 CCC[C@H](N)c1c[n]cc(N)c1 Amb25330227 [0,2,0,0,0,0|2,0,0]=4 7589 B12R1.17 CCC[C@H](N)c1cc(Br)[n]cc1 Amb24427757 [0,2,0,0,0,0|2,0,0]=4 7590 B12R1.17 CCC[C@H](N)c1cc(Br)ccc1 Amb24400381 [0,2,0,0,0,0|1,0,0]=3 7591 B12R1.17 CCC[C@H](N)c1cc(F)[n]cc1 Amb24761412 [0,2,0,0,0,0|2,0,0]=4 7592 B12R1.17 CCC[C@H](N)c1cc(O)[n]cc1 Amb24484170 [0,2,0,0,0,0|2,0,0]=4 7593 B12R1.17 CCC[C@H](N)c1cccc(F)[n]1 Amb25113431 [0,2,0,0,0,0|2,0,0]=4 7594 B12R1.17 CCC[C@H](O)c1c[n]cc(Br)c1 Amb24704858 [0,2,0,0,0,0|2,0,0]=4 7595 B12R1.17 CCC[C@H](O)c1cc(Br)ccc1 Amb25762439 [0,2,0,0,0,0|1,0,0]=3 7596 B12R1.17 CCNC(C)c1cccc(I)c1 Amb25061694 [0,2,0,0,0,0|2,0,0]=4 7597 B12R1.17 CCNC(C)c1cccc(S)c1 Amb25798719 [0,2,0,0,0,0|2,0,0]=4 7598 B12R1.17 CCN[C@@H](C)c1cccc(Cl)c1 Amb25081589 [0,2,0,0,0,0|2,0,0]=4 7599 B12R1.17 CCN[C@H](C)c1cccc(Br)c1 Amb25075777 [0,2,0,0,0,0|2,0,0]=4 7600 B12R1.17 CCN[C@H](C)c1cccc(Cl)c1 Amb25067502 [0,2,0,0,0,0|2,0,0]=4 7601 B12R1.17 CCOC(C)c1cccc(N)c1 Amb18973987 [0,2,0,0,0,0|2,0,0]=4 7602 B12R1.17 CCOC(Cl)c1cccc(F)c1 Amb24429076 [0,2,0,0,0,0|2,0,0]=4 7603 B12R1.17 CCSC(C)c1cccc(Cl)c1 Amb25036538 [0,2,0,0,0,0|2,0,0]=4 7604 B12R1.17 CCSC(C)c1cccc(N)c1 Amb18973995 [0,2,0,0,0,0|2,0,0]=4 7605 B12R1.17 CN(CCBr)c1cccc(Cl)c1 Amb25854316 [0,2,0,0,0,0|2,0,0]=4 7606 B12R1.17 CN(CCBr)c1cccc(F)c1 Amb22886711 [0,2,0,0,0,0|2,0,0]=4 7607 B12R1.17 CN(CCI)c1cccc(Br)c1 Amb25680335 [0,2,0,0,0,0|2,0,0]=4 7608 B12R1.17 CN(CCI)c1cccc(F)c1 Amb24732661 [0,2,0,0,0,0|2,0,0]=4 7609 B12R1.17 CN(CCI)c1cccc(O)c1 Amb24397741 [0,2,0,0,0,0|2,0,0]=4 7610 B12R1.17 CN(CCN)c1cc(Br)ccc1 Amb24525334 [0,2,0,0,0,0|2,0,0]=4 7611 B12R1.17 CN(CCN)c1cc(O)ccc1 Amb25804629 [0,2,0,0,0,0|2,0,0]=4 7612 B12R1.17 CN(CCO)c1c[n]cc(Br)c1 Amb23744740 [0,2,0,0,0,0|2,0,0]=4 7613 B12R1.17 CN(CCO)c1c[n]cc(N)c1 Amb25139848 [0,2,0,0,0,0|2,0,0]=4 7614 B12R1.17 CN(CCO)c1cc(Br)cc[n]1 Amb18160449 [0,2,0,0,0,0|2,0,0]=4 7615 B12R1.17 CN(CCO)c1cc(N)cc[n]1 Amb18981476 [0,2,0,0,0,0|2,0,0]=4 7616 B12R1.17 CN(CCO)c1cc[n]c(N)c1 Amb24644882 [0,2,0,0,0,0|2,0,0]=4 7617 B12R1.17 CN(CCO)c1cccc(Br)[n]1 Amb24683325 [0,2,0,0,0,0|2,0,0]=4 7618 B12R1.17 CN(CCO)c1cccc(Cl)[n]1 Amb21957698 [0,2,0,0,0,0|2,0,0]=4 7619 B12R1.17 CN(CCO)c1cccc(F)[n]1 Amb18789196 [0,2,0,0,0,0|2,0,0]=4 7620 B12R1.17 CN(CCO)c1cccc(N)[n]1 Amb25711550 [0,2,0,0,0,0|2,0,0]=4 7621 B12R1.17 CNCC(C)c1cccc(O)c1 Amb25804026 [0,2,0,0,0,0|2,0,0]=4 7622 B12R1.17 CNCC(Cl)c1cccc(F)c1 Amb24635680 [0,2,0,0,0,0|2,0,0]=4 7623 B12R1.17 CNCC(O)c1cccc(F)c1 Amb18289718 [0,2,0,0,0,0|2,0,0]=4 7624 B12R1.17 CNCC(O)c1cccc(I)c1 Amb25121468 [0,2,0,0,0,0|2,0,0]=4 7625 B12R1.17 CNCC(c1cccc(c1)Br)O Amb17142607 [0,2,0,0,0,0|2,0,0]=4 7626 B12R1.17 CNCC(c1cccc(c1)N)O Amb17594135 [0,2,0,0,0,0|2,0,0]=4 7627 B12R1.17 CNC[C@@H](O)c1cc(O)ccc1 Amb19133645 [0,2,0,0,0,0|2,0,0]=4 7628 B12R1.17 CNC[C@@H](O)c1cc(O)ccc1 Amb22799790 [0,2,0,0,0,0|2,0,0]=4 7629 B12R1.17 CNC[C@H](C)c1cccc(O)c1 Amb25774924 [0,2,0,0,0,0|2,0,0]=4 7630 B12R1.17 CNC[C@H](O)c1cc(O)ccc1 Amb22168059 [0,2,0,0,0,0|2,0,0]=4 7631 B12R1.17 CNC[C@H](c1cccc(c1)O)O Amb16231685 [0,2,0,0,0,0|2,0,0]=4 7632 B12R1.17 COCC(F)c1cccc(O)c1 Amb25283248 [0,2,0,0,0,0|2,0,0]=4 7633 B12R1.17 COCC(N)c1cccc(Cl)c1 Amb18983032 [0,2,0,0,0,0|2,0,0]=4 7634 B12R1.17 COCC(N)c1cccc(I)c1 Amb25034579 [0,2,0,0,0,0|2,0,0]=4 7635 B12R1.17 COCC(N)c1cccc(O)c1 Amb24378072 [0,2,0,0,0,0|2,0,0]=4 7636 B12R1.17 COCC(N)c1cccc(S)c1 Amb24428810 [0,2,0,0,0,0|2,0,0]=4 7637 B12R1.17 COCC(O)c1cccc(Cl)c1 Amb19076385 [0,2,0,0,0,0|2,0,0]=4 7638 B12R1.17 COCC(O)c1cccc(F)c1 Amb18793594 [0,2,0,0,0,0|2,0,0]=4 7639 B12R1.17 COCC(c1cccc(c1)N)O Amb13952267 [0,2,0,0,0,0|2,0,0]=4 7640 B12R1.17 COC[C@@H](N)c1cc(N)ccc1 Amb25132108 [0,2,0,0,0,0|2,0,0]=4 7641 B12R1.17 COC[C@@H](N)c1cccc(Br)c1 Amb25669519 [0,2,0,0,0,0|2,0,0]=4 7642 B12R1.17 COC[C@@H](N)c1cccc(Cl)c1 Amb24670292 [0,2,0,0,0,0|2,0,0]=4 7643 B12R1.17 COC[C@@H](N)c1cccc(F)c1 Amb25794807 [0,2,0,0,0,0|2,0,0]=4 7644 B12R1.17 COC[C@@H](N)c1cccc(O)c1 Amb25809467 [0,2,0,0,0,0|2,0,0]=4 7645 B12R1.17 COC[C@H](N)c1cc(N)ccc1 Amb24360714 [0,2,0,0,0,0|2,0,0]=4 7646 B12R1.17 COC[C@H](N)c1cccc(I)c1 Amb25691760 [0,2,0,0,0,0|2,0,0]=4 7647 B12R1.17 CSCC(C)c1cccc(Cl)c1 Amb24525351 [0,2,0,0,0,0|2,0,0]=4 7648 B12R1.17 CSCC(N)c1cccc(Cl)c1 Amb18995356 [0,2,0,0,0,0|2,0,0]=4 7649 B12R1.17 CSCC(N)c1cccc(F)c1 Amb18995351 [0,2,0,0,0,0|2,0,0]=4 7650 B12R1.17 CSCC(O)c1cccc(F)c1 Amb19070007 [0,2,0,0,0,0|2,0,0]=4 7651 B12R1.17 CSCC(O)c1cccc(N)c1 Amb18296181 [0,2,0,0,0,0|2,0,0]=4 7652 B12R1.17 C[C@H](CC=O)c1cccc(Cl)c1 Amb24640335 [0,2,0,0,0,0|0,0,2]=4 7653 B12R1.17 C\C(=C\CO)\c1cccc(Br)c1 Amb25260939 [0,2,0,0,0,0|0,0,2]=4 7654 B12R1.17 Cc1c[n]cc(c1)[C@@H](N)CCC Amb25824214 [0,2,0,0,0,0|2,0,0]=4 7655 B12R1.17 Cc1c[n]cc(c1)[C@H](N)CCC Amb25727231 [0,2,0,0,0,0|2,0,0]=4 7656 B12R1.17 Cc1cc([n]cc1)C(O)CCN Amb24584095 [0,2,0,0,0,0|2,0,0]=4 7657 B12R1.17 Cc1cc([n]cc1)[C@@H](N)CCO Amb25667121 [0,2,0,0,0,0|1,0,0]=3 7658 B12R1.17 Cc1cc(c[n]c1)[C@H](N)CCO Amb24761431 [0,2,0,0,0,0|1,0,0]=3 7659 B12R1.17 Cc1cc(cc[n]1)C(N)CCO Amb25727723 [0,2,0,0,0,0|1,0,0]=3 7660 B12R1.17 Cc1cc(cc[n]1)C(O)CCC Amb25331562 [0,2,0,0,0,0|2,0,0]=4 7661 B12R1.17 Cc1cc(cc[n]1)N(C)CCO Amb25065009 [0,2,0,0,0,0|2,0,0]=4 7662 B12R1.17 Cc1cc(cc[n]1)[C@@H](N)CCC Amb25324356 [0,2,0,0,0,0|2,0,0]=4 7663 B12R1.17 Cc1cc(cc[n]1)[C@H](N)CCC Amb25104806 [0,2,0,0,0,0|2,0,0]=4 7664 B12R1.17 Cc1cc(cc[n]1)[C@H](N)CCO Amb24419434 [0,2,0,0,0,0|1,0,0]=3 7665 B12R1.17 Cc1cc(ccc1)C(=C)CCO Amb25056805 [0,2,0,0,0,0|0,0,1]=3 7666 B12R1.17 Cc1cc(ccc1)C(=O)CCN Amb24700399 [0,2,0,0,0,0|1,0,1]=4 7667 B12R1.17 Cc1cc(ccc1)C(=O)CCO Amb25735228 [0,2,0,0,0,0|0,0,1]=3 7668 B12R1.17 Cc1cc(ccc1)C(Cl)CCO Amb24355343 [0,2,0,0,0,0|0,0,0]=2 7669 B12R1.17 Cc1cc(ccc1)C(F)CCN Amb25043004 [0,2,0,0,0,0|1,0,0]=3 7670 B12R1.17 Cc1cc(ccc1)C(N)CC#C Amb18800160 [0,2,0,0,0,0|1,0,1]=4 7671 B12R1.17 Cc1cc(ccc1)C(N)CC#N Amb18563499 [0,2,0,0,0,0|1,0,1]=4 7672 B12R1.17 Cc1cc(ccc1)C(N)CC=C Amb18977591 [0,2,0,0,0,0|1,0,1]=4 7673 B12R1.17 Cc1cc(ccc1)C(O)CC#C Amb18800364 [0,2,0,0,0,0|1,0,1]=4 7674 B12R1.17 Cc1cc(ccc1)C(O)CC=C Amb18177788 [0,2,0,0,0,0|1,0,1]=4 7675 B12R1.17 Cc1cc(ccc1)C(O)CC=O Amb24366566 [0,2,0,0,0,0|0,0,2]=4 7676 B12R1.17 Cc1cc(ccc1)C(O)CCCl Amb25725000 [0,2,0,0,0,0|1,0,0]=3 7677 B12R1.17 Cc1cc(ccc1)S(=O)CCCl Amb24428231 [0,2,0,0,0,0|2,0,0]=4 7678 B12R1.17 Cc1cc(ccc1)S(=O)CCN Amb18974528 [0,2,0,0,0,0|2,0,0]=4 7679 B12R1.17 Cc1cc(ccc1)[C@@H](N)CC=C Amb25681927 [0,2,0,0,0,0|1,0,1]=4 7680 B12R1.17 Cc1cc(ccc1)[C@@H](N)CCO Amb19888371 [0,2,0,0,0,0|0,0,0]=2 7681 B12R1.17 Cc1cc(ccc1)[C@@H](O)CC#N Amb25092023 [0,2,0,0,0,0|1,0,1]=4 7682 B12R1.17 Cc1cc(ccc1)[C@H](N)CC=C Amb24392927 [0,2,0,0,0,0|1,0,1]=4 7683 B12R1.17 Cc1cc(ccc1)[C@H](N)CCN Amb24612216 [0,2,0,0,0,0|1,0,0]=3 7684 B12R1.17 Cc1cc(ccc1)[C@H](N)CCO Amb19887706 [0,2,0,0,0,0|0,0,0]=2 7685 B12R1.17 Cc1cc(ccc1)[C@H](O)CC#C Amb25157924 [0,2,0,0,0,0|1,0,1]=4 7686 B12R1.17 Cc1cc[n]c(c1)C(N)CCC Amb18828646 [0,2,0,0,0,0|2,0,0]=4 7687 B12R1.17 Cc1cc[n]c(c1)C(O)CCC Amb24425208 [0,2,0,0,0,0|2,0,0]=4 7688 B12R1.17 Cc1cc[n]c(c1)N(C)CCO Amb18798583 [0,2,0,0,0,0|2,0,0]=4 7689 B12R1.17 Cc1cc[n]c(c1)[C@@H](N)CCC Amb24548212 [0,2,0,0,0,0|2,0,0]=4 7690 B12R1.17 Cc1cc[n]c(c1)[C@@H](O)CCC Amb25848810 [0,2,0,0,0,0|2,0,0]=4 7691 B12R1.17 Cc1cc[n]c(c1)[C@H](N)CCC Amb24761470 [0,2,0,0,0,0|2,0,0]=4 7692 B12R1.17 Cc1cc[n]c(c1)[C@H](O)CCC Amb25048748 [0,2,0,0,0,0|2,0,0]=4 7693 B12R1.17 Cc1cccc([n]1)C(C)CCC Amb25847085 [0,2,0,0,0,0|2,0,0]=4 7694 B12R1.17 Cc1cccc([n]1)C(N)CCC Amb18828650 [0,2,0,0,0,0|2,0,0]=4 7695 B12R1.17 Cc1cccc([n]1)C(N)CCO Amb24697663 [0,2,0,0,0,0|1,0,0]=3 7696 B12R1.17 Cc1cccc([n]1)N(C)CCO Amb18792800 [0,2,0,0,0,0|2,0,0]=4 7697 B12R1.17 Cc1cccc([n]1)[C@@H](N)CCO Amb24644867 [0,2,0,0,0,0|1,0,0]=3 7698 B12R1.17 Cc1cccc([n]1)[C@@H](O)CCC Amb25787490 [0,2,0,0,0,0|2,0,0]=4 7699 B12R1.17 Cc1cccc([n]1)[C@H](N)CCO Amb24487360 [0,2,0,0,0,0|1,0,0]=3 7700 B12R1.17 Cc1cccc(c1)C(C)CNC Amb25069401 [0,2,0,0,0,0|2,0,0]=4 7701 B12R1.17 Cc1cccc(c1)C(C)SCC Amb25792019 [0,2,0,0,0,0|2,0,0]=4 7702 B12R1.17 Cc1cccc(c1)C(N)COC Amb18975558 [0,2,0,0,0,0|2,0,0]=4 7703 B12R1.17 Cc1cccc(c1)C(N)CSC Amb18995349 [0,2,0,0,0,0|2,0,0]=4 7704 B12R1.17 Cc1cccc(c1)C(O)COC Amb18792769 [0,2,0,0,0,0|2,0,0]=4 7705 B12R1.17 Cc1cccc(c1)C(O)CSC Amb19061294 [0,2,0,0,0,0|2,0,0]=4 7706 B12R1.17 Cc1cccc(c1)N(C)CCF Amb25057274 [0,2,0,0,0,0|2,0,0]=4 7707 B12R1.17 Cc1cccc(c1)N(C)CCI Amb25802690 [0,2,0,0,0,0|2,0,0]=4 7708 B12R1.17 Cc1cccc(c1)[C@@H](C)CCO Amb25155793 [0,2,0,0,0,0|0,0,0]=2 7709 B12R1.17 Cc1cccc(c1)[C@@H](C)NCC Amb24448414 [0,2,0,0,0,0|2,0,0]=4 7710 B12R1.17 Cc1cccc(c1)[C@@H](N)CCC Amb22746897 [0,2,0,0,0,0|1,0,0]=3 7711 B12R1.17 Cc1cccc(c1)[C@H](N)CCC Amb22298528 [0,2,0,0,0,0|1,0,0]=3 7712 B12R1.17 Cc1cccc(c1)[C@H](N)CCC Amb25328596 [0,2,0,0,0,0|1,0,0]=3 7713 B12R1.17 Cc1cccc(c1)\C(\C)=C/CO Amb25852937 [0,2,0,0,0,0|0,0,2]=4 7714 B12R1.17 ClCCC(=O)c1cccc(c1)Br Amb17351482 [0,2,0,0,0,0|1,0,1]=4 7715 B12R1.17 ClCCN(c1cccc(c1)Br)C Amb17351920 [0,2,0,0,0,0|2,0,0]=4 7716 B12R1.17 ClCCN(c1cccc(c1)C)C Amb17335671 [0,2,0,0,0,0|2,0,0]=4 7717 B12R1.17 ClCCN(c1cccc(c1)Cl)C Amb17338056 [0,2,0,0,0,0|2,0,0]=4 7718 B12R1.17 ClCCN(c1cccc(c1)F)C Amb17335953 [0,2,0,0,0,0|2,0,0]=4 7719 B12R1.17 N#CCC(O)c1cc(O)ccc1 Amb25674244 [0,2,0,0,0,0|1,0,1]=4 7720 B12R1.17 N#CCC(O)c1cccc(Br)c1 Amb25139301 [0,2,0,0,0,0|1,0,1]=4 7721 B12R1.17 N#CCC(c1cccc(c1)C)O Amb1111387 [0,2,0,0,0,0|1,0,1]=4 7722 B12R1.17 N#CCC(c1cccc(c1)Cl)O Amb17233865 [0,2,0,0,0,0|1,0,1]=4 7723 B12R1.17 N#CCC(c1cccc(c1)F)O Amb17232517 [0,2,0,0,0,0|1,0,1]=4 7724 B12R1.17 N#CC[C@@H](O)c1cc(O)ccc1 Amb24492822 [0,2,0,0,0,0|1,0,1]=4 7725 B12R1.17 N#CC[C@@H](O)c1cccc(Cl)c1 Amb24360505 [0,2,0,0,0,0|1,0,1]=4 7726 B12R1.17 N#CC[C@@H](O)c1cccc(F)c1 Amb25721001 [0,2,0,0,0,0|1,0,1]=4 7727 B12R1.17 N#CC[C@H](O)c1cccc(F)c1 Amb25699065 [0,2,0,0,0,0|1,0,1]=4 7728 B12R1.17 NC(CC#N)c1cccc(Br)c1 Amb18068031 [0,2,0,0,0,0|1,0,1]=4 7729 B12R1.17 NC(CC#N)c1cccc(Cl)c1 Amb18564159 [0,2,0,0,0,0|1,0,1]=4 7730 B12R1.17 NC(CC#N)c1cccc(F)c1 Amb18563606 [0,2,0,0,0,0|1,0,1]=4 7731 B12R1.17 NC(CC#N)c1cccc(O)c1 Amb25760250 [0,2,0,0,0,0|1,0,1]=4 7732 B12R1.17 NC(CCO)c1cc(Br)[n]cc1 Amb25805294 [0,2,0,0,0,0|1,0,0]=3 7733 B12R1.17 NC(CCO)c1cc(Br)cc[n]1 Amb24637813 [0,2,0,0,0,0|1,0,0]=3 7734 B12R1.17 NC(CCO)c1cc(Br)ccc1 Amb18990231 [0,2,0,0,0,0|0,0,0]=2 7735 B12R1.17 NC(CCO)c1cc(Cl)[n]cc1 Amb22296964 [0,2,0,0,0,0|1,0,0]=3 7736 B12R1.17 NC(CCO)c1cc(F)[n]cc1 Amb25324412 [0,2,0,0,0,0|1,0,0]=3 7737 B12R1.17 NC(CCO)c1cc(O)ccc1 Amb19887678 [0,2,0,0,0,0|0,0,0]=2 7738 B12R1.17 NC(CCO)c1cc(S)ccc1 Amb24655390 [0,2,0,0,0,0|0,0,0]=2 7739 B12R1.17 NCCC(=O)c1cc(Br)ccc1 Amb18121501 [0,2,0,0,0,0|1,0,1]=4 7740 B12R1.17 NCCC(N)c1cc[n]c(Br)c1 Amb24697935 [0,2,0,0,0,0|2,0,0]=4 7741 B12R1.17 NCCC(O)c1cc(Br)ccc1 Amb18121493 [0,2,0,0,0,0|1,0,0]=3 7742 B12R1.17 NCCC(O)c1cc(I)ccc1 Amb24493265 [0,2,0,0,0,0|1,0,0]=3 7743 B12R1.17 NCCC(O)c1cc(O)ccc1 Amb18251885 [0,2,0,0,0,0|1,0,0]=3 7744 B12R1.17 NCCC(c1cccc(c1)C)C Amb17232450 [0,2,0,0,0,0|1,0,0]=3 7745 B12R1.17 NCCC(c1cccc(c1)C)O Amb17232540 [0,2,0,0,0,0|1,0,0]=3 7746 B12R1.17 NCCC(c1cccc(c1)Cl)C Amb17234051 [0,2,0,0,0,0|1,0,0]=3 7747 B12R1.17 NCCC(c1cccc(c1)Cl)O Amb17234260 [0,2,0,0,0,0|1,0,0]=3 7748 B12R1.17 NCCC(c1cccc(c1)F)C Amb17232650 [0,2,0,0,0,0|1,0,0]=3 7749 B12R1.17 NCCC(c1cccc(c1)F)O Amb17232697 [0,2,0,0,0,0|1,0,0]=3 7750 B12R1.17 NCCN(c1cccc(c1)Br)C Amb17059773 [0,2,0,0,0,0|2,0,0]=4 7751 B12R1.17 NCCN(c1cccc(c1)C)C Amb17059641 [0,2,0,0,0,0|2,0,0]=4 7752 B12R1.17 NCCN(c1cccc(c1)Cl)C Amb17059646 [0,2,0,0,0,0|2,0,0]=4 7753 B12R1.17 NCCN(c1cccc(c1)F)C Amb17059643 [0,2,0,0,0,0|2,0,0]=4 7754 B12R1.17 NCCS(=O)c1cc(Br)ccc1 Amb18301434 [0,2,0,0,0,0|2,0,0]=4 7755 B12R1.17 NCCS(=O)c1cc(Cl)ccc1 Amb18299921 [0,2,0,0,0,0|2,0,0]=4 7756 B12R1.17 NCCS(=O)c1cc(F)ccc1 Amb24487393 [0,2,0,0,0,0|2,0,0]=4 7757 B12R1.17 NCC[C@@H](N)c1cccc(Br)c1 Amb25314552 [0,2,0,0,0,0|1,0,0]=3 7758 B12R1.17 NCC[C@@H](N)c1cccc(Cl)c1 Amb25850090 [0,2,0,0,0,0|1,0,0]=3 7759 B12R1.17 NCC[C@@H](N)c1cccc(F)c1 Amb24610239 [0,2,0,0,0,0|1,0,0]=3 7760 B12R1.17 NCC[C@@H](O)c1cc(Cl)ccc1 Amb25105024 [0,2,0,0,0,0|1,0,0]=3 7761 B12R1.17 NCC[C@H](N)c1cccc(Br)[n]1 Amb25302317 [0,2,0,0,0,0|2,0,0]=4 7762 B12R1.17 NCC[C@H](N)c1cccc(F)c1 Amb25230671 [0,2,0,0,0,0|1,0,0]=3 7763 B12R1.17 NNCC(O)c1cccc(F)c1 Amb18563928 [0,2,0,0,0,0|2,0,0]=4 7764 B12R1.17 NNCC(c1cccc(c1)Br)O Amb17249279 [0,2,0,0,0,0|2,0,0]=4 7765 B12R1.17 NNCC(c1cccc(c1)C)O Amb17232609 [0,2,0,0,0,0|2,0,0]=4 7766 B12R1.17 NNCC(c1cccc(c1)Cl)O Amb17234361 [0,2,0,0,0,0|2,0,0]=4 7767 B12R1.17 N[C@@H](CC#N)c1cccc(Cl)c1 Amb24351211 [0,2,0,0,0,0|1,0,1]=4 7768 B12R1.17 N[C@@H](CC#N)c1cccc(O)c1 Amb25820726 [0,2,0,0,0,0|1,0,1]=4 7769 B12R1.17 N[C@@H](CCO)c1c[n]cc(F)c1 Amb25048026 [0,2,0,0,0,0|1,0,0]=3 7770 B12R1.17 N[C@@H](CCO)c1cc(Br)[n]cc1 Amb24341990 [0,2,0,0,0,0|1,0,0]=3 7771 B12R1.17 N[C@@H](CCO)c1cc(Cl)ccc1 Amb19888404 [0,2,0,0,0,0|0,0,0]=2 7772 B12R1.17 N[C@@H](CCO)c1cc(F)ccc1 Amb19888379 [0,2,0,0,0,0|0,0,0]=2 7773 B12R1.17 N[C@@H](CCO)c1cc(O)[n]cc1 Amb24715791 [0,2,0,0,0,0|1,0,0]=3 7774 B12R1.17 N[C@@H](CCO)c1cc(O)c[n]c1 Amb25709599 [0,2,0,0,0,0|1,0,0]=3 7775 B12R1.17 N[C@@H](CCO)c1cc(O)ccc1 Amb19888375 [0,2,0,0,0,0|0,0,0]=2 7776 B12R1.17 N[C@@H](CCO)c1cc(O)ccc1 Amb19929578 [0,2,0,0,0,0|0,0,0]=2 7777 B12R1.17 N[C@@H](CCO)c1cc(S)ccc1 Amb24745621 [0,2,0,0,0,0|0,0,0]=2 7778 B12R1.17 N[C@@H](CCO)c1cccc(Br)[n]1 Amb25055651 [0,2,0,0,0,0|1,0,0]=3 7779 B12R1.17 N[C@@H](CCO)c1cccc(Cl)[n]1 Amb24460351 [0,2,0,0,0,0|1,0,0]=3 7780 B12R1.17 N[C@@H](CCO)c1cccc(O)[n]1 Amb24618184 [0,2,0,0,0,0|1,0,0]=3 7781 B12R1.17 N[C@H](CC#N)c1cccc(Cl)c1 Amb24573692 [0,2,0,0,0,0|1,0,1]=4 7782 B12R1.17 N[C@H](CC#N)c1cccc(F)c1 Amb24674109 [0,2,0,0,0,0|1,0,1]=4 7783 B12R1.17 N[C@H](CC#N)c1cccc(S)c1 Amb24364680 [0,2,0,0,0,0|1,0,1]=4 7784 B12R1.17 N[C@H](CCO)c1c[n]cc(Br)c1 Amb25758880 [0,2,0,0,0,0|1,0,0]=3 7785 B12R1.17 N[C@H](CCO)c1cc(Br)ccc1 Amb19887619 [0,2,0,0,0,0|0,0,0]=2 7786 B12R1.17 N[C@H](CCO)c1cc(Br)ccc1 Amb19943918 [0,2,0,0,0,0|0,0,0]=2 7787 B12R1.17 N[C@H](CCO)c1cc(Cl)[n]cc1 Amb24488508 [0,2,0,0,0,0|1,0,0]=3 7788 B12R1.17 N[C@H](CCO)c1cc(Cl)ccc1 Amb19887652 [0,2,0,0,0,0|0,0,0]=2 7789 B12R1.17 N[C@H](CCO)c1cc(F)ccc1 Amb19887668 [0,2,0,0,0,0|0,0,0]=2 7790 B12R1.17 N[C@H](CCO)c1cc(F)ccc1 Amb19888995 [0,2,0,0,0,0|0,0,0]=2 7791 B12R1.17 N[C@H](CCO)c1cc(O)[n]cc1 Amb24433305 [0,2,0,0,0,0|1,0,0]=3 7792 B12R1.17 N[C@H](CCO)c1cc(O)c[n]c1 Amb25758090 [0,2,0,0,0,0|1,0,0]=3 7793 B12R1.17 N[C@H](CCO)c1cc(O)cc[n]1 Amb25119351 [0,2,0,0,0,0|1,0,0]=3 7794 B12R1.17 N[C@H](CCO)c1cc(O)ccc1 Amb19887679 [0,2,0,0,0,0|0,0,0]=2 7795 B12R1.17 N[C@H](CCO)c1cccc(Br)[n]1 Amb24483637 [0,2,0,0,0,0|1,0,0]=3 7796 B12R1.17 N[C@H](CCO)c1cccc(F)[n]1 Amb24341639 [0,2,0,0,0,0|1,0,0]=3 7797 B12R1.17 Nc1c[n]cc(c1)C(N)CCO Amb25152307 [0,2,0,0,0,0|1,0,0]=3 7798 B12R1.17 Nc1cc(cc[n]1)[C@@H](N)CCO Amb24655927 [0,2,0,0,0,0|1,0,0]=3 7799 B12R1.17 Nc1cc(cc[n]1)[C@H](N)CCO Amb24487135 [0,2,0,0,0,0|1,0,0]=3 7800 B12R1.17 Nc1cc[n]c(c1)[C@@H](N)CCO Amb24674058 [0,2,0,0,0,0|1,0,0]=3 7801 B12R1.17 Nc1cccc(c1)C(N)CCO Amb19929590 [0,2,0,0,0,0|0,0,0]=2 7802 B12R1.17 Nc1cccc(c1)C(N)CCO Amb22235814 [0,2,0,0,0,0|0,0,0]=2 7803 B12R1.17 Nc1cccc(c1)[C@@H](N)CC#N Amb25707936 [0,2,0,0,0,0|1,0,1]=4 7804 B12R1.17 Nc1cccc(c1)[C@H](N)CC#N Amb25360884 [0,2,0,0,0,0|1,0,1]=4 7805 B12R1.17 Nc1cccc(c1)[C@H](N)CCO Amb19887593 [0,2,0,0,0,0|0,0,0]=2 7806 B12R1.17 O=C(CCBr)c1cccc(Cl)c1 Amb24483618 [0,2,0,0,0,0|1,0,1]=4 7807 B12R1.17 O=C(CCBr)c1cccc(F)c1 Amb25669661 [0,2,0,0,0,0|1,0,1]=4 7808 B12R1.17 O=C(CCBr)c1cccc(S)c1 Amb25312667 [0,2,0,0,0,0|1,0,1]=4 7809 B12R1.17 O=C(CCCl)c1cc(Cl)ccc1 Amb25742498 [0,2,0,0,0,0|1,0,1]=4 7810 B12R1.17 O=S(CCF)c1cc(F)ccc1 Amb24602311 [0,2,0,0,0,0|2,0,0]=4 7811 B12R1.17 OC(CC=O)c1cccc(Br)c1 Amb25258748 [0,2,0,0,0,0|0,0,2]=4 7812 B12R1.17 OCCC(=O)c1cc(Cl)[n]cc1 Amb25156807 [0,2,0,0,0,0|1,0,1]=4 7813 B12R1.17 OCCC(Cl)c1cc(F)ccc1 Amb24444966 [0,2,0,0,0,0|0,0,0]=2 7814 B12R1.17 OCCC(O)c1cc[n]c(Cl)c1 Amb22298355 [0,2,0,0,0,0|1,0,0]=3 7815 B12R1.17 OCCC(O)c1cccc(Br)c1 Amb24513513 [0,2,0,0,0,0|0,0,0]=2 7816 B12R1.17 OCCC(O)c1cccc(F)c1 Amb24406026 [0,2,0,0,0,0|0,0,0]=2 7817 B12R1.17 OCCC(c1cccc(c1)C)C Amb17232501 [0,2,0,0,0,0|0,0,0]=2 7818 B12R1.17 OCCC(c1cccc(c1)C)N Amb17103954 [0,2,0,0,0,0|0,0,0]=2 7819 B12R1.17 OCCC(c1cccc(c1)Cl)C Amb17234166 [0,2,0,0,0,0|0,0,0]=2 7820 B12R1.17 OCCC(c1cccc(c1)Cl)N Amb2417047 [0,2,0,0,0,0|0,0,0]=2 7821 B12R1.17 OCCC(c1cccc(c1)F)C Amb17232674 [0,2,0,0,0,0|0,0,0]=2 7822 B12R1.17 OCCN(c1cccc(c1)Br)C Amb17344452 [0,2,0,0,0,0|1,0,0]=3 7823 B12R1.17 OCCN(c1cccc(c1)C)C Amb17334644 [0,2,0,0,0,0|1,0,0]=3 7824 B12R1.17 OCCN(c1cccc(c1)Cl)C Amb17335811 [0,2,0,0,0,0|1,0,0]=3 7825 B12R1.17 OCCN(c1cccc(c1)F)C Amb17334765 [0,2,0,0,0,0|1,0,0]=3 7826 B12R1.17 OCCS(=O)c1cc(F)ccc1 Amb24354278 [0,2,0,0,0,0|1,0,0]=3 7827 B12R1.17 OCC[C@@H](O)c1cccc(Cl)c1 Amb25049479 [0,2,0,0,0,0|0,0,0]=2 7828 B12R1.17 OCC[C@@H](O)c1cccc(F)c1 Amb24405405 [0,2,0,0,0,0|0,0,0]=2 7829 B12R1.17 OCNC(=O)c1cccc(Cl)c1 Amb24666791 [0,2,0,0,0,0|1,0,1]=4 7830 B12R1.17 ONCC(c1cccc(c1)Br)O Amb17345006 [0,2,0,0,0,0|1,0,0]=3 7831 B12R1.17 ONCC(c1cccc(c1)C)O Amb17334703 [0,2,0,0,0,0|1,0,0]=3 7832 B12R1.17 ONCC(c1cccc(c1)Cl)O Amb17335948 [0,2,0,0,0,0|1,0,0]=3 7833 B12R1.17 ONCC(c1cccc(c1)O)O Amb17334759 [0,2,0,0,0,0|1,0,0]=3 7834 B12R1.17 O[C@@H](CCCl)c1cc(Cl)ccc1 Amb24655785 [0,2,0,0,0,0|1,0,0]=3 7835 B12R1.17 Oc1cccc(c1)C(O)CCO Amb24430894 [0,2,0,0,0,0|0,0,0]=2 7836 B12R1.17 Oc1cccc(c1)[C@@H](O)CCO Amb24686857 [0,2,0,0,0,0|0,0,0]=2 7837 B12R1.17 Oc1cccc(c1)[C@H](O)CCO Amb25797566 [0,2,0,0,0,0|0,0,0]=2 7838 B12R1.30 BrCCCC(=O)c1ccccc1 Amb17247624 [0,2,0,0,0,0|1,0,0]=3 7839 B12R1.30 BrCC\C=C(\c1ccccc1)/C Amb17246875 [0,2,0,0,0,0|1,0,1]=4 7840 B12R1.30 C#CCCC(Cl)c1ccccc1 Amb25756186 [0,2,0,0,0,0|1,0,0]=3 7841 B12R1.30 C#CCCC(O)c1c[n]ccc1 Amb25765608 [0,2,0,0,0,0|2,0,0]=4 7842 B12R1.30 C#CCCC(O)c1cccc[n]1 Amb25765607 [0,2,0,0,0,0|2,0,0]=4 7843 B12R1.30 C#CCCC(O)c1ccccc1 Amb18800360 [0,2,0,0,0,0|1,0,0]=3 7844 B12R1.30 C=C=CCC(Cl)c1ccccc1 Amb25700989 [0,2,0,0,0,0|1,0,1]=4 7845 B12R1.30 C=CCCC(N)c1ccccc1 Amb18126305 [0,2,0,0,0,0|1,0,0]=3 7846 B12R1.30 C=CCCN(c1ccccc1)C Amb10559130 [0,2,0,0,0,0|1,0,1]=4 7847 B12R1.30 CC#CCC(N)c1ccccc1 Amb18988278 [0,2,0,0,0,0|1,0,1]=4 7848 B12R1.30 CC#CCC(O)c1ccccc1 Amb18797803 [0,2,0,0,0,0|1,0,1]=4 7849 B12R1.30 CC#CC[C@H](N)c1ccccc1 Amb25055199 [0,2,0,0,0,0|1,0,1]=4 7850 B12R1.30 CC(=C=CCO)c1ccccc1 Amb25855530 [0,2,0,0,0,0|0,0,2]=4 7851 B12R1.30 CC(C#CCO)c1ccccc1 Amb24457769 [0,2,0,0,0,0|0,0,1]=3 7852 B12R1.30 CC(CCC=C)c1ccccc1 Amb24062989 [0,2,0,0,0,0|1,0,0]=3 7853 B12R1.30 CC(CCCN)c1ccccc1 Amb18563593 [0,2,0,0,0,0|1,0,0]=3 7854 B12R1.30 CC(CN=C=S)c1ccccc1 Amb25102676 [0,2,0,0,0,0|0,1,1]=4 7855 B12R1.30 CC(CNC#N)c1ccccc1 Amb24419584 [0,2,0,0,0,0|1,0,1]=4 7856 B12R1.30 CC(C\C=N\N)c1ccccc1 Amb24685554 [0,2,0,0,0,0|1,0,1]=4 7857 B12R1.30 CC(NCCO)c1c[n]cc[n]1 Amb21861913 [0,2,0,0,0,0|2,0,0]=4 7858 B12R1.30 CC(OCCO)c1ccccc1 Amb24103429 [0,2,0,0,0,0|0,0,0]=2 7859 B12R1.30 CC(SCC#C)c1ccccc1 Amb25763673 [0,2,0,0,0,0|1,0,1]=4 7860 B12R1.30 CC(\C=C\CCl)c1ccccc1 Amb25776220 [0,2,0,0,0,0|1,0,1]=4 7861 B12R1.30 CC(\C=C\CN)c1ccccc1 Amb24702766 [0,2,0,0,0,0|1,0,1]=4 7862 B12R1.30 CC(\N=C\CCl)c1ccccc1 Amb24558631 [0,2,0,0,0,0|1,0,1]=4 7863 B12R1.30 CC(c1ccccc1)SCC#N Amb17501742 [0,2,0,0,0,0|1,0,1]=4 7864 B12R1.30 CC=CCC(C)c1ccccc1 Amb24062990 [0,2,0,0,0,0|1,0,1]=4 7865 B12R1.30 CCC#CC(O)c1ccccc1 Amb24672537 [0,2,0,0,0,0|1,0,1]=4 7866 B12R1.30 CCC/N=C(\C)c1ccccc1 Amb17779516 [0,2,0,0,0,0|1,0,1]=4 7867 B12R1.30 CCCCC(=O)c1cccnc1 Amb10607964 [0,2,0,0,0,0|2,0,0]=4 7868 B12R1.30 CCCCC(=O)c1ccncc1 Amb10573758 [0,2,0,0,0,0|2,0,0]=4 7869 B12R1.30 CCCCC(N)c1cccc[n]1 Amb19026090 [0,2,0,0,0,0|2,0,0]=4 7870 B12R1.30 CCCCC(c1cccnc1)N Amb10607965 [0,2,0,0,0,0|2,0,0]=4 7871 B12R1.30 CCCCC(c1ccncc1)N Amb10573553 [0,2,0,0,0,0|2,0,0]=4 7872 B12R1.30 CCCCN(c1ccccc1)N Amb17226670 [0,2,0,0,0,0|1,0,0]=3 7873 B12R1.30 CCCNC(=N)c1ccccc1 Amb23447119 [0,2,0,0,0,0|1,0,1]=4 7874 B12R1.30 CCCNC(=S)c1ccccc1 Amb25827093 [0,2,0,0,0,0|1,0,1]=4 7875 B12R1.30 CCCNC(c1ccccc1)C Amb1833463 [0,2,0,0,0,0|1,0,0]=3 7876 B12R1.30 CCC\N=C(\Cl)/c1ccccc1 Amb25142394 [0,2,0,0,0,0|1,0,1]=4 7877 B12R1.30 CCNCC(N)c1ccccc1 Amb19009737 [0,2,0,0,0,0|1,0,0]=3 7878 B12R1.30 CCNCC(O)c1ccccc1 Amb22491734 [0,2,0,0,0,0|1,0,0]=3 7879 B12R1.30 CCNCC(c1ccccc1)C Amb2119469 [0,2,0,0,0,0|1,0,0]=3 7880 B12R1.30 CCNCC(c1ccccn1)O Amb17138608 [0,2,0,0,0,0|2,0,0]=4 7881 B12R1.30 CCNCC(c1cccnc1)O Amb17138609 [0,2,0,0,0,0|2,0,0]=4 7882 B12R1.30 CCNCC(c1ccncc1)O Amb17138610 [0,2,0,0,0,0|2,0,0]=4 7883 B12R1.30 CCOC[C@H](c1ccccc1)N Amb17061646 [0,2,0,0,0,0|1,0,0]=3 7884 B12R1.30 CC\C=C/C(N)c1ccccc1 Amb25696046 [0,2,0,0,0,0|1,0,1]=4 7885 B12R1.30 CC\C=C\C(O)c1ccccc1 Amb22546781 [0,2,0,0,0,0|1,0,1]=4 7886 B12R1.30 CC\C=N\C(C)c1ccccc1 Amb24436889 [0,2,0,0,0,0|1,0,1]=4 7887 B12R1.30 CN(c1ccccc1)CCC#C Amb10559135 [0,2,0,0,0,0|1,0,1]=4 7888 B12R1.30 CNCCC(=O)c1ccccc1 Amb11032366 [0,2,0,0,0,0|1,0,1]=4 7889 B12R1.30 CNCC[C@@H](O)c1ccccc1 Amb20240620 [0,2,0,0,0,0|1,0,0]=3 7890 B12R1.30 CNCC[C@@H](O)c1ccccc1 Amb22747753 [0,2,0,0,0,0|1,0,0]=3 7891 B12R1.30 COCCC(=O)c1ccccc1 Amb10602329 [0,2,0,0,0,0|0,0,1]=3 7892 B12R1.30 COCCC(O)c1ccccc1 Amb18788453 [0,2,0,0,0,0|0,0,0]=2 7893 B12R1.30 CO\C=C\C(O)c1ccccc1 Amb25204750 [0,2,0,0,0,0|0,0,2]=4 7894 B12R1.30 CO\N=C\C(C)c1ccccc1 Amb24403672 [0,2,0,0,0,0|1,0,1]=4 7895 B12R1.30 CO\N=C\C(O)c1ccccc1 Amb25788975 [0,2,0,0,0,0|1,0,1]=4 7896 B12R1.30 CO\N=C\[C@@H](O)c1ccccc1 Amb24592391 [0,2,0,0,0,0|1,0,1]=4 7897 B12R1.30 C[C@@H](CN=C=S)c1ccccc1 Amb19892937 [0,2,0,0,0,0|0,1,1]=4 7898 B12R1.30 C[C@@H](OCC=O)c1ccccc1 Amb22896802 [0,2,0,0,0,0|0,0,2]=4 7899 B12R1.30 C[C@@H](\N=C\CCl)c1ccccc1 Amb25187511 [0,2,0,0,0,0|1,0,1]=4 7900 B12R1.30 C[C@H](CN=C=S)c1ccccc1 Amb19892936 [0,2,0,0,0,0|0,1,1]=4 7901 B12R1.30 C[C@H]([NH2+]CCCl)c1ccccc1 Amb17773001 [0,2,0,0,0,0|1,0,0]=3 7902 B12R1.30 C\C(=C\CCCl)\c1ccccc1 Amb24394711 [0,2,0,0,0,0|1,0,1]=4 7903 B12R1.30 C\C=N\CC(O)c1ccccc1 Amb25256333 [0,2,0,0,0,0|1,0,1]=4 7904 B12R1.30 ClCC#CC(Cl)c1ccccc1 Amb25772764 [0,2,0,0,0,0|1,0,1]=4 7905 B12R1.30 ClCCCC(=O)c1ccccc1 Amb1229841 [0,2,0,0,0,0|1,0,0]=3 7906 B12R1.30 ClCCCC(c1ccccc1)O Amb17194564 [0,2,0,0,0,0|1,0,0]=3 7907 B12R1.30 ClCCCN(c1ccccc1)C Amb17335669 [0,2,0,0,0,0|1,0,0]=3 7908 B12R1.30 ClCCNC(=O)c1ccccc1 Amb2414312 [0,2,0,0,0,0|1,0,1]=4 7909 B12R1.30 ClCCNC(c1ccccc1)C Amb10069614 [0,2,0,0,0,0|1,0,0]=3 7910 B12R1.30 ClCCNC(c1ccccc1)C Amb17335659 [0,2,0,0,0,0|1,0,0]=3 7911 B12R1.30 ClCC\C=C(\c1ccccc1)/C Amb17233775 [0,2,0,0,0,0|1,0,1]=4 7912 B12R1.30 ClC\C=C\C(Cl)c1ccccc1 Amb24642037 [0,2,0,0,0,0|1,0,1]=4 7913 B12R1.30 Cl\C(=N/CCCl)\c1ccccc1 Amb25758706 [0,2,0,0,0,0|1,0,1]=4 7914 B12R1.30 ICCOC(=O)c1ccccc1 Amb16233230 [0,2,0,0,0,0|1,0,1]=4 7915 B12R1.30 N#CCCC(=O)c1ccccc1 Amb1672449 [0,2,0,0,0,0|1,0,1]=4 7916 B12R1.30 N#CCCC(Cl)c1ccccc1 Amb18648313 [0,2,0,0,0,0|1,0,0]=3 7917 B12R1.30 N#CCCC(O)c1cc[n]cc1 Amb24415879 [0,2,0,0,0,0|2,0,0]=4 7918 B12R1.30 N#CCCC(O)c1cccc[n]1 Amb25045309 [0,2,0,0,0,0|2,0,0]=4 7919 B12R1.30 N#CCCC(c1cccnc1)O Amb17232405 [0,2,0,0,0,0|2,0,0]=4 7920 B12R1.30 N#CCCS(=O)c1ccccc1 Amb18648265 [0,2,0,0,0,0|1,0,1]=4 7921 B12R1.30 N#CCC[C@H](O)c1ccccc1 Amb24466214 [0,2,0,0,0,0|1,0,0]=3 7922 B12R1.30 N#CNCC(O)c1ccccc1 Amb18800628 [0,2,0,0,0,0|1,0,1]=4 7923 B12R1.30 N=C(NCCF)c1ccccc1 Amb25351227 [0,2,0,0,0,0|1,0,1]=4 7924 B12R1.30 N=C(OCCO)c1ccccc1 Amb22465986 [0,2,0,0,0,0|0,0,1]=3 7925 B12R1.30 NC(\C=C\CO)c1ccccc1 Amb25312103 [0,2,0,0,0,0|0,0,1]=3 7926 B12R1.30 NCCCC(=O)c1ccc[n]c1 Amb18120064 [0,2,0,0,0,0|2,0,0]=4 7927 B12R1.30 NCCCC(=O)c1ccc[n]c1 Amb22831532 [0,2,0,0,0,0|2,0,0]=4 7928 B12R1.30 NCCCC(=O)c1ccccc1 Amb18623671 [0,2,0,0,0,0|1,0,0]=3 7929 B12R1.30 NCCCC(=O)c1cccnc1 Amb10602572 [0,2,0,0,0,0|2,0,0]=4 7930 B12R1.30 NCCCC(=O)c1cccnc1 Amb17608288 [0,2,0,0,0,0|2,0,0]=4 7931 B12R1.30 NCCCC(O)c1cc[n]cc1 Amb18563731 [0,2,0,0,0,0|2,0,0]=4 7932 B12R1.30 NCCCC(O)c1cccc[n]1 Amb18563728 [0,2,0,0,0,0|2,0,0]=4 7933 B12R1.30 NCCCC(O)c1ccccc1 Amb21984517 [0,2,0,0,0,0|1,0,0]=3 7934 B12R1.30 NCCCC(c1ccccc1)O Amb17079154 [0,2,0,0,0,0|1,0,0]=3 7935 B12R1.30 NCCCC(c1ccccn1)N Amb10070102 [0,2,0,0,0,0|2,0,0]=4 7936 B12R1.30 NCCCC(c1cccnc1)N Amb10070101 [0,2,0,0,0,0|2,0,0]=4 7937 B12R1.30 NCCCC(c1cccnc1)O Amb17232606 [0,2,0,0,0,0|2,0,0]=4 7938 B12R1.30 NCCCC(c1ccncc1)N Amb10070100 [0,2,0,0,0,0|2,0,0]=4 7939 B12R1.30 NCCNC(c1ccccc1)C Amb17091024 [0,2,0,0,0,0|1,0,0]=3 7940 B12R1.30 NCCOC(=O)c1ccccc1 Amb10807731 [0,2,0,0,0,0|1,0,1]=4 7941 B12R1.30 NCCSC(=O)c1ccccc1 Amb21618899 [0,2,0,0,0,0|1,0,1]=4 7942 B12R1.30 NCCSC(c1ccccc1)C Amb17500453 [0,2,0,0,0,0|1,0,0]=3 7943 B12R1.30 NCC\C=C(\c1ccccc1)/C Amb17232384 [0,2,0,0,0,0|1,0,1]=4 7944 B12R1.30 NOCCN(c1ccccc1)C Amb17104857 [0,2,0,0,0,0|1,0,0]=3 7945 B12R1.30 N[C@@H](CCCO)c1ccccc1 Amb23440411 [0,2,0,0,0,0|0,0,0]=2 7946 B12R1.30 O=C(NCCF)c1ccccc1 Amb25139529 [0,2,0,0,0,0|1,0,1]=4 7947 B12R1.30 O=C(NCCI)c1ccccc1 Amb22753771 [0,2,0,0,0,0|1,0,1]=4 7948 B12R1.30 O=C=NCC(Cl)c1ccccc1 Amb24692969 [0,2,0,0,0,0|0,0,2]=4 7949 B12R1.30 OC(CNC=O)c1ccccc1 Amb18792635 [0,2,0,0,0,0|0,0,2]=4 7950 B12R1.30 OC(C\C=C/Cl)c1ccccc1 Amb25109311 [0,2,0,0,0,0|1,0,1]=4 7951 B12R1.30 OC(c1ccccc1)CCC#N Amb17232364 [0,2,0,0,0,0|1,0,0]=3 7952 B12R1.30 OCC#CC(=O)c1ccccc1 Amb22495841 [0,2,0,0,0,0|0,0,2]=4 7953 B12R1.30 OCC#CS(=O)c1ccccc1 Amb24431904 [0,2,0,0,0,0|0,0,2]=4 7954 B12R1.30 OCC#C[C@H](O)c1ccccc1 Amb24588419 [0,2,0,0,0,0|0,0,1]=3 7955 B12R1.30 OCCCC(=O)c1ccccc1 Amb17334609 [0,2,0,0,0,0|0,0,0]=2 7956 B12R1.30 OCCCC(=O)c1cccnc1 Amb17615812 [0,2,0,0,0,0|1,0,0]=3 7957 B12R1.30 OCCCC(c1ccccc1)O Amb17334675 [0,2,0,0,0,0|0,0,0]=2 7958 B12R1.30 OCCCC(c1cccnc1)O Amb17619700 [0,2,0,0,0,0|1,0,0]=3 7959 B12R1.30 OCCNC(=O)c1ccccn1 Amb1951218 [0,2,0,0,0,0|1,0,1]=4 7960 B12R1.30 OCCNC(=S)c1c[n]ccc1 Amb24407503 [0,2,0,0,0,0|1,0,1]=4 7961 B12R1.30 OCCNC(c1ccccc1)C Amb2092663 [0,2,0,0,0,0|0,0,0]=2 7962 B12R1.30 OCCOC(=N)c1ccccn1 Amb10553000 [0,2,0,0,0,0|1,0,1]=4 7963 B12R1.30 OCCOC(=O)c1ccccc1 Amb1110468 [0,2,0,0,0,0|0,0,1]=3 7964 B12R1.30 OCC\C=C(\Cl)/c1ccccc1 Amb25204635 [0,2,0,0,0,0|0,0,1]=3 7965 B12R1.30 OCNNC(=O)c1ccccc1 Amb24608056 [0,2,0,0,0,0|1,0,1]=4 7966 B12R1.30 OC\C=C\C(=O)c1ccccc1 Amb24706829 [0,2,0,0,0,0|0,0,2]=4 7967 B12R1.30 OC\C=C\C(O)c1ccccc1 Amb25071691 [0,2,0,0,0,0|0,0,1]=3 7968 B12R1.30 OC\C=C\[C@@H](O)c1ccccc1 Amb25285682 [0,2,0,0,0,0|0,0,1]=3 7969 B12R1.30 O[C@H](C\C=C/Cl)c1ccccc1 Amb25751194 [0,2,0,0,0,0|1,0,1]=4 7970 B12R1.30 O\N=C/CC(=O)c1ccccc1 Amb25833653 [0,2,0,0,0,0|0,0,2]=4 7971 B12R1.30 O\N=C\CC(O)c1ccccc1 Amb25156836 [0,2,0,0,0,0|0,0,1]=3 7972 B12R1.30 [C-]#[N+]CCC(F)c1ccccc1 Amb25217234 [0,2,0,0,0,0|1,0,0]=3 7973 B12R1.30 [N-]=[N+]=NCC(Cl)c1ccccc1 Amb25276328 [0,2,0,0,0,0|2,0,0]=4 7974 B12R1.30 [N-]=[N+]=NCC(N)c1ccccc1 Amb25694755 [0,2,0,0,0,0|2,0,0]=4 7975 B12R1.30 [N-]=[N+]=NCC(O)c1ccccc1 Amb18792465 [0,2,0,0,0,0|2,0,0]=4 7976 B12R1.30 [N-]=[N+]=NC[C@@H](N)c1ccccc1 Amb24398753 [0,2,0,0,0,0|2,0,0]=4 7977 B12R1.30 [N-]=[N+]=NC[C@H](O)c1ccccc1 Amb25102649 [0,2,0,0,0,0|2,0,0]=4 7978 B12R1.34 BrCC(Br)C(Br)c1ccccc1 Amb25114235 [0,2,0,0,0,0|1,0,0]=3 7979 B12R1.34 C#CC(F)C(O)c1ccccc1 Amb25129675 [0,2,0,0,0,0|1,0,1]=4 7980 B12R1.34 C#C[C@@H](O)[C@@H](O)c1ccccc1 Amb25138509 [0,2,0,0,0,0|1,0,1]=4 7981 B12R1.34 C#C[C@H](F)[C@@H](O)c1ccccc1 Amb24733476 [0,2,0,0,0,0|1,0,1]=4 7982 B12R1.34 C#C[C@H](O)[C@@H](O)c1ccccc1 Amb24748425 [0,2,0,0,0,0|1,0,1]=4 7983 B12R1.34 C=C(C(O)CO)c1ccccc1 Amb25333663 [0,2,0,0,0,0|0,0,1]=3 7984 B12R1.34 C=C(CO)C(=O)c1ccccc1 Amb24645413 [0,2,0,0,0,0|0,0,2]=4 7985 B12R1.34 C=C(CO)C(O)c1ccccc1 Amb24671500 [0,2,0,0,0,0|0,0,1]=3 7986 B12R1.34 C=C(CO)S(=O)c1ccccc1 Amb24497581 [0,2,0,0,0,0|1,0,1]=4 7987 B12R1.34 C=CC(C(c1ccccc1)O)C Amb10567365 [0,2,0,0,0,0|1,0,1]=4 7988 B12R1.34 C=CC(Cl)C(O)c1ccccc1 Amb24374608 [0,2,0,0,0,0|1,0,1]=4 7989 B12R1.34 C=CC(N)C(O)c1ccccc1 Amb24106047 [0,2,0,0,0,0|1,0,1]=4 7990 B12R1.34 C=CC(O)C(N)c1ccccc1 Amb22831164 [0,2,0,0,0,0|1,0,1]=4 7991 B12R1.34 C=CC(O)C(O)c1ccccc1 Amb24704468 [0,2,0,0,0,0|1,0,1]=4 7992 B12R1.34 C=CC(O)[C@H](N)c1ccccc1 Amb24468873 [0,2,0,0,0,0|1,0,1]=4 7993 B12R1.34 C=C[C@@H](N)[C@H](O)c1ccccc1 Amb24386492 [0,2,0,0,0,0|1,0,1]=4 7994 B12R1.34 C=C[C@@H](O)[C@@H](N)c1ccccc1 Amb25375938 [0,2,0,0,0,0|1,0,1]=4 7995 B12R1.34 C=C[C@@H](O)[C@@H](O)c1ccccc1 Amb25279737 [0,2,0,0,0,0|1,0,1]=4 7996 B12R1.34 C=C[C@H](Cl)[C@@H](O)c1ccccc1 Amb25241929 [0,2,0,0,0,0|1,0,1]=4 7997 B12R1.34 C=C[C@H](N)[C@@H](N)c1ccccc1 Amb25758971 [0,2,0,0,0,0|1,0,1]=4 7998 B12R1.34 C=C[C@H](O)[C@@H](O)c1ccccc1 Amb25859224 [0,2,0,0,0,0|1,0,1]=4 7999 B12R1.34 C=C[C@H](O)[C@H](O)c1ccccc1 Amb25058473 [0,2,0,0,0,0|1,0,1]=4 8000 B12R1.34 CC(C#C)C(O)c1ccccc1 Amb25145323 [0,2,0,0,0,0|1,0,1]=4 8001 B12R1.34 CC(C(=O)CBr)c1ccccc1 Amb25134301 [0,2,0,0,0,0|1,0,1]=4 8002 B12R1.34 CC(C(=O)CCl)c1ccccc1 Amb25150842 [0,2,0,0,0,0|1,0,1]=4 8003 B12R1.34 CC(C(=O)CN)c1ccccc1 Amb24535411 [0,2,0,0,0,0|1,0,1]=4 8004 B12R1.34 CC(C(=O)NO)c1ccccc1 Amb25800798 [0,2,0,0,0,0|1,0,1]=4 8005 B12R1.34 CC(C(Br)CC)c1cccc[n]1 Amb24737683 [0,2,0,0,0,0|2,0,0]=4 8006 B12R1.34 CC(C(Br)CC)c1ccccc1 Amb25805104 [0,2,0,0,0,0|1,0,0]=3 8007 B12R1.34 CC(C(C)C=O)c1ccccc1 Amb24065337 [0,2,0,0,0,0|0,0,2]=4 8008 B12R1.34 CC(C(C)CN)c1c[n]ccc1 Amb18828712 [0,2,0,0,0,0|2,0,0]=4 8009 B12R1.34 CC(C(C)CN)c1ccccc1 Amb18829124 [0,2,0,0,0,0|1,0,0]=3 8010 B12R1.34 CC(C(C)NN)c1ccccc1 Amb24488638 [0,2,0,0,0,0|2,0,0]=4 8011 B12R1.34 CC(C(Cl)C#N)c1ccccc1 Amb18791080 [0,2,0,0,0,0|1,0,1]=4 8012 B12R1.34 CC(C(Cl)C=O)c1ccccc1 Amb18648719 [0,2,0,0,0,0|0,0,2]=4 8013 B12R1.34 CC(C(F)CO)c1ccccc1 Amb25316277 [0,2,0,0,0,0|0,0,0]=2 8014 B12R1.34 CC(C(N)C#C)c1ccccc1 Amb25159878 [0,2,0,0,0,0|1,0,1]=4 8015 B12R1.34 CC(C(N)C#N)c1ccccc1 Amb18953074 [0,2,0,0,0,0|1,0,1]=4 8016 B12R1.34 CC(C(N)CC)c1cc[n]cc1 Amb18828706 [0,2,0,0,0,0|2,0,0]=4 8017 B12R1.34 CC(C(N)CC)c1cccc[n]1 Amb18828694 [0,2,0,0,0,0|2,0,0]=4 8018 B12R1.34 CC(C(N)CC)c1ccccc1 Amb18829127 [0,2,0,0,0,0|1,0,0]=3 8019 B12R1.34 CC(C(N)CC)c1ccccc1 Amb20623710 [0,2,0,0,0,0|1,0,0]=3 8020 B12R1.34 CC(C(N)CN)c1ccccc1 Amb18972125 [0,2,0,0,0,0|1,0,0]=3 8021 B12R1.34 CC(C(N)CO)c1ccccc1 Amb18975503 [0,2,0,0,0,0|0,0,0]=2 8022 B12R1.34 CC(C(N)CO)c1ccccc1 Amb19349648 [0,2,0,0,0,0|0,0,0]=2 8023 B12R1.34 CC(C(O)C#C)c1ccccc1 Amb25700248 [0,2,0,0,0,0|1,0,1]=4 8024 B12R1.34 CC(C(O)C#N)c1ccccc1 Amb18788076 [0,2,0,0,0,0|1,0,1]=4 8025 B12R1.34 CC(C(O)C=C)c1ccccc1 Amb25310831 [0,2,0,0,0,0|1,0,1]=4 8026 B12R1.34 CC(C(O)CC)c1cccc[n]1 Amb24367087 [0,2,0,0,0,0|2,0,0]=4 8027 B12R1.34 CC(CC)C(Br)c1ccccc1 Amb24618999 [0,2,0,0,0,0|1,0,0]=3 8028 B12R1.34 CC(CC)C(Cl)c1c[n]ccc1 Amb25156869 [0,2,0,0,0,0|2,0,0]=4 8029 B12R1.34 CC(CC)C(Cl)c1ccccc1 Amb19057046 [0,2,0,0,0,0|1,0,0]=3 8030 B12R1.34 CC(CC)C(N)c1cc[n]cc1 Amb18828651 [0,2,0,0,0,0|2,0,0]=4 8031 B12R1.34 CC(CC)C(N)c1cccc[n]1 Amb25674376 [0,2,0,0,0,0|2,0,0]=4 8032 B12R1.34 CC(CC)C(O)c1c[n]ccc1 Amb24665088 [0,2,0,0,0,0|2,0,0]=4 8033 B12R1.34 CC(CC)C(O)c1cc[n]cc1 Amb24446286 [0,2,0,0,0,0|2,0,0]=4 8034 B12R1.34 CC(CC)C(O)c1cccc[n]1 Amb24437193 [0,2,0,0,0,0|2,0,0]=4 8035 B12R1.34 CC(CC)C(O)c1ccccc1 Amb18792585 [0,2,0,0,0,0|1,0,0]=3 8036 B12R1.34 CC(CC)[C@@H](N)c1c[n]ccc1 Amb25201730 [0,2,0,0,0,0|2,0,0]=4 8037 B12R1.34 CC(CC)[C@@H](N)c1ccccc1 Amb23438852 [0,2,0,0,0,0|1,0,0]=3 8038 B12R1.34 CC(CC)[C@@H](O)c1ccccc1 Amb25158043 [0,2,0,0,0,0|1,0,0]=3 8039 B12R1.34 CC(CN)C(=O)c1ccccc1 Amb18829249 [0,2,0,0,0,0|1,0,1]=4 8040 B12R1.34 CC(CN)C(O)c1ccc[n]c1 Amb25762523 [0,2,0,0,0,0|2,0,0]=4 8041 B12R1.34 CC(CN)C(O)c1cccc[n]1 Amb25380785 [0,2,0,0,0,0|2,0,0]=4 8042 B12R1.34 CC(CN)C(O)c1ccccc1 Amb18646366 [0,2,0,0,0,0|1,0,0]=3 8043 B12R1.34 CC(CN)S(=O)c1ccccc1 Amb24469474 [0,2,0,0,0,0|2,0,0]=4 8044 B12R1.34 CC(CO)C(N)c1ccccc1 Amb18646383 [0,2,0,0,0,0|0,0,0]=2 8045 B12R1.34 CC(CO)C(O)c1c[n]ccc1 Amb25036612 [0,2,0,0,0,0|1,0,0]=3 8046 B12R1.34 CC(CO)C(O)c1cc[n]cc1 Amb24412972 [0,2,0,0,0,0|1,0,0]=3 8047 B12R1.34 CC(CO)C(O)c1ccccc1 Amb25220934 [0,2,0,0,0,0|0,0,0]=2 8048 B12R1.34 CC(CO)N(C)c1cc[n]cc1 Amb25781190 [0,2,0,0,0,0|2,0,0]=4 8049 B12R1.34 CC(CO)N(C)c1cccc[n]1 Amb25071051 [0,2,0,0,0,0|2,0,0]=4 8050 B12R1.34 CC(CO)[C@@H](O)c1ccccc1 Amb25832639 [0,2,0,0,0,0|0,0,0]=2 8051 B12R1.34 CC(NC)C(N)c1ccccc1 Amb24652517 [0,2,0,0,0,0|2,0,0]=4 8052 B12R1.34 CC(NC)C(O)c1ccccc1 Amb20246611 [0,2,0,0,0,0|2,0,0]=4 8053 B12R1.34 CC(NC)C(O)c1ccccc1 Amb22489693 [0,2,0,0,0,0|2,0,0]=4 8054 B12R1.34 CC(NC)C(O)c1ccccc1 Amb22729748 [0,2,0,0,0,0|2,0,0]=4 8055 B12R1.34 CC(NO)C(=O)c1ccccc1 Amb25130640 [0,2,0,0,0,0|1,0,1]=4 8056 B12R1.34 CC(OC)C(Cl)c1ccccc1 Amb24391584 [0,2,0,0,0,0|2,0,0]=4 8057 B12R1.34 CC(OC)C(O)c1ccccc1 Amb18801037 [0,2,0,0,0,0|2,0,0]=4 8058 B12R1.34 CC(SC)C(N)c1ccccc1 Amb18648548 [0,2,0,0,0,0|2,0,0]=4 8059 B12R1.34 CC(SC)[C@H](O)c1ccccc1 Amb24648340 [0,2,0,0,0,0|2,0,0]=4 8060 B12R1.34 CC([NH2+]C)C(O)c1ccccc1 Amb22334155 [0,2,0,0,0,0|2,0,0]=4 8061 B12R1.34 CC(\C(\N)=N\O)c1ccccc1 Amb24595995 [0,2,0,0,0,0|1,0,1]=4 8062 B12R1.34 CCC(=C)C(C)c1ccccc1 Amb24617256 [0,2,0,0,0,0|1,0,1]=4 8063 B12R1.34 CCC(=C)[C@@H](O)c1ccccc1 Amb25356347 [0,2,0,0,0,0|1,0,1]=4 8064 B12R1.34 CCC(=O)C(c1ccccc1)Br Amb17596238 [0,2,0,0,0,0|1,0,1]=4 8065 B12R1.34 CCC(=O)[C@@H](C)c1ccccc1 Amb25706991 [0,2,0,0,0,0|1,0,1]=4 8066 B12R1.34 CCC(=O)[C@H](C)c1ccccc1 Amb25730209 [0,2,0,0,0,0|1,0,1]=4 8067 B12R1.34 CCC(=O)[C@H](N)c1ccccc1 Amb25757342 [0,2,0,0,0,0|1,0,1]=4 8068 B12R1.34 CCC(C(=O)c1ccccc1)N Amb17138555 [0,2,0,0,0,0|1,0,1]=4 8069 B12R1.34 CCC(C)C(=C)c1ccccc1 Amb24598173 [0,2,0,0,0,0|1,0,1]=4 8070 B12R1.34 CCC(C)N(C)c1ccccc1 Amb24525678 [0,2,0,0,0,0|2,0,0]=4 8071 B12R1.34 CCC(Cl)C(=O)c1ccccc1 Amb19074252 [0,2,0,0,0,0|1,0,1]=4 8072 B12R1.34 CCC(Cl)C(Cl)c1ccccc1 Amb25039087 [0,2,0,0,0,0|1,0,0]=3 8073 B12R1.34 CCC(F)C(O)c1ccccc1 Amb25158096 [0,2,0,0,0,0|1,0,0]=3 8074 B12R1.34 CCC(I)C(=O)c1ccccc1 Amb20621476 [0,2,0,0,0,0|1,0,1]=4 8075 B12R1.34 CCC(N)C(=O)c1ccccc1 Amb22549075 [0,2,0,0,0,0|1,0,1]=4 8076 B12R1.34 CCC(N)C(N)c1c[n]ccc1 Amb24558425 [0,2,0,0,0,0|2,0,0]=4 8077 B12R1.34 CCC(N)C(N)c1cccc[n]1 Amb25261365 [0,2,0,0,0,0|2,0,0]=4 8078 B12R1.34 CCC(N)C(N)c1ccccc1 Amb25765179 [0,2,0,0,0,0|1,0,0]=3 8079 B12R1.34 CCC(N)C(O)c1ccccc1 Amb19373101 [0,2,0,0,0,0|1,0,0]=3 8080 B12R1.34 CCC(O)C(=O)c1ccccc1 Amb18800792 [0,2,0,0,0,0|1,0,1]=4 8081 B12R1.34 CCC(O)C(N)c1ccc[n]c1 Amb25343553 [0,2,0,0,0,0|2,0,0]=4 8082 B12R1.34 CCC(O)C(O)c1c[n]ccc1 Amb25354449 [0,2,0,0,0,0|2,0,0]=4 8083 B12R1.34 CCC(O)C(O)c1cc[n]cc1 Amb24524979 [0,2,0,0,0,0|2,0,0]=4 8084 B12R1.34 CCC(O)C(O)c1cccc[n]1 Amb25769439 [0,2,0,0,0,0|2,0,0]=4 8085 B12R1.34 CC[C@@H](C)C(=O)c1ccccc1 Amb24724257 [0,2,0,0,0,0|1,0,1]=4 8086 B12R1.34 CC[C@@H](N)C(=O)c1ccccc1 Amb24595929 [0,2,0,0,0,0|1,0,1]=4 8087 B12R1.34 CC[C@@H](N)[C@@H](N)c1ccccc1 Amb25151083 [0,2,0,0,0,0|1,0,0]=3 8088 B12R1.34 CC[C@@H](N)[C@H](O)c1ccc[n]c1 Amb25228779 [0,2,0,0,0,0|2,0,0]=4 8089 B12R1.34 CC[C@@H](N)[C@H](O)c1ccccc1 Amb25793544 [0,2,0,0,0,0|1,0,0]=3 8090 B12R1.34 CC[C@@H](O)C(=O)c1ccccc1 Amb24691713 [0,2,0,0,0,0|1,0,1]=4 8091 B12R1.34 CC[C@@H](O)[C@@H](N)c1cc[n]cc1 Amb25251848 [0,2,0,0,0,0|2,0,0]=4 8092 B12R1.34 CC[C@@H](O)[C@@H](N)c1ccc[n]c1 Amb24450166 [0,2,0,0,0,0|2,0,0]=4 8093 B12R1.34 CC[C@@H](O)[C@@H](N)c1cccc[n]1 Amb25714479 [0,2,0,0,0,0|2,0,0]=4 8094 B12R1.34 CC[C@@H](O)[C@@H](N)c1ccccc1 Amb25760697 [0,2,0,0,0,0|1,0,0]=3 8095 B12R1.34 CC[C@@H](O)[C@H](N)c1ccccc1 Amb25301206 [0,2,0,0,0,0|1,0,0]=3 8096 B12R1.34 CC[C@H](C)C(=O)c1ccccc1 Amb24378367 [0,2,0,0,0,0|1,0,1]=4 8097 B12R1.34 CC[C@H](N)C(=O)c1ccccc1 Amb25302294 [0,2,0,0,0,0|1,0,1]=4 8098 B12R1.34 CC[C@H](N)[C@@H](N)c1cc[n]cc1 Amb24744764 [0,2,0,0,0,0|2,0,0]=4 8099 B12R1.34 CC[C@H](N)[C@@H](O)c1ccccc1 Amb24677748 [0,2,0,0,0,0|1,0,0]=3 8100 B12R1.34 CC[C@H](O)C(=O)c1ccccc1 Amb25799278 [0,2,0,0,0,0|1,0,1]=4 8101 B12R1.34 CC[C@H](O)[C@@H](O)c1ccccc1 Amb25280169 [0,2,0,0,0,0|1,0,0]=3 8102 B12R1.34 CC[C@H](O)[C@H](N)c1cc[n]cc1 Amb25245868 [0,2,0,0,0,0|2,0,0]=4 8103 B12R1.34 CC[C@H](O)[C@H](N)c1cccc[n]1 Amb25159912 [0,2,0,0,0,0|2,0,0]=4 8104 B12R1.34 CNC(C(c1ccccc1)Cl)C Amb17594731 [0,2,0,0,0,0|2,0,0]=4 8105 B12R1.34 CNC(C)C(C)c1ccccc1 Amb18645936 [0,2,0,0,0,0|2,0,0]=4 8106 B12R1.34 CN[C@@H](C)[C@@H](C)c1ccccc1 Amb25674163 [0,2,0,0,0,0|2,0,0]=4 8107 B12R1.34 CN[C@@H]([C@H](c1ccccc1)O)C Amb17613676 [0,2,0,0,0,0|2,0,0]=4 8108 B12R1.34 CN[C@H](C)[C@@H](C)c1ccccc1 Amb24373827 [0,2,0,0,0,0|2,0,0]=4 8109 B12R1.34 COC(C(c1ccccc1)N)C Amb1139088 [0,2,0,0,0,0|2,0,0]=4 8110 B12R1.34 COC(Cl)C(Cl)c1ccccc1 Amb24539299 [0,2,0,0,0,0|2,0,0]=4 8111 B12R1.34 COC(O)C(N)c1ccccc1 Amb24599253 [0,2,0,0,0,0|2,0,0]=4 8112 B12R1.34 CO[C@H](N)[C@@H](O)c1ccccc1 Amb25322160 [0,2,0,0,0,0|2,0,0]=4 8113 B12R1.34 C[C@@H](C(=O)NO)c1ccccc1 Amb24722255 [0,2,0,0,0,0|1,0,1]=4 8114 B12R1.34 C[C@@H](C=C)[C@@H](N)c1ccccc1 Amb25837307 [0,2,0,0,0,0|1,0,1]=4 8115 B12R1.34 C[C@@H](C=C)[C@@H](O)c1ccccc1 Amb25071531 [0,2,0,0,0,0|1,0,1]=4 8116 B12R1.34 C[C@@H](C=C)[C@H](N)c1ccccc1 Amb25053412 [0,2,0,0,0,0|1,0,1]=4 8117 B12R1.34 C[C@@H](C=C)[C@H](O)c1ccccc1 Amb25347648 [0,2,0,0,0,0|1,0,1]=4 8118 B12R1.34 C[C@@H](C=O)C(O)c1ccccc1 Amb24341884 [0,2,0,0,0,0|0,0,2]=4 8119 B12R1.34 C[C@@H](C=O)[C@H](O)c1ccccc1 Amb25780663 [0,2,0,0,0,0|0,0,2]=4 8120 B12R1.34 C[C@@H](CN)[C@@H](N)c1ccccc1 Amb25738664 [0,2,0,0,0,0|1,0,0]=3 8121 B12R1.34 C[C@@H](CN)[C@@H](O)c1ccccc1 Amb24711275 [0,2,0,0,0,0|1,0,0]=3 8122 B12R1.34 C[C@@H](CO)C(O)c1ccccc1 Amb25769383 [0,2,0,0,0,0|0,0,0]=2 8123 B12R1.34 C[C@@H](CO)N(C)c1cccc[n]1 Amb25742051 [0,2,0,0,0,0|2,0,0]=4 8124 B12R1.34 C[C@@H](CO)S(=O)c1ccccc1 Amb24733124 [0,2,0,0,0,0|1,0,0]=3 8125 B12R1.34 C[C@@H](CO)[C@@H](N)c1ccccc1 Amb25152441 [0,2,0,0,0,0|0,0,0]=2 8126 B12R1.34 C[C@@H](CO)[C@@H](O)c1ccccc1 Amb24497744 [0,2,0,0,0,0|0,0,0]=2 8127 B12R1.34 C[C@@H](CO)[C@H](N)c1ccccc1 Amb25320937 [0,2,0,0,0,0|0,0,0]=2 8128 B12R1.34 C[C@@H](CO)[C@H](O)c1c[n]ccc1 Amb24407542 [0,2,0,0,0,0|1,0,0]=3 8129 B12R1.34 C[C@@H](CO)[C@H](O)c1ccccc1 Amb24412993 [0,2,0,0,0,0|0,0,0]=2 8130 B12R1.34 C[C@@H](NC)C(Cl)c1ccccc1 Amb25366190 [0,2,0,0,0,0|2,0,0]=4 8131 B12R1.34 C[C@@H](NC)C(O)c1ccccc1 Amb25095866 [0,2,0,0,0,0|2,0,0]=4 8132 B12R1.34 C[C@@H](NC)[C@@H](O)c1ccccc1 Amb22366967 [0,2,0,0,0,0|2,0,0]=4 8133 B12R1.34 C[C@@H](NC)[C@@H](S)c1ccccc1 Amb25302304 [0,2,0,0,0,0|2,0,0]=4 8134 B12R1.34 C[C@@H](NC)[C@H](F)c1ccccc1 Amb24367049 [0,2,0,0,0,0|2,0,0]=4 8135 B12R1.34 C[C@@H](NC)[C@H](O)c1ccccc1 Amb19133732 [0,2,0,0,0,0|2,0,0]=4 8136 B12R1.34 C[C@@H](OC)[C@@H](Cl)c1ccccc1 Amb25751354 [0,2,0,0,0,0|2,0,0]=4 8137 B12R1.34 C[C@@H](OC)[C@@H](O)c1ccccc1 Amb24464720 [0,2,0,0,0,0|2,0,0]=4 8138 B12R1.34 C[C@@H](SC)[C@@H](O)c1ccccc1 Amb25106008 [0,2,0,0,0,0|2,0,0]=4 8139 B12R1.34 C[C@@H]([C@@H](Cl)C=O)c1ccccc1 Amb24634357 [0,2,0,0,0,0|0,0,2]=4 8140 B12R1.34 C[C@@H]([C@@H](F)CO)c1ccccc1 Amb24362837 [0,2,0,0,0,0|0,0,0]=2 8141 B12R1.34 C[C@@H]([C@@H](O)C#N)c1ccccc1 Amb25099408 [0,2,0,0,0,0|1,0,1]=4 8142 B12R1.34 C[C@@H]([C@@H](O)CF)c1ccccc1 Amb24372036 [0,2,0,0,0,0|1,0,0]=3 8143 B12R1.34 C[C@@H]([C@@H](O)CO)c1ccccc1 Amb24662545 [0,2,0,0,0,0|0,0,0]=2 8144 B12R1.34 C[C@@H]([C@H](Cl)C=O)c1ccccc1 Amb25322070 [0,2,0,0,0,0|0,0,2]=4 8145 B12R1.34 C[C@@H]([C@H](O)CC)c1ccccc1 Amb25317557 [0,2,0,0,0,0|1,0,0]=3 8146 B12R1.34 C[C@H](C(=O)NO)c1ccccc1 Amb24459061 [0,2,0,0,0,0|1,0,1]=4 8147 B12R1.34 C[C@H](C(Cl)C=O)c1ccccc1 Amb24358040 [0,2,0,0,0,0|0,0,2]=4 8148 B12R1.34 C[C@H](C=C)[C@H](O)c1ccccc1 Amb25246183 [0,2,0,0,0,0|1,0,1]=4 8149 B12R1.34 C[C@H](C=O)[C@@H](O)c1ccccc1 Amb25255331 [0,2,0,0,0,0|0,0,2]=4 8150 B12R1.34 C[C@H](CC)C(O)c1ccccc1 Amb24735208 [0,2,0,0,0,0|1,0,0]=3 8151 B12R1.34 C[C@H](CC)[C@@H](O)c1ccccc1 Amb25047673 [0,2,0,0,0,0|1,0,0]=3 8152 B12R1.34 C[C@H](CN)[C@@H](N)c1ccccc1 Amb25669594 [0,2,0,0,0,0|1,0,0]=3 8153 B12R1.34 C[C@H](CN)[C@@H](O)c1ccccc1 Amb24710137 [0,2,0,0,0,0|1,0,0]=3 8154 B12R1.34 C[C@H](CO)C(=O)c1ccccc1 Amb25139941 [0,2,0,0,0,0|0,0,1]=3 8155 B12R1.34 C[C@H](CO)N(C)c1cccc[n]1 Amb25160368 [0,2,0,0,0,0|2,0,0]=4 8156 B12R1.34 C[C@H](CO)[C@@H](N)c1ccccc1 Amb24373854 [0,2,0,0,0,0|0,0,0]=2 8157 B12R1.34 C[C@H](CO)[C@@H](O)c1c[n]ccc1 Amb24675561 [0,2,0,0,0,0|1,0,0]=3 8158 B12R1.34 C[C@H](CO)[C@@H](O)c1ccccc1 Amb25687837 [0,2,0,0,0,0|0,0,0]=2 8159 B12R1.34 C[C@H](CO)[C@H](O)c1c[n]ccc1 Amb25221434 [0,2,0,0,0,0|1,0,0]=3 8160 B12R1.34 C[C@H](CO)[C@H](O)c1ccccc1 Amb24448086 [0,2,0,0,0,0|0,0,0]=2 8161 B12R1.34 C[C@H](NC)[C@@H](Cl)c1ccccc1 Amb24692816 [0,2,0,0,0,0|2,0,0]=4 8162 B12R1.34 C[C@H](NC)[C@@H](S)c1ccccc1 Amb24453442 [0,2,0,0,0,0|2,0,0]=4 8163 B12R1.34 C[C@H](NC)[C@H](N)c1ccccc1 Amb24739761 [0,2,0,0,0,0|2,0,0]=4 8164 B12R1.34 C[C@H](NC)[C@H](O)c1ccccc1 Amb22351362 [0,2,0,0,0,0|2,0,0]=4 8165 B12R1.34 C[C@H](NC)[C@H](S)c1ccccc1 Amb24727185 [0,2,0,0,0,0|2,0,0]=4 8166 B12R1.34 C[C@H](NN)[C@H](O)c1ccccc1 Amb25346319 [0,2,0,0,0,0|2,0,0]=4 8167 B12R1.34 C[C@H](NO)[C@H](O)c1ccccc1 Amb24475112 [0,2,0,0,0,0|1,0,0]=3 8168 B12R1.34 C[C@H](OC)[C@@H](Cl)c1ccccc1 Amb25274934 [0,2,0,0,0,0|2,0,0]=4 8169 B12R1.34 C[C@H](OC)[C@H](O)c1ccccc1 Amb25106038 [0,2,0,0,0,0|2,0,0]=4 8170 B12R1.34 C[C@H]([C@@H](O)NC)c1ccccc1 Amb25803440 [0,2,0,0,0,0|2,0,0]=4 8171 B12R1.34 C[C@H]([C@H](N)CC)c1ccccc1 Amb25800098 [0,2,0,0,0,0|1,0,0]=3 8172 B12R1.34 C[C@H]([C@H](N)CO)c1ccccc1 Amb24427355 [0,2,0,0,0,0|0,0,0]=2 8173 B12R1.34 C[C@H]([C@H](O)C=C)c1ccccc1 Amb25097849 [0,2,0,0,0,0|1,0,1]=4 8174 B12R1.34 C[C@H]([C@H](O)CO)c1ccccc1 Amb24735213 [0,2,0,0,0,0|0,0,0]=2 8175 B12R1.34 C\C(=C(\F)/CO)\c1ccccc1 Amb24412960 [0,2,0,0,0,0|0,0,2]=4 8176 B12R1.34 C\C(=N/O)\C(C)c1ccccc1 Amb24518613 [0,2,0,0,0,0|1,0,1]=4 8177 B12R1.34 C\C(\CO)=C(\O)/c1ccccc1 Amb24520521 [0,2,0,0,0,0|0,0,2]=4 8178 B12R1.34 ClCC(C(=O)c1ccccc1)Br Amb17351480 [0,2,0,0,0,0|1,0,1]=4 8179 B12R1.34 ClCC(C(=O)c1ccccc1)Cl Amb17337895 [0,2,0,0,0,0|1,0,1]=4 8180 B12R1.34 N#CC(Cl)C(Cl)c1ccccc1 Amb18130480 [0,2,0,0,0,0|1,0,1]=4 8181 B12R1.34 N#CC(O)C(F)c1ccccc1 Amb25320704 [0,2,0,0,0,0|1,0,1]=4 8182 B12R1.34 N#CC(O)[C@@H](O)c1ccccc1 Amb24353058 [0,2,0,0,0,0|1,0,1]=4 8183 B12R1.34 N#C[C@@H](F)[C@@H](O)c1ccccc1 Amb24386850 [0,2,0,0,0,0|1,0,1]=4 8184 B12R1.34 N#C[C@@H](O)[C@H](O)c1ccccc1 Amb25157844 [0,2,0,0,0,0|1,0,1]=4 8185 B12R1.34 N#C[C@H](O)[C@@H](F)c1ccccc1 Amb25157415 [0,2,0,0,0,0|1,0,1]=4 8186 B12R1.34 N#C[C@H](O)[C@@H](O)c1ccccc1 Amb24705594 [0,2,0,0,0,0|1,0,1]=4 8187 B12R1.34 N#C[C@H](O)[C@H](O)c1ccccc1 Amb25285601 [0,2,0,0,0,0|1,0,1]=4 8188 B12R1.34 NC(C#N)C(F)c1ccccc1 Amb25335487 [0,2,0,0,0,0|1,0,1]=4 8189 B12R1.34 NC(C(=O)CCl)c1ccccc1 Amb24341671 [0,2,0,0,0,0|1,0,1]=4 8190 B12R1.34 NC(C(N)C#N)c1ccccc1 Amb25121131 [0,2,0,0,0,0|1,0,1]=4 8191 B12R1.34 NC(C(O)C#N)c1ccccc1 Amb24713669 [0,2,0,0,0,0|1,0,1]=4 8192 B12R1.34 NC(C(O)CO)c1ccccc1 Amb18646773 [0,2,0,0,0,0|0,0,0]=2 8193 B12R1.34 NC(CF)C(O)c1ccccc1 Amb25101573 [0,2,0,0,0,0|1,0,0]=3 8194 B12R1.34 NC(CN)C(O)c1ccccc1 Amb25150994 [0,2,0,0,0,0|1,0,0]=3 8195 B12R1.34 NC(CO)C(=O)c1ccccc1 Amb24711479 [0,2,0,0,0,0|0,0,1]=3 8196 B12R1.34 NC(CO)C(Cl)c1ccccc1 Amb25159303 [0,2,0,0,0,0|0,0,0]=2 8197 B12R1.34 NC(CO)C(F)c1ccccc1 Amb25299166 [0,2,0,0,0,0|0,0,0]=2 8198 B12R1.34 NC(CO)C(O)c1c[n]ccc1 Amb18826621 [0,2,0,0,0,0|1,0,0]=3 8199 B12R1.34 NC(CO)C(O)c1cccc[n]1 Amb25736521 [0,2,0,0,0,0|1,0,0]=3 8200 B12R1.34 NC(CO)[C@H](O)c1ccccc1 Amb25247266 [0,2,0,0,0,0|0,0,0]=2 8201 B12R1.34 NCC(Br)C(=O)c1ccccc1 Amb25188302 [0,2,0,0,0,0|1,0,1]=4 8202 B12R1.34 NCC(C(=O)c1ccccc1)N Amb10843426 [0,2,0,0,0,0|1,0,1]=4 8203 B12R1.34 NCC(C(c1ccccc1)C)O Amb17232553 [0,2,0,0,0,0|1,0,0]=3 8204 B12R1.34 NCC(F)C(F)c1ccccc1 Amb25851560 [0,2,0,0,0,0|1,0,0]=3 8205 B12R1.34 NCC(N(c1ccccc1)C)C Amb1128364 [0,2,0,0,0,0|2,0,0]=4 8206 B12R1.34 NCC(N(c1ccccc1)C)C Amb13949221 [0,2,0,0,0,0|2,0,0]=4 8207 B12R1.34 NCC(O)C(O)c1ccccc1 Amb19148004 [0,2,0,0,0,0|1,0,0]=3 8208 B12R1.34 NC[C@@H](O)[C@H](O)c1ccccc1 Amb24401596 [0,2,0,0,0,0|1,0,0]=3 8209 B12R1.34 NC[C@H](O)[C@@H](F)c1ccccc1 Amb24678302 [0,2,0,0,0,0|1,0,0]=3 8210 B12R1.34 NC[C@H](O)[C@@H](O)c1ccccc1 Amb24461599 [0,2,0,0,0,0|1,0,0]=3 8211 B12R1.34 NC[C@H](O)[C@H](O)c1ccccc1 Amb24695219 [0,2,0,0,0,0|1,0,0]=3 8212 B12R1.34 N[C@@H](C(=O)NO)c1ccccc1 Amb25061821 [0,2,0,0,0,0|1,0,1]=4 8213 B12R1.34 N[C@@H](CO)C(O)c1ccccc1 Amb24739572 [0,2,0,0,0,0|0,0,0]=2 8214 B12R1.34 N[C@@H](CO)[C@H](O)c1ccccc1 Amb24487235 [0,2,0,0,0,0|0,0,0]=2 8215 B12R1.34 N[C@H](CO)[C@@H](O)c1ccccc1 Amb25789451 [0,2,0,0,0,0|0,0,0]=2 8216 B12R1.34 N[C@H]([C@@H](N)C#N)c1ccccc1 Amb25084618 [0,2,0,0,0,0|1,0,1]=4 8217 B12R1.34 N[C@H]([C@H](N)CO)c1ccccc1 Amb24558772 [0,2,0,0,0,0|0,0,0]=2 8218 B12R1.34 N\C(=N\O)\C(O)c1ccccc1 Amb22052910 [0,2,0,0,0,0|1,0,1]=4 8219 B12R1.34 O=C(C(Br)CBr)c1ccccc1 Amb25087312 [0,2,0,0,0,0|1,0,1]=4 8220 B12R1.34 O=C(CCl)C(F)c1ccccc1 Amb24390277 [0,2,0,0,0,0|1,0,1]=4 8221 B12R1.34 O=CC(C(c1ccccc1)Br)Br Amb16233220 [0,2,0,0,0,0|0,0,2]=4 8222 B12R1.34 O=CC(Cl)C(Cl)c1ccccc1 Amb25123958 [0,2,0,0,0,0|0,0,2]=4 8223 B12R1.34 O=C[C@H](Cl)[C@@H](Cl)c1ccccc1 Amb25119234 [0,2,0,0,0,0|0,0,2]=4 8224 B12R1.34 OC(C(O)C=O)c1ccccc1 Amb25309597 [0,2,0,0,0,0|0,0,2]=4 8225 B12R1.34 OC(CCl)C(Cl)c1ccccc1 Amb25803612 [0,2,0,0,0,0|1,0,0]=3 8226 B12R1.34 OC(CO)C(F)c1ccccc1 Amb25792385 [0,2,0,0,0,0|0,0,0]=2 8227 B12R1.34 OCC(=O)C(O)c1ccc[n]c1 Amb25059701 [0,2,0,0,0,0|1,0,1]=4 8228 B12R1.34 OCC(=O)C(O)c1ccccc1 Amb24364158 [0,2,0,0,0,0|0,0,1]=3 8229 B12R1.34 OCC(=O)[C@@H](O)c1ccccc1 Amb24357245 [0,2,0,0,0,0|0,0,1]=3 8230 B12R1.34 OCC(C(c1ccccc1)O)Br Amb17596330 [0,2,0,0,0,0|0,0,0]=2 8231 B12R1.34 OCC(C(c1ccccc1)O)Cl Amb17594842 [0,2,0,0,0,0|0,0,0]=2 8232 B12R1.34 OCC(Cl)C(=O)c1ccccc1 Amb24104261 [0,2,0,0,0,0|0,0,1]=3 8233 B12R1.34 OCC(Cl)C(Cl)c1ccccc1 Amb25759065 [0,2,0,0,0,0|0,0,0]=2 8234 B12R1.34 OCC(F)C(=O)c1ccccc1 Amb24084171 [0,2,0,0,0,0|0,0,1]=3 8235 B12R1.34 OCC(O)C(O)c1cccc[n]1 Amb24550636 [0,2,0,0,0,0|1,0,0]=3 8236 B12R1.34 OC[C@@H](O)C(O)c1ccccc1 Amb25332503 [0,2,0,0,0,0|0,0,0]=2 8237 B12R1.34 OC[C@@H](O)[C@@H](O)c1cccc[n]1 Amb25200149 [0,2,0,0,0,0|1,0,0]=3 8238 B12R1.34 OC[C@@H](O)[C@H](O)c1cccc[n]1 Amb24641998 [0,2,0,0,0,0|1,0,0]=3 8239 B12R1.34 OC[C@@H](O)[C@H](O)c1ccccc1 Amb24496901 [0,2,0,0,0,0|0,0,0]=2 8240 B12R1.34 OC[C@H](Cl)[C@H](Cl)c1ccccc1 Amb25678650 [0,2,0,0,0,0|0,0,0]=2 8241 B12R1.34 OC[C@H](O)C(=O)c1ccccc1 Amb25086748 [0,2,0,0,0,0|0,0,1]=3 8242 B12R1.34 OC[C@H](O)[C@@H](O)c1ccccc1 Amb25816355 [0,2,0,0,0,0|0,0,0]=2 8243 B12R1.34 OC[C@H](O)[C@H](O)c1ccccc1 Amb24735337 [0,2,0,0,0,0|0,0,0]=2 8244 B12R1.34 ONC(=O)C(Cl)c1ccccc1 Amb25361902 [0,2,0,0,0,0|1,0,1]=4 8245 B12R1.34 ONC(=O)C(F)c1ccccc1 Amb25777677 [0,2,0,0,0,0|1,0,1]=4 8246 B12R1.34 ONC(=O)C(c1ccccc1)N Amb2430893 [0,2,0,0,0,0|1,0,1]=4 8247 B12R1.34 ONC(=O)[C@@H](O)c1ccccc1 Amb25071532 [0,2,0,0,0,0|1,0,1]=4 8248 B12R1.34 ONC(=O)[C@H](O)c1ccccc1 Amb25787201 [0,2,0,0,0,0|1,0,1]=4 8249 B12R1.34 O[C@@H](CCl)C(=O)c1ccccc1 Amb24365917 [0,2,0,0,0,0|1,0,1]=4 8250 B12R1.34 O[C@@H](CO)[C@@H](F)c1ccccc1 Amb25206688 [0,2,0,0,0,0|0,0,0]=2 8251 B12R1.34 O[C@@H](CO)[C@H](F)c1ccccc1 Amb25157359 [0,2,0,0,0,0|0,0,0]=2 8252 B12R1.34 O[C@@H]([C@@H](Cl)CO)c1ccccc1 Amb25321935 [0,2,0,0,0,0|0,0,0]=2 8253 B12R1.34 O[C@H]([C@@H](O)C=O)c1ccccc1 Amb25785152 [0,2,0,0,0,0|0,0,2]=4 8254 B12R1.39 BrCCS(=O)(=O)c1ccccc1 Amb17106167 [0,2,0,0,0,0|2,0,0]=4 8255 B12R1.39 CC(C)(CC#N)c1ccccc1 Amb18645224 [0,2,0,0,0,0|1,0,1]=4 8256 B12R1.39 CC(C)(CC=C)c1ccccc1 Amb25674101 [0,2,0,0,0,0|1,0,1]=4 8257 B12R1.39 CC(C)(CC=O)c1ccccc1 Amb18645712 [0,2,0,0,0,0|0,0,2]=4 8258 B12R1.39 CC(C)(CCBr)c1ccccc1 Amb25726868 [0,2,0,0,0,0|1,0,0]=3 8259 B12R1.39 CC(C)(CCCl)c1cc[n]cc1 Amb24710201 [0,2,0,0,0,0|2,0,0]=4 8260 B12R1.39 CC(C)(CCN)c1ccccc1 Amb22755963 [0,2,0,0,0,0|1,0,0]=3 8261 B12R1.39 CC(C)(CCO)c1ccccc1 Amb23440831 [0,2,0,0,0,0|0,0,0]=2 8262 B12R1.39 CC(C)(C[Hg]Cl)c1ccccc1 Amb22347662 [0,2,0,0,0,0|2,0,0]=4 8263 B12R1.39 CC(C)(C[Mg]Cl)c1ccccc1 Amb22336292 [0,2,0,0,0,0|2,0,0]=4 8264 B12R1.39 CC(C)(C[Zn]Cl)c1ccccc1 Amb22897847 [0,2,0,0,0,0|2,0,0]=4 8265 B12R1.39 CC(F)(CC#N)c1ccccc1 Amb24702719 [0,2,0,0,0,0|1,0,1]=4 8266 B12R1.39 CC(N)(CCO)c1c[n]cc[n]1 Amb25080470 [0,2,0,0,0,0|2,0,0]=4 8267 B12R1.39 CC(N)(CCO)c1c[n]ccc1 Amb25686451 [0,2,0,0,0,0|1,0,0]=3 8268 B12R1.39 CC(N)(CCO)c1cc[n]cc1 Amb25732906 [0,2,0,0,0,0|1,0,0]=3 8269 B12R1.39 CC(N)(CCO)c1cccc[n]1 Amb24468790 [0,2,0,0,0,0|1,0,0]=3 8270 B12R1.39 CC(N)(CCO)c1ccccc1 Amb18862633 [0,2,0,0,0,0|0,0,0]=2 8271 B12R1.39 CC(O)(CC=O)c1ccccc1 Amb18646085 [0,2,0,0,0,0|0,0,2]=4 8272 B12R1.39 CC(O)(CCCl)c1ccccc1 Amb25114796 [0,2,0,0,0,0|1,0,0]=3 8273 B12R1.39 CC(O)(CCN)c1c[n]ccc1 Amb18827674 [0,2,0,0,0,0|2,0,0]=4 8274 B12R1.39 CC(O)(CCN)c1cc[n]cc1 Amb18827672 [0,2,0,0,0,0|2,0,0]=4 8275 B12R1.39 CC(O)(CCN)c1cccc[n]1 Amb18827673 [0,2,0,0,0,0|2,0,0]=4 8276 B12R1.39 CC(O)(CCO)c1ccccc1 Amb25716950 [0,2,0,0,0,0|0,0,0]=2 8277 B12R1.39 CC(S)(CCO)c1ccccc1 Amb24630816 [0,2,0,0,0,0|0,0,0]=2 8278 B12R1.39 CCCC(F)(F)c1ccccc1 Amb19894549 [0,2,0,0,0,0|1,0,0]=3 8279 B12R1.39 CCCS(=O)(=O)c1ccccc1 Amb24485446 [0,2,0,0,0,0|2,0,0]=4 8280 B12R1.39 CNCC(C)(N)c1ccccc1 Amb18298752 [0,2,0,0,0,0|2,0,0]=4 8281 B12R1.39 COCC(C)(N)c1ccccc1 Amb18992592 [0,2,0,0,0,0|2,0,0]=4 8282 B12R1.39 COCC(C)(O)c1ccccc1 Amb18801043 [0,2,0,0,0,0|2,0,0]=4 8283 B12R1.39 COC[C@@](C)(N)c1ccccc1 Amb25856946 [0,2,0,0,0,0|2,0,0]=4 8284 B12R1.39 CSCC(C)(O)c1ccccc1 Amb19061286 [0,2,0,0,0,0|2,0,0]=4 8285 B12R1.39 C[C@@](N)(CC#N)c1ccccc1 Amb25059074 [0,2,0,0,0,0|1,0,1]=4 8286 B12R1.39 C[C@@](N)(CC=C)c1ccccc1 Amb25111215 [0,2,0,0,0,0|1,0,1]=4 8287 B12R1.39 C[C@@](N)(CCO)c1c[n]cc[n]1 Amb25716704 [0,2,0,0,0,0|2,0,0]=4 8288 B12R1.39 C[C@@](N)(CCO)c1c[n]ccc1 Amb25709797 [0,2,0,0,0,0|1,0,0]=3 8289 B12R1.39 C[C@@](N)(CCO)c1cc[n]cc1 Amb25776127 [0,2,0,0,0,0|1,0,0]=3 8290 B12R1.39 C[C@@](N)(CCO)c1cccc[n]1 Amb25704179 [0,2,0,0,0,0|1,0,0]=3 8291 B12R1.39 C[C@@](N)(CCO)c1ccccc1 Amb25097043 [0,2,0,0,0,0|0,0,0]=2 8292 B12R1.39 C[C@@](O)(CCCl)c1ccccc1 Amb25361033 [0,2,0,0,0,0|1,0,0]=3 8293 B12R1.39 C[C@](N)(CC#N)c1ccccc1 Amb24559923 [0,2,0,0,0,0|1,0,1]=4 8294 B12R1.39 C[C@](N)(CCO)c1c[n]cc[n]1 Amb25715290 [0,2,0,0,0,0|2,0,0]=4 8295 B12R1.39 C[C@](N)(CCO)c1cccc[n]1 Amb24341958 [0,2,0,0,0,0|1,0,0]=3 8296 B12R1.39 C[C@](O)(CCCl)c1ccccc1 Amb25667166 [0,2,0,0,0,0|1,0,0]=3 8297 B12R1.39 C[C@](S)(CCO)c1ccccc1 Amb25120134 [0,2,0,0,0,0|0,0,0]=2 8298 B12R1.39 C[Si](C)(CCCl)c1ccccc1 Amb25765655 [0,2,0,0,0,0|1,1,0]=4 8299 B12R1.39 C[Si](C)(CCO)c1ccccc1 Amb25788909 [0,2,0,0,0,0|0,1,0]=3 8300 B12R1.39 ClCCS(=O)(=O)c1ccccc1 Amb1034876 [0,2,0,0,0,0|2,0,0]=4 8301 B12R1.39 N#CCC(F)(F)c1ccccc1 Amb25070879 [0,2,0,0,0,0|1,0,1]=4 8302 B12R1.39 NC(O)(CCO)c1ccccc1 Amb24431011 [0,2,0,0,0,0|0,0,0]=2 8303 B12R1.39 NCCC(F)(F)c1c[n]ccc1 Amb24554774 [0,2,0,0,0,0|2,0,0]=4 8304 B12R1.39 NCCC(F)(F)c1cccc[n]1 Amb25159830 [0,2,0,0,0,0|2,0,0]=4 8305 B12R1.39 NCCC(c1ccccc1)(O)C Amb17594116 [0,2,0,0,0,0|1,0,0]=3 8306 B12R1.39 NCC[S+](=O)(c1ccccc1)[O-] Amb10230992 [0,2,0,0,0,0|2,0,0]=4 8307 B12R1.39 NNCC(F)(F)c1ccccc1 Amb25692683 [0,2,0,0,0,0|2,0,0]=4 8308 B12R1.39 NNCC(c1ccccc1)(O)C Amb17232616 [0,2,0,0,0,0|2,0,0]=4 8309 B12R1.39 NOCC(F)(F)c1ccccc1 Amb25842068 [0,2,0,0,0,0|2,0,0]=4 8310 B12R1.39 N[C@](O)(CCO)c1ccccc1 Amb25356322 [0,2,0,0,0,0|0,0,0]=2 8311 B12R1.39 O=S(=O)(CCF)c1ccccc1 Amb24734666 [0,2,0,0,0,0|2,0,0]=4 8312 B12R1.39 OCCP(O)(=O)c1ccccc1 Amb25706050 [0,2,0,0,0,0|1,0,0]=3 8313 B12R1.39 [C-]#[N+]CC(F)(F)c1ccccc1 Amb25249868 [0,2,0,0,0,0|2,0,0]=4 8314 B12R1.107 BrC(c1ccccc1)CN(C)C Amb10563751 [0,2,0,0,0,0|2,0,0]=4 8315 B12R1.107 C=C(CC(O)=O)c1ccccc1 Amb18645643 [0,2,0,0,0,0|0,0,2]=4 8316 B12R1.107 C=C(Cl)CC(O)c1ccccc1 Amb25359026 [0,2,0,0,0,0|1,0,1]=4 8317 B12R1.107 C=C(Cl)C[C@H](O)c1ccccc1 Amb25362960 [0,2,0,0,0,0|1,0,1]=4 8318 B12R1.107 C=C(F)CC(O)c1ccccc1 Amb25158203 [0,2,0,0,0,0|1,0,1]=4 8319 B12R1.107 CC(=C)CC(N)c1ccccc1 Amb24423888 [0,2,0,0,0,0|1,0,1]=4 8320 B12R1.107 CC(=C)C[C@H](N)c1ccccc1 Amb25124122 [0,2,0,0,0,0|1,0,1]=4 8321 B12R1.107 CC(=C)C[C@H](O)c1ccccc1 Amb24497632 [0,2,0,0,0,0|1,0,1]=4 8322 B12R1.107 CC(C)CC(Cl)c1ccc[n]c1 Amb24703067 [0,2,0,0,0,0|2,0,0]=4 8323 B12R1.107 CC(C)CC(N)c1cc[n]cc1 Amb18968290 [0,2,0,0,0,0|2,0,0]=4 8324 B12R1.107 CC(C)CC(N)c1cccc[n]1 Amb18993299 [0,2,0,0,0,0|2,0,0]=4 8325 B12R1.107 CC(C)CC(N)c1cccc[n]1 Amb22499080 [0,2,0,0,0,0|2,0,0]=4 8326 B12R1.107 CC(C)CC(O)c1cc[n]cc1 Amb18792668 [0,2,0,0,0,0|2,0,0]=4 8327 B12R1.107 CC(C)CC(O)c1cccc[n]1 Amb18792671 [0,2,0,0,0,0|2,0,0]=4 8328 B12R1.107 CC(C)C[C@@H](Cl)c1ccccc1 Amb25667428 [0,2,0,0,0,0|1,0,0]=3 8329 B12R1.107 CC(C)C[C@@H](N)c1cc[n]cc1 Amb24573501 [0,2,0,0,0,0|2,0,0]=4 8330 B12R1.107 CC(C)C[C@@H](N)c1ccc[n]c1 Amb24450038 [0,2,0,0,0,0|2,0,0]=4 8331 B12R1.107 CC(C)C[C@@H](N)c1cccc[n]1 Amb25850213 [0,2,0,0,0,0|2,0,0]=4 8332 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb22288660 [0,2,0,0,0,0|1,0,0]=3 8333 B12R1.107 CC(C)C[C@@H](O)c1ccccc1 Amb25816173 [0,2,0,0,0,0|1,0,0]=3 8334 B12R1.107 CC(C)C[C@H](N)c1cc[n]cc1 Amb24567925 [0,2,0,0,0,0|2,0,0]=4 8335 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb22288705 [0,2,0,0,0,0|1,0,0]=3 8336 B12R1.107 CC(C)C[C@H](O)c1ccccc1 Amb24344678 [0,2,0,0,0,0|1,0,0]=3 8337 B12R1.107 CC(C)N[C@@H](C)c1ccccc1 Amb22747560 [0,2,0,0,0,0|2,0,0]=4 8338 B12R1.107 CC(C)SC(C)c1ccccc1 Amb24371858 [0,2,0,0,0,0|2,0,0]=4 8339 B12R1.107 CC(C)[NH2+][C@@H](C)c1ccccc1 Amb22049556 [0,2,0,0,0,0|2,0,0]=4 8340 B12R1.107 CC(CB(O)O)c1ccccc1 Amb24725059 [0,2,0,0,0,0|1,0,0]=3 8341 B12R1.107 CC(CC(C)Br)c1ccccc1 Amb25273655 [0,2,0,0,0,0|1,0,0]=3 8342 B12R1.107 CC(CC(C)O)c1c[n]cc[n]1 Amb25117161 [0,2,0,0,0,0|2,0,0]=4 8343 B12R1.107 CC(CC(C)O)c1c[n]ccc1 Amb25278209 [0,2,0,0,0,0|1,0,0]=3 8344 B12R1.107 CC(CC(N)=S)c1ccccc1 Amb24583414 [0,2,0,0,0,0|0,1,1]=4 8345 B12R1.107 CC(CC(N)N)c1ccccc1 Amb24670721 [0,2,0,0,0,0|1,0,0]=3 8346 B12R1.107 CC(CC(O)O)c1ccccc1 Amb25092014 [0,2,0,0,0,0|0,0,0]=2 8347 B12R1.107 CC(CC(c1cccnc1)N)C Amb10607963 [0,2,0,0,0,0|2,0,0]=4 8348 B12R1.107 CC(CC(c1cccnc1)O)C Amb17232541 [0,2,0,0,0,0|2,0,0]=4 8349 B12R1.107 CC(CN(C)C)c1ccccc1 Amb22491726 [0,2,0,0,0,0|2,0,0]=4 8350 B12R1.107 CC(CN(C)C)c1ccccc1 Amb25848155 [0,2,0,0,0,0|2,0,0]=4 8351 B12R1.107 CC(CN(C)N)c1ccccc1 Amb24379493 [0,2,0,0,0,0|2,0,0]=4 8352 B12R1.107 CC(CN(c1ccccc1)C)C Amb17232437 [0,2,0,0,0,0|2,0,0]=4 8353 B12R1.107 CC(CN(c1ccccc1)C)N Amb10610213 [0,2,0,0,0,0|2,0,0]=4 8354 B12R1.107 CC(CN(c1ccccc1)C)N Amb1137929 [0,2,0,0,0,0|2,0,0]=4 8355 B12R1.107 CC(CN(c1ccccc1)C)O Amb17138595 [0,2,0,0,0,0|1,0,0]=3 8356 B12R1.107 CC(CN(c1ccccc1)N)C Amb17226667 [0,2,0,0,0,0|2,0,0]=4 8357 B12R1.107 CC(CS(C)=O)c1ccccc1 Amb24673234 [0,2,0,0,0,0|1,0,1]=4 8358 B12R1.107 CC(CS(O)=O)c1ccccc1 Amb24557264 [0,2,0,0,0,0|1,0,0]=3 8359 B12R1.107 CC(CS([O-])=O)c1ccccc1 Amb24385785 [0,2,0,0,0,0|1,0,1]=4 8360 B12R1.107 CC(Cl)CN(C)c1ccccc1 Amb24711498 [0,2,0,0,0,0|2,0,0]=4 8361 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb20668879 [0,2,0,0,0,0|1,0,1]=4 8362 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb22059727 [0,2,0,0,0,0|1,0,1]=4 8363 B12R1.107 CC(N)CC(O)c1ccc[n]c1 Amb25798886 [0,2,0,0,0,0|2,0,0]=4 8364 B12R1.107 CC(N)CC(O)c1ccccc1 Amb18646365 [0,2,0,0,0,0|1,0,0]=3 8365 B12R1.107 CC(N)C[C@@H](O)c1ccccc1 Amb25719473 [0,2,0,0,0,0|1,0,0]=3 8366 B12R1.107 CC(O)CC(=C)c1ccc[n]c1 Amb25706101 [0,2,0,0,0,0|1,0,1]=4 8367 B12R1.107 CC(O)CC(=O)c1ccc[n]c1 Amb25060077 [0,2,0,0,0,0|1,0,1]=4 8368 B12R1.107 CC(O)CC(N)c1cc[n]cc1 Amb25124085 [0,2,0,0,0,0|1,0,0]=3 8369 B12R1.107 CC(O)CC(N)c1ccc[n]c1 Amb25362253 [0,2,0,0,0,0|1,0,0]=3 8370 B12R1.107 CC(O)CC(N)c1ccccc1 Amb18646382 [0,2,0,0,0,0|0,0,0]=2 8371 B12R1.107 CC(O)CC(P)c1ccccc1 Amb25157842 [0,2,0,0,0,0|0,0,0]=2 8372 B12R1.107 CC(O)CC(S)c1ccccc1 Amb24525704 [0,2,0,0,0,0|0,0,0]=2 8373 B12R1.107 CC(O)CN(C)c1cc[n]cc1 Amb18798599 [0,2,0,0,0,0|2,0,0]=4 8374 B12R1.107 CC(O)CN(C)c1cccc[n]1 Amb18798612 [0,2,0,0,0,0|2,0,0]=4 8375 B12R1.107 CC(O)CS(=O)c1ccccc1 Amb25042910 [0,2,0,0,0,0|1,0,0]=3 8376 B12R1.107 CC(O)C[C@H](O)c1ccccc1 Amb24355251 [0,2,0,0,0,0|0,0,0]=2 8377 B12R1.107 CC([SiH2]C(Cl)Cl)c1ccccc1 Amb25743475 [0,2,0,0,0,0|1,1,0]=4 8378 B12R1.107 CC(c1ccccc1)CC(=O)O Amb1207393 [0,2,0,0,0,0|0,0,1]=3 8379 B12R1.107 CN(C)CC(Br)c1ccccc1 Amb25055256 [0,2,0,0,0,0|2,0,0]=4 8380 B12R1.107 CN(C)CC(F)c1ccccc1 Amb24623425 [0,2,0,0,0,0|2,0,0]=4 8381 B12R1.107 CN(C)CC(N)c1ccccc1 Amb22042488 [0,2,0,0,0,0|2,0,0]=4 8382 B12R1.107 CN(C)C[C@@H](N)c1ccccc1 Amb22745082 [0,2,0,0,0,0|2,0,0]=4 8383 B12R1.107 CN(C)C[C@@H](O)c1ccccc1 Amb22226504 [0,2,0,0,0,0|2,0,0]=4 8384 B12R1.107 CN(C)C[C@H](O)c1ccccc1 Amb24707113 [0,2,0,0,0,0|2,0,0]=4 8385 B12R1.107 CN(CC(Cl)Cl)c1ccccc1 Amb24351871 [0,2,0,0,0,0|2,0,0]=4 8386 B12R1.107 CN(CC(F)F)c1ccccc1 Amb25079937 [0,2,0,0,0,0|2,0,0]=4 8387 B12R1.107 CN(c1ccccc1)CC(=O)O Amb10610413 [0,2,0,0,0,0|1,0,1]=4 8388 B12R1.107 CP(CC(O)=O)c1ccccc1 Amb25108110 [0,2,0,0,0,0|1,0,1]=4 8389 B12R1.107 CS(=O)CC(N)c1ccccc1 Amb18648795 [0,2,0,0,0,0|1,0,1]=4 8390 B12R1.107 CS(=O)CC(O)c1ccccc1 Amb25781686 [0,2,0,0,0,0|1,0,1]=4 8391 B12R1.107 C[C@@H](N)CN(C)c1ccccc1 Amb25058714 [0,2,0,0,0,0|2,0,0]=4 8392 B12R1.107 C[C@@H](N)CS(=O)c1ccccc1 Amb24381565 [0,2,0,0,0,0|2,0,0]=4 8393 B12R1.107 C[C@@H](N)C[C@@H]([O-])c1ccccc1 Amb25825094 [0,2,0,0,0,0|1,0,0]=3 8394 B12R1.107 C[C@@H](O)CN(C)c1cc[n]cc1 Amb25065978 [0,2,0,0,0,0|2,0,0]=4 8395 B12R1.107 C[C@@H](O)CN(C)c1ccccc1 Amb24663849 [0,2,0,0,0,0|1,0,0]=3 8396 B12R1.107 C[C@@H](O)CS(=O)c1ccccc1 Amb25788068 [0,2,0,0,0,0|1,0,0]=3 8397 B12R1.107 C[C@@H](O)C[C@@H](N)c1ccccc1 Amb24634311 [0,2,0,0,0,0|0,0,0]=2 8398 B12R1.107 C[C@@H](O)C[C@H](N)c1ccccc1 Amb24711221 [0,2,0,0,0,0|0,0,0]=2 8399 B12R1.107 C[C@@H](c1ccccc1)CC(=O)O Amb10844340 [0,2,0,0,0,0|0,0,1]=3 8400 B12R1.107 C[C@H](C[C@H](C)O)c1ccccc1 Amb25741359 [0,2,0,0,0,0|0,0,0]=2 8401 B12R1.107 C[C@H](Cl)C[C@@H](Cl)c1ccccc1 Amb25119306 [0,2,0,0,0,0|1,0,0]=3 8402 B12R1.107 C[C@H](N)C[C@@H](O)c1ccccc1 Amb25362221 [0,2,0,0,0,0|1,0,0]=3 8403 B12R1.107 C[C@H](N)C[C@H]([O-])c1ccccc1 Amb25180739 [0,2,0,0,0,0|1,0,0]=3 8404 B12R1.107 C[C@H](O)CC(=C)c1ccccc1 Amb25741335 [0,2,0,0,0,0|0,0,1]=3 8405 B12R1.107 C[C@H](O)CC(N)c1ccccc1 Amb24608910 [0,2,0,0,0,0|0,0,0]=2 8406 B12R1.107 C[C@H](O)CC(O)c1ccccc1 Amb25846972 [0,2,0,0,0,0|0,0,0]=2 8407 B12R1.107 C[C@H](O)CN(C)c1cccc[n]1 Amb25182856 [0,2,0,0,0,0|2,0,0]=4 8408 B12R1.107 C[C@H](O)CS(=O)c1ccccc1 Amb24364273 [0,2,0,0,0,0|1,0,0]=3 8409 B12R1.107 C[C@H](O)C[C@@H](N)c1ccccc1 Amb25152440 [0,2,0,0,0,0|0,0,0]=2 8410 B12R1.107 C[C@H](O)C[C@@H](O)c1ccccc1 Amb24431811 [0,2,0,0,0,0|0,0,0]=2 8411 B12R1.107 C[C@H](O)C[C@H](S)c1ccccc1 Amb24398074 [0,2,0,0,0,0|0,0,0]=2 8412 B12R1.107 C[C@H](c1ccccc1)CC(=O)O Amb10844379 [0,2,0,0,0,0|0,0,1]=3 8413 B12R1.107 C\C(=C\C(C)O)\c1ccccc1 Amb25823380 [0,2,0,0,0,0|0,0,2]=4 8414 B12R1.107 ClC(c1ccccc1)CN(C)C Amb10563749 [0,2,0,0,0,0|2,0,0]=4 8415 B12R1.107 ClC(c1ccccc1)CN(C)C Amb17546791 [0,2,0,0,0,0|2,0,0]=4 8416 B12R1.107 NC(=O)C[C@@H](N)c1ccccc1 Amb18792562 [0,2,0,0,0,0|0,0,2]=4 8417 B12R1.107 NC(=O)C[C@@H](O)c1ccccc1 Amb25751170 [0,2,0,0,0,0|0,0,2]=4 8418 B12R1.107 NC(=O)C[C@H](O)c1ccccc1 Amb25150965 [0,2,0,0,0,0|0,0,2]=4 8419 B12R1.107 NC(=S)CC(O)c1ccccc1 Amb18805332 [0,2,0,0,0,0|0,1,1]=4 8420 B12R1.107 NC(CB(O)O)c1ccccc1 Amb24658322 [0,2,0,0,0,0|1,0,0]=3 8421 B12R1.107 NC(CC(Cl)Cl)c1ccccc1 Amb25324519 [0,2,0,0,0,0|1,0,0]=3 8422 B12R1.107 NC(CC(F)F)c1ccccc1 Amb18802187 [0,2,0,0,0,0|1,0,0]=3 8423 B12R1.107 NC(CC(O)=O)c1cccc[n]1 Amb22898991 [0,2,0,0,0,0|1,0,1]=4 8424 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609847 [0,2,0,0,0,0|0,0,2]=4 8425 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609952 [0,2,0,0,0,0|0,0,2]=4 8426 B12R1.107 NC(c1ccccc1)CC(=O)O Amb1048120 [0,2,0,0,0,0|0,0,1]=3 8427 B12R1.107 NC(c1ccccc1)CC(C)C Amb1107536 [0,2,0,0,0,0|1,0,0]=3 8428 B12R1.107 NC(c1ccccc1)CN(C)C Amb1218288 [0,2,0,0,0,0|2,0,0]=4 8429 B12R1.107 NN(CC(O)=O)c1ccccc1 Amb22757137 [0,2,0,0,0,0|1,0,1]=4 8430 B12R1.107 N[C@@H](CC(O)=O)c1cc[n]cc1 Amb19929593 [0,2,0,0,0,0|1,0,1]=4 8431 B12R1.107 N[C@@H](CC(O)=O)c1cc[n]cc1 Amb20240885 [0,2,0,0,0,0|1,0,1]=4 8432 B12R1.107 N[C@@H](CC(O)=O)c1ccc[n]c1 Amb19929600 [0,2,0,0,0,0|1,0,1]=4 8433 B12R1.107 N[C@@H](CC(O)=O)c1cccc[n]1 Amb20241102 [0,2,0,0,0,0|1,0,1]=4 8434 B12R1.107 N[C@H](CC(O)=O)c1cc[n]cc1 Amb19929602 [0,2,0,0,0,0|1,0,1]=4 8435 B12R1.107 N[C@H](CC(O)=O)c1cc[n]cc1 Amb20241136 [0,2,0,0,0,0|1,0,1]=4 8436 B12R1.107 N[C@H](CC(O)=O)c1ccc[n]c1 Amb19929601 [0,2,0,0,0,0|1,0,1]=4 8437 B12R1.107 N[C@H](CC(O)=O)c1cccc[n]1 Amb20241101 [0,2,0,0,0,0|1,0,1]=4 8438 B12R1.107 O=C(c1ccccc1)CC(=O)O Amb10576353 [0,2,0,0,0,0|0,0,2]=4 8439 B12R1.107 OB(O)OC(O)c1ccccc1 Amb24343472 [0,2,0,0,0,0|2,0,0]=4 8440 B12R1.107 OC(=O)CC(Cl)c1cc[n]cc1 Amb18119876 [0,2,0,0,0,0|1,0,1]=4 8441 B12R1.107 OC(=O)CC(Cl)c1ccc[n]c1 Amb18119752 [0,2,0,0,0,0|1,0,1]=4 8442 B12R1.107 OC(=O)CC(Cl)c1cccc[n]1 Amb18120042 [0,2,0,0,0,0|1,0,1]=4 8443 B12R1.107 OC(=O)CC(Cl)c1ccccc1 Amb18120400 [0,2,0,0,0,0|0,0,1]=3 8444 B12R1.107 OC(=O)CC(F)c1ccc[n]c1 Amb25823686 [0,2,0,0,0,0|1,0,1]=4 8445 B12R1.107 OC(=O)CC(F)c1ccccc1 Amb24554792 [0,2,0,0,0,0|0,0,1]=3 8446 B12R1.107 OC(=O)CC(O)c1cc[n]cc1 Amb18563783 [0,2,0,0,0,0|1,0,1]=4 8447 B12R1.107 OC(=O)CC(O)c1cccc[n]1 Amb18563782 [0,2,0,0,0,0|1,0,1]=4 8448 B12R1.107 OC(=O)CC(S)c1ccccc1 Amb18303085 [0,2,0,0,0,0|0,0,1]=3 8449 B12R1.107 OC(=O)CC(c1ccccn1)Br Amb17596297 [0,2,0,0,0,0|1,0,1]=4 8450 B12R1.107 OC(=O)CC(c1cccnc1)N Amb1993735 [0,2,0,0,0,0|1,0,1]=4 8451 B12R1.107 OC(=O)CS(=O)c1ccccc1 Amb18290924 [0,2,0,0,0,0|1,0,1]=4 8452 B12R1.107 OC(CC(F)F)c1ccccc1 Amb24433354 [0,2,0,0,0,0|1,0,0]=3 8453 B12R1.107 OC(CC(S)=S)c1ccccc1 Amb25145313 [0,2,0,0,0,0|0,1,1]=4 8454 B12R1.107 OC(c1ccccc1)CC(C)C Amb1110402 [0,2,0,0,0,0|1,0,0]=3 8455 B12R1.107 OC(c1ccccc1)CC(O)C Amb1110547 [0,2,0,0,0,0|0,0,0]=2 8456 B12R1.107 OC(c1ccccc1)CN(C)C Amb10563753 [0,2,0,0,0,0|2,0,0]=4 8457 B12R1.107 OC(c1ccccc1)CN(C)C Amb17104281 [0,2,0,0,0,0|2,0,0]=4 8458 B12R1.107 OC(c1ccccc1)C[N+](=O)[O-] Amb1048142 [0,2,0,0,0,0|1,0,1]=4 8459 B12R1.107 O[C@H](OP(O)O)c1ccccc1 Amb24675416 [0,2,0,0,0,0|2,0,0]=4 8460 B12R1.308 C#CCC(N)c1ccccc1Cl Amb18809279 [0,2,0,0,0,0|1,0,1]=4 8461 B12R1.308 C#CCC(N)c1ccccc1F Amb18967422 [0,2,0,0,0,0|1,0,1]=4 8462 B12R1.308 C#CCC(O)c1ccccc1Cl Amb18186758 [0,2,0,0,0,0|1,0,1]=4 8463 B12R1.308 C#CCC(O)c1ccccc1F Amb18788274 [0,2,0,0,0,0|1,0,1]=4 8464 B12R1.308 C#CC[C@@H](O)c1ccccc1F Amb24100209 [0,2,0,0,0,0|1,0,1]=4 8465 B12R1.308 C#CC[C@H](O)c1ccccc1Cl Amb25158196 [0,2,0,0,0,0|1,0,1]=4 8466 B12R1.308 C=CCC(N)c1ccccc1Br Amb18293502 [0,2,0,0,0,0|1,0,1]=4 8467 B12R1.308 C=CCC(N)c1ccccc1Cl Amb18986268 [0,2,0,0,0,0|1,0,1]=4 8468 B12R1.308 C=CCC(N)c1ccccc1F Amb19002611 [0,2,0,0,0,0|1,0,1]=4 8469 B12R1.308 C=CCC(N)c1ccccc1I Amb25377094 [0,2,0,0,0,0|1,0,1]=4 8470 B12R1.308 C=CCC(N)c1ccccc1O Amb25261429 [0,2,0,0,0,0|1,0,1]=4 8471 B12R1.308 C=CCC(O)c1ccccc1Br Amb24671319 [0,2,0,0,0,0|1,0,1]=4 8472 B12R1.308 C=CCC(O)c1ccccc1Cl Amb19074253 [0,2,0,0,0,0|1,0,1]=4 8473 B12R1.308 C=CCC(O)c1ccccc1F Amb18177819 [0,2,0,0,0,0|1,0,1]=4 8474 B12R1.308 C=CCC(O)c1ccccc1I Amb25775871 [0,2,0,0,0,0|1,0,1]=4 8475 B12R1.308 C=CCC(O)c1ccccc1O Amb18646046 [0,2,0,0,0,0|1,0,1]=4 8476 B12R1.308 C=CC[C@@H](N)c1ccccc1Cl Amb19889592 [0,2,0,0,0,0|1,0,1]=4 8477 B12R1.308 C=CC[C@@H](N)c1ccccc1Cl Amb22831179 [0,2,0,0,0,0|1,0,1]=4 8478 B12R1.308 C=CC[C@@H](N)c1ccccc1F Amb22831408 [0,2,0,0,0,0|1,0,1]=4 8479 B12R1.308 C=CC[C@@H](N)c1ccccc1N Amb25368389 [0,2,0,0,0,0|1,0,1]=4 8480 B12R1.308 C=CC[C@@H](O)c1ccccc1Cl Amb24372071 [0,2,0,0,0,0|1,0,1]=4 8481 B12R1.308 C=CC[C@H](N)c1ccccc1Cl Amb19889591 [0,2,0,0,0,0|1,0,1]=4 8482 B12R1.308 C=CC[C@H](N)c1ccccc1N Amb25138190 [0,2,0,0,0,0|1,0,1]=4 8483 B12R1.308 C=CC[C@H](N)c1ccccc1S Amb24460315 [0,2,0,0,0,0|1,0,1]=4 8484 B12R1.308 C=CC[C@H](O)c1ccccc1Cl Amb24534332 [0,2,0,0,0,0|1,0,1]=4 8485 B12R1.308 C=CC[C@H](O)c1ccccc1O Amb24497366 [0,2,0,0,0,0|1,0,1]=4 8486 B12R1.308 C=CC[C@H](O)c1ccccc1S Amb24608088 [0,2,0,0,0,0|1,0,1]=4 8487 B12R1.308 CC(CC#N)c1ccccc1Cl Amb25083306 [0,2,0,0,0,0|1,0,1]=4 8488 B12R1.308 CC(CC#N)c1ccccc1O Amb18645498 [0,2,0,0,0,0|1,0,1]=4 8489 B12R1.308 CC(CC=O)c1ccccc1Cl Amb18648717 [0,2,0,0,0,0|0,0,2]=4 8490 B12R1.308 CC(CC=O)c1ccccc1F Amb25253611 [0,2,0,0,0,0|0,0,2]=4 8491 B12R1.308 CC(CCN)c1cc[n]cc1F Amb25378379 [0,2,0,0,0,0|2,0,0]=4 8492 B12R1.308 CC(CCN)c1ccccc1O Amb24643805 [0,2,0,0,0,0|1,0,0]=3 8493 B12R1.308 CCCC(=N)c1ccccc1O Amb24721703 [0,2,0,0,0,0|1,0,1]=4 8494 B12R1.308 CCCC(=O)c1ccccc1Br Amb17343723 [0,2,0,0,0,0|1,0,1]=4 8495 B12R1.308 CCCC(=O)c1ccccc1C Amb17198733 [0,2,0,0,0,0|1,0,1]=4 8496 B12R1.308 CCCC(=O)c1ccccc1Cl Amb17198743 [0,2,0,0,0,0|1,0,1]=4 8497 B12R1.308 CCCC(=O)c1ccccc1F Amb17198734 [0,2,0,0,0,0|1,0,1]=4 8498 B12R1.308 CCCC(=O)c1ccccc1I Amb24397248 [0,2,0,0,0,0|1,0,1]=4 8499 B12R1.308 CCCC(=O)c1ccccc1N Amb18645869 [0,2,0,0,0,0|1,0,1]=4 8500 B12R1.308 CCCC(C)c1c[n]ccc1N Amb25350094 [0,2,0,0,0,0|2,0,0]=4 8501 B12R1.308 CCCC(C)c1ccccc1N Amb24729496 [0,2,0,0,0,0|1,0,0]=3 8502 B12R1.308 CCCC(Cl)c1cc[n]cc1F Amb24388670 [0,2,0,0,0,0|2,0,0]=4 8503 B12R1.308 CCCC(Cl)c1ccc[n]c1N Amb25801186 [0,2,0,0,0,0|2,0,0]=4 8504 B12R1.308 CCCC(Cl)c1ccccc1F Amb25127215 [0,2,0,0,0,0|1,0,0]=3 8505 B12R1.308 CCCC(N)c1[n]cccc1Br Amb25756399 [0,2,0,0,0,0|2,0,0]=4 8506 B12R1.308 CCCC(N)c1[n]cccc1F Amb25698331 [0,2,0,0,0,0|2,0,0]=4 8507 B12R1.308 CCCC(N)c1c[n]ccc1Cl Amb24551068 [0,2,0,0,0,0|2,0,0]=4 8508 B12R1.308 CCCC(N)c1cc[n]cc1N Amb24718260 [0,2,0,0,0,0|2,0,0]=4 8509 B12R1.308 CCCC(N)c1cc[n]cc1O Amb24487322 [0,2,0,0,0,0|2,0,0]=4 8510 B12R1.308 CCCC(N)c1ccc[n]c1F Amb24744474 [0,2,0,0,0,0|2,0,0]=4 8511 B12R1.308 CCCC(N)c1ccc[n]c1S Amb24763765 [0,2,0,0,0,0|2,0,0]=4 8512 B12R1.308 CCCC(N)c1ccccc1N Amb25119381 [0,2,0,0,0,0|1,0,0]=3 8513 B12R1.308 CCCC(N)c1ccccc1S Amb24488673 [0,2,0,0,0,0|1,0,0]=3 8514 B12R1.308 CCCC(O)c1[n]cccc1Br Amb24554689 [0,2,0,0,0,0|2,0,0]=4 8515 B12R1.308 CCCC(O)c1[n]cccc1O Amb25092013 [0,2,0,0,0,0|2,0,0]=4 8516 B12R1.308 CCCC(O)c1c[n]ccc1Cl Amb25317649 [0,2,0,0,0,0|2,0,0]=4 8517 B12R1.308 CCCC(O)c1ccc[n]c1N Amb25719741 [0,2,0,0,0,0|2,0,0]=4 8518 B12R1.308 CCCC(O)c1ccccc1I Amb24623046 [0,2,0,0,0,0|1,0,0]=3 8519 B12R1.308 CCCC(O)c1ccccc1N Amb24473035 [0,2,0,0,0,0|1,0,0]=3 8520 B12R1.308 CCCC(O)c1ccccc1O Amb18646532 [0,2,0,0,0,0|1,0,0]=3 8521 B12R1.308 CCCC(c1ccccc1C)N Amb17232446 [0,2,0,0,0,0|1,0,0]=3 8522 B12R1.308 CCCC(c1ccccc1C)O Amb17232483 [0,2,0,0,0,0|1,0,0]=3 8523 B12R1.308 CCCC(c1ccccc1Cl)N Amb17234047 [0,2,0,0,0,0|1,0,0]=3 8524 B12R1.308 CCCC(c1ccccc1Cl)O Amb17234154 [0,2,0,0,0,0|1,0,0]=3 8525 B12R1.308 CCCC(c1ccccc1F)N Amb17232645 [0,2,0,0,0,0|1,0,0]=3 8526 B12R1.308 CCCC(c1ccccc1F)O Amb17232666 [0,2,0,0,0,0|1,0,0]=3 8527 B12R1.308 CCCN(C)c1ccccc1Br Amb25306279 [0,2,0,0,0,0|2,0,0]=4 8528 B12R1.308 CCCN(C)c1ccccc1F Amb25345830 [0,2,0,0,0,0|2,0,0]=4 8529 B12R1.308 CCCS(=O)c1ccccc1N Amb18291960 [0,2,0,0,0,0|2,0,0]=4 8530 B12R1.308 CCCS(=O)c1ccccc1O Amb25143473 [0,2,0,0,0,0|2,0,0]=4 8531 B12R1.308 CCC[C@@H](N)c1c[n]ccc1Cl Amb24554560 [0,2,0,0,0,0|2,0,0]=4 8532 B12R1.308 CCC[C@@H](N)c1ccc[n]c1F Amb24359891 [0,2,0,0,0,0|2,0,0]=4 8533 B12R1.308 CCC[C@@H](N)c1ccc[n]c1N Amb24502096 [0,2,0,0,0,0|2,0,0]=4 8534 B12R1.308 CCC[C@@H](N)c1ccc[n]c1O Amb25789514 [0,2,0,0,0,0|2,0,0]=4 8535 B12R1.308 CCC[C@@H](N)c1ccccc1I Amb24443865 [0,2,0,0,0,0|1,0,0]=3 8536 B12R1.308 CCC[C@@H](O)c1[n]cccc1Cl Amb24343501 [0,2,0,0,0,0|2,0,0]=4 8537 B12R1.308 CCC[C@@H](O)c1cc[n]cc1Cl Amb25210984 [0,2,0,0,0,0|2,0,0]=4 8538 B12R1.308 CCC[C@@H](O)c1cc[n]cc1F Amb25719941 [0,2,0,0,0,0|2,0,0]=4 8539 B12R1.308 CCC[C@@H](O)c1ccccc1Br Amb24705993 [0,2,0,0,0,0|1,0,0]=3 8540 B12R1.308 CCC[C@@H](O)c1ccccc1Cl Amb25043992 [0,2,0,0,0,0|1,0,0]=3 8541 B12R1.308 CCC[C@H](N)c1[n]cccc1Br Amb25738631 [0,2,0,0,0,0|2,0,0]=4 8542 B12R1.308 CCC[C@H](N)c1[n]cccc1Cl Amb25148612 [0,2,0,0,0,0|2,0,0]=4 8543 B12R1.308 CCC[C@H](N)c1[n]cccc1F Amb25324305 [0,2,0,0,0,0|2,0,0]=4 8544 B12R1.308 CCC[C@H](N)c1[n]cccc1O Amb24585638 [0,2,0,0,0,0|2,0,0]=4 8545 B12R1.308 CCC[C@H](N)c1c[n]ccc1N Amb24546358 [0,2,0,0,0,0|2,0,0]=4 8546 B12R1.308 CCC[C@H](N)c1cc[n]cc1Cl Amb24671287 [0,2,0,0,0,0|2,0,0]=4 8547 B12R1.308 CCC[C@H](N)c1cc[n]cc1F Amb25815303 [0,2,0,0,0,0|2,0,0]=4 8548 B12R1.308 CCC[C@H](N)c1cc[n]cc1N Amb25337593 [0,2,0,0,0,0|2,0,0]=4 8549 B12R1.308 CCC[C@H](N)c1cc[n]cc1O Amb25144000 [0,2,0,0,0,0|2,0,0]=4 8550 B12R1.308 CCC[C@H](N)c1ccc[n]c1Cl Amb24746738 [0,2,0,0,0,0|2,0,0]=4 8551 B12R1.308 CCC[C@H](N)c1ccc[n]c1N Amb24361372 [0,2,0,0,0,0|2,0,0]=4 8552 B12R1.308 CCC[C@H](N)c1ccc[n]c1S Amb24485710 [0,2,0,0,0,0|2,0,0]=4 8553 B12R1.308 CCC[C@H](N)c1ccccc1Br Amb25096337 [0,2,0,0,0,0|1,0,0]=3 8554 B12R1.308 CCC[C@H](N)c1ccccc1N Amb25088274 [0,2,0,0,0,0|1,0,0]=3 8555 B12R1.308 CCC[C@H](O)c1[n]cccc1F Amb25355276 [0,2,0,0,0,0|2,0,0]=4 8556 B12R1.308 CCC[C@H](O)c1c[n]ccc1Cl Amb24386986 [0,2,0,0,0,0|2,0,0]=4 8557 B12R1.308 CCC[C@H](O)c1cc[n]cc1Cl Amb25361495 [0,2,0,0,0,0|2,0,0]=4 8558 B12R1.308 CCC[C@H](O)c1cc[n]cc1F Amb24718709 [0,2,0,0,0,0|2,0,0]=4 8559 B12R1.308 CCN[C@@H](C)c1ccccc1Br Amb25073112 [0,2,0,0,0,0|2,0,0]=4 8560 B12R1.308 CCN[C@@H](C)c1ccccc1Cl Amb25764966 [0,2,0,0,0,0|2,0,0]=4 8561 B12R1.308 CCN[C@H](C)c1ccccc1F Amb24665516 [0,2,0,0,0,0|2,0,0]=4 8562 B12R1.308 CCOC(C)c1ccccc1Cl Amb24061174 [0,2,0,0,0,0|2,0,0]=4 8563 B12R1.308 CCOC(C)c1ccccc1O Amb25667447 [0,2,0,0,0,0|2,0,0]=4 8564 B12R1.308 CCSC(C)c1ccccc1Br Amb24732685 [0,2,0,0,0,0|2,0,0]=4 8565 B12R1.308 CCSC(C)c1ccccc1O Amb18648671 [0,2,0,0,0,0|2,0,0]=4 8566 B12R1.308 CN(CCBr)c1ccccc1F Amb24454501 [0,2,0,0,0,0|2,0,0]=4 8567 B12R1.308 CN(CCI)c1ccccc1F Amb25344514 [0,2,0,0,0,0|2,0,0]=4 8568 B12R1.308 CN(CCO)c1[n]cccc1Br Amb25215188 [0,2,0,0,0,0|2,0,0]=4 8569 B12R1.308 CN(CCO)c1[n]cccc1Cl Amb19076386 [0,2,0,0,0,0|2,0,0]=4 8570 B12R1.308 CN(CCO)c1[n]cccc1F Amb18801751 [0,2,0,0,0,0|2,0,0]=4 8571 B12R1.308 CN(CCO)c1ccccc1I Amb25307387 [0,2,0,0,0,0|1,0,0]=3 8572 B12R1.308 CN(CCS)c1ccccc1F Amb24577221 [0,2,0,0,0,0|1,1,0]=4 8573 B12R1.308 CNCC(C)c1ccccc1Br Amb25035170 [0,2,0,0,0,0|2,0,0]=4 8574 B12R1.308 CNCC(C)c1ccccc1F Amb25827937 [0,2,0,0,0,0|2,0,0]=4 8575 B12R1.308 CNCC(O)c1ccccc1Br Amb18301236 [0,2,0,0,0,0|2,0,0]=4 8576 B12R1.308 CNCC(O)c1ccccc1O Amb24739803 [0,2,0,0,0,0|2,0,0]=4 8577 B12R1.308 CNC[C@@H](O)c1ccccc1O Amb24427596 [0,2,0,0,0,0|2,0,0]=4 8578 B12R1.308 COCC(N)c1ccccc1Cl Amb18979037 [0,2,0,0,0,0|2,0,0]=4 8579 B12R1.308 COCC(N)c1ccccc1N Amb25709589 [0,2,0,0,0,0|2,0,0]=4 8580 B12R1.308 COCC(N)c1ccccc1S Amb25790028 [0,2,0,0,0,0|2,0,0]=4 8581 B12R1.308 COCC(O)c1ccccc1Br Amb24641135 [0,2,0,0,0,0|2,0,0]=4 8582 B12R1.308 COCC(O)c1ccccc1Cl Amb19058987 [0,2,0,0,0,0|2,0,0]=4 8583 B12R1.308 COCC(O)c1ccccc1F Amb18806459 [0,2,0,0,0,0|2,0,0]=4 8584 B12R1.308 COCC(O)c1ccccc1N Amb18987946 [0,2,0,0,0,0|2,0,0]=4 8585 B12R1.308 COCC(c1ccccc1C)N Amb1129629 [0,2,0,0,0,0|2,0,0]=4 8586 B12R1.308 COCC(c1ccccc1F)N Amb1139580 [0,2,0,0,0,0|2,0,0]=4 8587 B12R1.308 COC[C@@H](N)c1ccccc1Cl Amb24670291 [0,2,0,0,0,0|2,0,0]=4 8588 B12R1.308 COC[C@@H](N)c1ccccc1F Amb25852206 [0,2,0,0,0,0|2,0,0]=4 8589 B12R1.308 COC[C@H](N)c1ccccc1Br Amb25225784 [0,2,0,0,0,0|2,0,0]=4 8590 B12R1.308 COC[C@H](N)c1ccccc1Cl Amb25118021 [0,2,0,0,0,0|2,0,0]=4 8591 B12R1.308 COC[C@H](N)c1ccccc1I Amb24483885 [0,2,0,0,0,0|2,0,0]=4 8592 B12R1.308 COC[C@H](N)c1ccccc1S Amb25063716 [0,2,0,0,0,0|2,0,0]=4 8593 B12R1.308 CSCC(N)c1ccccc1Cl Amb18300371 [0,2,0,0,0,0|2,0,0]=4 8594 B12R1.308 CSCC(N)c1ccccc1F Amb18995354 [0,2,0,0,0,0|2,0,0]=4 8595 B12R1.308 CSCC(O)c1ccccc1Cl Amb25789089 [0,2,0,0,0,0|2,0,0]=4 8596 B12R1.308 CSCC(O)c1ccccc1F Amb19070008 [0,2,0,0,0,0|2,0,0]=4 8597 B12R1.308 CSCC(O)c1ccccc1N Amb18987947 [0,2,0,0,0,0|2,0,0]=4 8598 B12R1.308 C[C@H](CC=O)c1ccccc1Cl Amb24537615 [0,2,0,0,0,0|0,0,2]=4 8599 B12R1.308 C[C@H](CCO)c1ccccc1O Amb24686462 [0,2,0,0,0,0|0,0,0]=2 8600 B12R1.308 C\C(=C/CO)\c1ccccc1Br Amb24438353 [0,2,0,0,0,0|0,0,2]=4 8601 B12R1.308 C\C(=C\CO)\c1ccccc1Br Amb24623710 [0,2,0,0,0,0|0,0,2]=4 8602 B12R1.308 C\C(=C\CO)\c1ccccc1Cl Amb25209579 [0,2,0,0,0,0|0,0,2]=4 8603 B12R1.308 C\C(=C\CO)\c1ccccc1F Amb24420735 [0,2,0,0,0,0|0,0,2]=4 8604 B12R1.308 C\C(=C\CO)\c1ccccc1O Amb18646033 [0,2,0,0,0,0|0,0,2]=4 8605 B12R1.308 Cc1[n]cccc1C(O)CCO Amb25669426 [0,2,0,0,0,0|1,0,0]=3 8606 B12R1.308 Cc1[n]cccc1[C@@H](N)CCO Amb24657174 [0,2,0,0,0,0|1,0,0]=3 8607 B12R1.308 Cc1[n]cccc1[C@H](N)CCC Amb25148613 [0,2,0,0,0,0|2,0,0]=4 8608 B12R1.308 Cc1[n]cccc1[C@H](N)CCO Amb25294664 [0,2,0,0,0,0|1,0,0]=3 8609 B12R1.308 Cc1c[n]ccc1C(O)CCC Amb25354367 [0,2,0,0,0,0|2,0,0]=4 8610 B12R1.308 Cc1c[n]ccc1[C@@H](N)CCC Amb25340450 [0,2,0,0,0,0|2,0,0]=4 8611 B12R1.308 Cc1c[n]ccc1[C@@H](N)CCO Amb24488509 [0,2,0,0,0,0|1,0,0]=3 8612 B12R1.308 Cc1cc[n]cc1C(C)CCN Amb24566086 [0,2,0,0,0,0|2,0,0]=4 8613 B12R1.308 Cc1cc[n]cc1C(Cl)CCC Amb25688230 [0,2,0,0,0,0|2,0,0]=4 8614 B12R1.308 Cc1cc[n]cc1C(N)CCC Amb18828707 [0,2,0,0,0,0|2,0,0]=4 8615 B12R1.308 Cc1cc[n]cc1C(O)CCC Amb25751730 [0,2,0,0,0,0|2,0,0]=4 8616 B12R1.308 Cc1cc[n]cc1[C@@H](N)CCO Amb25324426 [0,2,0,0,0,0|1,0,0]=3 8617 B12R1.308 Cc1cc[n]cc1[C@H](N)CCO Amb25131710 [0,2,0,0,0,0|1,0,0]=3 8618 B12R1.308 Cc1cc[n]cc1[C@H](O)CCC Amb24398454 [0,2,0,0,0,0|2,0,0]=4 8619 B12R1.308 Cc1ccc[n]c1C(N)CCC Amb18985048 [0,2,0,0,0,0|2,0,0]=4 8620 B12R1.308 Cc1ccc[n]c1C(N)CCO Amb24488620 [0,2,0,0,0,0|1,0,0]=3 8621 B12R1.308 Cc1ccc[n]c1C(O)CCC Amb18182634 [0,2,0,0,0,0|2,0,0]=4 8622 B12R1.308 Cc1ccc[n]c1N(C)CCO Amb18801092 [0,2,0,0,0,0|2,0,0]=4 8623 B12R1.308 Cc1ccc[n]c1[C@@H](N)CCO Amb25127456 [0,2,0,0,0,0|1,0,0]=3 8624 B12R1.308 Cc1ccc[n]c1[C@H](N)CCC Amb25789996 [0,2,0,0,0,0|2,0,0]=4 8625 B12R1.308 Cc1ccc[n]c1[C@H](N)CCO Amb24487361 [0,2,0,0,0,0|1,0,0]=3 8626 B12R1.308 Cc1ccc[n]c1[C@H](O)CCC Amb25043993 [0,2,0,0,0,0|2,0,0]=4 8627 B12R1.308 Cc1ccccc1C(=O)CCN Amb25062867 [0,2,0,0,0,0|1,0,1]=4 8628 B12R1.308 Cc1ccccc1C(C)CNC Amb25255160 [0,2,0,0,0,0|2,0,0]=4 8629 B12R1.308 Cc1ccccc1C(C)CNN Amb24365526 [0,2,0,0,0,0|2,0,0]=4 8630 B12R1.308 Cc1ccccc1C(C)SCC Amb25157280 [0,2,0,0,0,0|2,0,0]=4 8631 B12R1.308 Cc1ccccc1C(Cl)CC=C Amb25044767 [0,2,0,0,0,0|1,0,1]=4 8632 B12R1.308 Cc1ccccc1C(Cl)CCC Amb25157873 [0,2,0,0,0,0|1,0,0]=3 8633 B12R1.308 Cc1ccccc1C(Cl)CCO Amb24692648 [0,2,0,0,0,0|0,0,0]=2 8634 B12R1.308 Cc1ccccc1C(N)CC#C Amb18800159 [0,2,0,0,0,0|1,0,1]=4 8635 B12R1.308 Cc1ccccc1C(N)CC#N Amb18563498 [0,2,0,0,0,0|1,0,1]=4 8636 B12R1.308 Cc1ccccc1C(N)CC=C Amb18292097 [0,2,0,0,0,0|1,0,1]=4 8637 B12R1.308 Cc1ccccc1C(N)CCCl Amb24739582 [0,2,0,0,0,0|1,0,0]=3 8638 B12R1.308 Cc1ccccc1C(N)CSC Amb18995352 [0,2,0,0,0,0|2,0,0]=4 8639 B12R1.308 Cc1ccccc1C(O)CC#C Amb18800363 [0,2,0,0,0,0|1,0,1]=4 8640 B12R1.308 Cc1ccccc1C(O)CC=C Amb18177787 [0,2,0,0,0,0|1,0,1]=4 8641 B12R1.308 Cc1ccccc1C(O)COC Amb18792768 [0,2,0,0,0,0|2,0,0]=4 8642 B12R1.308 Cc1ccccc1C(O)CSC Amb19061296 [0,2,0,0,0,0|2,0,0]=4 8643 B12R1.308 Cc1ccccc1N(C)CCBr Amb24418265 [0,2,0,0,0,0|2,0,0]=4 8644 B12R1.308 Cc1ccccc1S(=O)CCN Amb18974524 [0,2,0,0,0,0|2,0,0]=4 8645 B12R1.308 Cc1ccccc1[C@@H](N)CC#N Amb25113376 [0,2,0,0,0,0|1,0,1]=4 8646 B12R1.308 Cc1ccccc1[C@@H](N)CCC Amb22298562 [0,2,0,0,0,0|1,0,0]=3 8647 B12R1.308 Cc1ccccc1[C@@H](N)CCN Amb24567843 [0,2,0,0,0,0|1,0,0]=3 8648 B12R1.308 Cc1ccccc1[C@@H](N)CCO Amb24393358 [0,2,0,0,0,0|0,0,0]=2 8649 B12R1.308 Cc1ccccc1[C@@H](N)COC Amb24447174 [0,2,0,0,0,0|2,0,0]=4 8650 B12R1.308 Cc1ccccc1[C@H](C)NCC Amb24361005 [0,2,0,0,0,0|2,0,0]=4 8651 B12R1.308 Cc1ccccc1[C@H](N)CCC Amb22298519 [0,2,0,0,0,0|1,0,0]=3 8652 B12R1.308 Cc1ccccc1[C@H](N)CCN Amb24580760 [0,2,0,0,0,0|1,0,0]=3 8653 B12R1.308 Cc1ccccc1[C@H](O)CNC Amb24398599 [0,2,0,0,0,0|2,0,0]=4 8654 B12R1.308 ClCCN(c1ccccc1Br)C Amb17351919 [0,2,0,0,0,0|2,0,0]=4 8655 B12R1.308 ClCCN(c1ccccc1C)C Amb17335670 [0,2,0,0,0,0|2,0,0]=4 8656 B12R1.308 ClCCN(c1ccccc1Cl)C Amb17338055 [0,2,0,0,0,0|2,0,0]=4 8657 B12R1.308 ClCCN(c1ccccc1F)C Amb17335951 [0,2,0,0,0,0|2,0,0]=4 8658 B12R1.308 FCCC(=O)c1ccccc1Br Amb16231892 [0,2,0,0,0,0|1,0,1]=4 8659 B12R1.308 N#CCC(F)c1ccccc1F Amb24439552 [0,2,0,0,0,0|1,0,1]=4 8660 B12R1.308 N#CCC(c1ccccc1C)O Amb1111330 [0,2,0,0,0,0|1,0,1]=4 8661 B12R1.308 N#CCC(c1ccccc1F)O Amb17232516 [0,2,0,0,0,0|1,0,1]=4 8662 B12R1.308 N#CC[C@@H](O)c1ccccc1Br Amb25070680 [0,2,0,0,0,0|1,0,1]=4 8663 B12R1.308 N#CC[C@@H](O)c1ccccc1Cl Amb25058529 [0,2,0,0,0,0|1,0,1]=4 8664 B12R1.308 N#CC[C@H](O)c1ccccc1Cl Amb25215874 [0,2,0,0,0,0|1,0,1]=4 8665 B12R1.308 N#CC[C@H](O)c1ccccc1F Amb25354676 [0,2,0,0,0,0|1,0,1]=4 8666 B12R1.308 NC(CC#N)c1ccccc1Br Amb18066761 [0,2,0,0,0,0|1,0,1]=4 8667 B12R1.308 NC(CC#N)c1ccccc1Cl Amb18564158 [0,2,0,0,0,0|1,0,1]=4 8668 B12R1.308 NC(CC#N)c1ccccc1F Amb18563603 [0,2,0,0,0,0|1,0,1]=4 8669 B12R1.308 NC(CCCl)c1ccccc1Cl Amb25667414 [0,2,0,0,0,0|1,0,0]=3 8670 B12R1.308 NC(CCO)c1[n]cccc1Br Amb25244942 [0,2,0,0,0,0|1,0,0]=3 8671 B12R1.308 NC(CCO)c1[n]cccc1Cl Amb24745647 [0,2,0,0,0,0|1,0,0]=3 8672 B12R1.308 NC(CCO)c1cc[n]cc1Br Amb25212924 [0,2,0,0,0,0|1,0,0]=3 8673 B12R1.308 NC(CCO)c1cc[n]cc1Cl Amb24655939 [0,2,0,0,0,0|1,0,0]=3 8674 B12R1.308 NC(CCO)c1ccc[n]c1Br Amb24461552 [0,2,0,0,0,0|1,0,0]=3 8675 B12R1.308 NC(CCO)c1ccc[n]c1Cl Amb22296967 [0,2,0,0,0,0|1,0,0]=3 8676 B12R1.308 NC(CCO)c1ccc[n]c1O Amb25152302 [0,2,0,0,0,0|1,0,0]=3 8677 B12R1.308 NC(CCO)c1ccc[n]c1S Amb25324363 [0,2,0,0,0,0|1,0,0]=3 8678 B12R1.308 NC(CCO)c1ccccc1Br Amb18297962 [0,2,0,0,0,0|0,0,0]=2 8679 B12R1.308 NC(CCO)c1ccccc1Cl Amb19888406 [0,2,0,0,0,0|0,0,0]=2 8680 B12R1.308 NC(CCO)c1ccccc1I Amb25729935 [0,2,0,0,0,0|0,0,0]=2 8681 B12R1.308 NC(CCO)c1ccccc1O Amb24487329 [0,2,0,0,0,0|0,0,0]=2 8682 B12R1.308 NC(CCO)c1ccccc1S Amb24488674 [0,2,0,0,0,0|0,0,0]=2 8683 B12R1.308 NCCC(=O)c1ccccc1Cl Amb25709180 [0,2,0,0,0,0|1,0,1]=4 8684 B12R1.308 NCCC(=O)c1ccccc1O Amb24346596 [0,2,0,0,0,0|1,0,1]=4 8685 B12R1.308 NCCC(F)c1cc[n]cc1F Amb24543855 [0,2,0,0,0,0|2,0,0]=4 8686 B12R1.308 NCCC(F)c1ccccc1Cl Amb25083769 [0,2,0,0,0,0|1,0,0]=3 8687 B12R1.308 NCCC(F)c1ccccc1O Amb24742701 [0,2,0,0,0,0|1,0,0]=3 8688 B12R1.308 NCCC(N)c1ccccc1Br Amb25339731 [0,2,0,0,0,0|1,0,0]=3 8689 B12R1.308 NCCC(O)c1[n]cccc1F Amb24536231 [0,2,0,0,0,0|2,0,0]=4 8690 B12R1.308 NCCC(O)c1cc[n]cc1F Amb25076891 [0,2,0,0,0,0|2,0,0]=4 8691 B12R1.308 NCCC(O)c1cc[n]cc1O Amb24596511 [0,2,0,0,0,0|2,0,0]=4 8692 B12R1.308 NCCC(O)c1ccccc1Br Amb18747006 [0,2,0,0,0,0|1,0,0]=3 8693 B12R1.308 NCCC(O)c1ccccc1O Amb24718394 [0,2,0,0,0,0|1,0,0]=3 8694 B12R1.308 NCCC(c1ccccc1C)C Amb17232447 [0,2,0,0,0,0|1,0,0]=3 8695 B12R1.308 NCCC(c1ccccc1C)O Amb17232539 [0,2,0,0,0,0|1,0,0]=3 8696 B12R1.308 NCCC(c1ccccc1Cl)C Amb17234048 [0,2,0,0,0,0|1,0,0]=3 8697 B12R1.308 NCCC(c1ccccc1Cl)O Amb17234259 [0,2,0,0,0,0|1,0,0]=3 8698 B12R1.308 NCCC(c1ccccc1F)C Amb17232646 [0,2,0,0,0,0|1,0,0]=3 8699 B12R1.308 NCCC(c1ccccc1F)O Amb17232696 [0,2,0,0,0,0|1,0,0]=3 8700 B12R1.308 NCCN(c1ccccc1Br)C Amb17059772 [0,2,0,0,0,0|2,0,0]=4 8701 B12R1.308 NCCN(c1ccccc1C)C Amb17059640 [0,2,0,0,0,0|2,0,0]=4 8702 B12R1.308 NCCN(c1ccccc1Cl)C Amb17059645 [0,2,0,0,0,0|2,0,0]=4 8703 B12R1.308 NCCN(c1ccccc1F)C Amb17059642 [0,2,0,0,0,0|2,0,0]=4 8704 B12R1.308 NCCS(=O)c1ccccc1Br Amb18290922 [0,2,0,0,0,0|2,0,0]=4 8705 B12R1.308 NCCS(=O)c1ccccc1Cl Amb18290916 [0,2,0,0,0,0|2,0,0]=4 8706 B12R1.308 NCCS(=O)c1ccccc1F Amb18974522 [0,2,0,0,0,0|2,0,0]=4 8707 B12R1.308 NCCS(=O)c1ccccc1F Amb19373859 [0,2,0,0,0,0|2,0,0]=4 8708 B12R1.308 NCC[C@@H](N)c1ccc[n]c1Cl Amb24656060 [0,2,0,0,0,0|2,0,0]=4 8709 B12R1.308 NCC[C@@H](N)c1ccccc1Br Amb24580692 [0,2,0,0,0,0|1,0,0]=3 8710 B12R1.308 NCC[C@@H](N)c1ccccc1F Amb24744679 [0,2,0,0,0,0|1,0,0]=3 8711 B12R1.308 NCC[C@@H](N)c1ccccc1O Amb24568021 [0,2,0,0,0,0|1,0,0]=3 8712 B12R1.308 NCC[C@H](N)c1cc[n]cc1Cl Amb25366616 [0,2,0,0,0,0|2,0,0]=4 8713 B12R1.308 NCC[C@H](N)c1ccccc1F Amb25339749 [0,2,0,0,0,0|1,0,0]=3 8714 B12R1.308 NNCC(O)c1ccccc1Br Amb18070085 [0,2,0,0,0,0|2,0,0]=4 8715 B12R1.308 NNCC(c1ccccc1C)O Amb17232608 [0,2,0,0,0,0|2,0,0]=4 8716 B12R1.308 NNCC(c1ccccc1Cl)O Amb17234360 [0,2,0,0,0,0|2,0,0]=4 8717 B12R1.308 NNCC(c1ccccc1F)O Amb17232742 [0,2,0,0,0,0|2,0,0]=4 8718 B12R1.308 N[C@@H](CC#N)c1ccccc1Cl Amb24580663 [0,2,0,0,0,0|1,0,1]=4 8719 B12R1.308 N[C@@H](CC#N)c1ccccc1S Amb24417746 [0,2,0,0,0,0|1,0,1]=4 8720 B12R1.308 N[C@@H](CCO)c1[n]cccc1F Amb25698321 [0,2,0,0,0,0|1,0,0]=3 8721 B12R1.308 N[C@@H](CCO)c1c[n]ccc1Cl Amb25148599 [0,2,0,0,0,0|1,0,0]=3 8722 B12R1.308 N[C@@H](CCO)c1cc[n]cc1F Amb24423142 [0,2,0,0,0,0|1,0,0]=3 8723 B12R1.308 N[C@@H](CCO)c1ccc[n]c1F Amb25821978 [0,2,0,0,0,0|1,0,0]=3 8724 B12R1.308 N[C@@H](CCO)c1ccccc1Br Amb25140602 [0,2,0,0,0,0|0,0,0]=2 8725 B12R1.308 N[C@@H](CCO)c1ccccc1Cl Amb19888408 [0,2,0,0,0,0|0,0,0]=2 8726 B12R1.308 N[C@@H](CCO)c1ccccc1S Amb25791527 [0,2,0,0,0,0|0,0,0]=2 8727 B12R1.308 N[C@H](CC#N)c1ccccc1Br Amb24727021 [0,2,0,0,0,0|1,0,1]=4 8728 B12R1.308 N[C@H](CC#N)c1ccccc1I Amb25778122 [0,2,0,0,0,0|1,0,1]=4 8729 B12R1.308 N[C@H](CC#N)c1ccccc1O Amb24588659 [0,2,0,0,0,0|1,0,1]=4 8730 B12R1.308 N[C@H](CC#N)c1ccccc1S Amb24465056 [0,2,0,0,0,0|1,0,1]=4 8731 B12R1.308 N[C@H](CCO)c1[n]cccc1Cl Amb25808103 [0,2,0,0,0,0|1,0,0]=3 8732 B12R1.308 N[C@H](CCO)c1[n]cccc1O Amb24487359 [0,2,0,0,0,0|1,0,0]=3 8733 B12R1.308 N[C@H](CCO)c1c[n]ccc1Br Amb25259097 [0,2,0,0,0,0|1,0,0]=3 8734 B12R1.308 N[C@H](CCO)c1c[n]ccc1Cl Amb25149887 [0,2,0,0,0,0|1,0,0]=3 8735 B12R1.308 N[C@H](CCO)c1cc[n]cc1Br Amb24696421 [0,2,0,0,0,0|1,0,0]=3 8736 B12R1.308 N[C@H](CCO)c1cc[n]cc1F Amb25761821 [0,2,0,0,0,0|1,0,0]=3 8737 B12R1.308 N[C@H](CCO)c1ccc[n]c1O Amb25751304 [0,2,0,0,0,0|1,0,0]=3 8738 B12R1.308 N[C@H](CCO)c1ccc[n]c1S Amb24488523 [0,2,0,0,0,0|1,0,0]=3 8739 B12R1.308 N[C@H](CCO)c1ccccc1Br Amb25301240 [0,2,0,0,0,0|0,0,0]=2 8740 B12R1.308 N[C@H](CCO)c1ccccc1Cl Amb19887650 [0,2,0,0,0,0|0,0,0]=2 8741 B12R1.308 N[C@H](CCO)c1ccccc1S Amb25694372 [0,2,0,0,0,0|0,0,0]=2 8742 B12R1.308 Nc1[n]cccc1C(O)CCN Amb24525118 [0,2,0,0,0,0|2,0,0]=4 8743 B12R1.308 Nc1[n]cccc1[C@H](N)CCO Amb24699148 [0,2,0,0,0,0|1,0,0]=3 8744 B12R1.308 Nc1c[n]ccc1[C@H](N)CCO Amb24746611 [0,2,0,0,0,0|1,0,0]=3 8745 B12R1.308 Nc1cc[n]cc1[C@@H](N)CCO Amb25111522 [0,2,0,0,0,0|1,0,0]=3 8746 B12R1.308 Nc1ccc[n]c1[C@@H](N)CCO Amb25809412 [0,2,0,0,0,0|1,0,0]=3 8747 B12R1.308 Nc1ccccc1C(=O)CCN Amb21855941 [0,2,0,0,0,0|1,0,1]=4 8748 B12R1.308 Nc1ccccc1C(=O)CCN Amb22350218 [0,2,0,0,0,0|1,0,1]=4 8749 B12R1.308 Nc1ccccc1C(N)CCO Amb22235813 [0,2,0,0,0,0|0,0,0]=2 8750 B12R1.308 Nc1ccccc1S(=O)CCF Amb25337402 [0,2,0,0,0,0|2,0,0]=4 8751 B12R1.308 Nc1ccccc1S(=O)CCO Amb25299207 [0,2,0,0,0,0|1,0,0]=3 8752 B12R1.308 Nc1ccccc1[C@H](N)CC#N Amb25714152 [0,2,0,0,0,0|1,0,1]=4 8753 B12R1.308 Nc1ccccc1[C@H](N)CCO Amb19887576 [0,2,0,0,0,0|0,0,0]=2 8754 B12R1.308 O=C(CCBr)c1ccccc1Br Amb24695292 [0,2,0,0,0,0|1,0,1]=4 8755 B12R1.308 O=C(CCBr)c1ccccc1I Amb24696334 [0,2,0,0,0,0|1,0,1]=4 8756 B12R1.308 O=C(CCCl)c1ccccc1Br Amb25377082 [0,2,0,0,0,0|1,0,1]=4 8757 B12R1.308 O=C(CCCl)c1ccccc1Cl Amb22229247 [0,2,0,0,0,0|1,0,1]=4 8758 B12R1.308 O=C(CCCl)c1ccccc1I Amb25796603 [0,2,0,0,0,0|1,0,1]=4 8759 B12R1.308 O=S(CCF)c1ccccc1F Amb25374903 [0,2,0,0,0,0|2,0,0]=4 8760 B12R1.308 OC(CCCl)c1ccccc1Cl Amb25159575 [0,2,0,0,0,0|1,0,0]=3 8761 B12R1.308 OCCC(=O)c1ccccc1F Amb25159895 [0,2,0,0,0,0|0,0,1]=3 8762 B12R1.308 OCCC(O)c1[n]cccc1Cl Amb25157617 [0,2,0,0,0,0|1,0,0]=3 8763 B12R1.308 OCCC(O)c1c[n]ccc1Br Amb24458860 [0,2,0,0,0,0|1,0,0]=3 8764 B12R1.308 OCCC(O)c1ccc[n]c1Cl Amb22298357 [0,2,0,0,0,0|1,0,0]=3 8765 B12R1.308 OCCC(O)c1ccccc1Br Amb24668754 [0,2,0,0,0,0|0,0,0]=2 8766 B12R1.308 OCCC(O)c1ccccc1Cl Amb25275717 [0,2,0,0,0,0|0,0,0]=2 8767 B12R1.308 OCCC(O)c1ccccc1F Amb24649873 [0,2,0,0,0,0|0,0,0]=2 8768 B12R1.308 OCCC(c1ccccc1C)C Amb17232499 [0,2,0,0,0,0|0,0,0]=2 8769 B12R1.308 OCCC(c1ccccc1C)N Amb17103953 [0,2,0,0,0,0|0,0,0]=2 8770 B12R1.308 OCCC(c1ccccc1Cl)C Amb17234164 [0,2,0,0,0,0|0,0,0]=2 8771 B12R1.308 OCCC(c1ccccc1Cl)N Amb1993960 [0,2,0,0,0,0|0,0,0]=2 8772 B12R1.308 OCCC(c1ccccc1F)C Amb17232671 [0,2,0,0,0,0|0,0,0]=2 8773 B12R1.308 OCCC(c1ccccc1F)N Amb2408130 [0,2,0,0,0,0|0,0,0]=2 8774 B12R1.308 OCCN(c1ccccc1Br)C Amb17344451 [0,2,0,0,0,0|1,0,0]=3 8775 B12R1.308 OCCN(c1ccccc1C)C Amb17334643 [0,2,0,0,0,0|1,0,0]=3 8776 B12R1.308 OCCN(c1ccccc1Cl)C Amb17335810 [0,2,0,0,0,0|1,0,0]=3 8777 B12R1.308 OCCN(c1ccccc1F)C Amb17334763 [0,2,0,0,0,0|1,0,0]=3 8778 B12R1.308 OCC[C@@H](O)c1ccccc1F Amb25308216 [0,2,0,0,0,0|0,0,0]=2 8779 B12R1.308 OCC[C@H](O)c1ccccc1Br Amb24385097 [0,2,0,0,0,0|0,0,0]=2 8780 B12R1.308 OCC[C@H](O)c1ccccc1Cl Amb24748463 [0,2,0,0,0,0|0,0,0]=2 8781 B12R1.308 OCC[C@H](O)c1ccccc1F Amb25353877 [0,2,0,0,0,0|0,0,0]=2 8782 B12R1.308 ONCC(c1ccccc1C)O Amb17334702 [0,2,0,0,0,0|1,0,0]=3 8783 B12R1.308 ONCC(c1ccccc1Cl)O Amb17335947 [0,2,0,0,0,0|1,0,0]=3 8784 B12R1.308 ONCC(c1ccccc1F)O Amb17334837 [0,2,0,0,0,0|1,0,0]=3 8785 B12R1.308 Oc1ccccc1\C(\Cl)=C/CO Amb24655131 [0,2,0,0,0,0|0,0,2]=4 8786 B12R1.308 [C-]#[N+]CC(F)c1ccccc1Br Amb24743648 [0,2,0,0,0,0|2,0,0]=4 8787 B12R1.308 [C-]#[N+]CC(F)c1ccccc1Cl Amb25217280 [0,2,0,0,0,0|2,0,0]=4 8788 B12R1.308 [C-]#[N+]CC(F)c1ccccc1O Amb24654120 [0,2,0,0,0,0|2,0,0]=4 8789 B12R1.25 C=CCCc1cccc(Cl)c1Cl Amb25363988 [0,2,0,0,0,0|1,0,1]=4 8790 B12R1.25 C=CCCc1cccc(Cl)c1F Amb24411459 [0,2,0,0,0,0|1,0,1]=4 8791 B12R1.25 C=CCCc1cccc(F)c1F Amb24663845 [0,2,0,0,0,0|1,0,1]=4 8792 B12R1.25 CC1=CC=CN(CCCBr)C1=O Amb25106410 [0,2,0,0,0,0|2,0,0]=4 8793 B12R1.25 CC1=CC=CN(CCCC)C1=O Amb18405639 [0,2,0,0,0,0|2,0,0]=4 8794 B12R1.25 CC1=CC=CN(CCCCl)C1=O Amb24483605 [0,2,0,0,0,0|2,0,0]=4 8795 B12R1.25 CC1=CC=CN(CCCF)C1=O Amb25131611 [0,2,0,0,0,0|2,0,0]=4 8796 B12R1.25 CC1=CC=CN(CCCN)C1=O Amb18535491 [0,2,0,0,0,0|2,0,0]=4 8797 B12R1.25 CC1=CC=CN(CCCO)C1=O Amb18041290 [0,2,0,0,0,0|1,0,0]=3 8798 B12R1.25 CC1=CC=CN(CCCS)C1=O Amb24704094 [0,2,0,0,0,0|1,1,0]=4 8799 B12R1.25 CC1=NC=CN(CCCO)C1=O Amb25676939 [0,2,0,0,0,0|2,0,0]=4 8800 B12R1.25 CCCCN1C=CC=C(Br)C1=O Amb25036262 [0,2,0,0,0,0|2,0,0]=4 8801 B12R1.25 CCCCN1C=CC=C(I)C1=O Amb25340266 [0,2,0,0,0,0|2,0,0]=4 8802 B12R1.25 CCCCN1C=CC=C(N)C1=O Amb18986286 [0,2,0,0,0,0|2,0,0]=4 8803 B12R1.25 CCCCc1cccc(Cl)c1O Amb24584452 [0,2,0,0,0,0|1,0,0]=3 8804 B12R1.25 CCCCc1cccc(F)c1N Amb25842564 [0,2,0,0,0,0|1,0,0]=3 8805 B12R1.25 CCCCc1cccc(N)c1Cl Amb22229240 [0,2,0,0,0,0|1,0,0]=3 8806 B12R1.25 CCCNc1cccc(Cl)c1N Amb24377739 [0,2,0,0,0,0|2,0,0]=4 8807 B12R1.25 CCCNc1cccc(F)c1F Amb18793935 [0,2,0,0,0,0|2,0,0]=4 8808 B12R1.25 CCCNc1cccc(F)c1N Amb18968033 [0,2,0,0,0,0|2,0,0]=4 8809 B12R1.25 CCCOc1cccc(Br)c1F Amb24563134 [0,2,0,0,0,0|2,0,0]=4 8810 B12R1.25 CCCOc1cccc(Br)c1N Amb24406179 [0,2,0,0,0,0|2,0,0]=4 8811 B12R1.25 CCCOc1cccc(C)c1C Amb25051268 [0,2,0,0,0,0|2,0,0]=4 8812 B12R1.25 CCCOc1cccc(F)c1I Amb25057474 [0,2,0,0,0,0|2,0,0]=4 8813 B12R1.25 CCCOc1cccc(F)c1N Amb18288907 [0,2,0,0,0,0|2,0,0]=4 8814 B12R1.25 CCCOc1cccc(N)c1Br Amb25781135 [0,2,0,0,0,0|2,0,0]=4 8815 B12R1.25 CCCOc1cccc(N)c1Cl Amb24381575 [0,2,0,0,0,0|2,0,0]=4 8816 B12R1.25 CCCOc1cccc(O)c1O Amb25092908 [0,2,0,0,0,0|2,0,0]=4 8817 B12R1.25 CCCOc1cccc(S)c1N Amb18271336 [0,2,0,0,0,0|2,0,0]=4 8818 B12R1.25 CCCOc1cccc(c1F)F Amb10839414 [0,2,0,0,0,0|2,0,0]=4 8819 B12R1.25 CCCSc1cccc(Cl)c1N Amb24680543 [0,2,0,0,0,0|2,0,0]=4 8820 B12R1.25 CCCSc1cccc(F)c1N Amb18968084 [0,2,0,0,0,0|2,0,0]=4 8821 B12R1.25 CCNCc1cccc(Br)c1O Amb18977687 [0,2,0,0,0,0|2,0,0]=4 8822 B12R1.25 CCNCc1cccc(Cl)c1F Amb25333914 [0,2,0,0,0,0|2,0,0]=4 8823 B12R1.25 CCNCc1cccc(Cl)c1O Amb25359268 [0,2,0,0,0,0|2,0,0]=4 8824 B12R1.25 CCNCc1cccc(F)c1Br Amb25783687 [0,2,0,0,0,0|2,0,0]=4 8825 B12R1.25 CCNCc1cccc(F)c1Cl Amb24370386 [0,2,0,0,0,0|2,0,0]=4 8826 B12R1.25 CCNCc1cccc(O)c1O Amb18291189 [0,2,0,0,0,0|2,0,0]=4 8827 B12R1.25 CCOCc1cccc(F)c1Br Amb25039081 [0,2,0,0,0,0|2,0,0]=4 8828 B12R1.25 CCOCc1cccc(N)c1Br Amb24524831 [0,2,0,0,0,0|2,0,0]=4 8829 B12R1.25 CCSCc1cccc(F)c1Br Amb25690565 [0,2,0,0,0,0|2,0,0]=4 8830 B12R1.25 CCSCc1cccc(F)c1Cl Amb24372465 [0,2,0,0,0,0|2,0,0]=4 8831 B12R1.25 CCSCc1cccc(F)c1F Amb25158618 [0,2,0,0,0,0|2,0,0]=4 8832 B12R1.25 CN1N=CC=C(CCCO)C1=O Amb24519026 [0,2,0,0,0,0|2,0,0]=4 8833 B12R1.25 CNCCc1cccc(Br)c1F Amb25159686 [0,2,0,0,0,0|2,0,0]=4 8834 B12R1.25 CNCCc1cccc(Cl)c1Cl Amb24460400 [0,2,0,0,0,0|2,0,0]=4 8835 B12R1.25 CNCCc1cccc(Cl)c1F Amb24407330 [0,2,0,0,0,0|2,0,0]=4 8836 B12R1.25 CNCCc1cccc(F)c1Br Amb25291460 [0,2,0,0,0,0|2,0,0]=4 8837 B12R1.25 CNCCc1cccc(F)c1F Amb18993051 [0,2,0,0,0,0|2,0,0]=4 8838 B12R1.25 CNCCc1cccc(O)c1Br Amb25331885 [0,2,0,0,0,0|2,0,0]=4 8839 B12R1.25 CNCCc1cccc(O)c1Cl Amb24497424 [0,2,0,0,0,0|2,0,0]=4 8840 B12R1.25 CNCCc1cccc(O)c1F Amb25080086 [0,2,0,0,0,0|2,0,0]=4 8841 B12R1.25 CNCCc1cccc(O)c1O Amb24664300 [0,2,0,0,0,0|2,0,0]=4 8842 B12R1.25 CSCCc1cccc(Cl)c1Cl Amb24632980 [0,2,0,0,0,0|2,0,0]=4 8843 B12R1.25 Cc1[n]ccc(CCCC)c1O Amb25223990 [0,2,0,0,0,0|2,0,0]=4 8844 B12R1.25 Cc1[n]ccc(SCCO)c1Cl Amb25795628 [0,2,0,0,0,0|2,0,0]=4 8845 B12R1.25 Cc1c(Br)[n]ccc1OCCO Amb24497837 [0,2,0,0,0,0|2,0,0]=4 8846 B12R1.25 Cc1c(Br)cccc1CCCCl Amb24579173 [0,2,0,0,0,0|1,0,0]=3 8847 B12R1.25 Cc1c(Br)cccc1NCCC Amb24420962 [0,2,0,0,0,0|2,0,0]=4 8848 B12R1.25 Cc1c(CCC#N)cccc1C Amb17204304 [0,2,0,0,0,0|1,0,1]=4 8849 B12R1.25 Cc1c(CCC#N)cccc1Cl Amb17204322 [0,2,0,0,0,0|1,0,1]=4 8850 B12R1.25 Cc1c(CCCN)cccc1C Amb17204309 [0,2,0,0,0,0|1,0,0]=3 8851 B12R1.25 Cc1c(CCCN)cccc1Cl Amb17204335 [0,2,0,0,0,0|1,0,0]=3 8852 B12R1.25 Cc1c(CCNN)cccc1C Amb17400169 [0,2,0,0,0,0|2,0,0]=4 8853 B12R1.25 Cc1c(Cl)c[n]cc1CCCN Amb24438422 [0,2,0,0,0,0|2,0,0]=4 8854 B12R1.25 Cc1c(Cl)cc[n]c1CCCN Amb25842554 [0,2,0,0,0,0|2,0,0]=4 8855 B12R1.25 Cc1c(Cl)cccc1CCC=O Amb18564226 [0,2,0,0,0,0|0,0,2]=4 8856 B12R1.25 Cc1c(Cl)cccc1CCCO Amb23537657 [0,2,0,0,0,0|0,0,0]=2 8857 B12R1.25 Cc1c(Cl)cccc1CNCC Amb24524983 [0,2,0,0,0,0|2,0,0]=4 8858 B12R1.25 Cc1c(F)cccc1CCC#N Amb25224723 [0,2,0,0,0,0|1,0,1]=4 8859 B12R1.25 Cc1c(F)cccc1CCC=O Amb25299267 [0,2,0,0,0,0|0,0,2]=4 8860 B12R1.25 Cc1c(F)cccc1CCCN Amb23442800 [0,2,0,0,0,0|1,0,0]=3 8861 B12R1.25 Cc1c(F)cccc1CCCO Amb23590885 [0,2,0,0,0,0|0,0,0]=2 8862 B12R1.25 Cc1c(F)cccc1CNCC Amb24543251 [0,2,0,0,0,0|2,0,0]=4 8863 B12R1.25 Cc1c(F)cccc1NCCC Amb18798862 [0,2,0,0,0,0|2,0,0]=4 8864 B12R1.25 Cc1c(F)cccc1\C=C\CO Amb23442807 [0,2,0,0,0,0|0,0,2]=4 8865 B12R1.25 Cc1c(N)cccc1CNCC Amb25043953 [0,2,0,0,0,0|2,0,0]=4 8866 B12R1.25 Cc1c(N)cccc1NCCC Amb18303020 [0,2,0,0,0,0|2,0,0]=4 8867 B12R1.25 Cc1c(N)cccc1NCCF Amb25799841 [0,2,0,0,0,0|2,0,0]=4 8868 B12R1.25 Cc1c(N)cccc1NCCO Amb19002458 [0,2,0,0,0,0|1,0,0]=3 8869 B12R1.25 Cc1c(N)cccc1OCCF Amb25238113 [0,2,0,0,0,0|2,0,0]=4 8870 B12R1.25 Cc1c(N)cccc1SCCC Amb18791357 [0,2,0,0,0,0|2,0,0]=4 8871 B12R1.25 Cc1c(N)cccc1SCCO Amb19002507 [0,2,0,0,0,0|1,0,0]=3 8872 B12R1.25 Cc1c(NCCCl)cccc1C Amb17335666 [0,2,0,0,0,0|2,0,0]=4 8873 B12R1.25 Cc1c(NCCN)cccc1C Amb17091054 [0,2,0,0,0,0|2,0,0]=4 8874 B12R1.25 Cc1c(NCCN)cccc1Cl Amb17091057 [0,2,0,0,0,0|2,0,0]=4 8875 B12R1.25 Cc1c(O)cccc1CCC#N Amb24527961 [0,2,0,0,0,0|1,0,1]=4 8876 B12R1.25 Cc1c(OCCN)cccc1C Amb1138513 [0,2,0,0,0,0|2,0,0]=4 8877 B12R1.25 Cc1c(OCCN)cccc1C Amb2091065 [0,2,0,0,0,0|2,0,0]=4 8878 B12R1.25 Cc1c(OCCS)cccc1C Amb17233945 [0,2,0,0,0,0|1,1,0]=4 8879 B12R1.25 Cc1c(cccc1Br)NCCN Amb24654407 [0,2,0,0,0,0|2,0,0]=4 8880 B12R1.25 Cc1c(cccc1Br)NCCO Amb25144864 [0,2,0,0,0,0|1,0,0]=3 8881 B12R1.25 Cc1c(cccc1Br)OCCN Amb24395348 [0,2,0,0,0,0|2,0,0]=4 8882 B12R1.25 Cc1c(cccc1Cl)NCCF Amb25744159 [0,2,0,0,0,0|2,0,0]=4 8883 B12R1.25 Cc1c(cccc1Cl)OCCN Amb24454848 [0,2,0,0,0,0|2,0,0]=4 8884 B12R1.25 Cc1c(cccc1F)NCCN Amb18251978 [0,2,0,0,0,0|2,0,0]=4 8885 B12R1.25 Cc1c(cccc1F)NCCO Amb18980394 [0,2,0,0,0,0|1,0,0]=3 8886 B12R1.25 Cc1c(cccc1I)NCCF Amb25124421 [0,2,0,0,0,0|2,0,0]=4 8887 B12R1.25 Cc1c(cccc1N)NCCN Amb19002501 [0,2,0,0,0,0|2,0,0]=4 8888 B12R1.25 Cc1c[n]cc(CCCN)c1C Amb24682311 [0,2,0,0,0,0|2,0,0]=4 8889 B12R1.25 Cc1c[n]cc(CCCN)c1F Amb25797431 [0,2,0,0,0,0|2,0,0]=4 8890 B12R1.25 Cc1cc[n]c(CCCC)c1N Amb25160013 [0,2,0,0,0,0|2,0,0]=4 8891 B12R1.25 Cc1cc[n]c(NCCO)c1Cl Amb25160117 [0,2,0,0,0,0|2,0,0]=4 8892 B12R1.25 Cc1cc[n]c(OCCO)c1N Amb24414249 [0,2,0,0,0,0|2,0,0]=4 8893 B12R1.25 Cc1cc[n]c(SCCO)c1N Amb25705549 [0,2,0,0,0,0|2,0,0]=4 8894 B12R1.25 Cc1cccc(C#CCO)c1C Amb18797805 [0,2,0,0,0,0|0,0,2]=4 8895 B12R1.25 Cc1cccc(CCC=O)c1Br Amb24532658 [0,2,0,0,0,0|0,0,2]=4 8896 B12R1.25 Cc1cccc(CCC=O)c1C Amb18563554 [0,2,0,0,0,0|0,0,2]=4 8897 B12R1.25 Cc1cccc(CCC=O)c1F Amb24093002 [0,2,0,0,0,0|0,0,2]=4 8898 B12R1.25 Cc1cccc(CCCBr)c1Br Amb25248971 [0,2,0,0,0,0|1,0,0]=3 8899 B12R1.25 Cc1cccc(CCCBr)c1O Amb25269813 [0,2,0,0,0,0|1,0,0]=3 8900 B12R1.25 Cc1cccc(CCCBr)c1S Amb25195138 [0,2,0,0,0,0|1,0,0]=3 8901 B12R1.25 Cc1cccc(CCCC)c1N Amb24104100 [0,2,0,0,0,0|1,0,0]=3 8902 B12R1.25 Cc1cccc(CCCC)c1O Amb25669631 [0,2,0,0,0,0|1,0,0]=3 8903 B12R1.25 Cc1cccc(CCCCl)c1Cl Amb24656579 [0,2,0,0,0,0|1,0,0]=3 8904 B12R1.25 Cc1cccc(CCCCl)c1O Amb25139391 [0,2,0,0,0,0|1,0,0]=3 8905 B12R1.25 Cc1cccc(CCCN)c1Cl Amb25677548 [0,2,0,0,0,0|1,0,0]=3 8906 B12R1.25 Cc1cccc(CCCN)c1F Amb25135172 [0,2,0,0,0,0|1,0,0]=3 8907 B12R1.25 Cc1cccc(CCCO)c1Br Amb25159971 [0,2,0,0,0,0|0,0,0]=2 8908 B12R1.25 Cc1cccc(CCCO)c1C Amb23537989 [0,2,0,0,0,0|0,0,0]=2 8909 B12R1.25 Cc1cccc(CCCO)c1O Amb24671286 [0,2,0,0,0,0|0,0,0]=2 8910 B12R1.25 Cc1cccc(CCNC)c1C Amb18993611 [0,2,0,0,0,0|2,0,0]=4 8911 B12R1.25 Cc1cccc(CCNC)c1F Amb25069543 [0,2,0,0,0,0|2,0,0]=4 8912 B12R1.25 Cc1cccc(CNCC)c1I Amb25278198 [0,2,0,0,0,0|2,0,0]=4 8913 B12R1.25 Cc1cccc(CNCC)c1O Amb24661722 [0,2,0,0,0,0|2,0,0]=4 8914 B12R1.25 Cc1cccc(COCS)c1N Amb24451659 [0,2,0,0,0,0|1,1,0]=4 8915 B12R1.25 Cc1cccc(NCCC)c1Cl Amb25816695 [0,2,0,0,0,0|2,0,0]=4 8916 B12R1.25 Cc1cccc(NCCF)c1Br Amb25108876 [0,2,0,0,0,0|2,0,0]=4 8917 B12R1.25 Cc1cccc(NCCN)c1F Amb25684079 [0,2,0,0,0,0|2,0,0]=4 8918 B12R1.25 Cc1cccc(NCCO)c1Br Amb25046066 [0,2,0,0,0,0|1,0,0]=3 8919 B12R1.25 Cc1cccc(NCCO)c1Cl Amb24652065 [0,2,0,0,0,0|1,0,0]=3 8920 B12R1.25 Cc1cccc(OCCBr)c1F Amb25068549 [0,2,0,0,0,0|2,0,0]=4 8921 B12R1.25 Cc1cccc(OCCF)c1N Amb24487580 [0,2,0,0,0,0|2,0,0]=4 8922 B12R1.25 Cc1cccc(OCCN)c1Cl Amb24447813 [0,2,0,0,0,0|2,0,0]=4 8923 B12R1.25 Cc1cccc(OCCS)c1F Amb25766773 [0,2,0,0,0,0|1,1,0]=4 8924 B12R1.25 Cc1cccc(SCCN)c1N Amb25133561 [0,2,0,0,0,0|2,0,0]=4 8925 B12R1.25 Cc1cccc(\C=C/CO)c1O Amb24497313 [0,2,0,0,0,0|0,0,2]=4 8926 B12R1.25 Cc1cccc(\C=C\CO)c1C Amb25139939 [0,2,0,0,0,0|0,0,2]=4 8927 B12R1.25 Cc1cccc(\C=C\CO)c1F Amb24473288 [0,2,0,0,0,0|0,0,2]=4 8928 B12R1.25 Cc1ccnc(c1N)NCCO Amb17213619 [0,2,0,0,0,0|2,0,0]=4 8929 B12R1.25 ClCCCc1cccc(Cl)c1Cl Amb24367464 [0,2,0,0,0,0|1,0,0]=3 8930 B12R1.25 ClCCCc1cccc(I)c1Br Amb25208583 [0,2,0,0,0,0|1,0,0]=3 8931 B12R1.25 ClCCCc1cccc(I)c1I Amb25249930 [0,2,0,0,0,0|1,0,0]=3 8932 B12R1.25 ClCCNc1cccc(c1C)Cl Amb17338051 [0,2,0,0,0,0|2,0,0]=4 8933 B12R1.25 ClCCNc1cccc(c1Cl)Cl Amb17343166 [0,2,0,0,0,0|2,0,0]=4 8934 B12R1.25 Clc1c(CCC#N)cccc1Cl Amb17204388 [0,2,0,0,0,0|1,0,1]=4 8935 B12R1.25 Clc1c(I)cccc1CCCBr Amb24656429 [0,2,0,0,0,0|1,0,0]=3 8936 B12R1.25 Clc1c(OCC[NH3+])cccc1Cl Amb2444251 [0,2,0,0,0,0|2,0,0]=4 8937 B12R1.25 Clc1cccc(CCCBr)c1Cl Amb24730274 [0,2,0,0,0,0|1,0,0]=3 8938 B12R1.25 FCCNc1cccc(Cl)c1Cl Amb25108906 [0,2,0,0,0,0|2,0,0]=4 8939 B12R1.25 Fc1c(Cl)cccc1NCCF Amb24693402 [0,2,0,0,0,0|2,0,0]=4 8940 B12R1.25 Fc1cccc(CCCBr)c1Br Amb25039114 [0,2,0,0,0,0|1,0,0]=3 8941 B12R1.25 Fc1cccc(CCCBr)c1F Amb22001598 [0,2,0,0,0,0|1,0,0]=3 8942 B12R1.25 Fc1cccc(CCCCl)c1Br Amb24566065 [0,2,0,0,0,0|1,0,0]=3 8943 B12R1.25 Fc1cccc(CCCCl)c1F Amb19073202 [0,2,0,0,0,0|1,0,0]=3 8944 B12R1.25 Fc1cccc(CCCCl)c1S Amb24712667 [0,2,0,0,0,0|1,0,0]=3 8945 B12R1.25 Fc1cccc(OCCCl)c1F Amb19041934 [0,2,0,0,0,0|2,0,0]=4 8946 B12R1.25 Fc1cccc(OCCS)c1F Amb25806509 [0,2,0,0,0,0|1,1,0]=4 8947 B12R1.25 N#CCCc1cccc(Br)c1I Amb24656655 [0,2,0,0,0,0|1,0,1]=4 8948 B12R1.25 N#CCCc1cccc(Br)c1O Amb24586533 [0,2,0,0,0,0|1,0,1]=4 8949 B12R1.25 N#CCCc1cccc(F)c1Br Amb25258746 [0,2,0,0,0,0|1,0,1]=4 8950 B12R1.25 N#CCCc1cccc(F)c1Cl Amb24751316 [0,2,0,0,0,0|1,0,1]=4 8951 B12R1.25 N#CCCc1cccc(O)c1O Amb24497134 [0,2,0,0,0,0|1,0,1]=4 8952 B12R1.25 N#CCCc1cccc(S)c1F Amb25254634 [0,2,0,0,0,0|1,0,1]=4 8953 B12R1.25 N#CCCc1cccc(S)c1I Amb24567236 [0,2,0,0,0,0|1,0,1]=4 8954 B12R1.25 N=CCCc1cccc(O)c1O Amb25713589 [0,2,0,0,0,0|1,0,1]=4 8955 B12R1.25 NC1=CC=CN(CCCO)C1=O Amb18295572 [0,2,0,0,0,0|1,0,0]=3 8956 B12R1.25 NCCCN1C=CC=C(Br)C1=O Amb18040597 [0,2,0,0,0,0|2,0,0]=4 8957 B12R1.25 NCCCc1c[n]cc(Cl)c1F Amb24679665 [0,2,0,0,0,0|2,0,0]=4 8958 B12R1.25 NCCCc1c[n]cc(Cl)c1O Amb24367850 [0,2,0,0,0,0|2,0,0]=4 8959 B12R1.25 NCCCc1c[n]cc(F)c1Cl Amb24454653 [0,2,0,0,0,0|2,0,0]=4 8960 B12R1.25 NCCCc1c[n]cc(O)c1Cl Amb24403092 [0,2,0,0,0,0|2,0,0]=4 8961 B12R1.25 NCCCc1cccc(Br)c1O Amb25738591 [0,2,0,0,0,0|1,0,0]=3 8962 B12R1.25 NCCCc1cccc(Cl)c1Br Amb25320523 [0,2,0,0,0,0|1,0,0]=3 8963 B12R1.25 NCCCc1cccc(F)c1Br Amb25683566 [0,2,0,0,0,0|1,0,0]=3 8964 B12R1.25 NCCCc1cccc(O)c1O Amb24426748 [0,2,0,0,0,0|1,0,0]=3 8965 B12R1.25 NCCCc1cccc(c1Cl)Cl Amb17204407 [0,2,0,0,0,0|1,0,0]=3 8966 B12R1.25 NCCNc1cccc(Cl)c1F Amb18909782 [0,2,0,0,0,0|2,0,0]=4 8967 B12R1.25 NCCNc1cccc(F)c1F Amb18908891 [0,2,0,0,0,0|2,0,0]=4 8968 B12R1.25 NCCNc1cccc(F)c1I Amb25723571 [0,2,0,0,0,0|2,0,0]=4 8969 B12R1.25 NCCNc1cccc(c1Cl)Cl Amb17091084 [0,2,0,0,0,0|2,0,0]=4 8970 B12R1.25 NCCOc1cccc(Br)c1F Amb25841484 [0,2,0,0,0,0|2,0,0]=4 8971 B12R1.25 NCCOc1cccc(Cl)c1Br Amb24686813 [0,2,0,0,0,0|2,0,0]=4 8972 B12R1.25 NCCOc1cccc(Cl)c1F Amb25330890 [0,2,0,0,0,0|2,0,0]=4 8973 B12R1.25 NCCOc1cccc(F)c1F Amb19002179 [0,2,0,0,0,0|2,0,0]=4 8974 B12R1.25 NCCOc1cccc(c1Cl)Cl Amb10609908 [0,2,0,0,0,0|2,0,0]=4 8975 B12R1.25 NNCCc1cccc(Cl)c1Cl Amb24751331 [0,2,0,0,0,0|2,0,0]=4 8976 B12R1.25 NNCCc1cccc(Cl)c1F Amb24655836 [0,2,0,0,0,0|2,0,0]=4 8977 B12R1.25 NNCCc1cccc(F)c1Cl Amb25342054 [0,2,0,0,0,0|2,0,0]=4 8978 B12R1.25 NOCCc1cccc(F)c1F Amb24497503 [0,2,0,0,0,0|2,0,0]=4 8979 B12R1.25 Nc1c(Br)cccc1NCCN Amb25071760 [0,2,0,0,0,0|2,0,0]=4 8980 B12R1.25 Nc1c(CCCBr)cccc1Br Amb25270390 [0,2,0,0,0,0|1,0,0]=3 8981 B12R1.25 Nc1c(COCS)cccc1Cl Amb25311898 [0,2,0,0,0,0|1,1,0]=4 8982 B12R1.25 Nc1c(Cl)cccc1CCC=O Amb24743856 [0,2,0,0,0,0|0,0,2]=4 8983 B12R1.25 Nc1c(Cl)cccc1CCCBr Amb25208690 [0,2,0,0,0,0|1,0,0]=3 8984 B12R1.25 Nc1c(Cl)cccc1NCCN Amb24671070 [0,2,0,0,0,0|2,0,0]=4 8985 B12R1.25 Nc1c(F)cccc1NCCN Amb18991513 [0,2,0,0,0,0|2,0,0]=4 8986 B12R1.25 Nc1c(F)cccc1OCCN Amb24685005 [0,2,0,0,0,0|2,0,0]=4 8987 B12R1.25 Nc1c(I)cccc1CCC=O Amb25249914 [0,2,0,0,0,0|0,0,2]=4 8988 B12R1.25 Nc1c(O)cccc1CCC#N Amb25239491 [0,2,0,0,0,0|1,0,1]=4 8989 B12R1.25 Nc1c(O)cccc1CCCCl Amb25208685 [0,2,0,0,0,0|1,0,0]=3 8990 B12R1.25 Nc1c(S)cccc1CCC=O Amb25242712 [0,2,0,0,0,0|0,0,2]=4 8991 B12R1.25 Nc1c(cccc1Br)NCCF Amb24359399 [0,2,0,0,0,0|2,0,0]=4 8992 B12R1.25 Nc1c(cccc1Cl)NCCF Amb25669798 [0,2,0,0,0,0|2,0,0]=4 8993 B12R1.25 Nc1c(cccc1Cl)OCCO Amb25800609 [0,2,0,0,0,0|1,0,0]=3 8994 B12R1.25 Nc1c(cccc1F)NCCO Amb18968044 [0,2,0,0,0,0|1,0,0]=3 8995 B12R1.25 Nc1c(cccc1F)OCCO Amb18968080 [0,2,0,0,0,0|1,0,0]=3 8996 B12R1.25 Nc1c(cccc1F)SCCO Amb18288911 [0,2,0,0,0,0|1,0,0]=3 8997 B12R1.25 Nc1c(cccc1O)OCCO Amb24621417 [0,2,0,0,0,0|1,0,0]=3 8998 B12R1.25 Nc1cc[n]c(NCCO)c1N Amb24374592 [0,2,0,0,0,0|2,0,0]=4 8999 B12R1.25 Nc1cccc(CCC#N)c1N Amb25312576 [0,2,0,0,0,0|1,0,1]=4 9000 B12R1.25 Nc1cccc(CCC#N)c1O Amb24579221 [0,2,0,0,0,0|1,0,1]=4 9001 B12R1.25 Nc1cccc(CCCBr)c1Cl Amb24574270 [0,2,0,0,0,0|1,0,0]=3 9002 B12R1.25 Nc1cccc(CCCBr)c1O Amb25195517 [0,2,0,0,0,0|1,0,0]=3 9003 B12R1.25 Nc1cccc(CCCCl)c1N Amb24695907 [0,2,0,0,0,0|1,0,0]=3 9004 B12R1.25 Nc1cccc(CCCCl)c1O Amb25253604 [0,2,0,0,0,0|1,0,0]=3 9005 B12R1.25 O=C1C(Br)=CC=CN1CCCCl Amb24652017 [0,2,0,0,0,0|2,0,0]=4 9006 B12R1.25 O=C1C(Br)=CC=CN1CCCF Amb25045085 [0,2,0,0,0,0|2,0,0]=4 9007 B12R1.25 O=CCCc1cccc(Br)c1Cl Amb24483778 [0,2,0,0,0,0|0,0,2]=4 9008 B12R1.25 O=CCCc1cccc(Br)c1F Amb25739079 [0,2,0,0,0,0|0,0,2]=4 9009 B12R1.25 O=CCCc1cccc(Br)c1S Amb25270364 [0,2,0,0,0,0|0,0,2]=4 9010 B12R1.25 O=CCCc1cccc(Cl)c1Br Amb25856957 [0,2,0,0,0,0|0,0,2]=4 9011 B12R1.25 O=CCCc1cccc(Cl)c1Cl Amb18066576 [0,2,0,0,0,0|0,0,2]=4 9012 B12R1.25 O=CCCc1cccc(F)c1F Amb18801722 [0,2,0,0,0,0|0,0,2]=4 9013 B12R1.25 O=CCCc1cccc(I)c1F Amb25148788 [0,2,0,0,0,0|0,0,2]=4 9014 B12R1.25 OCC#Cc1cccc(Cl)c1F Amb25306469 [0,2,0,0,0,0|0,0,2]=4 9015 B12R1.25 OCC#Cc1cccc(F)c1F Amb25148503 [0,2,0,0,0,0|0,0,2]=4 9016 B12R1.25 OCCCN1C=CC=C(Br)C1=O Amb18543189 [0,2,0,0,0,0|1,0,0]=3 9017 B12R1.25 OCCCN1C=CN=C(Cl)C1=O Amb25275953 [0,2,0,0,0,0|2,0,0]=4 9018 B12R1.25 OCCCN1C=NC=C(Br)C1=O Amb24411359 [0,2,0,0,0,0|2,0,0]=4 9019 B12R1.25 OCCCN1C=NC=C(I)C1=O Amb24427940 [0,2,0,0,0,0|2,0,0]=4 9020 B12R1.25 OCCCc1cccc(Cl)c1F Amb24402092 [0,2,0,0,0,0|0,0,0]=2 9021 B12R1.25 OCCCc1cccc(F)c1Br Amb25834826 [0,2,0,0,0,0|0,0,0]=2 9022 B12R1.25 OCCCc1cccc(F)c1Cl Amb25136399 [0,2,0,0,0,0|0,0,0]=2 9023 B12R1.25 OCCCc1cccc(F)c1F Amb18802844 [0,2,0,0,0,0|0,0,0]=2 9024 B12R1.25 OCCCc1cccc(O)c1O Amb25063876 [0,2,0,0,0,0|0,0,0]=2 9025 B12R1.25 OCCCc1cccc(c1Cl)Cl Amb17605780 [0,2,0,0,0,0|0,0,0]=2 9026 B12R1.25 OCCNc1cccc(Br)c1Cl Amb25787091 [0,2,0,0,0,0|1,0,0]=3 9027 B12R1.25 OCCNc1cccc(Cl)c1Br Amb24271233 [0,2,0,0,0,0|1,0,0]=3 9028 B12R1.25 OCCNc1cccc(F)c1Cl Amb25675434 [0,2,0,0,0,0|1,0,0]=3 9029 B12R1.25 OCCNc1cccc(F)c1F Amb18972086 [0,2,0,0,0,0|1,0,0]=3 9030 B12R1.25 OCCNc1cccc(F)c1I Amb24365727 [0,2,0,0,0,0|1,0,0]=3 9031 B12R1.25 OCCOc1cccc(Cl)c1F Amb25154046 [0,2,0,0,0,0|1,0,0]=3 9032 B12R1.25 OCCOc1cccc(F)c1F Amb18790271 [0,2,0,0,0,0|1,0,0]=3 9033 B12R1.25 OCCOc1cccc(O)c1O Amb25142616 [0,2,0,0,0,0|1,0,0]=3 9034 B12R1.25 OC\C=C\c1cccc(Cl)c1Cl Amb23555632 [0,2,0,0,0,0|0,0,2]=4 9035 B12R1.25 OC\C=C\c1cccc(Cl)c1F Amb24581201 [0,2,0,0,0,0|0,0,2]=4 9036 B12R1.25 OC\C=C\c1cccc(F)c1F Amb24593079 [0,2,0,0,0,0|0,0,2]=4 9037 B12R1.25 Oc1c(Br)cccc1CCC=O Amb24728306 [0,2,0,0,0,0|0,0,2]=4 9038 B12R1.25 Oc1c(Br)cccc1CCCCl Amb25364541 [0,2,0,0,0,0|1,0,0]=3 9039 B12R1.25 Oc1c(Cl)cccc1CCCBr Amb24759296 [0,2,0,0,0,0|1,0,0]=3 9040 B12R1.25 Oc1c(Cl)cccc1CCCO Amb25098650 [0,2,0,0,0,0|0,0,0]=2 9041 B12R1.25 Oc1c(F)cccc1CCCO Amb24551042 [0,2,0,0,0,0|0,0,0]=2 9042 B12R1.25 Oc1c(I)cccc1CCCBr Amb24527854 [0,2,0,0,0,0|1,0,0]=3 9043 B12R1.25 Oc1c(S)cccc1CCCBr Amb24696726 [0,2,0,0,0,0|1,0,0]=3 9044 B12R1.25 Oc1c(S)cccc1CCCCl Amb24628082 [0,2,0,0,0,0|1,0,0]=3 9045 B12R1.25 Oc1cccc(CCC=O)c1F Amb25831101 [0,2,0,0,0,0|0,0,2]=4 9046 B12R1.25 Oc1cccc(CCCBr)c1Br Amb25325193 [0,2,0,0,0,0|1,0,0]=3 9047 B12R1.25 Oc1cccc(CCCBr)c1F Amb24679117 [0,2,0,0,0,0|1,0,0]=3 9048 B12R1.25 Oc1cccc(CCCBr)c1I Amb24527846 [0,2,0,0,0,0|1,0,0]=3 9049 B12R1.25 Oc1cccc(CCCCl)c1Br Amb24638371 [0,2,0,0,0,0|1,0,0]=3 9050 B12R1.25 Oc1cccc(\C=C\CO)c1Cl Amb24456130 [0,2,0,0,0,0|0,0,2]=4 9051 B12R1.25 SCCOc1cccc(c1Cl)Cl Amb17245966 [0,2,0,0,0,0|1,1,0]=4 9052 B12R1.25 Sc1c(I)cccc1CCCBr Amb24758199 [0,2,0,0,0,0|1,0,0]=3 9053 B12R1.25 Sc1cccc(CCCBr)c1S Amb25351784 [0,2,0,0,0,0|1,0,0]=3 9054 B12R1.121 C#CCCc1ccccc1C#N Amb18118066 [0,2,0,0,0,0|1,0,1]=4 9055 B12R1.121 C#CCCc1ccccc1CO Amb24069017 [0,2,0,0,0,0|1,0,1]=4 9056 B12R1.121 C#Cc1c[n]ccc1CCCO Amb24702653 [0,2,0,0,0,0|1,0,0]=3 9057 B12R1.121 C#Cc1ccccc1CCC=O Amb24422382 [0,2,0,0,0,0|0,0,2]=4 9058 B12R1.121 C#Cc1ccccc1OCCO Amb25092012 [0,2,0,0,0,0|1,0,0]=3 9059 B12R1.121 C=CCCc1ccccc1CO Amb24069012 [0,2,0,0,0,0|1,0,1]=4 9060 B12R1.121 C=Cc1ccccc1C#CCO Amb25236524 [0,2,0,0,0,0|0,0,2]=4 9061 B12R1.121 CCCNc1ccccc1CCl Amb24630890 [0,2,0,0,0,0|2,0,0]=4 9062 B12R1.121 CCCNc1ccccc1CN Amb18800850 [0,2,0,0,0,0|2,0,0]=4 9063 B12R1.121 CCCOc1ccccc1C=O Amb1033069 [0,2,0,0,0,0|2,0,0]=4 9064 B12R1.121 CCCOc1ccccc1CN Amb1141875 [0,2,0,0,0,0|2,0,0]=4 9065 B12R1.121 CCCOc1ccccc1NC Amb18316381 [0,2,0,0,0,0|2,0,0]=4 9066 B12R1.121 CCCOc1ccccc1NN Amb25751634 [0,2,0,0,0,0|2,0,0]=4 9067 B12R1.121 CCCOc1ccccc1[Zn]Br Amb22897953 [0,2,0,0,0,0|2,0,0]=4 9068 B12R1.121 CCCSc1ccccc1C=O Amb18648423 [0,2,0,0,0,0|2,0,0]=4 9069 B12R1.121 CCCSc1ccccc1[Zn]Br Amb22897954 [0,2,0,0,0,0|2,0,0]=4 9070 B12R1.121 CCNCc1ccccc1C#C Amb25139786 [0,2,0,0,0,0|2,0,0]=4 9071 B12R1.121 CCNCc1ccccc1C#N Amb10610322 [0,2,0,0,0,0|2,0,0]=4 9072 B12R1.121 CCNCc1ccccc1CN Amb19649753 [0,2,0,0,0,0|2,0,0]=4 9073 B12R1.121 CCOCc1ccccc1CN Amb1137684 [0,2,0,0,0,0|2,0,0]=4 9074 B12R1.121 CCOCc1ccccc1NC Amb18316378 [0,2,0,0,0,0|2,0,0]=4 9075 B12R1.121 CCOCc1ccccc1[Zn]Br Amb22898130 [0,2,0,0,0,0|2,0,0]=4 9076 B12R1.121 CCc1ccccc1C#CCO Amb24449940 [0,2,0,0,0,0|0,0,2]=4 9077 B12R1.121 CCc1ccccc1NCCN Amb24513622 [0,2,0,0,0,0|2,0,0]=4 9078 B12R1.121 CNc1cc[n]cc1CCCN Amb25207863 [0,2,0,0,0,0|2,0,0]=4 9079 B12R1.121 CNc1ccccc1CCOC Amb24448428 [0,2,0,0,0,0|2,0,0]=4 9080 B12R1.121 CNc1ccccc1CNCC Amb25816529 [0,2,0,0,0,0|2,0,0]=4 9081 B12R1.121 COCCc1ccccc1CO Amb24069010 [0,2,0,0,0,0|2,0,0]=4 9082 B12R1.121 COCCc1ccccc1NN Amb24676071 [0,2,0,0,0,0|2,0,0]=4 9083 B12R1.121 COCCc1ccccc1[N+]#N Amb25118976 [0,2,0,0,0,0|2,0,0]=4 9084 B12R1.121 COc1ccc[n]c1NCCO Amb25046084 [0,2,0,0,0,0|2,0,0]=4 9085 B12R1.121 COc1ccccc1C#CCO Amb18180050 [0,2,0,0,0,0|0,0,2]=4 9086 B12R1.121 COc1ccccc1CCC#C Amb18636005 [0,2,0,0,0,0|1,0,1]=4 9087 B12R1.121 COc1ccccc1CCON Amb22896636 [0,2,0,0,0,0|2,0,0]=4 9088 B12R1.121 COc1ccccc1NCCF Amb25855105 [0,2,0,0,0,0|2,0,0]=4 9089 B12R1.121 COc1ccccc1OCCN Amb20241252 [0,2,0,0,0,0|2,0,0]=4 9090 B12R1.121 COc1ccccc1SCCN Amb19024665 [0,2,0,0,0,0|2,0,0]=4 9091 B12R1.121 CSc1[n]cccc1OCCO Amb24105861 [0,2,0,0,0,0|2,0,0]=4 9092 B12R1.121 CSc1ccccc1C#CCO Amb25037042 [0,2,0,0,0,0|0,0,2]=4 9093 B12R1.121 CSc1ccccc1CCC#N Amb25239192 [0,2,0,0,0,0|1,0,1]=4 9094 B12R1.121 CSc1ccccc1NCCF Amb24467958 [0,2,0,0,0,0|2,0,0]=4 9095 B12R1.121 CSc1ccccc1OCCN Amb22523348 [0,2,0,0,0,0|2,0,0]=4 9096 B12R1.121 ClCCCc1ccccc1OC Amb17104531 [0,2,0,0,0,0|1,0,0]=3 9097 B12R1.121 ClCCNc1ccccc1C#N Amb17335460 [0,2,0,0,0,0|2,0,0]=4 9098 B12R1.121 ClCCNc1ccccc1CC Amb17335667 [0,2,0,0,0,0|2,0,0]=4 9099 B12R1.121 ClCCNc1ccccc1OC Amb17335806 [0,2,0,0,0,0|2,0,0]=4 9100 B12R1.121 N#CCCc1ccccc1C#N Amb17593908 [0,2,0,0,0,0|1,0,1]=4 9101 B12R1.121 N#CCCc1ccccc1CO Amb24591065 [0,2,0,0,0,0|1,0,1]=4 9102 B12R1.121 N#CCCc1ccccc1OC Amb17508974 [0,2,0,0,0,0|1,0,1]=4 9103 B12R1.121 N#Cc1[n]cccc1SCCO Amb25042308 [0,2,0,0,0,0|2,0,0]=4 9104 B12R1.121 N#Cc1c[n]ccc1CCCO Amb25088271 [0,2,0,0,0,0|1,0,0]=3 9105 B12R1.121 N#Cc1c[n]ccc1NCCO Amb25059127 [0,2,0,0,0,0|2,0,0]=4 9106 B12R1.121 N#Cc1c[n]ccc1OCCO Amb24568499 [0,2,0,0,0,0|2,0,0]=4 9107 B12R1.121 N#Cc1c[n]ccc1SCCO Amb25683201 [0,2,0,0,0,0|2,0,0]=4 9108 B12R1.121 N#Cc1cc[n]cc1NCCO Amb25772070 [0,2,0,0,0,0|2,0,0]=4 9109 B12R1.121 N#Cc1cc[n]cc1SCCO Amb18648381 [0,2,0,0,0,0|2,0,0]=4 9110 B12R1.121 N#Cc1ccccc1CCC=O Amb25685434 [0,2,0,0,0,0|0,0,2]=4 9111 B12R1.121 N#Cc1ccccc1CSCCl Amb25065321 [0,2,0,0,0,0|2,0,0]=4 9112 B12R1.121 N#Cc1ccccc1NCCF Amb25305472 [0,2,0,0,0,0|2,0,0]=4 9113 B12R1.121 N#Cc1ccccc1SCCF Amb24430499 [0,2,0,0,0,0|2,0,0]=4 9114 B12R1.121 N#Cc1ccccc1\C=C\CO Amb18645181 [0,2,0,0,0,0|0,0,2]=4 9115 B12R1.121 NCCCc1ccccc1C#N Amb18251586 [0,2,0,0,0,0|1,0,0]=3 9116 B12R1.121 NCCNc1ccccc1C#N Amb17933166 [0,2,0,0,0,0|2,0,0]=4 9117 B12R1.121 NCCNc1ccccc1C#N Amb18289758 [0,2,0,0,0,0|2,0,0]=4 9118 B12R1.121 NCCNc1ccccc1OC Amb17057753 [0,2,0,0,0,0|2,0,0]=4 9119 B12R1.121 NCCOc1ccccc1C#N Amb17740016 [0,2,0,0,0,0|2,0,0]=4 9120 B12R1.121 NCCOc1ccccc1OC Amb1210085 [0,2,0,0,0,0|2,0,0]=4 9121 B12R1.121 NCCSc1ccccc1C#N Amb18909080 [0,2,0,0,0,0|2,0,0]=4 9122 B12R1.121 NCc1ccc[n]c1NCCO Amb19025092 [0,2,0,0,0,0|2,0,0]=4 9123 B12R1.121 NCc1ccccc1CCCBr Amb24099890 [0,2,0,0,0,0|1,0,0]=3 9124 B12R1.121 NCc1ccccc1NCCF Amb24594115 [0,2,0,0,0,0|2,0,0]=4 9125 B12R1.121 NCc1ccccc1\C=C\CO Amb24575002 [0,2,0,0,0,0|0,0,2]=4 9126 B12R1.121 O=CCCc1ccccc1CCl Amb24092985 [0,2,0,0,0,0|0,0,2]=4 9127 B12R1.121 O=CCCc1ccccc1OC Amb17081677 [0,2,0,0,0,0|0,0,2]=4 9128 B12R1.121 O=Cc1ccccc1NCCF Amb24708154 [0,2,0,0,0,0|2,0,0]=4 9129 B12R1.121 OCC#Cc1ccccc1C=O Amb24100546 [0,2,0,0,0,0|0,0,2]=4 9130 B12R1.121 OCC#Cc1ccccc1CO Amb18792412 [0,2,0,0,0,0|0,0,2]=4 9131 B12R1.121 OCCOc1ccccc1OC Amb2209353 [0,2,0,0,0,0|1,0,0]=3 9132 B12R1.121 OC\C=C\c1ccccc1C=O Amb24629278 [0,2,0,0,0,0|0,0,2]=4 9133 B12R1.121 OC\C=C\c1ccccc1OC Amb1110152 [0,2,0,0,0,0|0,0,2]=4 9134 B12R1.121 OCc1ccc[n]c1NCCO Amb18106094 [0,2,0,0,0,0|2,0,0]=4 9135 B12R1.121 OCc1ccccc1NCCO Amb25042975 [0,2,0,0,0,0|1,0,0]=3 9136 B12R1.121 SCCCc1ccccc1OC Amb17400949 [0,2,0,0,0,0|0,1,0]=3 9137 B12R1.121 SCCOc1ccccc1CC Amb17233941 [0,2,0,0,0,0|1,1,0]=4 9138 B12R1.121 SCCOc1ccccc1OC Amb17234095 [0,2,0,0,0,0|1,1,0]=4 9139 B12R1.125 CC(=O)CCc1ccccc1O Amb17507153 [0,2,0,0,0,0|0,0,2]=4 9140 B12R1.125 CC(Br)CCc1cc[n]cc1F Amb24460482 [0,2,0,0,0,0|2,0,0]=4 9141 B12R1.125 CC(Br)CCc1ccccc1Br Amb24488694 [0,2,0,0,0,0|1,0,0]=3 9142 B12R1.125 CC(C)CCN1C=CC=CC1=O Amb25757730 [0,2,0,0,0,0|2,0,0]=4 9143 B12R1.125 CC(C)CC[n+]1ccccc1C Amb25381008 [0,2,0,0,0,0|2,0,0]=4 9144 B12R1.125 CC(C)CC[n+]1ccccc1F Amb24370900 [0,2,0,0,0,0|2,0,0]=4 9145 B12R1.125 CC(C)CCc1[n]cccc1N Amb18828682 [0,2,0,0,0,0|2,0,0]=4 9146 B12R1.125 CC(C)CCc1c[n]ccc1N Amb24417551 [0,2,0,0,0,0|2,0,0]=4 9147 B12R1.125 CC(C)CCc1cc[n]cc1N Amb18828686 [0,2,0,0,0,0|2,0,0]=4 9148 B12R1.125 CC(C)CNc1ccccc1O Amb25739989 [0,2,0,0,0,0|2,0,0]=4 9149 B12R1.125 CC(C)COc1ccccc1Cl Amb24632680 [0,2,0,0,0,0|2,0,0]=4 9150 B12R1.125 CC(C)COc1ccccc1F Amb25078524 [0,2,0,0,0,0|2,0,0]=4 9151 B12R1.125 CC(C)COc1ccccc1I Amb25148597 [0,2,0,0,0,0|2,0,0]=4 9152 B12R1.125 CC(C)COc1ccccc1S Amb25844615 [0,2,0,0,0,0|2,0,0]=4 9153 B12R1.125 CC(C)CSc1ccccc1Br Amb24728137 [0,2,0,0,0,0|2,0,0]=4 9154 B12R1.125 CC(C)CSc1ccccc1O Amb18318224 [0,2,0,0,0,0|2,0,0]=4 9155 B12R1.125 CC(C)CSc1ccccc1S Amb25359793 [0,2,0,0,0,0|2,0,0]=4 9156 B12R1.125 CC(C)NCc1ccccc1I Amb21861743 [0,2,0,0,0,0|2,0,0]=4 9157 B12R1.125 CC(C)NCc1ccccc1N Amb18973318 [0,2,0,0,0,0|2,0,0]=4 9158 B12R1.125 CC(C)NCc1ccccc1O Amb20673451 [0,2,0,0,0,0|2,0,0]=4 9159 B12R1.125 CC(C)OCc1ccccc1Br Amb22900130 [0,2,0,0,0,0|2,0,0]=4 9160 B12R1.125 CC(C)SCc1ccccc1Br Amb22228181 [0,2,0,0,0,0|2,0,0]=4 9161 B12R1.125 CC(C)SCc1ccccc1F Amb24412737 [0,2,0,0,0,0|2,0,0]=4 9162 B12R1.125 CC(C)SCc1ccccc1N Amb18289434 [0,2,0,0,0,0|2,0,0]=4 9163 B12R1.125 CC(CCc1ccccc1N)C Amb13951566 [0,2,0,0,0,0|1,0,0]=3 9164 B12R1.125 CC(CCc1ccccc1O)N Amb17507315 [0,2,0,0,0,0|1,0,0]=3 9165 B12R1.125 CC(CCc1ccccc1O)O Amb17507249 [0,2,0,0,0,0|0,0,0]=2 9166 B12R1.125 CC(CNc1ccccc1Br)O Amb17142610 [0,2,0,0,0,0|1,0,0]=3 9167 B12R1.125 CC(CNc1ccccc1C)O Amb17138592 [0,2,0,0,0,0|1,0,0]=3 9168 B12R1.125 CC(CNc1ccccc1Cl)O Amb17139125 [0,2,0,0,0,0|1,0,0]=3 9169 B12R1.125 CC(CNc1ccccc1F)O Amb17138650 [0,2,0,0,0,0|1,0,0]=3 9170 B12R1.125 CC(COc1ccccc1Br)N Amb17062516 [0,2,0,0,0,0|2,0,0]=4 9171 B12R1.125 CC(COc1ccccc1C)N Amb1124829 [0,2,0,0,0,0|2,0,0]=4 9172 B12R1.125 CC(COc1ccccc1F)N Amb1134402 [0,2,0,0,0,0|2,0,0]=4 9173 B12R1.125 CC(COc1ccccc1N)C Amb1137660 [0,2,0,0,0,0|2,0,0]=4 9174 B12R1.125 CC(COc1ccccc1N)C Amb2140563 [0,2,0,0,0,0|2,0,0]=4 9175 B12R1.125 CC(COc1ccccc1O)C Amb1016836 [0,2,0,0,0,0|2,0,0]=4 9176 B12R1.125 CC(Cl)CCc1cc[n]cc1Cl Amb25045357 [0,2,0,0,0,0|2,0,0]=4 9177 B12R1.125 CC(Cl)CCc1ccc[n]c1N Amb25725649 [0,2,0,0,0,0|2,0,0]=4 9178 B12R1.125 CC(Cl)CCc1ccccc1Br Amb24488697 [0,2,0,0,0,0|1,0,0]=3 9179 B12R1.125 CC(Cl)CCc1ccccc1F Amb19076400 [0,2,0,0,0,0|1,0,0]=3 9180 B12R1.125 CC(Cl)COc1ccccc1Cl Amb25785226 [0,2,0,0,0,0|2,0,0]=4 9181 B12R1.125 CC(Cl)COc1ccccc1F Amb24355402 [0,2,0,0,0,0|2,0,0]=4 9182 B12R1.125 CC(F)CCN1C=CC=CC1=O Amb25072253 [0,2,0,0,0,0|2,0,0]=4 9183 B12R1.125 CC(F)CCc1ccccc1N Amb25212968 [0,2,0,0,0,0|1,0,0]=3 9184 B12R1.125 CC(F)COc1ccccc1N Amb25208077 [0,2,0,0,0,0|2,0,0]=4 9185 B12R1.125 CC(F)CSc1ccccc1Br Amb24564104 [0,2,0,0,0,0|2,0,0]=4 9186 B12R1.125 CC(N)CCc1[n]cccc1Br Amb24462438 [0,2,0,0,0,0|2,0,0]=4 9187 B12R1.125 CC(N)CCc1c[n]ccc1N Amb25669485 [0,2,0,0,0,0|2,0,0]=4 9188 B12R1.125 CC(N)CCc1ccc[n]c1N Amb24399078 [0,2,0,0,0,0|2,0,0]=4 9189 B12R1.125 CC(N)CCc1ccccc1N Amb18646140 [0,2,0,0,0,0|1,0,0]=3 9190 B12R1.125 CC(N)COc1ccccc1I Amb25095421 [0,2,0,0,0,0|2,0,0]=4 9191 B12R1.125 CC(N)CSc1ccccc1Cl Amb25696792 [0,2,0,0,0,0|2,0,0]=4 9192 B12R1.125 CC(N)CSc1ccccc1F Amb24597976 [0,2,0,0,0,0|2,0,0]=4 9193 B12R1.125 CC(N)CSc1ccccc1N Amb18648678 [0,2,0,0,0,0|2,0,0]=4 9194 B12R1.125 CC(N)CSc1ccccc1O Amb25816545 [0,2,0,0,0,0|2,0,0]=4 9195 B12R1.125 CC(NCc1ccccc1Br)C Amb2111113 [0,2,0,0,0,0|2,0,0]=4 9196 B12R1.125 CC(NCc1ccccc1C)C Amb2118769 [0,2,0,0,0,0|2,0,0]=4 9197 B12R1.125 CC(NCc1ccccc1Cl)C Amb2098773 [0,2,0,0,0,0|2,0,0]=4 9198 B12R1.125 CC(NCc1ccccc1F)C Amb2118765 [0,2,0,0,0,0|2,0,0]=4 9199 B12R1.125 CC(O)CCN1C=CC=CC1=O Amb18805593 [0,2,0,0,0,0|1,0,0]=3 9200 B12R1.125 CC(O)CCN1C=CC=NC1=O Amb18805806 [0,2,0,0,0,0|2,0,0]=4 9201 B12R1.125 CC(O)CCN1N=CC=CC1=O Amb18793045 [0,2,0,0,0,0|2,0,0]=4 9202 B12R1.125 CC(O)CCc1cc[n]cc1Cl Amb25053788 [0,2,0,0,0,0|1,0,0]=3 9203 B12R1.125 CC(O)CCc1ccc[n]c1N Amb25726251 [0,2,0,0,0,0|1,0,0]=3 9204 B12R1.125 CC(O)CCc1ccccc1Br Amb25763352 [0,2,0,0,0,0|0,0,0]=2 9205 B12R1.125 CC(O)CCc1ccccc1Cl Amb19075162 [0,2,0,0,0,0|0,0,0]=2 9206 B12R1.125 CC(O)CCc1ccccc1F Amb18805845 [0,2,0,0,0,0|0,0,0]=2 9207 B12R1.125 CC(O)CCc1ccccc1N Amb24485690 [0,2,0,0,0,0|0,0,0]=2 9208 B12R1.125 CC(O)CNc1[n]cccc1Br Amb18292050 [0,2,0,0,0,0|2,0,0]=4 9209 B12R1.125 CC(O)CNc1[n]cccc1F Amb18300637 [0,2,0,0,0,0|2,0,0]=4 9210 B12R1.125 CC(O)CNc1cc[n]cc1Cl Amb24373611 [0,2,0,0,0,0|2,0,0]=4 9211 B12R1.125 CC(O)CNc1ccccc1O Amb18646739 [0,2,0,0,0,0|1,0,0]=3 9212 B12R1.125 CC(O)COc1ccc[n]c1N Amb25854752 [0,2,0,0,0,0|2,0,0]=4 9213 B12R1.125 CC(O)COc1cccc[n+]1[O-] Amb25097547 [0,2,0,0,0,0|2,0,0]=4 9214 B12R1.125 CC(O)COc1ccccc1Cl Amb25337460 [0,2,0,0,0,0|1,0,0]=3 9215 B12R1.125 CC(O)COc1ccccc1F Amb18806458 [0,2,0,0,0,0|1,0,0]=3 9216 B12R1.125 CC(O)COc1ccccc1N Amb18971553 [0,2,0,0,0,0|1,0,0]=3 9217 B12R1.125 CC(O)COc1ccccc1O Amb18646901 [0,2,0,0,0,0|1,0,0]=3 9218 B12R1.125 CC(O)CSc1[n]cccc1Br Amb25100776 [0,2,0,0,0,0|2,0,0]=4 9219 B12R1.125 CC(O)CSc1[n]cccc1Cl Amb24415071 [0,2,0,0,0,0|2,0,0]=4 9220 B12R1.125 CC(O)CSc1[n]cccc1N Amb18969623 [0,2,0,0,0,0|2,0,0]=4 9221 B12R1.125 CC(O)CSc1[n]cccc1O Amb18649167 [0,2,0,0,0,0|2,0,0]=4 9222 B12R1.125 CC(O)CSc1cc[n]cc1N Amb18969622 [0,2,0,0,0,0|2,0,0]=4 9223 B12R1.125 CC(O)CSc1cccc[n+]1[O-] Amb24718225 [0,2,0,0,0,0|2,0,0]=4 9224 B12R1.125 CC(O)CSc1ccccc1F Amb19058401 [0,2,0,0,0,0|1,0,0]=3 9225 B12R1.125 CC(O)CSc1ccccc1N Amb18969617 [0,2,0,0,0,0|1,0,0]=3 9226 B12R1.125 CC(O)CSc1ccccc1O Amb19045466 [0,2,0,0,0,0|1,0,0]=3 9227 B12R1.125 CC(O)\C=C\c1ccccc1Br Amb25086864 [0,2,0,0,0,0|0,0,2]=4 9228 B12R1.125 CC(OCc1ccccc1O)C Amb10560039 [0,2,0,0,0,0|2,0,0]=4 9229 B12R1.125 CN(C)CCc1ccccc1Br Amb25795341 [0,2,0,0,0,0|2,0,0]=4 9230 B12R1.125 CN(C)CCc1ccccc1O Amb25066330 [0,2,0,0,0,0|2,0,0]=4 9231 B12R1.125 CN(N)CCc1ccccc1Cl Amb18564316 [0,2,0,0,0,0|2,0,0]=4 9232 B12R1.125 CN(N)CCc1ccccc1F Amb18563850 [0,2,0,0,0,0|2,0,0]=4 9233 B12R1.125 CS(=O)CCc1ccccc1N Amb18299124 [0,2,0,0,0,0|1,0,1]=4 9234 B12R1.125 C[C@@H](COc1ccccc1Br)N Amb17248850 [0,2,0,0,0,0|2,0,0]=4 9235 B12R1.125 C[C@@H](COc1ccccc1C)N Amb17232557 [0,2,0,0,0,0|2,0,0]=4 9236 B12R1.125 C[C@@H](COc1ccccc1Cl)N Amb17234270 [0,2,0,0,0,0|2,0,0]=4 9237 B12R1.125 C[C@@H](COc1ccccc1F)N Amb17232706 [0,2,0,0,0,0|2,0,0]=4 9238 B12R1.125 C[C@@H](N)CCc1ccccc1Cl Amb24117939 [0,2,0,0,0,0|1,0,0]=3 9239 B12R1.125 C[C@@H](N)COc1ccccc1Br Amb18036081 [0,2,0,0,0,0|2,0,0]=4 9240 B12R1.125 C[C@@H](N)COc1ccccc1Cl Amb18538518 [0,2,0,0,0,0|2,0,0]=4 9241 B12R1.125 C[C@@H](N)COc1ccccc1F Amb18538499 [0,2,0,0,0,0|2,0,0]=4 9242 B12R1.125 C[C@@H](O)CNc1cc[n]cc1Br Amb25065990 [0,2,0,0,0,0|2,0,0]=4 9243 B12R1.125 C[C@@H](O)COc1ccccc1O Amb24689528 [0,2,0,0,0,0|1,0,0]=3 9244 B12R1.125 C[C@@H](O)CSc1ccccc1Br Amb24725913 [0,2,0,0,0,0|1,0,0]=3 9245 B12R1.125 C[C@@H](O)CSc1ccccc1Cl Amb25831408 [0,2,0,0,0,0|1,0,0]=3 9246 B12R1.125 C[C@H](N)CCc1ccccc1Cl Amb24470862 [0,2,0,0,0,0|1,0,0]=3 9247 B12R1.125 C[C@H](N)CCc1ccccc1O Amb25149919 [0,2,0,0,0,0|1,0,0]=3 9248 B12R1.125 C[C@H](N)CSc1ccccc1Br Amb24608778 [0,2,0,0,0,0|2,0,0]=4 9249 B12R1.125 C[C@H](N)CSc1ccccc1Cl Amb25825016 [0,2,0,0,0,0|2,0,0]=4 9250 B12R1.125 C[C@H](O)CNc1[n]cccc1Br Amb25160146 [0,2,0,0,0,0|2,0,0]=4 9251 B12R1.125 C[C@H](O)CNc1[n]cccc1Cl Amb24351996 [0,2,0,0,0,0|2,0,0]=4 9252 B12R1.125 C[C@H](O)CNc1cc[n]cc1Cl Amb25717399 [0,2,0,0,0,0|2,0,0]=4 9253 B12R1.125 C[C@H](O)COc1ccccc1F Amb25784865 [0,2,0,0,0,0|1,0,0]=3 9254 B12R1.125 C[C@H](O)CSc1ccccc1Br Amb24497740 [0,2,0,0,0,0|1,0,0]=3 9255 B12R1.125 C[C@H](O)CSc1ccccc1F Amb25073686 [0,2,0,0,0,0|1,0,0]=3 9256 B12R1.125 Cc1[n]cccc1CCC(O)=O Amb18853387 [0,2,0,0,0,0|1,0,1]=4 9257 B12R1.125 Cc1[n]cccc1OC[C@@H](C)O Amb24411996 [0,2,0,0,0,0|2,0,0]=4 9258 B12R1.125 Cc1c[n]ccc1NC[C@@H](C)O Amb25188212 [0,2,0,0,0,0|2,0,0]=4 9259 B12R1.125 Cc1c[n]ccc1NC[C@H](C)O Amb25115834 [0,2,0,0,0,0|2,0,0]=4 9260 B12R1.125 Cc1cc[n]cc1CCC(C)C Amb24346549 [0,2,0,0,0,0|2,0,0]=4 9261 B12R1.125 Cc1cc[n]cc1CCC(O)=O Amb18828438 [0,2,0,0,0,0|1,0,1]=4 9262 B12R1.125 Cc1ccc[n]c1NCC(C)O Amb18296068 [0,2,0,0,0,0|2,0,0]=4 9263 B12R1.125 Cc1ccc[n]c1SCC(C)O Amb25037300 [0,2,0,0,0,0|2,0,0]=4 9264 B12R1.125 Cc1cccc[n+]1CCC(O)=O Amb24410939 [0,2,0,0,0,0|1,0,1]=4 9265 B12R1.125 Cc1ccccc1C#C[C@H](C)O Amb25077975 [0,2,0,0,0,0|0,0,2]=4 9266 B12R1.125 Cc1ccccc1CCC(=O)Cl Amb19066206 [0,2,0,0,0,0|0,0,2]=4 9267 B12R1.125 Cc1ccccc1CCC(C)Cl Amb19074258 [0,2,0,0,0,0|1,0,0]=3 9268 B12R1.125 Cc1ccccc1CCC(C)O Amb18800836 [0,2,0,0,0,0|0,0,0]=2 9269 B12R1.125 Cc1ccccc1CCC(N)=N Amb18065464 [0,2,0,0,0,0|1,0,1]=4 9270 B12R1.125 Cc1ccccc1CCN(C)N Amb18563651 [0,2,0,0,0,0|2,0,0]=4 9271 B12R1.125 Cc1ccccc1CSC(C)C Amb24458313 [0,2,0,0,0,0|2,0,0]=4 9272 B12R1.125 Cc1ccccc1NCC(F)F Amb18793934 [0,2,0,0,0,0|2,0,0]=4 9273 B12R1.125 Cc1ccccc1NC[C@H](C)O Amb25096984 [0,2,0,0,0,0|1,0,0]=3 9274 B12R1.125 Cc1ccccc1OCC(C)C Amb24590121 [0,2,0,0,0,0|2,0,0]=4 9275 B12R1.125 Cc1ccccc1OCC(C)Cl Amb25189523 [0,2,0,0,0,0|2,0,0]=4 9276 B12R1.125 Cc1ccccc1OCC(C)O Amb18182639 [0,2,0,0,0,0|1,0,0]=3 9277 B12R1.125 Cc1ccccc1OCC(F)F Amb24386309 [0,2,0,0,0,0|2,0,0]=4 9278 B12R1.125 Cc1ccccc1OCC(O)O Amb24420845 [0,2,0,0,0,0|1,0,0]=3 9279 B12R1.125 Cc1ccccc1OC[C@@H](C)N Amb18538491 [0,2,0,0,0,0|2,0,0]=4 9280 B12R1.125 Cc1ccccc1OC[C@H](C)O Amb25068670 [0,2,0,0,0,0|1,0,0]=3 9281 B12R1.125 Cc1ccccc1SCC(C)C Amb25730826 [0,2,0,0,0,0|2,0,0]=4 9282 B12R1.125 Cc1ccccc1SCC(C)O Amb19054504 [0,2,0,0,0,0|1,0,0]=3 9283 B12R1.125 ClC(=O)CCc1ccccc1F Amb10838958 [0,2,0,0,0,0|0,0,2]=4 9284 B12R1.125 ClC(Cl)COc1ccccc1I Amb24351985 [0,2,0,0,0,0|2,0,0]=4 9285 B12R1.125 FC(CSc1ccccc1Br)F Amb10976061 [0,2,0,0,0,0|2,0,0]=4 9286 B12R1.125 FC(F)CNc1ccccc1Cl Amb18320405 [0,2,0,0,0,0|2,0,0]=4 9287 B12R1.125 FC(F)CNc1ccccc1I Amb24693475 [0,2,0,0,0,0|2,0,0]=4 9288 B12R1.125 FC(F)COc1ccccc1Br Amb22008304 [0,2,0,0,0,0|2,0,0]=4 9289 B12R1.125 FC(F)COc1ccccc1I Amb24056920 [0,2,0,0,0,0|2,0,0]=4 9290 B12R1.125 Fc1ccccc1NCC(F)F Amb18795536 [0,2,0,0,0,0|2,0,0]=4 9291 B12R1.125 Fc1ccccc1SCC(F)F Amb25763543 [0,2,0,0,0,0|2,0,0]=4 9292 B12R1.125 NC(=N)CCc1ccccc1Br Amb18070244 [0,2,0,0,0,0|1,0,1]=4 9293 B12R1.125 NC(=N)CCc1ccccc1Cl Amb10844871 [0,2,0,0,0,0|1,0,1]=4 9294 B12R1.125 NC(=N)CCc1ccccc1F Amb18563718 [0,2,0,0,0,0|1,0,1]=4 9295 B12R1.125 NC(=O)CCc1ccccc1Br Amb11468216 [0,2,0,0,0,0|0,0,2]=4 9296 B12R1.125 NC(=O)CCc1ccccc1C Amb17400134 [0,2,0,0,0,0|0,0,2]=4 9297 B12R1.125 NC(=O)CCc1ccccc1Cl Amb2142514 [0,2,0,0,0,0|0,0,2]=4 9298 B12R1.125 NC(=S)CCc1ccccc1F Amb17234010 [0,2,0,0,0,0|0,1,1]=4 9299 B12R1.125 Nc1[n]cccc1CCC(O)=O Amb25124989 [0,2,0,0,0,0|1,0,1]=4 9300 B12R1.125 Nc1cc[n]cc1CCC(O)=O Amb24375593 [0,2,0,0,0,0|1,0,1]=4 9301 B12R1.125 Nc1ccccc1CCC(O)=O Amb24118035 [0,2,0,0,0,0|0,0,1]=3 9302 B12R1.125 Nc1ccccc1NCC(O)=O Amb18296519 [0,2,0,0,0,0|1,0,1]=4 9303 B12R1.125 O=C(Cl)CCc1ccccc1Br Amb19888630 [0,2,0,0,0,0|0,0,2]=4 9304 B12R1.125 O=C(Cl)CCc1ccccc1Cl Amb25061965 [0,2,0,0,0,0|0,0,2]=4 9305 B12R1.125 OC(=O)CCC1=CC=CNC1=O Amb18262602 [0,2,0,0,0,0|1,0,1]=4 9306 B12R1.125 OC(=O)CCN1C=CC=CC1=O Amb18534261 [0,2,0,0,0,0|1,0,1]=4 9307 B12R1.125 OC(=O)CCN1C=CC=CC1=O Amb21955606 [0,2,0,0,0,0|1,0,1]=4 9308 B12R1.125 OC(=O)CCc1[n]cccc1F Amb25311377 [0,2,0,0,0,0|1,0,1]=4 9309 B12R1.125 OC(=O)CCc1c[n]ccc1Br Amb25253329 [0,2,0,0,0,0|1,0,1]=4 9310 B12R1.125 OC(=O)CCc1c[n]ccc1Cl Amb25270751 [0,2,0,0,0,0|1,0,1]=4 9311 B12R1.125 OC(=O)CCc1cc[n]cc1Cl Amb23596515 [0,2,0,0,0,0|1,0,1]=4 9312 B12R1.125 OC(=O)CCc1ccc[n]c1Br Amb24525068 [0,2,0,0,0,0|1,0,1]=4 9313 B12R1.125 OC(=O)CCc1ccc[n]c1Cl Amb24484270 [0,2,0,0,0,0|1,0,1]=4 9314 B12R1.125 OC(=O)CCc1ccc[n]c1F Amb25295347 [0,2,0,0,0,0|1,0,1]=4 9315 B12R1.125 OC(=O)CCc1ccccc1Cl Amb1209214 [0,2,0,0,0,0|0,0,1]=3 9316 B12R1.125 OC(=O)CCc1ccccc1I Amb10071543 [0,2,0,0,0,0|0,0,1]=3 9317 B12R1.125 OC(=O)CCc1ccccc1N Amb17477727 [0,2,0,0,0,0|0,0,1]=3 9318 B12R1.125 OC(=O)CCc1ccccc1O Amb1211927 [0,2,0,0,0,0|0,0,1]=3 9319 B12R1.125 OC(=O)CCc1ccccc1S Amb18648646 [0,2,0,0,0,0|0,0,1]=3 9320 B12R1.125 OC(=O)CCn1ccccc1=O Amb1124605 [0,2,0,0,0,0|1,0,1]=4 9321 B12R1.125 OC(=O)CNc1ccccc1C Amb1258286 [0,2,0,0,0,0|1,0,1]=4 9322 B12R1.125 OC(=O)CNc1ccccc1S Amb25124141 [0,2,0,0,0,0|1,0,1]=4 9323 B12R1.125 OC(=O)COc1ccccc1C Amb1215022 [0,2,0,0,0,0|1,0,1]=4 9324 B12R1.125 OC(=O)COc1ccccc1O Amb1030005 [0,2,0,0,0,0|1,0,1]=4 9325 B12R1.125 OC(=O)CSc1ccccc1Br Amb1113386 [0,2,0,0,0,0|1,0,1]=4 9326 B12R1.125 OC(=O)CSc1ccccc1C Amb1205492 [0,2,0,0,0,0|1,0,1]=4 9327 B12R1.125 OC(=O)CSc1ccccc1Cl Amb1105912 [0,2,0,0,0,0|1,0,1]=4 9328 B12R1.125 OC(=O)CSc1ccccc1F Amb1105913 [0,2,0,0,0,0|1,0,1]=4 9329 B12R1.125 Oc1ccccc1CCC(=O)Cl Amb25808033 [0,2,0,0,0,0|0,0,2]=4 9330 B12R1.125 Oc1ccccc1OCC(F)F Amb18795191 [0,2,0,0,0,0|2,0,0]=4 9331 B12R1.125 Oc1ccccc1SCC(F)F Amb18317372 [0,2,0,0,0,0|2,0,0]=4 9332 B12R1.125 Oc1ccccc1SCC(O)=O Amb18294823 [0,2,0,0,0,0|1,0,1]=4 9333 B12R1.125 [O-][N+](=O)CCc1ccccc1C Amb17400176 [0,2,0,0,0,0|1,0,1]=4 9334 B12R1.125 [O-][N+](=O)CCc1ccccc1Cl Amb17401072 [0,2,0,0,0,0|1,0,1]=4 9335 B12R1.125 [O-][N+](=O)CCc1ccccc1F Amb17400297 [0,2,0,0,0,0|1,0,1]=4 9336 B12R1.267 BrCC\C=C\c1ccccc1C Amb17246876 [0,2,0,0,0,0|1,0,1]=4 9337 B12R1.267 BrCC\C=C\c1ccccc1Cl Amb17258089 [0,2,0,0,0,0|1,0,1]=4 9338 B12R1.267 BrCC\C=C\c1ccccc1F Amb17248420 [0,2,0,0,0,0|1,0,1]=4 9339 B12R1.267 C#CCCCc1c[n]ccc1N Amb25809458 [0,2,0,0,0,0|2,0,0]=4 9340 B12R1.267 C#CCCNc1ccccc1Cl Amb25118560 [0,2,0,0,0,0|1,0,1]=4 9341 B12R1.267 C#CCCNc1ccccc1F Amb25047099 [0,2,0,0,0,0|1,0,1]=4 9342 B12R1.267 C#CCCOc1ccccc1Cl Amb25748470 [0,2,0,0,0,0|1,0,1]=4 9343 B12R1.267 C#CCCOc1ccccc1F Amb24732557 [0,2,0,0,0,0|1,0,1]=4 9344 B12R1.267 C#CCCOc1ccccc1N Amb18290041 [0,2,0,0,0,0|1,0,1]=4 9345 B12R1.267 C#CCCSc1ccccc1Br Amb25727396 [0,2,0,0,0,0|1,0,1]=4 9346 B12R1.267 C#CCCSc1ccccc1Cl Amb25727168 [0,2,0,0,0,0|1,0,1]=4 9347 B12R1.267 C#CCCSc1ccccc1F Amb25225107 [0,2,0,0,0,0|1,0,1]=4 9348 B12R1.267 C#CCCSc1ccccc1O Amb18790975 [0,2,0,0,0,0|1,0,1]=4 9349 B12R1.267 C#CCNCc1ccccc1Cl Amb1925447 [0,2,0,0,0,0|1,0,1]=4 9350 B12R1.267 C#CCNCc1ccccc1F Amb21979501 [0,2,0,0,0,0|1,0,1]=4 9351 B12R1.267 C#CCOCc1ccccc1Br Amb25107682 [0,2,0,0,0,0|1,0,1]=4 9352 B12R1.267 C#CCSCc1ccccc1Br Amb25383350 [0,2,0,0,0,0|1,0,1]=4 9353 B12R1.267 C=CCCCc1ccccc1C Amb13890662 [0,2,0,0,0,0|1,0,0]=3 9354 B12R1.267 C=CCCNc1ccccc1Cl Amb25373616 [0,2,0,0,0,0|1,0,1]=4 9355 B12R1.267 C=CCCNc1ccccc1I Amb24364914 [0,2,0,0,0,0|1,0,1]=4 9356 B12R1.267 C=CCCOc1ccccc1Br Amb22232193 [0,2,0,0,0,0|1,0,1]=4 9357 B12R1.267 C=CCNCc1ccccc1Br Amb20673595 [0,2,0,0,0,0|1,0,1]=4 9358 B12R1.267 C=CCNCc1ccccc1F Amb10609764 [0,2,0,0,0,0|1,0,1]=4 9359 B12R1.267 C=CCNCc1ccccc1F Amb22279672 [0,2,0,0,0,0|1,0,1]=4 9360 B12R1.267 C=CCNCc1ccccc1O Amb19890804 [0,2,0,0,0,0|1,0,1]=4 9361 B12R1.267 C=CCOCc1ccccc1Br Amb22360706 [0,2,0,0,0,0|1,0,1]=4 9362 B12R1.267 C=CCOCc1ccccc1F Amb22227646 [0,2,0,0,0,0|1,0,1]=4 9363 B12R1.267 C=CCOCc1ccccc1N Amb22503744 [0,2,0,0,0,0|1,0,1]=4 9364 B12R1.267 CCCC#Cc1ccccc1Br Amb25676440 [0,2,0,0,0,0|1,0,1]=4 9365 B12R1.267 CCCC#Cc1ccccc1N Amb25238355 [0,2,0,0,0,0|1,0,1]=4 9366 B12R1.267 CCCCNc1[n]cccc1Br Amb25805902 [0,2,0,0,0,0|2,0,0]=4 9367 B12R1.267 CCCCNc1[n]cccc1F Amb18314049 [0,2,0,0,0,0|2,0,0]=4 9368 B12R1.267 CCCCNc1cc[n]cc1Br Amb24459992 [0,2,0,0,0,0|2,0,0]=4 9369 B12R1.267 CCCCNc1cc[n]cc1Cl Amb24434404 [0,2,0,0,0,0|2,0,0]=4 9370 B12R1.267 CCCCNc1ccc[n]c1Br Amb24748989 [0,2,0,0,0,0|2,0,0]=4 9371 B12R1.267 CCCCNc1ccc[n]c1N Amb25724907 [0,2,0,0,0,0|2,0,0]=4 9372 B12R1.267 CCCCNc1ccccc1O Amb18646353 [0,2,0,0,0,0|1,0,0]=3 9373 B12R1.267 CCCCNc1ccccc1S Amb25805362 [0,2,0,0,0,0|1,0,0]=3 9374 B12R1.267 CCCCOC1=CC=CNC1=O Amb18034630 [0,2,0,0,0,0|2,0,0]=4 9375 B12R1.267 CCCCOc1[n]cccc1Cl Amb24308905 [0,2,0,0,0,0|2,0,0]=4 9376 B12R1.267 CCCCOc1ccc[n]c1Br Amb20242847 [0,2,0,0,0,0|2,0,0]=4 9377 B12R1.267 CCCCOc1ccc[n]c1Cl Amb20242808 [0,2,0,0,0,0|2,0,0]=4 9378 B12R1.267 CCCCOc1ccccc1N Amb1033054 [0,2,0,0,0,0|1,0,0]=3 9379 B12R1.267 CCCNCc1ccccc1Br Amb19892805 [0,2,0,0,0,0|1,0,0]=3 9380 B12R1.267 CCCNCc1ccccc1O Amb20673481 [0,2,0,0,0,0|1,0,0]=3 9381 B12R1.267 CCCSCc1ccccc1Br Amb22228182 [0,2,0,0,0,0|1,0,0]=3 9382 B12R1.267 CCC\C=C/c1ccccc1O Amb24662307 [0,2,0,0,0,0|1,0,1]=4 9383 B12R1.267 CCC\C=C\c1ccccc1O Amb24707025 [0,2,0,0,0,0|1,0,1]=4 9384 B12R1.267 CCC\C=N\c1ccccc1N Amb24485477 [0,2,0,0,0,0|1,0,1]=4 9385 B12R1.267 CCC\N=C\c1ccccc1O Amb24408352 [0,2,0,0,0,0|1,0,1]=4 9386 B12R1.267 CC\C=C\Cc1ccccc1O Amb25730107 [0,2,0,0,0,0|1,0,1]=4 9387 B12R1.267 CNCCCc1ccccc1Br Amb17605546 [0,2,0,0,0,0|1,0,0]=3 9388 B12R1.267 CNCCCc1ccccc1C Amb17104499 [0,2,0,0,0,0|1,0,0]=3 9389 B12R1.267 CNCCCc1ccccc1Cl Amb17104507 [0,2,0,0,0,0|1,0,0]=3 9390 B12R1.267 CNCCCc1ccccc1F Amb17104502 [0,2,0,0,0,0|1,0,0]=3 9391 B12R1.267 CNCCNc1ccccc1Br Amb18312614 [0,2,0,0,0,0|2,0,0]=4 9392 B12R1.267 CNCCNc1ccccc1C Amb15772130 [0,2,0,0,0,0|2,0,0]=4 9393 B12R1.267 CNCCNc1ccccc1Cl Amb19025278 [0,2,0,0,0,0|2,0,0]=4 9394 B12R1.267 CNCCNc1ccccc1F Amb19025282 [0,2,0,0,0,0|2,0,0]=4 9395 B12R1.267 CNCCOc1ccccc1C Amb1222745 [0,2,0,0,0,0|2,0,0]=4 9396 B12R1.267 CNCCOc1ccccc1C Amb2140560 [0,2,0,0,0,0|2,0,0]=4 9397 B12R1.267 CNCCOc1ccccc1Cl Amb1669286 [0,2,0,0,0,0|2,0,0]=4 9398 B12R1.267 CNCCOc1ccccc1F Amb1669285 [0,2,0,0,0,0|2,0,0]=4 9399 B12R1.267 CNCCOc1ccccc1F Amb2132299 [0,2,0,0,0,0|2,0,0]=4 9400 B12R1.267 CNCCOc1ccccc1N Amb17232613 [0,2,0,0,0,0|2,0,0]=4 9401 B12R1.267 COCC#Cc1ccccc1Cl Amb25693189 [0,2,0,0,0,0|0,0,2]=4 9402 B12R1.267 COCCNc1[n]cccc1F Amb18314046 [0,2,0,0,0,0|2,0,0]=4 9403 B12R1.267 COCCNc1c[n]ccc1N Amb25059984 [0,2,0,0,0,0|2,0,0]=4 9404 B12R1.267 COCCNc1ccc[n]c1Br Amb25738806 [0,2,0,0,0,0|2,0,0]=4 9405 B12R1.267 COCCNc1ccc[n]c1N Amb24649774 [0,2,0,0,0,0|2,0,0]=4 9406 B12R1.267 COCCOc1[n]cccc1Br Amb19448504 [0,2,0,0,0,0|2,0,0]=4 9407 B12R1.267 COCCOc1ccccc1N Amb22492333 [0,2,0,0,0,0|1,0,0]=3 9408 B12R1.267 COCOCc1ccccc1Br Amb21964629 [0,2,0,0,0,0|1,0,0]=3 9409 B12R1.267 CSCCNc1ccccc1Cl Amb24451973 [0,2,0,0,0,0|1,1,0]=4 9410 B12R1.267 CSCCNc1ccccc1F Amb19025512 [0,2,0,0,0,0|1,1,0]=4 9411 B12R1.267 C\C=C\CCc1ccccc1N Amb25233153 [0,2,0,0,0,0|1,0,1]=4 9412 B12R1.267 C\C=C\CCc1ccccc1O Amb24676835 [0,2,0,0,0,0|1,0,1]=4 9413 B12R1.267 Cc1[n]cc[n]c1NCCCO Amb25830161 [0,2,0,0,0,0|2,0,0]=4 9414 B12R1.267 Cc1c[n]ccc1C#CCCO Amb24441297 [0,2,0,0,0,0|1,0,1]=4 9415 B12R1.267 Cc1c[n]ccc1NCCCC Amb25376631 [0,2,0,0,0,0|2,0,0]=4 9416 B12R1.267 Cc1cc[n]cc1C#CCCO Amb24735671 [0,2,0,0,0,0|1,0,1]=4 9417 B12R1.267 Cc1cc[n]cc1CCCCN Amb18828701 [0,2,0,0,0,0|2,0,0]=4 9418 B12R1.267 Cc1cc[n]cc1NCCCC Amb24692478 [0,2,0,0,0,0|2,0,0]=4 9419 B12R1.267 Cc1cc[n]cc1NCCOC Amb24452333 [0,2,0,0,0,0|2,0,0]=4 9420 B12R1.267 Cc1ccc[n]c1NCCCC Amb18792595 [0,2,0,0,0,0|2,0,0]=4 9421 B12R1.267 Cc1ccc[n]c1NCCCF Amb25129357 [0,2,0,0,0,0|2,0,0]=4 9422 B12R1.267 Cc1ccc[n]c1NCCCN Amb18800959 [0,2,0,0,0,0|2,0,0]=4 9423 B12R1.267 Cc1ccc[n]c1NCCCO Amb18801091 [0,2,0,0,0,0|1,0,0]=3 9424 B12R1.267 Cc1ccc[n]c1NCCOC Amb18801090 [0,2,0,0,0,0|2,0,0]=4 9425 B12R1.267 Cc1ccccc1C#CCCCl Amb18796084 [0,2,0,0,0,0|1,0,1]=4 9426 B12R1.267 Cc1ccccc1C#CCCN Amb25153987 [0,2,0,0,0,0|1,0,1]=4 9427 B12R1.267 Cc1ccccc1C#CCCO Amb18792226 [0,2,0,0,0,0|0,0,1]=3 9428 B12R1.267 Cc1ccccc1CCC=CC Amb22347883 [0,2,0,0,0,0|1,0,1]=4 9429 B12R1.267 Cc1ccccc1CCCC#N Amb24502058 [0,2,0,0,0,0|1,0,0]=3 9430 B12R1.267 Cc1ccccc1CCCCN Amb17991254 [0,2,0,0,0,0|1,0,0]=3 9431 B12R1.267 Cc1ccccc1CCCCS Amb18564154 [0,2,0,0,0,0|0,1,0]=3 9432 B12R1.267 Cc1ccccc1CCNC=O Amb24637730 [0,2,0,0,0,0|0,0,2]=4 9433 B12R1.267 Cc1ccccc1CNCC#C Amb21979502 [0,2,0,0,0,0|1,0,1]=4 9434 B12R1.267 Cc1ccccc1COCC#C Amb24493349 [0,2,0,0,0,0|1,0,1]=4 9435 B12R1.267 Cc1ccccc1CSCC#C Amb18808916 [0,2,0,0,0,0|1,0,1]=4 9436 B12R1.267 Cc1ccccc1C\C=C\CO Amb24592563 [0,2,0,0,0,0|0,0,1]=3 9437 B12R1.267 Cc1ccccc1NCCC#C Amb24444032 [0,2,0,0,0,0|1,0,1]=4 9438 B12R1.267 Cc1ccccc1NCCC=C Amb25073730 [0,2,0,0,0,0|1,0,1]=4 9439 B12R1.267 Cc1ccccc1NCCN=C Amb24406582 [0,2,0,0,0,0|2,0,0]=4 9440 B12R1.267 Cc1ccccc1NCCNC Amb21959972 [0,2,0,0,0,0|2,0,0]=4 9441 B12R1.267 Cc1ccccc1NCCSC Amb19025516 [0,2,0,0,0,0|1,1,0]=4 9442 B12R1.267 Cc1ccccc1SCCC#C Amb25849161 [0,2,0,0,0,0|1,0,1]=4 9443 B12R1.267 Cc1ccccc1SCCC#N Amb17740947 [0,2,0,0,0,0|1,0,1]=4 9444 B12R1.267 Cc1ccccc1S\C=C\CO Amb24412213 [0,2,0,0,0,0|0,0,2]=4 9445 B12R1.267 Cc1ccccc1\C=N\CCO Amb24675358 [0,2,0,0,0,0|0,0,1]=3 9446 B12R1.267 ClCCCNc1[n]cccc1Br Amb24532766 [0,2,0,0,0,0|2,0,0]=4 9447 B12R1.267 ClCCCNc1cc[n]cc1Br Amb25327053 [0,2,0,0,0,0|2,0,0]=4 9448 B12R1.267 ClCCCOc1ccccc1C Amb1141955 [0,2,0,0,0,0|1,0,0]=3 9449 B12R1.267 ClCCCOc1ccccc1Cl Amb1135755 [0,2,0,0,0,0|1,0,0]=3 9450 B12R1.267 ClCCCOc1ccccc1F Amb1131839 [0,2,0,0,0,0|1,0,0]=3 9451 B12R1.267 ClCC\C=C\c1ccccc1C Amb17233777 [0,2,0,0,0,0|1,0,1]=4 9452 B12R1.267 ClCC\C=C\c1ccccc1Cl Amb17237226 [0,2,0,0,0,0|1,0,1]=4 9453 B12R1.267 ClCC\C=C\c1ccccc1F Amb17234150 [0,2,0,0,0,0|1,0,1]=4 9454 B12R1.267 Clc1ccccc1C#CCCCl Amb18322039 [0,2,0,0,0,0|1,0,1]=4 9455 B12R1.267 Clc1ccccc1C\C=C\CCl Amb24519629 [0,2,0,0,0,0|1,0,1]=4 9456 B12R1.267 FCCCNc1[n]cccc1Br Amb25053679 [0,2,0,0,0,0|2,0,0]=4 9457 B12R1.267 FCCCNc1[n]cccc1Cl Amb24724601 [0,2,0,0,0,0|2,0,0]=4 9458 B12R1.267 FCCCNc1ccccc1Cl Amb24426496 [0,2,0,0,0,0|1,0,0]=3 9459 B12R1.267 FCCCNc1ccccc1I Amb25847224 [0,2,0,0,0,0|1,0,0]=3 9460 B12R1.267 FCCCOc1ccccc1Br Amb22008306 [0,2,0,0,0,0|1,0,0]=3 9461 B12R1.267 Fc1ccc[n]c1NCCCCl Amb25236236 [0,2,0,0,0,0|2,0,0]=4 9462 B12R1.267 Fc1ccccc1C#CCCCl Amb19074251 [0,2,0,0,0,0|1,0,1]=4 9463 B12R1.267 Fc1ccccc1CCCCS Amb18066143 [0,2,0,0,0,0|0,1,0]=3 9464 B12R1.267 Fc1ccccc1NCCCF Amb24460043 [0,2,0,0,0,0|1,0,0]=3 9465 B12R1.267 N#CCCCN1C=CC=CC1=O Amb18041800 [0,2,0,0,0,0|2,0,0]=4 9466 B12R1.267 N#CCCCc1ccccc1Br Amb25732390 [0,2,0,0,0,0|1,0,0]=3 9467 B12R1.267 N#CCCCc1ccccc1O Amb24679850 [0,2,0,0,0,0|1,0,0]=3 9468 B12R1.267 N#CCCNc1ccccc1F Amb1103848 [0,2,0,0,0,0|1,0,1]=4 9469 B12R1.267 N#CCCOc1ccccc1C Amb1635755 [0,2,0,0,0,0|1,0,1]=4 9470 B12R1.267 N#CCCOc1ccccc1F Amb1148995 [0,2,0,0,0,0|1,0,1]=4 9471 B12R1.267 N#CCCOc1ccccc1O Amb25735836 [0,2,0,0,0,0|1,0,1]=4 9472 B12R1.267 N#CCCSc1ccccc1O Amb25093813 [0,2,0,0,0,0|1,0,1]=4 9473 B12R1.267 N#CCNCc1ccccc1Br Amb18977750 [0,2,0,0,0,0|1,0,1]=4 9474 B12R1.267 N#CCNCc1ccccc1C Amb17400074 [0,2,0,0,0,0|1,0,1]=4 9475 B12R1.267 N#CCNCc1ccccc1O Amb24433925 [0,2,0,0,0,0|1,0,1]=4 9476 B12R1.267 N#CCOCc1ccccc1Br Amb25088050 [0,2,0,0,0,0|1,0,1]=4 9477 B12R1.267 N#CCSCc1ccccc1Br Amb24720310 [0,2,0,0,0,0|1,0,1]=4 9478 B12R1.267 N#CCSCc1ccccc1C Amb17501732 [0,2,0,0,0,0|1,0,1]=4 9479 B12R1.267 N#CCSCc1ccccc1Cl Amb17501723 [0,2,0,0,0,0|1,0,1]=4 9480 B12R1.267 N#CCSCc1ccccc1F Amb17501731 [0,2,0,0,0,0|1,0,1]=4 9481 B12R1.267 N#CNCCc1ccccc1F Amb18800779 [0,2,0,0,0,0|1,0,1]=4 9482 B12R1.267 NCCC#Cc1ccccc1Cl Amb24439812 [0,2,0,0,0,0|1,0,1]=4 9483 B12R1.267 NCCCCN1C=CC=CC1=O Amb18535494 [0,2,0,0,0,0|2,0,0]=4 9484 B12R1.267 NCCCCc1ccccc1Br Amb18069064 [0,2,0,0,0,0|1,0,0]=3 9485 B12R1.267 NCCCCc1ccccc1Cl Amb22904185 [0,2,0,0,0,0|1,0,0]=3 9486 B12R1.267 NCCCCc1ccccc1F Amb18524598 [0,2,0,0,0,0|1,0,0]=3 9487 B12R1.267 NCCCCc1ccccc1O Amb18828230 [0,2,0,0,0,0|1,0,0]=3 9488 B12R1.267 NCCCNc1[n]cccc1Br Amb19015764 [0,2,0,0,0,0|2,0,0]=4 9489 B12R1.267 NCCCNc1[n]cccc1F Amb18314044 [0,2,0,0,0,0|2,0,0]=4 9490 B12R1.267 NCCCNc1c[n]ccc1Cl Amb24493036 [0,2,0,0,0,0|2,0,0]=4 9491 B12R1.267 NCCCNc1cc[n]cc1Cl Amb25034570 [0,2,0,0,0,0|2,0,0]=4 9492 B12R1.267 NCCCNc1ccccc1C Amb17057721 [0,2,0,0,0,0|1,0,0]=3 9493 B12R1.267 NCCCNc1ccccc1Cl Amb17057727 [0,2,0,0,0,0|1,0,0]=3 9494 B12R1.267 NCCCNc1ccccc1F Amb17057724 [0,2,0,0,0,0|1,0,0]=3 9495 B12R1.267 NCCCNc1ccccc1O Amb25214340 [0,2,0,0,0,0|1,0,0]=3 9496 B12R1.267 NCCCOc1ccccc1C Amb1136099 [0,2,0,0,0,0|1,0,0]=3 9497 B12R1.267 NCCCOc1ccccc1F Amb1107911 [0,2,0,0,0,0|1,0,0]=3 9498 B12R1.267 NCCCOc1ccccc1F Amb1221365 [0,2,0,0,0,0|1,0,0]=3 9499 B12R1.267 NCCNCc1ccccc1Br Amb18306264 [0,2,0,0,0,0|1,0,0]=3 9500 B12R1.267 NCCNCc1ccccc1Cl Amb10075510 [0,2,0,0,0,0|1,0,0]=3 9501 B12R1.267 NCCNCc1ccccc1F Amb10075506 [0,2,0,0,0,0|1,0,0]=3 9502 B12R1.267 NCCNCc1ccccc1O Amb19005483 [0,2,0,0,0,0|1,0,0]=3 9503 B12R1.267 NCCOCc1ccccc1Br Amb19020774 [0,2,0,0,0,0|1,0,0]=3 9504 B12R1.267 NCCOCc1ccccc1C Amb17061814 [0,2,0,0,0,0|1,0,0]=3 9505 B12R1.267 NCCOCc1ccccc1F Amb17061817 [0,2,0,0,0,0|1,0,0]=3 9506 B12R1.267 NCC\C=C\c1ccccc1Br Amb25129350 [0,2,0,0,0,0|1,0,1]=4 9507 B12R1.267 NCC\C=C\c1ccccc1C Amb17232386 [0,2,0,0,0,0|1,0,1]=4 9508 B12R1.267 NCC\C=C\c1ccccc1Cl Amb17233874 [0,2,0,0,0,0|1,0,1]=4 9509 B12R1.267 NCC\C=C\c1ccccc1F Amb17232531 [0,2,0,0,0,0|1,0,1]=4 9510 B12R1.267 NCC\N=C\c1ccccc1[O-] Amb24585164 [0,2,0,0,0,0|1,0,1]=4 9511 B12R1.267 NNCCOc1ccccc1Br Amb17407554 [0,2,0,0,0,0|2,0,0]=4 9512 B12R1.267 NNCCOc1ccccc1C Amb2282444 [0,2,0,0,0,0|2,0,0]=4 9513 B12R1.267 NNCCOc1ccccc1C Amb2370790 [0,2,0,0,0,0|2,0,0]=4 9514 B12R1.267 NNCCOc1ccccc1Cl Amb1114795 [0,2,0,0,0,0|2,0,0]=4 9515 B12R1.267 NNCCOc1ccccc1F Amb17400321 [0,2,0,0,0,0|2,0,0]=4 9516 B12R1.267 NOCC#Cc1ccccc1F Amb25773644 [0,2,0,0,0,0|0,0,2]=4 9517 B12R1.267 NOCCCc1ccccc1C Amb17089549 [0,2,0,0,0,0|0,0,0]=2 9518 B12R1.267 NOCCCc1ccccc1Cl Amb17089558 [0,2,0,0,0,0|0,0,0]=2 9519 B12R1.267 NOCCCc1ccccc1F Amb17089552 [0,2,0,0,0,0|0,0,0]=2 9520 B12R1.267 NOCCOc1ccccc1Br Amb17088297 [0,2,0,0,0,0|1,0,0]=3 9521 B12R1.267 NOCCOc1ccccc1C Amb17088288 [0,2,0,0,0,0|1,0,0]=3 9522 B12R1.267 NOCCOc1ccccc1Cl Amb17088294 [0,2,0,0,0,0|1,0,0]=3 9523 B12R1.267 NOCCOc1ccccc1F Amb17088291 [0,2,0,0,0,0|1,0,0]=3 9524 B12R1.267 Nc1[n]cccc1CCCCBr Amb24083016 [0,2,0,0,0,0|2,0,0]=4 9525 B12R1.267 Nc1c[n]ccc1NCCCF Amb25356614 [0,2,0,0,0,0|2,0,0]=4 9526 B12R1.267 Nc1cc[n]cc1NCCCF Amb24736854 [0,2,0,0,0,0|2,0,0]=4 9527 B12R1.267 Nc1cc[n]cc1NCCCO Amb25330082 [0,2,0,0,0,0|1,0,0]=3 9528 B12R1.267 Nc1ccc[n]c1CCCC#N Amb18645520 [0,2,0,0,0,0|2,0,0]=4 9529 B12R1.267 Nc1ccc[n]c1NCCCF Amb25354299 [0,2,0,0,0,0|2,0,0]=4 9530 B12R1.267 Nc1ccc[n]c1NCCCN Amb20673110 [0,2,0,0,0,0|2,0,0]=4 9531 B12R1.267 Nc1ccccc1CCCC#N Amb25253484 [0,2,0,0,0,0|1,0,0]=3 9532 B12R1.267 Nc1ccccc1NCCCN Amb24367240 [0,2,0,0,0,0|1,0,0]=3 9533 B12R1.267 Nc1ccccc1OCCC#N Amb18971549 [0,2,0,0,0,0|1,0,1]=4 9534 B12R1.267 Nc1ccccc1OCCCF Amb23539407 [0,2,0,0,0,0|1,0,0]=3 9535 B12R1.267 Nc1ccccc1\C=C\CCN Amb25805143 [0,2,0,0,0,0|1,0,1]=4 9536 B12R1.267 Nc1ccccc1\C=C\CCO Amb24623669 [0,2,0,0,0,0|0,0,1]=3 9537 B12R1.267 Nc1ncccc1OCCCO Amb17206812 [0,2,0,0,0,0|1,0,0]=3 9538 B12R1.267 O=C=NCCc1ccccc1C Amb17232365 [0,2,0,0,0,0|0,0,2]=4 9539 B12R1.267 O=C=NCCc1ccccc1Cl Amb17233866 [0,2,0,0,0,0|0,0,2]=4 9540 B12R1.267 O=CCCOc1ccccc1Br Amb17099971 [0,2,0,0,0,0|0,0,2]=4 9541 B12R1.267 O=CNCCc1ccccc1Cl Amb25101673 [0,2,0,0,0,0|0,0,2]=4 9542 B12R1.267 O=CNCCc1ccccc1F Amb24399686 [0,2,0,0,0,0|0,0,2]=4 9543 B12R1.267 OCCC#Cc1cc[n]cc1F Amb25118228 [0,2,0,0,0,0|1,0,1]=4 9544 B12R1.267 OCCC#Cc1ccccc1Cl Amb18796383 [0,2,0,0,0,0|0,0,1]=3 9545 B12R1.267 OCCC#Cc1ccccc1F Amb18800777 [0,2,0,0,0,0|0,0,1]=3 9546 B12R1.267 OCCCNc1[n]c[n]cc1Br Amb25805094 [0,2,0,0,0,0|2,0,0]=4 9547 B12R1.267 OCCCNc1[n]c[n]cc1Cl Amb25106976 [0,2,0,0,0,0|2,0,0]=4 9548 B12R1.267 OCCCNc1[n]c[n]cc1I Amb25785259 [0,2,0,0,0,0|2,0,0]=4 9549 B12R1.267 OCCCNc1[n]cc[n]c1Cl Amb19071495 [0,2,0,0,0,0|2,0,0]=4 9550 B12R1.267 OCCCNc1[n]cccc1Br Amb19015766 [0,2,0,0,0,0|1,0,0]=3 9551 B12R1.267 OCCCNc1[n]cccc1F Amb19029642 [0,2,0,0,0,0|1,0,0]=3 9552 B12R1.267 OCCCNc1cc[n]cc1Br Amb25314096 [0,2,0,0,0,0|1,0,0]=3 9553 B12R1.267 OCCCNc1cccc[n+]1O Amb17308217 [0,2,0,0,0,0|1,0,0]=3 9554 B12R1.267 OCCCNc1ccccc1Br Amb17306220 [0,2,0,0,0,0|0,0,0]=2 9555 B12R1.267 OCCCNc1ccccc1C Amb17306598 [0,2,0,0,0,0|0,0,0]=2 9556 B12R1.267 OCCCNc1ccccc1Cl Amb17306039 [0,2,0,0,0,0|0,0,0]=2 9557 B12R1.267 OCCCNc1ccccc1F Amb17306155 [0,2,0,0,0,0|0,0,0]=2 9558 B12R1.267 OCCNCc1[n]cc[n]c1Cl Amb21861905 [0,2,0,0,0,0|2,0,0]=4 9559 B12R1.267 OCCNCc1ccc[n]c1Cl Amb24048984 [0,2,0,0,0,0|1,0,0]=3 9560 B12R1.267 OCCNCc1ccccc1Cl Amb13949019 [0,2,0,0,0,0|0,0,0]=2 9561 B12R1.267 OCCNCc1ccccc1I Amb21861540 [0,2,0,0,0,0|0,0,0]=2 9562 B12R1.267 OCC\C=C\c1ccccc1Cl Amb25670027 [0,2,0,0,0,0|0,0,1]=3 9563 B12R1.267 OCC\C=C\c1ccccc1F Amb25221113 [0,2,0,0,0,0|0,0,1]=3 9564 B12R1.267 OCC\N=C\c1ccccc1F Amb25769365 [0,2,0,0,0,0|0,0,1]=3 9565 B12R1.267 ONCCOc1ccccc1Br Amb17088423 [0,2,0,0,0,0|1,0,0]=3 9566 B12R1.267 ONCCOc1ccccc1C Amb17088414 [0,2,0,0,0,0|1,0,0]=3 9567 B12R1.267 ONCCOc1ccccc1Cl Amb17088420 [0,2,0,0,0,0|1,0,0]=3 9568 B12R1.267 ONCCOc1ccccc1F Amb17088417 [0,2,0,0,0,0|1,0,0]=3 9569 B12R1.267 Oc1ccccc1CCN=C=O Amb25267891 [0,2,0,0,0,0|0,0,2]=4 9570 B12R1.267 Oc1ccccc1OCCCF Amb23449023 [0,2,0,0,0,0|1,0,0]=3 9571 B12R1.267 Oc1ccccc1\C=N\CCO Amb24633463 [0,2,0,0,0,0|0,0,1]=3 9572 B12R1.267 S=C=NCCc1ccccc1C Amb17233308 [0,2,0,0,0,0|0,1,1]=4 9573 B12R1.267 S=C=NCCc1ccccc1Cl Amb17236675 [0,2,0,0,0,0|0,1,1]=4 9574 B12R1.267 SCCCCc1ccccc1Br Amb18576923 [0,2,0,0,0,0|0,1,0]=3 9575 B12R1.267 SCCCCc1ccccc1Cl Amb18066299 [0,2,0,0,0,0|0,1,0]=3 9576 B12R1.267 SCCCOc1ccccc1Br Amb17258957 [0,2,0,0,0,0|0,1,0]=3 9577 B12R1.267 SCCCOc1ccccc1C Amb17233940 [0,2,0,0,0,0|0,1,0]=3 9578 B12R1.267 SCCCOc1ccccc1Cl Amb17237588 [0,2,0,0,0,0|0,1,0]=3 9579 B12R1.267 SCCCOc1ccccc1F Amb17234296 [0,2,0,0,0,0|0,1,0]=3 9580 B12R1.267 [C-]#[N+]CCCc1ccccc1Br Amb25364511 [0,2,0,0,0,0|1,0,0]=3 9581 B12R1.267 [C-]#[N+]CCCc1ccccc1F Amb24754342 [0,2,0,0,0,0|1,0,0]=3 9582 B12R1.267 [C-]#[N+]CCCc1ccccc1O Amb25202328 [0,2,0,0,0,0|1,0,0]=3 9583 B12R1.267 [C-]#[N+]CCOc1ccccc1Br Amb25196036 [0,2,0,0,0,0|2,0,0]=4 9584 B12R1.267 [C-]#[N+]CCSc1ccccc1Br Amb25762926 [0,2,0,0,0,0|2,0,0]=4 9585 B12R1.267 [C-]#[N+]CCSc1ccccc1C Amb25697577 [0,2,0,0,0,0|2,0,0]=4 9586 B12R1.267 [O-][n+]1ccccc1NCCCO Amb25751367 [0,2,0,0,0,0|1,0,0]=3 9587 B12R1.371 BrCC(Oc1ccccc1Br)C Amb17291820 [0,2,0,0,0,0|2,0,0]=4 9588 B12R1.371 BrCC(Oc1ccccc1C)C Amb17248431 [0,2,0,0,0,0|2,0,0]=4 9589 B12R1.371 BrCC(Oc1ccccc1Cl)C Amb17261129 [0,2,0,0,0,0|2,0,0]=4 9590 B12R1.371 BrCC(Oc1ccccc1F)C Amb17250549 [0,2,0,0,0,0|2,0,0]=4 9591 B12R1.371 C=CC(Cl)Cc1ccccc1Cl Amb25123891 [0,2,0,0,0,0|1,0,1]=4 9592 B12R1.371 C=CC(N)Cc1ccccc1F Amb24471242 [0,2,0,0,0,0|1,0,1]=4 9593 B12R1.371 C=CC(O)Cc1ccccc1Br Amb24523932 [0,2,0,0,0,0|1,0,1]=4 9594 B12R1.371 CC(CCl)Oc1ccccc1O Amb24096843 [0,2,0,0,0,0|2,0,0]=4 9595 B12R1.371 CC(CN)CN1C=CC=CC1=O Amb19002925 [0,2,0,0,0,0|2,0,0]=4 9596 B12R1.371 CC(CN)Cc1cc[n]cc1Cl Amb24537709 [0,2,0,0,0,0|2,0,0]=4 9597 B12R1.371 CC(CN)Cc1ccccc1Br Amb18992226 [0,2,0,0,0,0|1,0,0]=3 9598 B12R1.371 CC(CN)Nc1ccccc1Cl Amb18909432 [0,2,0,0,0,0|2,0,0]=4 9599 B12R1.371 CC(CN)Nc1ccccc1F Amb18908737 [0,2,0,0,0,0|2,0,0]=4 9600 B12R1.371 CC(CN)Nc1ccccc1I Amb24551694 [0,2,0,0,0,0|2,0,0]=4 9601 B12R1.371 CC(CN)Oc1ccccc1Cl Amb19148877 [0,2,0,0,0,0|2,0,0]=4 9602 B12R1.371 CC(CN)Oc1ccccc1F Amb18299438 [0,2,0,0,0,0|2,0,0]=4 9603 B12R1.371 CC(CN)Sc1ccccc1Br Amb18992815 [0,2,0,0,0,0|2,0,0]=4 9604 B12R1.371 CC(CN)Sc1ccccc1Cl Amb18992821 [0,2,0,0,0,0|2,0,0]=4 9605 B12R1.371 CC(CN)Sc1ccccc1F Amb18992820 [0,2,0,0,0,0|2,0,0]=4 9606 B12R1.371 CC(CN)Sc1ccccc1N Amb18909296 [0,2,0,0,0,0|2,0,0]=4 9607 B12R1.371 CC(CN)Sc1ccccc1O Amb18909347 [0,2,0,0,0,0|2,0,0]=4 9608 B12R1.371 CC(CO)Cc1cc[n]cc1F Amb25367851 [0,2,0,0,0,0|1,0,0]=3 9609 B12R1.371 CC(CO)Cc1ccccc1Br Amb25208316 [0,2,0,0,0,0|0,0,0]=2 9610 B12R1.371 CC(CO)Cc1ccccc1Cl Amb25039912 [0,2,0,0,0,0|0,0,0]=2 9611 B12R1.371 CC(CO)Nc1[n]cccc1Br Amb18977528 [0,2,0,0,0,0|2,0,0]=4 9612 B12R1.371 CC(CO)Nc1[n]cccc1F Amb18300638 [0,2,0,0,0,0|2,0,0]=4 9613 B12R1.371 CC(CO)Nc1[n]cccc1I Amb25681220 [0,2,0,0,0,0|2,0,0]=4 9614 B12R1.371 CC(CO)Nc1c[n]ccc1N Amb24752776 [0,2,0,0,0,0|2,0,0]=4 9615 B12R1.371 CC(CO)Nc1cc[n]cc1F Amb24747865 [0,2,0,0,0,0|2,0,0]=4 9616 B12R1.371 CC(CO)Nc1ccc[n]c1N Amb25803740 [0,2,0,0,0,0|2,0,0]=4 9617 B12R1.371 CC(CO)Nc1ccccc1Br Amb18290138 [0,2,0,0,0,0|1,0,0]=3 9618 B12R1.371 CC(CO)Nc1ccccc1Cl Amb18971813 [0,2,0,0,0,0|1,0,0]=3 9619 B12R1.371 CC(CO)Nc1ccccc1F Amb18971852 [0,2,0,0,0,0|1,0,0]=3 9620 B12R1.371 CC(CO)Oc1ccccc1I Amb25828459 [0,2,0,0,0,0|1,0,0]=3 9621 B12R1.371 CC(CO)Oc1ccccc1O Amb24559693 [0,2,0,0,0,0|1,0,0]=3 9622 B12R1.371 CC(CO)Sc1[n]cccc1Br Amb25804892 [0,2,0,0,0,0|2,0,0]=4 9623 B12R1.371 CC(CO)Sc1[n]cccc1N Amb24439608 [0,2,0,0,0,0|2,0,0]=4 9624 B12R1.371 CC(CO)Sc1cc[n]cc1Br Amb24745188 [0,2,0,0,0,0|2,0,0]=4 9625 B12R1.371 CC(CO)Sc1cccc[n+]1[O-] Amb25154653 [0,2,0,0,0,0|2,0,0]=4 9626 B12R1.371 CC(CO)Sc1ccccc1F Amb25330415 [0,2,0,0,0,0|1,0,0]=3 9627 B12R1.371 CC(CO)Sc1ccccc1N Amb25266122 [0,2,0,0,0,0|1,0,0]=3 9628 B12R1.371 CC(CS)CN1C=CC=CC1=O Amb24393655 [0,2,0,0,0,0|1,1,0]=4 9629 B12R1.371 CC(Cc1[n]cccc1Br)CBr Amb25111379 [0,2,0,0,0,0|2,0,0]=4 9630 B12R1.371 CC(Cc1c[n]ccc1N)CBr Amb25306937 [0,2,0,0,0,0|2,0,0]=4 9631 B12R1.371 CC(Cc1c[n]ccc1N)CCl Amb25206089 [0,2,0,0,0,0|2,0,0]=4 9632 B12R1.371 CC(Cc1cc[n]cc1Cl)CBr Amb24443693 [0,2,0,0,0,0|2,0,0]=4 9633 B12R1.371 CC(Cc1cc[n]cc1F)CBr Amb24401162 [0,2,0,0,0,0|2,0,0]=4 9634 B12R1.371 CC(Cc1ccc[n]c1N)CO Amb25302419 [0,2,0,0,0,0|1,0,0]=3 9635 B12R1.371 CC(Cc1ccccc1Br)C=O Amb25324057 [0,2,0,0,0,0|0,0,2]=4 9636 B12R1.371 CC(Cc1ccccc1Br)CBr Amb25040689 [0,2,0,0,0,0|1,0,0]=3 9637 B12R1.371 CC(Cc1ccccc1Cl)C#N Amb25717018 [0,2,0,0,0,0|1,0,1]=4 9638 B12R1.371 CC(Cc1ccccc1F)C=O Amb24429443 [0,2,0,0,0,0|0,0,2]=4 9639 B12R1.371 CC(Cc1ccccc1F)CBr Amb25741700 [0,2,0,0,0,0|1,0,0]=3 9640 B12R1.371 CC(Cc1ccccc1F)CCl Amb25349982 [0,2,0,0,0,0|1,0,0]=3 9641 B12R1.371 CC(Cc1ccccc1I)C=O Amb24437612 [0,2,0,0,0,0|0,0,2]=4 9642 B12R1.371 CC(Cc1ccccc1O)C=O Amb25313067 [0,2,0,0,0,0|0,0,2]=4 9643 B12R1.371 CCC(=O)Cc1ccccc1Br Amb19148340 [0,2,0,0,0,0|1,0,1]=4 9644 B12R1.371 CCC(=O)Cc1ccccc1C Amb17138542 [0,2,0,0,0,0|1,0,1]=4 9645 B12R1.371 CCC(=O)Cc1ccccc1Cl Amb17139041 [0,2,0,0,0,0|1,0,1]=4 9646 B12R1.371 CCC(=O)Cc1ccccc1F Amb17138603 [0,2,0,0,0,0|1,0,1]=4 9647 B12R1.371 CCC(=O)Cc1ccccc1O Amb18646038 [0,2,0,0,0,0|1,0,1]=4 9648 B12R1.371 CCC(Br)Cc1ccccc1Cl Amb24675424 [0,2,0,0,0,0|1,0,0]=3 9649 B12R1.371 CCC(C)CN1C=CC=CC1=O Amb25667279 [0,2,0,0,0,0|2,0,0]=4 9650 B12R1.371 CCC(C)Cc1ccccc1N Amb25034567 [0,2,0,0,0,0|1,0,0]=3 9651 B12R1.371 CCC(C)Oc1ccccc1I Amb24531541 [0,2,0,0,0,0|2,0,0]=4 9652 B12R1.371 CCC(C)Sc1ccccc1O Amb19045078 [0,2,0,0,0,0|2,0,0]=4 9653 B12R1.371 CCC(Cc1ccccc1C)Cl Amb17477425 [0,2,0,0,0,0|1,0,0]=3 9654 B12R1.371 CCC(Cc1ccccc1C)O Amb17138581 [0,2,0,0,0,0|1,0,0]=3 9655 B12R1.371 CCC(Cc1ccccc1Cl)Cl Amb17477603 [0,2,0,0,0,0|1,0,0]=3 9656 B12R1.371 CCC(Cc1ccccc1Cl)O Amb17139101 [0,2,0,0,0,0|1,0,0]=3 9657 B12R1.371 CCC(Cc1ccccc1F)O Amb17138635 [0,2,0,0,0,0|1,0,0]=3 9658 B12R1.371 CCC(Cl)Cc1c[n]ccc1N Amb25296625 [0,2,0,0,0,0|2,0,0]=4 9659 B12R1.371 CCC(Cl)Cc1cc[n]cc1Cl Amb24366328 [0,2,0,0,0,0|2,0,0]=4 9660 B12R1.371 CCC(Cl)Cc1ccccc1F Amb19046368 [0,2,0,0,0,0|1,0,0]=3 9661 B12R1.371 CCC(N)CN1C=CC=CC1=O Amb18040292 [0,2,0,0,0,0|2,0,0]=4 9662 B12R1.371 CCC(N)Cc1[n]cccc1Br Amb24366923 [0,2,0,0,0,0|2,0,0]=4 9663 B12R1.371 CCC(N)Cc1[n]cccc1O Amb25255439 [0,2,0,0,0,0|2,0,0]=4 9664 B12R1.371 CCC(N)Cc1c[n]ccc1Br Amb25200276 [0,2,0,0,0,0|2,0,0]=4 9665 B12R1.371 CCC(N)Cc1c[n]ccc1N Amb24746623 [0,2,0,0,0,0|2,0,0]=4 9666 B12R1.371 CCC(N)Cc1cc[n]cc1Cl Amb24653802 [0,2,0,0,0,0|2,0,0]=4 9667 B12R1.371 CCC(N)Cc1ccc[n]c1Cl Amb25791112 [0,2,0,0,0,0|2,0,0]=4 9668 B12R1.371 CCC(N)Cc1ccc[n]c1F Amb25211825 [0,2,0,0,0,0|2,0,0]=4 9669 B12R1.371 CCC(N)Cc1ccc[n]c1N Amb24546960 [0,2,0,0,0,0|2,0,0]=4 9670 B12R1.371 CCC(N)Cc1ccccc1Br Amb20627508 [0,2,0,0,0,0|1,0,0]=3 9671 B12R1.371 CCC(O)CN1C=CC=CC1=O Amb18792909 [0,2,0,0,0,0|2,0,0]=4 9672 B12R1.371 CCC(O)Cc1c[n]ccc1N Amb24643382 [0,2,0,0,0,0|2,0,0]=4 9673 B12R1.371 CCC(O)Cc1cc[n]cc1Cl Amb24594806 [0,2,0,0,0,0|2,0,0]=4 9674 B12R1.371 CCC(O)Cc1ccccc1Br Amb24465632 [0,2,0,0,0,0|1,0,0]=3 9675 B12R1.371 CCC(O)Cc1ccccc1N Amb25335274 [0,2,0,0,0,0|1,0,0]=3 9676 B12R1.371 CCN(C)Cc1ccccc1Br Amb24370391 [0,2,0,0,0,0|2,0,0]=4 9677 B12R1.371 CCN(C)Cc1ccccc1Cl Amb25107530 [0,2,0,0,0,0|2,0,0]=4 9678 B12R1.371 CCN(C)Cc1ccccc1F Amb25749463 [0,2,0,0,0,0|2,0,0]=4 9679 B12R1.371 CCN(C)Cc1ccccc1F Amb25846054 [0,2,0,0,0,0|2,0,0]=4 9680 B12R1.371 CCN(C)Cc1ccccc1O Amb24493028 [0,2,0,0,0,0|2,0,0]=4 9681 B12R1.371 CCN(N)Cc1ccccc1Br Amb25738572 [0,2,0,0,0,0|2,0,0]=4 9682 B12R1.371 CCS(=O)Cc1ccccc1F Amb24449347 [0,2,0,0,0,0|2,0,0]=4 9683 B12R1.371 CCS(=O)Cc1ccccc1N Amb18290934 [0,2,0,0,0,0|2,0,0]=4 9684 B12R1.371 CCS(=O)Cc1ccccc1O Amb18648969 [0,2,0,0,0,0|2,0,0]=4 9685 B12R1.371 CNC(C)Cc1ccccc1Br Amb25149882 [0,2,0,0,0,0|2,0,0]=4 9686 B12R1.371 CN[C@@H](C)Cc1ccccc1F Amb25264769 [0,2,0,0,0,0|2,0,0]=4 9687 B12R1.371 COC(C)Cc1ccccc1O Amb18646540 [0,2,0,0,0,0|2,0,0]=4 9688 B12R1.371 C[C@@H](CO)Nc1[n]cccc1Cl Amb24408027 [0,2,0,0,0,0|2,0,0]=4 9689 B12R1.371 C[C@@H](CO)Nc1[n]cccc1F Amb25256998 [0,2,0,0,0,0|2,0,0]=4 9690 B12R1.371 C[C@@H](CO)Oc1ccccc1Cl Amb24407533 [0,2,0,0,0,0|1,0,0]=3 9691 B12R1.371 C[C@@H](CO)Oc1ccccc1I Amb22746638 [0,2,0,0,0,0|1,0,0]=3 9692 B12R1.371 C[C@@H](Cc1ccccc1O)CO Amb24633514 [0,2,0,0,0,0|0,0,0]=2 9693 B12R1.371 C[C@H](CO)Cc1ccccc1Cl Amb25157925 [0,2,0,0,0,0|0,0,0]=2 9694 B12R1.371 C[C@H](CO)Cc1ccccc1F Amb25837933 [0,2,0,0,0,0|0,0,0]=2 9695 B12R1.371 C[C@H](CO)Oc1ccccc1I Amb25150105 [0,2,0,0,0,0|1,0,0]=3 9696 B12R1.371 C[C@H](Cc1ccccc1O)CO Amb25094364 [0,2,0,0,0,0|0,0,0]=2 9697 B12R1.371 C\C(\CO)=C/c1ccccc1O Amb25838654 [0,2,0,0,0,0|0,0,2]=4 9698 B12R1.371 C\C(\CO)=C\c1ccccc1Br Amb25335085 [0,2,0,0,0,0|0,0,2]=4 9699 B12R1.371 C\C(\CO)=C\c1ccccc1Cl Amb24557711 [0,2,0,0,0,0|0,0,2]=4 9700 B12R1.371 C\C(\CO)=C\c1ccccc1F Amb24700903 [0,2,0,0,0,0|0,0,2]=4 9701 B12R1.371 C\C(\CO)=C\c1ccccc1O Amb18646032 [0,2,0,0,0,0|0,0,2]=4 9702 B12R1.371 C\C(\Cc1ccccc1Cl)=N\O Amb25290972 [0,2,0,0,0,0|1,0,1]=4 9703 B12R1.371 C\C(\Cc1ccccc1F)=N\O Amb25252610 [0,2,0,0,0,0|1,0,1]=4 9704 B12R1.371 C\C(\Cc1ccccc1O)=N\O Amb25211004 [0,2,0,0,0,0|1,0,1]=4 9705 B12R1.371 Cc1c[n]ccc1CC(N)CC Amb25680032 [0,2,0,0,0,0|2,0,0]=4 9706 B12R1.371 Cc1c[n]ccc1CC(N)CO Amb24549921 [0,2,0,0,0,0|1,0,0]=3 9707 B12R1.371 Cc1c[n]ccc1NC(C)CO Amb24487182 [0,2,0,0,0,0|2,0,0]=4 9708 B12R1.371 Cc1cc[n]cc1CC(C)CCl Amb24556506 [0,2,0,0,0,0|2,0,0]=4 9709 B12R1.371 Cc1cc[n]cc1CC(C)CN Amb24734143 [0,2,0,0,0,0|2,0,0]=4 9710 B12R1.371 Cc1cc[n]cc1CC(N)CC Amb18828654 [0,2,0,0,0,0|2,0,0]=4 9711 B12R1.371 Cc1ccc[n]c1CC(Br)CC Amb25349171 [0,2,0,0,0,0|2,0,0]=4 9712 B12R1.371 Cc1ccc[n]c1CC(N)CC Amb24753508 [0,2,0,0,0,0|2,0,0]=4 9713 B12R1.371 Cc1ccc[n]c1CC(N)CO Amb25751493 [0,2,0,0,0,0|1,0,0]=3 9714 B12R1.371 Cc1ccc[n]c1CC(O)CC Amb24415938 [0,2,0,0,0,0|2,0,0]=4 9715 B12R1.371 Cc1ccc[n]c1NC(C)CO Amb18296069 [0,2,0,0,0,0|2,0,0]=4 9716 B12R1.371 Cc1ccccc1CC(=O)CN Amb18829246 [0,2,0,0,0,0|1,0,1]=4 9717 B12R1.371 Cc1ccccc1CC(=O)CO Amb18563611 [0,2,0,0,0,0|0,0,1]=3 9718 B12R1.371 Cc1ccccc1CC(C)C=O Amb18645713 [0,2,0,0,0,0|0,0,2]=4 9719 B12R1.371 Cc1ccccc1CC(C)CBr Amb25733982 [0,2,0,0,0,0|1,0,0]=3 9720 B12R1.371 Cc1ccccc1CC(C)CO Amb25152371 [0,2,0,0,0,0|0,0,0]=2 9721 B12R1.371 Cc1ccccc1CC(C)NC Amb24271197 [0,2,0,0,0,0|2,0,0]=4 9722 B12R1.371 Cc1ccccc1CC(F)CN Amb24745160 [0,2,0,0,0,0|1,0,0]=3 9723 B12R1.371 Cc1ccccc1CC(N)C#C Amb25148677 [0,2,0,0,0,0|1,0,1]=4 9724 B12R1.371 Cc1ccccc1CC(O)C#C Amb25764953 [0,2,0,0,0,0|1,0,1]=4 9725 B12R1.371 Cc1ccccc1CC(O)C=O Amb25789140 [0,2,0,0,0,0|0,0,2]=4 9726 B12R1.371 Cc1ccccc1CC(O)CCl Amb25258048 [0,2,0,0,0,0|1,0,0]=3 9727 B12R1.371 Cc1ccccc1CC(O)CO Amb24615514 [0,2,0,0,0,0|0,0,0]=2 9728 B12R1.371 Cc1ccccc1C[C@@H](N)CC Amb24410901 [0,2,0,0,0,0|1,0,0]=3 9729 B12R1.371 Cc1ccccc1C[C@H](O)CC Amb25157887 [0,2,0,0,0,0|1,0,0]=3 9730 B12R1.371 Cc1ccccc1NC(C)CN Amb18251701 [0,2,0,0,0,0|2,0,0]=4 9731 B12R1.371 Cc1ccccc1NC(C)CO Amb18971809 [0,2,0,0,0,0|1,0,0]=3 9732 B12R1.371 Cc1ccccc1OC(Cl)CCl Amb25141618 [0,2,0,0,0,0|2,0,0]=4 9733 B12R1.371 Cc1ccccc1SC(=C)CO Amb25271481 [0,2,0,0,0,0|1,0,1]=4 9734 B12R1.371 Cc1ccccc1SC(C)CN Amb18299446 [0,2,0,0,0,0|2,0,0]=4 9735 B12R1.371 Cc1ccccc1SC(O)CC Amb22228394 [0,2,0,0,0,0|2,0,0]=4 9736 B12R1.371 Cc1ccccc1\C=C(\F)/CO Amb24407513 [0,2,0,0,0,0|0,0,2]=4 9737 B12R1.371 ClCC(Oc1ccccc1Br)C Amb17261132 [0,2,0,0,0,0|2,0,0]=4 9738 B12R1.371 ClCC(Oc1ccccc1C)C Amb17234168 [0,2,0,0,0,0|2,0,0]=4 9739 B12R1.371 ClCC(Oc1ccccc1Cl)C Amb17238289 [0,2,0,0,0,0|2,0,0]=4 9740 B12R1.371 ClCC(Oc1ccccc1F)C Amb17234613 [0,2,0,0,0,0|2,0,0]=4 9741 B12R1.371 N#CC(Cc1ccccc1Br)Br Amb17376788 [0,2,0,0,0,0|1,0,1]=4 9742 B12R1.371 N#CC(Cc1ccccc1Br)Cl Amb17204671 [0,2,0,0,0,0|1,0,1]=4 9743 B12R1.371 N#CC(Cc1ccccc1C)Br Amb17342951 [0,2,0,0,0,0|1,0,1]=4 9744 B12R1.371 N#CC(Cc1ccccc1C)Cl Amb17204319 [0,2,0,0,0,0|1,0,1]=4 9745 B12R1.371 N#CC(Cc1ccccc1Cl)Br Amb17349963 [0,2,0,0,0,0|1,0,1]=4 9746 B12R1.371 N#CC(Cc1ccccc1Cl)Cl Amb2520868 [0,2,0,0,0,0|1,0,1]=4 9747 B12R1.371 N#CC(Cc1ccccc1F)Br Amb17344011 [0,2,0,0,0,0|1,0,1]=4 9748 B12R1.371 N#CC(Cc1ccccc1F)Cl Amb17204330 [0,2,0,0,0,0|1,0,1]=4 9749 B12R1.371 N=C1C=CC=CN1CC(O)CCl Amb18048560 [0,2,0,0,0,0|2,0,0]=4 9750 B12R1.371 N=C1C=CC=CN1CC(O)CO Amb24475826 [0,2,0,0,0,0|1,0,0]=3 9751 B12R1.371 NC(CF)Cc1ccccc1Cl Amb24596044 [0,2,0,0,0,0|1,0,0]=3 9752 B12R1.371 NC(CO)Cc1[n]cccc1Br Amb24581707 [0,2,0,0,0,0|1,0,0]=3 9753 B12R1.371 NC(CO)Cc1cc[n]cc1Br Amb24542635 [0,2,0,0,0,0|1,0,0]=3 9754 B12R1.371 NC(CO)Cc1cc[n]cc1Cl Amb25669679 [0,2,0,0,0,0|1,0,0]=3 9755 B12R1.371 NC(CO)Cc1cc[n]cc1F Amb25261338 [0,2,0,0,0,0|1,0,0]=3 9756 B12R1.371 NC(CO)Cc1ccc[n]c1Cl Amb25241685 [0,2,0,0,0,0|1,0,0]=3 9757 B12R1.371 NC(CO)Cc1ccccc1Br Amb18747032 [0,2,0,0,0,0|0,0,0]=2 9758 B12R1.371 NC(CO)Cc1ccccc1I Amb25200271 [0,2,0,0,0,0|0,0,0]=2 9759 B12R1.371 NC(Cc1ccccc1Cl)C#N Amb23557157 [0,2,0,0,0,0|1,0,1]=4 9760 B12R1.371 NC(Cc1ccccc1F)CF Amb25255727 [0,2,0,0,0,0|1,0,0]=3 9761 B12R1.371 NC(Cc1ccccc1O)CO Amb18827210 [0,2,0,0,0,0|0,0,0]=2 9762 B12R1.371 NCC(=O)Cc1ccccc1Br Amb25667280 [0,2,0,0,0,0|1,0,1]=4 9763 B12R1.371 NCC(=O)Cc1ccccc1Cl Amb18909368 [0,2,0,0,0,0|1,0,1]=4 9764 B12R1.371 NCC(=O)Cc1ccccc1F Amb18827239 [0,2,0,0,0,0|1,0,1]=4 9765 B12R1.371 NCC(Cc1ccccc1C)O Amb17232545 [0,2,0,0,0,0|1,0,0]=3 9766 B12R1.371 NCC(Cc1ccccc1Cl)O Amb17234263 [0,2,0,0,0,0|1,0,0]=3 9767 B12R1.371 NCC(Cc1ccccc1F)O Amb17232700 [0,2,0,0,0,0|1,0,0]=3 9768 B12R1.371 NCC(O)CN1C=CC=CC1=O Amb18288788 [0,2,0,0,0,0|2,0,0]=4 9769 B12R1.371 NCC(O)Cc1[n]cccc1Br Amb25144691 [0,2,0,0,0,0|2,0,0]=4 9770 B12R1.371 NCC(O)Cc1cc[n]cc1Cl Amb25092324 [0,2,0,0,0,0|2,0,0]=4 9771 B12R1.371 NCC(O)Cc1ccc[n]c1F Amb25762785 [0,2,0,0,0,0|2,0,0]=4 9772 B12R1.371 NCC(O)Cc1ccccc1Br Amb18069447 [0,2,0,0,0,0|1,0,0]=3 9773 B12R1.371 NC[C@@H](O)CN1C=CC=CC1=O Amb25809156 [0,2,0,0,0,0|2,0,0]=4 9774 B12R1.371 N[C@@H](CO)Cc1ccccc1Cl Amb25106847 [0,2,0,0,0,0|0,0,0]=2 9775 B12R1.371 N[C@@H](CO)Cc1ccccc1F Amb25331070 [0,2,0,0,0,0|0,0,0]=2 9776 B12R1.371 N[C@H](CO)Cc1ccccc1Br Amb24424605 [0,2,0,0,0,0|0,0,0]=2 9777 B12R1.371 N[C@H](CO)Cc1ccccc1Cl Amb22233157 [0,2,0,0,0,0|0,0,0]=2 9778 B12R1.371 N[C@H](CO)Cc1ccccc1F Amb25308478 [0,2,0,0,0,0|0,0,0]=2 9779 B12R1.371 Nc1[n]cccc1CC(F)CN Amb24701427 [0,2,0,0,0,0|2,0,0]=4 9780 B12R1.371 Nc1c[n]ccc1CC(N)CO Amb25287483 [0,2,0,0,0,0|1,0,0]=3 9781 B12R1.371 Nc1cc[n]cc1CC(O)CCl Amb24758325 [0,2,0,0,0,0|2,0,0]=4 9782 B12R1.371 Nc1ccccc1CC(N)CO Amb25712145 [0,2,0,0,0,0|0,0,0]=2 9783 B12R1.371 Nc1ccccc1C[C@H](N)CO Amb22233158 [0,2,0,0,0,0|0,0,0]=2 9784 B12R1.371 O=C(CBr)Cc1ccccc1I Amb25352153 [0,2,0,0,0,0|1,0,1]=4 9785 B12R1.371 O=C(CCl)Cc1ccccc1I Amb25253621 [0,2,0,0,0,0|1,0,1]=4 9786 B12R1.371 O=C(CF)Cc1ccccc1Cl Amb23454831 [0,2,0,0,0,0|1,0,1]=4 9787 B12R1.371 O=C(Cc1ccccc1Cl)CBr Amb25312032 [0,2,0,0,0,0|1,0,1]=4 9788 B12R1.371 O=CC(Cc1ccccc1Br)Cl Amb17204707 [0,2,0,0,0,0|0,0,2]=4 9789 B12R1.371 O=CC(Cc1ccccc1C)Cl Amb17204326 [0,2,0,0,0,0|0,0,2]=4 9790 B12R1.371 O=CC(Cc1ccccc1Cl)Cl Amb17204401 [0,2,0,0,0,0|0,0,2]=4 9791 B12R1.371 O=CC(Cc1ccccc1F)Cl Amb17204341 [0,2,0,0,0,0|0,0,2]=4 9792 B12R1.371 O=CC(Cl)Cc1ccccc1I Amb25827697 [0,2,0,0,0,0|0,0,2]=4 9793 B12R1.371 O=CC(F)Cc1ccccc1Cl Amb25148636 [0,2,0,0,0,0|0,0,2]=4 9794 B12R1.371 O=CC(F)Cc1ccccc1F Amb24341410 [0,2,0,0,0,0|0,0,2]=4 9795 B12R1.371 OC(CBr)CN1C=CC=CC1=O Amb25751689 [0,2,0,0,0,0|2,0,0]=4 9796 B12R1.371 OC(CCl)CN1C=CC=CC1=O Amb25102536 [0,2,0,0,0,0|2,0,0]=4 9797 B12R1.371 OC(Cc1ccccc1F)C=O Amb24554950 [0,2,0,0,0,0|0,0,2]=4 9798 B12R1.371 OC(Cc1ccccc1F)CCl Amb24355863 [0,2,0,0,0,0|1,0,0]=3 9799 B12R1.371 OCC(=O)Cc1ccccc1Cl Amb18564303 [0,2,0,0,0,0|0,0,1]=3 9800 B12R1.371 OCC(=O)Cc1ccccc1F Amb18805788 [0,2,0,0,0,0|0,0,1]=3 9801 B12R1.371 OCC(=O)Nc1ccccc1Br Amb1109988 [0,2,0,0,0,0|1,0,1]=4 9802 B12R1.371 OCC(=O)Nc1ccccc1C Amb1110662 [0,2,0,0,0,0|1,0,1]=4 9803 B12R1.371 OCC(=O)Nc1ccccc1Cl Amb1111147 [0,2,0,0,0,0|1,0,1]=4 9804 B12R1.371 OCC(=O)Nc1ccccc1F Amb1109775 [0,2,0,0,0,0|1,0,1]=4 9805 B12R1.371 OCC(=O)Oc1ccccc1Cl Amb25072212 [0,2,0,0,0,0|1,0,1]=4 9806 B12R1.371 OCC(=O)Oc1ccccc1F Amb25122488 [0,2,0,0,0,0|1,0,1]=4 9807 B12R1.371 OCC(=O)Oc1ccccc1I Amb25056604 [0,2,0,0,0,0|1,0,1]=4 9808 B12R1.371 OCC(Cc1ccccc1C)N Amb17062685 [0,2,0,0,0,0|0,0,0]=2 9809 B12R1.371 OCC(Cc1ccccc1Cl)N Amb17062694 [0,2,0,0,0,0|0,0,0]=2 9810 B12R1.371 OCC(Cc1ccccc1F)N Amb17062688 [0,2,0,0,0,0|0,0,0]=2 9811 B12R1.371 OCC(O)CN1C=CC=CC1=O Amb25817247 [0,2,0,0,0,0|1,0,0]=3 9812 B12R1.371 OCC(O)CN1C=CC=NC1=O Amb24360601 [0,2,0,0,0,0|2,0,0]=4 9813 B12R1.371 OCC(O)CN1C=CN=CC1=O Amb25307780 [0,2,0,0,0,0|2,0,0]=4 9814 B12R1.371 OCC(Oc1ccccc1Br)C Amb17249276 [0,2,0,0,0,0|1,0,0]=3 9815 B12R1.371 OCC(Oc1ccccc1C)C Amb17232600 [0,2,0,0,0,0|1,0,0]=3 9816 B12R1.371 OCC(Oc1ccccc1Cl)C Amb17234356 [0,2,0,0,0,0|1,0,0]=3 9817 B12R1.371 OCC(Oc1ccccc1F)C Amb17232739 [0,2,0,0,0,0|1,0,0]=3 9818 B12R1.371 OC[C@H](O)CN1C=CC=NC1=O Amb24457817 [0,2,0,0,0,0|2,0,0]=4 9819 B12R1.371 O\N=C(\Cc1ccccc1C)/N Amb1118586 [0,2,0,0,0,0|1,0,1]=4 9820 B12R1.371 O\N=C(\Cc1ccccc1Cl)/N Amb10205341 [0,2,0,0,0,0|1,0,1]=4 9821 B12R1.371 Oc1ccccc1CC(=O)CCl Amb25376294 [0,2,0,0,0,0|1,0,1]=4 9822 B12R1.371 Oc1ccccc1CC(F)C=O Amb25148635 [0,2,0,0,0,0|0,0,2]=4 9823 B12R1.374 BrCCCc1cc(Br)ccc1Br Amb24537172 [0,2,0,0,0,0|1,0,0]=3 9824 B12R1.374 BrCCOc1cc(Br)ccc1Br Amb10068285 [0,2,0,0,0,0|2,0,0]=4 9825 B12R1.374 C#CCCc1cc(F)ccc1O Amb24100511 [0,2,0,0,0,0|1,0,1]=4 9826 B12R1.374 C=CCCc1cc(Br)ccc1F Amb25804334 [0,2,0,0,0,0|1,0,1]=4 9827 B12R1.374 CC1=CN(CCCN)C(=O)C=C1 Amb18030530 [0,2,0,0,0,0|2,0,0]=4 9828 B12R1.374 CC1=CN(CCCO)C(=O)C=C1 Amb18041286 [0,2,0,0,0,0|1,0,0]=3 9829 B12R1.374 CC1=CN(CCCO)C(=O)N=C1 Amb25140706 [0,2,0,0,0,0|2,0,0]=4 9830 B12R1.374 CC=1C=CC(=O)N(CCCC)C1 Amb18404884 [0,2,0,0,0,0|2,0,0]=4 9831 B12R1.374 CC=1C=CC(=O)N(CCCO)N1 Amb18788776 [0,2,0,0,0,0|2,0,0]=4 9832 B12R1.374 CCCCC1=CC(=O)C=CC1=O Amb24065452 [0,2,0,0,0,0|1,0,0]=3 9833 B12R1.374 CCCCN1C=C(Br)C=CC1=O Amb18404496 [0,2,0,0,0,0|2,0,0]=4 9834 B12R1.374 CCCCN1C=C(Cl)C=CC1=O Amb18405090 [0,2,0,0,0,0|2,0,0]=4 9835 B12R1.374 CCCCN1C=C(F)C=CC1=O Amb18405301 [0,2,0,0,0,0|2,0,0]=4 9836 B12R1.374 CCCCN1C=C(N)C=CC1=O Amb18030068 [0,2,0,0,0,0|2,0,0]=4 9837 B12R1.374 CCCCc1cc(Cl)ccc1N Amb25691483 [0,2,0,0,0,0|1,0,0]=3 9838 B12R1.374 CCCCc1cc(Cl)ccc1O Amb25273097 [0,2,0,0,0,0|1,0,0]=3 9839 B12R1.374 CCCCc1cc(N)ccc1Cl Amb25843846 [0,2,0,0,0,0|1,0,0]=3 9840 B12R1.374 CCCCc1cc(O)ccc1O Amb24330377 [0,2,0,0,0,0|1,0,0]=3 9841 B12R1.374 CCCNc1cc(Br)ccc1I Amb25670015 [0,2,0,0,0,0|2,0,0]=4 9842 B12R1.374 CCCNc1cc(Br)ccc1N Amb25738246 [0,2,0,0,0,0|2,0,0]=4 9843 B12R1.374 CCCNc1cc(Cl)ccc1Br Amb25675324 [0,2,0,0,0,0|2,0,0]=4 9844 B12R1.374 CCCNc1cc(F)ccc1N Amb18989853 [0,2,0,0,0,0|2,0,0]=4 9845 B12R1.374 CCCOc1cc(Br)ccc1Cl Amb25342832 [0,2,0,0,0,0|2,0,0]=4 9846 B12R1.374 CCCOc1cc(Br)ccc1F Amb24483694 [0,2,0,0,0,0|2,0,0]=4 9847 B12R1.374 CCCOc1cc(Br)ccc1N Amb24727840 [0,2,0,0,0,0|2,0,0]=4 9848 B12R1.374 CCCOc1cc(Cl)ccc1Br Amb25291702 [0,2,0,0,0,0|2,0,0]=4 9849 B12R1.374 CCCOc1cc(Cl)ccc1N Amb18296228 [0,2,0,0,0,0|2,0,0]=4 9850 B12R1.374 CCCOc1cc(Cl)ccc1O Amb25282670 [0,2,0,0,0,0|2,0,0]=4 9851 B12R1.374 CCCOc1cc(F)ccc1F Amb25681585 [0,2,0,0,0,0|2,0,0]=4 9852 B12R1.374 CCCOc1cc(F)ccc1N Amb1132322 [0,2,0,0,0,0|2,0,0]=4 9853 B12R1.374 CCCOc1cc(N)ccc1Cl Amb18649207 [0,2,0,0,0,0|2,0,0]=4 9854 B12R1.374 CCCOc1cc(N)ccc1O Amb25059149 [0,2,0,0,0,0|2,0,0]=4 9855 B12R1.374 CCCOc1cc(O)ccc1N Amb24461245 [0,2,0,0,0,0|2,0,0]=4 9856 B12R1.374 CCCOc1cc(S)ccc1F Amb25692041 [0,2,0,0,0,0|2,0,0]=4 9857 B12R1.374 CCCOc1cc(S)ccc1N Amb25714978 [0,2,0,0,0,0|2,0,0]=4 9858 B12R1.374 CCCSc1cc(Cl)ccc1N Amb25720780 [0,2,0,0,0,0|2,0,0]=4 9859 B12R1.374 CCCSc1cc(F)ccc1N Amb18297864 [0,2,0,0,0,0|2,0,0]=4 9860 B12R1.374 CCCSc1cc(N)ccc1Cl Amb25208915 [0,2,0,0,0,0|2,0,0]=4 9861 B12R1.374 CCCSc1cc(N)ccc1N Amb25124116 [0,2,0,0,0,0|2,0,0]=4 9862 B12R1.374 CCCSc1cc(O)ccc1Cl Amb24689472 [0,2,0,0,0,0|2,0,0]=4 9863 B12R1.374 CCNCc1cc(Br)ccc1F Amb13952066 [0,2,0,0,0,0|2,0,0]=4 9864 B12R1.374 CCNCc1cc(Br)ccc1O Amb17144307 [0,2,0,0,0,0|2,0,0]=4 9865 B12R1.374 CCNCc1cc(Cl)ccc1Br Amb25301151 [0,2,0,0,0,0|2,0,0]=4 9866 B12R1.374 CCNCc1cc(F)ccc1Cl Amb24696201 [0,2,0,0,0,0|2,0,0]=4 9867 B12R1.374 CCNCc1cc(F)ccc1O Amb18275908 [0,2,0,0,0,0|2,0,0]=4 9868 B12R1.374 CCNCc1cc(N)ccc1Br Amb24722171 [0,2,0,0,0,0|2,0,0]=4 9869 B12R1.374 CCNCc1cc(N)ccc1Cl Amb25217164 [0,2,0,0,0,0|2,0,0]=4 9870 B12R1.374 CCNCc1cc(N)ccc1O Amb17613931 [0,2,0,0,0,0|2,0,0]=4 9871 B12R1.374 CCNCc1cc(O)ccc1Br Amb21926786 [0,2,0,0,0,0|2,0,0]=4 9872 B12R1.374 CCOCC1=CC(=O)C=CC1=O Amb24403286 [0,2,0,0,0,0|2,0,0]=4 9873 B12R1.374 CCOCc1cc(Br)ccc1F Amb22900162 [0,2,0,0,0,0|2,0,0]=4 9874 B12R1.374 CCOCc1cc(F)ccc1Br Amb22900140 [0,2,0,0,0,0|2,0,0]=4 9875 B12R1.374 CCOCc1cc(O)ccc1O Amb25092906 [0,2,0,0,0,0|2,0,0]=4 9876 B12R1.374 CCSCc1cc(Br)ccc1Cl Amb24752022 [0,2,0,0,0,0|2,0,0]=4 9877 B12R1.374 CCSCc1cc(Br)ccc1F Amb24590830 [0,2,0,0,0,0|2,0,0]=4 9878 B12R1.374 CCSCc1cc(Cl)ccc1Br Amb25347057 [0,2,0,0,0,0|2,0,0]=4 9879 B12R1.374 CCSCc1cc(Cl)ccc1Cl Amb24752023 [0,2,0,0,0,0|2,0,0]=4 9880 B12R1.374 CCSCc1cc(Cl)ccc1F Amb25822958 [0,2,0,0,0,0|2,0,0]=4 9881 B12R1.374 CCSCc1cc(Cl)ccc1N Amb24415878 [0,2,0,0,0,0|2,0,0]=4 9882 B12R1.374 CNCCc1cc(Br)ccc1Cl Amb25159743 [0,2,0,0,0,0|2,0,0]=4 9883 B12R1.374 CNCCc1cc(Br)ccc1F Amb18299520 [0,2,0,0,0,0|2,0,0]=4 9884 B12R1.374 CNCCc1cc(C)ccc1C Amb17085230 [0,2,0,0,0,0|2,0,0]=4 9885 B12R1.374 CNCCc1cc(Cl)ccc1F Amb18243883 [0,2,0,0,0,0|2,0,0]=4 9886 B12R1.374 CNCCc1cc(Cl)ccc1O Amb18939315 [0,2,0,0,0,0|2,0,0]=4 9887 B12R1.374 CNCCc1cc(F)ccc1Br Amb18299508 [0,2,0,0,0,0|2,0,0]=4 9888 B12R1.374 CNCCc1cc(F)ccc1F Amb18993055 [0,2,0,0,0,0|2,0,0]=4 9889 B12R1.374 CNCCc1cc(F)ccc1O Amb18275939 [0,2,0,0,0,0|2,0,0]=4 9890 B12R1.374 CNCCc1cc(O)ccc1Br Amb25283021 [0,2,0,0,0,0|2,0,0]=4 9891 B12R1.374 CNCCc1cc(O)ccc1Cl Amb24684086 [0,2,0,0,0,0|2,0,0]=4 9892 B12R1.374 CSCCc1cc(Cl)ccc1Cl Amb25323402 [0,2,0,0,0,0|2,0,0]=4 9893 B12R1.374 Cc1[n][n]c(C)cc1CCCO Amb23560290 [0,2,0,0,0,0|2,0,0]=4 9894 B12R1.374 Cc1c[n]c(C)c(CCCN)c1 Amb25674297 [0,2,0,0,0,0|2,0,0]=4 9895 B12R1.374 Cc1c[n]c(Cl)cc1CCCN Amb24547121 [0,2,0,0,0,0|2,0,0]=4 9896 B12R1.374 Cc1c[n]c(Cl)cc1SCCO Amb25068179 [0,2,0,0,0,0|2,0,0]=4 9897 B12R1.374 Cc1cc(C#CCO)c(C)cc1 Amb18792227 [0,2,0,0,0,0|0,0,2]=4 9898 B12R1.374 Cc1cc(C#CCO)c(F)cc1 Amb18792543 [0,2,0,0,0,0|0,0,2]=4 9899 B12R1.374 Cc1cc(C#CCO)c(O)cc1 Amb24497073 [0,2,0,0,0,0|0,0,2]=4 9900 B12R1.374 Cc1cc(CCC#C)c(C)cc1 Amb18117997 [0,2,0,0,0,0|1,0,1]=4 9901 B12R1.374 Cc1cc(CCC#N)c(Cl)cc1 Amb25376438 [0,2,0,0,0,0|1,0,1]=4 9902 B12R1.374 Cc1cc(CCC#N)c(I)cc1 Amb24605294 [0,2,0,0,0,0|1,0,1]=4 9903 B12R1.374 Cc1cc(CCC#N)c(O)cc1 Amb25773347 [0,2,0,0,0,0|1,0,1]=4 9904 B12R1.374 Cc1cc(CCC=O)c(C)cc1 Amb18798123 [0,2,0,0,0,0|0,0,2]=4 9905 B12R1.374 Cc1cc(CCC=O)c(F)cc1 Amb25775656 [0,2,0,0,0,0|0,0,2]=4 9906 B12R1.374 Cc1cc(CCC=O)c(O)cc1 Amb24527959 [0,2,0,0,0,0|0,0,2]=4 9907 B12R1.374 Cc1cc(CCCBr)c(C)cc1 Amb24593678 [0,2,0,0,0,0|1,0,0]=3 9908 B12R1.374 Cc1cc(CCCBr)c(N)[n]c1 Amb25840156 [0,2,0,0,0,0|2,0,0]=4 9909 B12R1.374 Cc1cc(CCCBr)c(O)cc1 Amb24558916 [0,2,0,0,0,0|1,0,0]=3 9910 B12R1.374 Cc1cc(CCCCl)c(C)cc1 Amb18325129 [0,2,0,0,0,0|1,0,0]=3 9911 B12R1.374 Cc1cc(CCCCl)c(F)cc1 Amb25250611 [0,2,0,0,0,0|1,0,0]=3 9912 B12R1.374 Cc1cc(CCCCl)c(I)cc1 Amb25230131 [0,2,0,0,0,0|1,0,0]=3 9913 B12R1.374 Cc1cc(CCCN)c(Cl)cc1 Amb18909370 [0,2,0,0,0,0|1,0,0]=3 9914 B12R1.374 Cc1cc(CCCN)c(F)[n]c1 Amb25330759 [0,2,0,0,0,0|2,0,0]=4 9915 B12R1.374 Cc1cc(CCCN)c(O)cc1 Amb18552860 [0,2,0,0,0,0|1,0,0]=3 9916 B12R1.374 Cc1cc(CCCO)c(Cl)cc1 Amb25074743 [0,2,0,0,0,0|0,0,0]=2 9917 B12R1.374 Cc1cc(CCCO)c(F)cc1 Amb25148634 [0,2,0,0,0,0|0,0,0]=2 9918 B12R1.374 Cc1cc(CCCO)c(N)[n]c1 Amb24679609 [0,2,0,0,0,0|1,0,0]=3 9919 B12R1.374 Cc1cc(NCCF)c(Br)cc1 Amb24736608 [0,2,0,0,0,0|2,0,0]=4 9920 B12R1.374 Cc1cc(NCCF)c(C)cc1 Amb24667607 [0,2,0,0,0,0|2,0,0]=4 9921 B12R1.374 Cc1cc(NCCN)c(Br)cc1 Amb25281394 [0,2,0,0,0,0|2,0,0]=4 9922 B12R1.374 Cc1cc(NCCN)c(F)cc1 Amb18299160 [0,2,0,0,0,0|2,0,0]=4 9923 B12R1.374 Cc1cc(NCCO)c(Cl)cc1 Amb24420961 [0,2,0,0,0,0|1,0,0]=3 9924 B12R1.374 Cc1cc(OCCF)c(C)cc1 Amb25238490 [0,2,0,0,0,0|2,0,0]=4 9925 B12R1.374 Cc1cc(OCCF)c(Cl)cc1 Amb25316429 [0,2,0,0,0,0|2,0,0]=4 9926 B12R1.374 Cc1cc(OCCF)c(I)cc1 Amb25807182 [0,2,0,0,0,0|2,0,0]=4 9927 B12R1.374 Cc1cc(OCCN)c(Cl)cc1 Amb21959599 [0,2,0,0,0,0|2,0,0]=4 9928 B12R1.374 Cc1cc(OCCO)c(F)cc1 Amb25225003 [0,2,0,0,0,0|1,0,0]=3 9929 B12R1.374 Cc1cc(OCCO)c(I)cc1 Amb25297123 [0,2,0,0,0,0|1,0,0]=3 9930 B12R1.374 Cc1cc(OCCS)c(F)cc1 Amb25058337 [0,2,0,0,0,0|1,1,0]=4 9931 B12R1.374 Cc1cc(OCCS)c(cc1)Cl Amb17237592 [0,2,0,0,0,0|1,1,0]=4 9932 B12R1.374 Cc1ccc(Br)c(c1)NCCC Amb25797222 [0,2,0,0,0,0|2,0,0]=4 9933 B12R1.374 Cc1ccc(Br)cc1CCC#N Amb25701944 [0,2,0,0,0,0|1,0,1]=4 9934 B12R1.374 Cc1ccc(Br)cc1CCCS Amb25036393 [0,2,0,0,0,0|0,1,0]=3 9935 B12R1.374 Cc1ccc(Br)cc1CCNN Amb24740195 [0,2,0,0,0,0|2,0,0]=4 9936 B12R1.374 Cc1ccc(Br)cc1CNCC Amb25743327 [0,2,0,0,0,0|2,0,0]=4 9937 B12R1.374 Cc1ccc(Br)cc1CSCC Amb24339605 [0,2,0,0,0,0|2,0,0]=4 9938 B12R1.374 Cc1ccc(Br)cc1OCCBr Amb24116416 [0,2,0,0,0,0|2,0,0]=4 9939 B12R1.374 Cc1ccc(Br)cc1OCCC Amb24116403 [0,2,0,0,0,0|2,0,0]=4 9940 B12R1.374 Cc1ccc(Br)cc1OCCCl Amb25330077 [0,2,0,0,0,0|2,0,0]=4 9941 B12R1.374 Cc1ccc(Br)cc1OCCN Amb24116411 [0,2,0,0,0,0|2,0,0]=4 9942 B12R1.374 Cc1ccc(Br)cc1OCCO Amb24116409 [0,2,0,0,0,0|1,0,0]=3 9943 B12R1.374 Cc1ccc(Br)cc1OCCS Amb24472577 [0,2,0,0,0,0|1,1,0]=4 9944 B12R1.374 Cc1ccc(C)[n]c1CCCN Amb24493220 [0,2,0,0,0,0|2,0,0]=4 9945 B12R1.374 Cc1ccc(Cl)c(CCCCl)c1 Amb25242993 [0,2,0,0,0,0|1,0,0]=3 9946 B12R1.374 Cc1ccc(Cl)c(NCCO)[n]1 Amb25853279 [0,2,0,0,0,0|2,0,0]=4 9947 B12R1.374 Cc1ccc(Cl)cc1CCC=O Amb18564227 [0,2,0,0,0,0|0,0,2]=4 9948 B12R1.374 Cc1ccc(Cl)cc1CCCBr Amb24615762 [0,2,0,0,0,0|1,0,0]=3 9949 B12R1.374 Cc1ccc(Cl)cc1CCCO Amb25829954 [0,2,0,0,0,0|0,0,0]=2 9950 B12R1.374 Cc1ccc(Cl)cc1NCCF Amb25702797 [0,2,0,0,0,0|2,0,0]=4 9951 B12R1.374 Cc1ccc(Cl)cc1OCCN Amb18649214 [0,2,0,0,0,0|2,0,0]=4 9952 B12R1.374 Cc1ccc(Cl)cc1\C=C\CO Amb25721181 [0,2,0,0,0,0|0,0,2]=4 9953 B12R1.374 Cc1ccc(F)c(CCNC)c1 Amb18301316 [0,2,0,0,0,0|2,0,0]=4 9954 B12R1.374 Cc1ccc(F)c(CNCC)c1 Amb18991721 [0,2,0,0,0,0|2,0,0]=4 9955 B12R1.374 Cc1ccc(F)c(c1)NCCF Amb24739348 [0,2,0,0,0,0|2,0,0]=4 9956 B12R1.374 Cc1ccc(F)c(c1)OCCC Amb21856655 [0,2,0,0,0,0|2,0,0]=4 9957 B12R1.374 Cc1ccc(F)cc1C#CCO Amb18792545 [0,2,0,0,0,0|0,0,2]=4 9958 B12R1.374 Cc1ccc(F)cc1CCC#N Amb25738354 [0,2,0,0,0,0|1,0,1]=4 9959 B12R1.374 Cc1ccc(F)cc1CCC=C Amb25259828 [0,2,0,0,0,0|1,0,1]=4 9960 B12R1.374 Cc1ccc(F)cc1CCNC Amb18301289 [0,2,0,0,0,0|2,0,0]=4 9961 B12R1.374 Cc1ccc(F)cc1CNCC Amb19002202 [0,2,0,0,0,0|2,0,0]=4 9962 B12R1.374 Cc1ccc(F)cc1NCCN Amb18992218 [0,2,0,0,0,0|2,0,0]=4 9963 B12R1.374 Cc1ccc(F)cc1OCCBr Amb25109433 [0,2,0,0,0,0|2,0,0]=4 9964 B12R1.374 Cc1ccc(F)cc1OCCC Amb25215912 [0,2,0,0,0,0|2,0,0]=4 9965 B12R1.374 Cc1ccc(F)cc1OCCCl Amb24590550 [0,2,0,0,0,0|2,0,0]=4 9966 B12R1.374 Cc1ccc(F)cc1OCCF Amb24394687 [0,2,0,0,0,0|2,0,0]=4 9967 B12R1.374 Cc1ccc(F)cc1OCCN Amb24682325 [0,2,0,0,0,0|2,0,0]=4 9968 B12R1.374 Cc1ccc(F)cc1\C=C\CO Amb25364684 [0,2,0,0,0,0|0,0,2]=4 9969 B12R1.374 Cc1ccc(I)cc1NCCF Amb24739352 [0,2,0,0,0,0|2,0,0]=4 9970 B12R1.374 Cc1ccc(I)cc1NCCN Amb25359504 [0,2,0,0,0,0|2,0,0]=4 9971 B12R1.374 Cc1ccc(I)cc1NCCO Amb24390698 [0,2,0,0,0,0|1,0,0]=3 9972 B12R1.374 Cc1ccc(N)c(CCCC)c1 Amb24365184 [0,2,0,0,0,0|1,0,0]=3 9973 B12R1.374 Cc1ccc(N)c(CNCC)c1 Amb24634806 [0,2,0,0,0,0|2,0,0]=4 9974 B12R1.374 Cc1ccc(N)c([n]1)SCCO Amb24759879 [0,2,0,0,0,0|2,0,0]=4 9975 B12R1.374 Cc1ccc(N)c(c1)NCCC Amb23114177 [0,2,0,0,0,0|2,0,0]=4 9976 B12R1.374 Cc1ccc(N)c(c1)OCCC Amb21954488 [0,2,0,0,0,0|2,0,0]=4 9977 B12R1.374 Cc1ccc(N)c(c1)SCCC Amb24427487 [0,2,0,0,0,0|2,0,0]=4 9978 B12R1.374 Cc1ccc(N)cc1CCCCl Amb25376376 [0,2,0,0,0,0|1,0,0]=3 9979 B12R1.374 Cc1ccc(N)cc1NCCC Amb18299607 [0,2,0,0,0,0|2,0,0]=4 9980 B12R1.374 Cc1ccc(N)cc1NCCN Amb18299627 [0,2,0,0,0,0|2,0,0]=4 9981 B12R1.374 Cc1ccc(N)cc1NCCO Amb18993356 [0,2,0,0,0,0|1,0,0]=3 9982 B12R1.374 Cc1ccc(N)cc1OCCF Amb25063471 [0,2,0,0,0,0|2,0,0]=4 9983 B12R1.374 Cc1ccc(N)cc1SCCC Amb18805443 [0,2,0,0,0,0|2,0,0]=4 9984 B12R1.374 Cc1ccc(N)cc1SCCN Amb25834786 [0,2,0,0,0,0|2,0,0]=4 9985 B12R1.374 Cc1ccc(N)cc1SCCO Amb18993401 [0,2,0,0,0,0|1,0,0]=3 9986 B12R1.374 Cc1ccc(O)c(CCCO)c1 Amb18646539 [0,2,0,0,0,0|0,0,0]=2 9987 B12R1.374 Cc1ccc(O)c(CCNC)c1 Amb18940457 [0,2,0,0,0,0|2,0,0]=4 9988 B12R1.374 Cc1ccc(O)c([n]1)SCCO Amb18649166 [0,2,0,0,0,0|2,0,0]=4 9989 B12R1.374 Cc1ccc(O)c(\C=C\CO)c1 Amb18646066 [0,2,0,0,0,0|0,0,2]=4 9990 B12R1.374 Cc1ccc(O)cc1CCC#C Amb25706933 [0,2,0,0,0,0|1,0,1]=4 9991 B12R1.374 Cc1ccc(O)cc1CCC=O Amb24093052 [0,2,0,0,0,0|0,0,2]=4 9992 B12R1.374 Cc1ccc(O)cc1CCCC Amb24527628 [0,2,0,0,0,0|1,0,0]=3 9993 B12R1.374 Cc1ccc(O)cc1CCCN Amb25777725 [0,2,0,0,0,0|1,0,0]=3 9994 B12R1.374 Cc1ccc(O)cc1NCCC Amb24405966 [0,2,0,0,0,0|2,0,0]=4 9995 B12R1.374 Cc1ccc(O)cc1OCCN Amb24754289 [0,2,0,0,0,0|2,0,0]=4 9996 B12R1.374 Cc1ccc(S)cc1CCCCl Amb24610834 [0,2,0,0,0,0|1,0,0]=3 9997 B12R1.374 Cc1ccc(c(n1)NCCO)N Amb17209129 [0,2,0,0,0,0|2,0,0]=4 9998 B12R1.374 Cc1ccc(cc1CCC#N)C Amb17204301 [0,2,0,0,0,0|1,0,1]=4 9999 B12R1.374 Cc1ccc(cc1CCC#N)Cl Amb17204323 [0,2,0,0,0,0|1,0,1]=4 10000 B12R1.374 Cc1ccc(cc1CCCN)C Amb17204307 [0,2,0,0,0,0|1,0,0]=3 10001 B12R1.374 Cc1ccc(cc1CCCN)Cl Amb17204336 [0,2,0,0,0,0|1,0,0]=3 10002 B12R1.374 Cc1ccc(cc1CCCO)C Amb17400156 [0,2,0,0,0,0|0,0,0]=2 10003 B12R1.374 Cc1ccc(cc1CCNN)C Amb17400164 [0,2,0,0,0,0|2,0,0]=4 10004 B12R1.374 Cc1ccc(cc1NCCCl)C Amb17335662 [0,2,0,0,0,0|2,0,0]=4 10005 B12R1.374 Cc1ccc(cc1NCCN)C Amb17091051 [0,2,0,0,0,0|2,0,0]=4 10006 B12R1.374 Cc1ccc(cc1NCCN)Cl Amb17091058 [0,2,0,0,0,0|2,0,0]=4 10007 B12R1.374 Cc1ccc(cc1OCCBr)C Amb1105545 [0,2,0,0,0,0|2,0,0]=4 10008 B12R1.374 Cc1ccc(cc1OCCN)C Amb1101722 [0,2,0,0,0,0|2,0,0]=4 10009 B12R1.374 ClCCNc1cc(Cl)ccc1C Amb17338052 [0,2,0,0,0,0|2,0,0]=4 10010 B12R1.374 ClCCNc1cc(Cl)ccc1Cl Amb17343164 [0,2,0,0,0,0|2,0,0]=4 10011 B12R1.374 Clc1cc(SCCI)c(Cl)cc1 Amb24418749 [0,2,0,0,0,0|2,0,0]=4 10012 B12R1.374 Clc1ccc(Br)c(CCCCl)c1 Amb25714131 [0,2,0,0,0,0|1,0,0]=3 10013 B12R1.374 Clc1ccc(Br)cc1OCCCl Amb25034588 [0,2,0,0,0,0|2,0,0]=4 10014 B12R1.374 Clc1ccc(cc1CCC#N)Cl Amb17204386 [0,2,0,0,0,0|1,0,1]=4 10015 B12R1.374 Clc1ccc(cc1CCC=O)Cl Amb10606178 [0,2,0,0,0,0|0,0,2]=4 10016 B12R1.374 Clc1ccc(cc1OCCBr)Cl Amb1106064 [0,2,0,0,0,0|2,0,0]=4 10017 B12R1.374 FCCNc1cc(Br)ccc1Br Amb25690163 [0,2,0,0,0,0|2,0,0]=4 10018 B12R1.374 FCCNc1cc(Cl)ccc1Cl Amb25776303 [0,2,0,0,0,0|2,0,0]=4 10019 B12R1.374 FCCNc1cc(F)ccc1F Amb25067555 [0,2,0,0,0,0|2,0,0]=4 10020 B12R1.374 FCCOc1cc(Br)ccc1Cl Amb24434277 [0,2,0,0,0,0|2,0,0]=4 10021 B12R1.374 FCCSc1cc(F)ccc1F Amb25048210 [0,2,0,0,0,0|2,0,0]=4 10022 B12R1.374 Fc1cc(CCCBr)c(F)cc1 Amb24439123 [0,2,0,0,0,0|1,0,0]=3 10023 B12R1.374 Fc1cc(CCCCl)c(Br)cc1 Amb24341770 [0,2,0,0,0,0|1,0,0]=3 10024 B12R1.374 Fc1cc(CCCCl)c(F)cc1 Amb19073201 [0,2,0,0,0,0|1,0,0]=3 10025 B12R1.374 Fc1cc(OCCBr)c(F)cc1 Amb24483410 [0,2,0,0,0,0|2,0,0]=4 10026 B12R1.374 Fc1cc(OCCCl)c(Br)cc1 Amb25687989 [0,2,0,0,0,0|2,0,0]=4 10027 B12R1.374 Fc1cc(OCCCl)c(F)cc1 Amb25374341 [0,2,0,0,0,0|2,0,0]=4 10028 B12R1.374 Fc1ccc(Br)cc1CCCBr Amb25204237 [0,2,0,0,0,0|1,0,0]=3 10029 B12R1.374 Fc1ccc(Br)cc1CCCS Amb25778866 [0,2,0,0,0,0|0,1,0]=3 10030 B12R1.374 Fc1ccc(Br)cc1NCCF Amb24488700 [0,2,0,0,0,0|2,0,0]=4 10031 B12R1.374 Fc1ccc(Cl)c(CCCCl)c1 Amb25796501 [0,2,0,0,0,0|1,0,0]=3 10032 B12R1.374 Fc1ccc(Cl)c(c1)NCCF Amb25817155 [0,2,0,0,0,0|2,0,0]=4 10033 B12R1.374 Fc1ccc(Cl)cc1CCCBr Amb24441885 [0,2,0,0,0,0|1,0,0]=3 10034 B12R1.374 Fc1ccc(Cl)cc1SCCF Amb24497846 [0,2,0,0,0,0|2,0,0]=4 10035 B12R1.374 Fc1ccc(I)cc1CCCBr Amb24571927 [0,2,0,0,0,0|1,0,0]=3 10036 B12R1.374 N#CCCc1cc(Br)ccc1Br Amb25248926 [0,2,0,0,0,0|1,0,1]=4 10037 B12R1.374 N#CCCc1cc(Br)ccc1F Amb25286118 [0,2,0,0,0,0|1,0,1]=4 10038 B12R1.374 N#CCCc1cc(Cl)ccc1F Amb18863064 [0,2,0,0,0,0|1,0,1]=4 10039 B12R1.374 N#CCCc1cc(Cl)ccc1O Amb24679559 [0,2,0,0,0,0|1,0,1]=4 10040 B12R1.374 N#CCCc1cc(F)ccc1F Amb18798745 [0,2,0,0,0,0|1,0,1]=4 10041 B12R1.374 N#CCCc1cc(O)ccc1Br Amb24586510 [0,2,0,0,0,0|1,0,1]=4 10042 B12R1.374 N#CCCc1cc(O)ccc1F Amb24541069 [0,2,0,0,0,0|1,0,1]=4 10043 B12R1.374 N#CCCc1cc(O)ccc1I Amb24527853 [0,2,0,0,0,0|1,0,1]=4 10044 B12R1.374 N#CCCc1cc(S)ccc1Cl Amb25191131 [0,2,0,0,0,0|1,0,1]=4 10045 B12R1.374 N#CCCc1cc(S)ccc1O Amb24695669 [0,2,0,0,0,0|1,0,1]=4 10046 B12R1.374 NC1=CN(CCCF)C(=O)C=C1 Amb25342827 [0,2,0,0,0,0|2,0,0]=4 10047 B12R1.374 NC1=CN(CCCO)C(=O)C=C1 Amb18535272 [0,2,0,0,0,0|1,0,0]=3 10048 B12R1.374 NCCCN1C=C(Br)C=CC1=O Amb18535492 [0,2,0,0,0,0|2,0,0]=4 10049 B12R1.374 NCCCN1C=C(Br)C=CC1=O Amb19514408 [0,2,0,0,0,0|2,0,0]=4 10050 B12R1.374 NCCCN1C=C(Cl)C=CC1=O Amb17992862 [0,2,0,0,0,0|2,0,0]=4 10051 B12R1.374 NCCCN1C=C(Cl)C=CC1=O Amb18368806 [0,2,0,0,0,0|2,0,0]=4 10052 B12R1.374 NCCCN1C=C(F)C=CC1=O Amb18040598 [0,2,0,0,0,0|2,0,0]=4 10053 B12R1.374 NCCCc1[n]c(Cl)ccc1F Amb24642849 [0,2,0,0,0,0|2,0,0]=4 10054 B12R1.374 NCCCc1cc(Br)ccc1Br Amb25309336 [0,2,0,0,0,0|1,0,0]=3 10055 B12R1.374 NCCCc1cc(Br)ccc1Cl Amb25036212 [0,2,0,0,0,0|1,0,0]=3 10056 B12R1.374 NCCCc1cc(Cl)ccc1Br Amb25150112 [0,2,0,0,0,0|1,0,0]=3 10057 B12R1.374 NCCCc1cc(Cl)ccc1Cl Amb17204405 [0,2,0,0,0,0|1,0,0]=3 10058 B12R1.374 NCCCc1cc(Cl)ccc1F Amb18863289 [0,2,0,0,0,0|1,0,0]=3 10059 B12R1.374 NCCCc1cc(Cl)ccc1O Amb18909512 [0,2,0,0,0,0|1,0,0]=3 10060 B12R1.374 NCCCc1cc(F)ccc1Cl Amb18821281 [0,2,0,0,0,0|1,0,0]=3 10061 B12R1.374 NCCCc1cc(F)ccc1F Amb18980797 [0,2,0,0,0,0|1,0,0]=3 10062 B12R1.374 NCCCc1cc(F)ccc1O Amb18556316 [0,2,0,0,0,0|1,0,0]=3 10063 B12R1.374 NCCCc1cc(I)ccc1F Amb24627911 [0,2,0,0,0,0|1,0,0]=3 10064 B12R1.374 NCCCc1cc(I)ccc1O Amb25063089 [0,2,0,0,0,0|1,0,0]=3 10065 B12R1.374 NCCCc1cc(O)ccc1Br Amb24537692 [0,2,0,0,0,0|1,0,0]=3 10066 B12R1.374 NCCCc1cc(O)ccc1Cl Amb25682654 [0,2,0,0,0,0|1,0,0]=3 10067 B12R1.374 NCCNc1cc(Br)ccc1Br Amb25302841 [0,2,0,0,0,0|2,0,0]=4 10068 B12R1.374 NCCNc1cc(Br)ccc1F Amb24732633 [0,2,0,0,0,0|2,0,0]=4 10069 B12R1.374 NCCNc1cc(Br)ccc1I Amb25086988 [0,2,0,0,0,0|2,0,0]=4 10070 B12R1.374 NCCNc1cc(Cl)ccc1Br Amb25268806 [0,2,0,0,0,0|2,0,0]=4 10071 B12R1.374 NCCNc1cc(Cl)ccc1Cl Amb17091082 [0,2,0,0,0,0|2,0,0]=4 10072 B12R1.374 NCCNc1cc(Cl)ccc1F Amb18243910 [0,2,0,0,0,0|2,0,0]=4 10073 B12R1.374 NCCNc1cc(F)ccc1Cl Amb24380239 [0,2,0,0,0,0|2,0,0]=4 10074 B12R1.374 NCCNc1cc(F)ccc1F Amb18997936 [0,2,0,0,0,0|2,0,0]=4 10075 B12R1.374 NCCOc1cc(Cl)ccc1Cl Amb21927638 [0,2,0,0,0,0|2,0,0]=4 10076 B12R1.374 NCCOc1cc(Cl)ccc1Cl Amb2446347 [0,2,0,0,0,0|2,0,0]=4 10077 B12R1.374 NCCOc1cc(Cl)ccc1F Amb18243938 [0,2,0,0,0,0|2,0,0]=4 10078 B12R1.374 NCCOc1cc(F)ccc1Br Amb25106321 [0,2,0,0,0,0|2,0,0]=4 10079 B12R1.374 NCCOc1cc(F)ccc1F Amb18243555 [0,2,0,0,0,0|2,0,0]=4 10080 B12R1.374 NCCOc1cc(O)ccc1Cl Amb25111598 [0,2,0,0,0,0|2,0,0]=4 10081 B12R1.374 NNCCc1cc(Cl)ccc1F Amb24392022 [0,2,0,0,0,0|2,0,0]=4 10082 B12R1.374 NOCCc1cc(Br)ccc1F Amb25159910 [0,2,0,0,0,0|2,0,0]=4 10083 B12R1.374 Nc1[n]cc(Cl)cc1CCCN Amb25252492 [0,2,0,0,0,0|2,0,0]=4 10084 B12R1.374 Nc1[n]cc(Cl)cc1CCCO Amb25370190 [0,2,0,0,0,0|1,0,0]=3 10085 B12R1.374 Nc1[n]cc(Cl)cc1OCCO Amb24470139 [0,2,0,0,0,0|2,0,0]=4 10086 B12R1.374 Nc1[n]cc(I)cc1CCCN Amb24483673 [0,2,0,0,0,0|2,0,0]=4 10087 B12R1.374 Nc1cc(CCC#N)c(Cl)cc1 Amb18648452 [0,2,0,0,0,0|1,0,1]=4 10088 B12R1.374 Nc1cc(CCC#N)c(I)cc1 Amb25239028 [0,2,0,0,0,0|1,0,1]=4 10089 B12R1.374 Nc1cc(CCC#N)c(S)cc1 Amb25253207 [0,2,0,0,0,0|1,0,1]=4 10090 B12R1.374 Nc1cc(CCC=O)c(Cl)cc1 Amb25352154 [0,2,0,0,0,0|0,0,2]=4 10091 B12R1.374 Nc1cc(CCC=O)c(I)cc1 Amb24695620 [0,2,0,0,0,0|0,0,2]=4 10092 B12R1.374 Nc1cc(CCCBr)c(N)cc1 Amb24665868 [0,2,0,0,0,0|1,0,0]=3 10093 B12R1.374 Nc1cc(CCCCl)c(N)cc1 Amb25239005 [0,2,0,0,0,0|1,0,0]=3 10094 B12R1.374 Nc1cc(OCCF)c(Cl)cc1 Amb25844731 [0,2,0,0,0,0|2,0,0]=4 10095 B12R1.374 Nc1cc(OCCO)c(Br)c[n]1 Amb25310212 [0,2,0,0,0,0|2,0,0]=4 10096 B12R1.374 Nc1cc(OCCO)c(Br)cc1 Amb25726570 [0,2,0,0,0,0|1,0,0]=3 10097 B12R1.374 Nc1cc(OCCO)c(Cl)cc1 Amb25779670 [0,2,0,0,0,0|1,0,0]=3 10098 B12R1.374 Nc1cc(OCCO)c(N)cc1 Amb24070056 [0,2,0,0,0,0|1,0,0]=3 10099 B12R1.374 Nc1cc(SCCF)c(Cl)cc1 Amb25857315 [0,2,0,0,0,0|2,0,0]=4 10100 B12R1.374 Nc1cc(SCCO)c(Br)c[n]1 Amb25182616 [0,2,0,0,0,0|2,0,0]=4 10101 B12R1.374 Nc1cc(\C=C\CO)c(N)cc1 Amb25366505 [0,2,0,0,0,0|0,0,2]=4 10102 B12R1.374 Nc1ccc(Br)c(CCCBr)c1 Amb24541058 [0,2,0,0,0,0|1,0,0]=3 10103 B12R1.374 Nc1ccc(Br)cc1CCC=O Amb24596596 [0,2,0,0,0,0|0,0,2]=4 10104 B12R1.374 Nc1ccc(Cl)c(c1)OCCN Amb24574085 [0,2,0,0,0,0|2,0,0]=4 10105 B12R1.374 Nc1ccc(Cl)cc1CCC#N Amb24579227 [0,2,0,0,0,0|1,0,1]=4 10106 B12R1.374 Nc1ccc(Cl)cc1CCC=O Amb24756893 [0,2,0,0,0,0|0,0,2]=4 10107 B12R1.374 Nc1ccc(Cl)cc1CCCCl Amb25779328 [0,2,0,0,0,0|1,0,0]=3 10108 B12R1.374 Nc1ccc(Cl)cc1CCCN Amb25177280 [0,2,0,0,0,0|1,0,0]=3 10109 B12R1.374 Nc1ccc(Cl)cc1COCS Amb24409628 [0,2,0,0,0,0|1,1,0]=4 10110 B12R1.374 Nc1ccc(Cl)cc1NCCF Amb25137457 [0,2,0,0,0,0|2,0,0]=4 10111 B12R1.374 Nc1ccc(Cl)cc1NCCN Amb25843427 [0,2,0,0,0,0|2,0,0]=4 10112 B12R1.374 Nc1ccc(Cl)cc1NCCO Amb18649473 [0,2,0,0,0,0|1,0,0]=3 10113 B12R1.374 Nc1ccc(Cl)cc1OCCF Amb24579905 [0,2,0,0,0,0|2,0,0]=4 10114 B12R1.374 Nc1ccc(Cl)cc1OCCO Amb18990920 [0,2,0,0,0,0|1,0,0]=3 10115 B12R1.374 Nc1ccc(Cl)cc1SCCN Amb24641295 [0,2,0,0,0,0|2,0,0]=4 10116 B12R1.374 Nc1ccc(Cl)cc1SCCO Amb24358543 [0,2,0,0,0,0|1,0,0]=3 10117 B12R1.374 Nc1ccc(F)cc1NCCN Amb18991517 [0,2,0,0,0,0|2,0,0]=4 10118 B12R1.374 Nc1ccc(F)cc1NCCO Amb18989891 [0,2,0,0,0,0|1,0,0]=3 10119 B12R1.374 Nc1ccc(F)cc1SCCN Amb25732834 [0,2,0,0,0,0|2,0,0]=4 10120 B12R1.374 Nc1ccc(F)cc1SCCO Amb18989905 [0,2,0,0,0,0|1,0,0]=3 10121 B12R1.374 Nc1ccc(I)cc1CCC#N Amb25248951 [0,2,0,0,0,0|1,0,1]=4 10122 B12R1.374 Nc1ccc(O)c(CCCN)c1 Amb25212967 [0,2,0,0,0,0|1,0,0]=3 10123 B12R1.374 Nc1ccc(O)c(c1)OCCO Amb24760908 [0,2,0,0,0,0|1,0,0]=3 10124 B12R1.374 Nc1ccc(O)cc1CCCN Amb24094576 [0,2,0,0,0,0|1,0,0]=3 10125 B12R1.374 Nc1ncc(cc1CCCO)F Amb13889726 [0,2,0,0,0,0|1,0,0]=3 10126 B12R1.374 Nc1ncc(cc1CCCO)I Amb13890001 [0,2,0,0,0,0|1,0,0]=3 10127 B12R1.374 O=C1C=CC(Br)=CN1CCCS Amb24487517 [0,2,0,0,0,0|1,1,0]=4 10128 B12R1.374 O=CCCc1cc(Br)ccc1Cl Amb24093048 [0,2,0,0,0,0|0,0,2]=4 10129 B12R1.374 O=CCCc1cc(Cl)ccc1Br Amb25669683 [0,2,0,0,0,0|0,0,2]=4 10130 B12R1.374 O=CCCc1cc(Cl)ccc1F Amb25336451 [0,2,0,0,0,0|0,0,2]=4 10131 B12R1.374 O=CCCc1cc(F)ccc1Br Amb20669022 [0,2,0,0,0,0|0,0,2]=4 10132 B12R1.374 O=CCCc1cc(F)ccc1F Amb18801724 [0,2,0,0,0,0|0,0,2]=4 10133 B12R1.374 O=CCCc1cc(F)ccc1I Amb25302517 [0,2,0,0,0,0|0,0,2]=4 10134 B12R1.374 OC=1C=C(CCCO)C(=O)NN1 Amb25697486 [0,2,0,0,0,0|2,0,0]=4 10135 B12R1.374 OCC#Cc1cc(Br)ccc1F Amb25846440 [0,2,0,0,0,0|0,0,2]=4 10136 B12R1.374 OCC#Cc1cc(Cl)ccc1F Amb24386907 [0,2,0,0,0,0|0,0,2]=4 10137 B12R1.374 OCC=Cc1cc(F)ccc1F Amb24082691 [0,2,0,0,0,0|0,0,2]=4 10138 B12R1.374 OCCCN1C=C(Br)C=CC1=O Amb18041268 [0,2,0,0,0,0|1,0,0]=3 10139 B12R1.374 OCCCN1C=C(Cl)C=CC1=O Amb18041266 [0,2,0,0,0,0|1,0,0]=3 10140 B12R1.374 OCCCN1C=C(F)C=CC1=O Amb18040863 [0,2,0,0,0,0|1,0,0]=3 10141 B12R1.374 OCCCN1NC(=O)C=CC1=O Amb18789172 [0,2,0,0,0,0|2,0,0]=4 10142 B12R1.374 OCCCc1cc(Br)ccc1F Amb25669437 [0,2,0,0,0,0|0,0,0]=2 10143 B12R1.374 OCCCc1cc(Cl)ccc1F Amb18863273 [0,2,0,0,0,0|0,0,0]=2 10144 B12R1.374 OCCCc1cc(F)ccc1Cl Amb25271650 [0,2,0,0,0,0|0,0,0]=2 10145 B12R1.374 OCCCc1cc(F)ccc1F Amb17605791 [0,2,0,0,0,0|0,0,0]=2 10146 B12R1.374 OCCCc1cc(F)cnc1Cl Amb13889729 [0,2,0,0,0,0|1,0,0]=3 10147 B12R1.374 OCCNc1cc(Br)c[n]c1Br Amb25246406 [0,2,0,0,0,0|2,0,0]=4 10148 B12R1.374 OCCNc1cc(Br)ccc1Br Amb25149787 [0,2,0,0,0,0|1,0,0]=3 10149 B12R1.374 OCCNc1cc(Br)ccc1I Amb24386418 [0,2,0,0,0,0|1,0,0]=3 10150 B12R1.374 OCCNc1cc(Cl)ccc1Br Amb25284978 [0,2,0,0,0,0|1,0,0]=3 10151 B12R1.374 OCCNc1cc(F)ccc1Cl Amb24559136 [0,2,0,0,0,0|1,0,0]=3 10152 B12R1.374 OCCNc1cc(I)ccc1Br Amb25765613 [0,2,0,0,0,0|1,0,0]=3 10153 B12R1.374 OCCOc1cc(Br)ccc1Br Amb23412184 [0,2,0,0,0,0|1,0,0]=3 10154 B12R1.374 OCCOc1cc(Br)ccc1F Amb24271232 [0,2,0,0,0,0|1,0,0]=3 10155 B12R1.374 OCCOc1cc(Cl)c[n]c1Br Amb25042604 [0,2,0,0,0,0|2,0,0]=4 10156 B12R1.374 OCCOc1cc(F)ccc1Cl Amb25118879 [0,2,0,0,0,0|1,0,0]=3 10157 B12R1.374 OCCOc1cc(F)ccc1F Amb25039649 [0,2,0,0,0,0|1,0,0]=3 10158 B12R1.374 OCCSC1=CC(=O)C=CC1=O Amb24525023 [0,2,0,0,0,0|1,0,0]=3 10159 B12R1.374 OCCSc1cc(Cl)ccc1Cl Amb1110887 [0,2,0,0,0,0|1,0,0]=3 10160 B12R1.374 OCCSc1cc(O)ccc1O Amb25729106 [0,2,0,0,0,0|1,0,0]=3 10161 B12R1.374 OC\C=C\c1cc(Br)ccc1Cl Amb24461355 [0,2,0,0,0,0|0,0,2]=4 10162 B12R1.374 OC\C=C\c1cc(Br)ccc1F Amb25742275 [0,2,0,0,0,0|0,0,2]=4 10163 B12R1.374 OC\C=C\c1cc(Cl)ccc1Cl Amb23442825 [0,2,0,0,0,0|0,0,2]=4 10164 B12R1.374 OC\C=C\c1cc(F)ccc1F Amb24404057 [0,2,0,0,0,0|0,0,2]=4 10165 B12R1.374 Oc1cc(CCC=O)c(Br)cc1 Amb25311997 [0,2,0,0,0,0|0,0,2]=4 10166 B12R1.374 Oc1cc(CCC=O)c(S)cc1 Amb25253244 [0,2,0,0,0,0|0,0,2]=4 10167 B12R1.374 Oc1cc(CCCBr)c(Cl)cc1 Amb24569466 [0,2,0,0,0,0|1,0,0]=3 10168 B12R1.374 Oc1ccc(Cl)c(CCCCl)c1 Amb25208780 [0,2,0,0,0,0|1,0,0]=3 10169 B12R1.374 Oc1ccc(Cl)cc1CCCO Amb25762478 [0,2,0,0,0,0|0,0,0]=2 10170 B12R1.374 Oc1ccc(Cl)cc1\C=C\CO Amb18649021 [0,2,0,0,0,0|0,0,2]=4 10171 B12R1.374 Oc1ccc(F)c(CCCO)c1 Amb24588858 [0,2,0,0,0,0|0,0,0]=2 10172 B12R1.374 Oc1ccc(F)cc1CCC=O Amb24432683 [0,2,0,0,0,0|0,0,2]=4 10173 B12R1.374 Oc1ccc(F)cc1CCCO Amb24377655 [0,2,0,0,0,0|0,0,0]=2 10174 B12R1.374 Oc1ccc(I)cc1CCCCl Amb25209323 [0,2,0,0,0,0|1,0,0]=3 10175 B12R1.374 Oc1ncc(cc1CCCO)F Amb13889728 [0,2,0,0,0,0|1,0,0]=3 10176 B12R1.374 SCCOc1cc(Cl)ccc1Cl Amb17245965 [0,2,0,0,0,0|1,1,0]=4 10177 B12R1.374 SCCSc1cc(Cl)ccc1Cl Amb25107258 [0,2,0,0,0,0|1,1,0]=4 10178 B12R1.1631 BrCCCc1c(F)cccc1Cl Amb17104568 [0,2,0,0,0,0|1,0,0]=3 10179 B12R1.1631 BrCCOc1c(C)cccc1C Amb1648711 [0,2,0,0,0,0|2,0,0]=4 10180 B12R1.1631 BrCCOc1c(C)cccc1Cl Amb10608622 [0,2,0,0,0,0|2,0,0]=4 10181 B12R1.1631 BrCCOc1c(Cl)cccc1Cl Amb1152417 [0,2,0,0,0,0|2,0,0]=4 10182 B12R1.1631 C#CCCc1c(Cl)cccc1Cl Amb18115182 [0,2,0,0,0,0|1,0,1]=4 10183 B12R1.1631 C#CCCc1c(F)cccc1Cl Amb18636109 [0,2,0,0,0,0|1,0,1]=4 10184 B12R1.1631 CC1=CC=CC(=O)N1CCCC Amb18402895 [0,2,0,0,0,0|2,0,0]=4 10185 B12R1.1631 CC1=CC=CC(=O)N1CCCCl Amb19058330 [0,2,0,0,0,0|2,0,0]=4 10186 B12R1.1631 CC1=CC=CC(=O)N1CCCN Amb18535488 [0,2,0,0,0,0|2,0,0]=4 10187 B12R1.1631 CC1=CC=CC(=O)N1CCCN Amb22587371 [0,2,0,0,0,0|2,0,0]=4 10188 B12R1.1631 CC1=CC=CC(=O)N1CCCO Amb18041293 [0,2,0,0,0,0|1,0,0]=3 10189 B12R1.1631 CC1=CC=CC(=O)N1CCCS Amb25856279 [0,2,0,0,0,0|1,1,0]=4 10190 B12R1.1631 CC1=CN=CC(=O)N1CCCO Amb24449349 [0,2,0,0,0,0|2,0,0]=4 10191 B12R1.1631 CC=1NC=CC(=O)C1CCCC Amb24373915 [0,2,0,0,0,0|2,0,0]=4 10192 B12R1.1631 CCCCN1C(N)=CC=CC1=N Amb25066953 [0,2,0,0,0,0|2,0,0]=4 10193 B12R1.1631 CCCCc1c(F)[n]ccc1Br Amb24654020 [0,2,0,0,0,0|2,0,0]=4 10194 B12R1.1631 CCCCc1c(N)c[n]cc1Br Amb25380660 [0,2,0,0,0,0|2,0,0]=4 10195 B12R1.1631 CCCCc1c(N)cccc1Cl Amb25365047 [0,2,0,0,0,0|1,0,0]=3 10196 B12R1.1631 CCCNc1c(Cl)cccc1Cl Amb17306283 [0,2,0,0,0,0|2,0,0]=4 10197 B12R1.1631 CCCNc1c(N)cccc1F Amb22289420 [0,2,0,0,0,0|2,0,0]=4 10198 B12R1.1631 CCCOc1c(F)cccc1Br Amb22896472 [0,2,0,0,0,0|2,0,0]=4 10199 B12R1.1631 CCCOc1c(F)cccc1Cl Amb25080640 [0,2,0,0,0,0|2,0,0]=4 10200 B12R1.1631 CCCOc1c(F)cccc1F Amb25670749 [0,2,0,0,0,0|2,0,0]=4 10201 B12R1.1631 CCCOc1c(N)cccc1Br Amb25258745 [0,2,0,0,0,0|2,0,0]=4 10202 B12R1.1631 CCCOc1c(N)cccc1F Amb25678737 [0,2,0,0,0,0|2,0,0]=4 10203 B12R1.1631 CCCOc1c(O)cccc1Br Amb22896497 [0,2,0,0,0,0|2,0,0]=4 10204 B12R1.1631 CCNCc1c(C)cccc1C Amb24484121 [0,2,0,0,0,0|2,0,0]=4 10205 B12R1.1631 CCNCc1c(Cl)cccc1Br Amb24364393 [0,2,0,0,0,0|2,0,0]=4 10206 B12R1.1631 CCOCc1c(Cl)cccc1Cl Amb24640814 [0,2,0,0,0,0|2,0,0]=4 10207 B12R1.1631 CCSCc1c(C)cccc1C Amb25669819 [0,2,0,0,0,0|2,0,0]=4 10208 B12R1.1631 CCSCc1c(F)cccc1Br Amb25143626 [0,2,0,0,0,0|2,0,0]=4 10209 B12R1.1631 CCSCc1c(F)cccc1Cl Amb25710319 [0,2,0,0,0,0|2,0,0]=4 10210 B12R1.1631 CCSCc1c(F)cccc1F Amb25796960 [0,2,0,0,0,0|2,0,0]=4 10211 B12R1.1631 CCSCc1c(N)cccc1Cl Amb24483543 [0,2,0,0,0,0|2,0,0]=4 10212 B12R1.1631 CCSCc1c(N)cccc1F Amb23571433 [0,2,0,0,0,0|2,0,0]=4 10213 B12R1.1631 CNCCc1c(Cl)cccc1Cl Amb17193870 [0,2,0,0,0,0|2,0,0]=4 10214 B12R1.1631 CNCCc1c(F)cccc1Br Amb24603339 [0,2,0,0,0,0|2,0,0]=4 10215 B12R1.1631 CNCCc1c(F)cccc1F Amb25342833 [0,2,0,0,0,0|2,0,0]=4 10216 B12R1.1631 CNCCc1c(O)cccc1F Amb25207994 [0,2,0,0,0,0|2,0,0]=4 10217 B12R1.1631 CNCCc1c(O)cccc1O Amb25270300 [0,2,0,0,0,0|2,0,0]=4 10218 B12R1.1631 CSCCc1c(Br)cccc1I Amb24632614 [0,2,0,0,0,0|2,0,0]=4 10219 B12R1.1631 CSCCc1c(F)cccc1Cl Amb25318344 [0,2,0,0,0,0|2,0,0]=4 10220 B12R1.1631 Cc1[n]ccc(Cl)c1CCCN Amb25049451 [0,2,0,0,0,0|2,0,0]=4 10221 B12R1.1631 Cc1c[n]cc(Cl)c1CCCN Amb25775233 [0,2,0,0,0,0|2,0,0]=4 10222 B12R1.1631 Cc1cc[n]c(F)c1CCCN Amb24682309 [0,2,0,0,0,0|2,0,0]=4 10223 B12R1.1631 Cc1cc[n]c(N)c1CCCN Amb25355269 [0,2,0,0,0,0|2,0,0]=4 10224 B12R1.1631 Cc1cc[n]c(N)c1CCCO Amb25099845 [0,2,0,0,0,0|1,0,0]=3 10225 B12R1.1631 Cc1cccc(Br)c1CCC=O Amb24341814 [0,2,0,0,0,0|0,0,2]=4 10226 B12R1.1631 Cc1cccc(C)c1CCC#N Amb25156532 [0,2,0,0,0,0|1,0,1]=4 10227 B12R1.1631 Cc1cccc(C)c1CCC=O Amb24092993 [0,2,0,0,0,0|0,0,2]=4 10228 B12R1.1631 Cc1cccc(C)c1CCCN Amb18251668 [0,2,0,0,0,0|1,0,0]=3 10229 B12R1.1631 Cc1cccc(C)c1NCCF Amb24418635 [0,2,0,0,0,0|2,0,0]=4 10230 B12R1.1631 Cc1cccc(Cl)c1CCCCl Amb25234260 [0,2,0,0,0,0|1,0,0]=3 10231 B12R1.1631 Cc1cccc(Cl)c1CCCO Amb25791304 [0,2,0,0,0,0|0,0,0]=2 10232 B12R1.1631 Cc1cccc(Cl)c1NCCO Amb25148802 [0,2,0,0,0,0|1,0,0]=3 10233 B12R1.1631 Cc1cccc(F)c1CCC=O Amb24432818 [0,2,0,0,0,0|0,0,2]=4 10234 B12R1.1631 Cc1cccc(F)c1CCCBr Amb24637088 [0,2,0,0,0,0|1,0,0]=3 10235 B12R1.1631 Cc1cccc(F)c1CCNC Amb25311693 [0,2,0,0,0,0|2,0,0]=4 10236 B12R1.1631 Cc1cccc(F)c1CNCC Amb24546788 [0,2,0,0,0,0|2,0,0]=4 10237 B12R1.1631 Cc1cccc(F)c1NCCF Amb25111768 [0,2,0,0,0,0|2,0,0]=4 10238 B12R1.1631 Cc1cccc(F)c1OCCN Amb24367943 [0,2,0,0,0,0|2,0,0]=4 10239 B12R1.1631 Cc1cccc(I)c1CCCCl Amb24561233 [0,2,0,0,0,0|1,0,0]=3 10240 B12R1.1631 Cc1cccc(N)c1CCCBr Amb25223463 [0,2,0,0,0,0|1,0,0]=3 10241 B12R1.1631 Cc1cccc(N)c1CCCCl Amb25253324 [0,2,0,0,0,0|1,0,0]=3 10242 B12R1.1631 Cc1cccc(N)c1NCCC Amb24678901 [0,2,0,0,0,0|2,0,0]=4 10243 B12R1.1631 Cc1cccc(N)c1OCCF Amb24455449 [0,2,0,0,0,0|2,0,0]=4 10244 B12R1.1631 Cc1cccc(N)c1OCCO Amb25324902 [0,2,0,0,0,0|1,0,0]=3 10245 B12R1.1631 Cc1cccc(N)c1SCCC Amb25667455 [0,2,0,0,0,0|2,0,0]=4 10246 B12R1.1631 Cc1cccc(O)c1CCC#N Amb24527960 [0,2,0,0,0,0|1,0,1]=4 10247 B12R1.1631 ClCCCc1c(Br)c[n]cc1Br Amb25148701 [0,2,0,0,0,0|2,0,0]=4 10248 B12R1.1631 ClCCCc1c(Br)cccc1Br Amb25208586 [0,2,0,0,0,0|1,0,0]=3 10249 B12R1.1631 ClCCCc1c(Cl)cccc1Cl Amb24341769 [0,2,0,0,0,0|1,0,0]=3 10250 B12R1.1631 ClCCCc1c(F)cccc1Cl Amb17104540 [0,2,0,0,0,0|1,0,0]=3 10251 B12R1.1631 ClCCNc1c(C)cccc1C Amb17335665 [0,2,0,0,0,0|2,0,0]=4 10252 B12R1.1631 ClCCOc1c(Cl)cccc1Cl Amb1152442 [0,2,0,0,0,0|2,0,0]=4 10253 B12R1.1631 Clc1cccc(Cl)c1CCCBr Amb24456278 [0,2,0,0,0,0|1,0,0]=3 10254 B12R1.1631 Clc1cccc(I)c1CCCBr Amb24695695 [0,2,0,0,0,0|1,0,0]=3 10255 B12R1.1631 Clc1cccc(I)c1CCCCl Amb25195180 [0,2,0,0,0,0|1,0,0]=3 10256 B12R1.1631 FCCNc1c(Cl)cccc1Cl Amb25707140 [0,2,0,0,0,0|2,0,0]=4 10257 B12R1.1631 FCCOc1c(Br)cccc1Br Amb24457439 [0,2,0,0,0,0|2,0,0]=4 10258 B12R1.1631 FCCSc1c(Cl)cccc1Cl Amb25079852 [0,2,0,0,0,0|2,0,0]=4 10259 B12R1.1631 Fc1[n]ccc(I)c1CCCCl Amb25225886 [0,2,0,0,0,0|2,0,0]=4 10260 B12R1.1631 Fc1cccc(Br)c1CCCBr Amb25312282 [0,2,0,0,0,0|1,0,0]=3 10261 B12R1.1631 Fc1cccc(Br)c1OCCBr Amb22896607 [0,2,0,0,0,0|2,0,0]=4 10262 B12R1.1631 Fc1cccc(Cl)c1NCCF Amb25113742 [0,2,0,0,0,0|2,0,0]=4 10263 B12R1.1631 Fc1cccc(Cl)c1OCCS Amb24471068 [0,2,0,0,0,0|1,1,0]=4 10264 B12R1.1631 Fc1cccc(F)c1CCCBr Amb25152621 [0,2,0,0,0,0|1,0,0]=3 10265 B12R1.1631 Fc1cccc(F)c1CCCCl Amb25189588 [0,2,0,0,0,0|1,0,0]=3 10266 B12R1.1631 Fc1cccc(F)c1OCCS Amb24412506 [0,2,0,0,0,0|1,1,0]=4 10267 B12R1.1631 N#CCCc1c(Cl)cccc1Cl Amb19038886 [0,2,0,0,0,0|1,0,1]=4 10268 B12R1.1631 N#CCCc1c(F)cccc1Br Amb25311739 [0,2,0,0,0,0|1,0,1]=4 10269 B12R1.1631 N#CCCc1c(F)cccc1Cl Amb19057365 [0,2,0,0,0,0|1,0,1]=4 10270 B12R1.1631 N#CCCc1c(F)cccc1I Amb25254633 [0,2,0,0,0,0|1,0,1]=4 10271 B12R1.1631 N#CCCc1c(F)cccc1S Amb25209546 [0,2,0,0,0,0|1,0,1]=4 10272 B12R1.1631 N#CCCc1c(O)cccc1I Amb24527834 [0,2,0,0,0,0|1,0,1]=4 10273 B12R1.1631 N#CCCc1c(O)cccc1O Amb24579256 [0,2,0,0,0,0|1,0,1]=4 10274 B12R1.1631 NCCCN1C(=O)C=CC=C1Br Amb18040601 [0,2,0,0,0,0|2,0,0]=4 10275 B12R1.1631 NCCCc1c(Br)c[n]cc1Br Amb25687067 [0,2,0,0,0,0|2,0,0]=4 10276 B12R1.1631 NCCCc1c(Cl)cccc1Br Amb24447135 [0,2,0,0,0,0|1,0,0]=3 10277 B12R1.1631 NCCCc1c(F)[n]ccc1Cl Amb25682533 [0,2,0,0,0,0|2,0,0]=4 10278 B12R1.1631 NCCCc1c(F)cccc1Cl Amb22548235 [0,2,0,0,0,0|1,0,0]=3 10279 B12R1.1631 NCCCc1c(F)cccc1F Amb18981388 [0,2,0,0,0,0|1,0,0]=3 10280 B12R1.1631 NCCCc1c(O)cccc1F Amb25149830 [0,2,0,0,0,0|1,0,0]=3 10281 B12R1.1631 NCCNc1c(Br)cccc1Br Amb25823941 [0,2,0,0,0,0|2,0,0]=4 10282 B12R1.1631 NCCNc1c(C)cccc1C Amb17091053 [0,2,0,0,0,0|2,0,0]=4 10283 B12R1.1631 NCCNc1c(Cl)cccc1Cl Amb18130950 [0,2,0,0,0,0|2,0,0]=4 10284 B12R1.1631 NCCNc1c(F)cccc1Br Amb24669803 [0,2,0,0,0,0|2,0,0]=4 10285 B12R1.1631 NCCNc1c(F)cccc1F Amb17091087 [0,2,0,0,0,0|2,0,0]=4 10286 B12R1.1631 NCCOc1c(F)cccc1F Amb22396841 [0,2,0,0,0,0|2,0,0]=4 10287 B12R1.1631 NCCSc1c(Cl)cccc1Cl Amb25296115 [0,2,0,0,0,0|2,0,0]=4 10288 B12R1.1631 NNCCc1c(Cl)cccc1Cl Amb19887712 [0,2,0,0,0,0|2,0,0]=4 10289 B12R1.1631 NOCCc1c(F)cccc1F Amb22900926 [0,2,0,0,0,0|2,0,0]=4 10290 B12R1.1631 Nc1c[n]cc(Cl)c1SCCO Amb25128664 [0,2,0,0,0,0|2,0,0]=4 10291 B12R1.1631 Nc1cccc(Br)c1CCC=O Amb25217703 [0,2,0,0,0,0|0,0,2]=4 10292 B12R1.1631 Nc1cccc(Br)c1CCCCl Amb24626552 [0,2,0,0,0,0|1,0,0]=3 10293 B12R1.1631 Nc1cccc(Cl)c1CCC=O Amb24727767 [0,2,0,0,0,0|0,0,2]=4 10294 B12R1.1631 Nc1cccc(Cl)c1CCCBr Amb24727766 [0,2,0,0,0,0|1,0,0]=3 10295 B12R1.1631 Nc1cccc(Cl)c1NCCF Amb25094961 [0,2,0,0,0,0|2,0,0]=4 10296 B12R1.1631 Nc1cccc(Cl)c1NCCN Amb18991499 [0,2,0,0,0,0|2,0,0]=4 10297 B12R1.1631 Nc1cccc(Cl)c1OCCF Amb25108017 [0,2,0,0,0,0|2,0,0]=4 10298 B12R1.1631 Nc1cccc(Cl)c1SCCN Amb18975708 [0,2,0,0,0,0|2,0,0]=4 10299 B12R1.1631 Nc1cccc(F)c1CCC=O Amb24579332 [0,2,0,0,0,0|0,0,2]=4 10300 B12R1.1631 Nc1cccc(F)c1NCCN Amb25089972 [0,2,0,0,0,0|2,0,0]=4 10301 B12R1.1631 Nc1cccc(F)c1OCCO Amb24729037 [0,2,0,0,0,0|1,0,0]=3 10302 B12R1.1631 Nc1cccc(N)c1CCC=O Amb25195431 [0,2,0,0,0,0|0,0,2]=4 10303 B12R1.1631 Nc1cccc(N)c1CCCBr Amb25312577 [0,2,0,0,0,0|1,0,0]=3 10304 B12R1.1631 Nc1cccc(N)c1NCCO Amb25758923 [0,2,0,0,0,0|1,0,0]=3 10305 B12R1.1631 Nc1cccc(O)c1CCC=O Amb24756892 [0,2,0,0,0,0|0,0,2]=4 10306 B12R1.1631 O=C1C=CC=C(Br)N1CCCF Amb24396832 [0,2,0,0,0,0|2,0,0]=4 10307 B12R1.1631 O=C1C=CC=C(Cl)N1CCCF Amb25127529 [0,2,0,0,0,0|2,0,0]=4 10308 B12R1.1631 O=CCCc1c(Br)cccc1Br Amb24092995 [0,2,0,0,0,0|0,0,2]=4 10309 B12R1.1631 O=CCCc1c(Cl)cccc1Cl Amb24092996 [0,2,0,0,0,0|0,0,2]=4 10310 B12R1.1631 O=CCCc1c(F)cccc1Br Amb25035166 [0,2,0,0,0,0|0,0,2]=4 10311 B12R1.1631 O=CCCc1c(F)cccc1Cl Amb17081684 [0,2,0,0,0,0|0,0,2]=4 10312 B12R1.1631 O=CCCc1c(F)cccc1F Amb25728226 [0,2,0,0,0,0|0,0,2]=4 10313 B12R1.1631 O=CCCc1c(F)cccc1I Amb25055675 [0,2,0,0,0,0|0,0,2]=4 10314 B12R1.1631 OCC#Cc1c(F)cccc1Cl Amb24493479 [0,2,0,0,0,0|0,0,2]=4 10315 B12R1.1631 OCC#Cc1c(F)cccc1F Amb24483483 [0,2,0,0,0,0|0,0,2]=4 10316 B12R1.1631 OCCCN1C(=O)C=CC=C1Br Amb18040866 [0,2,0,0,0,0|1,0,0]=3 10317 B12R1.1631 OCCCN1C(=O)C=CC=C1Cl Amb25042512 [0,2,0,0,0,0|1,0,0]=3 10318 B12R1.1631 OCCCN1C(=O)NC=CC1=O Amb25816472 [0,2,0,0,0,0|2,0,0]=4 10319 B12R1.1631 OCCCc1c(Br)c[n]cc1Br Amb25786116 [0,2,0,0,0,0|1,0,0]=3 10320 B12R1.1631 OCCCc1c(Cl)cccc1Br Amb25829173 [0,2,0,0,0,0|0,0,0]=2 10321 B12R1.1631 OCCCc1c(Cl)cccc1Cl Amb24356168 [0,2,0,0,0,0|0,0,0]=2 10322 B12R1.1631 OCCCc1c(F)cccc1Cl Amb17089506 [0,2,0,0,0,0|0,0,0]=2 10323 B12R1.1631 OCCCc1c(F)cccc1F Amb24447301 [0,2,0,0,0,0|0,0,0]=2 10324 B12R1.1631 OCCNc1c(Br)cccc1Br Amb24375032 [0,2,0,0,0,0|1,0,0]=3 10325 B12R1.1631 OCCNc1c(C)cccc1C Amb17306428 [0,2,0,0,0,0|1,0,0]=3 10326 B12R1.1631 OCCNc1c(Cl)cccc1Cl Amb17306298 [0,2,0,0,0,0|1,0,0]=3 10327 B12R1.1631 OCCNc1c(F)cccc1Br Amb24375111 [0,2,0,0,0,0|1,0,0]=3 10328 B12R1.1631 OCCSc1c(Br)c[n]cc1Br Amb25852513 [0,2,0,0,0,0|2,0,0]=4 10329 B12R1.1631 OCNCc1c(Cl)cccc1Cl Amb24567203 [0,2,0,0,0,0|1,0,0]=3 10330 B12R1.1631 OC\C=C\c1c(F)cccc1F Amb23442862 [0,2,0,0,0,0|0,0,2]=4 10331 B12R1.1631 Oc1cccc(Br)c1CCCBr Amb25377434 [0,2,0,0,0,0|1,0,0]=3 10332 B12R1.1631 Oc1cccc(Br)c1CCCCl Amb24638372 [0,2,0,0,0,0|1,0,0]=3 10333 B12R1.1631 Oc1cccc(Cl)c1CCCO Amb24416761 [0,2,0,0,0,0|0,0,0]=2 10334 B12R1.1631 Oc1cccc(F)c1CCC=O Amb25066926 [0,2,0,0,0,0|0,0,2]=4 10335 B12R1.1631 Oc1cccc(I)c1CCC=O Amb25784762 [0,2,0,0,0,0|0,0,2]=4 10336 B12R1.1631 Oc1cccc(I)c1CCCBr Amb24758191 [0,2,0,0,0,0|1,0,0]=3 10337 B12R1.1631 Oc1cccc(O)c1CCC=O Amb25268615 [0,2,0,0,0,0|0,0,2]=4 10338 B12R1.1631 Oc1cccc(O)c1CCCBr Amb24639237 [0,2,0,0,0,0|1,0,0]=3 10339 B12R1.1631 Oc1cccc(O)c1CCCCl Amb25218074 [0,2,0,0,0,0|1,0,0]=3 10340 B12R1.1631 SCCCc1c(F)cccc1Cl Amb17402978 [0,2,0,0,0,0|0,1,0]=3 10341 B12R1.1631 Sc1cccc(Br)c1CCCBr Amb25217975 [0,2,0,0,0,0|1,0,0]=3 10342 B12R1.1631 Sc1cccc(I)c1CCCCl Amb24628126 [0,2,0,0,0,0|1,0,0]=3 10343 B12R1.28 BrCCCOc1cccc(c1)C Amb1675755 [0,2,0,0,0,0|1,0,0]=3 10344 B12R1.28 BrCC\C=C\c1cccc(c1)C Amb17246877 [0,2,0,0,0,0|1,0,1]=4 10345 B12R1.28 BrCC\C=C\c1cccc(c1)Cl Amb17258090 [0,2,0,0,0,0|1,0,1]=4 10346 B12R1.28 BrCC\C=C\c1cccc(c1)F Amb17248421 [0,2,0,0,0,0|1,0,1]=4 10347 B12R1.28 C#CCCCc1cc[n]c(N)c1 Amb24460752 [0,2,0,0,0,0|2,0,0]=4 10348 B12R1.28 C#CCCNc1cccc(F)c1 Amb25800317 [0,2,0,0,0,0|1,0,1]=4 10349 B12R1.28 C#CCCOc1cccc(F)c1 Amb24706220 [0,2,0,0,0,0|1,0,1]=4 10350 B12R1.28 C#CCCOc1cccc(I)c1 Amb24646963 [0,2,0,0,0,0|1,0,1]=4 10351 B12R1.28 C#CCCOc1cccc(N)c1 Amb18971498 [0,2,0,0,0,0|1,0,1]=4 10352 B12R1.28 C#CCCSc1cccc(F)c1 Amb24487394 [0,2,0,0,0,0|1,0,1]=4 10353 B12R1.28 C#CCCSc1cccc(N)c1 Amb24418218 [0,2,0,0,0,0|1,0,1]=4 10354 B12R1.28 C#CCNCc1cccc(Br)c1 Amb21979461 [0,2,0,0,0,0|1,0,1]=4 10355 B12R1.28 C#CCNCc1cccc(Cl)c1 Amb21979462 [0,2,0,0,0,0|1,0,1]=4 10356 B12R1.28 C#CCOCc1cccc(Br)c1 Amb23512551 [0,2,0,0,0,0|1,0,1]=4 10357 B12R1.28 C#CCOCc1cccc(N)c1 Amb24116425 [0,2,0,0,0,0|1,0,1]=4 10358 B12R1.28 C#CCSCc1cccc(Br)c1 Amb25204934 [0,2,0,0,0,0|1,0,1]=4 10359 B12R1.28 C#CCSCc1cccc(Cl)c1 Amb25332082 [0,2,0,0,0,0|1,0,1]=4 10360 B12R1.28 C=CCCCc1cccc(c1)C Amb13890666 [0,2,0,0,0,0|1,0,0]=3 10361 B12R1.28 C=CCCCc1cccc(c1)Cl Amb13890654 [0,2,0,0,0,0|1,0,0]=3 10362 B12R1.28 C=CCCCc1cccc(c1)F Amb13890678 [0,2,0,0,0,0|1,0,0]=3 10363 B12R1.28 C=CCCNc1cccc(F)c1 Amb24072145 [0,2,0,0,0,0|1,0,1]=4 10364 B12R1.28 C=CCCOc1cccc(I)c1 Amb22503741 [0,2,0,0,0,0|1,0,1]=4 10365 B12R1.28 C=CCCOc1cccc(N)c1 Amb24271220 [0,2,0,0,0,0|1,0,1]=4 10366 B12R1.28 C=CCNCc1cccc(Cl)c1 Amb19890325 [0,2,0,0,0,0|1,0,1]=4 10367 B12R1.28 C=CCNCc1cccc(F)c1 Amb20673583 [0,2,0,0,0,0|1,0,1]=4 10368 B12R1.28 C=CCNCc1cccc(O)c1 Amb19890781 [0,2,0,0,0,0|1,0,1]=4 10369 B12R1.28 C=CCNCc1cccc(c1)Br Amb1923351 [0,2,0,0,0,0|1,0,1]=4 10370 B12R1.28 C=CCOCc1cccc(I)c1 Amb22503743 [0,2,0,0,0,0|1,0,1]=4 10371 B12R1.28 CCCC#Cc1cc(Br)ccc1 Amb25721063 [0,2,0,0,0,0|1,0,1]=4 10372 B12R1.28 CCCC#Cc1cc(F)ccc1 Amb25221923 [0,2,0,0,0,0|1,0,1]=4 10373 B12R1.28 CCCC#Cc1cc(I)ccc1 Amb24604509 [0,2,0,0,0,0|1,0,1]=4 10374 B12R1.28 CCCC#Cc1cc(O)ccc1 Amb24568856 [0,2,0,0,0,0|1,0,1]=4 10375 B12R1.28 CCCCCC1=CC=CC(=O)O1 Amb19668103 [0,2,0,0,0,0|2,0,0]=4 10376 B12R1.28 CCCCCc1c[n]cc(N)c1 Amb23570651 [0,2,0,0,0,0|2,0,0]=4 10377 B12R1.28 CCCCCc1cccc(F)c1 Amb22235097 [0,2,0,0,0,0|1,0,0]=3 10378 B12R1.28 CCCCNc1c[n]cc(Br)c1 Amb23450120 [0,2,0,0,0,0|2,0,0]=4 10379 B12R1.28 CCCCNc1c[n]cc(Cl)c1 Amb24666531 [0,2,0,0,0,0|2,0,0]=4 10380 B12R1.28 CCCCNc1cc(N)ccn1 Amb17334646 [0,2,0,0,0,0|2,0,0]=4 10381 B12R1.28 CCCCNc1cccc(Br)[n]1 Amb25303603 [0,2,0,0,0,0|2,0,0]=4 10382 B12R1.28 CCCCNc1cccc(Cl)[n]1 Amb21958687 [0,2,0,0,0,0|2,0,0]=4 10383 B12R1.28 CCCCNc1cccc(F)[n]1 Amb18177869 [0,2,0,0,0,0|2,0,0]=4 10384 B12R1.28 CCCCNc1cccc(I)c1 Amb19232035 [0,2,0,0,0,0|1,0,0]=3 10385 B12R1.28 CCCCOc1cc(Br)cc[n]1 Amb22276477 [0,2,0,0,0,0|2,0,0]=4 10386 B12R1.28 CCCCOc1cc(Cl)cc[n]1 Amb22276195 [0,2,0,0,0,0|2,0,0]=4 10387 B12R1.28 CCCCOc1cc(N)cc[n]1 Amb18798584 [0,2,0,0,0,0|2,0,0]=4 10388 B12R1.28 CCCCOc1cccc(Br)[n]1 Amb19959446 [0,2,0,0,0,0|2,0,0]=4 10389 B12R1.28 CCCCOc1cccc([NH3+])c1 Amb22483190 [0,2,0,0,0,0|1,0,0]=3 10390 B12R1.28 CCCCOc1cccc(c1)N Amb1132055 [0,2,0,0,0,0|1,0,0]=3 10391 B12R1.28 CCCCOc1cccc(c1)N Amb2140562 [0,2,0,0,0,0|1,0,0]=3 10392 B12R1.28 CCCCSc1cc(Cl)cc[n]1 Amb22236363 [0,2,0,0,0,0|2,0,0]=4 10393 B12R1.28 CCCNCc1cccc(F)c1 Amb20673497 [0,2,0,0,0,0|1,0,0]=3 10394 B12R1.28 CCCNCc1cccc(O)c1 Amb20673478 [0,2,0,0,0,0|1,0,0]=3 10395 B12R1.28 CCCNCc1cccc(c1)Br Amb1922696 [0,2,0,0,0,0|1,0,0]=3 10396 B12R1.28 CCCNCc1cccc(c1)Cl Amb1923473 [0,2,0,0,0,0|1,0,0]=3 10397 B12R1.28 CCC\N=C\c1cc(O)ccc1 Amb25249271 [0,2,0,0,0,0|1,0,1]=4 10398 B12R1.28 CCNCCc1cccc(N)c1 Amb18550383 [0,2,0,0,0,0|1,0,0]=3 10399 B12R1.28 CCNCCc1cccc(c1)Br Amb17407066 [0,2,0,0,0,0|1,0,0]=3 10400 B12R1.28 CCNCCc1cccc(c1)C Amb17193871 [0,2,0,0,0,0|1,0,0]=3 10401 B12R1.28 CCOCOc1cc(N)ccc1 Amb24085370 [0,2,0,0,0,0|2,0,0]=4 10402 B12R1.28 CNCCCc1cccc(c1)Br Amb17104522 [0,2,0,0,0,0|1,0,0]=3 10403 B12R1.28 CNCCCc1cccc(c1)C Amb17104500 [0,2,0,0,0,0|1,0,0]=3 10404 B12R1.28 CNCCCc1cccc(c1)Cl Amb17104508 [0,2,0,0,0,0|1,0,0]=3 10405 B12R1.28 CNCCCc1cccc(c1)F Amb17605539 [0,2,0,0,0,0|1,0,0]=3 10406 B12R1.28 CNCCNc1cc(Br)ccc1 Amb19025286 [0,2,0,0,0,0|2,0,0]=4 10407 B12R1.28 CNCCNc1cc(Cl)ccc1 Amb19025283 [0,2,0,0,0,0|2,0,0]=4 10408 B12R1.28 CNCCNc1cc(F)ccc1 Amb19025285 [0,2,0,0,0,0|2,0,0]=4 10409 B12R1.28 CNCCOc1cccc(c1)C Amb1670237 [0,2,0,0,0,0|2,0,0]=4 10410 B12R1.28 CNCCOc1cccc(c1)C Amb2140579 [0,2,0,0,0,0|2,0,0]=4 10411 B12R1.28 CNCCOc1cccc(c1)Cl Amb1106194 [0,2,0,0,0,0|2,0,0]=4 10412 B12R1.28 CNCCOc1cccc(c1)F Amb2132298 [0,2,0,0,0,0|2,0,0]=4 10413 B12R1.28 CNCCOc1cccc(c1)N Amb17232614 [0,2,0,0,0,0|2,0,0]=4 10414 B12R1.28 COCC#Cc1cc(Cl)ccc1 Amb24436599 [0,2,0,0,0,0|0,0,2]=4 10415 B12R1.28 COCC#Cc1cc(I)ccc1 Amb24368630 [0,2,0,0,0,0|0,0,2]=4 10416 B12R1.28 COCC#Cc1cc(O)ccc1 Amb25156562 [0,2,0,0,0,0|0,0,2]=4 10417 B12R1.28 COCCCc1cc(Cl)[n]c[n]1 Amb23453469 [0,2,0,0,0,0|2,0,0]=4 10418 B12R1.28 COCCCc1cc(O)[n]c[n]1 Amb23453435 [0,2,0,0,0,0|2,0,0]=4 10419 B12R1.28 COCCCc1cc[n]c(O)[n]1 Amb23453463 [0,2,0,0,0,0|2,0,0]=4 10420 B12R1.28 COCCNc1c[n]cc(N)c1 Amb23454675 [0,2,0,0,0,0|2,0,0]=4 10421 B12R1.28 COCCNc1cc(Br)cc[n]1 Amb24450746 [0,2,0,0,0,0|2,0,0]=4 10422 B12R1.28 COCCNc1cc(N)ccn1 Amb17334706 [0,2,0,0,0,0|2,0,0]=4 10423 B12R1.28 COCCNc1cccc(Cl)[n]1 Amb21958803 [0,2,0,0,0,0|2,0,0]=4 10424 B12R1.28 COCCNc1cccc(F)[n]1 Amb19011120 [0,2,0,0,0,0|2,0,0]=4 10425 B12R1.28 COCCNc1cccc(N)[n]1 Amb24581106 [0,2,0,0,0,0|2,0,0]=4 10426 B12R1.28 COCCOc1cc(Br)c[n]c1 Amb22276360 [0,2,0,0,0,0|2,0,0]=4 10427 B12R1.28 COCCOc1cc(Br)cc[n]1 Amb22276471 [0,2,0,0,0,0|2,0,0]=4 10428 B12R1.28 COCCOc1cc(Cl)cc[n]1 Amb22276482 [0,2,0,0,0,0|2,0,0]=4 10429 B12R1.28 COCCOc1cccc(c1)N Amb1995345 [0,2,0,0,0,0|1,0,0]=3 10430 B12R1.28 COCCOc1cccc(c1)N Amb2189171 [0,2,0,0,0,0|1,0,0]=3 10431 B12R1.28 COC\C=C\c1cccc(Br)c1 Amb25245073 [0,2,0,0,0,0|0,0,2]=4 10432 B12R1.28 CSCCNc1cccc(F)c1 Amb19025515 [0,2,0,0,0,0|1,1,0]=4 10433 B12R1.28 CSCCNc1cccc(I)c1 Amb25232446 [0,2,0,0,0,0|1,1,0]=4 10434 B12R1.28 CSCCNc1cccc(c1)C Amb17307508 [0,2,0,0,0,0|1,1,0]=4 10435 B12R1.28 CSCCOc1cccc(c1)N Amb17504021 [0,2,0,0,0,0|1,1,0]=4 10436 B12R1.28 Cc1[n]c(cc[n]1)NCCCO Amb19031140 [0,2,0,0,0,0|2,0,0]=4 10437 B12R1.28 Cc1c[n]cc(c1)NCCOC Amb24451954 [0,2,0,0,0,0|2,0,0]=4 10438 B12R1.28 Cc1cc(CCCC#N)cc[n]1 Amb25073982 [0,2,0,0,0,0|2,0,0]=4 10439 B12R1.28 Cc1cc(CCCCN)[n]cc1 Amb18828700 [0,2,0,0,0,0|2,0,0]=4 10440 B12R1.28 Cc1cc(CCCCS)ccc1 Amb18564155 [0,2,0,0,0,0|0,1,0]=3 10441 B12R1.28 Cc1cc(CCNC#N)ccc1 Amb18800415 [0,2,0,0,0,0|1,0,1]=4 10442 B12R1.28 Cc1cc(CCNC=O)ccc1 Amb25758483 [0,2,0,0,0,0|0,0,2]=4 10443 B12R1.28 Cc1cc(CNCC#C)ccc1 Amb21979538 [0,2,0,0,0,0|1,0,1]=4 10444 B12R1.28 Cc1cc(CNCC=C)ccc1 Amb19890661 [0,2,0,0,0,0|1,0,1]=4 10445 B12R1.28 Cc1cc(CSCC#C)ccc1 Amb18184115 [0,2,0,0,0,0|1,0,1]=4 10446 B12R1.28 Cc1cc(CSCC#N)ccc1 Amb18804686 [0,2,0,0,0,0|1,0,1]=4 10447 B12R1.28 Cc1cc(NCCCN)[n]cc1 Amb18798447 [0,2,0,0,0,0|2,0,0]=4 10448 B12R1.28 Cc1cc(NCCCO)[n]cc1 Amb18798582 [0,2,0,0,0,0|1,0,0]=3 10449 B12R1.28 Cc1cc(\C=C\CCO)ccc1 Amb25333403 [0,2,0,0,0,0|0,0,1]=3 10450 B12R1.28 Cc1cc(\C=N\CCO)ccc1 Amb25144474 [0,2,0,0,0,0|0,0,1]=3 10451 B12R1.28 Cc1cc(cc[n]1)C#CCCO Amb24601417 [0,2,0,0,0,0|1,0,1]=4 10452 B12R1.28 Cc1cc(cc[n]1)NCCCC Amb24649186 [0,2,0,0,0,0|2,0,0]=4 10453 B12R1.28 Cc1cc(cc[n]1)NCCCF Amb25719313 [0,2,0,0,0,0|2,0,0]=4 10454 B12R1.28 Cc1cc(cc[n]1)NCCCN Amb25074981 [0,2,0,0,0,0|2,0,0]=4 10455 B12R1.28 Cc1cc(cc[n]1)NCCCO Amb24406842 [0,2,0,0,0,0|1,0,0]=3 10456 B12R1.28 Cc1cc(cc[n]1)NCCOC Amb24590544 [0,2,0,0,0,0|2,0,0]=4 10457 B12R1.28 Cc1cc(ccc1)C#CCCCl Amb18796082 [0,2,0,0,0,0|1,0,1]=4 10458 B12R1.28 Cc1cc(ccc1)C#CCCN Amb25766570 [0,2,0,0,0,0|1,0,1]=4 10459 B12R1.28 Cc1cc(ccc1)C#CCCO Amb18792224 [0,2,0,0,0,0|0,0,1]=3 10460 B12R1.28 Cc1cc(ccc1)C#CCOC Amb25125980 [0,2,0,0,0,0|0,0,2]=4 10461 B12R1.28 Cc1cc(ccc1)NCCCF Amb25809142 [0,2,0,0,0,0|1,0,0]=3 10462 B12R1.28 Cc1cc(ccc1)OCCC#C Amb24732559 [0,2,0,0,0,0|1,0,1]=4 10463 B12R1.28 Cc1cc(ccc1)SCCC#C Amb25148457 [0,2,0,0,0,0|1,0,1]=4 10464 B12R1.28 Cc1cc(ccc1)SCCC#N Amb18790888 [0,2,0,0,0,0|1,0,1]=4 10465 B12R1.28 Cc1cc(ccc1)SCCCCl Amb18317179 [0,2,0,0,0,0|1,0,0]=3 10466 B12R1.28 Cc1cc[n]c(NCCCO)[n]1 Amb19035257 [0,2,0,0,0,0|2,0,0]=4 10467 B12R1.28 Cc1cc[n]c(c1)NCCCC Amb19018811 [0,2,0,0,0,0|2,0,0]=4 10468 B12R1.28 Cc1cc[n]c(c1)NCCOC Amb18798581 [0,2,0,0,0,0|2,0,0]=4 10469 B12R1.28 Cc1cccc(CCCCO)[n]1 Amb23441243 [0,2,0,0,0,0|1,0,0]=3 10470 B12R1.28 Cc1cccc(CNCCC)c1 Amb20673492 [0,2,0,0,0,0|1,0,0]=3 10471 B12R1.28 Cc1cccc(NCCCC)[n]1 Amb19005118 [0,2,0,0,0,0|2,0,0]=4 10472 B12R1.28 Cc1cccc(NCCCCl)[n]1 Amb25705741 [0,2,0,0,0,0|2,0,0]=4 10473 B12R1.28 Cc1cccc(NCCCF)[n]1 Amb25809721 [0,2,0,0,0,0|2,0,0]=4 10474 B12R1.28 Cc1cccc(NCCCN)[n]1 Amb19005111 [0,2,0,0,0,0|2,0,0]=4 10475 B12R1.28 Cc1cccc(NCCCO)[n]1 Amb19009921 [0,2,0,0,0,0|1,0,0]=3 10476 B12R1.28 Cc1cccc(NCCOC)[n]1 Amb19005113 [0,2,0,0,0,0|2,0,0]=4 10477 B12R1.28 Cc1cccc([n]1)OCCCO Amb22900068 [0,2,0,0,0,0|1,0,0]=3 10478 B12R1.28 Cc1cccc(c1)NCCNC Amb19025279 [0,2,0,0,0,0|2,0,0]=4 10479 B12R1.28 ClCCCOc1cccc(c1)Br Amb1128139 [0,2,0,0,0,0|1,0,0]=3 10480 B12R1.28 ClCCCOc1cccc(c1)C Amb1138744 [0,2,0,0,0,0|1,0,0]=3 10481 B12R1.28 ClCCCOc1cccc(c1)Cl Amb1126449 [0,2,0,0,0,0|1,0,0]=3 10482 B12R1.28 ClCCCOc1cccc(c1)F Amb1129297 [0,2,0,0,0,0|1,0,0]=3 10483 B12R1.28 ClCC\C=C\c1cccc(c1)C Amb17233778 [0,2,0,0,0,0|1,0,1]=4 10484 B12R1.28 ClCC\C=C\c1cccc(c1)Cl Amb17237227 [0,2,0,0,0,0|1,0,1]=4 10485 B12R1.28 ClCC\C=C\c1cccc(c1)F Amb17234151 [0,2,0,0,0,0|1,0,1]=4 10486 B12R1.28 Clc1cc(CC#CCCl)ccc1 Amb25111199 [0,2,0,0,0,0|1,0,1]=4 10487 B12R1.28 Clc1cc(ccc1)C#CCCCl Amb19088531 [0,2,0,0,0,0|1,0,1]=4 10488 B12R1.28 FCCCNc1cccc(Br)[n]1 Amb24359792 [0,2,0,0,0,0|2,0,0]=4 10489 B12R1.28 FCCCNc1cccc(Br)c1 Amb25679781 [0,2,0,0,0,0|1,0,0]=3 10490 B12R1.28 FCCCNc1cccc(Cl)c1 Amb24350967 [0,2,0,0,0,0|1,0,0]=3 10491 B12R1.28 FCCCOc1cccc(Br)c1 Amb22008307 [0,2,0,0,0,0|1,0,0]=3 10492 B12R1.28 Fc1cc(CCCCS)ccc1 Amb18564294 [0,2,0,0,0,0|0,1,0]=3 10493 B12R1.28 Fc1cc(ccc1)C#CCCCl Amb18321955 [0,2,0,0,0,0|1,0,1]=4 10494 B12R1.28 Fc1cccc(NCCCF)[n]1 Amb24673898 [0,2,0,0,0,0|2,0,0]=4 10495 B12R1.28 Fc1cccc(c1)NCCCF Amb24452997 [0,2,0,0,0,0|1,0,0]=3 10496 B12R1.28 N#CCCNc1cccc(c1)C Amb1647378 [0,2,0,0,0,0|1,0,1]=4 10497 B12R1.28 N#CCCNc1cccc(c1)Cl Amb1647289 [0,2,0,0,0,0|1,0,1]=4 10498 B12R1.28 N#CCCNc1cccc(c1)O Amb17142902 [0,2,0,0,0,0|1,0,1]=4 10499 B12R1.28 N#CCCOc1cccc(c1)O Amb10564583 [0,2,0,0,0,0|1,0,1]=4 10500 B12R1.28 N#CCCSc1cccc(Cl)c1 Amb18325237 [0,2,0,0,0,0|1,0,1]=4 10501 B12R1.28 N#CCNCc1cccc(Br)c1 Amb18977748 [0,2,0,0,0,0|1,0,1]=4 10502 B12R1.28 N#CCNCc1cccc(c1)C Amb17400075 [0,2,0,0,0,0|1,0,1]=4 10503 B12R1.28 N#CCNCc1cccc(c1)Cl Amb2416269 [0,2,0,0,0,0|1,0,1]=4 10504 B12R1.28 N#CCOCc1cccc(Br)c1 Amb25211535 [0,2,0,0,0,0|1,0,1]=4 10505 B12R1.28 N#CCSCc1cccc(c1)Cl Amb17501727 [0,2,0,0,0,0|1,0,1]=4 10506 B12R1.28 N#CCSCc1cccc(c1)F Amb17501763 [0,2,0,0,0,0|1,0,1]=4 10507 B12R1.28 N#CNCCc1cccc(Br)c1 Amb24366281 [0,2,0,0,0,0|1,0,1]=4 10508 B12R1.28 N#CNCCc1cccc(F)c1 Amb18800780 [0,2,0,0,0,0|1,0,1]=4 10509 B12R1.28 NCCC#Cc1cc(Cl)ccc1 Amb25083732 [0,2,0,0,0,0|1,0,1]=4 10510 B12R1.28 NCCCCc1cccc(Br)c1 Amb18549204 [0,2,0,0,0,0|1,0,0]=3 10511 B12R1.28 NCCCCc1cccc(F)c1 Amb18563815 [0,2,0,0,0,0|1,0,0]=3 10512 B12R1.28 NCCCNC1=CC=CC(=O)N1 Amb25051511 [0,2,0,0,0,0|2,0,0]=4 10513 B12R1.28 NCCCNc1c[n]cc(Br)c1 Amb25825867 [0,2,0,0,0,0|2,0,0]=4 10514 B12R1.28 NCCCNc1c[n]cc(F)c1 Amb19017792 [0,2,0,0,0,0|2,0,0]=4 10515 B12R1.28 NCCCNc1cc(Cl)cc[n]1 Amb25675655 [0,2,0,0,0,0|2,0,0]=4 10516 B12R1.28 NCCCNc1cccc(c1)C Amb17057722 [0,2,0,0,0,0|1,0,0]=3 10517 B12R1.28 NCCCNc1cccc(c1)Cl Amb17057728 [0,2,0,0,0,0|1,0,0]=3 10518 B12R1.28 NCCCNc1cccc(c1)F Amb17057725 [0,2,0,0,0,0|1,0,0]=3 10519 B12R1.28 NCCCOc1cc(Br)cc[n]1 Amb22276283 [0,2,0,0,0,0|2,0,0]=4 10520 B12R1.28 NCCCOc1cc(Cl)cc[n]1 Amb22276287 [0,2,0,0,0,0|2,0,0]=4 10521 B12R1.28 NCCCOc1cccc(c1)C Amb1108604 [0,2,0,0,0,0|1,0,0]=3 10522 B12R1.28 NCCCOc1cccc(c1)C Amb1221739 [0,2,0,0,0,0|1,0,0]=3 10523 B12R1.28 NCCCOc1cccc(c1)F Amb1140971 [0,2,0,0,0,0|1,0,0]=3 10524 B12R1.28 NCCCSc1cccc(c1)C Amb17083071 [0,2,0,0,0,0|1,0,0]=3 10525 B12R1.28 NCCCSc1cccc(c1)Cl Amb17083080 [0,2,0,0,0,0|1,0,0]=3 10526 B12R1.28 NCCNCc1cccc(Br)c1 Amb19005476 [0,2,0,0,0,0|1,0,0]=3 10527 B12R1.28 NCCNCc1cccc(O)c1 Amb19005503 [0,2,0,0,0,0|1,0,0]=3 10528 B12R1.28 NCCNCc1cccc(c1)C Amb10075511 [0,2,0,0,0,0|1,0,0]=3 10529 B12R1.28 NCCNCc1cccc(c1)Cl Amb10075509 [0,2,0,0,0,0|1,0,0]=3 10530 B12R1.28 NCCNCc1cccc(c1)F Amb10075489 [0,2,0,0,0,0|1,0,0]=3 10531 B12R1.28 NCCOCc1cccc(c1)Br Amb17061821 [0,2,0,0,0,0|1,0,0]=3 10532 B12R1.28 NCCOCc1cccc(c1)C Amb17061815 [0,2,0,0,0,0|1,0,0]=3 10533 B12R1.28 NCCOCc1cccc(c1)Cl Amb17061820 [0,2,0,0,0,0|1,0,0]=3 10534 B12R1.28 NCCOCc1cccc(c1)F Amb17061818 [0,2,0,0,0,0|1,0,0]=3 10535 B12R1.28 NCCSCc1cc[n]c(Cl)c1 Amb19023098 [0,2,0,0,0,0|2,0,0]=4 10536 B12R1.28 NCC\C=C\c1cc(I)ccc1 Amb24560016 [0,2,0,0,0,0|1,0,1]=4 10537 B12R1.28 NCC\C=C\c1cc(O)ccc1 Amb24519589 [0,2,0,0,0,0|1,0,1]=4 10538 B12R1.28 NCC\C=C\c1cccc(c1)C Amb17232387 [0,2,0,0,0,0|1,0,1]=4 10539 B12R1.28 NCC\C=C\c1cccc(c1)Cl Amb17233875 [0,2,0,0,0,0|1,0,1]=4 10540 B12R1.28 NCC\C=C\c1cccc(c1)F Amb17232532 [0,2,0,0,0,0|1,0,1]=4 10541 B12R1.28 NNCCOc1cccc(c1)Br Amb1116522 [0,2,0,0,0,0|2,0,0]=4 10542 B12R1.28 NNCCOc1cccc(c1)C Amb17400212 [0,2,0,0,0,0|2,0,0]=4 10543 B12R1.28 NNCCOc1cccc(c1)Cl Amb17401092 [0,2,0,0,0,0|2,0,0]=4 10544 B12R1.28 NNCCOc1cccc(c1)F Amb17400322 [0,2,0,0,0,0|2,0,0]=4 10545 B12R1.28 NOCC#Cc1cc(F)ccc1 Amb24689943 [0,2,0,0,0,0|0,0,2]=4 10546 B12R1.28 NOCCCc1cccc(c1)Br Amb17089578 [0,2,0,0,0,0|0,0,0]=2 10547 B12R1.28 NOCCCc1cccc(c1)C Amb17089550 [0,2,0,0,0,0|0,0,0]=2 10548 B12R1.28 NOCCCc1cccc(c1)Cl Amb17089559 [0,2,0,0,0,0|0,0,0]=2 10549 B12R1.28 NOCCCc1cccc(c1)O Amb17089577 [0,2,0,0,0,0|0,0,0]=2 10550 B12R1.28 NOCCOc1cccc(c1)Br Amb17088298 [0,2,0,0,0,0|1,0,0]=3 10551 B12R1.28 NOCCOc1cccc(c1)C Amb17088289 [0,2,0,0,0,0|1,0,0]=3 10552 B12R1.28 NOCCOc1cccc(c1)Cl Amb17088295 [0,2,0,0,0,0|1,0,0]=3 10553 B12R1.28 NOCCOc1cccc(c1)F Amb17088292 [0,2,0,0,0,0|1,0,0]=3 10554 B12R1.28 Nc1c[n]cc(NCCCO)[n]1 Amb25773585 [0,2,0,0,0,0|2,0,0]=4 10555 B12R1.28 Nc1cc(CCCC#N)ccc1 Amb24681109 [0,2,0,0,0,0|1,0,0]=3 10556 B12R1.28 Nc1cc(CSCCO)cc[n]1 Amb18311356 [0,2,0,0,0,0|1,0,0]=3 10557 B12R1.28 Nc1cc(NCCCO)[n]cc1 Amb18798796 [0,2,0,0,0,0|1,0,0]=3 10558 B12R1.28 Nc1cc(cc[n]1)NCCCF Amb25740053 [0,2,0,0,0,0|2,0,0]=4 10559 B12R1.28 Nc1cc(cc[n]1)NCCCO Amb24685867 [0,2,0,0,0,0|1,0,0]=3 10560 B12R1.28 Nc1cc(ccc1)C#CCCO Amb24423816 [0,2,0,0,0,0|0,0,1]=3 10561 B12R1.28 Nc1cc(ccc1)NCCCF Amb25132504 [0,2,0,0,0,0|1,0,0]=3 10562 B12R1.28 Nc1cc(ccc1)OCCC#N Amb18971514 [0,2,0,0,0,0|1,0,1]=4 10563 B12R1.28 Nc1cc(ccc1)OCCCCl Amb22831609 [0,2,0,0,0,0|1,0,0]=3 10564 B12R1.28 Nc1cc(ccc1)OCCCF Amb23539406 [0,2,0,0,0,0|1,0,0]=3 10565 B12R1.28 Nc1cc(ccc1)SCCC#N Amb25707773 [0,2,0,0,0,0|1,0,1]=4 10566 B12R1.28 Nc1cccc(NCCCF)[n]1 Amb25140618 [0,2,0,0,0,0|2,0,0]=4 10567 B12R1.28 Nc1cccc(NCCCO)[n]1 Amb25133228 [0,2,0,0,0,0|1,0,0]=3 10568 B12R1.28 O=C=NCCc1cccc(F)c1 Amb24392961 [0,2,0,0,0,0|0,0,2]=4 10569 B12R1.28 O=C=NCCc1cccc(c1)Br Amb17247243 [0,2,0,0,0,0|0,0,2]=4 10570 B12R1.28 O=C=NCCc1cccc(c1)C Amb17232366 [0,2,0,0,0,0|0,0,2]=4 10571 B12R1.28 O=CCCCc1cccc(Br)c1 Amb18048776 [0,2,0,0,0,0|0,0,1]=3 10572 B12R1.28 O=CCCSc1cccc(c1)C Amb17082972 [0,2,0,0,0,0|0,0,2]=4 10573 B12R1.28 O=CCCSc1cccc(c1)Cl Amb17082982 [0,2,0,0,0,0|0,0,2]=4 10574 B12R1.28 O=CNCCc1cccc(Br)c1 Amb24694394 [0,2,0,0,0,0|0,0,2]=4 10575 B12R1.28 O=CNCCc1cccc(F)c1 Amb25853482 [0,2,0,0,0,0|0,0,2]=4 10576 B12R1.28 OCCC#Cc1cc(Cl)ccc1 Amb18809453 [0,2,0,0,0,0|0,0,1]=3 10577 B12R1.28 OCCC#Cc1cc(F)c[n]c1 Amb18792621 [0,2,0,0,0,0|1,0,1]=4 10578 B12R1.28 OCCC#Cc1cc(F)ccc1 Amb18792548 [0,2,0,0,0,0|0,0,1]=3 10579 B12R1.28 OCCCCc1cccc(Br)c1 Amb20668830 [0,2,0,0,0,0|0,0,0]=2 10580 B12R1.28 OCCCNC1=CC=CC(=O)N1 Amb24487347 [0,2,0,0,0,0|1,0,0]=3 10581 B12R1.28 OCCCNC=1C=NNC(=O)C1 Amb25154034 [0,2,0,0,0,0|2,0,0]=4 10582 B12R1.28 OCCCNc1[n]c(Cl)cc[n]1 Amb25363166 [0,2,0,0,0,0|2,0,0]=4 10583 B12R1.28 OCCCNc1c[n]cc(Br)c1 Amb24410008 [0,2,0,0,0,0|1,0,0]=3 10584 B12R1.28 OCCCNc1c[n]cc(Cl)[n]1 Amb19018901 [0,2,0,0,0,0|2,0,0]=4 10585 B12R1.28 OCCCNc1cc(Cl)[n]c[n]1 Amb18306006 [0,2,0,0,0,0|2,0,0]=4 10586 B12R1.28 OCCCNc1cc[n]c(Cl)[n]1 Amb18308401 [0,2,0,0,0,0|2,0,0]=4 10587 B12R1.28 OCCCNc1cccc(Cl)[n]1 Amb21958816 [0,2,0,0,0,0|1,0,0]=3 10588 B12R1.28 OCCCNc1cccc(F)[n]1 Amb19011128 [0,2,0,0,0,0|1,0,0]=3 10589 B12R1.28 OCCCNc1cccc(I)c1 Amb25091300 [0,2,0,0,0,0|0,0,0]=2 10590 B12R1.28 OCCCNc1cccc(c1)Br Amb17306225 [0,2,0,0,0,0|0,0,0]=2 10591 B12R1.28 OCCCNc1cccc(c1)C Amb17306565 [0,2,0,0,0,0|0,0,0]=2 10592 B12R1.28 OCCCNc1cccc(c1)Cl Amb17307144 [0,2,0,0,0,0|0,0,0]=2 10593 B12R1.28 OCCCNc1cccc(c1)F Amb17306246 [0,2,0,0,0,0|0,0,0]=2 10594 B12R1.28 OCCNCc1cc[n]c(Br)c1 Amb21861822 [0,2,0,0,0,0|1,0,0]=3 10595 B12R1.28 OCCNCc1cccc(Cl)c1 Amb22284257 [0,2,0,0,0,0|0,0,0]=2 10596 B12R1.28 OCCNCc1cccc(F)c1 Amb24271193 [0,2,0,0,0,0|0,0,0]=2 10597 B12R1.28 OCCOCc1cccc(c1)Cl Amb2438435 [0,2,0,0,0,0|0,0,0]=2 10598 B12R1.28 OCC\C=C\c1cc(Cl)ccc1 Amb25357329 [0,2,0,0,0,0|0,0,1]=3 10599 B12R1.28 OCC\C=C\c1cc(F)ccc1 Amb25157956 [0,2,0,0,0,0|0,0,1]=3 10600 B12R1.28 OCC\N=C\c1cc(Cl)ccc1 Amb25069558 [0,2,0,0,0,0|0,0,1]=3 10601 B12R1.28 OC\C=C\Cc1cc(Cl)ccc1 Amb25725507 [0,2,0,0,0,0|0,0,1]=3 10602 B12R1.28 ONCCOc1cccc(c1)Br Amb17088424 [0,2,0,0,0,0|1,0,0]=3 10603 B12R1.28 ONCCOc1cccc(c1)C Amb17088415 [0,2,0,0,0,0|1,0,0]=3 10604 B12R1.28 ONCCOc1cccc(c1)Cl Amb17088421 [0,2,0,0,0,0|1,0,0]=3 10605 B12R1.28 ONCCOc1cccc(c1)F Amb17088418 [0,2,0,0,0,0|1,0,0]=3 10606 B12R1.28 Oc1cc(CCN=C=O)ccc1 Amb24636993 [0,2,0,0,0,0|0,0,2]=4 10607 B12R1.28 Oc1cc(CCNC=O)ccc1 Amb24399967 [0,2,0,0,0,0|0,0,2]=4 10608 B12R1.28 Oc1cccc(c1)\C=N\CCO Amb24628979 [0,2,0,0,0,0|0,0,1]=3 10609 B12R1.28 S=C=NCCc1cccc(c1)Br Amb17255960 [0,2,0,0,0,0|0,1,1]=4 10610 B12R1.28 S=C=NCCc1cccc(c1)C Amb17233309 [0,2,0,0,0,0|0,1,1]=4 10611 B12R1.28 SCCCCc1cccc(Br)c1 Amb18072286 [0,2,0,0,0,0|0,1,0]=3 10612 B12R1.28 SCCCCc1cccc(Cl)c1 Amb18565790 [0,2,0,0,0,0|0,1,0]=3 10613 B12R1.28 SCCCOc1cccc(c1)Br Amb17258958 [0,2,0,0,0,0|0,1,0]=3 10614 B12R1.28 SCCCOc1cccc(c1)Cl Amb17237589 [0,2,0,0,0,0|0,1,0]=3 10615 B12R1.28 SCCCOc1cccc(c1)F Amb17234297 [0,2,0,0,0,0|0,1,0]=3 10616 B12R1.28 [C-]#[N+]CCOc1cccc(C)c1 Amb25249438 [0,2,0,0,0,0|2,0,0]=4 10617 B12R1.28 [C-]#[N+]CCOc1cccc(O)c1 Amb25178461 [0,2,0,0,0,0|2,0,0]=4 10618 B12R1.50 BrCC(Oc1cccc(c1)Br)C Amb17291821 [0,2,0,0,0,0|2,0,0]=4 10619 B12R1.50 BrCC(Oc1cccc(c1)C)C Amb17248432 [0,2,0,0,0,0|2,0,0]=4 10620 B12R1.50 BrCC(Oc1cccc(c1)Cl)C Amb17261130 [0,2,0,0,0,0|2,0,0]=4 10621 B12R1.50 BrCC(Oc1cccc(c1)F)C Amb17250550 [0,2,0,0,0,0|2,0,0]=4 10622 B12R1.50 C#CC(N)Cc1cccc(Cl)c1 Amb25148721 [0,2,0,0,0,0|1,0,1]=4 10623 B12R1.50 C#CC(O)Cc1cccc(Br)c1 Amb24713259 [0,2,0,0,0,0|1,0,1]=4 10624 B12R1.50 C#CC(O)Cc1cccc(Cl)c1 Amb24362185 [0,2,0,0,0,0|1,0,1]=4 10625 B12R1.50 C#CC(O)Cc1cccc(F)c1 Amb25209915 [0,2,0,0,0,0|1,0,1]=4 10626 B12R1.50 C#C[C@@H](N)Cc1cccc(F)c1 Amb25825141 [0,2,0,0,0,0|1,0,1]=4 10627 B12R1.50 C=CC(N)Cc1cccc(Cl)c1 Amb25126466 [0,2,0,0,0,0|1,0,1]=4 10628 B12R1.50 C=CC(O)Cc1cccc(Cl)c1 Amb25343968 [0,2,0,0,0,0|1,0,1]=4 10629 B12R1.50 CC(CCl)Cc1cc(Br)ccc1 Amb24728303 [0,2,0,0,0,0|1,0,0]=3 10630 B12R1.50 CC(CN)Cc1cc(Br)ccc1 Amb18992227 [0,2,0,0,0,0|1,0,0]=3 10631 B12R1.50 CC(CN)Cc1cc(F)ccc1 Amb18299465 [0,2,0,0,0,0|1,0,0]=3 10632 B12R1.50 CC(CN)Cc1cc(O)ccc1 Amb24537853 [0,2,0,0,0,0|1,0,0]=3 10633 B12R1.50 CC(CN)Nc1cccc(F)c1 Amb18908739 [0,2,0,0,0,0|2,0,0]=4 10634 B12R1.50 CC(CN)Oc1cccc(Cl)c1 Amb18299442 [0,2,0,0,0,0|2,0,0]=4 10635 B12R1.50 CC(CN)Oc1cccc(Cl)c1 Amb19148897 [0,2,0,0,0,0|2,0,0]=4 10636 B12R1.50 CC(CN)Oc1cccc(F)c1 Amb18299439 [0,2,0,0,0,0|2,0,0]=4 10637 B12R1.50 CC(CN)Sc1cccc(Br)c1 Amb18301433 [0,2,0,0,0,0|2,0,0]=4 10638 B12R1.50 CC(CN)Sc1cccc(Cl)c1 Amb18299920 [0,2,0,0,0,0|2,0,0]=4 10639 B12R1.50 CC(CO)Cc1cc(Br)c[n]c1 Amb25803193 [0,2,0,0,0,0|1,0,0]=3 10640 B12R1.50 CC(CO)Cc1cc(Br)ccc1 Amb25729945 [0,2,0,0,0,0|0,0,0]=2 10641 B12R1.50 CC(CO)Cc1cc(Cl)ccc1 Amb25212222 [0,2,0,0,0,0|0,0,0]=2 10642 B12R1.50 CC(CO)Cc1cc(F)c[n]c1 Amb24654523 [0,2,0,0,0,0|1,0,0]=3 10643 B12R1.50 CC(CO)Cc1cc(F)ccc1 Amb25228330 [0,2,0,0,0,0|0,0,0]=2 10644 B12R1.50 CC(CO)Nc1c[n]cc(N)c1 Amb24531592 [0,2,0,0,0,0|2,0,0]=4 10645 B12R1.50 CC(CO)Nc1cc(Br)cc[n]1 Amb24705364 [0,2,0,0,0,0|2,0,0]=4 10646 B12R1.50 CC(CO)Nc1cc(N)cc[n]1 Amb18293573 [0,2,0,0,0,0|2,0,0]=4 10647 B12R1.50 CC(CO)Nc1cc[n]c(F)c1 Amb24419333 [0,2,0,0,0,0|2,0,0]=4 10648 B12R1.50 CC(CO)Nc1cccc(Br)[n]1 Amb24483480 [0,2,0,0,0,0|2,0,0]=4 10649 B12R1.50 CC(CO)Nc1cccc(Br)c1 Amb18290175 [0,2,0,0,0,0|1,0,0]=3 10650 B12R1.50 CC(CO)Nc1cccc(Cl)[n]1 Amb24682006 [0,2,0,0,0,0|2,0,0]=4 10651 B12R1.50 CC(CO)Nc1cccc(Cl)c1 Amb18290158 [0,2,0,0,0,0|1,0,0]=3 10652 B12R1.50 CC(CO)Nc1cccc(F)[n]1 Amb18290678 [0,2,0,0,0,0|2,0,0]=4 10653 B12R1.50 CC(CO)Nc1cccc(F)c1 Amb18971844 [0,2,0,0,0,0|1,0,0]=3 10654 B12R1.50 CC(CO)Oc1cc(O)ccc1 Amb25320205 [0,2,0,0,0,0|1,0,0]=3 10655 B12R1.50 CC(CO)Oc1cccc(N)c1 Amb25849749 [0,2,0,0,0,0|1,0,0]=3 10656 B12R1.50 CC(CO)Sc1cc(O)ccc1 Amb25130867 [0,2,0,0,0,0|1,0,0]=3 10657 B12R1.50 CC(CO)Sc1cc[n]c(F)c1 Amb24637560 [0,2,0,0,0,0|2,0,0]=4 10658 B12R1.50 CC(CO)Sc1cccc(Br)c1 Amb24361119 [0,2,0,0,0,0|1,0,0]=3 10659 B12R1.50 CC(CO)Sc1cccc(F)[n]1 Amb25247749 [0,2,0,0,0,0|2,0,0]=4 10660 B12R1.50 CC(CO)Sc1cccc(F)c1 Amb25792582 [0,2,0,0,0,0|1,0,0]=3 10661 B12R1.50 CC(CO)Sc1cccc(N)[n]1 Amb25758425 [0,2,0,0,0,0|2,0,0]=4 10662 B12R1.50 CC(CO)Sc1cccc(N)c1 Amb24697150 [0,2,0,0,0,0|1,0,0]=3 10663 B12R1.50 CC(Cc1cc(O)ccc1)CO Amb24579423 [0,2,0,0,0,0|0,0,0]=2 10664 B12R1.50 CC(Cc1cccc(Br)c1)C#N Amb25159927 [0,2,0,0,0,0|1,0,1]=4 10665 B12R1.50 CC(Cc1cccc(Br)c1)NN Amb25342052 [0,2,0,0,0,0|2,0,0]=4 10666 B12R1.50 CC(Cc1cccc(Cl)c1)C#N Amb25762801 [0,2,0,0,0,0|1,0,1]=4 10667 B12R1.50 CC(Cc1cccc(Cl)c1)C=O Amb25804355 [0,2,0,0,0,0|0,0,2]=4 10668 B12R1.50 CC(Cc1cccc(Cl)c1)NN Amb24434144 [0,2,0,0,0,0|2,0,0]=4 10669 B12R1.50 CC(Cc1cccc(F)c1)NN Amb25056305 [0,2,0,0,0,0|2,0,0]=4 10670 B12R1.50 CC(Cc1cccc(F)c1)NO Amb25056304 [0,2,0,0,0,0|1,0,0]=3 10671 B12R1.50 CC(Cc1cccc(I)c1)C=O Amb25850018 [0,2,0,0,0,0|0,0,2]=4 10672 B12R1.50 CC(Cc1cccc(N)c1)C=O Amb25251154 [0,2,0,0,0,0|0,0,2]=4 10673 B12R1.50 CC(Cc1cccc(O)c1)CBr Amb24444691 [0,2,0,0,0,0|1,0,0]=3 10674 B12R1.50 CC(Cc1cccc(O)c1)CCl Amb24537852 [0,2,0,0,0,0|1,0,0]=3 10675 B12R1.50 CCC(=O)Cc1cccc(c1)Br Amb17477613 [0,2,0,0,0,0|1,0,1]=4 10676 B12R1.50 CCC(=O)Cc1cccc(c1)C Amb17138543 [0,2,0,0,0,0|1,0,1]=4 10677 B12R1.50 CCC(=O)Cc1cccc(c1)Cl Amb17139042 [0,2,0,0,0,0|1,0,1]=4 10678 B12R1.50 CCC(=O)Cc1cccc(c1)F Amb17138604 [0,2,0,0,0,0|1,0,1]=4 10679 B12R1.50 CCC(Br)Cc1cc(Br)ccc1 Amb18049408 [0,2,0,0,0,0|1,0,0]=3 10680 B12R1.50 CCC(Br)Cc1cc(F)ccc1 Amb25039883 [0,2,0,0,0,0|1,0,0]=3 10681 B12R1.50 CCC(Br)Cc1cc(N)cc[n]1 Amb24082392 [0,2,0,0,0,0|2,0,0]=4 10682 B12R1.50 CCC(C)Oc1cccc(I)c1 Amb24422625 [0,2,0,0,0,0|2,0,0]=4 10683 B12R1.50 CCC(C)Sc1cccc(Br)c1 Amb25706089 [0,2,0,0,0,0|2,0,0]=4 10684 B12R1.50 CCC(C)Sc1cccc(N)c1 Amb18289356 [0,2,0,0,0,0|2,0,0]=4 10685 B12R1.50 CCC(C)Sc1cccc(O)c1 Amb25136875 [0,2,0,0,0,0|2,0,0]=4 10686 B12R1.50 CCC(Cc1cccc(c1)Br)Cl Amb17477597 [0,2,0,0,0,0|1,0,0]=3 10687 B12R1.50 CCC(Cc1cccc(c1)Br)O Amb17477580 [0,2,0,0,0,0|1,0,0]=3 10688 B12R1.50 CCC(Cc1cccc(c1)C)Cl Amb17477424 [0,2,0,0,0,0|1,0,0]=3 10689 B12R1.50 CCC(Cc1cccc(c1)C)O Amb17138582 [0,2,0,0,0,0|1,0,0]=3 10690 B12R1.50 CCC(Cc1cccc(c1)Cl)Cl Amb17477605 [0,2,0,0,0,0|1,0,0]=3 10691 B12R1.50 CCC(Cc1cccc(c1)Cl)O Amb17139102 [0,2,0,0,0,0|1,0,0]=3 10692 B12R1.50 CCC(Cc1cccc(c1)F)O Amb17138636 [0,2,0,0,0,0|1,0,0]=3 10693 B12R1.50 CCC(Cl)Cc1cc(Br)c[n]c1 Amb25036374 [0,2,0,0,0,0|2,0,0]=4 10694 B12R1.50 CCC(Cl)Cc1cc(F)ccc1 Amb19046367 [0,2,0,0,0,0|1,0,0]=3 10695 B12R1.50 CCC(N)Cc1cc(Cl)[n]cc1 Amb24460329 [0,2,0,0,0,0|2,0,0]=4 10696 B12R1.50 CCC(N)Cc1cc(I)ccc1 Amb25800100 [0,2,0,0,0,0|1,0,0]=3 10697 B12R1.50 CCC(N)Cc1cccc(Br)[n]1 Amb24400334 [0,2,0,0,0,0|2,0,0]=4 10698 B12R1.50 CCC(N)Cc1cccc(F)[n]1 Amb25252198 [0,2,0,0,0,0|2,0,0]=4 10699 B12R1.50 CCC(O)Cc1cc(Br)c[n]c1 Amb24593414 [0,2,0,0,0,0|2,0,0]=4 10700 B12R1.50 CCC(Oc1cccc(c1)N)C Amb2189170 [0,2,0,0,0,0|2,0,0]=4 10701 B12R1.50 CCN(C)Cc1cccc(Cl)c1 Amb24619073 [0,2,0,0,0,0|2,0,0]=4 10702 B12R1.50 CCN(C)Cc1cccc(Cl)c1 Amb25769163 [0,2,0,0,0,0|2,0,0]=4 10703 B12R1.50 CCS(=O)Cc1cc(N)ccc1 Amb18977540 [0,2,0,0,0,0|2,0,0]=4 10704 B12R1.50 CC[C@@H](N)Cc1cc(F)ccc1 Amb24535474 [0,2,0,0,0,0|1,0,0]=3 10705 B12R1.50 CC[C@H](C)Oc1cccc(O)c1 Amb24497029 [0,2,0,0,0,0|2,0,0]=4 10706 B12R1.50 CC[C@H](N)Cc1cc(Cl)ccc1 Amb24668259 [0,2,0,0,0,0|1,0,0]=3 10707 B12R1.50 CNC(C)Cc1cccc(F)c1 Amb18792939 [0,2,0,0,0,0|2,0,0]=4 10708 B12R1.50 CNC(C)Cc1cccc(S)c1 Amb24542790 [0,2,0,0,0,0|2,0,0]=4 10709 B12R1.50 CNC(Cc1cccc(c1)F)C Amb17614425 [0,2,0,0,0,0|2,0,0]=4 10710 B12R1.50 CN[C@@H](C)Cc1cccc(O)c1 Amb25697180 [0,2,0,0,0,0|2,0,0]=4 10711 B12R1.50 C[C@@H](CO)Nc1cc(Br)cc[n]1 Amb25160518 [0,2,0,0,0,0|2,0,0]=4 10712 B12R1.50 C[C@@H](CO)Nc1cccc(Cl)[n]1 Amb24476491 [0,2,0,0,0,0|2,0,0]=4 10713 B12R1.50 C[C@@H](CO)Nc1cccc(Cl)c1 Amb22831872 [0,2,0,0,0,0|1,0,0]=3 10714 B12R1.50 C[C@@H](CO)Nc1cccc(F)[n]1 Amb25160519 [0,2,0,0,0,0|2,0,0]=4 10715 B12R1.50 C[C@@H](CO)Oc1cccc(Cl)c1 Amb24618891 [0,2,0,0,0,0|1,0,0]=3 10716 B12R1.50 C[C@H](CO)Oc1cccc(Cl)c1 Amb24414999 [0,2,0,0,0,0|1,0,0]=3 10717 B12R1.50 C\C(\CO)=C\c1cc(O)ccc1 Amb25369722 [0,2,0,0,0,0|0,0,2]=4 10718 B12R1.50 C\C(\Cc1cc(O)ccc1)=N/O Amb24487234 [0,2,0,0,0,0|1,0,1]=4 10719 B12R1.50 C\C(\Cc1cc(O)ccc1)=N\O Amb25227653 [0,2,0,0,0,0|1,0,1]=4 10720 B12R1.50 C\C(\Cc1cccc(Br)c1)=N\O Amb24634595 [0,2,0,0,0,0|1,0,1]=4 10721 B12R1.50 C\C(\Cc1cccc(F)c1)=N\O Amb25225688 [0,2,0,0,0,0|1,0,1]=4 10722 B12R1.50 Cc1c[n]cc(CC(C)CN)c1 Amb25702058 [0,2,0,0,0,0|2,0,0]=4 10723 B12R1.50 Cc1cc(CC(=O)CBr)ccc1 Amb25089939 [0,2,0,0,0,0|1,0,1]=4 10724 B12R1.50 Cc1cc(CC(=O)CN)ccc1 Amb18829247 [0,2,0,0,0,0|1,0,1]=4 10725 B12R1.50 Cc1cc(CC(=O)CO)ccc1 Amb18563612 [0,2,0,0,0,0|0,0,1]=3 10726 B12R1.50 Cc1cc(CC(=O)NO)ccc1 Amb18798398 [0,2,0,0,0,0|1,0,1]=4 10727 B12R1.50 Cc1cc(CC(N)C#N)ccc1 Amb24653997 [0,2,0,0,0,0|1,0,1]=4 10728 B12R1.50 Cc1cc(CC(N)CF)ccc1 Amb24708150 [0,2,0,0,0,0|1,0,0]=3 10729 B12R1.50 Cc1cc(CC(N)CO)c[n]c1 Amb25374367 [0,2,0,0,0,0|1,0,0]=3 10730 B12R1.50 Cc1cc(CC(O)C#C)ccc1 Amb24457341 [0,2,0,0,0,0|1,0,1]=4 10731 B12R1.50 Cc1cc(CC(O)C=C)ccc1 Amb24431083 [0,2,0,0,0,0|1,0,1]=4 10732 B12R1.50 Cc1cc(CC(O)CCl)ccc1 Amb24711431 [0,2,0,0,0,0|1,0,0]=3 10733 B12R1.50 Cc1cc(CC(O)CO)ccc1 Amb24397224 [0,2,0,0,0,0|0,0,0]=2 10734 B12R1.50 Cc1cc(C[C@@H](N)CO)ccc1 Amb24362986 [0,2,0,0,0,0|0,0,0]=2 10735 B12R1.50 Cc1cc(C[C@@H](O)C=C)ccc1 Amb25155807 [0,2,0,0,0,0|1,0,1]=4 10736 B12R1.50 Cc1cc(C[C@@H](O)CCl)ccc1 Amb24652370 [0,2,0,0,0,0|1,0,0]=3 10737 B12R1.50 Cc1cc(cc[n]1)SC(C)CO Amb25373441 [0,2,0,0,0,0|2,0,0]=4 10738 B12R1.50 Cc1cc(ccc1)OC(=O)CO Amb25160233 [0,2,0,0,0,0|1,0,1]=4 10739 B12R1.50 Cc1cc[n]c(c1)NC(C)CO Amb18293563 [0,2,0,0,0,0|2,0,0]=4 10740 B12R1.50 Cc1cccc(CC(Br)CC)c1 Amb24483315 [0,2,0,0,0,0|1,0,0]=3 10741 B12R1.50 Cc1cccc(CC(C)C=O)c1 Amb25120274 [0,2,0,0,0,0|0,0,2]=4 10742 B12R1.50 Cc1cccc(CC(C)CO)c1 Amb24341616 [0,2,0,0,0,0|0,0,0]=2 10743 B12R1.50 Cc1cccc(CC(N)CO)[n]1 Amb25737795 [0,2,0,0,0,0|1,0,0]=3 10744 B12R1.50 Cc1cccc(CN(C)CC)c1 Amb25749187 [0,2,0,0,0,0|2,0,0]=4 10745 B12R1.50 Cc1cccc(CS(=O)CC)c1 Amb24408190 [0,2,0,0,0,0|2,0,0]=4 10746 B12R1.50 Cc1cccc(C\C(\C)=N\O)c1 Amb24487383 [0,2,0,0,0,0|1,0,1]=4 10747 B12R1.50 Cc1cccc(NC(C)CO)[n]1 Amb18972552 [0,2,0,0,0,0|2,0,0]=4 10748 B12R1.50 Cc1cccc([n]1)SC(C)CO Amb24703024 [0,2,0,0,0,0|2,0,0]=4 10749 B12R1.50 Cc1cccc(c1)NC(C)CN Amb18251702 [0,2,0,0,0,0|2,0,0]=4 10750 B12R1.50 Cc1cccc(c1)NC(C)CO Amb18971818 [0,2,0,0,0,0|1,0,0]=3 10751 B12R1.50 Cc1cccc(c1)OC(C)CC Amb24484235 [0,2,0,0,0,0|2,0,0]=4 10752 B12R1.50 Cc1cccc(c1)SC(C)CN Amb18992832 [0,2,0,0,0,0|2,0,0]=4 10753 B12R1.50 Cc1cccc(c1)SC(C)CO Amb25792350 [0,2,0,0,0,0|1,0,0]=3 10754 B12R1.50 Cc1cccc(c1)SC(O)CC Amb22228367 [0,2,0,0,0,0|2,0,0]=4 10755 B12R1.50 ClCC(Oc1cccc(c1)Br)C Amb17261133 [0,2,0,0,0,0|2,0,0]=4 10756 B12R1.50 ClCC(Oc1cccc(c1)C)C Amb17234169 [0,2,0,0,0,0|2,0,0]=4 10757 B12R1.50 ClCC(Oc1cccc(c1)Cl)C Amb17238290 [0,2,0,0,0,0|2,0,0]=4 10758 B12R1.50 ClCC(Oc1cccc(c1)F)C Amb17234614 [0,2,0,0,0,0|2,0,0]=4 10759 B12R1.50 N#CC(Cc1cccc(c1)Br)Br Amb17376789 [0,2,0,0,0,0|1,0,1]=4 10760 B12R1.50 N#CC(Cc1cccc(c1)Br)Cl Amb17204672 [0,2,0,0,0,0|1,0,1]=4 10761 B12R1.50 N#CC(Cc1cccc(c1)C)Br Amb2520871 [0,2,0,0,0,0|1,0,1]=4 10762 B12R1.50 N#CC(Cc1cccc(c1)C)Cl Amb17204320 [0,2,0,0,0,0|1,0,1]=4 10763 B12R1.50 N#CC(Cc1cccc(c1)Cl)Br Amb17349964 [0,2,0,0,0,0|1,0,1]=4 10764 B12R1.50 N#CC(Cc1cccc(c1)Cl)Cl Amb17204382 [0,2,0,0,0,0|1,0,1]=4 10765 B12R1.50 N#CC(Cc1cccc(c1)F)Br Amb17344013 [0,2,0,0,0,0|1,0,1]=4 10766 B12R1.50 N#CC(Cc1cccc(c1)F)Cl Amb17204332 [0,2,0,0,0,0|1,0,1]=4 10767 B12R1.50 N#CC(O)Cc1cccc(F)c1 Amb24372046 [0,2,0,0,0,0|1,0,1]=4 10768 B12R1.50 NC(CO)CC1=CC=CC(=O)N1 Amb25853681 [0,2,0,0,0,0|1,0,0]=3 10769 B12R1.50 NC(CO)Cc1cc(Br)[n]cc1 Amb25241686 [0,2,0,0,0,0|1,0,0]=3 10770 B12R1.50 NC(CO)Cc1cc(F)ccc1 Amb22751648 [0,2,0,0,0,0|0,0,0]=2 10771 B12R1.50 NC(CO)Cc1cc(I)ccc1 Amb24694473 [0,2,0,0,0,0|0,0,0]=2 10772 B12R1.50 NC(Cc1cc(F)ccc1)CF Amb25267761 [0,2,0,0,0,0|1,0,0]=3 10773 B12R1.50 NC(Cc1cccc(F)c1)C#N Amb24596484 [0,2,0,0,0,0|1,0,1]=4 10774 B12R1.50 NCC(=O)Cc1cc(Br)ccc1 Amb18160371 [0,2,0,0,0,0|1,0,1]=4 10775 B12R1.50 NCC(=O)Cc1cc(Cl)ccc1 Amb18823030 [0,2,0,0,0,0|1,0,1]=4 10776 B12R1.50 NCC(=O)Cc1cc(F)ccc1 Amb18199528 [0,2,0,0,0,0|1,0,1]=4 10777 B12R1.50 NCC(=O)Cc1cc(O)ccc1 Amb18251724 [0,2,0,0,0,0|1,0,1]=4 10778 B12R1.50 NCC(Cc1cccc(c1)Br)O Amb17248846 [0,2,0,0,0,0|1,0,0]=3 10779 B12R1.50 NCC(Cc1cccc(c1)C)O Amb17232548 [0,2,0,0,0,0|1,0,0]=3 10780 B12R1.50 NCC(Cc1cccc(c1)Cl)O Amb17234266 [0,2,0,0,0,0|1,0,0]=3 10781 B12R1.50 NCC(F)Cc1cc(Cl)ccc1 Amb25078215 [0,2,0,0,0,0|1,0,0]=3 10782 B12R1.50 NCC(F)Cc1cc(F)ccc1 Amb25667301 [0,2,0,0,0,0|1,0,0]=3 10783 B12R1.50 NCC(N)Cc1cccc(O)c1 Amb25097207 [0,2,0,0,0,0|1,0,0]=3 10784 B12R1.50 NCC(Nc1cccc(c1)Cl)C Amb17226673 [0,2,0,0,0,0|2,0,0]=4 10785 B12R1.50 NCC(O)Cc1cc(Br)c[n]c1 Amb25740056 [0,2,0,0,0,0|2,0,0]=4 10786 B12R1.50 NCC(O)Cc1cc(F)ccc1 Amb18563898 [0,2,0,0,0,0|1,0,0]=3 10787 B12R1.50 N[C@@H](Cc1cc(O)ccc1)CO Amb22233156 [0,2,0,0,0,0|0,0,0]=2 10788 B12R1.50 N[C@H](CO)Cc1cc(Cl)ccc1 Amb22233154 [0,2,0,0,0,0|0,0,0]=2 10789 B12R1.50 N\C(\Cc1cc(O)ccc1)=N\O Amb25103462 [0,2,0,0,0,0|1,0,1]=4 10790 B12R1.50 Nc1cc(CC(F)CN)cc[n]1 Amb25667302 [0,2,0,0,0,0|2,0,0]=4 10791 B12R1.50 Nc1cc(CC(O)CN)cc[n]1 Amb24720093 [0,2,0,0,0,0|2,0,0]=4 10792 B12R1.50 Nc1cccc(CC(N)CN)c1 Amb24559863 [0,2,0,0,0,0|1,0,0]=3 10793 B12R1.50 Nc1cccc(C[C@H](N)CO)c1 Amb22233155 [0,2,0,0,0,0|0,0,0]=2 10794 B12R1.50 Nc1cccc(C\C(\N)=N/O)c1 Amb24711722 [0,2,0,0,0,0|1,0,1]=4 10795 B12R1.50 O=C(CF)Cc1cc(Cl)ccc1 Amb23454832 [0,2,0,0,0,0|1,0,1]=4 10796 B12R1.50 O=C(Cc1cc(Br)ccc1)CBr Amb22233785 [0,2,0,0,0,0|1,0,1]=4 10797 B12R1.50 O=C(Cc1cccc(Cl)c1)CBr Amb24627962 [0,2,0,0,0,0|1,0,1]=4 10798 B12R1.50 O=CC(Cc1cccc(c1)Br)Cl Amb17204708 [0,2,0,0,0,0|0,0,2]=4 10799 B12R1.50 O=CC(Cc1cccc(c1)C)Cl Amb17204327 [0,2,0,0,0,0|0,0,2]=4 10800 B12R1.50 O=CC(Cc1cccc(c1)Cl)Cl Amb17204402 [0,2,0,0,0,0|0,0,2]=4 10801 B12R1.50 O=CC(Cc1cccc(c1)F)Cl Amb17204343 [0,2,0,0,0,0|0,0,2]=4 10802 B12R1.50 O=CC(F)Cc1cccc(Cl)c1 Amb24341527 [0,2,0,0,0,0|0,0,2]=4 10803 B12R1.50 OC(CCl)Sc1cc(Cl)ccc1 Amb24065279 [0,2,0,0,0,0|2,0,0]=4 10804 B12R1.50 OC(Cc1cc(Cl)ccc1)CCl Amb25780609 [0,2,0,0,0,0|1,0,0]=3 10805 B12R1.50 OC(Cc1cccc(Br)c1)C=O Amb25802176 [0,2,0,0,0,0|0,0,2]=4 10806 B12R1.50 OC(Cc1cccc(Cl)c1)C=O Amb25107935 [0,2,0,0,0,0|0,0,2]=4 10807 B12R1.50 OC(Cc1cccc(F)c1)C=O Amb25047798 [0,2,0,0,0,0|0,0,2]=4 10808 B12R1.50 OC(Cc1cccc(F)c1)CCl Amb25266882 [0,2,0,0,0,0|1,0,0]=3 10809 B12R1.50 OCC(=O)Cc1cc(Br)ccc1 Amb18572003 [0,2,0,0,0,0|0,0,1]=3 10810 B12R1.50 OCC(=O)Cc1cc(Cl)ccc1 Amb18564304 [0,2,0,0,0,0|0,0,1]=3 10811 B12R1.50 OCC(=O)Cc1cc(F)ccc1 Amb25232023 [0,2,0,0,0,0|0,0,1]=3 10812 B12R1.50 OCC(=O)Nc1cccc(c1)Cl Amb1110353 [0,2,0,0,0,0|1,0,1]=4 10813 B12R1.50 OCC(=O)Nc1cccc(c1)F Amb1110282 [0,2,0,0,0,0|1,0,1]=4 10814 B12R1.50 OCC(=O)Oc1cccc(Cl)c1 Amb25043439 [0,2,0,0,0,0|1,0,1]=4 10815 B12R1.50 OCC(Cc1cccc(c1)Br)N Amb17062712 [0,2,0,0,0,0|0,0,0]=2 10816 B12R1.50 OCC(Cc1cccc(c1)C)N Amb17062686 [0,2,0,0,0,0|0,0,0]=2 10817 B12R1.50 OCC(Cc1cccc(c1)Cl)N Amb17062695 [0,2,0,0,0,0|0,0,0]=2 10818 B12R1.50 OCC(Cc1cccc(c1)O)N Amb17062711 [0,2,0,0,0,0|0,0,0]=2 10819 B12R1.50 OCC(O)C[n+]1cc(Br)ccc1 Amb21994488 [0,2,0,0,0,0|1,0,0]=3 10820 B12R1.50 OCC(O)Cc1cccc(Cl)c1 Amb25281635 [0,2,0,0,0,0|0,0,0]=2 10821 B12R1.50 OCC(Oc1cccc(c1)Br)C Amb17249277 [0,2,0,0,0,0|1,0,0]=3 10822 B12R1.50 OCC(Oc1cccc(c1)C)C Amb17232601 [0,2,0,0,0,0|1,0,0]=3 10823 B12R1.50 OCC(Oc1cccc(c1)Cl)C Amb17234357 [0,2,0,0,0,0|1,0,0]=3 10824 B12R1.50 OCC(Oc1cccc(c1)F)C Amb17232740 [0,2,0,0,0,0|1,0,0]=3 10825 B12R1.50 OCC(S)Cc1cc(F)ccc1 Amb25177551 [0,2,0,0,0,0|0,0,0]=2 10826 B12R1.50 ONC(=O)Cc1cccc(Br)c1 Amb25751442 [0,2,0,0,0,0|1,0,1]=4 10827 B12R1.50 ONC(=O)Cc1cccc(Cl)c1 Amb19075673 [0,2,0,0,0,0|1,0,1]=4 10828 B12R1.50 O\N=C(\Cc1cccc(c1)Cl)/N Amb1117604 [0,2,0,0,0,0|1,0,1]=4 10829 B12R1.50 Oc1cc(CC(=O)NO)ccc1 Amb18788532 [0,2,0,0,0,0|1,0,1]=4 10830 B12R1.50 Oc1cc(CC(F)C=O)ccc1 Amb25836660 [0,2,0,0,0,0|0,0,2]=4 10831 B12R1.50 Oc1cccc(CC(O)CO)c1 Amb24497069 [0,2,0,0,0,0|0,0,0]=2 10832 B12R1.100 BrCCOc1cc(C)cc(c1)C Amb1153291 [0,2,0,0,0,0|2,0,0]=4 10833 B12R1.100 C#CCCc1cc(O)cc(O)c1 Amb24633549 [0,2,0,0,0,0|1,0,1]=4 10834 B12R1.100 C=CCCc1cc(F)cc(Cl)c1 Amb24615616 [0,2,0,0,0,0|1,0,1]=4 10835 B12R1.100 CC1=CC(=O)C=C(CCCC)O1 Amb24633495 [0,2,0,0,0,0|2,0,0]=4 10836 B12R1.100 CCCCC1=CC(O)=CC(=O)O1 Amb25201813 [0,2,0,0,0,0|2,0,0]=4 10837 B12R1.100 CCCCc1cc(Br)cc(Br)c1 Amb19944051 [0,2,0,0,0,0|1,0,0]=3 10838 B12R1.100 CCCCc1cc(C)cc(C)c1 Amb20621114 [0,2,0,0,0,0|1,0,0]=3 10839 B12R1.100 CCCCc1cc(C)nc(c1)C Amb10561382 [0,2,0,0,0,0|2,0,0]=4 10840 B12R1.100 CCCCc1cc(F)cc(F)c1 Amb20620632 [0,2,0,0,0,0|1,0,0]=3 10841 B12R1.100 CCCCc1cc(O)cc(O)c1 Amb24331632 [0,2,0,0,0,0|1,0,0]=3 10842 B12R1.100 CCCNc1cc(F)cc(N)c1 Amb18289354 [0,2,0,0,0,0|2,0,0]=4 10843 B12R1.100 CCCOc1cc(C)cc(c1)Br Amb17506057 [0,2,0,0,0,0|2,0,0]=4 10844 B12R1.100 CCCOc1cc(Cl)cc(Cl)c1 Amb21964743 [0,2,0,0,0,0|2,0,0]=4 10845 B12R1.100 CCCOc1cc(N)cc(N)c1 Amb24405495 [0,2,0,0,0,0|2,0,0]=4 10846 B12R1.100 CCCOc1cc(S)cc(N)c1 Amb25830785 [0,2,0,0,0,0|2,0,0]=4 10847 B12R1.100 CCCSc1cc(F)cc(N)c1 Amb18969323 [0,2,0,0,0,0|2,0,0]=4 10848 B12R1.100 CCNCc1cc(Br)cc(Cl)c1 Amb25198177 [0,2,0,0,0,0|2,0,0]=4 10849 B12R1.100 CCNCc1cc(Cl)cc(N)c1 Amb24549743 [0,2,0,0,0,0|2,0,0]=4 10850 B12R1.100 CCNCc1cc(F)cc(F)c1 Amb24066802 [0,2,0,0,0,0|2,0,0]=4 10851 B12R1.100 CCNCc1cc(F)cc(O)c1 Amb25034912 [0,2,0,0,0,0|2,0,0]=4 10852 B12R1.100 CCNCc1cc(I)cc(N)c1 Amb25239939 [0,2,0,0,0,0|2,0,0]=4 10853 B12R1.100 CCOCc1cc(Br)cc(F)c1 Amb22900173 [0,2,0,0,0,0|2,0,0]=4 10854 B12R1.100 CNCCc1cc(Br)cc(Br)c1 Amb24536197 [0,2,0,0,0,0|2,0,0]=4 10855 B12R1.100 CNCCc1cc(C)cc(C)c1 Amb18993052 [0,2,0,0,0,0|2,0,0]=4 10856 B12R1.100 CNCCc1cc(Cl)cc(Cl)c1 Amb25821763 [0,2,0,0,0,0|2,0,0]=4 10857 B12R1.100 CNCCc1cc(F)cc(Br)c1 Amb25710136 [0,2,0,0,0,0|2,0,0]=4 10858 B12R1.100 CNCCc1cc(F)cc(F)c1 Amb18993626 [0,2,0,0,0,0|2,0,0]=4 10859 B12R1.100 CNCCc1cc(O)cc(Br)c1 Amb25682658 [0,2,0,0,0,0|2,0,0]=4 10860 B12R1.100 CNCCc1cc(O)cc(Cl)c1 Amb25331884 [0,2,0,0,0,0|2,0,0]=4 10861 B12R1.100 CNCCc1cc(O)cc(F)c1 Amb25226474 [0,2,0,0,0,0|2,0,0]=4 10862 B12R1.100 CSCCc1cc(Cl)cc(Cl)c1 Amb25160476 [0,2,0,0,0,0|2,0,0]=4 10863 B12R1.100 Cc1cc(Br)cc(CCNC)c1 Amb25820241 [0,2,0,0,0,0|2,0,0]=4 10864 B12R1.100 Cc1cc(Br)cc(c1)NCCN Amb25068548 [0,2,0,0,0,0|2,0,0]=4 10865 B12R1.100 Cc1cc(Br)cc(c1)NCCO Amb24653429 [0,2,0,0,0,0|1,0,0]=3 10866 B12R1.100 Cc1cc(Br)cc(c1)OCCN Amb23590664 [0,2,0,0,0,0|2,0,0]=4 10867 B12R1.100 Cc1cc(CCC#N)cc(Cl)c1 Amb25270535 [0,2,0,0,0,0|1,0,1]=4 10868 B12R1.100 Cc1cc(CCC=O)cc(Br)c1 Amb25141592 [0,2,0,0,0,0|0,0,2]=4 10869 B12R1.100 Cc1cc(CCC=O)cc(C)c1 Amb18798122 [0,2,0,0,0,0|0,0,2]=4 10870 B12R1.100 Cc1cc(CCC=O)cc(F)c1 Amb25839793 [0,2,0,0,0,0|0,0,2]=4 10871 B12R1.100 Cc1cc(CCCBr)cc(F)c1 Amb24453699 [0,2,0,0,0,0|1,0,0]=3 10872 B12R1.100 Cc1cc(CCCBr)cc(I)c1 Amb24605669 [0,2,0,0,0,0|1,0,0]=3 10873 B12R1.100 Cc1cc(CCCCl)cc(C)c1 Amb19068163 [0,2,0,0,0,0|1,0,0]=3 10874 B12R1.100 Cc1cc(CCCCl)cc(O)c1 Amb25217661 [0,2,0,0,0,0|1,0,0]=3 10875 B12R1.100 Cc1cc(CCCF)[n]c(N)c1 Amb24373060 [0,2,0,0,0,0|2,0,0]=4 10876 B12R1.100 Cc1cc(CCCN)[n]c(C)c1 Amb25304204 [0,2,0,0,0,0|2,0,0]=4 10877 B12R1.100 Cc1cc(CCCN)cc(Br)c1 Amb25851408 [0,2,0,0,0,0|1,0,0]=3 10878 B12R1.100 Cc1cc(CCCN)cc(Cl)c1 Amb25282299 [0,2,0,0,0,0|1,0,0]=3 10879 B12R1.100 Cc1cc(CCCO)cc(C)c1 Amb18798360 [0,2,0,0,0,0|0,0,0]=2 10880 B12R1.100 Cc1cc(CCNN)cc(F)c1 Amb24439958 [0,2,0,0,0,0|2,0,0]=4 10881 B12R1.100 Cc1cc(CNCC)cc(Br)c1 Amb25841852 [0,2,0,0,0,0|2,0,0]=4 10882 B12R1.100 Cc1cc(Cl)cc(c1)OCCC Amb25265303 [0,2,0,0,0,0|2,0,0]=4 10883 B12R1.100 Cc1cc(Cl)cc(c1)OCCN Amb24410300 [0,2,0,0,0,0|2,0,0]=4 10884 B12R1.100 Cc1cc(F)cc(CCNC)c1 Amb25841993 [0,2,0,0,0,0|2,0,0]=4 10885 B12R1.100 Cc1cc(F)cc(c1)NCCN Amb25034985 [0,2,0,0,0,0|2,0,0]=4 10886 B12R1.100 Cc1cc(I)cc(c1)NCCO Amb25160175 [0,2,0,0,0,0|1,0,0]=3 10887 B12R1.100 Cc1cc(N)[n]c(CCCN)c1 Amb24724890 [0,2,0,0,0,0|2,0,0]=4 10888 B12R1.100 Cc1cc(N)cc(CCCC)c1 Amb24457282 [0,2,0,0,0,0|1,0,0]=3 10889 B12R1.100 Cc1cc(N)cc(c1)NCCN Amb25098174 [0,2,0,0,0,0|2,0,0]=4 10890 B12R1.100 Cc1cc(N)cc(c1)OCCC Amb25345513 [0,2,0,0,0,0|2,0,0]=4 10891 B12R1.100 Cc1cc(O)cc(CCCC)c1 Amb25102928 [0,2,0,0,0,0|1,0,0]=3 10892 B12R1.100 Cc1cc(O)cc(c1)OCCC Amb25109724 [0,2,0,0,0,0|2,0,0]=4 10893 B12R1.100 Cc1cc(\C=C\CO)cc(C)c1 Amb23555572 [0,2,0,0,0,0|0,0,2]=4 10894 B12R1.100 Cc1cc(cc(C)[n]1)NCCO Amb24493543 [0,2,0,0,0,0|2,0,0]=4 10895 B12R1.100 Cc1cc(cc(C)[n]1)OCCO Amb25323364 [0,2,0,0,0,0|2,0,0]=4 10896 B12R1.100 Cc1cc(cc(C)[n]1)SCCO Amb25857668 [0,2,0,0,0,0|2,0,0]=4 10897 B12R1.100 Cc1cc(cc(C)c1)C#CCO Amb18792231 [0,2,0,0,0,0|0,0,2]=4 10898 B12R1.100 Cc1cc(cc(C)c1)SCCN Amb18909241 [0,2,0,0,0,0|2,0,0]=4 10899 B12R1.100 Cc1cc(cc(F)c1)C#CCO Amb25825086 [0,2,0,0,0,0|0,0,2]=4 10900 B12R1.100 Cc1cc(cc(N)c1)NCCO Amb24431310 [0,2,0,0,0,0|1,0,0]=3 10901 B12R1.100 Cc1cc(cc(N)c1)SCCO Amb24462266 [0,2,0,0,0,0|1,0,0]=3 10902 B12R1.100 Cc1cc(cc(O)c1)OCCCl Amb25233023 [0,2,0,0,0,0|2,0,0]=4 10903 B12R1.100 ClCCCc1cc(Cl)cc(Cl)c1 Amb24656658 [0,2,0,0,0,0|1,0,0]=3 10904 B12R1.100 ClCCNc1cc(C)cc(c1)C Amb17335664 [0,2,0,0,0,0|2,0,0]=4 10905 B12R1.100 ClCCNc1cc(Cl)cc(c1)Cl Amb17343165 [0,2,0,0,0,0|2,0,0]=4 10906 B12R1.100 ClCCOc1cc(Br)cc(Br)c1 Amb24493398 [0,2,0,0,0,0|2,0,0]=4 10907 B12R1.100 Clc1cc(Br)cc(CCCBr)c1 Amb24424487 [0,2,0,0,0,0|1,0,0]=3 10908 B12R1.100 Clc1cc(I)cc(CCCCl)c1 Amb24596614 [0,2,0,0,0,0|1,0,0]=3 10909 B12R1.100 Clc1cc(cc(Cl)c1)SCCBr Amb25834988 [0,2,0,0,0,0|2,0,0]=4 10910 B12R1.100 Fc1cc(Br)cc(CCCBr)c1 Amb25804673 [0,2,0,0,0,0|1,0,0]=3 10911 B12R1.100 Fc1cc(Br)cc(c1)OCCBr Amb24465729 [0,2,0,0,0,0|2,0,0]=4 10912 B12R1.100 Fc1cc(Br)cc(c1)OCCCl Amb24474593 [0,2,0,0,0,0|2,0,0]=4 10913 B12R1.100 Fc1cc(CCCBr)cc(F)c1 Amb25034793 [0,2,0,0,0,0|1,0,0]=3 10914 B12R1.100 Fc1cc(CCCBr)cc(I)c1 Amb24640773 [0,2,0,0,0,0|1,0,0]=3 10915 B12R1.100 Fc1cc(CCCCl)cc(F)c1 Amb25152291 [0,2,0,0,0,0|1,0,0]=3 10916 B12R1.100 Fc1cc(CCCCl)cc(I)c1 Amb24640774 [0,2,0,0,0,0|1,0,0]=3 10917 B12R1.100 Fc1cc(CC[Zn]Br)cc(Cl)c1 Amb22000505 [0,2,0,0,0,0|2,0,0]=4 10918 B12R1.100 Fc1cc(Cl)cc(c1)NCCF Amb25720516 [0,2,0,0,0,0|2,0,0]=4 10919 B12R1.100 Fc1cc(cc(F)c1)OCCCl Amb19061624 [0,2,0,0,0,0|2,0,0]=4 10920 B12R1.100 Fc1cc(cc(F)c1)OCCS Amb25345868 [0,2,0,0,0,0|1,1,0]=4 10921 B12R1.100 N#CCCc1cc(Br)cc(Br)c1 Amb24537171 [0,2,0,0,0,0|1,0,1]=4 10922 B12R1.100 N#CCCc1cc(C)cc(c1)C Amb17204303 [0,2,0,0,0,0|1,0,1]=4 10923 B12R1.100 N#CCCc1cc(Cl)cc(Br)c1 Amb24664557 [0,2,0,0,0,0|1,0,1]=4 10924 B12R1.100 N#CCCc1cc(Cl)cc(I)c1 Amb24610880 [0,2,0,0,0,0|1,0,1]=4 10925 B12R1.100 N#CCCc1cc(Cl)cc(c1)Cl Amb17204387 [0,2,0,0,0,0|1,0,1]=4 10926 B12R1.100 N#CCCc1cc(F)cc(S)c1 Amb25290826 [0,2,0,0,0,0|1,0,1]=4 10927 B12R1.100 N#CCCc1cc(O)cc(Br)c1 Amb25325192 [0,2,0,0,0,0|1,0,1]=4 10928 B12R1.100 N#CCCc1cc(O)cc(F)c1 Amb24541071 [0,2,0,0,0,0|1,0,1]=4 10929 B12R1.100 N#CCCc1cc(O)cc(I)c1 Amb24616441 [0,2,0,0,0,0|1,0,1]=4 10930 B12R1.100 N#CCCc1cc(O)cc(O)c1 Amb24666000 [0,2,0,0,0,0|1,0,1]=4 10931 B12R1.100 N#CCCc1cc(S)cc(Br)c1 Amb25364410 [0,2,0,0,0,0|1,0,1]=4 10932 B12R1.100 N#CCCc1cc(S)cc(Cl)c1 Amb24637165 [0,2,0,0,0,0|1,0,1]=4 10933 B12R1.100 NCCCc1cc(Br)cc(Br)c1 Amb24420259 [0,2,0,0,0,0|1,0,0]=3 10934 B12R1.100 NCCCc1cc(C)cc(c1)C Amb17204308 [0,2,0,0,0,0|1,0,0]=3 10935 B12R1.100 NCCCc1cc(Cl)[n]c(Cl)c1 Amb25323951 [0,2,0,0,0,0|2,0,0]=4 10936 B12R1.100 NCCCc1cc(Cl)cc(F)[n]1 Amb24701320 [0,2,0,0,0,0|2,0,0]=4 10937 B12R1.100 NCCCc1cc(Cl)cc(c1)Cl Amb17204406 [0,2,0,0,0,0|1,0,0]=3 10938 B12R1.100 NCCCc1cc(F)cc(Br)c1 Amb25795729 [0,2,0,0,0,0|1,0,0]=3 10939 B12R1.100 NCCCc1cc(F)cc(Cl)c1 Amb25709208 [0,2,0,0,0,0|1,0,0]=3 10940 B12R1.100 NCCCc1cc(F)cc(F)c1 Amb18126758 [0,2,0,0,0,0|1,0,0]=3 10941 B12R1.100 NCCCc1cc(O)cc(Br)c1 Amb25045372 [0,2,0,0,0,0|1,0,0]=3 10942 B12R1.100 NCCCc1cc(O)cc(Cl)c1 Amb25710883 [0,2,0,0,0,0|1,0,0]=3 10943 B12R1.100 NCCCc1cc(O)cc(O)c1 Amb25113881 [0,2,0,0,0,0|1,0,0]=3 10944 B12R1.100 NCCNc1cc(Br)cc(Cl)c1 Amb24502463 [0,2,0,0,0,0|2,0,0]=4 10945 B12R1.100 NCCNc1cc(C)cc(c1)C Amb17057763 [0,2,0,0,0,0|2,0,0]=4 10946 B12R1.100 NCCNc1cc(Cl)cc(F)c1 Amb25817322 [0,2,0,0,0,0|2,0,0]=4 10947 B12R1.100 NCCNc1cc(Cl)cc(c1)Cl Amb17091083 [0,2,0,0,0,0|2,0,0]=4 10948 B12R1.100 NCCNc1cc(F)cc(F)c1 Amb18299159 [0,2,0,0,0,0|2,0,0]=4 10949 B12R1.100 NCCOc1cc(Br)cc(Cl)c1 Amb25034906 [0,2,0,0,0,0|2,0,0]=4 10950 B12R1.100 NCCOc1cc(Br)cc(F)c1 Amb24389824 [0,2,0,0,0,0|2,0,0]=4 10951 B12R1.100 NCCOc1cc(C)cc(c1)C Amb1065358 [0,2,0,0,0,0|2,0,0]=4 10952 B12R1.100 NCCOc1cc(F)cc(F)c1 Amb18997300 [0,2,0,0,0,0|2,0,0]=4 10953 B12R1.100 NNCCc1cc(C)cc(c1)C Amb17400168 [0,2,0,0,0,0|2,0,0]=4 10954 B12R1.100 NNCCc1cc(F)cc(Br)c1 Amb25100154 [0,2,0,0,0,0|2,0,0]=4 10955 B12R1.100 NNCCc1cc(F)cc(c1)F Amb17400365 [0,2,0,0,0,0|2,0,0]=4 10956 B12R1.100 Nc1cc(CCC#N)cc(F)c1 Amb25292881 [0,2,0,0,0,0|1,0,1]=4 10957 B12R1.100 Nc1cc(CCC#N)cc(N)c1 Amb24574169 [0,2,0,0,0,0|1,0,1]=4 10958 B12R1.100 Nc1cc(CCC=O)cc(O)c1 Amb24566643 [0,2,0,0,0,0|0,0,2]=4 10959 B12R1.100 Nc1cc(F)cc(c1)NCCN Amb18991515 [0,2,0,0,0,0|2,0,0]=4 10960 B12R1.100 Nc1cc(F)cc(c1)NCCO Amb18969362 [0,2,0,0,0,0|1,0,0]=3 10961 B12R1.100 Nc1cc(F)cc(c1)OCCO Amb25703510 [0,2,0,0,0,0|1,0,0]=3 10962 B12R1.100 Nc1cc(F)cc(c1)SCCO Amb18289367 [0,2,0,0,0,0|1,0,0]=3 10963 B12R1.100 Nc1cc(O)cc(c1)OCCO Amb24451135 [0,2,0,0,0,0|1,0,0]=3 10964 B12R1.100 Nc1cc(cc(N)c1)OCCO Amb24367238 [0,2,0,0,0,0|1,0,0]=3 10965 B12R1.100 O=CCCc1cc(Cl)cc(Cl)c1 Amb18066575 [0,2,0,0,0,0|0,0,2]=4 10966 B12R1.100 O=CCCc1cc(Cl)cc(I)c1 Amb24368144 [0,2,0,0,0,0|0,0,2]=4 10967 B12R1.100 O=CCCc1cc(F)cc(F)c1 Amb25149927 [0,2,0,0,0,0|0,0,2]=4 10968 B12R1.100 O=CCCc1cc(F)cc(I)c1 Amb25104319 [0,2,0,0,0,0|0,0,2]=4 10969 B12R1.100 O=CCCc1cc(F)cc(S)c1 Amb24571930 [0,2,0,0,0,0|0,0,2]=4 10970 B12R1.100 OC=1C=C(CCCO)NC(=O)C1 Amb25714614 [0,2,0,0,0,0|1,0,0]=3 10971 B12R1.100 OCCCc1cc(C)nc(c1)C Amb10573709 [0,2,0,0,0,0|1,0,0]=3 10972 B12R1.100 OCCCc1cc(Cl)cc(Br)c1 Amb25150113 [0,2,0,0,0,0|0,0,0]=2 10973 B12R1.100 OCCCc1cc(Cl)cc(c1)Cl Amb17605792 [0,2,0,0,0,0|0,0,0]=2 10974 B12R1.100 OCCCc1cc(F)cc(Br)c1 Amb24453157 [0,2,0,0,0,0|0,0,0]=2 10975 B12R1.100 OCCCc1cc(F)cc(Cl)c1 Amb24673776 [0,2,0,0,0,0|0,0,0]=2 10976 B12R1.100 OCCCc1cc(F)cc(F)c1 Amb24094063 [0,2,0,0,0,0|0,0,0]=2 10977 B12R1.100 OCCCc1cc(O)cc(O)c1 Amb24674121 [0,2,0,0,0,0|0,0,0]=2 10978 B12R1.100 OCCNc1cc(C)[nH]c(=O)c1 Amb2549073 [0,2,0,0,0,0|2,0,0]=4 10979 B12R1.100 OCCNc1cc(Cl)cc(F)c1 Amb25710763 [0,2,0,0,0,0|1,0,0]=3 10980 B12R1.100 OCCOc1cc(Br)cc(F)c1 Amb25344156 [0,2,0,0,0,0|1,0,0]=3 10981 B12R1.100 OCCOc1cc(C)cc(c1)C Amb2209348 [0,2,0,0,0,0|1,0,0]=3 10982 B12R1.100 OCCOc1cc(F)cc(F)c1 Amb18803893 [0,2,0,0,0,0|1,0,0]=3 10983 B12R1.100 OCCOc1cc(I)cc(F)c1 Amb24498015 [0,2,0,0,0,0|1,0,0]=3 10984 B12R1.100 OCCSc1cc(Br)cc(Cl)c1 Amb25680612 [0,2,0,0,0,0|1,0,0]=3 10985 B12R1.100 OC\C=C\c1cc(F)cc(Cl)c1 Amb24446625 [0,2,0,0,0,0|0,0,2]=4 10986 B12R1.100 OC\C=C\c1cc(F)cc(F)c1 Amb19889731 [0,2,0,0,0,0|0,0,2]=4 10987 B12R1.100 Oc1cc(CCCBr)cc(I)c1 Amb24605307 [0,2,0,0,0,0|1,0,0]=3 10988 B12R1.100 Oc1cc(CCCCl)cc(I)c1 Amb24713686 [0,2,0,0,0,0|1,0,0]=3 10989 B12R1.100 Oc1cc(CCCCl)cc(S)c1 Amb24541060 [0,2,0,0,0,0|1,0,0]=3 10990 B12R1.100 Oc1cc(Cl)cc(CCCCl)c1 Amb25195602 [0,2,0,0,0,0|1,0,0]=3 10991 B12R1.100 Oc1cc(\C=C\CO)cc(F)c1 Amb24673086 [0,2,0,0,0,0|0,0,2]=4 10992 B12R1.100 SCCOc1cc(Cl)cc(c1)Cl Amb17245967 [0,2,0,0,0,0|1,1,0]=4 10993 B12R1.100 SCCSc1cc(Cl)cc(Cl)c1 Amb24357102 [0,2,0,0,0,0|1,1,0]=4 10994 B12R1.100 Sc1cc(CCCBr)cc(I)c1 Amb24696764 [0,2,0,0,0,0|1,0,0]=3 10995 B12R1.226 CC(=O)CCc1cccc(O)c1 Amb18646057 [0,2,0,0,0,0|0,0,2]=4 10996 B12R1.226 CC(Br)CCc1c[n]cc(F)c1 Amb25846577 [0,2,0,0,0,0|2,0,0]=4 10997 B12R1.226 CC(Br)CCc1cc(Br)ccc1 Amb24488695 [0,2,0,0,0,0|1,0,0]=3 10998 B12R1.226 CC(Br)CCc1cccc(F)c1 Amb24366969 [0,2,0,0,0,0|1,0,0]=3 10999 B12R1.226 CC(Br)CCc1cccc(O)c1 Amb25765194 [0,2,0,0,0,0|1,0,0]=3 11000 B12R1.226 CC(C)CCc1c[n]cc(N)c1 Amb18828679 [0,2,0,0,0,0|2,0,0]=4 11001 B12R1.226 CC(C)CCc1cc[n]c(N)c1 Amb18828684 [0,2,0,0,0,0|2,0,0]=4 11002 B12R1.226 CC(C)CCc1cccc(N)[n]1 Amb18828734 [0,2,0,0,0,0|2,0,0]=4 11003 B12R1.226 CC(C)COc1cccc(Cl)c1 Amb24484227 [0,2,0,0,0,0|2,0,0]=4 11004 B12R1.226 CC(C)COc1cccc(S)c1 Amb25808776 [0,2,0,0,0,0|2,0,0]=4 11005 B12R1.226 CC(C)CSc1cccc(Br)c1 Amb22227900 [0,2,0,0,0,0|2,0,0]=4 11006 B12R1.226 CC(C)CSc1cccc(Cl)c1 Amb25206523 [0,2,0,0,0,0|2,0,0]=4 11007 B12R1.226 CC(C)CSc1cccc(N)c1 Amb18289365 [0,2,0,0,0,0|2,0,0]=4 11008 B12R1.226 CC(C)CSc1cccc(O)c1 Amb25207683 [0,2,0,0,0,0|2,0,0]=4 11009 B12R1.226 CC(C)NCc1cccc(F)c1 Amb20673453 [0,2,0,0,0,0|2,0,0]=4 11010 B12R1.226 CC(C)NCc1cccc(N)c1 Amb18290344 [0,2,0,0,0,0|2,0,0]=4 11011 B12R1.226 CC(C)NCc1cccc(O)c1 Amb19891164 [0,2,0,0,0,0|2,0,0]=4 11012 B12R1.226 CC(C)OCc1cccc(Br)c1 Amb22058979 [0,2,0,0,0,0|2,0,0]=4 11013 B12R1.226 CC(C)OCc1cccc(O)c1 Amb23443320 [0,2,0,0,0,0|2,0,0]=4 11014 B12R1.226 CC(C)SCc1cccc(N)c1 Amb18289436 [0,2,0,0,0,0|2,0,0]=4 11015 B12R1.226 CC(CCc1cccc(c1)C)O Amb17507253 [0,2,0,0,0,0|0,0,0]=2 11016 B12R1.226 CC(CNc1cccc(c1)Br)O Amb17142611 [0,2,0,0,0,0|1,0,0]=3 11017 B12R1.226 CC(CNc1cccc(c1)C)O Amb17138593 [0,2,0,0,0,0|1,0,0]=3 11018 B12R1.226 CC(CNc1cccc(c1)Cl)O Amb17139126 [0,2,0,0,0,0|1,0,0]=3 11019 B12R1.226 CC(CNc1cccc(c1)F)O Amb17138652 [0,2,0,0,0,0|1,0,0]=3 11020 B12R1.226 CC(COc1cccc(c1)Br)N Amb17062517 [0,2,0,0,0,0|2,0,0]=4 11021 B12R1.226 CC(COc1cccc(c1)C)N Amb1127701 [0,2,0,0,0,0|2,0,0]=4 11022 B12R1.226 CC(COc1cccc(c1)F)N Amb1142128 [0,2,0,0,0,0|2,0,0]=4 11023 B12R1.226 CC(COc1cccc(c1)N)C Amb1133931 [0,2,0,0,0,0|2,0,0]=4 11024 B12R1.226 CC(COc1cccc(c1)N)C Amb2140554 [0,2,0,0,0,0|2,0,0]=4 11025 B12R1.226 CC(Cl)CCc1cccc(F)c1 Amb19076401 [0,2,0,0,0,0|1,0,0]=3 11026 B12R1.226 CC(F)CCc1cccc(N)c1 Amb24610510 [0,2,0,0,0,0|1,0,0]=3 11027 B12R1.226 CC(F)CSc1cccc(N)c1 Amb25223187 [0,2,0,0,0,0|2,0,0]=4 11028 B12R1.226 CC(F)CSc1cccc(O)c1 Amb24694587 [0,2,0,0,0,0|2,0,0]=4 11029 B12R1.226 CC(N)CCc1c[n]cc(F)c1 Amb24513769 [0,2,0,0,0,0|2,0,0]=4 11030 B12R1.226 CC(N)CCc1cc(N)ccc1 Amb24424070 [0,2,0,0,0,0|1,0,0]=3 11031 B12R1.226 CC(N)CCc1cccc(I)c1 Amb25281897 [0,2,0,0,0,0|1,0,0]=3 11032 B12R1.226 CC(N)CCc1cccc(O)c1 Amb18828241 [0,2,0,0,0,0|1,0,0]=3 11033 B12R1.226 CC(N)CNc1cccc(Br)c1 Amb25674799 [0,2,0,0,0,0|2,0,0]=4 11034 B12R1.226 CC(N)COc1cccc(Cl)c1 Amb22642660 [0,2,0,0,0,0|2,0,0]=4 11035 B12R1.226 CC(N)COc1cccc(I)c1 Amb24441736 [0,2,0,0,0,0|2,0,0]=4 11036 B12R1.226 CC(N)CSc1cccc(Cl)c1 Amb18066336 [0,2,0,0,0,0|2,0,0]=4 11037 B12R1.226 CC(N)CSc1cccc(O)c1 Amb25179966 [0,2,0,0,0,0|2,0,0]=4 11038 B12R1.226 CC(NCc1cccc(c1)Br)C Amb2118534 [0,2,0,0,0,0|2,0,0]=4 11039 B12R1.226 CC(NCc1cccc(c1)Cl)C Amb2118749 [0,2,0,0,0,0|2,0,0]=4 11040 B12R1.226 CC(O)CCc1cc(O)ccc1 Amb25251886 [0,2,0,0,0,0|0,0,0]=2 11041 B12R1.226 CC(O)CCc1cccc(Cl)c1 Amb19075161 [0,2,0,0,0,0|0,0,0]=2 11042 B12R1.226 CC(O)CCc1cccc(F)c1 Amb18805846 [0,2,0,0,0,0|0,0,0]=2 11043 B12R1.226 CC(O)CNc1cc(Br)cc[n]1 Amb25043498 [0,2,0,0,0,0|2,0,0]=4 11044 B12R1.226 CC(O)CNc1cc(F)cc[n]1 Amb24465837 [0,2,0,0,0,0|2,0,0]=4 11045 B12R1.226 CC(O)CNc1cc(N)cc[n]1 Amb18293572 [0,2,0,0,0,0|2,0,0]=4 11046 B12R1.226 CC(O)CNc1cccc(Br)[n]1 Amb24643479 [0,2,0,0,0,0|2,0,0]=4 11047 B12R1.226 CC(O)CNc1cccc(Cl)[n]1 Amb24401999 [0,2,0,0,0,0|2,0,0]=4 11048 B12R1.226 CC(O)CNc1cccc(F)[n]1 Amb18290677 [0,2,0,0,0,0|2,0,0]=4 11049 B12R1.226 CC(O)CNc1cccc(I)c1 Amb24463052 [0,2,0,0,0,0|1,0,0]=3 11050 B12R1.226 CC(O)COc1c[n]cc(Br)c1 Amb24368963 [0,2,0,0,0,0|2,0,0]=4 11051 B12R1.226 CC(O)COc1c[n]cc(F)c1 Amb25109424 [0,2,0,0,0,0|2,0,0]=4 11052 B12R1.226 CC(O)COc1cccc(F)c1 Amb18806456 [0,2,0,0,0,0|1,0,0]=3 11053 B12R1.226 CC(O)COc1cccc(I)c1 Amb24535405 [0,2,0,0,0,0|1,0,0]=3 11054 B12R1.226 CC(O)COc1cccc(N)c1 Amb18290032 [0,2,0,0,0,0|1,0,0]=3 11055 B12R1.226 CC(O)CSc1cc(O)ccc1 Amb24356234 [0,2,0,0,0,0|1,0,0]=3 11056 B12R1.226 CC(O)CSc1cccc(F)c1 Amb25698440 [0,2,0,0,0,0|1,0,0]=3 11057 B12R1.226 CC(O)\C=C\c1cc(O)ccc1 Amb25065736 [0,2,0,0,0,0|0,0,2]=4 11058 B12R1.226 CC(O)\C=C\c1cccc(Br)c1 Amb25098989 [0,2,0,0,0,0|0,0,2]=4 11059 B12R1.226 CC(O)\C=C\c1cccc(Cl)c1 Amb24590748 [0,2,0,0,0,0|0,0,2]=4 11060 B12R1.226 CC(O)\C=C\c1cccc(F)c1 Amb25730368 [0,2,0,0,0,0|0,0,2]=4 11061 B12R1.226 CN(C)CCc1cccc(O)c1 Amb17942808 [0,2,0,0,0,0|2,0,0]=4 11062 B12R1.226 CN(CCc1cccc(c1)N)C Amb17050647 [0,2,0,0,0,0|2,0,0]=4 11063 B12R1.226 CN(N)CCc1cccc(Br)c1 Amb18571910 [0,2,0,0,0,0|2,0,0]=4 11064 B12R1.226 CN(N)CCc1cccc(Cl)c1 Amb18564317 [0,2,0,0,0,0|2,0,0]=4 11065 B12R1.226 C[C@@H](COc1cccc(c1)Br)N Amb17248851 [0,2,0,0,0,0|2,0,0]=4 11066 B12R1.226 C[C@@H](COc1cccc(c1)C)N Amb17232558 [0,2,0,0,0,0|2,0,0]=4 11067 B12R1.226 C[C@@H](COc1cccc(c1)Cl)N Amb17234271 [0,2,0,0,0,0|2,0,0]=4 11068 B12R1.226 C[C@@H](COc1cccc(c1)F)N Amb17232707 [0,2,0,0,0,0|2,0,0]=4 11069 B12R1.226 C[C@@H](N)COc1cccc(Br)c1 Amb18036076 [0,2,0,0,0,0|2,0,0]=4 11070 B12R1.226 C[C@@H](N)COc1cccc(Cl)c1 Amb18538519 [0,2,0,0,0,0|2,0,0]=4 11071 B12R1.226 C[C@@H](N)COc1cccc(F)c1 Amb18538500 [0,2,0,0,0,0|2,0,0]=4 11072 B12R1.226 C[C@@H](N)CSc1cccc(Cl)c1 Amb25132468 [0,2,0,0,0,0|2,0,0]=4 11073 B12R1.226 C[C@@H](N)CSc1cccc(F)c1 Amb24354913 [0,2,0,0,0,0|2,0,0]=4 11074 B12R1.226 C[C@@H](O)CNc1cc[n]c(Cl)c1 Amb25711976 [0,2,0,0,0,0|2,0,0]=4 11075 B12R1.226 C[C@@H](O)CNc1cccc(Cl)[n]1 Amb25036595 [0,2,0,0,0,0|2,0,0]=4 11076 B12R1.226 C[C@@H](O)COc1c[n]cc(Cl)c1 Amb24704043 [0,2,0,0,0,0|2,0,0]=4 11077 B12R1.226 C[C@H](N)CCc1cccc(Br)c1 Amb24683805 [0,2,0,0,0,0|1,0,0]=3 11078 B12R1.226 C[C@H](O)CNc1cc(Br)cc[n]1 Amb25712641 [0,2,0,0,0,0|2,0,0]=4 11079 B12R1.226 C[C@H](O)CNc1cccc(Br)c1 Amb25373826 [0,2,0,0,0,0|1,0,0]=3 11080 B12R1.226 C[C@H](O)CNc1cccc(F)[n]1 Amb24388271 [0,2,0,0,0,0|2,0,0]=4 11081 B12R1.226 C[C@H](O)CNc1cccc(F)c1 Amb24708973 [0,2,0,0,0,0|1,0,0]=3 11082 B12R1.226 C[C@H](O)CNc1cccc(I)c1 Amb25717242 [0,2,0,0,0,0|1,0,0]=3 11083 B12R1.226 C[C@H](O)COc1c[n]cc(Br)c1 Amb25345851 [0,2,0,0,0,0|2,0,0]=4 11084 B12R1.226 C[C@H](O)COc1cccc(Cl)c1 Amb25037433 [0,2,0,0,0,0|1,0,0]=3 11085 B12R1.226 C[C@H](O)COc1cccc(F)c1 Amb24637453 [0,2,0,0,0,0|1,0,0]=3 11086 B12R1.226 Cc1cc(CCB(O)O)ccc1 Amb25790748 [0,2,0,0,0,0|1,0,0]=3 11087 B12R1.226 Cc1cc(CCC(=O)Cl)ccc1 Amb18325287 [0,2,0,0,0,0|0,0,2]=4 11088 B12R1.226 Cc1cc(CCC(N)=N)ccc1 Amb18065465 [0,2,0,0,0,0|1,0,1]=4 11089 B12R1.226 Cc1cc(CCC(O)=O)[n]cc1 Amb18828439 [0,2,0,0,0,0|1,0,1]=4 11090 B12R1.226 Cc1cc(CCC(O)=O)c[n]c1 Amb22886573 [0,2,0,0,0,0|1,0,1]=4 11091 B12R1.226 Cc1cc(CCC(O)=O)cc[n]1 Amb22886572 [0,2,0,0,0,0|1,0,1]=4 11092 B12R1.226 Cc1cc(cc[n]1)NC[C@@H](C)O Amb25296997 [0,2,0,0,0,0|2,0,0]=4 11093 B12R1.226 Cc1cc(ccc1)NCC(F)F Amb18180317 [0,2,0,0,0,0|2,0,0]=4 11094 B12R1.226 Cc1cc(ccc1)OCC(F)F Amb25077448 [0,2,0,0,0,0|2,0,0]=4 11095 B12R1.226 Cc1cc(ccc1)OCC(O)O Amb24618797 [0,2,0,0,0,0|1,0,0]=3 11096 B12R1.226 Cc1cc(ccc1)SCC(F)F Amb25160449 [0,2,0,0,0,0|2,0,0]=4 11097 B12R1.226 Cc1cc[n]c(CCC(C)C)c1 Amb25320282 [0,2,0,0,0,0|2,0,0]=4 11098 B12R1.226 Cc1cc[n]c(c1)NCC(C)O Amb18293562 [0,2,0,0,0,0|2,0,0]=4 11099 B12R1.226 Cc1cc[n]c(c1)NC[C@@H](C)O Amb25160112 [0,2,0,0,0,0|2,0,0]=4 11100 B12R1.226 Cc1cccc(CCC(C)Br)c1 Amb25723537 [0,2,0,0,0,0|1,0,0]=3 11101 B12R1.226 Cc1cccc(CCC(C)Cl)c1 Amb18321700 [0,2,0,0,0,0|1,0,0]=3 11102 B12R1.226 Cc1cccc(CCN(C)N)c1 Amb18563652 [0,2,0,0,0,0|2,0,0]=4 11103 B12R1.226 Cc1cccc(CC[C@H](C)N)c1 Amb24682488 [0,2,0,0,0,0|1,0,0]=3 11104 B12R1.226 Cc1cccc(NCC(C)O)[n]1 Amb18972551 [0,2,0,0,0,0|2,0,0]=4 11105 B12R1.226 Cc1cccc(NC[C@H](C)O)[n]1 Amb24720567 [0,2,0,0,0,0|2,0,0]=4 11106 B12R1.226 Cc1cccc([n]1)OCC(C)O Amb22900273 [0,2,0,0,0,0|2,0,0]=4 11107 B12R1.226 Cc1cccc(c1)C#CC(C)O Amb25303891 [0,2,0,0,0,0|0,0,2]=4 11108 B12R1.226 Cc1cccc(c1)C#C[C@H](C)O Amb24592401 [0,2,0,0,0,0|0,0,2]=4 11109 B12R1.226 Cc1cccc(c1)OCC(C)C Amb25375594 [0,2,0,0,0,0|2,0,0]=4 11110 B12R1.226 Cc1cccc(c1)OCC(C)Cl Amb24429171 [0,2,0,0,0,0|2,0,0]=4 11111 B12R1.226 Cc1cccc(c1)OCC(C)O Amb18182641 [0,2,0,0,0,0|1,0,0]=3 11112 B12R1.226 Cc1cccc(c1)OC[C@@H](C)N Amb18538492 [0,2,0,0,0,0|2,0,0]=4 11113 B12R1.226 Cc1cccc(c1)OC[C@@H](C)O Amb25123169 [0,2,0,0,0,0|1,0,0]=3 11114 B12R1.226 Cc1cccc(c1)OC[C@H](C)O Amb25270564 [0,2,0,0,0,0|1,0,0]=3 11115 B12R1.226 Cc1cccc(c1)SCC(C)N Amb18564187 [0,2,0,0,0,0|2,0,0]=4 11116 B12R1.226 Cc1cccc(c1)SCC(C)O Amb18318405 [0,2,0,0,0,0|1,0,0]=3 11117 B12R1.226 Cc1cccc(c1)SC[C@H](C)N Amb25112431 [0,2,0,0,0,0|2,0,0]=4 11118 B12R1.226 Cc1cccc(c1)\C=C\C(C)O Amb25683937 [0,2,0,0,0,0|0,0,2]=4 11119 B12R1.226 Cc1cccc(c1)\C=C\[C@@H](C)O Amb24404792 [0,2,0,0,0,0|0,0,2]=4 11120 B12R1.226 Cc1cccc(c1)\C=C\[C@H](C)O Amb25725509 [0,2,0,0,0,0|0,0,2]=4 11121 B12R1.226 ClC(Cl)COc1cccc(I)c1 Amb24612554 [0,2,0,0,0,0|2,0,0]=4 11122 B12R1.226 FC(F)CNc1cccc(Br)c1 Amb25770279 [0,2,0,0,0,0|2,0,0]=4 11123 B12R1.226 FC(F)CNc1cccc(Cl)c1 Amb18320416 [0,2,0,0,0,0|2,0,0]=4 11124 B12R1.226 FC(F)CNc1cccc(I)c1 Amb24650609 [0,2,0,0,0,0|2,0,0]=4 11125 B12R1.226 FC(F)COc1cccc(Br)c1 Amb19148821 [0,2,0,0,0,0|2,0,0]=4 11126 B12R1.226 FC(F)COc1cccc(I)c1 Amb24056922 [0,2,0,0,0,0|2,0,0]=4 11127 B12R1.226 FC(F)CSc1cccc(Br)c1 Amb22227888 [0,2,0,0,0,0|2,0,0]=4 11128 B12R1.226 FC(F)CSc1cccc(Cl)c1 Amb25295654 [0,2,0,0,0,0|2,0,0]=4 11129 B12R1.226 Fc1cccc(c1)NCC(F)F Amb18795534 [0,2,0,0,0,0|2,0,0]=4 11130 B12R1.226 NC(=N)CCc1cccc(Br)c1 Amb18571443 [0,2,0,0,0,0|1,0,1]=4 11131 B12R1.226 NC(=N)CCc1cccc(Cl)c1 Amb18564230 [0,2,0,0,0,0|1,0,1]=4 11132 B12R1.226 NC(=N)CCc1cccc(F)c1 Amb18563720 [0,2,0,0,0,0|1,0,1]=4 11133 B12R1.226 NC(=O)CCc1cccc(c1)C Amb17400135 [0,2,0,0,0,0|0,0,2]=4 11134 B12R1.226 NC(=O)CCc1cccc(c1)Cl Amb17400995 [0,2,0,0,0,0|0,0,2]=4 11135 B12R1.226 Nc1cc(CCC(F)F)ccc1 Amb25253012 [0,2,0,0,0,0|1,0,0]=3 11136 B12R1.226 Nc1cc(CCC(O)=O)c[n]c1 Amb25760281 [0,2,0,0,0,0|1,0,1]=4 11137 B12R1.226 Nc1cc(CCC(O)=O)cc[n]1 Amb24105413 [0,2,0,0,0,0|1,0,1]=4 11138 B12R1.226 Nc1cc(CCC([O-])=O)ccc1 Amb22408735 [0,2,0,0,0,0|0,0,2]=4 11139 B12R1.226 Nc1cc(CCC([O-])=O)ccc1 Amb22757721 [0,2,0,0,0,0|0,0,2]=4 11140 B12R1.226 Nc1cc(ccc1)NCC(F)F Amb25216863 [0,2,0,0,0,0|2,0,0]=4 11141 B12R1.226 Nc1cc(ccc1)NCC(O)=O Amb18987711 [0,2,0,0,0,0|1,0,1]=4 11142 B12R1.226 Nc1cc(ccc1)SCC(O)=O Amb25700944 [0,2,0,0,0,0|1,0,1]=4 11143 B12R1.226 O=C(Cl)CCc1cc(Cl)ccc1 Amb24403345 [0,2,0,0,0,0|0,0,2]=4 11144 B12R1.226 O=C(Cl)CCc1cccc(Br)c1 Amb25150110 [0,2,0,0,0,0|0,0,2]=4 11145 B12R1.226 O=C(Cl)CCc1cccc(F)c1 Amb25129437 [0,2,0,0,0,0|0,0,2]=4 11146 B12R1.226 OB(O)CCc1cccc(F)c1 Amb24392487 [0,2,0,0,0,0|1,0,0]=3 11147 B12R1.226 OC(=O)CCC1=CC(=O)C=CN1 Amb25230528 [0,2,0,0,0,0|1,0,1]=4 11148 B12R1.226 OC(=O)CCc1c[n]cc(Cl)c1 Amb25689846 [0,2,0,0,0,0|1,0,1]=4 11149 B12R1.226 OC(=O)CCc1c[n]cc(F)c1 Amb23450303 [0,2,0,0,0,0|1,0,1]=4 11150 B12R1.226 OC(=O)CCc1cc(F)cc[n]1 Amb22886576 [0,2,0,0,0,0|1,0,1]=4 11151 B12R1.226 OC(=O)CCc1cc[n]c(Br)c1 Amb24418909 [0,2,0,0,0,0|1,0,1]=4 11152 B12R1.226 OC(=O)CCc1cccc(c1)Br Amb1209216 [0,2,0,0,0,0|0,0,1]=3 11153 B12R1.226 OC(=O)CCc1cccc(c1)C Amb1106242 [0,2,0,0,0,0|0,0,1]=3 11154 B12R1.226 OC(=O)CCc1cccc(c1)Cl Amb1672952 [0,2,0,0,0,0|0,0,1]=3 11155 B12R1.226 OC(=O)CCc1cccc(c1)F Amb1091868 [0,2,0,0,0,0|0,0,1]=3 11156 B12R1.226 OC(=O)CCc1cccc(c1)I Amb16232982 [0,2,0,0,0,0|0,0,1]=3 11157 B12R1.226 OC(=O)CNc1cccc(F)c1 Amb19341704 [0,2,0,0,0,0|1,0,1]=4 11158 B12R1.226 OC(=O)CNc1cccc(c1)Cl Amb10609174 [0,2,0,0,0,0|1,0,1]=4 11159 B12R1.226 OC(=O)COc1cccc(c1)Cl Amb1211231 [0,2,0,0,0,0|1,0,1]=4 11160 B12R1.226 OC(=O)COc1cccc(c1)F Amb1102803 [0,2,0,0,0,0|1,0,1]=4 11161 B12R1.226 OC(=O)CSc1cccc(F)c1 Amb19887452 [0,2,0,0,0,0|1,0,1]=4 11162 B12R1.226 OC(=O)CSc1cccc(c1)Br Amb2372547 [0,2,0,0,0,0|1,0,1]=4 11163 B12R1.226 Oc1c[n]cc(CCC(O)=O)c1 Amb24435210 [0,2,0,0,0,0|1,0,1]=4 11164 B12R1.226 Oc1cc(CCC(=O)Cl)ccc1 Amb25356247 [0,2,0,0,0,0|0,0,2]=4 11165 B12R1.226 Oc1cc(ccc1)OCC(F)F Amb18795192 [0,2,0,0,0,0|2,0,0]=4 11166 B12R1.226 Oc1cc(ccc1)SCC(F)F Amb24362099 [0,2,0,0,0,0|2,0,0]=4 11167 B12R1.226 [O-][N+](=O)CCc1cccc(O)c1 Amb25141958 [0,2,0,0,0,0|1,0,1]=4 11168 B12R1.226 [O-][N+](=O)CCc1cccc(c1)C Amb17400177 [0,2,0,0,0,0|1,0,1]=4 11169 B12R1.226 [O-][N+](=O)CCc1cccc(c1)Cl Amb17401073 [0,2,0,0,0,0|1,0,1]=4 11170 B12R1.382 BrCCCc1cccc(c1)OC Amb17104558 [0,2,0,0,0,0|1,0,0]=3 11171 B12R1.382 BrCCOc1cccc(c1)CC Amb1657338 [0,2,0,0,0,0|2,0,0]=4 11172 B12R1.382 C#CCCc1cccc(c1)C#N Amb18116227 [0,2,0,0,0,0|1,0,1]=4 11173 B12R1.382 C#Cc1cc(ccc1)NCCN Amb18251584 [0,2,0,0,0,0|2,0,0]=4 11174 B12R1.382 C#Cc1cccc(CCCO)c1 Amb24388502 [0,2,0,0,0,0|0,0,0]=2 11175 B12R1.382 C=CCCc1cccc(C=O)c1 Amb24085224 [0,2,0,0,0,0|1,0,1]=4 11176 B12R1.382 CCCCc1cc(CN)ccc1 Amb22755129 [0,2,0,0,0,0|1,0,0]=3 11177 B12R1.382 CCCCc1cc(cc[n]1)C#N Amb18645406 [0,2,0,0,0,0|2,0,0]=4 11178 B12R1.382 CCCCc1cc(cc[n]1)NN Amb24497614 [0,2,0,0,0,0|2,0,0]=4 11179 B12R1.382 CCCCc1cc(ccc1)C#N Amb19893374 [0,2,0,0,0,0|1,0,0]=3 11180 B12R1.382 CCCOc1cc(ccc1)NC Amb19037542 [0,2,0,0,0,0|2,0,0]=4 11181 B12R1.382 CCCOc1cc(ccc1)[Zn]Br Amb22897961 [0,2,0,0,0,0|2,0,0]=4 11182 B12R1.382 CCCOc1cccc(c1)CN Amb10201546 [0,2,0,0,0,0|2,0,0]=4 11183 B12R1.382 CCCOc1cccc(c1)CN Amb1135599 [0,2,0,0,0,0|2,0,0]=4 11184 B12R1.382 CCCOc1cccc(c1)NN Amb17232618 [0,2,0,0,0,0|2,0,0]=4 11185 B12R1.382 CCCSc1cc(ccc1)[Zn]Br Amb22897962 [0,2,0,0,0,0|2,0,0]=4 11186 B12R1.382 CCNCc1cc(CN)ccc1 Amb19649768 [0,2,0,0,0,0|2,0,0]=4 11187 B12R1.382 CCNCc1cc(CO)ccc1 Amb19649765 [0,2,0,0,0,0|2,0,0]=4 11188 B12R1.382 CCOCc1cc(ccc1)[Zn]Br Amb22898129 [0,2,0,0,0,0|2,0,0]=4 11189 B12R1.382 CCOCc1cccc(c1)CN Amb10609741 [0,2,0,0,0,0|2,0,0]=4 11190 B12R1.382 CCOCc1cccc(c1)CN Amb1138303 [0,2,0,0,0,0|2,0,0]=4 11191 B12R1.382 CCc1cc(CCC#N)ccc1 Amb24537117 [0,2,0,0,0,0|1,0,1]=4 11192 B12R1.382 CCc1cc(CCCN)[n]cc1 Amb18828703 [0,2,0,0,0,0|2,0,0]=4 11193 B12R1.382 CCc1cccc(CCCN)[n]1 Amb18828661 [0,2,0,0,0,0|2,0,0]=4 11194 B12R1.382 CCc1cccc(c1)C#CCO Amb25096891 [0,2,0,0,0,0|0,0,2]=4 11195 B12R1.382 CNCCc1cccc(c1)C#N Amb25214234 [0,2,0,0,0,0|2,0,0]=4 11196 B12R1.382 CNc1c[n]cc(c1)NCCO Amb25090709 [0,2,0,0,0,0|2,0,0]=4 11197 B12R1.382 CNc1cc(c[n]c1)OCCO Amb24419132 [0,2,0,0,0,0|2,0,0]=4 11198 B12R1.382 CNc1cc(cc[n]1)NCCO Amb25118036 [0,2,0,0,0,0|2,0,0]=4 11199 B12R1.382 CNc1cc(cc[n]1)SCCO Amb24342139 [0,2,0,0,0,0|2,0,0]=4 11200 B12R1.382 CNc1cccc(CCCN)[n]1 Amb24419904 [0,2,0,0,0,0|2,0,0]=4 11201 B12R1.382 COc1cc(CCC#C)ccc1 Amb18117994 [0,2,0,0,0,0|1,0,1]=4 11202 B12R1.382 COc1cc(CCNN)ccc1 Amb19887556 [0,2,0,0,0,0|2,0,0]=4 11203 B12R1.382 COc1cc(NCCO)[n]cc1 Amb24651088 [0,2,0,0,0,0|2,0,0]=4 11204 B12R1.382 COc1cc(ccc1)NCCF Amb24435276 [0,2,0,0,0,0|2,0,0]=4 11205 B12R1.382 COc1cc(ccc1)NCCS Amb25667359 [0,2,0,0,0,0|1,1,0]=4 11206 B12R1.382 COc1cccc(CCCN)c1 Amb19429208 [0,2,0,0,0,0|1,0,0]=3 11207 B12R1.382 COc1cccc(CCON)c1 Amb22896637 [0,2,0,0,0,0|2,0,0]=4 11208 B12R1.382 COc1cccc(\C=C\CO)c1 Amb23442965 [0,2,0,0,0,0|0,0,2]=4 11209 B12R1.382 COc1cccc(c1)C#CCO Amb18180049 [0,2,0,0,0,0|0,0,2]=4 11210 B12R1.382 ClCCCc1cccc(c1)OC Amb17104532 [0,2,0,0,0,0|1,0,0]=3 11211 B12R1.382 ClCCNc1cccc(c1)C#N Amb17335461 [0,2,0,0,0,0|2,0,0]=4 11212 B12R1.382 ClCCNc1cccc(c1)OC Amb17335807 [0,2,0,0,0,0|2,0,0]=4 11213 B12R1.382 FCCOc1cc(CBr)ccc1 Amb23580156 [0,2,0,0,0,0|2,0,0]=4 11214 B12R1.382 N#CCCc1cccc(CO)c1 Amb25249968 [0,2,0,0,0,0|1,0,1]=4 11215 B12R1.382 N#CCCc1cccc(c1)OC Amb17204306 [0,2,0,0,0,0|1,0,1]=4 11216 B12R1.382 N#Cc1cc(CCC=O)ccc1 Amb18645176 [0,2,0,0,0,0|0,0,2]=4 11217 B12R1.382 N#Cc1cc(CCCO)cc[n]1 Amb25798409 [0,2,0,0,0,0|1,0,0]=3 11218 B12R1.382 N#Cc1cc(cc[n]1)NCCO Amb19000091 [0,2,0,0,0,0|2,0,0]=4 11219 B12R1.382 N#Cc1cc(cc[n]1)OCCO Amb18788264 [0,2,0,0,0,0|2,0,0]=4 11220 B12R1.382 N#Cc1cc(cc[n]1)SCCO Amb18791122 [0,2,0,0,0,0|2,0,0]=4 11221 B12R1.382 N#Cc1cc(ccc1)OCCF Amb23580158 [0,2,0,0,0,0|2,0,0]=4 11222 B12R1.382 N#Cc1cccc(CCCBr)c1 Amb25675608 [0,2,0,0,0,0|1,0,0]=3 11223 B12R1.382 N#Cc1cccc(CCCCl)c1 Amb25270450 [0,2,0,0,0,0|1,0,0]=3 11224 B12R1.382 N#Cc1cccc(\C=C\CO)c1 Amb18645175 [0,2,0,0,0,0|0,0,2]=4 11225 B12R1.382 NCCCc1cc(ccc1)C#N Amb25217817 [0,2,0,0,0,0|1,0,0]=3 11226 B12R1.382 NCCCc1cccc(c1)OC Amb1092531 [0,2,0,0,0,0|1,0,0]=3 11227 B12R1.382 NCCNc1cc(ccc1)C#N Amb18992217 [0,2,0,0,0,0|2,0,0]=4 11228 B12R1.382 NCCNc1cccc(c1)OC Amb17057754 [0,2,0,0,0,0|2,0,0]=4 11229 B12R1.382 NCCOc1cc(CO)ccc1 Amb18182646 [0,2,0,0,0,0|2,0,0]=4 11230 B12R1.382 NCCOc1cccc(c1)C#N Amb17562051 [0,2,0,0,0,0|2,0,0]=4 11231 B12R1.382 NCCOc1cccc(c1)OC Amb1135524 [0,2,0,0,0,0|2,0,0]=4 11232 B12R1.382 NCc1cc(NCCO)[n]cc1 Amb19025121 [0,2,0,0,0,0|2,0,0]=4 11233 B12R1.382 NCc1cc(cc[n]1)NCCO Amb19034627 [0,2,0,0,0,0|2,0,0]=4 11234 B12R1.382 NCc1cc(ccc1)OCCF Amb23580157 [0,2,0,0,0,0|2,0,0]=4 11235 B12R1.382 NNc1cc(cc[n]1)OCCO Amb24376376 [0,2,0,0,0,0|2,0,0]=4 11236 B12R1.382 NNc1cccc(NCCO)[n]1 Amb25694991 [0,2,0,0,0,0|2,0,0]=4 11237 B12R1.382 NNc1cccc([n]1)OCCO Amb24616697 [0,2,0,0,0,0|2,0,0]=4 11238 B12R1.382 NNc1cccc([n]1)SCCO Amb25823752 [0,2,0,0,0,0|2,0,0]=4 11239 B12R1.382 O=Cc1cc(ccc1)OCCF Amb23579958 [0,2,0,0,0,0|2,0,0]=4 11240 B12R1.382 OCC#Cc1cc(CO)ccc1 Amb18792414 [0,2,0,0,0,0|0,0,2]=4 11241 B12R1.382 OCCCc1cccc(c1)C#N Amb17605790 [0,2,0,0,0,0|0,0,0]=2 11242 B12R1.382 OCCCc1cccc(c1)OC Amb13883640 [0,2,0,0,0,0|0,0,0]=2 11243 B12R1.382 OCCOc1cccc(c1)OC Amb2209352 [0,2,0,0,0,0|1,0,0]=3 11244 B12R1.382 OCc1cc(ccc1)OCCF Amb23580003 [0,2,0,0,0,0|2,0,0]=4 11245 B12R1.382 SCCCc1cccc(c1)OC Amb17400950 [0,2,0,0,0,0|0,1,0]=3 11246 B12R1.382 SCCOc1cccc(c1)CC Amb17233942 [0,2,0,0,0,0|1,1,0]=4 11247 B12R1.8 BrCCCNCc1ccccc1 Amb18134994 [0,2,0,0,0,0|1,0,0]=3 11248 B12R1.8 BrCCNCCc1ccncc1 Amb1030873 [0,2,0,0,0,0|2,0,0]=4 11249 B12R1.8 Br[Zn]CCCOc1ccccc1 Amb22000474 [0,2,0,0,0,0|1,0,0]=3 11250 B12R1.8 C#CCNOCc1ccccc1 Amb25282219 [0,2,0,0,0,0|1,0,1]=4 11251 B12R1.8 C#CCONCc1ccccc1 Amb24444637 [0,2,0,0,0,0|1,0,1]=4 11252 B12R1.8 C=C=CCNCc1ccccc1 Amb25775091 [0,2,0,0,0,0|1,0,1]=4 11253 B12R1.8 C=CCCCCc1ccccc1 Amb19930233 [0,2,0,0,0,0|1,0,0]=3 11254 B12R1.8 C=CCNCCc1ccccc1 Amb2119614 [0,2,0,0,0,0|1,0,0]=3 11255 B12R1.8 C=CCONCc1ccccc1 Amb24725564 [0,2,0,0,0,0|1,0,1]=4 11256 B12R1.8 C=C\C=C\CCc1ccccc1 Amb20248567 [0,2,0,0,0,0|1,0,1]=4 11257 B12R1.8 CC#CCNCc1ccccc1 Amb10233665 [0,2,0,0,0,0|1,0,1]=4 11258 B12R1.8 CC#CCSCc1ccccc1 Amb25788750 [0,2,0,0,0,0|1,0,1]=4 11259 B12R1.8 CCCCCCc1cc[n]cc1 Amb22235257 [0,2,0,0,0,0|2,0,0]=4 11260 B12R1.8 CCCCCCc1cccnc1 Amb10807465 [0,2,0,0,0,0|2,0,0]=4 11261 B12R1.8 CCCCCOc1ccccc1 Amb1106330 [0,2,0,0,0,0|1,0,0]=3 11262 B12R1.8 CCCCNCc1c[n]ccc1 Amb20673559 [0,2,0,0,0,0|2,0,0]=4 11263 B12R1.8 CCCCNCc1cc[n]cc1 Amb20673560 [0,2,0,0,0,0|2,0,0]=4 11264 B12R1.8 CCCCNCc1cccc[n]1 Amb20673556 [0,2,0,0,0,0|2,0,0]=4 11265 B12R1.8 CCCCSSc1cccc[n]1 Amb24101204 [0,2,0,0,0,0|2,0,0]=4 11266 B12R1.8 CCCC\C=C/c1ccccc1 Amb22546625 [0,2,0,0,0,0|1,0,0]=3 11267 B12R1.8 CCCC\C=C\c1cccc[n]1 Amb19148732 [0,2,0,0,0,0|2,0,0]=4 11268 B12R1.8 CCCC\N=C\c1ccccc1 Amb20248424 [0,2,0,0,0,0|1,0,0]=3 11269 B12R1.8 CCCNCCc1ccccc1 Amb2119486 [0,2,0,0,0,0|1,0,0]=3 11270 B12R1.8 CCCN\C=C\c1ccccc1 Amb24565827 [0,2,0,0,0,0|1,0,1]=4 11271 B12R1.8 CCCONCc1ccccc1 Amb25031180 [0,2,0,0,0,0|1,0,0]=3 11272 B12R1.8 CCCSCCc1ccncc1 Amb1864661 [0,2,0,0,0,0|2,0,0]=4 11273 B12R1.8 CCC\C=C/Cc1ccccc1 Amb22546636 [0,2,0,0,0,0|1,0,0]=3 11274 B12R1.8 CCC\C=N\Cc1ccccc1 Amb10562392 [0,2,0,0,0,0|1,0,0]=3 11275 B12R1.8 CCNCC#Cc1ccccc1 Amb18800149 [0,2,0,0,0,0|1,0,1]=4 11276 B12R1.8 CCNCCCc1ccccc1 Amb2094490 [0,2,0,0,0,0|1,0,0]=3 11277 B12R1.8 CCNCCNc1ccccc1 Amb18792597 [0,2,0,0,0,0|1,0,0]=3 11278 B12R1.8 CCNCCOc1ccccc1 Amb2099717 [0,2,0,0,0,0|1,0,0]=3 11279 B12R1.8 CCNCCSc1cccc[n]1 Amb19045126 [0,2,0,0,0,0|2,0,0]=4 11280 B12R1.8 CCNCCSc1ccccc1 Amb10608724 [0,2,0,0,0,0|1,0,0]=3 11281 B12R1.8 CCOCC#Cc1ccccc1 Amb24663302 [0,2,0,0,0,0|0,0,2]=4 11282 B12R1.8 CCOCCCc1ccccc1 Amb24063530 [0,2,0,0,0,0|0,0,0]=2 11283 B12R1.8 CCSCC#Cc1ccccc1 Amb25822151 [0,2,0,0,0,0|1,0,1]=4 11284 B12R1.8 CCSCCNc1ccccc1 Amb17307513 [0,2,0,0,0,0|1,0,0]=3 11285 B12R1.8 CCSCCSc1cccc[n]1 Amb24105858 [0,2,0,0,0,0|2,0,0]=4 11286 B12R1.8 CC\C=C\NCc1ccccc1 Amb24519259 [0,2,0,0,0,0|1,0,1]=4 11287 B12R1.8 CC\C=N\OCc1ccccc1 Amb24395281 [0,2,0,0,0,0|1,0,1]=4 11288 B12R1.8 CNCCC#Cc1ccccc1 Amb19025186 [0,2,0,0,0,0|1,0,1]=4 11289 B12R1.8 CNCCCCc1ccccc1 Amb10068774 [0,2,0,0,0,0|1,0,0]=3 11290 B12R1.8 CNCCCCc1cccnc1 Amb17617748 [0,2,0,0,0,0|2,0,0]=4 11291 B12R1.8 CNCCCNc1ccccc1 Amb13951704 [0,2,0,0,0,0|1,0,0]=3 11292 B12R1.8 CNCCCSc1ccccc1 Amb10608730 [0,2,0,0,0,0|1,0,0]=3 11293 B12R1.8 CNCCCSc1ccccc1 Amb22588097 [0,2,0,0,0,0|1,0,0]=3 11294 B12R1.8 CNCCNCc1c[n]ccc1 Amb18798457 [0,2,0,0,0,0|2,0,0]=4 11295 B12R1.8 CNCCNCc1cc[n]cc1 Amb20414384 [0,2,0,0,0,0|2,0,0]=4 11296 B12R1.8 CNCCNCc1cccc[n]1 Amb18798456 [0,2,0,0,0,0|2,0,0]=4 11297 B12R1.8 CNCCOCc1ccccc1 Amb20668782 [0,2,0,0,0,0|1,0,0]=3 11298 B12R1.8 CNCCSCc1c[n]ccc1 Amb21984678 [0,2,0,0,0,0|2,0,0]=4 11299 B12R1.8 CNCCSCc1cccc[n]1 Amb21984677 [0,2,0,0,0,0|2,0,0]=4 11300 B12R1.8 CNCCSCc1ccccc1 Amb18809641 [0,2,0,0,0,0|1,0,0]=3 11301 B12R1.8 COCCCNc1c[n]c[n]c1 Amb18270117 [0,2,0,0,0,0|2,0,0]=4 11302 B12R1.8 COCCCNc1ccccc1 Amb17232551 [0,2,0,0,0,0|0,0,0]=2 11303 B12R1.8 COCCCOc1ccccc1 Amb23450364 [0,2,0,0,0,0|0,0,0]=2 11304 B12R1.8 COCCNCc1ccccn1 Amb1663439 [0,2,0,0,0,0|1,0,0]=3 11305 B12R1.8 COCCNCc1ccccn1 Amb17622505 [0,2,0,0,0,0|1,0,0]=3 11306 B12R1.8 CONCC#Cc1ccccc1 Amb25139183 [0,2,0,0,0,0|0,0,2]=4 11307 B12R1.8 CSCCNCc1ccccc1 Amb18187025 [0,2,0,0,0,0|0,1,0]=3 11308 B12R1.8 C\C=C\CNCc1ccccc1 Amb18645560 [0,2,0,0,0,0|1,0,1]=4 11309 B12R1.8 ClCC#CCNc1ccccc1 Amb24652633 [0,2,0,0,0,0|1,0,1]=4 11310 B12R1.8 ClCCC#CCc1c[n]ccc1 Amb25304783 [0,2,0,0,0,0|2,0,0]=4 11311 B12R1.8 ClCCC#CCc1cc[n]cc1 Amb24710857 [0,2,0,0,0,0|2,0,0]=4 11312 B12R1.8 ClCCC#CCc1cccc[n]1 Amb24595319 [0,2,0,0,0,0|2,0,0]=4 11313 B12R1.8 ClCCCCCc1ccccc1 Amb10808064 [0,2,0,0,0,0|1,0,0]=3 11314 B12R1.8 ClCCCNCc1c[n]ccc1 Amb20573314 [0,2,0,0,0,0|2,0,0]=4 11315 B12R1.8 ClCCCNCc1cc[n]cc1 Amb20573340 [0,2,0,0,0,0|2,0,0]=4 11316 B12R1.8 ClCCCNCc1cc[n]cc1 Amb20623668 [0,2,0,0,0,0|2,0,0]=4 11317 B12R1.8 ClCCCNCc1cccc[n]1 Amb20573480 [0,2,0,0,0,0|2,0,0]=4 11318 B12R1.8 ClCCCNCc1ccccc1 Amb10766327 [0,2,0,0,0,0|1,0,0]=3 11319 B12R1.8 ClCOCC#Cc1ccccc1 Amb25363282 [0,2,0,0,0,0|0,0,2]=4 11320 B12R1.8 Cl[Zn]CCCCc1ccccc1 Amb22897864 [0,2,0,0,0,0|1,0,0]=3 11321 B12R1.8 Cl\C=C/COCc1ccccc1 Amb24711309 [0,2,0,0,0,0|1,0,1]=4 11322 B12R1.8 FCCCSCc1ccccc1 Amb22008717 [0,2,0,0,0,0|1,0,0]=3 11323 B12R1.8 N#CCCCNc1cc[n]cc1 Amb25669722 [0,2,0,0,0,0|2,0,0]=4 11324 B12R1.8 N#CCCCOc1cccc[n]1 Amb19374567 [0,2,0,0,0,0|2,0,0]=4 11325 B12R1.8 N#CCCNCc1cccnc1 Amb1651452 [0,2,0,0,0,0|2,0,0]=4 11326 B12R1.8 N#CCCNCc1ccncc1 Amb2278358 [0,2,0,0,0,0|2,0,0]=4 11327 B12R1.8 N#CCCNNc1ccccc1 Amb17594020 [0,2,0,0,0,0|1,0,1]=4 11328 B12R1.8 N#CCC\C=C\c1ccccc1 Amb18644947 [0,2,0,0,0,0|1,0,1]=4 11329 B12R1.8 N#C\C=C\CCc1ccccc1 Amb17477529 [0,2,0,0,0,0|1,0,1]=4 11330 B12R1.8 NCCCC#Cc1c[n]ccc1 Amb25048057 [0,2,0,0,0,0|2,0,0]=4 11331 B12R1.8 NCCCC#Cc1cccc[n]1 Amb25048054 [0,2,0,0,0,0|2,0,0]=4 11332 B12R1.8 NCCCC#Cc1ccccc1 Amb25803470 [0,2,0,0,0,0|1,0,0]=3 11333 B12R1.8 NCCCCCc1ccccc1 Amb18034503 [0,2,0,0,0,0|1,0,0]=3 11334 B12R1.8 NCCCCNc1cc[n]cc1 Amb18792687 [0,2,0,0,0,0|2,0,0]=4 11335 B12R1.8 NCCCCNc1ccccn1 Amb13952725 [0,2,0,0,0,0|2,0,0]=4 11336 B12R1.8 NCCCNCc1ccccc1 Amb17720405 [0,2,0,0,0,0|1,0,0]=3 11337 B12R1.8 NCCCNCc1ccccn1 Amb17315287 [0,2,0,0,0,0|2,0,0]=4 11338 B12R1.8 NCCCNCc1cccnc1 Amb17315286 [0,2,0,0,0,0|2,0,0]=4 11339 B12R1.8 NCCCNCc1ccncc1 Amb17315285 [0,2,0,0,0,0|2,0,0]=4 11340 B12R1.8 NCCCOCc1ccccc1 Amb1217769 [0,2,0,0,0,0|1,0,0]=3 11341 B12R1.8 NCCC\C=C\c1ccccc1 Amb18563531 [0,2,0,0,0,0|1,0,0]=3 11342 B12R1.8 NCCNCCc1ccccc1 Amb1086596 [0,2,0,0,0,0|1,0,0]=3 11343 B12R1.8 NCCNCCc1ccccc1 Amb22283881 [0,2,0,0,0,0|1,0,0]=3 11344 B12R1.8 NCCOCCc1ccccc1 Amb19374389 [0,2,0,0,0,0|1,0,0]=3 11345 B12R1.8 NC\C=C\CNc1ccccc1 Amb25046454 [0,2,0,0,0,0|1,0,1]=4 11346 B12R1.8 NNCCCCc1cccc[n]1 Amb22497574 [0,2,0,0,0,0|2,0,0]=4 11347 B12R1.8 NNCCCCc1ccccn1 Amb10844877 [0,2,0,0,0,0|2,0,0]=4 11348 B12R1.8 NNCCCOc1ccccc1 Amb19373220 [0,2,0,0,0,0|1,0,0]=3 11349 B12R1.8 NOCCOCc1ccccc1 Amb22896393 [0,2,0,0,0,0|0,0,0]=2 11350 B12R1.8 NOCC\C=C\c1ccccc1 Amb18563583 [0,2,0,0,0,0|0,0,1]=3 11351 B12R1.8 O=C=NCCOc1ccccc1 Amb13783673 [0,2,0,0,0,0|0,0,2]=4 11352 B12R1.8 O=CC#CCCc1ccccc1 Amb24356095 [0,2,0,0,0,0|0,0,2]=4 11353 B12R1.8 O=CCCCCc1ccccc1 Amb18798121 [0,2,0,0,0,0|0,0,1]=3 11354 B12R1.8 O=CCCCOc1ccccc1 Amb18798283 [0,2,0,0,0,0|0,0,1]=3 11355 B12R1.8 O=CCOCCc1ccccc1 Amb18800786 [0,2,0,0,0,0|0,0,1]=3 11356 B12R1.8 O=CNCNCc1ccccc1 Amb24532665 [0,2,0,0,0,0|0,0,2]=4 11357 B12R1.8 O=CNCOCc1ccccc1 Amb24552397 [0,2,0,0,0,0|0,0,2]=4 11358 B12R1.8 O=COCCCc1ccccc1 Amb22229401 [0,2,0,0,0,0|0,0,0]=2 11359 B12R1.8 OCC#CC#Cc1ccccc1 Amb25714420 [0,2,0,0,0,0|0,0,2]=4 11360 B12R1.8 OCC#CCNc1ccccc1 Amb25758889 [0,2,0,0,0,0|0,0,1]=3 11361 B12R1.8 OCCC#CCc1cc[n]cc1 Amb25287671 [0,2,0,0,0,0|1,0,0]=3 11362 B12R1.8 OCCCC#Cc1c[n]cc[n]1 Amb24589494 [0,2,0,0,0,0|2,0,0]=4 11363 B12R1.8 OCCCC#Cc1cc[n]cc1 Amb24364350 [0,2,0,0,0,0|1,0,0]=3 11364 B12R1.8 OCCCC#Cc1ccccc1 Amb22730795 [0,2,0,0,0,0|0,0,0]=2 11365 B12R1.8 OCCCCCc1cccc[n]1 Amb23441163 [0,2,0,0,0,0|1,0,0]=3 11366 B12R1.8 OCCCNCc1cc[n]cc1 Amb22588118 [0,2,0,0,0,0|1,0,0]=3 11367 B12R1.8 OCCCNCc1ccccc1 Amb2221510 [0,2,0,0,0,0|0,0,0]=2 11368 B12R1.8 OCCCNCc1cccnc1 Amb2114454 [0,2,0,0,0,0|1,0,0]=3 11369 B12R1.8 OCCNCCc1cc[n]cc1 Amb22282674 [0,2,0,0,0,0|1,0,0]=3 11370 B12R1.8 OCCNCCc1cc[n]cc1 Amb22282814 [0,2,0,0,0,0|1,0,0]=3 11371 B12R1.8 OCCNCCc1ccccc1 Amb2119205 [0,2,0,0,0,0|0,0,0]=2 11372 B12R1.8 OCCNCCc1ccncc1 Amb1028249 [0,2,0,0,0,0|1,0,0]=3 11373 B12R1.8 OCCN\C=C\c1ccccc1 Amb25087866 [0,2,0,0,0,0|0,0,1]=3 11374 B12R1.8 OCCN\C=N\c1cccc[n]1 Amb25696101 [0,2,0,0,0,0|1,0,1]=4 11375 B12R1.8 OCCSCCc1ccccn1 Amb10608714 [0,2,0,0,0,0|1,0,0]=3 11376 B12R1.8 OCCSCCc1ccncc1 Amb15695449 [0,2,0,0,0,0|1,0,0]=3 11377 B12R1.8 OCC\C=N\Nc1ccccc1 Amb25846258 [0,2,0,0,0,0|0,0,1]=3 11378 B12R1.8 OCOCOCc1ccccc1 Amb25803238 [0,2,0,0,0,0|0,0,0]=2 11379 B12R1.8 OC\C=C\C#Cc1ccccc1 Amb17593957 [0,2,0,0,0,0|0,0,2]=4 11380 B12R1.8 OC\C=C\C=Cc1ccccc1 Amb24700798 [0,2,0,0,0,0|0,0,2]=4 11381 B12R1.8 O\C=C\NCCc1ccccc1 Amb24721604 [0,2,0,0,0,0|0,0,1]=3 11382 B12R1.8 S=C=NCCOc1ccccc1 Amb17233560 [0,2,0,0,0,0|0,1,1]=4 11383 B12R1.8 S=C=NCCSc1ccccc1 Amb2371165 [0,2,0,0,0,0|0,1,1]=4 11384 B12R1.8 SCCCNCc1ccccc1 Amb25751336 [0,2,0,0,0,0|0,1,0]=3 11385 B12R1.8 [N-]=[N+]=NCCCc1ccccc1 Amb10572439 [0,2,0,0,0,0|1,0,0]=3 11386 B12R1.27 BrCC(=O)NCc1ccccc1 Amb2221074 [0,2,0,0,0,0|1,0,1]=4 11387 B12R1.27 C#CC(=O)CCc1ccccc1 Amb24483845 [0,2,0,0,0,0|0,0,2]=4 11388 B12R1.27 C#CC(Cl)CCc1ccccc1 Amb25775006 [0,2,0,0,0,0|1,0,0]=3 11389 B12R1.27 C#CC(N)CCc1c[n]ccc1 Amb25197860 [0,2,0,0,0,0|2,0,0]=4 11390 B12R1.27 C#CC(N)CCc1ccccc1 Amb25150966 [0,2,0,0,0,0|1,0,0]=3 11391 B12R1.27 C#CC(N)CSc1ccccc1 Amb24731339 [0,2,0,0,0,0|1,0,1]=4 11392 B12R1.27 C#CC(O)C#Cc1ccccc1 Amb24544056 [0,2,0,0,0,0|0,0,2]=4 11393 B12R1.27 C#CC(O)CCc1ccccc1 Amb25024201 [0,2,0,0,0,0|0,0,0]=2 11394 B12R1.27 C#CC(O)COc1ccccc1 Amb25686511 [0,2,0,0,0,0|1,0,0]=3 11395 B12R1.27 C#C[C@@H](O)COc1ccccc1 Amb25205027 [0,2,0,0,0,0|1,0,0]=3 11396 B12R1.27 C#C[C@@H](O)\C=C\c1ccccc1 Amb24592205 [0,2,0,0,0,0|0,0,2]=4 11397 B12R1.27 C#C[C@H](O)CCc1ccccc1 Amb25266374 [0,2,0,0,0,0|0,0,0]=2 11398 B12R1.27 C=C(CO)C#Cc1ccccc1 Amb24497788 [0,2,0,0,0,0|0,0,2]=4 11399 B12R1.27 C=C(CO)CNc1ccccc1 Amb24537817 [0,2,0,0,0,0|0,0,1]=3 11400 B12R1.27 C=CC(=O)CCc1ccccc1 Amb10562280 [0,2,0,0,0,0|0,0,2]=4 11401 B12R1.27 C=CC(O)CSc1ccccc1 Amb24273355 [0,2,0,0,0,0|1,0,0]=3 11402 B12R1.27 C=C[C@@H](O)C#Cc1ccccc1 Amb25817128 [0,2,0,0,0,0|0,0,2]=4 11403 B12R1.27 CC(C#C)OCc1ccccc1 Amb25208112 [0,2,0,0,0,0|1,0,1]=4 11404 B12R1.27 CC(C#N)NCc1ccccc1 Amb17044860 [0,2,0,0,0,0|1,0,1]=4 11405 B12R1.27 CC(C#N)OCc1ccccc1 Amb18797967 [0,2,0,0,0,0|1,0,1]=4 11406 B12R1.27 CC(C#N)SCc1ccccc1 Amb18808999 [0,2,0,0,0,0|1,0,1]=4 11407 B12R1.27 CC(C=O)OCc1ccccc1 Amb18646071 [0,2,0,0,0,0|0,0,2]=4 11408 B12R1.27 CC(CCc1ccccc1)NN Amb22445317 [0,2,0,0,0,0|1,0,0]=3 11409 B12R1.27 CC(CCl)CNc1cccc[n]1 Amb25117118 [0,2,0,0,0,0|2,0,0]=4 11410 B12R1.27 CC(CCl)CNc1ccccc1 Amb22756334 [0,2,0,0,0,0|1,0,0]=3 11411 B12R1.27 CC(CCl)OCc1ccccc1 Amb25257973 [0,2,0,0,0,0|1,0,0]=3 11412 B12R1.27 CC(CF)NCc1ccccc1 Amb24536598 [0,2,0,0,0,0|1,0,0]=3 11413 B12R1.27 CC(CN)CNc1c[n]ccc1 Amb25223001 [0,2,0,0,0,0|2,0,0]=4 11414 B12R1.27 CC(CN)CNc1ccccc1 Amb19027860 [0,2,0,0,0,0|1,0,0]=3 11415 B12R1.27 CC(CN)NCc1ccccc1 Amb18646179 [0,2,0,0,0,0|1,0,0]=3 11416 B12R1.27 CC(CN)OCc1ccccc1 Amb18312421 [0,2,0,0,0,0|1,0,0]=3 11417 B12R1.27 CC(CNc1ccccc1)C=C Amb25080486 [0,2,0,0,0,0|1,0,1]=4 11418 B12R1.27 CC(CNc1ccccc1)NN Amb18646401 [0,2,0,0,0,0|2,0,0]=4 11419 B12R1.27 CC(CO)C#Cc1ccccc1 Amb25071626 [0,2,0,0,0,0|0,0,1]=3 11420 B12R1.27 CC(CO)CNc1[n]ccc[n]1 Amb25207018 [0,2,0,0,0,0|2,0,0]=4 11421 B12R1.27 CC(CO)CNc1c[n]cc[n]1 Amb25736835 [0,2,0,0,0,0|2,0,0]=4 11422 B12R1.27 CC(CO)CNc1cc[n]c[n]1 Amb25733713 [0,2,0,0,0,0|2,0,0]=4 11423 B12R1.27 CC(CO)CNc1cc[n]cc1 Amb24364366 [0,2,0,0,0,0|1,0,0]=3 11424 B12R1.27 CC(CO)OCc1ccccc1 Amb25667474 [0,2,0,0,0,0|0,0,0]=2 11425 B12R1.27 CC(CO)\C=C\c1ccccc1 Amb25378732 [0,2,0,0,0,0|0,0,1]=3 11426 B12R1.27 CC(CO)\C=N\c1ccccc1 Amb20248421 [0,2,0,0,0,0|0,0,1]=3 11427 B12R1.27 CC(CO)\N=C\c1ccccc1 Amb25680631 [0,2,0,0,0,0|0,0,1]=3 11428 B12R1.27 CC(COc1ccccc1)NN Amb18563755 [0,2,0,0,0,0|2,0,0]=4 11429 B12R1.27 CCC(=C)CNc1ccccc1 Amb25093473 [0,2,0,0,0,0|1,0,1]=4 11430 B12R1.27 CCC(=N)NCc1ccccc1 Amb24388885 [0,2,0,0,0,0|1,0,1]=4 11431 B12R1.27 CCC(C)CNc1cc[n]cc1 Amb19028789 [0,2,0,0,0,0|2,0,0]=4 11432 B12R1.27 CCC(C)CNc1cccc[n]1 Amb19031075 [0,2,0,0,0,0|2,0,0]=4 11433 B12R1.27 CCC(C)NCc1c[n]ccc1 Amb20673665 [0,2,0,0,0,0|2,0,0]=4 11434 B12R1.27 CCC(C)NCc1cc[n]cc1 Amb20673659 [0,2,0,0,0,0|2,0,0]=4 11435 B12R1.27 CCC(C)NCc1cccc[n]1 Amb20673664 [0,2,0,0,0,0|2,0,0]=4 11436 B12R1.27 CCC(CCc1ccccc1)O Amb17138574 [0,2,0,0,0,0|0,0,0]=2 11437 B12R1.27 CCC(CNc1ccccc1)O Amb13952005 [0,2,0,0,0,0|1,0,0]=3 11438 B12R1.27 CCC(CSc1ccccc1)N Amb17485970 [0,2,0,0,0,0|1,0,0]=3 11439 B12R1.27 CCC(Cl)CNc1cc[n]cc1 Amb25706223 [0,2,0,0,0,0|2,0,0]=4 11440 B12R1.27 CCC(Cl)\C=C\c1ccccc1 Amb25210818 [0,2,0,0,0,0|1,0,1]=4 11441 B12R1.27 CCC(N)CNc1cccc[n]1 Amb24483338 [0,2,0,0,0,0|2,0,0]=4 11442 B12R1.27 CCC(N)CNc1ccccc1 Amb19009674 [0,2,0,0,0,0|1,0,0]=3 11443 B12R1.27 CCC(N)COc1cccc[n]1 Amb22522748 [0,2,0,0,0,0|2,0,0]=4 11444 B12R1.27 CCC(N)COc1ccccc1 Amb19029691 [0,2,0,0,0,0|1,0,0]=3 11445 B12R1.27 CCC(O)CNc1cccc[n]1 Amb25350283 [0,2,0,0,0,0|2,0,0]=4 11446 B12R1.27 CCC(O)OCc1ccccc1 Amb25793622 [0,2,0,0,0,0|1,0,0]=3 11447 B12R1.27 CCC(O)\C=C\c1ccccc1 Amb22546605 [0,2,0,0,0,0|0,0,2]=4 11448 B12R1.27 CCC(O)\C=N\c1ccccc1 Amb25333476 [0,2,0,0,0,0|1,0,1]=4 11449 B12R1.27 CCN(C)CCc1cc[n]cc1 Amb24099576 [0,2,0,0,0,0|2,0,0]=4 11450 B12R1.27 CCS(=O)NCc1ccccc1 Amb25359778 [0,2,0,0,0,0|2,0,0]=4 11451 B12R1.27 CC[C@@H](O)C#Cc1ccccc1 Amb24525022 [0,2,0,0,0,0|0,0,2]=4 11452 B12R1.27 CC[C@@H](O)\C=C\c1ccccc1 Amb25320497 [0,2,0,0,0,0|0,0,2]=4 11453 B12R1.27 CC[C@H](C)CNc1ccccc1 Amb25843960 [0,2,0,0,0,0|1,0,0]=3 11454 B12R1.27 CC[C@H](O)CNc1cc[n]cc1 Amb24372478 [0,2,0,0,0,0|2,0,0]=4 11455 B12R1.27 CC[C@H](O)CNc1cccc[n]1 Amb24364763 [0,2,0,0,0,0|2,0,0]=4 11456 B12R1.27 CN(CCc1ccccc1)C#N Amb24448226 [0,2,0,0,0,0|1,0,1]=4 11457 B12R1.27 CNC(C)CNc1ccccc1 Amb18312626 [0,2,0,0,0,0|2,0,0]=4 11458 B12R1.27 CNC(CCc1ccccc1)C Amb1138722 [0,2,0,0,0,0|1,0,0]=3 11459 B12R1.27 CNC(CCc1cccnc1)C Amb17507452 [0,2,0,0,0,0|2,0,0]=4 11460 B12R1.27 COC(=N)CCc1cc[n]cc1 Amb18563635 [0,2,0,0,0,0|1,0,1]=4 11461 B12R1.27 COC(=N)CCc1ccc[n]c1 Amb18563630 [0,2,0,0,0,0|1,0,1]=4 11462 B12R1.27 COC(=N)CCc1cccc[n]1 Amb18563625 [0,2,0,0,0,0|1,0,1]=4 11463 B12R1.27 COC(=N)CNc1ccccc1 Amb24597022 [0,2,0,0,0,0|1,0,1]=4 11464 B12R1.27 COC(=N)COc1ccccc1 Amb18798404 [0,2,0,0,0,0|1,0,1]=4 11465 B12R1.27 COC(=O)CCc1ccncc1 Amb10604945 [0,2,0,0,0,0|1,0,1]=4 11466 B12R1.27 COC(=O)OCc1ccccc1 Amb25034726 [0,2,0,0,0,0|1,0,1]=4 11467 B12R1.27 COC(C)CNc1c[n]ccc1 Amb25359695 [0,2,0,0,0,0|2,0,0]=4 11468 B12R1.27 COC(C)CNc1cccc[n]1 Amb25689750 [0,2,0,0,0,0|2,0,0]=4 11469 B12R1.27 COC(C)CNc1ccccc1 Amb19025483 [0,2,0,0,0,0|1,0,0]=3 11470 B12R1.27 CSC(C)CNc1ccccc1 Amb18312645 [0,2,0,0,0,0|1,1,0]=4 11471 B12R1.27 C[C@@H](CCl)OCc1ccccc1 Amb25320908 [0,2,0,0,0,0|1,0,0]=3 11472 B12R1.27 C[C@@H](CN)NCc1ccccc1 Amb24396541 [0,2,0,0,0,0|1,0,0]=3 11473 B12R1.27 C[C@@H](CO)NCc1ccccc1 Amb19301927 [0,2,0,0,0,0|0,0,0]=2 11474 B12R1.27 C[C@@H](CO)\C=C\c1ccccc1 Amb25127764 [0,2,0,0,0,0|0,0,1]=3 11475 B12R1.27 C[C@H](C=O)OCc1ccccc1 Amb25326165 [0,2,0,0,0,0|0,0,2]=4 11476 B12R1.27 C[C@H](CO)NCc1ccccc1 Amb19375302 [0,2,0,0,0,0|0,0,0]=2 11477 B12R1.27 C[C@H](CO)OCc1ccccc1 Amb25694316 [0,2,0,0,0,0|0,0,0]=2 11478 B12R1.27 C[C@H](CO)ONc1ccccc1 Amb24625280 [0,2,0,0,0,0|1,0,0]=3 11479 B12R1.27 C[C@H](CO)\N=C\c1ccccc1 Amb25048456 [0,2,0,0,0,0|0,0,1]=3 11480 B12R1.27 C\C(\CCc1ccccc1)=N\O Amb24638706 [0,2,0,0,0,0|0,0,1]=3 11481 B12R1.27 C\C(\CCl)=C\Cc1ccccc1 Amb25279568 [0,2,0,0,0,0|1,0,1]=4 11482 B12R1.27 C\C(\CN)=C\Cc1ccccc1 Amb24438874 [0,2,0,0,0,0|1,0,1]=4 11483 B12R1.27 C\C(\CO)=N\Nc1ccccc1 Amb24619168 [0,2,0,0,0,0|1,0,1]=4 11484 B12R1.27 C\C(\NCc1ccccc1)=N\O Amb25083251 [0,2,0,0,0,0|1,0,1]=4 11485 B12R1.27 ClCC(=O)CCc1ccccc1 Amb17139043 [0,2,0,0,0,0|1,0,0]=3 11486 B12R1.27 ClCC(=O)COc1ccccc1 Amb17139095 [0,2,0,0,0,0|1,0,1]=4 11487 B12R1.27 ClCC(CNc1ccccc1)O Amb10565986 [0,2,0,0,0,0|1,0,0]=3 11488 B12R1.27 ClCC(Cl)OCc1ccccc1 Amb25139547 [0,2,0,0,0,0|1,0,0]=3 11489 B12R1.27 ClCC(Cl)\C=C\c1ccccc1 Amb25124868 [0,2,0,0,0,0|1,0,1]=4 11490 B12R1.27 Cl\C(\CCl)=C/Cc1ccccc1 Amb25803609 [0,2,0,0,0,0|1,0,1]=4 11491 B12R1.27 Cl\C(\CCl)=N/Cc1ccccc1 Amb24540801 [0,2,0,0,0,0|1,0,1]=4 11492 B12R1.27 N#CC(=O)CCc1ccccc1 Amb25143496 [0,2,0,0,0,0|0,0,2]=4 11493 B12R1.27 N#CC(Cl)CCc1ccccc1 Amb18791084 [0,2,0,0,0,0|1,0,0]=3 11494 B12R1.27 N#CC(Cl)CNc1ccccc1 Amb18648453 [0,2,0,0,0,0|1,0,1]=4 11495 B12R1.27 N#CC(Cl)CSc1ccccc1 Amb18130442 [0,2,0,0,0,0|1,0,1]=4 11496 B12R1.27 N#CC(O)CCc1cccc[n]1 Amb25284586 [0,2,0,0,0,0|1,0,0]=3 11497 B12R1.27 N#CC(O)CCc1ccccc1 Amb18177732 [0,2,0,0,0,0|0,0,0]=2 11498 B12R1.27 N#CC(O)CNc1cccc[n]1 Amb25035185 [0,2,0,0,0,0|2,0,0]=4 11499 B12R1.27 N#CC(O)CSc1ccccc1 Amb25051459 [0,2,0,0,0,0|1,0,0]=3 11500 B12R1.27 N#C[C@@H](O)CCc1ccccc1 Amb25073440 [0,2,0,0,0,0|0,0,0]=2 11501 B12R1.27 N#C[C@@H](O)COc1ccccc1 Amb24474239 [0,2,0,0,0,0|1,0,0]=3 11502 B12R1.27 N#C[C@@H](O)\C=C\c1ccccc1 Amb24581221 [0,2,0,0,0,0|0,0,2]=4 11503 B12R1.27 N#C[C@H](O)CCc1ccccc1 Amb24344695 [0,2,0,0,0,0|0,0,0]=2 11504 B12R1.27 N#C[C@H](O)\C=C\c1ccccc1 Amb25371981 [0,2,0,0,0,0|0,0,2]=4 11505 B12R1.27 N=C(CF)NCc1ccccc1 Amb24392158 [0,2,0,0,0,0|1,0,1]=4 11506 B12R1.27 N=C(CS)NCc1ccccc1 Amb24664256 [0,2,0,0,0,0|0,1,1]=4 11507 B12R1.27 NC(C#N)COc1ccccc1 Amb17076555 [0,2,0,0,0,0|1,0,1]=4 11508 B12R1.27 NC(CCc1ccccc1)C#N Amb18999188 [0,2,0,0,0,0|1,0,0]=3 11509 B12R1.27 NC(CO)C#Cc1ccccc1 Amb25667614 [0,2,0,0,0,0|0,0,1]=3 11510 B12R1.27 NC(CO)CCc1c[n]ccc1 Amb18563730 [0,2,0,0,0,0|1,0,0]=3 11511 B12R1.27 NC(CO)CCc1cc[n]cc1 Amb18563732 [0,2,0,0,0,0|1,0,0]=3 11512 B12R1.27 NC(CO)CCc1cccc[n]1 Amb18563729 [0,2,0,0,0,0|1,0,0]=3 11513 B12R1.27 NC(CO)CNc1[n]ccc[n]1 Amb25264038 [0,2,0,0,0,0|2,0,0]=4 11514 B12R1.27 NC(CO)CNc1cc[n]c[n]1 Amb24648917 [0,2,0,0,0,0|2,0,0]=4 11515 B12R1.27 NC(CO)CNc1cc[n]cc1 Amb24570958 [0,2,0,0,0,0|1,0,0]=3 11516 B12R1.27 NC(CO)CNc1ccccc1 Amb25674165 [0,2,0,0,0,0|0,0,0]=2 11517 B12R1.27 NC(CO)COc1ccccc1 Amb18563798 [0,2,0,0,0,0|0,0,0]=2 11518 B12R1.27 NC(CO)\C=C\c1ccccc1 Amb25201509 [0,2,0,0,0,0|0,0,1]=3 11519 B12R1.27 NC(CSc1ccccc1)C#N Amb18984305 [0,2,0,0,0,0|1,0,1]=4 11520 B12R1.27 NC(NCc1ccccc1)=NO Amb18800915 [0,2,0,0,0,0|1,0,1]=4 11521 B12R1.27 NCC(=O)CCc1ccccc1 Amb18563587 [0,2,0,0,0,0|1,0,0]=3 11522 B12R1.27 NCC(=O)OCc1ccccc1 Amb1207685 [0,2,0,0,0,0|1,0,1]=4 11523 B12R1.27 NCC(=O)OCc1ccccc1 Amb1808695 [0,2,0,0,0,0|1,0,1]=4 11524 B12R1.27 NCC(=O)OCc1ccccc1 Amb2228429 [0,2,0,0,0,0|1,0,1]=4 11525 B12R1.27 NCC(CNc1ccccc1)O Amb17138613 [0,2,0,0,0,0|1,0,0]=3 11526 B12R1.27 NCC(COc1ccccc1)O Amb1139174 [0,2,0,0,0,0|1,0,0]=3 11527 B12R1.27 NCC(F)C#Cc1ccccc1 Amb24470253 [0,2,0,0,0,0|1,0,1]=4 11528 B12R1.27 NCC(N)\C=C\c1ccccc1 Amb24678472 [0,2,0,0,0,0|1,0,1]=4 11529 B12R1.27 NCC(O)C#Cc1ccccc1 Amb24677996 [0,2,0,0,0,0|0,0,2]=4 11530 B12R1.27 NCC(O)CNc1cc[n]cc1 Amb24752893 [0,2,0,0,0,0|2,0,0]=4 11531 B12R1.27 NCC(O)\C=C\c1ccccc1 Amb18126377 [0,2,0,0,0,0|0,0,2]=4 11532 B12R1.27 NC[C@@H](O)COc1ccccc1 Amb22747719 [0,2,0,0,0,0|1,0,0]=3 11533 B12R1.27 NC\C(\F)=C\Cc1ccccc1 Amb24743578 [0,2,0,0,0,0|1,0,1]=4 11534 B12R1.27 NNC(=O)CCc1ccccc1 Amb1130599 [0,2,0,0,0,0|0,0,2]=4 11535 B12R1.27 N[C@@H](CO)\C=C\c1ccccc1 Amb24565958 [0,2,0,0,0,0|0,0,1]=3 11536 B12R1.27 N\C(\CCc1c[n]ccc1)=N/O Amb24678911 [0,2,0,0,0,0|1,0,1]=4 11537 B12R1.27 N\C(\CCc1cc[n]cc1)=N/O Amb18792640 [0,2,0,0,0,0|1,0,1]=4 11538 B12R1.27 N\C(\CCc1cccc[n]1)=N/O Amb18792639 [0,2,0,0,0,0|1,0,1]=4 11539 B12R1.27 N\C(\CCc1ccccc1)=N\N Amb18788201 [0,2,0,0,0,0|1,0,1]=4 11540 B12R1.27 N\C(\CCc1ccccc1)=N\O Amb22053006 [0,2,0,0,0,0|0,0,1]=3 11541 B12R1.27 N\C(\CNc1ccccc1)=N\O Amb24614329 [0,2,0,0,0,0|1,0,1]=4 11542 B12R1.27 O=C(CBr)CCc1ccccc1 Amb20171375 [0,2,0,0,0,0|1,0,0]=3 11543 B12R1.27 O=C(CBr)COc1ccccc1 Amb20668077 [0,2,0,0,0,0|1,0,1]=4 11544 B12R1.27 O=C(CI)NCc1ccccc1 Amb24084424 [0,2,0,0,0,0|1,0,1]=4 11545 B12R1.27 O=C(CI)OCc1ccccc1 Amb25144488 [0,2,0,0,0,0|1,0,1]=4 11546 B12R1.27 O=CC(CSc1ccccc1)C Amb17594629 [0,2,0,0,0,0|0,0,2]=4 11547 B12R1.27 O=C[C@@H](OCc1ccccc1)C Amb17609288 [0,2,0,0,0,0|0,0,2]=4 11548 B12R1.27 OC(C=O)C#Cc1ccccc1 Amb25375035 [0,2,0,0,0,0|0,0,2]=4 11549 B12R1.27 OC(CF)C#Cc1ccccc1 Amb25157858 [0,2,0,0,0,0|0,0,2]=4 11550 B12R1.27 OC(CF)\C=C\c1ccccc1 Amb25284420 [0,2,0,0,0,0|0,0,2]=4 11551 B12R1.27 OCC(=O)C#Cc1ccccc1 Amb25094460 [0,2,0,0,0,0|0,0,2]=4 11552 B12R1.27 OCC(=O)CCc1cc[n]cc1 Amb18563675 [0,2,0,0,0,0|1,0,0]=3 11553 B12R1.27 OCC(=O)CCc1ccc[n]c1 Amb18563674 [0,2,0,0,0,0|1,0,0]=3 11554 B12R1.27 OCC(=O)CCc1cccc[n]1 Amb18563673 [0,2,0,0,0,0|1,0,0]=3 11555 B12R1.27 OCC(=O)CCc1ccccc1 Amb18563609 [0,2,0,0,0,0|0,0,0]=2 11556 B12R1.27 OCC(=O)COc1ccccc1 Amb18563713 [0,2,0,0,0,0|0,0,1]=3 11557 B12R1.27 OCC(=O)NCc1ccccc1 Amb1111331 [0,2,0,0,0,0|0,0,1]=3 11558 B12R1.27 OCC(=O)NCc1ccccn1 Amb17334667 [0,2,0,0,0,0|1,0,1]=4 11559 B12R1.27 OCC(=O)NCc1cccnc1 Amb17334668 [0,2,0,0,0,0|1,0,1]=4 11560 B12R1.27 OCC(=O)NCc1ccncc1 Amb17334669 [0,2,0,0,0,0|1,0,1]=4 11561 B12R1.27 OCC(=O)\C=C\c1ccccc1 Amb25142729 [0,2,0,0,0,0|0,0,2]=4 11562 B12R1.27 OCC(CNc1ccccc1)O Amb17307124 [0,2,0,0,0,0|0,0,0]=2 11563 B12R1.27 OCC(COc1ccccc1)C Amb17232599 [0,2,0,0,0,0|0,0,0]=2 11564 B12R1.27 OCC(CSc1ccccc1)Cl Amb10553704 [0,2,0,0,0,0|0,0,0]=2 11565 B12R1.27 OCC(Cl)\C=C\c1ccccc1 Amb24711501 [0,2,0,0,0,0|0,0,1]=3 11566 B12R1.27 OCC(F)C#Cc1ccccc1 Amb25157406 [0,2,0,0,0,0|0,0,1]=3 11567 B12R1.27 OCC(O)CNc1ccc[n][n]1 Amb24687294 [0,2,0,0,0,0|2,0,0]=4 11568 B12R1.27 OCC(O)CSc1[n]ccc[n]1 Amb21978218 [0,2,0,0,0,0|2,0,0]=4 11569 B12R1.27 OCC(O)CSc1cccc[n]1 Amb21978181 [0,2,0,0,0,0|1,0,0]=3 11570 B12R1.27 OCC(O)\C=C\c1ccccc1 Amb24496400 [0,2,0,0,0,0|0,0,1]=3 11571 B12R1.27 OC[C@@H](COc1ccccc1)O Amb10982588 [0,2,0,0,0,0|0,0,0]=2 11572 B12R1.27 OC[C@@H](O)CNc1ccccc1 Amb18792912 [0,2,0,0,0,0|0,0,0]=2 11573 B12R1.27 OC[C@@H](O)\C=C\c1ccccc1 Amb24371109 [0,2,0,0,0,0|0,0,1]=3 11574 B12R1.27 OC[C@@H](OCc1ccccc1)C Amb17609287 [0,2,0,0,0,0|0,0,0]=2 11575 B12R1.27 OC\C(=C/Cc1ccccc1)\C Amb17594048 [0,2,0,0,0,0|0,0,1]=3 11576 B12R1.27 OC\C(\F)=C\Cc1ccccc1 Amb24661184 [0,2,0,0,0,0|0,0,1]=3 11577 B12R1.27 ONC(=O)CCc1cc[n]cc1 Amb24577197 [0,2,0,0,0,0|1,0,1]=4 11578 B12R1.27 ONC(=O)CCc1ccc[n]c1 Amb24413046 [0,2,0,0,0,0|1,0,1]=4 11579 B12R1.27 ONC(=O)CCc1cccc[n]1 Amb24703542 [0,2,0,0,0,0|1,0,1]=4 11580 B12R1.27 ONC(=O)OCc1ccccc1 Amb2445312 [0,2,0,0,0,0|1,0,1]=4 11581 B12R1.27 ONC(=S)NCc1ccccc1 Amb25823184 [0,2,0,0,0,0|1,0,1]=4 11582 B12R1.27 O[C@@H](CCl)C#Cc1ccccc1 Amb24429084 [0,2,0,0,0,0|0,0,2]=4 11583 B12R1.27 O[C@@H](CF)C#Cc1ccccc1 Amb24370047 [0,2,0,0,0,0|0,0,2]=4 11584 B12R1.27 O[C@H](CCl)C#Cc1ccccc1 Amb25216902 [0,2,0,0,0,0|0,0,2]=4 11585 B12R1.27 O[C@H](CCl)CNc1ccccc1 Amb24426200 [0,2,0,0,0,0|1,0,0]=3 11586 B12R1.27 O[C@H](CCl)\C=C\c1ccccc1 Amb24565740 [0,2,0,0,0,0|0,0,2]=4 11587 B12R1.27 O[C@H](CF)C#Cc1ccccc1 Amb25769474 [0,2,0,0,0,0|0,0,2]=4 11588 B12R1.27 O[C@H](CF)\C=C\c1ccccc1 Amb24497699 [0,2,0,0,0,0|0,0,2]=4 11589 B12R1.27 O\N=C(\CCc1ccccc1)/N Amb1115853 [0,2,0,0,0,0|0,0,1]=3 11590 B12R1.27 O\N=C(\COc1ccccc1)/N Amb1154723 [0,2,0,0,0,0|1,0,1]=4 11591 B12R1.27 [NH4]OP(=O)OCc1ccccc1 Amb22346178 [0,2,0,0,0,0|2,0,0]=4 11592 B12R1.32 BrCCC(=O)Nc1ccccc1 Amb16191990 [0,2,0,0,0,0|1,0,1]=4 11593 B12R1.32 BrCCC(Br)Cc1ccccc1 Amb23456171 [0,2,0,0,0,0|1,0,0]=3 11594 B12R1.32 C#CCC(=O)Cc1ccccc1 Amb18799925 [0,2,0,0,0,0|1,0,1]=4 11595 B12R1.32 C#CCC(N)Cc1c[n]ccc1 Amb18992475 [0,2,0,0,0,0|2,0,0]=4 11596 B12R1.32 C#CCC(N)Cc1cc[n]cc1 Amb18299312 [0,2,0,0,0,0|2,0,0]=4 11597 B12R1.32 C#CCC(N)Cc1cccc[n]1 Amb18296096 [0,2,0,0,0,0|2,0,0]=4 11598 B12R1.32 C#CCC(N)Cc1ccccc1 Amb18296094 [0,2,0,0,0,0|1,0,0]=3 11599 B12R1.32 C#CCC(O)Cc1c[n]ccc1 Amb18800525 [0,2,0,0,0,0|2,0,0]=4 11600 B12R1.32 C#CCC(O)Cc1cc[n]cc1 Amb18800527 [0,2,0,0,0,0|2,0,0]=4 11601 B12R1.32 C#CCC(O)Cc1cccc[n]1 Amb18800521 [0,2,0,0,0,0|2,0,0]=4 11602 B12R1.32 C#CCC(O)Cc1ccccc1 Amb18800362 [0,2,0,0,0,0|1,0,0]=3 11603 B12R1.32 C#CC[C@@H](O)Cc1ccccc1 Amb24497745 [0,2,0,0,0,0|1,0,0]=3 11604 B12R1.32 C=C=CC(O)Cc1ccccc1 Amb24420844 [0,2,0,0,0,0|1,0,1]=4 11605 B12R1.32 C=C=C[C@H](O)Cc1ccccc1 Amb25158000 [0,2,0,0,0,0|1,0,1]=4 11606 B12R1.32 C=CCC(N)Cc1ccccc1 Amb19015820 [0,2,0,0,0,0|1,0,0]=3 11607 B12R1.32 CC#CC(N)Cc1ccccc1 Amb24417700 [0,2,0,0,0,0|1,0,1]=4 11608 B12R1.32 CC(CC#N)Sc1ccccc1 Amb18795942 [0,2,0,0,0,0|1,0,1]=4 11609 B12R1.32 CC(CCCl)Nc1cc[n]cc1 Amb24524799 [0,2,0,0,0,0|2,0,0]=4 11610 B12R1.32 CC(CCN)Nc1cc[n]cc1 Amb25081324 [0,2,0,0,0,0|2,0,0]=4 11611 B12R1.32 CC(CCO)Nc1c[n]ccc1 Amb25153319 [0,2,0,0,0,0|1,0,0]=3 11612 B12R1.32 CC(CNN)Nc1ccccc1 Amb18646400 [0,2,0,0,0,0|2,0,0]=4 11613 B12R1.32 CC(CNN)Oc1ccccc1 Amb18563756 [0,2,0,0,0,0|2,0,0]=4 11614 B12R1.32 CC(Cc1ccccc1)N=C=O Amb17103991 [0,2,0,0,0,0|0,0,2]=4 11615 B12R1.32 CC(Cc1ccccc1)N=C=S Amb18790890 [0,2,0,0,0,0|0,1,1]=4 11616 B12R1.32 CC(Cc1ccccc1)N=[N+]=[N-] Amb25249262 [0,2,0,0,0,0|2,0,0]=4 11617 B12R1.32 CC(Cc1ccccc1)NC#N Amb18177707 [0,2,0,0,0,0|1,0,1]=4 11618 B12R1.32 CC(Cc1ccccc1)NC=S Amb24635878 [0,2,0,0,0,0|0,1,1]=4 11619 B12R1.32 CC(Nc1ccccc1)CC#N Amb17138511 [0,2,0,0,0,0|1,0,1]=4 11620 B12R1.32 CC(Oc1ccccc1)CC#N Amb17232369 [0,2,0,0,0,0|1,0,1]=4 11621 B12R1.32 CCCC(=N)Nc1ccccc1 Amb24096810 [0,2,0,0,0,0|1,0,1]=4 11622 B12R1.32 CCCC(C)Cc1c[n]ccc1 Amb24094032 [0,2,0,0,0,0|2,0,0]=4 11623 B12R1.32 CCCC(C)Cc1ccccc1 Amb22224920 [0,2,0,0,0,0|1,0,0]=3 11624 B12R1.32 CCCC(Cc1ccccc1)[NH3+] Amb10560244 [0,2,0,0,0,0|1,0,0]=3 11625 B12R1.32 CCCC(N)Cc1ccccc1 Amb18180073 [0,2,0,0,0,0|1,0,0]=3 11626 B12R1.32 CCC\C(\I)=C/c1ccccc1 Amb22546627 [0,2,0,0,0,0|1,0,1]=4 11627 B12R1.32 CCNC(=S)Cc1ccccc1 Amb24066800 [0,2,0,0,0,0|1,0,1]=4 11628 B12R1.32 CCNC(C)Cc1ccccc1 Amb18552940 [0,2,0,0,0,0|1,0,0]=3 11629 B12R1.32 CCNC(C)Cc1ccccc1 Amb22055190 [0,2,0,0,0,0|1,0,0]=3 11630 B12R1.32 CCNC(Cc1ccccn1)C Amb1995151 [0,2,0,0,0,0|2,0,0]=4 11631 B12R1.32 CCOC(=N)Cc1ccccc1 Amb20673132 [0,2,0,0,0,0|1,0,1]=4 11632 B12R1.32 CCSC(C)Nc1ccccc1 Amb24585828 [0,2,0,0,0,0|2,0,0]=4 11633 B12R1.32 CC\N=C(\N)/Cc1ccccc1 Amb23569052 [0,2,0,0,0,0|1,0,1]=4 11634 B12R1.32 CN(CC=O)Cc1ccccc1 Amb18800711 [0,2,0,0,0,0|0,0,2]=4 11635 B12R1.32 CN(CCBr)Cc1ccccc1 Amb24357900 [0,2,0,0,0,0|1,0,0]=3 11636 B12R1.32 CN(CCCl)Cc1ccccc1 Amb19895292 [0,2,0,0,0,0|1,0,0]=3 11637 B12R1.32 CN(CCF)Cc1ccccc1 Amb25318241 [0,2,0,0,0,0|1,0,0]=3 11638 B12R1.32 CN(CCI)Cc1ccccc1 Amb25235494 [0,2,0,0,0,0|1,0,0]=3 11639 B12R1.32 CN(CCO)Cc1c[n]cc[n]1 Amb18805619 [0,2,0,0,0,0|2,0,0]=4 11640 B12R1.32 CNCC(C)Oc1ccccc1 Amb19025044 [0,2,0,0,0,0|2,0,0]=4 11641 B12R1.32 CNCC(Cc1ccccc1)O Amb17193901 [0,2,0,0,0,0|1,0,0]=3 11642 B12R1.32 CNCC(Cc1cccnc1)O Amb17232605 [0,2,0,0,0,0|2,0,0]=4 11643 B12R1.32 CNCC(N)Cc1ccccc1 Amb19009730 [0,2,0,0,0,0|1,0,0]=3 11644 B12R1.32 COCC(C)Nc1c[n]ccc1 Amb19024143 [0,2,0,0,0,0|2,0,0]=4 11645 B12R1.32 COCC(C)Nc1ccccc1 Amb19024307 [0,2,0,0,0,0|1,0,0]=3 11646 B12R1.32 COCC(N)Cc1ccccc1 Amb20623561 [0,2,0,0,0,0|0,0,0]=2 11647 B12R1.32 COC[C@@H](C)Nc1cc[n]cc1 Amb25220804 [0,2,0,0,0,0|2,0,0]=4 11648 B12R1.32 CONC(=O)Cc1ccccc1 Amb16969924 [0,2,0,0,0,0|1,0,1]=4 11649 B12R1.32 CSCC(C)Nc1ccccc1 Amb25674366 [0,2,0,0,0,0|1,1,0]=4 11650 B12R1.32 C[C@@H](CC#N)Nc1ccccc1 Amb25301483 [0,2,0,0,0,0|1,0,1]=4 11651 B12R1.32 C[C@@H](CCO)Nc1[n]ccc[n]1 Amb25205315 [0,2,0,0,0,0|2,0,0]=4 11652 B12R1.32 C[C@@H](CCO)Nc1c[n]cc[n]1 Amb24631928 [0,2,0,0,0,0|2,0,0]=4 11653 B12R1.32 C[C@@H](CCO)Nc1ccc[n][n]1 Amb24633067 [0,2,0,0,0,0|2,0,0]=4 11654 B12R1.32 C[C@@H](CCO)Nc1cccc[n]1 Amb24722354 [0,2,0,0,0,0|1,0,0]=3 11655 B12R1.32 C[C@@H](CCO)Nc1ccccc1 Amb25124401 [0,2,0,0,0,0|0,0,0]=2 11656 B12R1.32 C[C@@H](Cc1ccccc1)N=[N+]=[N-] Amb24356215 [0,2,0,0,0,0|2,0,0]=4 11657 B12R1.32 C[C@@H](Cc1ccccc1)NC=O Amb24637855 [0,2,0,0,0,0|0,0,2]=4 11658 B12R1.32 C[C@H](CC#N)Nc1ccccc1 Amb24459585 [0,2,0,0,0,0|1,0,1]=4 11659 B12R1.32 C[C@H](CCO)Nc1[n]ccc[n]1 Amb24387625 [0,2,0,0,0,0|2,0,0]=4 11660 B12R1.32 C[C@H](CCO)Nc1c[n]cc[n]1 Amb25746188 [0,2,0,0,0,0|2,0,0]=4 11661 B12R1.32 C[C@H](CCO)Nc1cc[n]cc1 Amb24722224 [0,2,0,0,0,0|1,0,0]=3 11662 B12R1.32 C[C@H](CCO)Nc1cccc[n]1 Amb25160516 [0,2,0,0,0,0|1,0,0]=3 11663 B12R1.32 C[C@H](CCO)Nc1ccccc1 Amb25324766 [0,2,0,0,0,0|0,0,0]=2 11664 B12R1.32 C[C@H](Cc1ccccc1)N=[N+]=[N-] Amb25667629 [0,2,0,0,0,0|2,0,0]=4 11665 B12R1.32 C\C(\CCBr)=C/c1ccccc1 Amb18063581 [0,2,0,0,0,0|1,0,1]=4 11666 B12R1.32 C\C(\CCN)=C/c1ccccc1 Amb18063553 [0,2,0,0,0,0|1,0,1]=4 11667 B12R1.32 C\C(\CCO)=C\c1ccccc1 Amb24576953 [0,2,0,0,0,0|0,0,1]=3 11668 B12R1.32 C\C(\Cc1ccccc1)=C\CN Amb25669583 [0,2,0,0,0,0|1,0,1]=4 11669 B12R1.32 C\C=C\C(N)Cc1ccccc1 Amb25142747 [0,2,0,0,0,0|1,0,1]=4 11670 B12R1.32 C\C=C\[C@@H](O)Cc1ccccc1 Amb25741490 [0,2,0,0,0,0|1,0,1]=4 11671 B12R1.32 C\C=C\[C@H](O)Cc1ccccc1 Amb24353018 [0,2,0,0,0,0|1,0,1]=4 11672 B12R1.32 ClCCC(=O)Oc1ccccc1 Amb16230794 [0,2,0,0,0,0|1,0,1]=4 11673 B12R1.32 ClCCN(Cc1ccccn1)C Amb17335728 [0,2,0,0,0,0|2,0,0]=4 11674 B12R1.32 ClCCN(Cc1cccnc1)C Amb17335729 [0,2,0,0,0,0|2,0,0]=4 11675 B12R1.32 ClCCN(Cc1ccncc1)C Amb17335730 [0,2,0,0,0,0|2,0,0]=4 11676 B12R1.32 Cl\C(\Cc1ccccc1)=C/CCl Amb25035226 [0,2,0,0,0,0|1,0,1]=4 11677 B12R1.32 Cl\C(\Cc1ccccc1)=C\CCl Amb24563867 [0,2,0,0,0,0|1,0,1]=4 11678 B12R1.32 N#CCC(=O)Cc1ccccc1 Amb17232286 [0,2,0,0,0,0|1,0,1]=4 11679 B12R1.32 N#CCC(Cl)Sc1ccccc1 Amb24373160 [0,2,0,0,0,0|1,0,1]=4 11680 B12R1.32 N#CCC(F)Cc1ccccc1 Amb25079148 [0,2,0,0,0,0|1,0,0]=3 11681 B12R1.32 N#CC[C@H](O)Cc1ccccc1 Amb24386953 [0,2,0,0,0,0|1,0,0]=3 11682 B12R1.32 NCCC(=O)Nc1ccccc1 Amb1125528 [0,2,0,0,0,0|1,0,1]=4 11683 B12R1.32 NCCC(=O)Nc1ccccc1 Amb15740909 [0,2,0,0,0,0|1,0,1]=4 11684 B12R1.32 NCCC(=O)Oc1ccccc1 Amb17334633 [0,2,0,0,0,0|1,0,1]=4 11685 B12R1.32 NCCC(Cc1ccccc1)C Amb17232439 [0,2,0,0,0,0|1,0,0]=3 11686 B12R1.32 NCCC(Cc1ccccc1)O Amb17232552 [0,2,0,0,0,0|1,0,0]=3 11687 B12R1.32 NCCC(O)Cc1c[n]ccc1 Amb18827678 [0,2,0,0,0,0|2,0,0]=4 11688 B12R1.32 NCCC(O)Cc1cccc[n]1 Amb18827677 [0,2,0,0,0,0|2,0,0]=4 11689 B12R1.32 NCCC(Oc1ccccc1)C Amb17232556 [0,2,0,0,0,0|1,0,0]=3 11690 B12R1.32 NCCS(=O)Cc1ccccc1 Amb18306046 [0,2,0,0,0,0|1,0,0]=3 11691 B12R1.32 NN(CCO)Cc1ccccc1 Amb18646608 [0,2,0,0,0,0|0,0,0]=2 11692 B12R1.32 NOCC(=O)Nc1ccccc1 Amb24596278 [0,2,0,0,0,0|1,0,1]=4 11693 B12R1.32 NOCC(=O)Oc1ccccc1 Amb24096859 [0,2,0,0,0,0|1,0,1]=4 11694 B12R1.32 N[C@@H](CC#N)Cc1ccccc1 Amb24483888 [0,2,0,0,0,0|1,0,0]=3 11695 B12R1.32 O=C(CCF)Nc1ccccc1 Amb25276540 [0,2,0,0,0,0|1,0,1]=4 11696 B12R1.32 O=C(CCI)Nc1ccccc1 Amb23447340 [0,2,0,0,0,0|1,0,1]=4 11697 B12R1.32 OC(CCCl)Nc1ccccc1 Amb24635759 [0,2,0,0,0,0|1,0,0]=3 11698 B12R1.32 OC(Cc1ccccc1)C#CCl Amb25156729 [0,2,0,0,0,0|1,0,1]=4 11699 B12R1.32 OC(Cc1ccccc1)CC#N Amb17232368 [0,2,0,0,0,0|1,0,0]=3 11700 B12R1.32 OCCC(Cc1ccccc1)C Amb17232486 [0,2,0,0,0,0|0,0,0]=2 11701 B12R1.32 OCCC(O)Cc1ccccc1 Amb22491209 [0,2,0,0,0,0|0,0,0]=2 11702 B12R1.32 OCCC(O)Nc1ccccc1 Amb25060097 [0,2,0,0,0,0|0,0,0]=2 11703 B12R1.32 OCCC(Oc1ccccc1)C Amb17232598 [0,2,0,0,0,0|0,0,0]=2 11704 B12R1.32 OCCN(O)Cc1ccccc1 Amb25284514 [0,2,0,0,0,0|0,0,0]=2 11705 B12R1.32 OCNC(=O)C[n+]1ccccc1 Amb25046777 [0,2,0,0,0,0|1,0,1]=4 11706 B12R1.32 OCNC(=O)Oc1ccccc1 Amb10552983 [0,2,0,0,0,0|1,0,1]=4 11707 B12R1.32 ONCC(=O)Nc1ccccc1 Amb24495972 [0,2,0,0,0,0|1,0,1]=4 11708 B12R1.32 O\C=C\C(=O)Cc1ccccc1 Amb25093804 [0,2,0,0,0,0|0,0,2]=4 11709 B12R1.32 O\N=C\C(=O)Cc1ccccc1 Amb24577781 [0,2,0,0,0,0|0,0,2]=4 11710 B12R1.32 O\N=C\C(O)Cc1ccccc1 Amb25136306 [0,2,0,0,0,0|0,0,1]=3 11711 B12R1.32 SCCC(=O)Nc1ccccc1 Amb17305724 [0,2,0,0,0,0|0,1,1]=4 11712 B12R1.32 SCCN(Cc1ccccc1)C Amb13881720 [0,2,0,0,0,0|0,1,0]=3 11713 B12R1.32 [BH3]N(CCC)Cc1ccccc1 Amb24678772 [0,2,0,0,0,0|1,0,0]=3 11714 B12R1.32 [K]ONC(=O)Cc1ccccc1 Amb10558422 [0,2,0,0,0,0|1,0,1]=4 11715 B12R1.252 BrC(=C)CNCc1ccccc1 Amb1774594 [0,2,0,0,0,0|1,0,1]=4 11716 B12R1.252 C=C(Br)COCc1ccccc1 Amb25305709 [0,2,0,0,0,0|1,0,1]=4 11717 B12R1.252 C=C(Cl)CNCc1ccccc1 Amb19004833 [0,2,0,0,0,0|1,0,1]=4 11718 B12R1.252 C=C(F)CNCc1ccccc1 Amb25060778 [0,2,0,0,0,0|1,0,1]=4 11719 B12R1.252 CC(=C)CCNc1ccccc1 Amb25771824 [0,2,0,0,0,0|1,0,1]=4 11720 B12R1.252 CC(=C)CNCc1ccccc1 Amb10608684 [0,2,0,0,0,0|1,0,1]=4 11721 B12R1.252 CC(=C)CNCc1ccccc1 Amb17622487 [0,2,0,0,0,0|1,0,1]=4 11722 B12R1.252 CC(=N)NCCc1ccccc1 Amb25148437 [0,2,0,0,0,0|1,0,1]=4 11723 B12R1.252 CC(=O)CCCc1cccc[n]1 Amb22284162 [0,2,0,0,0,0|1,0,1]=4 11724 B12R1.252 CC(=O)CCCc1ccccn1 Amb1102603 [0,2,0,0,0,0|1,0,1]=4 11725 B12R1.252 CC(=O)CCCc1cccnc1 Amb17232426 [0,2,0,0,0,0|1,0,1]=4 11726 B12R1.252 CC(Br)CCSc1ccccc1 Amb20623511 [0,2,0,0,0,0|1,0,0]=3 11727 B12R1.252 CC(C)=CCCc1ccccc1 Amb17843373 [0,2,0,0,0,0|1,0,1]=4 11728 B12R1.252 CC(C)CCCc1ccccc1 Amb24063684 [0,2,0,0,0,0|1,0,0]=3 11729 B12R1.252 CC(C)CCOc1ccccc1 Amb23450363 [0,2,0,0,0,0|1,0,0]=3 11730 B12R1.252 CC(C)CNCc1c[n]ccc1 Amb19890483 [0,2,0,0,0,0|2,0,0]=4 11731 B12R1.252 CC(C)CNCc1cc[n]cc1 Amb19890504 [0,2,0,0,0,0|2,0,0]=4 11732 B12R1.252 CC(C)CNCc1cccc[n]1 Amb19890497 [0,2,0,0,0,0|2,0,0]=4 11733 B12R1.252 CC(C)CNCc1ccccc1 Amb22586944 [0,2,0,0,0,0|1,0,0]=3 11734 B12R1.252 CC(C)NCCc1cc[n]cc1 Amb24117837 [0,2,0,0,0,0|2,0,0]=4 11735 B12R1.252 CC(C)NOCc1ccccc1 Amb24407142 [0,2,0,0,0,0|2,0,0]=4 11736 B12R1.252 CC(C)ONCc1ccccc1 Amb24408832 [0,2,0,0,0,0|2,0,0]=4 11737 B12R1.252 CC(CCCc1ccccc1)Cl Amb17477428 [0,2,0,0,0,0|1,0,0]=3 11738 B12R1.252 CC(CCCc1ccccc1)O Amb17138575 [0,2,0,0,0,0|0,0,0]=2 11739 B12R1.252 CC(CCCc1ccccn1)C Amb10573555 [0,2,0,0,0,0|2,0,0]=4 11740 B12R1.252 CC(CCCc1cccnc1)N Amb17232504 [0,2,0,0,0,0|2,0,0]=4 11741 B12R1.252 CC(CCSc1ccccc1)N Amb13881552 [0,2,0,0,0,0|1,0,0]=3 11742 B12R1.252 CC(CNCc1cccnc1)C Amb17622318 [0,2,0,0,0,0|2,0,0]=4 11743 B12R1.252 CC(COCc1ccccc1)N Amb1124568 [0,2,0,0,0,0|1,0,0]=3 11744 B12R1.252 CC(Cl)CCNc1cccc[n]1 Amb24461371 [0,2,0,0,0,0|2,0,0]=4 11745 B12R1.252 CC(Cl)COCc1ccccc1 Amb25059141 [0,2,0,0,0,0|1,0,0]=3 11746 B12R1.252 CC(Cl)\C=C\Cc1ccccc1 Amb25724973 [0,2,0,0,0,0|1,0,1]=4 11747 B12R1.252 CC(F)CCCc1ccccc1 Amb22229780 [0,2,0,0,0,0|1,0,0]=3 11748 B12R1.252 CC(F)CNCc1ccccc1 Amb25795376 [0,2,0,0,0,0|1,0,0]=3 11749 B12R1.252 CC(I)CCCc1ccccc1 Amb22274883 [0,2,0,0,0,0|1,0,0]=3 11750 B12R1.252 CC(N)CC#Cc1ccccc1 Amb25081198 [0,2,0,0,0,0|1,0,1]=4 11751 B12R1.252 CC(N)CCNc1ccccc1 Amb19009675 [0,2,0,0,0,0|1,0,0]=3 11752 B12R1.252 CC(N)CNCc1ccccc1 Amb18305296 [0,2,0,0,0,0|1,0,0]=3 11753 B12R1.252 CC(NCCc1ccccc1)C Amb2111109 [0,2,0,0,0,0|1,0,0]=3 11754 B12R1.252 CC(NCCc1cccnc1)C Amb17400162 [0,2,0,0,0,0|2,0,0]=4 11755 B12R1.252 CC(O)C#COc1ccccc1 Amb25357442 [0,2,0,0,0,0|0,0,2]=4 11756 B12R1.252 CC(O)C=C=Cc1ccccc1 Amb24431362 [0,2,0,0,0,0|0,0,2]=4 11757 B12R1.252 CC(O)CC#Cc1c[n]ccc1 Amb24464546 [0,2,0,0,0,0|1,0,1]=4 11758 B12R1.252 CC(O)CCCc1c[n]ccc1 Amb22292250 [0,2,0,0,0,0|1,0,0]=3 11759 B12R1.252 CC(O)CCNc1[n]ccc[n]1 Amb25774705 [0,2,0,0,0,0|2,0,0]=4 11760 B12R1.252 CC(O)CCNc1cc[n]c[n]1 Amb25108875 [0,2,0,0,0,0|2,0,0]=4 11761 B12R1.252 CC(O)CCNc1cccc[n]1 Amb25361843 [0,2,0,0,0,0|1,0,0]=3 11762 B12R1.252 CC(O)CCNc1ccccc1 Amb25376877 [0,2,0,0,0,0|0,0,0]=2 11763 B12R1.252 CC(O)CNNc1ccccc1 Amb24719484 [0,2,0,0,0,0|1,0,0]=3 11764 B12R1.252 CC(O)C\C=C\c1c[n]ccc1 Amb25047994 [0,2,0,0,0,0|1,0,1]=4 11765 B12R1.252 CC(O)C\C=C\c1ccccc1 Amb24645318 [0,2,0,0,0,0|0,0,1]=3 11766 B12R1.252 CC(O)C\N=N\c1ccccc1 Amb25855784 [0,2,0,0,0,0|1,0,0]=3 11767 B12R1.252 CC(O)\C=N\Nc1ccccc1 Amb25816526 [0,2,0,0,0,0|1,0,1]=4 11768 B12R1.252 CC(OCCc1ccccn1)C Amb10573511 [0,2,0,0,0,0|2,0,0]=4 11769 B12R1.252 CC(S)CNCc1ccccc1 Amb18648551 [0,2,0,0,0,0|0,1,0]=3 11770 B12R1.252 CN(C)CCOc1ccccc1 Amb22499767 [0,2,0,0,0,0|2,0,0]=4 11771 B12R1.252 CN(CCCc1ccccc1)C Amb1085936 [0,2,0,0,0,0|1,0,0]=3 11772 B12R1.252 CN(N)CCNc1ccccc1 Amb18646399 [0,2,0,0,0,0|2,0,0]=4 11773 B12R1.252 CN(N)CCOc1ccccc1 Amb18563757 [0,2,0,0,0,0|2,0,0]=4 11774 B12R1.252 CS(=O)CCNc1ccccc1 Amb24562694 [0,2,0,0,0,0|1,0,1]=4 11775 B12R1.252 C[C@@H](COCc1ccccc1)N Amb17061656 [0,2,0,0,0,0|1,0,0]=3 11776 B12R1.252 C[C@@H](N)CCCc1c[n]ccc1 Amb22388607 [0,2,0,0,0,0|2,0,0]=4 11777 B12R1.252 C[C@@H](N)COCc1ccccc1 Amb18529657 [0,2,0,0,0,0|1,0,0]=3 11778 B12R1.252 C[C@@H](O)CCNc1[n]ccc[n]1 Amb24476471 [0,2,0,0,0,0|2,0,0]=4 11779 B12R1.252 C[C@@H](O)CNCc1ccccc1 Amb25708513 [0,2,0,0,0,0|0,0,0]=2 11780 B12R1.252 C[C@@H](O)COCc1ccccc1 Amb22169747 [0,2,0,0,0,0|0,0,0]=2 11781 B12R1.252 C[C@@H](O)C\C=C\c1c[n]ccc1 Amb25157958 [0,2,0,0,0,0|1,0,1]=4 11782 B12R1.252 C[C@@H](O)C\C=C\c1ccccc1 Amb25846224 [0,2,0,0,0,0|0,0,1]=3 11783 B12R1.252 C[C@@H](O)C\N=C\c1ccccc1 Amb25369326 [0,2,0,0,0,0|0,0,1]=3 11784 B12R1.252 C[C@@H](O)\C=C\Sc1ccccc1 Amb25052220 [0,2,0,0,0,0|0,0,2]=4 11785 B12R1.252 C[C@@H](O)\C=N\Nc1ccccc1 Amb24608055 [0,2,0,0,0,0|1,0,1]=4 11786 B12R1.252 C[C@H](Cl)\C=N\Cc1ccccc1 Amb25279567 [0,2,0,0,0,0|1,0,1]=4 11787 B12R1.252 C[C@H](N)CNCc1ccccc1 Amb25047295 [0,2,0,0,0,0|1,0,0]=3 11788 B12R1.252 C[C@H](O)CC#Cc1ccccc1 Amb24593809 [0,2,0,0,0,0|0,0,1]=3 11789 B12R1.252 C[C@H](O)CCNc1cc[n]cc1 Amb25334540 [0,2,0,0,0,0|1,0,0]=3 11790 B12R1.252 C[C@H](O)CCNc1ccc[n][n]1 Amb25297157 [0,2,0,0,0,0|2,0,0]=4 11791 B12R1.252 C[C@H](O)CCNc1cccc[n]1 Amb24676365 [0,2,0,0,0,0|1,0,0]=3 11792 B12R1.252 C[C@H](O)COCc1ccccc1 Amb22044890 [0,2,0,0,0,0|0,0,0]=2 11793 B12R1.252 C[C@H](O)C\C=C\c1ccccc1 Amb25080010 [0,2,0,0,0,0|0,0,1]=3 11794 B12R1.252 C[C@H](O)C\N=C\c1ccccc1 Amb24642411 [0,2,0,0,0,0|0,0,1]=3 11795 B12R1.252 C[C@H](O)\C=N\Nc1ccccc1 Amb25816090 [0,2,0,0,0,0|1,0,1]=4 11796 B12R1.252 C[SiH](C)CCCc1ccccc1 Amb22366558 [0,2,0,0,0,0|1,0,0]=3 11797 B12R1.252 ClC(=O)CCSc1ccccc1 Amb10064363 [0,2,0,0,0,0|0,0,2]=4 11798 B12R1.252 ClC(Cl)[SiH2]CCc1cc[n]cc1 Amb24091142 [0,2,0,0,0,0|2,0,0]=4 11799 B12R1.252 Cl[SiH](Cl)CCCc1ccccc1 Amb22232507 [0,2,0,0,0,0|1,0,0]=3 11800 B12R1.252 FC(CNCc1ccccc1)F Amb16229911 [0,2,0,0,0,0|1,0,0]=3 11801 B12R1.252 FC(F)CNCc1c[n]ccc1 Amb18794307 [0,2,0,0,0,0|2,0,0]=4 11802 B12R1.252 FC(F)CSCc1ccccc1 Amb22008716 [0,2,0,0,0,0|1,0,0]=3 11803 B12R1.252 NC(=N)CCCc1cc[n]cc1 Amb24083112 [0,2,0,0,0,0|2,0,0]=4 11804 B12R1.252 NC(=N)CCCc1ccc[n]c1 Amb24062322 [0,2,0,0,0,0|2,0,0]=4 11805 B12R1.252 NC(=N)CCCc1cccc[n]1 Amb21618753 [0,2,0,0,0,0|2,0,0]=4 11806 B12R1.252 NC(=N)CNCc1ccccc1 Amb25031584 [0,2,0,0,0,0|1,0,1]=4 11807 B12R1.252 NC(=N)NCCc1ccccc1 Amb22736089 [0,2,0,0,0,0|1,0,1]=4 11808 B12R1.252 NC(=N)NCCc1ccccc1 Amb22736599 [0,2,0,0,0,0|1,0,1]=4 11809 B12R1.252 NC(=N)SCCc1ccccc1 Amb20675983 [0,2,0,0,0,0|1,0,1]=4 11810 B12R1.252 NC(=O)NCCc1ccccc1 Amb1124980 [0,2,0,0,0,0|0,0,2]=4 11811 B12R1.252 NC(=S)CCNc1ccccc1 Amb17233757 [0,2,0,0,0,0|0,1,1]=4 11812 B12R1.252 NC(=S)CCSc1ccccc1 Amb17307558 [0,2,0,0,0,0|0,1,1]=4 11813 B12R1.252 NC(=S)CNCc1ccccc1 Amb17233758 [0,2,0,0,0,0|0,1,1]=4 11814 B12R1.252 NC(=S)NCCc1ccccc1 Amb1647056 [0,2,0,0,0,0|0,1,1]=4 11815 B12R1.252 O=C(Cl)CNCc1ccccc1 Amb25040534 [0,2,0,0,0,0|0,0,2]=4 11816 B12R1.252 O=C(Cl)NCCc1ccccc1 Amb24619690 [0,2,0,0,0,0|0,0,2]=4 11817 B12R1.252 OB(O)CCCc1ccccc1 Amb21928056 [0,2,0,0,0,0|0,0,0]=2 11818 B12R1.252 OB(O)\C=C\Cc1ccccc1 Amb21856558 [0,2,0,0,0,0|0,0,2]=4 11819 B12R1.252 OC(=O)CC#Cc1ccccc1 Amb18296382 [0,2,0,0,0,0|0,0,2]=4 11820 B12R1.252 OC(=O)CCC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22056045 [0,2,0,0,0,0|0,0,0]=2 11821 B12R1.252 OC(=O)CCCc1[n]ccc[n]1 Amb18862661 [0,2,0,0,0,0|2,0,0]=4 11822 B12R1.252 OC(=O)CCCc1c[n]c[n]c1 Amb18827885 [0,2,0,0,0,0|2,0,0]=4 11823 B12R1.252 OC(=O)CCCc1cc[n]cc1 Amb19929548 [0,2,0,0,0,0|1,0,0]=3 11824 B12R1.252 OC(=O)CCCc1cccc[n]1 Amb19356883 [0,2,0,0,0,0|1,0,0]=3 11825 B12R1.252 OC(=O)CCCc1ccccc1 Amb2388283 [0,2,0,0,0,0|0,0,0]=2 11826 B12R1.252 OC(=O)CCCc1ccccn1 Amb1099328 [0,2,0,0,0,0|1,0,0]=3 11827 B12R1.252 OC(=O)CCCc1cccnc1 Amb17232526 [0,2,0,0,0,0|1,0,0]=3 11828 B12R1.252 OC(=O)CCCc1ccncc1 Amb1099336 [0,2,0,0,0,0|1,0,0]=3 11829 B12R1.252 OC(=O)CCNc1ccc[n]c1 Amb18269696 [0,2,0,0,0,0|1,0,1]=4 11830 B12R1.252 OC(=O)CCNc1ccccc1 Amb1207377 [0,2,0,0,0,0|0,0,1]=3 11831 B12R1.252 OC(=O)CCNc1ccccn1 Amb10609119 [0,2,0,0,0,0|1,0,1]=4 11832 B12R1.252 OC(=O)CCOc1ccccc1 Amb1206804 [0,2,0,0,0,0|0,0,1]=3 11833 B12R1.252 OC(=O)CCSc1ccccc1 Amb1036581 [0,2,0,0,0,0|0,0,1]=3 11834 B12R1.252 OC(=O)CCSc1ccccn1 Amb1133894 [0,2,0,0,0,0|1,0,1]=4 11835 B12R1.252 OC(=O)CNCc1ccccn1 Amb1111426 [0,2,0,0,0,0|1,0,1]=4 11836 B12R1.252 OC(=O)CNCc1ccccn1 Amb13951702 [0,2,0,0,0,0|1,0,1]=4 11837 B12R1.252 OC(=O)CNCc1cccnc1 Amb1111197 [0,2,0,0,0,0|1,0,1]=4 11838 B12R1.252 OC(=O)CNCc1ccncc1 Amb1110916 [0,2,0,0,0,0|1,0,1]=4 11839 B12R1.252 OC(=O)CNNc1ccccc1 Amb25258415 [0,2,0,0,0,0|1,0,1]=4 11840 B12R1.252 OC(=O)COCc1ccncc1 Amb13883046 [0,2,0,0,0,0|1,0,1]=4 11841 B12R1.252 OC(=O)CSCc1ccccn1 Amb1126746 [0,2,0,0,0,0|1,0,1]=4 11842 B12R1.252 OC(=O)CSCc1cccnc1 Amb1129471 [0,2,0,0,0,0|1,0,1]=4 11843 B12R1.252 OC(=O)CSCc1ccncc1 Amb1134758 [0,2,0,0,0,0|1,0,1]=4 11844 B12R1.252 OC(=O)C[NH2+]Cc1ccccc1 Amb24113880 [0,2,0,0,0,0|0,0,1]=3 11845 B12R1.252 OC(=O)C\N=C\c1ccccc1 Amb24627161 [0,2,0,0,0,0|0,0,2]=4 11846 B12R1.252 OC(=O)\C=N/Cc1ccccc1 Amb24068312 [0,2,0,0,0,0|0,0,2]=4 11847 B12R1.252 [O-]C(=O)CCCc1ccccc1 Amb15690987 [0,2,0,0,0,0|0,0,1]=3 11848 B12R1.252 [O-]C(=O)CC[NH2+]c1ccccc1 Amb22499683 [0,2,0,0,0,0|0,0,2]=4 11849 B12R1.43 BrC(C(=O)C)Cc1ccccc1 Amb17507835 [0,2,0,0,0,0|0,0,2]=4 11850 B12R1.43 BrC(C(=O)O)C[n+]1ccccc1 Amb1030017 [0,2,0,0,0,0|1,0,1]=4 11851 B12R1.43 Br[C@@H](C(=O)O)Cc1ccccc1 Amb17610062 [0,2,0,0,0,0|0,0,1]=3 11852 B12R1.43 Br[C@H](C(=O)O)Cc1ccccc1 Amb17610063 [0,2,0,0,0,0|0,0,1]=3 11853 B12R1.43 CC(=C)C(Cl)Cc1ccccc1 Amb24635687 [0,2,0,0,0,0|1,0,1]=4 11854 B12R1.43 CC(=C)[C@@H](O)Cc1ccccc1 Amb25077949 [0,2,0,0,0,0|1,0,1]=4 11855 B12R1.43 CC(=O)C(O)Cc1ccccc1 Amb25340966 [0,2,0,0,0,0|0,0,2]=4 11856 B12R1.43 CC(=O)[C@@H](C)Cc1ccccc1 Amb24356281 [0,2,0,0,0,0|0,0,2]=4 11857 B12R1.43 CC(=O)[C@@H](Cl)Cc1ccccc1 Amb24595784 [0,2,0,0,0,0|0,0,2]=4 11858 B12R1.43 CC(=O)[C@@H](O)Cc1ccccc1 Amb24722888 [0,2,0,0,0,0|0,0,2]=4 11859 B12R1.43 CC(=O)[C@H](C)Cc1ccccc1 Amb25233687 [0,2,0,0,0,0|0,0,2]=4 11860 B12R1.43 CC(C(=O)C)Cc1ccccc1 Amb17232407 [0,2,0,0,0,0|0,0,2]=4 11861 B12R1.43 CC(C(=O)Cc1ccccc1)Cl Amb10609316 [0,2,0,0,0,0|1,0,1]=4 11862 B12R1.43 CC(C(=O)Nc1ccccc1)O Amb1230509 [0,2,0,0,0,0|1,0,1]=4 11863 B12R1.43 CC(C(=O)O)Nc1ccccc1 Amb1213440 [0,2,0,0,0,0|1,0,1]=4 11864 B12R1.43 CC(C(=O)O)Sc1ccccc1 Amb1215286 [0,2,0,0,0,0|1,0,1]=4 11865 B12R1.43 CC(C(N)C)Cc1ccccc1 Amb17232438 [0,2,0,0,0,0|1,0,0]=3 11866 B12R1.43 CC(C(O)C)Cc1ccccc1 Amb17232485 [0,2,0,0,0,0|0,0,0]=2 11867 B12R1.43 CC(C)C(Br)Cc1cc[n]cc1 Amb25044666 [0,2,0,0,0,0|2,0,0]=4 11868 B12R1.43 CC(C)C(Br)Cc1cccc[n]1 Amb25336043 [0,2,0,0,0,0|2,0,0]=4 11869 B12R1.43 CC(C)C(Br)Cc1ccccc1 Amb25690703 [0,2,0,0,0,0|1,0,0]=3 11870 B12R1.43 CC(C)C(Cl)Cc1cc[n]cc1 Amb25148443 [0,2,0,0,0,0|2,0,0]=4 11871 B12R1.43 CC(C)C(Cl)Cc1ccccc1 Amb19045146 [0,2,0,0,0,0|1,0,0]=3 11872 B12R1.43 CC(C)C(N)Cc1cc[n]cc1 Amb18299313 [0,2,0,0,0,0|2,0,0]=4 11873 B12R1.43 CC(C)C(N)Cc1ccc[n]c1 Amb18299298 [0,2,0,0,0,0|2,0,0]=4 11874 B12R1.43 CC(C)C(O)Cc1cc[n]cc1 Amb18800936 [0,2,0,0,0,0|2,0,0]=4 11875 B12R1.43 CC(C)C(O)Cc1ccc[n]c1 Amb18800935 [0,2,0,0,0,0|2,0,0]=4 11876 B12R1.43 CC(C)C(O)Cc1cccc[n]1 Amb18792669 [0,2,0,0,0,0|2,0,0]=4 11877 B12R1.43 CC(C)N(O)Cc1ccccc1 Amb25130380 [0,2,0,0,0,0|2,0,0]=4 11878 B12R1.43 CC(C)[C@@H](C)Nc1ccccc1 Amb25375808 [0,2,0,0,0,0|2,0,0]=4 11879 B12R1.43 CC(Cc1[n]ccc[n]1)C(C)O Amb25710237 [0,2,0,0,0,0|2,0,0]=4 11880 B12R1.43 CC(Cc1c[n]ccc1)C(C)Cl Amb25711097 [0,2,0,0,0,0|2,0,0]=4 11881 B12R1.43 CC(Cc1cc[n]cc1)C(C)Cl Amb25827015 [0,2,0,0,0,0|2,0,0]=4 11882 B12R1.43 CC(Cc1cc[n]cc1)C(C)N Amb18828714 [0,2,0,0,0,0|2,0,0]=4 11883 B12R1.43 CC(Cc1cc[n]cc1)C(C)O Amb25710238 [0,2,0,0,0,0|1,0,0]=3 11884 B12R1.43 CC(Cc1cccc[n]1)C(C)Br Amb25732857 [0,2,0,0,0,0|2,0,0]=4 11885 B12R1.43 CC(Cc1cccc[n]1)C(C)Cl Amb24640097 [0,2,0,0,0,0|2,0,0]=4 11886 B12R1.43 CC(Cc1cccc[n]1)C(C)N Amb25277034 [0,2,0,0,0,0|2,0,0]=4 11887 B12R1.43 CC(Cc1cccc[n]1)C(C)O Amb24341829 [0,2,0,0,0,0|1,0,0]=3 11888 B12R1.43 CC(Cc1ccccc1)C(C)Br Amb24751375 [0,2,0,0,0,0|1,0,0]=3 11889 B12R1.43 CC(Cc1ccccc1)C(C)Cl Amb19074260 [0,2,0,0,0,0|1,0,0]=3 11890 B12R1.43 CC(Cc1ccccc1)[N+]([O-])=O Amb17689219 [0,2,0,0,0,0|1,0,1]=4 11891 B12R1.43 CC(N(C)C)Cc1ccccc1 Amb1086747 [0,2,0,0,0,0|2,0,0]=4 11892 B12R1.43 CC(N(C)C)Cc1ccccc1 Amb2099764 [0,2,0,0,0,0|2,0,0]=4 11893 B12R1.43 CC(N)C(=O)Cc1ccccc1 Amb18829240 [0,2,0,0,0,0|1,0,1]=4 11894 B12R1.43 CC(N)C(F)Cc1ccccc1 Amb25850180 [0,2,0,0,0,0|1,0,0]=3 11895 B12R1.43 CC(N)C(F)Sc1ccccc1 Amb24385932 [0,2,0,0,0,0|2,0,0]=4 11896 B12R1.43 CC(N)C(O)Cc1cc[n]cc1 Amb18827650 [0,2,0,0,0,0|2,0,0]=4 11897 B12R1.43 CC(N)C(O)Cc1ccc[n]c1 Amb18827666 [0,2,0,0,0,0|2,0,0]=4 11898 B12R1.43 CC(N)C(O)Cc1ccccc1 Amb18828237 [0,2,0,0,0,0|1,0,0]=3 11899 B12R1.43 CC(N)[C@H](O)Cc1ccccc1 Amb24389484 [0,2,0,0,0,0|1,0,0]=3 11900 B12R1.43 CC(Nc1cc[n]cc1)C(C)O Amb24593774 [0,2,0,0,0,0|2,0,0]=4 11901 B12R1.43 CC(Nc1cccc[n]1)C(C)O Amb25817172 [0,2,0,0,0,0|2,0,0]=4 11902 B12R1.43 CC(Nc1ccccc1)C(C)N Amb18646160 [0,2,0,0,0,0|2,0,0]=4 11903 B12R1.43 CC(Nc1ccccc1)P(O)=O Amb25270636 [0,2,0,0,0,0|2,0,0]=4 11904 B12R1.43 CC(O)C(=C)Cc1ccccc1 Amb25155687 [0,2,0,0,0,0|0,0,1]=3 11905 B12R1.43 CC(O)C(=O)Cc1ccc[n]c1 Amb24344752 [0,2,0,0,0,0|1,0,1]=4 11906 B12R1.43 CC(O)C(=O)Cc1cccc[n]1 Amb25205815 [0,2,0,0,0,0|1,0,1]=4 11907 B12R1.43 CC(O)C(=O)Cc1ccccc1 Amb24487306 [0,2,0,0,0,0|0,0,1]=3 11908 B12R1.43 CC(O)C(=O)Oc1ccccc1 Amb25154221 [0,2,0,0,0,0|1,0,1]=4 11909 B12R1.43 CC(O)C(Cl)Cc1ccccc1 Amb25082706 [0,2,0,0,0,0|0,0,0]=2 11910 B12R1.43 CC(O)C(N)Cc1ccccc1 Amb18646379 [0,2,0,0,0,0|0,0,0]=2 11911 B12R1.43 CC(O)C(O)Cc1cc[n]cc1 Amb25158222 [0,2,0,0,0,0|1,0,0]=3 11912 B12R1.43 CC(O)C(O)Cc1ccccc1 Amb25159724 [0,2,0,0,0,0|0,0,0]=2 11913 B12R1.43 CC(O)[C@@H](N)Cc1ccccc1 Amb24682603 [0,2,0,0,0,0|0,0,0]=2 11914 B12R1.43 CC(O)[C@@H](O)Cc1ccccc1 Amb24354395 [0,2,0,0,0,0|0,0,0]=2 11915 B12R1.43 CC(O)[C@H](N)Cc1ccccc1 Amb25730054 [0,2,0,0,0,0|0,0,0]=2 11916 B12R1.43 CC(Oc1ccccc1)C(C)Cl Amb24532569 [0,2,0,0,0,0|2,0,0]=4 11917 B12R1.43 CC(Oc1ccccc1)C(C)N Amb18291409 [0,2,0,0,0,0|2,0,0]=4 11918 B12R1.43 CC(Oc1ccccc1)C(C)O Amb18801039 [0,2,0,0,0,0|1,0,0]=3 11919 B12R1.43 CC(Oc1ccccc1)[C@H](C)N Amb25089792 [0,2,0,0,0,0|2,0,0]=4 11920 B12R1.43 CC(Pc1ccccc1)C(O)=O Amb25059181 [0,2,0,0,0,0|1,0,1]=4 11921 B12R1.43 CC(Sc1ccccc1)C(C)Cl Amb25290258 [0,2,0,0,0,0|2,0,0]=4 11922 B12R1.43 CC(Sc1ccccc1)C(C)N Amb18648553 [0,2,0,0,0,0|2,0,0]=4 11923 B12R1.43 C[C@@H](C(=O)O)Cc1ccccc1 Amb10844541 [0,2,0,0,0,0|0,0,1]=3 11924 B12R1.43 C[C@@H](Cc1ccccc1)C(C)O Amb25769503 [0,2,0,0,0,0|0,0,0]=2 11925 B12R1.43 C[C@@H](Cc1ccccc1)C(N)=O Amb24651128 [0,2,0,0,0,0|0,0,2]=4 11926 B12R1.43 C[C@@H](Cc1ccccc1)N(C)C Amb22747859 [0,2,0,0,0,0|2,0,0]=4 11927 B12R1.43 C[C@@H](Cc1ccccc1)[C@@H](C)O Amb25795494 [0,2,0,0,0,0|0,0,0]=2 11928 B12R1.43 C[C@@H](Cc1ccccc1)[C@H](C)Cl Amb25275062 [0,2,0,0,0,0|1,0,0]=3 11929 B12R1.43 C[C@@H](Cl)[C@@H](Cl)Oc1ccccc1 Amb24611251 [0,2,0,0,0,0|2,0,0]=4 11930 B12R1.43 C[C@@H](N)[C@@H](N)Cc1ccccc1 Amb24407278 [0,2,0,0,0,0|1,0,0]=3 11931 B12R1.43 C[C@@H](N)[C@@H](O)Cc1ccccc1 Amb25202137 [0,2,0,0,0,0|1,0,0]=3 11932 B12R1.43 C[C@@H](N)[C@H](O)Cc1ccccc1 Amb25258010 [0,2,0,0,0,0|1,0,0]=3 11933 B12R1.43 C[C@@H](Nc1ccccc1)C(O)=O Amb22801823 [0,2,0,0,0,0|1,0,1]=4 11934 B12R1.43 C[C@@H](Nc1ccccc1)[C@H](C)N Amb25237533 [0,2,0,0,0,0|2,0,0]=4 11935 B12R1.43 C[C@@H](Nc1ccccc1)[C@H](C)O Amb24382503 [0,2,0,0,0,0|1,0,0]=3 11936 B12R1.43 C[C@@H](O)C(=O)Cc1ccccc1 Amb25792955 [0,2,0,0,0,0|0,0,1]=3 11937 B12R1.43 C[C@@H](O)C(=O)Nc1ccccc1 Amb25229042 [0,2,0,0,0,0|1,0,1]=4 11938 B12R1.43 C[C@@H](O)C(=O)Oc1ccccc1 Amb25763938 [0,2,0,0,0,0|1,0,1]=4 11939 B12R1.43 C[C@@H](O)C(=O)Sc1ccccc1 Amb25847054 [0,2,0,0,0,0|1,0,1]=4 11940 B12R1.43 C[C@@H](O)[C@@H](O)Cc1ccccc1 Amb25847064 [0,2,0,0,0,0|0,0,0]=2 11941 B12R1.43 C[C@@H](O)[C@H](Cl)Cc1ccccc1 Amb25823111 [0,2,0,0,0,0|0,0,0]=2 11942 B12R1.43 C[C@@H](O)[C@H](N)Cc1ccccc1 Amb24664138 [0,2,0,0,0,0|0,0,0]=2 11943 B12R1.43 C[C@@H](Oc1ccccc1)C(O)=O Amb22736710 [0,2,0,0,0,0|1,0,1]=4 11944 B12R1.43 C[C@@H](Oc1ccccc1)[C@@H](C)O Amb25687748 [0,2,0,0,0,0|1,0,0]=3 11945 B12R1.43 C[C@@H](Oc1ccccc1)[C@H](C)N Amb24407272 [0,2,0,0,0,0|2,0,0]=4 11946 B12R1.43 C[C@@H](Oc1ccccc1)[C@H](C)O Amb25284620 [0,2,0,0,0,0|1,0,0]=3 11947 B12R1.43 C[C@@H](Sc1ccccc1)[C@@H](C)N Amb25074048 [0,2,0,0,0,0|2,0,0]=4 11948 B12R1.43 C[C@@H](Sc1ccccc1)[C@@H](C)O Amb24414998 [0,2,0,0,0,0|1,0,0]=3 11949 B12R1.43 C[C@@H](Sc1ccccc1)[C@H](C)Cl Amb24444921 [0,2,0,0,0,0|2,0,0]=4 11950 B12R1.43 C[C@H](C(=O)O)Cc1ccccc1 Amb10844540 [0,2,0,0,0,0|0,0,1]=3 11951 B12R1.43 C[C@H](Cc1ccccc1)[C@@H](C)O Amb25157972 [0,2,0,0,0,0|0,0,0]=2 11952 B12R1.43 C[C@H](Cc1ccccc1)[C@H](C)O Amb25769397 [0,2,0,0,0,0|0,0,0]=2 11953 B12R1.43 C[C@H](N)[C@@H](N)Cc1ccccc1 Amb25152488 [0,2,0,0,0,0|1,0,0]=3 11954 B12R1.43 C[C@H](Nc1ccccc1)C(O)=O Amb24434019 [0,2,0,0,0,0|1,0,1]=4 11955 B12R1.43 C[C@H](O)C(=O)Cc1ccccc1 Amb25143432 [0,2,0,0,0,0|0,0,1]=3 11956 B12R1.43 C[C@H](O)C(=O)Oc1ccccc1 Amb25769345 [0,2,0,0,0,0|1,0,1]=4 11957 B12R1.43 C[C@H](O)[C@@H](N)Cc1ccccc1 Amb25690953 [0,2,0,0,0,0|0,0,0]=2 11958 B12R1.43 C[C@H](O)[C@@H](O)Cc1ccccc1 Amb24496614 [0,2,0,0,0,0|0,0,0]=2 11959 B12R1.43 C[C@H](O)[C@H](N)Cc1ccccc1 Amb25375788 [0,2,0,0,0,0|0,0,0]=2 11960 B12R1.43 C[C@H](Oc1ccccc1)C(O)=O Amb22736711 [0,2,0,0,0,0|1,0,1]=4 11961 B12R1.43 C[C@H](Sc1ccccc1)C(O)=O Amb24390829 [0,2,0,0,0,0|1,0,1]=4 11962 B12R1.43 C[C@H](Sc1ccccc1)[C@H](C)O Amb24661261 [0,2,0,0,0,0|1,0,0]=3 11963 B12R1.43 C\C(=C/c1ccccc1)\[C@@H](C)O Amb25816522 [0,2,0,0,0,0|0,0,2]=4 11964 B12R1.43 ClC(C(=O)C)Cc1ccccc1 Amb17204329 [0,2,0,0,0,0|0,0,2]=4 11965 B12R1.43 ClC(C(=O)Cl)Cc1ccccc1 Amb17204400 [0,2,0,0,0,0|0,0,2]=4 11966 B12R1.43 ClC(C(=O)N)Cc1ccccc1 Amb17204334 [0,2,0,0,0,0|0,0,2]=4 11967 B12R1.43 ClC(C(=O)O)Cc1ccccc1 Amb17204339 [0,2,0,0,0,0|0,0,1]=3 11968 B12R1.43 FB(F)C(Cl)Cc1ccccc1 Amb25246443 [0,2,0,0,0,0|2,0,0]=4 11969 B12R1.43 FB(F)[C@H](Cl)Cc1ccccc1 Amb25138719 [0,2,0,0,0,0|2,0,0]=4 11970 B12R1.43 NC(=O)C(Br)Cc1ccccc1 Amb23533327 [0,2,0,0,0,0|0,0,2]=4 11971 B12R1.43 NC(=O)C(F)Cc1ccccc1 Amb24343162 [0,2,0,0,0,0|0,0,2]=4 11972 B12R1.43 NC(=O)C(N)Cc1ccccc1 Amb20240621 [0,2,0,0,0,0|0,0,2]=4 11973 B12R1.43 NC(=O)C(O)Cc1ccccc1 Amb18800896 [0,2,0,0,0,0|0,0,2]=4 11974 B12R1.43 NC(=O)[C@@H](Cl)Cc1ccccc1 Amb25034612 [0,2,0,0,0,0|0,0,2]=4 11975 B12R1.43 NC(=O)[C@H](O)Cc1ccccc1 Amb25359872 [0,2,0,0,0,0|0,0,2]=4 11976 B12R1.43 NC(=S)C(N)Cc1ccccc1 Amb25765717 [0,2,0,0,0,0|0,1,1]=4 11977 B12R1.43 NC(=S)[C@H](O)Cc1ccccc1 Amb24419006 [0,2,0,0,0,0|0,1,1]=4 11978 B12R1.43 NC(C(=O)C)Cc1ccccc1 Amb1099237 [0,2,0,0,0,0|0,0,2]=4 11979 B12R1.43 NC(C(C)C)Cc1ccccc1 Amb17138565 [0,2,0,0,0,0|1,0,0]=3 11980 B12R1.43 NC(C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22367486 [0,2,0,0,0,0|0,0,1]=3 11981 B12R1.43 NC(Cc1cc[n]cc1)C(F)F Amb25733681 [0,2,0,0,0,0|2,0,0]=4 11982 B12R1.43 NC(Cc1cc[n]cc1)C(O)=O Amb22728340 [0,2,0,0,0,0|1,0,1]=4 11983 B12R1.43 NC(Cc1ccc[n]c1)C(O)=O Amb22301544 [0,2,0,0,0,0|1,0,1]=4 11984 B12R1.43 NC(Cc1ccc[n]c1)C(O)=O Amb22497387 [0,2,0,0,0,0|1,0,1]=4 11985 B12R1.43 NC(Cc1cccc[n]1)C(O)=O Amb22234042 [0,2,0,0,0,0|1,0,1]=4 11986 B12R1.43 NC(Cc1ccccc1)C(=O)Cl Amb24620480 [0,2,0,0,0,0|0,0,2]=4 11987 B12R1.43 NC(Cc1ccccc1)C(=O)S Amb25760658 [0,2,0,0,0,0|0,0,2]=4 11988 B12R1.43 NC(Cc1ccccc1)C(O)=O Amb19958284 [0,2,0,0,0,0|0,0,1]=3 11989 B12R1.43 NC(Cc1ccccc1)P(O)O Amb25227409 [0,2,0,0,0,0|1,0,0]=3 11990 B12R1.43 NC(Cc1ccccc1)[13C](O)=O Amb22363196 [0,2,0,0,0,0|0,0,1]=3 11991 B12R1.43 NC(Oc1ccccc1)C(O)=O Amb25060706 [0,2,0,0,0,0|1,0,1]=4 11992 B12R1.43 NC([13CH2]c1ccccc1)C(O)=O Amb22363309 [0,2,0,0,0,0|0,0,1]=3 11993 B12R1.43 N[13C@@H](Cc1ccccc1)C(O)=O Amb22351319 [0,2,0,0,0,0|0,0,1]=3 11994 B12R1.43 N[13CH](Cc1ccccc1)C(O)=O Amb22367538 [0,2,0,0,0,0|0,0,1]=3 11995 B12R1.43 N[14CH]([14CH2]c1ccccc1)[14C](O)=O Amb22352760 [0,2,0,0,0,0|0,0,1]=3 11996 B12R1.43 N[C@@H](C(=O)N)Cc1ccccc1 Amb16183950 [0,2,0,0,0,0|0,0,2]=4 11997 B12R1.43 N[C@@H](C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22353689 [0,2,0,0,0,0|0,0,1]=3 11998 B12R1.43 N[C@@H](Cc1cc[n]cc1)C(O)=O Amb20241997 [0,2,0,0,0,0|1,0,1]=4 11999 B12R1.43 N[C@@H](Cc1cc[n]cc1)C(O)=O Amb22745959 [0,2,0,0,0,0|1,0,1]=4 12000 B12R1.43 N[C@@H](Cc1ccc[n]c1)C(O)=O Amb22008701 [0,2,0,0,0,0|1,0,1]=4 12001 B12R1.43 N[C@@H](Cc1ccccc1)B(O)O Amb25366514 [0,2,0,0,0,0|1,0,0]=3 12002 B12R1.43 N[C@@H](Cc1ccccc1)C(O)=O Amb22351110 [0,2,0,0,0,0|0,0,1]=3 12003 B12R1.43 N[C@@H](Cc1ccccc1)P(O)O Amb25828976 [0,2,0,0,0,0|1,0,0]=3 12004 B12R1.43 N[C@H](Cc1cc[n]cc1)C(O)=O Amb19944301 [0,2,0,0,0,0|1,0,1]=4 12005 B12R1.43 N[C@H](Cc1ccc[n]c1)C(O)=O Amb19930749 [0,2,0,0,0,0|1,0,1]=4 12006 B12R1.43 N[C@H](Cc1ccc[n]c1)C(O)=O Amb22008700 [0,2,0,0,0,0|1,0,1]=4 12007 B12R1.43 N[C@H](Cc1ccccc1)C(=O)Cl Amb25092703 [0,2,0,0,0,0|0,0,2]=4 12008 B12R1.43 N[C@H](Cc1ccccc1)P(O)=O Amb24355910 [0,2,0,0,0,0|1,0,0]=3 12009 B12R1.43 O=C(Cc1ccccc1)C(F)F Amb18180246 [0,2,0,0,0,0|1,0,1]=4 12010 B12R1.43 O=C(Cl)C(Br)Cc1ccccc1 Amb21961005 [0,2,0,0,0,0|0,0,2]=4 12011 B12R1.43 OB(O)C(Cl)Cc1ccccc1 Amb24419999 [0,2,0,0,0,0|1,0,0]=3 12012 B12R1.43 OB(O)[C@H](Cl)Cc1ccccc1 Amb25779933 [0,2,0,0,0,0|1,0,0]=3 12013 B12R1.43 OC(=O)C(Br)Oc1ccccc1 Amb24406770 [0,2,0,0,0,0|1,0,1]=4 12014 B12R1.43 OC(=O)C(Cc1ccccc1)Br Amb16210937 [0,2,0,0,0,0|0,0,1]=3 12015 B12R1.43 OC(=O)C(Cc1ccccn1)O Amb17138619 [0,2,0,0,0,0|1,0,1]=4 12016 B12R1.43 OC(=O)C(Cl)Oc1ccccc1 Amb24635704 [0,2,0,0,0,0|1,0,1]=4 12017 B12R1.43 OC(=O)C(F)Oc1ccccc1 Amb24433426 [0,2,0,0,0,0|1,0,1]=4 12018 B12R1.43 OC(=O)C(F)Sc1ccccc1 Amb24350687 [0,2,0,0,0,0|1,0,1]=4 12019 B12R1.43 OC(=O)C(O)Sc1ccccc1 Amb24748903 [0,2,0,0,0,0|1,0,1]=4 12020 B12R1.43 OC(=O)C(S)Cc1cc[n]cc1 Amb18289016 [0,2,0,0,0,0|1,0,1]=4 12021 B12R1.43 OC(=O)C(S)Cc1ccc[n]c1 Amb18968269 [0,2,0,0,0,0|1,0,1]=4 12022 B12R1.43 OC(=O)C(S)Cc1cccc[n]1 Amb18289034 [0,2,0,0,0,0|1,0,1]=4 12023 B12R1.43 OC(=O)C(S)Cc1ccccc1 Amb18289035 [0,2,0,0,0,0|0,0,1]=3 12024 B12R1.43 OC(=O)[C@@H](Cl)Cc1ccccc1 Amb24707843 [0,2,0,0,0,0|0,0,1]=3 12025 B12R1.43 OC(=O)[C@@H](S)Cc1ccccc1 Amb25124079 [0,2,0,0,0,0|0,0,1]=3 12026 B12R1.43 OC(=O)[C@H](Cc1cccnc1)N Amb16231985 [0,2,0,0,0,0|1,0,1]=4 12027 B12R1.43 OC(=O)[C@H](Cl)Cc1ccccc1 Amb22225171 [0,2,0,0,0,0|0,0,1]=3 12028 B12R1.43 OC(=O)[C@H](F)Cc1ccccc1 Amb25061394 [0,2,0,0,0,0|0,0,1]=3 12029 B12R1.43 OC(=O)[C@H](O)Cc1c[n]ccc1 Amb24726274 [0,2,0,0,0,0|1,0,1]=4 12030 B12R1.43 OC(=O)[C@H](O)Cc1cc[n]cc1 Amb25260488 [0,2,0,0,0,0|1,0,1]=4 12031 B12R1.43 OC(=S)C(I)Cc1ccccc1 Amb24061263 [0,2,0,0,0,0|0,0,1]=3 12032 B12R1.43 OC(C(=O)O)Cc1ccncc1 Amb17138620 [0,2,0,0,0,0|1,0,1]=4 12033 B12R1.43 OC(C(C)C)Cc1ccccc1 Amb17138584 [0,2,0,0,0,0|1,0,0]=3 12034 B12R1.43 OC(Cc1cc[n]cc1)C(F)F Amb25057853 [0,2,0,0,0,0|2,0,0]=4 12035 B12R1.43 OC(Cc1ccccc1)C(F)Cl Amb25288246 [0,2,0,0,0,0|1,0,0]=3 12036 B12R1.43 OC(Cc1ccccc1)C(F)F Amb24665165 [0,2,0,0,0,0|1,0,0]=3 12037 B12R1.43 OC(Cl)C(=O)Oc1ccccc1 Amb24658483 [0,2,0,0,0,0|1,0,1]=4 12038 B12R1.43 OC(S)C(=O)Oc1ccccc1 Amb25285714 [0,2,0,0,0,0|1,0,1]=4 12039 B12R1.43 O[C@@H](Cc1ccccc1)C(F)F Amb24371353 [0,2,0,0,0,0|1,0,0]=3 12040 B12R1.43 O[C@@H](Cc1ccccc1)[C@H](F)Cl Amb24373884 [0,2,0,0,0,0|1,0,0]=3 12041 B12R1.43 O[C@H](Cc1ccccc1)C(F)F Amb25129748 [0,2,0,0,0,0|1,0,0]=3 12042 B12R1.43 [15NH2]C(Cc1ccccc1)C(O)=O Amb22338047 [0,2,0,0,0,0|0,0,1]=3 12043 B12R1.118 C#CC(CO)Cc1ccccc1 Amb25105982 [0,2,0,0,0,0|0,0,0]=2 12044 B12R1.118 C=C=C(CCl)Cc1ccccc1 Amb25211674 [0,2,0,0,0,0|1,0,1]=4 12045 B12R1.118 C=C=C(CO)Cc1ccccc1 Amb25777134 [0,2,0,0,0,0|0,0,1]=3 12046 B12R1.118 C=CC(CO)Nc1cc[n]cc1 Amb24343558 [0,2,0,0,0,0|2,0,0]=4 12047 B12R1.118 C=C[C@@H](CO)Nc1ccccc1 Amb25763187 [0,2,0,0,0,0|1,0,0]=3 12048 B12R1.118 CCC(C#C)Nc1ccccc1 Amb25689867 [0,2,0,0,0,0|2,0,0]=4 12049 B12R1.118 CCC(C#N)Nc1ccccc1 Amb18289853 [0,2,0,0,0,0|2,0,0]=4 12050 B12R1.118 CCC(C#N)Oc1ccccc1 Amb18797968 [0,2,0,0,0,0|2,0,0]=4 12051 B12R1.118 CCC(CN)Oc1ccccc1 Amb18311092 [0,2,0,0,0,0|2,0,0]=4 12052 B12R1.118 CCC(CO)Oc1ccccc1 Amb23538023 [0,2,0,0,0,0|1,0,0]=3 12053 B12R1.118 CCC(Cc1c[n]ccc1)CC Amb24090136 [0,2,0,0,0,0|2,0,0]=4 12054 B12R1.118 CCC(Cc1ccccc1)CN Amb10778756 [0,2,0,0,0,0|1,0,0]=3 12055 B12R1.118 CCC(Cc1ccccc1)NC Amb18792514 [0,2,0,0,0,0|1,0,0]=3 12056 B12R1.118 CCC(Nc1ccccc1)CO Amb13952611 [0,2,0,0,0,0|1,0,0]=3 12057 B12R1.118 CCC(Sc1ccccc1)C#N Amb10565503 [0,2,0,0,0,0|2,0,0]=4 12058 B12R1.118 CCN(Cc1ccccc1)C#N Amb24700837 [0,2,0,0,0,0|2,0,0]=4 12059 B12R1.118 CCN(Cc1ccccc1)C=O Amb25034769 [0,2,0,0,0,0|2,0,0]=4 12060 B12R1.118 CCN(Cc1ccccc1)CC Amb22348278 [0,2,0,0,0,0|2,0,0]=4 12061 B12R1.118 CCN(Cc1ccccc1)N=O Amb24376725 [0,2,0,0,0,0|2,0,0]=4 12062 B12R1.118 CC[C@@H](CO)Nc1cc[n]cc1 Amb25160371 [0,2,0,0,0,0|2,0,0]=4 12063 B12R1.118 CC\C(\Cc1ccccc1)=N\N Amb25057429 [0,2,0,0,0,0|1,0,1]=4 12064 B12R1.118 CNC(Cc1ccccc1)C#C Amb25797878 [0,2,0,0,0,0|1,0,1]=4 12065 B12R1.118 CN[C@@H](CO)Cc1ccccc1 Amb22745072 [0,2,0,0,0,0|0,0,0]=2 12066 B12R1.118 CN\C(\Cc1ccccc1)=N\O Amb25376955 [0,2,0,0,0,0|1,0,1]=4 12067 B12R1.118 COC(CN)Cc1ccccc1 Amb21954040 [0,2,0,0,0,0|1,0,0]=3 12068 B12R1.118 COC(CN)Oc1ccccc1 Amb24061283 [0,2,0,0,0,0|2,0,0]=4 12069 B12R1.118 COC(Cc1ccccc1)C#N Amb25681947 [0,2,0,0,0,0|1,0,1]=4 12070 B12R1.118 CSC(Cc1ccccc1)C#N Amb17594511 [0,2,0,0,0,0|1,0,1]=4 12071 B12R1.118 N#CC(CBr)Cc1ccccc1 Amb25821723 [0,2,0,0,0,0|1,0,0]=3 12072 B12R1.118 N#CC(CCl)Cc1ccccc1 Amb24753458 [0,2,0,0,0,0|1,0,0]=3 12073 B12R1.118 N#CC(CCl)Nc1ccccc1 Amb25151143 [0,2,0,0,0,0|2,0,0]=4 12074 B12R1.118 N#CC(CO)Cc1c[n]ccc1 Amb23537654 [0,2,0,0,0,0|1,0,0]=3 12075 B12R1.118 N#CC(CO)Cc1cc[n]cc1 Amb23538040 [0,2,0,0,0,0|1,0,0]=3 12076 B12R1.118 N#CC(CO)Cc1cccc[n]1 Amb23538039 [0,2,0,0,0,0|1,0,0]=3 12077 B12R1.118 N#CC(CO)Cc1ccccc1 Amb18110109 [0,2,0,0,0,0|0,0,0]=2 12078 B12R1.118 N#CC(Cc1ccccc1)C#N Amb10574574 [0,2,0,0,0,0|1,0,1]=4 12079 B12R1.118 N#CC(Cc1ccccc1)C=O Amb22371309 [0,2,0,0,0,0|0,0,2]=4 12080 B12R1.118 NCC(CO)Cc1ccccc1 Amb22899484 [0,2,0,0,0,0|0,0,0]=2 12081 B12R1.118 NCC(CO)Nc1ccccc1 Amb25776544 [0,2,0,0,0,0|1,0,0]=3 12082 B12R1.118 NCC(Cc1ccccc1)C#N Amb18908588 [0,2,0,0,0,0|1,0,0]=3 12083 B12R1.118 OCC(CO)=Cc1ccccc1 Amb25077955 [0,2,0,0,0,0|0,0,2]=4 12084 B12R1.118 OCC(CO)Nc1cccc[n]1 Amb24402792 [0,2,0,0,0,0|2,0,0]=4 12085 B12R1.118 OCC(CO)Nc1ccccc1 Amb25060728 [0,2,0,0,0,0|1,0,0]=3 12086 B12R1.118 OC\C(\Cc1ccccc1)=C\F Amb25037074 [0,2,0,0,0,0|0,0,1]=3 12087 B12R1.118 OC\C(\Cc1ccccc1)=N\O Amb25052256 [0,2,0,0,0,0|0,0,1]=3 12088 B12R1.194 BrCC(Oc1ccccc1)(C)C Amb17248430 [0,2,0,0,0,0|2,0,0]=4 12089 B12R1.194 C#CC(Cc1ccccc1)(O)C Amb1083082 [0,2,0,0,0,0|1,0,1]=4 12090 B12R1.194 CC(C)(CN)Cc1c[n]ccc1 Amb24379600 [0,2,0,0,0,0|2,0,0]=4 12091 B12R1.194 CC(C)(CN)Cc1cccc[n]1 Amb24349483 [0,2,0,0,0,0|2,0,0]=4 12092 B12R1.194 CC(C)(CN)Cc1ccccc1 Amb19310600 [0,2,0,0,0,0|1,0,0]=3 12093 B12R1.194 CC(C)(CN)Oc1ccccc1 Amb19515084 [0,2,0,0,0,0|2,0,0]=4 12094 B12R1.194 CC(C)(CN)Sc1ccccc1 Amb18909240 [0,2,0,0,0,0|2,0,0]=4 12095 B12R1.194 CC(C)(CO)Nc1c[n]ccc1 Amb18267817 [0,2,0,0,0,0|2,0,0]=4 12096 B12R1.194 CC(C)(CO)Nc1ccccc1 Amb18269010 [0,2,0,0,0,0|1,0,0]=3 12097 B12R1.194 CC(C)(CO)Sc1ccccc1 Amb24557142 [0,2,0,0,0,0|1,0,0]=3 12098 B12R1.194 CC(C)(Cc1ccccc1)N=O Amb22055953 [0,2,0,0,0,0|1,0,1]=4 12099 B12R1.194 CC(C)(Cc1ccccc1)NC Amb22349936 [0,2,0,0,0,0|2,0,0]=4 12100 B12R1.194 CC(C)(Cc1ccccc1)NN Amb18646155 [0,2,0,0,0,0|2,0,0]=4 12101 B12R1.194 CC(C)(Cc1ccccc1)NO Amb24411489 [0,2,0,0,0,0|1,0,0]=3 12102 B12R1.194 CC(Cl)(CO)Cc1ccccc1 Amb25115909 [0,2,0,0,0,0|0,0,0]=2 12103 B12R1.194 CC(Cl)(Cc1ccccc1)C#N Amb18791085 [0,2,0,0,0,0|1,0,1]=4 12104 B12R1.194 CC(F)(CN)Cc1c[n]ccc1 Amb25825977 [0,2,0,0,0,0|2,0,0]=4 12105 B12R1.194 CC(N)(CO)Cc1ccccc1 Amb19001800 [0,2,0,0,0,0|0,0,0]=2 12106 B12R1.194 CC(N)(Cc1ccccc1)CN Amb19001789 [0,2,0,0,0,0|1,0,0]=3 12107 B12R1.194 CC(O)(CCl)Cc1cccc[n]1 Amb25735253 [0,2,0,0,0,0|2,0,0]=4 12108 B12R1.194 CC(O)(Cc1ccccc1)C#N Amb18177733 [0,2,0,0,0,0|1,0,1]=4 12109 B12R1.194 CC(O)(Cc1ccccc1)NN Amb25361538 [0,2,0,0,0,0|2,0,0]=4 12110 B12R1.194 CCC(C)(Cl)Cc1ccccc1 Amb25080041 [0,2,0,0,0,0|1,0,0]=3 12111 B12R1.194 CCC(C)(N)Cc1cc[n]cc1 Amb24483651 [0,2,0,0,0,0|2,0,0]=4 12112 B12R1.194 CCC(C)(O)Cc1cc[n]cc1 Amb25075866 [0,2,0,0,0,0|2,0,0]=4 12113 B12R1.194 COC(Cc1ccccc1)(C)C Amb10555866 [0,2,0,0,0,0|2,0,0]=4 12114 B12R1.194 C[C@@](O)(Cc1ccccc1)C=O Amb24539297 [0,2,0,0,0,0|0,0,2]=4 12115 B12R1.194 C[C@@](O)(Cc1ccccc1)CO Amb25817130 [0,2,0,0,0,0|0,0,0]=2 12116 B12R1.194 C[C@](O)(Cc1ccccc1)CO Amb24474165 [0,2,0,0,0,0|0,0,0]=2 12117 B12R1.194 C[Si](C)(CCl)Cc1ccccc1 Amb22338132 [0,2,0,0,0,0|1,1,0]=4 12118 B12R1.194 C[Si](C)(CN)Cc1ccccc1 Amb25151035 [0,2,0,0,0,0|1,1,0]=4 12119 B12R1.194 ClCC(Oc1ccccc1)(C)C Amb17234167 [0,2,0,0,0,0|2,0,0]=4 12120 B12R1.194 FC(F)(CCl)Oc1ccccc1 Amb24565773 [0,2,0,0,0,0|2,0,0]=4 12121 B12R1.194 FC(F)(CCl)Sc1ccccc1 Amb24376612 [0,2,0,0,0,0|2,0,0]=4 12122 B12R1.194 N#CC(Cc1ccccc1)(C)C Amb17333794 [0,2,0,0,0,0|1,0,1]=4 12123 B12R1.194 N#CC(Cc1ccccc1)(N)C Amb17232330 [0,2,0,0,0,0|1,0,1]=4 12124 B12R1.194 NCC(Cc1ccccc1)(C)C Amb17333839 [0,2,0,0,0,0|1,0,0]=3 12125 B12R1.194 NCC(Cc1ccccc1)(O)C Amb17082131 [0,2,0,0,0,0|1,0,0]=3 12126 B12R1.194 NCC(Cc1ccccn1)(O)C Amb17082128 [0,2,0,0,0,0|2,0,0]=4 12127 B12R1.194 NCC(Cc1cccnc1)(O)C Amb17082129 [0,2,0,0,0,0|2,0,0]=4 12128 B12R1.194 NCC(Cc1ccncc1)(O)C Amb17082130 [0,2,0,0,0,0|2,0,0]=4 12129 B12R1.194 NCC(F)(F)Cc1c[n]ccc1 Amb22304221 [0,2,0,0,0,0|2,0,0]=4 12130 B12R1.194 NCC(F)(F)Cc1cccc[n]1 Amb25789459 [0,2,0,0,0,0|2,0,0]=4 12131 B12R1.194 NCC(F)(F)Cc1ccccc1 Amb25103781 [0,2,0,0,0,0|1,0,0]=3 12132 B12R1.194 NCC(Oc1ccccc1)(C)C Amb17074797 [0,2,0,0,0,0|2,0,0]=4 12133 B12R1.194 O=CC(F)(F)Cc1ccccc1 Amb24424443 [0,2,0,0,0,0|0,0,2]=4 12134 B12R1.194 O=S(=O)(CCl)Cc1ccccc1 Amb22364602 [0,2,0,0,0,0|2,0,0]=4 12135 B12R1.194 OCC(F)(Cl)Cc1ccccc1 Amb25182929 [0,2,0,0,0,0|0,0,0]=2 12136 B12R1.194 OCC(F)(F)Cc1ccccc1 Amb25847026 [0,2,0,0,0,0|0,0,0]=2 12137 B12R1.194 OCC(F)(F)Sc1ccccc1 Amb25097690 [0,2,0,0,0,0|1,0,0]=3 12138 B12R1.194 OCC(Oc1ccccc1)(C)C Amb17232597 [0,2,0,0,0,0|1,0,0]=3 12139 B12R1.194 ONC(Cc1ccccc1)(C)C Amb17615684 [0,2,0,0,0,0|1,0,0]=3 12140 B12R1.891 C([2H])(NCc1ccccc1)([2H])[2H] Amb17617207 [0,2,0,0,0,0|2,0,0]=4 12141 B12R1.891 CC(C)(C)CCc1cccc[n]1 Amb24451459 [0,2,0,0,0,0|2,0,0]=4 12142 B12R1.891 CC(C)(C)CCc1ccccc1 Amb24470690 [0,2,0,0,0,0|1,0,0]=3 12143 B12R1.891 CC(C)(C)CNc1ccccc1 Amb22394914 [0,2,0,0,0,0|2,0,0]=4 12144 B12R1.891 CC(C)(C)COc1ccccc1 Amb24487425 [0,2,0,0,0,0|2,0,0]=4 12145 B12R1.891 CC(C)(C)SCc1ccccc1 Amb25846774 [0,2,0,0,0,0|2,0,0]=4 12146 B12R1.891 CC(C)(N)CCc1c[n]ccc1 Amb18563644 [0,2,0,0,0,0|2,0,0]=4 12147 B12R1.891 CC(C)(N)CCc1cc[n]cc1 Amb18563646 [0,2,0,0,0,0|2,0,0]=4 12148 B12R1.891 CC(C)(N)CCc1cccc[n]1 Amb18563642 [0,2,0,0,0,0|2,0,0]=4 12149 B12R1.891 CC(C)(N)CCc1ccccc1 Amb19373033 [0,2,0,0,0,0|1,0,0]=3 12150 B12R1.891 CC(C)(N)CNc1ccccc1 Amb18974263 [0,2,0,0,0,0|2,0,0]=4 12151 B12R1.891 CC(C)(O)CCc1ccccc1 Amb18540684 [0,2,0,0,0,0|0,0,0]=2 12152 B12R1.891 CC(C)(O)COc1ccccc1 Amb18180107 [0,2,0,0,0,0|1,0,0]=3 12153 B12R1.891 CC(C)(O)CSc1cc[n]cc1 Amb24487399 [0,2,0,0,0,0|2,0,0]=4 12154 B12R1.891 CC(C)(O)CSc1cccc[n]1 Amb19057238 [0,2,0,0,0,0|2,0,0]=4 12155 B12R1.891 CC(C)(O)CSc1ccccc1 Amb18321685 [0,2,0,0,0,0|1,0,0]=3 12156 B12R1.891 CC(C)(S)CNc1ccccc1 Amb25764000 [0,2,0,0,0,0|1,1,0]=4 12157 B12R1.891 CC(CCc1ccccc1)(N)C Amb17334588 [0,2,0,0,0,0|1,0,0]=3 12158 B12R1.891 CC(CNc1ccccc1)(C)C Amb10889788 [0,2,0,0,0,0|2,0,0]=4 12159 B12R1.891 CC(CNc1ccccc1)(O)C Amb17138596 [0,2,0,0,0,0|1,0,0]=3 12160 B12R1.891 CC(COc1ccccc1)(N)C Amb17074732 [0,2,0,0,0,0|2,0,0]=4 12161 B12R1.891 CC(CSc1ccccc1)(N)C Amb17485972 [0,2,0,0,0,0|2,0,0]=4 12162 B12R1.891 CC(F)(F)CNc1ccccc1 Amb25323931 [0,2,0,0,0,0|2,0,0]=4 12163 B12R1.891 CS(=O)(=O)CCc1ccccc1 Amb24454272 [0,2,0,0,0,0|1,0,1]=4 12164 B12R1.891 C[N+](C)(C)CCc1ccccc1 Amb22433133 [0,2,0,0,0,0|2,0,0]=4 12165 B12R1.891 C[N+](C)(C)CCc1ccccc1 Amb22433887 [0,2,0,0,0,0|2,0,0]=4 12166 B12R1.891 C[N+](C)(C)CCc1ccccc1 Amb22483565 [0,2,0,0,0,0|2,0,0]=4 12167 B12R1.891 C[Si](C)(Cl)CCc1ccccc1 Amb19893995 [0,2,0,0,0,0|1,1,0]=4 12168 B12R1.891 ClC(Cl)(Cl)CCc1ccccc1 Amb24418534 [0,2,0,0,0,0|1,0,0]=3 12169 B12R1.891 ClS(=O)(=O)CCc1ccccc1 Amb1130049 [0,2,0,0,0,0|1,0,1]=4 12170 B12R1.891 Cl[Si](Cl)(Cl)CCc1ccccc1 Amb19893996 [0,2,0,0,0,0|1,1,0]=4 12171 B12R1.891 FC(COc1ccccc1)(F)F Amb10840984 [0,2,0,0,0,0|2,0,0]=4 12172 B12R1.891 FC(F)(Br)CNc1ccccc1 Amb25837719 [0,2,0,0,0,0|2,0,0]=4 12173 B12R1.891 FC(F)(F)CSc1ccccc1 Amb17673273 [0,2,0,0,0,0|2,0,0]=4 12174 B12R1.891 F[B-](CCc1ccccc1)(F)F Amb13890492 [0,2,0,0,0,0|2,0,0]=4 12175 B12R1.891 O=S(=O)(Br)CCc1ccccc1 Amb23555507 [0,2,0,0,0,0|1,0,1]=4 12176 B12R1.891 O=S(=O)(F)CCc1ccccc1 Amb19375026 [0,2,0,0,0,0|1,0,1]=4 12177 B12R1.891 OS(=O)(=O)CCc1ccccc1 Amb19866568 [0,2,0,0,0,0|1,0,0]=3 12178 B12R1.891 OS(=O)(=O)NCc1ccccc1 Amb22551828 [0,2,0,0,0,0|2,0,0]=4 12179 B12R1.891 [O-]S(=O)(=O)CCc1ccccc1 Amb22457030 [0,2,0,0,0,0|1,0,1]=4 12180 B10R1.30 C=C1C=CC(=O)CC1CO Amb25713605 [0,0,1,1,0,0|1,0,0]=3 12181 B10R1.30 CC1CCC(=O)C=C1C=C Amb24372163 [0,0,1,1,0,0|2,0,0]=4 12182 B10R1.32 OCC1CC(=O)C=C1C=O Amb25347500 [0,0,1,1,0,0|2,0,0]=4 12183 B10R1.32 OC[C@H]1CC(=O)C=C1C=O Amb24706970 [0,0,1,1,0,0|2,0,0]=4 12184 B10R1.71 O=C1CCC(Br)C=CC=C1 Amb24757602 [0,0,1,1,0,0|2,0,0]=4 12185 B10R1.71 OC1CCC(O)C=CC=C1 Amb25739730 [0,0,1,1,0,0|1,0,1]=4 12186 B10R1.78 C=C1CCCCC=CC=C1 Amb22342435 [0,0,1,1,0,0|1,0,0]=3 12187 B10R1.78 O=C1CCCCC=CC=C1 Amb22342438 [0,0,1,1,0,0|2,0,0]=4 12188 B10R1.187 CC/1CCC(=O)\C1=C/C=C Amb25128943 [0,0,1,1,0,0|2,0,0]=4 12189 B10R1.436 C[C@]1(C[C@H]1CO)\C=C\C=C Amb24581264 [0,0,1,1,0,0|0,0,2]=4 12190 B10R1.5 C=CC1=CCN[C@@H]1CCO Amb25202104 [0,0,1,1,0,0|1,0,1]=4 12191 B10R1.5 OCCn1cccc1C=O Amb17116748 [0,0,1,1,0,0|2,0,0]=4 12192 B10R1.20 C=CC=1CCCCC1C=O Amb18643087 [0,0,1,1,0,0|2,0,0]=4 12193 B10R1.94 CC=1C(O)CCC1CC=C Amb25795647 [0,0,1,1,0,0|0,0,2]=4 12194 B10R1.94 CC=1[C@@H](O)CCC1CC=C Amb25723518 [0,0,1,1,0,0|0,0,2]=4 12195 B10R1.172 C=Cc1cccc(CO)c1 Amb24405968 [0,0,1,1,0,0|0,0,2]=4 12196 B10R1.19 C=CC1=CCCCCC1O Amb25769382 [0,0,1,1,0,0|0,0,2]=4 12197 B10R1.19 C=CC1=CCCCC[C@H]1O Amb25284362 [0,0,1,1,0,0|0,0,2]=4 12198 B10R1.56 CCCC\C=C/C1=CC1=O Amb25115005 [0,0,1,1,0,0|2,0,0]=4 12199 B10R1.56 CCCC\C=C\C1=CC1=O Amb25146317 [0,0,1,1,0,0|2,0,0]=4 12200 B10R2.6 C1CC1c2[n]ccc[n]2 Amb24104366 [1,0,0,1,0,0|2,0,0]=4 12201 B10R2.6 C1CC1c2c[n]ccc2 Amb22235730 [1,0,0,1,0,0|1,0,0]=3 12202 B10R2.6 C1CC1c2cc[n]c[n]2 Amb24091440 [1,0,0,1,0,0|2,0,0]=4 12203 B10R2.6 C1CC1c2ccc[n][n]2 Amb25376122 [1,0,0,1,0,0|2,0,0]=4 12204 B10R2.6 C1NC1c2c[n]ccc2 Amb18221862 [1,0,0,1,0,0|2,0,0]=4 12205 B10R2.6 C1NC1c2cc[n]cc2 Amb18221868 [1,0,0,1,0,0|2,0,0]=4 12206 B10R2.6 C1NC1c2cccc[n]2 Amb18860383 [1,0,0,1,0,0|2,0,0]=4 12207 B10R2.6 C1NC1c2ccccc2 Amb25082886 [1,0,0,1,0,0|1,0,0]=3 12208 B10R2.6 C1OC1c2c[n]c[n]c2 Amb24657638 [1,0,0,1,0,0|2,0,0]=4 12209 B10R2.6 C1OC1c2c[n]cc[n]2 Amb25104129 [1,0,0,1,0,0|2,0,0]=4 12210 B10R2.6 C1O[C@@H]1c2c[n]cc[n]2 Amb24481608 [1,0,0,1,0,0|2,0,0]=4 12211 B10R2.6 C1O[C@@H]1c2c[n]ccc2 Amb25758556 [1,0,0,1,0,0|1,0,0]=3 12212 B10R2.6 C1O[C@@H]1c2cc[n]cc2 Amb24103202 [1,0,0,1,0,0|1,0,0]=3 12213 B10R2.6 C1O[C@@H]1c2cccc[n]2 Amb24481607 [1,0,0,1,0,0|1,0,0]=3 12214 B10R2.6 C1O[C@H]1c2c[n]cc[n]2 Amb24481609 [1,0,0,1,0,0|2,0,0]=4 12215 B10R2.6 C1O[C@H]1c2cc[n]cc2 Amb24103149 [1,0,0,1,0,0|1,0,0]=3 12216 B10R2.6 C1O[C@H]1c2cccc[n]2 Amb24101968 [1,0,0,1,0,0|1,0,0]=3 12217 B10R2.6 C1SC1c2ccccc2 Amb17666888 [1,0,0,1,0,0|0,1,0]=3 12218 B10R2.6 O1CC1c2ccncc2 Amb17090250 [1,0,0,1,0,0|1,0,0]=3 12219 B10R2.6 c1ccc(cn1)C2CO2 Amb17090249 [1,0,0,1,0,0|1,0,0]=3 12220 B10R2.6 c1ccc(nc1)C2CO2 Amb17090248 [1,0,0,1,0,0|1,0,0]=3 12221 B10R2.7 C1C=CCC=2CCCC21 Amb22230313 [1,0,0,1,0,0|0,0,2]=4 12222 B10R2.7 C1CC[n+]2ccccc21 Amb25852290 [1,0,0,1,0,0|1,0,0]=3 12223 B10R2.7 C1CCc2[n]c[n]cc21 Amb22522317 [1,0,0,1,0,0|2,0,0]=4 12224 B10R2.7 C1CCc2cc[n]cc21 Amb22233572 [1,0,0,1,0,0|1,0,0]=3 12225 B10R2.7 C1CN2C=CC=CC2=N1 Amb24101571 [1,0,0,1,0,0|2,0,0]=4 12226 B10R2.7 C1CNc2c[n]ccc21 Amb19516033 [1,0,0,1,0,0|2,0,0]=4 12227 B10R2.7 C1CNc2c[n]ccc21 Amb22495003 [1,0,0,1,0,0|2,0,0]=4 12228 B10R2.7 C1CNc2c[n]ccc21 Amb23412122 [1,0,0,1,0,0|2,0,0]=4 12229 B10R2.7 C1CNc2cc[n]cc21 Amb19515489 [1,0,0,1,0,0|2,0,0]=4 12230 B10R2.7 C1CNc2cc[n]cc21 Amb22372217 [1,0,0,1,0,0|2,0,0]=4 12231 B10R2.7 C1CNc2ccc[n]c21 Amb18833005 [1,0,0,1,0,0|2,0,0]=4 12232 B10R2.7 C1CNc2ccc[n]c21 Amb22494916 [1,0,0,1,0,0|2,0,0]=4 12233 B10R2.7 C1COc2[n]cccc21 Amb25337454 [1,0,0,1,0,0|1,0,0]=3 12234 B10R2.7 C1COc2c[n]ccc21 Amb22372207 [1,0,0,1,0,0|1,0,0]=3 12235 B10R2.7 C1COc2cc[n]cc21 Amb24101562 [1,0,0,1,0,0|1,0,0]=3 12236 B10R2.7 C1COc2ccc[n]c21 Amb23455396 [1,0,0,1,0,0|1,0,0]=3 12237 B10R2.7 C1CPc2ccccc21 Amb24477880 [1,0,0,1,0,0|1,0,0]=3 12238 B10R2.7 C1CSc2c[n]ccc21 Amb24101588 [1,0,0,1,0,0|1,1,0]=4 12239 B10R2.7 C1CSc2ccccc21 Amb24101549 [1,0,0,1,0,0|0,1,0]=3 12240 B10R2.7 C1C[n+]2ccccc2O1 Amb22364467 [1,0,0,1,0,0|1,0,0]=3 12241 B10R2.7 C1N=Cc2ccccc21 Amb20241766 [1,0,0,1,0,0|1,0,1]=4 12242 B10R2.7 C1N=c2ccccc2=N1 Amb24100741 [1,0,0,1,0,0|2,0,0]=4 12243 B10R2.7 C1NCc2[n]cccc21 Amb20671408 [1,0,0,1,0,0|2,0,0]=4 12244 B10R2.7 C1NCc2[n]cccc21 Amb22489863 [1,0,0,1,0,0|2,0,0]=4 12245 B10R2.7 C1NCc2cc[n]cc21 Amb20242101 [1,0,0,1,0,0|2,0,0]=4 12246 B10R2.7 C1NCc2ccccc12 Amb17739945 [1,0,0,1,0,0|1,0,0]=3 12247 B10R2.7 C1Nc2ccccc2P1 Amb25102824 [1,0,0,1,0,0|2,0,0]=4 12248 B10R2.7 C1OCc2[n]cccc21 Amb24467517 [1,0,0,1,0,0|2,0,0]=4 12249 B10R2.7 C1OCc2cc[n]cc21 Amb24738431 [1,0,0,1,0,0|2,0,0]=4 12250 B10R2.7 C1OSc2ccccc21 Amb25250664 [1,0,0,1,0,0|1,1,0]=4 12251 B10R2.7 C1Oc2c[n]ccc2S1 Amb25116284 [1,0,0,1,0,0|2,0,0]=4 12252 B10R2.7 C1Oc2ccc[n]c2O1 Amb21858055 [1,0,0,1,0,0|2,0,0]=4 12253 B10R2.7 C1Oc2ccccc2S1 Amb21963815 [1,0,0,1,0,0|1,0,0]=3 12254 B10R2.7 C1SCc2ccccc21 Amb21962922 [1,0,0,1,0,0|1,0,0]=3 12255 B10R2.7 [bH]1oc2ccccc2o1 Amb22731069 [1,0,0,1,0,0|2,0,0]=4 12256 B10R2.7 c1ccc2[n+](c1)CCN2 Amb10552798 [1,0,0,1,0,0|2,0,0]=4 12257 B10R2.7 c1ccc2[n+](c1)OCC2 Amb10560834 [1,0,0,1,0,0|1,0,0]=3 12258 B10R2.7 c1ccc2c(c1)C=CC2 Amb2383760 [1,0,0,1,0,0|0,0,2]=4 12259 B10R2.7 c1ccc2c(c1)NCC2 Amb1869493 [1,0,0,1,0,0|1,0,0]=3 12260 B10R2.7 c1ccc2c(c1)onc2 Amb1233398 [1,0,0,1,0,0|1,0,1]=4 12261 B10R2.7 c1ncc2c(c1)CNC2 Amb10067652 [1,0,0,1,0,0|2,0,0]=4 12262 B10R2.320 CC1Cc2ccccc12 Amb17778870 [1,0,0,1,0,0|0,0,0]=2 12263 B10R2.320 ClC1Cc2ccccc12 Amb17778800 [1,0,0,1,0,0|1,0,0]=3 12264 B10R2.320 OC1=Cc2ccccc21 Amb22002555 [1,0,0,1,0,0|0,0,2]=4 12265 B10R2.320 OC1Cc2c[n]ccc21 Amb24478648 [1,0,0,1,0,0|1,0,0]=3 12266 B10R2.320 OC1Cc2ccccc12 Amb17778676 [1,0,0,1,0,0|0,0,0]=2 12267 B10R2.320 O[C@@H]1Cc2ccccc21 Amb25676494 [1,0,0,1,0,0|0,0,0]=2 12268 B10R2.320 O[C@H]1Cc2ccccc21 Amb24704470 [1,0,0,1,0,0|0,0,0]=2 12269 B10R2.320 [NH3+]C1Cc2ccccc12 Amb17778877 [1,0,0,1,0,0|1,0,0]=3 12270 B10R2.484 C1CCC12C=CNC=C2 Amb24647920 [1,0,0,1,0,0|1,0,1]=4 12271 B10R2.5 BrC1CC1=C2C=CC=C2 Amb24522972 [0,0,0,1,1,0|1,0,1]=4 12272 B10R2.5 BrC1CC1c2ccc[s]2 Amb25841340 [0,0,0,1,1,0|2,0,0]=4 12273 B10R2.5 BrC1CC1c2ccoc2 Amb24481967 [0,0,0,1,1,0|2,0,0]=4 12274 B10R2.5 Br[C@@H]1C[C@H]1c2ccc[s]2 Amb24446792 [0,0,0,1,1,0|2,0,0]=4 12275 B10R2.5 CC1CC1[n]2cccc2 Amb24411315 [0,0,0,1,1,0|2,0,0]=4 12276 B10R2.5 NC1CC1[n]2cccc2 Amb18278848 [0,0,0,1,1,0|2,0,0]=4 12277 B10R2.5 NC1CC1c2ccoc2 Amb24527705 [0,0,0,1,1,0|2,0,0]=4 12278 B10R2.32 BrC1CC=C2C=CC=C21 Amb24635905 [0,0,0,1,1,0|1,0,1]=4 12279 B10R2.32 CC1CC[n]2cccc21 Amb25376943 [0,0,0,1,1,0|2,0,0]=4 12280 B10R2.32 ClC1CCc2c1ccs2 Amb17087991 [0,0,0,1,1,0|2,0,0]=4 12281 B10R2.32 NC1CCc2[s]ccc21 Amb22754584 [0,0,0,1,1,0|2,0,0]=4 12282 B10R2.32 NC1CCc2c[s]cc21 Amb18202935 [0,0,0,1,1,0|2,0,0]=4 12283 B10R2.32 NC1CCc2cc[s]c21 Amb18643462 [0,0,0,1,1,0|2,0,0]=4 12284 B10R2.32 OC1CC[n]2cc[n]c21 Amb22584148 [0,0,0,1,1,0|2,0,0]=4 12285 B10R2.32 OC1CCc2[nH][n]cc21 Amb24122167 [0,0,0,1,1,0|2,0,0]=4 12286 B10R2.32 OC1CCc2c1ccs2 Amb17087941 [0,0,0,1,1,0|1,0,0]=3 12287 B10R2.32 OC1CCc2c[s]cc21 Amb18202846 [0,0,0,1,1,0|1,0,0]=3 12288 B10R2.32 OC1CCc2cc[s]c21 Amb24675555 [0,0,0,1,1,0|1,0,0]=3 12289 B10R2.32 O[C@@H]1CC[n]2cc[n]c21 Amb24412913 [0,0,0,1,1,0|2,0,0]=4 12290 B10R2.136 C1CC(N1)c2ccc[s]2 Amb22056242 [0,0,0,1,1,0|2,0,0]=4 12291 B10R2.136 C1C[C@H](N1)c2c[s]cc2 Amb24606181 [0,0,0,1,1,0|2,0,0]=4 12292 B10R2.136 C1C[C@H](N1)c2ccc[nH]2 Amb24477863 [0,0,0,1,1,0|2,0,0]=4 12293 B10R2.136 C1C[C@H](N1)c2ccc[s]2 Amb25202793 [0,0,0,1,1,0|2,0,0]=4 12294 B10R2.138 C1CCCc2ccc1[nH]2 Amb24563878 [0,0,0,1,1,0|2,0,0]=4 12295 B10R2.193 C1OC1Cc2[nH]cc[n]2 Amb24392942 [0,0,0,1,1,0|2,0,0]=4 12296 B10R2.193 C1OC1Cc2c[s]c[n]2 Amb25143297 [0,0,0,1,1,0|2,0,0]=4 12297 B10R2.193 C1OC1Cc2c[s]cc2 Amb24392264 [0,0,0,1,1,0|1,0,0]=3 12298 B10R2.193 C1OC1Cc2cc[s][n]2 Amb25170528 [0,0,0,1,1,0|2,0,0]=4 12299 B10R2.193 C1OC1Cc2ccc[nH]2 Amb25062577 [0,0,0,1,1,0|1,0,0]=3 12300 B10R2.193 c1cnn(c1)CC2CO2 Amb1134488 [0,0,0,1,1,0|2,0,0]=4 12301 B10R2.193 c1ncn(c1)CC2CO2 Amb1131405 [0,0,0,1,1,0|2,0,0]=4 12302 B12R2.41 C1CCC2C=CC=CNC2=N1 Amb24538143 [0,0,0,1,0,1|1,0,1]=4 12303 B12R2.586 O=C1CCC2=CC=CC=CC21 Amb25150334 [0,0,0,1,0,1|0,0,2]=4 12304 B12R2.586 O=C1CCC=2C=CCC=CC21 Amb24357209 [0,0,0,1,0,1|0,0,2]=4 12305 B12R2.586 O=C1CCC=2CC=CC=CC21 Amb24097416 [0,0,0,1,0,1|0,0,2]=4 12306 B12R2.586 OC1CCC2=CC=CC=CC21 Amb25056856 [0,0,0,1,0,1|0,0,0]=2 12307 B12R2.586 OC1CCC2=CCCC=CC21 Amb25189587 [0,0,0,1,0,1|0,0,2]=4 12308 B12R2.586 OC1CCC=2CC=CC=CC21 Amb24466334 [0,0,0,1,0,1|0,0,0]=2 12309 B12R2.2017 C1CCCC2=CC=CC=C1N2 Amb25213582 [0,0,0,1,0,1|1,0,0]=3 12310 B12R2.24 BrC1CCc2c(C1)cccc2 Amb13952699 [0,1,0,1,0,0|1,0,0]=3 12311 B12R2.24 BrC=1CCc2ccccc2C1 Amb25726468 [0,1,0,1,0,0|1,0,1]=4 12312 B12R2.24 Brc1cc2CCCCc2[n]c1 Amb22289551 [0,1,0,1,0,0|2,0,0]=4 12313 B12R2.24 Brc1cc2CCCCc2c[n]1 Amb23455611 [0,1,0,1,0,0|2,0,0]=4 12314 B12R2.24 Brc1cc2CCCNc2[n]c1 Amb19878999 [0,1,0,1,0,0|2,0,0]=4 12315 B12R2.24 Brc1cc2CCCNc2c[n]1 Amb25149050 [0,1,0,1,0,0|2,0,0]=4 12316 B12R2.24 Brc1cc2CCCSc2[n]c1 Amb25758961 [0,1,0,1,0,0|1,1,0]=4 12317 B12R2.24 Brc1cc2CCCSc2cc1 Amb18755837 [0,1,0,1,0,0|0,1,0]=3 12318 B12R2.24 Brc1cc2CCNCc2cc1 Amb19957726 [0,1,0,1,0,0|2,0,0]=4 12319 B12R2.24 Brc1cc2CCOCc2cc1 Amb19958103 [0,1,0,1,0,0|2,0,0]=4 12320 B12R2.24 Brc1cc2CNCCc2cc1 Amb19957727 [0,1,0,1,0,0|2,0,0]=4 12321 B12R2.24 Brc1cc2COCCc2cc1 Amb21962440 [0,1,0,1,0,0|2,0,0]=4 12322 B12R2.24 Brc1cc2COCNc2cc1 Amb24564128 [0,1,0,1,0,0|2,0,0]=4 12323 B12R2.24 Brc1cc2NCCNc2cc1 Amb22231980 [0,1,0,1,0,0|2,0,0]=4 12324 B12R2.24 Brc1cc2NCCOc2[n]c1 Amb22756067 [0,1,0,1,0,0|2,0,0]=4 12325 B12R2.24 Brc1cc2NCCOc2cc1 Amb21964574 [0,1,0,1,0,0|1,0,0]=3 12326 B12R2.24 Brc1cc2NCCSc2cc1 Amb24487014 [0,1,0,1,0,0|1,1,0]=4 12327 B12R2.24 Brc1cc2OCCNc2cc1 Amb19958005 [0,1,0,1,0,0|1,0,0]=3 12328 B12R2.24 Brc1cc2OCCOc2nc1 Amb13889671 [0,1,0,1,0,0|2,0,0]=4 12329 B12R2.24 Brc1cc2SCCNc2cc1 Amb25086833 [0,1,0,1,0,0|1,1,0]=4 12330 B12R2.24 Brc1cc2SCCOc2cc1 Amb24719830 [0,1,0,1,0,0|1,0,0]=3 12331 B12R2.24 Brc1ccc2CCCOc2c1 Amb23440336 [0,1,0,1,0,0|0,0,0]=2 12332 B12R2.24 Brc1ccc2CCCSc2c1 Amb25728354 [0,1,0,1,0,0|0,1,0]=3 12333 B12R2.24 Brc1ccc2CCN=Cc2c1 Amb22490212 [0,1,0,1,0,0|2,0,0]=4 12334 B12R2.24 Brc1ccc2OCC=Cc2c1 Amb22231978 [0,1,0,1,0,0|0,0,2]=4 12335 B12R2.24 Brc1ccc2OCCNc2[n]1 Amb21864617 [0,1,0,1,0,0|2,0,0]=4 12336 B12R2.24 Brc1ccc2c(c1)C=CCC2 Amb2383772 [0,1,0,1,0,0|1,0,1]=4 12337 B12R2.24 Brc1ccc2c(c1)CCCN2 Amb1090469 [0,1,0,1,0,0|1,0,0]=3 12338 B12R2.24 Brc1ccc2c(c1)CCNC2 Amb10602999 [0,1,0,1,0,0|2,0,0]=4 12339 B12R2.24 Brc1ccc2c(c1)CNCC2 Amb2383361 [0,1,0,1,0,0|2,0,0]=4 12340 B12R2.24 Brc1ccc2c(c1)COCO2 Amb16231031 [0,1,0,1,0,0|1,0,0]=3 12341 B12R2.24 Brc1ccc2c(c1)NCCC2 Amb10576260 [0,1,0,1,0,0|1,0,0]=3 12342 B12R2.24 Brc1ccc2c(c1)NCCC2 Amb2383341 [0,1,0,1,0,0|1,0,0]=3 12343 B12R2.24 Brc1ccc2c(c1)NCCO2 Amb2383447 [0,1,0,1,0,0|1,0,0]=3 12344 B12R2.24 Brc1ccc2c(c1)OCCN2 Amb10603903 [0,1,0,1,0,0|1,0,0]=3 12345 B12R2.24 Brc1ccc2c(c1)OCCO2 Amb1152259 [0,1,0,1,0,0|1,0,0]=3 12346 B12R2.24 Brc1ccc2c(n1)CCCC2 Amb15701630 [0,1,0,1,0,0|2,0,0]=4 12347 B12R2.24 Brc1ccc2c(n1)CCCN2 Amb17621868 [0,1,0,1,0,0|2,0,0]=4 12348 B12R2.24 Brc1ccc2c(n1)OCCN2 Amb13890276 [0,1,0,1,0,0|2,0,0]=4 12349 B12R2.24 C=C1Cc2ccccc2CC1 Amb25151359 [0,1,0,1,0,0|1,0,1]=4 12350 B12R2.24 C=C1Cc2ccccc2OC1 Amb25087646 [0,1,0,1,0,0|0,0,1]=3 12351 B12R2.24 CC1=Nc2c(CC1)cccc2 Amb10553816 [0,1,0,1,0,0|1,0,1]=4 12352 B12R2.24 CC1C=Cc2ccccc2O1 Amb24715788 [0,1,0,1,0,0|0,0,2]=4 12353 B12R2.24 CC1CCc2c(N1)cccc2 Amb2525824 [0,1,0,1,0,0|1,0,0]=3 12354 B12R2.24 CC1CCc2ccc[n]c2N1 Amb24715838 [0,1,0,1,0,0|2,0,0]=4 12355 B12R2.24 CC1CCc2ccccc2N1 Amb22499773 [0,1,0,1,0,0|1,0,0]=3 12356 B12R2.24 CC1CCc2ccccc2O1 Amb19515436 [0,1,0,1,0,0|0,0,0]=2 12357 B12R2.24 CC1CCc2ccccc2S1 Amb25706129 [0,1,0,1,0,0|0,1,0]=3 12358 B12R2.24 CC1CNc2[n]cccc2O1 Amb24709310 [0,1,0,1,0,0|2,0,0]=4 12359 B12R2.24 CC1CNc2c(O1)cccc2 Amb17097653 [0,1,0,1,0,0|1,0,0]=3 12360 B12R2.24 CC1COc2ccc[n]c2N1 Amb25137304 [0,1,0,1,0,0|2,0,0]=4 12361 B12R2.24 CC1COc2ccc[n]c2O1 Amb24485964 [0,1,0,1,0,0|2,0,0]=4 12362 B12R2.24 CC1CSc2ccccc2N1 Amb20622496 [0,1,0,1,0,0|1,1,0]=4 12363 B12R2.24 CC1Cc2[n]cccc2CC1 Amb25187438 [0,1,0,1,0,0|2,0,0]=4 12364 B12R2.24 CC1Cc2ccccc2CN1 Amb22755434 [0,1,0,1,0,0|2,0,0]=4 12365 B12R2.24 CC1Cc2ccccc2N=C1 Amb24682970 [0,1,0,1,0,0|1,0,1]=4 12366 B12R2.24 CC1Cc2ccccc2NC1 Amb22501042 [0,1,0,1,0,0|1,0,0]=3 12367 B12R2.24 CC1Cc2ccccc2OC1 Amb25189640 [0,1,0,1,0,0|0,0,0]=2 12368 B12R2.24 CC1Nc2ccccc2CS1 Amb24373918 [0,1,0,1,0,0|2,0,0]=4 12369 B12R2.24 CC=1COc2ccccc2C1 Amb24484437 [0,1,0,1,0,0|0,0,2]=4 12370 B12R2.24 CC=1Cc2ccccc2ON1 Amb25077210 [0,1,0,1,0,0|1,0,1]=4 12371 B12R2.24 CN1CCc2c(C1)cccc2 Amb2581727 [0,1,0,1,0,0|2,0,0]=4 12372 B12R2.24 CN1Cc2ccccc2CC1 Amb22001820 [0,1,0,1,0,0|2,0,0]=4 12373 B12R2.24 C[C@@H]1CCc2ccccc2N1 Amb22751676 [0,1,0,1,0,0|1,0,0]=3 12374 B12R2.24 C[C@@H]1Cc2ccccc2C=N1 Amb22747779 [0,1,0,1,0,0|2,0,0]=4 12375 B12R2.24 C[C@@H]1Cc2ccccc2CN1 Amb22751934 [0,1,0,1,0,0|2,0,0]=4 12376 B12R2.24 C[C@H]1CCc2ccccc2N1 Amb25138125 [0,1,0,1,0,0|1,0,0]=3 12377 B12R2.24 C[C@H]1CNc2ccccc2N1 Amb25348686 [0,1,0,1,0,0|2,0,0]=4 12378 B12R2.24 C[C@H]1COc2ccc[n]c2N1 Amb24488013 [0,1,0,1,0,0|2,0,0]=4 12379 B12R2.24 C[C@H]1Cc2[n]cccc2CC1 Amb24068759 [0,1,0,1,0,0|2,0,0]=4 12380 B12R2.24 C[C@H]1Cc2ccccc2C=N1 Amb25056784 [0,1,0,1,0,0|2,0,0]=4 12381 B12R2.24 C[C@H]1Cc2ccccc2CN1 Amb24087372 [0,1,0,1,0,0|2,0,0]=4 12382 B12R2.24 C[N+]1=Cc2c(CC1)cccc2 Amb10553962 [0,1,0,1,0,0|2,0,0]=4 12383 B12R2.24 Cc1cc2CCCCc2c[n]1 Amb21948319 [0,1,0,1,0,0|2,0,0]=4 12384 B12R2.24 Cc1cc2CCCNc2c[n]1 Amb25241977 [0,1,0,1,0,0|2,0,0]=4 12385 B12R2.24 Cc1cc2CCCNc2cc1 Amb22499776 [0,1,0,1,0,0|1,0,0]=3 12386 B12R2.24 Cc1cc2CCCNc2nc1 Amb10879389 [0,1,0,1,0,0|2,0,0]=4 12387 B12R2.24 Cc1cc2CCCSc2cc1 Amb24642871 [0,1,0,1,0,0|0,1,0]=3 12388 B12R2.24 Cc1cc2CCNCc2cc1 Amb22500761 [0,1,0,1,0,0|2,0,0]=4 12389 B12R2.24 Cc1cc2CNCCc2cc1 Amb19515632 [0,1,0,1,0,0|2,0,0]=4 12390 B12R2.24 Cc1cc2COCOc2cc1 Amb24648861 [0,1,0,1,0,0|1,0,0]=3 12391 B12R2.24 Cc1cc2NCCNc2cc1 Amb20080170 [0,1,0,1,0,0|2,0,0]=4 12392 B12R2.24 Cc1cc2NCCOc2[n]c1 Amb22059623 [0,1,0,1,0,0|2,0,0]=4 12393 B12R2.24 Cc1cc2NCCOc2cc1 Amb22234866 [0,1,0,1,0,0|1,0,0]=3 12394 B12R2.24 Cc1cc2NCCSc2cc1 Amb22886453 [0,1,0,1,0,0|1,1,0]=4 12395 B12R2.24 Cc1cc2OCCNc2[n]c1 Amb24727299 [0,1,0,1,0,0|2,0,0]=4 12396 B12R2.24 Cc1cc2OCCOc2c[n]1 Amb22751371 [0,1,0,1,0,0|2,0,0]=4 12397 B12R2.24 Cc1cc2OCCOc2cc1 Amb22741143 [0,1,0,1,0,0|1,0,0]=3 12398 B12R2.24 Cc1cc2SCCNc2cc1 Amb22498966 [0,1,0,1,0,0|1,1,0]=4 12399 B12R2.24 Cc1ccc2CCCCc2c1 Amb17673387 [0,1,0,1,0,0|1,0,0]=3 12400 B12R2.24 Cc1ccc2CCCNc2c1 Amb22000879 [0,1,0,1,0,0|1,0,0]=3 12401 B12R2.24 Cc1ccc2CCN=Cc2c1 Amb22500760 [0,1,0,1,0,0|2,0,0]=4 12402 B12R2.24 Cc1ccc2CCN=Cc2c1 Amb22500763 [0,1,0,1,0,0|2,0,0]=4 12403 B12R2.24 Cc1ccc2NCCCc2[n]1 Amb24460718 [0,1,0,1,0,0|2,0,0]=4 12404 B12R2.24 Cc1ccc2NCCOc2[n]1 Amb22059721 [0,1,0,1,0,0|2,0,0]=4 12405 B12R2.24 Cc1ccc2OCC=Cc2c1 Amb23441455 [0,1,0,1,0,0|0,0,2]=4 12406 B12R2.24 Cc1ccc2OCCNc2[n]1 Amb21858358 [0,1,0,1,0,0|2,0,0]=4 12407 B12R2.24 Cc1ccc2OCCOc2[n]1 Amb24073998 [0,1,0,1,0,0|2,0,0]=4 12408 B12R2.24 Cc1ccc2c(c1)CCCO2 Amb13951730 [0,1,0,1,0,0|0,0,0]=2 12409 B12R2.24 Cc1ccc2c(c1)CNCC2 Amb2383365 [0,1,0,1,0,0|2,0,0]=4 12410 B12R2.24 Cc1ccc2c(c1)NCCC2 Amb1089737 [0,1,0,1,0,0|1,0,0]=3 12411 B12R2.24 Cc1ccc2c(c1)NCCC2 Amb2099820 [0,1,0,1,0,0|1,0,0]=3 12412 B12R2.24 Cc1ccc2c(c1)NCCO2 Amb2383451 [0,1,0,1,0,0|1,0,0]=3 12413 B12R2.24 Cc1ccc2c(c1)OCCN2 Amb17496858 [0,1,0,1,0,0|1,0,0]=3 12414 B12R2.24 Cc1ccc2c(n1)NCCC2 Amb10982585 [0,1,0,1,0,0|2,0,0]=4 12415 B12R2.24 ClC1CCc2ccccc2C1 Amb17672772 [0,1,0,1,0,0|1,0,0]=3 12416 B12R2.24 ClC1CCc2ccccc2O1 Amb24509296 [0,1,0,1,0,0|0,0,0]=2 12417 B12R2.24 ClC1CCc2ccccc2S1 Amb24487897 [0,1,0,1,0,0|0,1,0]=3 12418 B12R2.24 ClC1CN=C2C=CC=CN2C1 Amb25053880 [0,1,0,1,0,0|2,0,0]=4 12419 B12R2.24 ClC1Cc2ccccc2CO1 Amb25152704 [0,1,0,1,0,0|2,0,0]=4 12420 B12R2.24 ClC=1COc2ccccc2N1 Amb18118341 [0,1,0,1,0,0|1,0,1]=4 12421 B12R2.24 Clc1c[n]c2CCCNc2c1 Amb25766188 [0,1,0,1,0,0|2,0,0]=4 12422 B12R2.24 Clc1cc2CCCCc2[n]c1 Amb22500842 [0,1,0,1,0,0|2,0,0]=4 12423 B12R2.24 Clc1cc2CCCCc2c[n]1 Amb19516978 [0,1,0,1,0,0|2,0,0]=4 12424 B12R2.24 Clc1cc2CCCNc2[n]c1 Amb25042644 [0,1,0,1,0,0|2,0,0]=4 12425 B12R2.24 Clc1cc2CCCNc2c[n]1 Amb25152852 [0,1,0,1,0,0|2,0,0]=4 12426 B12R2.24 Clc1cc2CCCOc2cc1 Amb22498254 [0,1,0,1,0,0|0,0,0]=2 12427 B12R2.24 Clc1cc2CCCSc2cc1 Amb25783030 [0,1,0,1,0,0|0,1,0]=3 12428 B12R2.24 Clc1cc2CCN=Cc2cc1 Amb24649802 [0,1,0,1,0,0|2,0,0]=4 12429 B12R2.24 Clc1cc2CCNCc2cc1 Amb21864875 [0,1,0,1,0,0|2,0,0]=4 12430 B12R2.24 Clc1cc2CCOCc2cc1 Amb22235175 [0,1,0,1,0,0|2,0,0]=4 12431 B12R2.24 Clc1cc2CNCCc2cc1 Amb20248082 [0,1,0,1,0,0|2,0,0]=4 12432 B12R2.24 Clc1cc2COCNc2cc1 Amb25211398 [0,1,0,1,0,0|2,0,0]=4 12433 B12R2.24 Clc1cc2NCCOc2[n]c1 Amb25347381 [0,1,0,1,0,0|2,0,0]=4 12434 B12R2.24 Clc1cc2NCCOc2c[n]1 Amb24486945 [0,1,0,1,0,0|2,0,0]=4 12435 B12R2.24 Clc1cc2NCCOc2cc1 Amb22490751 [0,1,0,1,0,0|1,0,0]=3 12436 B12R2.24 Clc1cc2OCC=Cc2cc1 Amb24349799 [0,1,0,1,0,0|0,0,2]=4 12437 B12R2.24 Clc1cc2OCCNc2[n]c1 Amb25336448 [0,1,0,1,0,0|2,0,0]=4 12438 B12R2.24 Clc1cc2OCCOc2[n]c1 Amb21959416 [0,1,0,1,0,0|2,0,0]=4 12439 B12R2.24 Clc1cc2SCCNc2cc1 Amb25151172 [0,1,0,1,0,0|1,1,0]=4 12440 B12R2.24 Clc1ccc2CCCNc2[n]1 Amb22753683 [0,1,0,1,0,0|2,0,0]=4 12441 B12R2.24 Clc1ccc2CCCOc2c1 Amb25103951 [0,1,0,1,0,0|0,0,0]=2 12442 B12R2.24 Clc1ccc2OCC=Cc2c1 Amb22586260 [0,1,0,1,0,0|0,0,2]=4 12443 B12R2.24 Clc1ccc2OCCNc2[n]1 Amb24509092 [0,1,0,1,0,0|2,0,0]=4 12444 B12R2.24 Clc1ccc2c(c1)C=CCC2 Amb2383770 [0,1,0,1,0,0|1,0,1]=4 12445 B12R2.24 Clc1ccc2c(c1)CCCN2 Amb1133229 [0,1,0,1,0,0|1,0,0]=3 12446 B12R2.24 Clc1ccc2c(c1)CCNC2 Amb10067199 [0,1,0,1,0,0|2,0,0]=4 12447 B12R2.24 Clc1ccc2c(c1)CNCC2 Amb2383359 [0,1,0,1,0,0|2,0,0]=4 12448 B12R2.24 Clc1ccc2c(c1)NCCC2 Amb10576261 [0,1,0,1,0,0|1,0,0]=3 12449 B12R2.24 Clc1ccc2c(c1)NCCC2 Amb2383339 [0,1,0,1,0,0|1,0,0]=3 12450 B12R2.24 Clc1ccc2c(c1)NCCN2 Amb10605577 [0,1,0,1,0,0|2,0,0]=4 12451 B12R2.24 Clc1ccc2c(c1)NCCO2 Amb2383445 [0,1,0,1,0,0|1,0,0]=3 12452 B12R2.24 Clc1ccc2c(c1)NCCS2 Amb2371893 [0,1,0,1,0,0|1,1,0]=4 12453 B12R2.24 Clc1ccc2c(c1)OCC=N2 Amb10603916 [0,1,0,1,0,0|1,0,1]=4 12454 B12R2.24 Clc1ccc2c(c1)OCCO2 Amb13951123 [0,1,0,1,0,0|1,0,0]=3 12455 B12R2.24 FC1CNc2ccccc2O1 Amb25301702 [0,1,0,1,0,0|1,0,0]=3 12456 B12R2.24 FC1Cc2ccccc2NC1 Amb25207965 [0,1,0,1,0,0|1,0,0]=3 12457 B12R2.24 Fc1cc2CCC=Cc2cc1 Amb25320782 [0,1,0,1,0,0|1,0,1]=4 12458 B12R2.24 Fc1cc2CCCOc2cc1 Amb21864763 [0,1,0,1,0,0|0,0,0]=2 12459 B12R2.24 Fc1cc2CCCOc2nc1 Amb13889669 [0,1,0,1,0,0|1,0,0]=3 12460 B12R2.24 Fc1cc2CCN=Cc2cc1 Amb24091693 [0,1,0,1,0,0|2,0,0]=4 12461 B12R2.24 Fc1cc2CCNCc2cc1 Amb18560951 [0,1,0,1,0,0|2,0,0]=4 12462 B12R2.24 Fc1cc2CCNCc2cc1 Amb21858227 [0,1,0,1,0,0|2,0,0]=4 12463 B12R2.24 Fc1cc2CNCCc2cc1 Amb19374000 [0,1,0,1,0,0|2,0,0]=4 12464 B12R2.24 Fc1cc2NCCOc2[n]c1 Amb25736367 [0,1,0,1,0,0|2,0,0]=4 12465 B12R2.24 Fc1cc2NCCSc2cc1 Amb25713881 [0,1,0,1,0,0|1,1,0]=4 12466 B12R2.24 Fc1cc2OCC=Cc2cc1 Amb24485991 [0,1,0,1,0,0|0,0,2]=4 12467 B12R2.24 Fc1cc2OCCOc2cc1 Amb22546380 [0,1,0,1,0,0|1,0,0]=3 12468 B12R2.24 Fc1ccc2CCCCc2[n]1 Amb24469968 [0,1,0,1,0,0|2,0,0]=4 12469 B12R2.24 Fc1ccc2CCCNc2c1 Amb22586301 [0,1,0,1,0,0|1,0,0]=3 12470 B12R2.24 Fc1ccc2CCCOc2c1 Amb25065166 [0,1,0,1,0,0|0,0,0]=2 12471 B12R2.24 Fc1ccc2CCCSc2c1 Amb25132871 [0,1,0,1,0,0|0,1,0]=3 12472 B12R2.24 Fc1ccc2CCN=Cc2c1 Amb24092083 [0,1,0,1,0,0|2,0,0]=4 12473 B12R2.24 Fc1ccc2OCC=Cc2c1 Amb25770785 [0,1,0,1,0,0|0,0,2]=4 12474 B12R2.24 Fc1ccc2c(c1)C=CCC2 Amb2383771 [0,1,0,1,0,0|1,0,1]=4 12475 B12R2.24 Fc1ccc2c(c1)CCCN2 Amb1107937 [0,1,0,1,0,0|1,0,0]=3 12476 B12R2.24 Fc1ccc2c(c1)CNCC2 Amb2383360 [0,1,0,1,0,0|2,0,0]=4 12477 B12R2.24 Fc1ccc2c(c1)NCCC2 Amb2383340 [0,1,0,1,0,0|1,0,0]=3 12478 B12R2.24 Fc1ccc2c(c1)NCCO2 Amb10603189 [0,1,0,1,0,0|1,0,0]=3 12479 B12R2.24 Fc1ccc2c(c1)NCCO2 Amb2383446 [0,1,0,1,0,0|1,0,0]=3 12480 B12R2.24 Fc1ccc2c(c1)OCCN2 Amb10974785 [0,1,0,1,0,0|1,0,0]=3 12481 B12R2.24 IC1Cc2ccccc2CO1 Amb25811321 [0,1,0,1,0,0|2,0,0]=4 12482 B12R2.24 Ic1cc2CCCCc2[n]c1 Amb22500843 [0,1,0,1,0,0|2,0,0]=4 12483 B12R2.24 Ic1cc2CCCOc2[n]c1 Amb21961014 [0,1,0,1,0,0|1,0,0]=3 12484 B12R2.24 Ic1cc2CCCOc2cc1 Amb22498253 [0,1,0,1,0,0|0,0,0]=2 12485 B12R2.24 Ic1cc2CNCCc2cc1 Amb22490586 [0,1,0,1,0,0|2,0,0]=4 12486 B12R2.24 Ic1cc2NCCOc2cc1 Amb22586266 [0,1,0,1,0,0|1,0,0]=3 12487 B12R2.24 Ic1cc2OCCOc2nc1 Amb13889674 [0,1,0,1,0,0|2,0,0]=4 12488 B12R2.24 Ic1ccc2CCCNc2c1 Amb22586311 [0,1,0,1,0,0|1,0,0]=3 12489 B12R2.24 Ic1ccc2OCCCc2[n]1 Amb21959447 [0,1,0,1,0,0|1,0,0]=3 12490 B12R2.24 Ic1ccc2OCCNc2[n]1 Amb21962491 [0,1,0,1,0,0|2,0,0]=4 12491 B12R2.24 Ic1ccc2c(c1)CNCC2 Amb2383367 [0,1,0,1,0,0|2,0,0]=4 12492 B12R2.24 Ic1ccc2c(c1)NCCC2 Amb2383346 [0,1,0,1,0,0|1,0,0]=3 12493 B12R2.24 Ic1ccc2c(c1)NCCO2 Amb2383453 [0,1,0,1,0,0|1,0,0]=3 12494 B12R2.24 Ic1ccc2c(n1)OCCN2 Amb13890275 [0,1,0,1,0,0|2,0,0]=4 12495 B12R2.24 Ic1ccc2c(n1)OCCO2 Amb13889672 [0,1,0,1,0,0|2,0,0]=4 12496 B12R2.24 NC1=Nc2c(CC1)cccc2 Amb2373583 [0,1,0,1,0,0|1,0,1]=4 12497 B12R2.24 NC1C=Cc2c(C1)cccc2 Amb17470378 [0,1,0,1,0,0|1,0,1]=4 12498 B12R2.24 NC1C=Cc2ccccc2O1 Amb24618074 [0,1,0,1,0,0|0,0,2]=4 12499 B12R2.24 NC1CCc2c(C1)cccc2 Amb13952050 [0,1,0,1,0,0|1,0,0]=3 12500 B12R2.24 NC1CCc2c(C1)cccc2 Amb2383251 [0,1,0,1,0,0|1,0,0]=3 12501 B12R2.24 NC1CNc2ccccc2O1 Amb24417784 [0,1,0,1,0,0|1,0,0]=3 12502 B12R2.24 NC1COc2c(C1)cccc2 Amb2383393 [0,1,0,1,0,0|0,0,0]=2 12503 B12R2.24 NC1Cc2[n]cccc2CC1 Amb21964047 [0,1,0,1,0,0|2,0,0]=4 12504 B12R2.24 NC1Cc2c[n]ccc2CC1 Amb18202204 [0,1,0,1,0,0|2,0,0]=4 12505 B12R2.24 NC1Cc2ccc[n]c2CC1 Amb19372737 [0,1,0,1,0,0|2,0,0]=4 12506 B12R2.24 NC1Cc2ccccc2CO1 Amb24365192 [0,1,0,1,0,0|2,0,0]=4 12507 B12R2.24 NC1Cc2ccccc2SC1 Amb18646412 [0,1,0,1,0,0|0,1,0]=3 12508 B12R2.24 NC=1COc2ccccc2N1 Amb18124903 [0,1,0,1,0,0|1,0,1]=4 12509 B12R2.24 NN1CCc2c(C1)cccc2 Amb17232046 [0,1,0,1,0,0|2,0,0]=4 12510 B12R2.24 NN1Cc2ccccc2CC1 Amb22495461 [0,1,0,1,0,0|2,0,0]=4 12511 B12R2.24 N[C@@H]1Cc2ccccc2OC1 Amb22756584 [0,1,0,1,0,0|0,0,0]=2 12512 B12R2.24 N[C@H]1Cc2ccccc2C=C1 Amb24699393 [0,1,0,1,0,0|1,0,1]=4 12513 B12R2.24 N[C@H]1Cc2ccccc2CC1 Amb25113422 [0,1,0,1,0,0|1,0,0]=3 12514 B12R2.24 N[C@H]1Cc2ccccc2NC1 Amb25224756 [0,1,0,1,0,0|1,0,0]=3 12515 B12R2.24 N[C@H]1Cc2ccccc2OC1 Amb23385337 [0,1,0,1,0,0|0,0,0]=2 12516 B12R2.24 N[C@H]1Cc2ccccc2OC1 Amb24485980 [0,1,0,1,0,0|0,0,0]=2 12517 B12R2.24 Nc1[n]cc2CCCOc2[n]1 Amb18125263 [0,1,0,1,0,0|2,0,0]=4 12518 B12R2.24 Nc1c[n]c2CCCNc2c1 Amb24439439 [0,1,0,1,0,0|2,0,0]=4 12519 B12R2.24 Nc1cc2CCCCc2[n]c1 Amb18202201 [0,1,0,1,0,0|2,0,0]=4 12520 B12R2.24 Nc1cc2CCCCc2c[n]1 Amb18644367 [0,1,0,1,0,0|2,0,0]=4 12521 B12R2.24 Nc1cc2CCCOc2[n]c1 Amb21961016 [0,1,0,1,0,0|1,0,0]=3 12522 B12R2.24 Nc1cc2CCCOc2c[n]1 Amb18201906 [0,1,0,1,0,0|1,0,0]=3 12523 B12R2.24 Nc1cc2CCCSc2cc1 Amb18828001 [0,1,0,1,0,0|0,1,0]=3 12524 B12R2.24 Nc1cc2CCOCc2cc1 Amb22497220 [0,1,0,1,0,0|2,0,0]=4 12525 B12R2.24 Nc1cc2N=CCOc2cc1 Amb24093681 [0,1,0,1,0,0|1,0,1]=4 12526 B12R2.24 Nc1cc2NCCOc2[n]c1 Amb25810070 [0,1,0,1,0,0|2,0,0]=4 12527 B12R2.24 Nc1cc2OCCOc2[n]c1 Amb21959405 [0,1,0,1,0,0|2,0,0]=4 12528 B12R2.24 Nc1ccc2CCCNc2c1 Amb22494228 [0,1,0,1,0,0|1,0,0]=3 12529 B12R2.24 Nc1ccc2CCCOc2c1 Amb25324386 [0,1,0,1,0,0|0,0,0]=2 12530 B12R2.24 Nc1ccc2CCN=Cc2c1 Amb25145814 [0,1,0,1,0,0|2,0,0]=4 12531 B12R2.24 Nc1ccc2COCOc2c1 Amb24509308 [0,1,0,1,0,0|1,0,0]=3 12532 B12R2.24 Nc1ccc2OCC=Cc2c1 Amb23441460 [0,1,0,1,0,0|0,0,2]=4 12533 B12R2.24 Nc1ccc2c(c1)CCCC2 Amb1084712 [0,1,0,1,0,0|1,0,0]=3 12534 B12R2.24 Nc1ccc2c(c1)CCCN2 Amb17598307 [0,1,0,1,0,0|1,0,0]=3 12535 B12R2.24 Nc1ccc2c(c1)CCCO2 Amb13952453 [0,1,0,1,0,0|0,0,0]=2 12536 B12R2.24 Nc1ccc2c(c1)NCCC2 Amb17598306 [0,1,0,1,0,0|1,0,0]=3 12537 B12R2.24 Nc1ccc2c(c1)NCCN2 Amb10606637 [0,1,0,1,0,0|2,0,0]=4 12538 B12R2.24 Nc1ccc2c(c1)NCCO2 Amb15695267 [0,1,0,1,0,0|1,0,0]=3 12539 B12R2.24 Nc1ccc2c(c1)NCCS2 Amb13881705 [0,1,0,1,0,0|1,1,0]=4 12540 B12R2.24 Nc1ccc2c(c1)OCCO2 Amb2539754 [0,1,0,1,0,0|1,0,0]=3 12541 B12R2.24 O=C1C=C2CCCCC2=CN1 Amb22750138 [0,1,0,1,0,0|2,0,0]=4 12542 B12R2.24 O=C1C=C2CCCCC2C=C1 Amb25839264 [0,1,0,1,0,0|1,0,1]=4 12543 B12R2.24 O=C1C=C2CCCCN2C=C1 Amb25073236 [0,1,0,1,0,0|2,0,0]=4 12544 B12R2.24 O=C1C=C2NCCOC2=CN1 Amb24634638 [0,1,0,1,0,0|2,0,0]=4 12545 B12R2.24 O=C1C=CC=2CCCCC2N1 Amb17934277 [0,1,0,1,0,0|2,0,0]=4 12546 B12R2.24 O=C1C=CC=2CCCCC2O1 Amb19755766 [0,1,0,1,0,0|2,0,0]=4 12547 B12R2.24 O=C1CCc2c(C1)cccc2 Amb2383557 [0,1,0,1,0,0|0,0,2]=4 12548 B12R2.24 O=C1CNc2ccccc2O1 Amb22166855 [0,1,0,1,0,0|1,0,1]=4 12549 B12R2.24 O=C1COc2c(C1)cccc2 Amb15692703 [0,1,0,1,0,0|0,0,1]=3 12550 B12R2.24 O=C1COc2c(N1)cccc2 Amb1011836 [0,1,0,1,0,0|1,0,1]=4 12551 B12R2.24 O=C1Cc2ccccc2NC1 Amb18202302 [0,1,0,1,0,0|1,0,1]=4 12552 B12R2.24 O=C1Cc2ccccc2SC1 Amb22231635 [0,1,0,1,0,0|0,1,1]=4 12553 B12R2.24 O=C1OCc2ccccc2O1 Amb24536007 [0,1,0,1,0,0|1,0,1]=4 12554 B12R2.24 OC1=Nc2c(NC1)cccc2 Amb2373483 [0,1,0,1,0,0|1,0,1]=4 12555 B12R2.24 OC1C=Cc2ccccc2O1 Amb21964141 [0,1,0,1,0,0|0,0,2]=4 12556 B12R2.24 OC1CCc2[n]cccc2O1 Amb24417236 [0,1,0,1,0,0|1,0,0]=3 12557 B12R2.24 OC1CCc2ccccc2O1 Amb22230405 [0,1,0,1,0,0|0,0,0]=2 12558 B12R2.24 OC1CN=C2C=CC=CN2C1 Amb17773345 [0,1,0,1,0,0|2,0,0]=4 12559 B12R2.24 OC1CN=C2C=CC=CN2C1 Amb17873523 [0,1,0,1,0,0|2,0,0]=4 12560 B12R2.24 OC1CNc2cccc[n+]2C1 Amb21867773 [0,1,0,1,0,0|2,0,0]=4 12561 B12R2.24 OC1CNc2ccccc2O1 Amb24485948 [0,1,0,1,0,0|1,0,0]=3 12562 B12R2.24 OC1COc2c(O1)cccc2 Amb10552971 [0,1,0,1,0,0|1,0,0]=3 12563 B12R2.24 OC1CSc2ccccc2O1 Amb25072247 [0,1,0,1,0,0|1,0,0]=3 12564 B12R2.24 OC1Cc2[n]cccc2CC1 Amb24070827 [0,1,0,1,0,0|1,0,0]=3 12565 B12R2.24 OC1Cc2c[n]c[n]c2CC1 Amb22011598 [0,1,0,1,0,0|2,0,0]=4 12566 B12R2.24 OC1Cc2ccccc2NC1 Amb23590875 [0,1,0,1,0,0|1,0,0]=3 12567 B12R2.24 OC1Cc2ccccc2OC1 Amb22498287 [0,1,0,1,0,0|0,0,0]=2 12568 B12R2.24 OC1Cc2ccccc2SC1 Amb25832476 [0,1,0,1,0,0|0,1,0]=3 12569 B12R2.24 OC1OCc2c(C1)cccc2 Amb17593730 [0,1,0,1,0,0|1,0,0]=3 12570 B12R2.24 OC=1COc2ccccc2C1 Amb22498277 [0,1,0,1,0,0|0,0,2]=4 12571 B12R2.24 OC=1COc2ccccc2N1 Amb22330533 [0,1,0,1,0,0|1,0,1]=4 12572 B12R2.24 ON1Cc2ccccc2CC1 Amb24533074 [0,1,0,1,0,0|1,0,0]=3 12573 B12R2.24 O[C@@H]1Cc2ccccc2CC1 Amb25149682 [0,1,0,1,0,0|0,0,0]=2 12574 B12R2.24 O[C@H]1Cc2ccccc2C=C1 Amb25792328 [0,1,0,1,0,0|0,0,2]=4 12575 B12R2.24 O[C@H]1Cc2ccccc2CC1 Amb25043599 [0,1,0,1,0,0|0,0,0]=2 12576 B12R2.24 O[C@H]1Cc2ccccc2NC1 Amb24426871 [0,1,0,1,0,0|1,0,0]=3 12577 B12R2.24 Oc1cc2CCCCc2[n]c1 Amb22289552 [0,1,0,1,0,0|2,0,0]=4 12578 B12R2.24 Oc1cc2CCCNc2[n]c1 Amb23597942 [0,1,0,1,0,0|2,0,0]=4 12579 B12R2.24 Oc1cc2CCCOc2cc1 Amb18243510 [0,1,0,1,0,0|0,0,0]=2 12580 B12R2.24 Oc1cc2CCN=Cc2cc1 Amb25073966 [0,1,0,1,0,0|2,0,0]=4 12581 B12R2.24 Oc1cc2CCOCc2cc1 Amb25044546 [0,1,0,1,0,0|2,0,0]=4 12582 B12R2.24 Oc1cc2CNCCc2cc1 Amb19373281 [0,1,0,1,0,0|2,0,0]=4 12583 B12R2.24 Oc1cc2COCCc2cc1 Amb25682436 [0,1,0,1,0,0|2,0,0]=4 12584 B12R2.24 Oc1cc2NCCOc2cc1 Amb21953873 [0,1,0,1,0,0|1,0,0]=3 12585 B12R2.24 Oc1cc2NCCOc2cc1 Amb22498359 [0,1,0,1,0,0|1,0,0]=3 12586 B12R2.24 Oc1cc2OCCNc2cc1 Amb22371507 [0,1,0,1,0,0|1,0,0]=3 12587 B12R2.24 Oc1cc2OCCNc2cc1 Amb22495584 [0,1,0,1,0,0|1,0,0]=3 12588 B12R2.24 Oc1cc2OCCOc2[n]c1 Amb19959863 [0,1,0,1,0,0|2,0,0]=4 12589 B12R2.24 Oc1cc2SCCOc2cc1 Amb22584035 [0,1,0,1,0,0|1,0,0]=3 12590 B12R2.24 Oc1ccc2CCCOc2c1 Amb18125116 [0,1,0,1,0,0|0,0,0]=2 12591 B12R2.24 Oc1ccc2CCNCc2c1 Amb17843849 [0,1,0,1,0,0|2,0,0]=4 12592 B12R2.24 Oc1ccc2CNCCc2c1 Amb17755303 [0,1,0,1,0,0|2,0,0]=4 12593 B12R2.24 Oc1ccc2COCOc2c1 Amb25802023 [0,1,0,1,0,0|1,0,0]=3 12594 B12R2.24 Oc1ccc2NCCCc2[n]1 Amb24657265 [0,1,0,1,0,0|2,0,0]=4 12595 B12R2.24 Oc1ccc2OCC=Cc2c1 Amb18124873 [0,1,0,1,0,0|0,0,2]=4 12596 B12R2.24 Oc1ccc2c(c1)CCNC2 Amb15692387 [0,1,0,1,0,0|2,0,0]=4 12597 B12R2.24 Oc1ccc2c(c1)OCCO2 Amb1157176 [0,1,0,1,0,0|1,0,0]=3 12598 B12R2.24 S=C1C=CC=2CCCCC2N1 Amb21951684 [0,1,0,1,0,0|2,0,0]=4 12599 B12R2.24 S=C1CCc2ccccc2N1 Amb25700408 [0,1,0,1,0,0|0,1,1]=4 12600 B12R2.24 S=C1CCc2ccccc2O1 Amb24104591 [0,1,0,1,0,0|0,0,1]=3 12601 B12R2.24 S=C1COc2c(N1)cccc2 Amb10070958 [0,1,0,1,0,0|1,0,1]=4 12602 B12R2.24 SC1CCc2ccccc2C1 Amb17672773 [0,1,0,1,0,0|0,1,0]=3 12603 B12R2.24 Sc1cc2CCCOc2cc1 Amb18180108 [0,1,0,1,0,0|0,0,0]=2 12604 B12R2.24 Sc1cc2CCCSc2cc1 Amb24509702 [0,1,0,1,0,0|0,1,0]=3 12605 B12R2.24 Sc1cc2NCCOc2cc1 Amb18664649 [0,1,0,1,0,0|1,0,0]=3 12606 B12R2.24 Sc1ccc2c(c1)OCCO2 Amb2370522 [0,1,0,1,0,0|1,0,0]=3 12607 B12R2.24 [O-][n+]1cc2CCCCc2cc1 Amb23412276 [0,1,0,1,0,0|2,0,0]=4 12608 B12R2.79 Br[C@@H]1C[C@H]1c2ccc(I)cc2 Amb25113713 [0,1,0,1,0,0|1,0,0]=3 12609 B12R2.79 Brc1ccc(cc1)C2CC2Br Amb23454932 [0,1,0,1,0,0|1,0,0]=3 12610 B12R2.79 CC1CC1c2ccc(Br)cc2 Amb23247702 [0,1,0,1,0,0|1,0,0]=3 12611 B12R2.79 CC1CC1c2ccc(F)cc2 Amb24662198 [0,1,0,1,0,0|1,0,0]=3 12612 B12R2.79 CC1CC1c2ccc(N)cc2 Amb23247694 [0,1,0,1,0,0|1,0,0]=3 12613 B12R2.79 CC1OC1c2ccc(cc2)Br Amb1127215 [0,1,0,1,0,0|2,0,0]=4 12614 B12R2.79 CC1OC1c2ccc(cc2)C Amb1142227 [0,1,0,1,0,0|2,0,0]=4 12615 B12R2.79 CC1OC1c2ccc(cc2)Cl Amb1132631 [0,1,0,1,0,0|2,0,0]=4 12616 B12R2.79 CC1OC1c2ccc(cc2)F Amb1137217 [0,1,0,1,0,0|2,0,0]=4 12617 B12R2.79 C[C@@H]1O[C@@H]1c2ccc(F)cc2 Amb24515103 [0,1,0,1,0,0|2,0,0]=4 12618 B12R2.79 Cc1ccc(cc1)C2CC2O Amb24527656 [0,1,0,1,0,0|0,0,0]=2 12619 B12R2.79 Cc1ccc(cc1)[C@@H]2C[C@@H]2Cl Amb25179016 [0,1,0,1,0,0|1,0,0]=3 12620 B12R2.79 Cc1ccc(cc1)[C@@H]2C[C@H]2Cl Amb25210810 [0,1,0,1,0,0|1,0,0]=3 12621 B12R2.79 Cc1ccc(cc1)[C@@H]2C[C@H]2N Amb24100233 [0,1,0,1,0,0|1,0,0]=3 12622 B12R2.79 Clc1ccc(cc1)C2CC2Br Amb23454925 [0,1,0,1,0,0|1,0,0]=3 12623 B12R2.79 Fc1ccc([n]c1)C2CC2Br Amb24458772 [0,1,0,1,0,0|2,0,0]=4 12624 B12R2.79 Fc1ccc(cc1)C2CC2Br Amb23454928 [0,1,0,1,0,0|1,0,0]=3 12625 B12R2.79 NC1CC1c2ccc(Br)cc2 Amb19346488 [0,1,0,1,0,0|1,0,0]=3 12626 B12R2.79 NC1CC1c2ccc(Cl)cc2 Amb19373427 [0,1,0,1,0,0|1,0,0]=3 12627 B12R2.79 NC1CC1c2ccc(F)cc2 Amb19514916 [0,1,0,1,0,0|1,0,0]=3 12628 B12R2.79 NC1CC1c2ccc(cc2)O Amb17568133 [0,1,0,1,0,0|1,0,0]=3 12629 B12R2.79 N[C@@H]1C[C@@H]1c2ccc(Br)cc2 Amb24763920 [0,1,0,1,0,0|1,0,0]=3 12630 B12R2.79 N[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb24655057 [0,1,0,1,0,0|1,0,0]=3 12631 B12R2.79 N[C@@H]1C[C@H]1c2ccc(F)cc2 Amb24100231 [0,1,0,1,0,0|1,0,0]=3 12632 B12R2.79 N[C@H]1CC1c2ccc(Cl)cc2 Amb25690946 [0,1,0,1,0,0|1,0,0]=3 12633 B12R2.79 N[C@H]1C[C@@H]1c2ccc(Cl)cc2 Amb24512288 [0,1,0,1,0,0|1,0,0]=3 12634 B12R2.79 N[C@H]1C[C@@H]1c2ccc(F)cc2 Amb25168877 [0,1,0,1,0,0|1,0,0]=3 12635 B12R2.79 N[C@H]1C[C@H]1c2ccc(Br)cc2 Amb25365231 [0,1,0,1,0,0|1,0,0]=3 12636 B12R2.79 N[C@H]1C[C@H]1c2ccc(Cl)cc2 Amb25326697 [0,1,0,1,0,0|1,0,0]=3 12637 B12R2.79 OC1CC1c2ccc(F)cc2 Amb24639281 [0,1,0,1,0,0|0,0,0]=2 12638 B12R2.132 Brc1ccc2CCC(Br)c2c1 Amb24707166 [0,1,0,1,0,0|1,0,0]=3 12639 B12R2.132 Brc1ccc2c(c1)C(=O)CC2 Amb2383532 [0,1,0,1,0,0|0,0,2]=4 12640 B12R2.132 Brc1ccc2c(c1)C(N)CC2 Amb2383225 [0,1,0,1,0,0|1,0,0]=3 12641 B12R2.132 Brc1ccc2c(c1)C(N)CO2 Amb2383235 [0,1,0,1,0,0|2,0,0]=4 12642 B12R2.132 C=C1CCc2ccc(Br)cc21 Amb24501876 [0,1,0,1,0,0|1,0,1]=4 12643 B12R2.132 CC1CCc2ccc(Cl)[n]c21 Amb25695443 [0,1,0,1,0,0|2,0,0]=4 12644 B12R2.132 CC1CCc2ccc(O)cc21 Amb24099164 [0,1,0,1,0,0|1,0,0]=3 12645 B12R2.132 CC1CNc2ccc(Br)cc21 Amb18561153 [0,1,0,1,0,0|2,0,0]=4 12646 B12R2.132 CC1CNc2ccc(Cl)cc21 Amb18063404 [0,1,0,1,0,0|2,0,0]=4 12647 B12R2.132 CC1CNc2ccc(F)cc21 Amb18063403 [0,1,0,1,0,0|2,0,0]=4 12648 B12R2.132 CC1COc2ccc(N)cc21 Amb24688008 [0,1,0,1,0,0|2,0,0]=4 12649 B12R2.132 CC1NCc2ccc(Br)cc21 Amb25693070 [0,1,0,1,0,0|2,0,0]=4 12650 B12R2.132 CC1NCc2ccc(Cl)cc21 Amb25265748 [0,1,0,1,0,0|2,0,0]=4 12651 B12R2.132 CC1NCc2ccc(F)cc21 Amb24414067 [0,1,0,1,0,0|2,0,0]=4 12652 B12R2.132 CC1NCc2ccc(N)cc21 Amb25085461 [0,1,0,1,0,0|2,0,0]=4 12653 B12R2.132 CN1CCc2ccc(Br)cc12 Amb25087238 [0,1,0,1,0,0|2,0,0]=4 12654 B12R2.132 CN1CCc2ccc(Cl)cc12 Amb24448676 [0,1,0,1,0,0|2,0,0]=4 12655 B12R2.132 CN1CCc2ccc(Cl)cc12 Amb24575788 [0,1,0,1,0,0|2,0,0]=4 12656 B12R2.132 CN1CCc2ccc(N)cc12 Amb22899074 [0,1,0,1,0,0|2,0,0]=4 12657 B12R2.132 C[C@@H]1NCc2ccc(Br)cc21 Amb25710280 [0,1,0,1,0,0|2,0,0]=4 12658 B12R2.132 C[C@@H]1NCc2ccc(Cl)cc21 Amb25859052 [0,1,0,1,0,0|2,0,0]=4 12659 B12R2.132 C[C@@H]1NCc2ccc(F)cc21 Amb25343338 [0,1,0,1,0,0|2,0,0]=4 12660 B12R2.132 C[C@@H]1NCc2ccc(N)cc21 Amb25121208 [0,1,0,1,0,0|2,0,0]=4 12661 B12R2.132 C[C@H]1NCc2ccc(Br)cc21 Amb24642891 [0,1,0,1,0,0|2,0,0]=4 12662 B12R2.132 C[C@H]1NCc2ccc(Cl)cc21 Amb25711286 [0,1,0,1,0,0|2,0,0]=4 12663 B12R2.132 C[C@H]1NCc2ccc(O)cc21 Amb25280892 [0,1,0,1,0,0|2,0,0]=4 12664 B12R2.132 Cc1cc2B(O)OCc2cc1 Amb25777120 [0,1,0,1,0,0|2,0,0]=4 12665 B12R2.132 Cc1cc2C(N)COc2cc1 Amb20626372 [0,1,0,1,0,0|2,0,0]=4 12666 B12R2.132 Cc1cc2C(O)OCc2cc1 Amb25151988 [0,1,0,1,0,0|1,0,0]=3 12667 B12R2.132 Cc1cc2[C@@H](N)COc2cc1 Amb25367329 [0,1,0,1,0,0|2,0,0]=4 12668 B12R2.132 Cc1cc2[C@H](N)COc2cc1 Amb25781341 [0,1,0,1,0,0|2,0,0]=4 12669 B12R2.132 Cc1ccc2CCC(=C)c2c1 Amb24359347 [0,1,0,1,0,0|1,0,1]=4 12670 B12R2.132 Cc1ccc2CCC(N)c2c1 Amb19301139 [0,1,0,1,0,0|1,0,0]=3 12671 B12R2.132 Cc1ccc2CCC(O)c2[n]1 Amb24105117 [0,1,0,1,0,0|1,0,0]=3 12672 B12R2.132 Cc1ccc2CCN(C)c2c1 Amb24485108 [0,1,0,1,0,0|2,0,0]=4 12673 B12R2.132 Cc1ccc2CC[C@@H](N)c2c1 Amb25367187 [0,1,0,1,0,0|1,0,0]=3 12674 B12R2.132 Cc1ccc2CC[C@H](N)c2c1 Amb25172752 [0,1,0,1,0,0|1,0,0]=3 12675 B12R2.132 Cc1ccc2CC[C@H](O)c2c1 Amb25337667 [0,1,0,1,0,0|0,0,0]=2 12676 B12R2.132 Cc1ccc2CN[C@H](C)c2c1 Amb25049401 [0,1,0,1,0,0|2,0,0]=4 12677 B12R2.132 Cc1ccc2c(c1)C(C)CN2 Amb17040660 [0,1,0,1,0,0|2,0,0]=4 12678 B12R2.132 Cc1ccc2c(c1)C(O)CC2 Amb17087924 [0,1,0,1,0,0|0,0,0]=2 12679 B12R2.132 ClC1CCc2ccc(I)cc21 Amb25293402 [0,1,0,1,0,0|1,0,0]=3 12680 B12R2.132 Clc1ccc2c(c1)C(=O)CC2 Amb2383530 [0,1,0,1,0,0|0,0,2]=4 12681 B12R2.132 Clc1ccc2c(c1)C(N)CC2 Amb2383223 [0,1,0,1,0,0|1,0,0]=3 12682 B12R2.132 Clc1ccc2c(c1)C(N)CO2 Amb2383233 [0,1,0,1,0,0|2,0,0]=4 12683 B12R2.132 Clc1ccc2c(n1)C(O)CC2 Amb16233494 [0,1,0,1,0,0|1,0,0]=3 12684 B12R2.132 Fc1ccc2CCC(Br)c2c1 Amb20623851 [0,1,0,1,0,0|1,0,0]=3 12685 B12R2.132 Fc1ccc2CCC(F)c2c1 Amb24514102 [0,1,0,1,0,0|1,0,0]=3 12686 B12R2.132 Fc1ccc2c(c1)C(=O)CC2 Amb2383531 [0,1,0,1,0,0|0,0,2]=4 12687 B12R2.132 Fc1ccc2c(c1)C(Cl)CC2 Amb17087975 [0,1,0,1,0,0|1,0,0]=3 12688 B12R2.132 Fc1ccc2c(c1)C(N)CC2 Amb2383224 [0,1,0,1,0,0|1,0,0]=3 12689 B12R2.132 Fc1ccc2c(c1)C(N)CO2 Amb2383234 [0,1,0,1,0,0|2,0,0]=4 12690 B12R2.132 Fc1ccc2c(c1)C(O)CC2 Amb17087925 [0,1,0,1,0,0|0,0,0]=2 12691 B12R2.132 Fc1ccc2c(c1)[C@H](N)CC2 Amb16233798 [0,1,0,1,0,0|1,0,0]=3 12692 B12R2.132 Ic1ccc2c(c1)C(=O)CC2 Amb10603865 [0,1,0,1,0,0|0,0,2]=4 12693 B12R2.132 NC1CCc2[n]cc(O)cc21 Amb24660724 [0,1,0,1,0,0|2,0,0]=4 12694 B12R2.132 NC1CCc2ccc(Br)cc21 Amb22277084 [0,1,0,1,0,0|1,0,0]=3 12695 B12R2.132 NC1CCc2ccc(Cl)cc21 Amb21964442 [0,1,0,1,0,0|1,0,0]=3 12696 B12R2.132 NC1CCc2ccc(F)cc21 Amb19373327 [0,1,0,1,0,0|1,0,0]=3 12697 B12R2.132 NC1CCc2ccc(O)cc21 Amb20241032 [0,1,0,1,0,0|1,0,0]=3 12698 B12R2.132 NC1CCc2ccc(S)cc21 Amb24485773 [0,1,0,1,0,0|1,0,0]=3 12699 B12R2.132 NC1CNc2ccc(Cl)cc21 Amb25239513 [0,1,0,1,0,0|2,0,0]=4 12700 B12R2.132 NC1COc2ccc(Br)cc21 Amb22751415 [0,1,0,1,0,0|2,0,0]=4 12701 B12R2.132 NC1COc2ccc(Cl)cc21 Amb20626373 [0,1,0,1,0,0|2,0,0]=4 12702 B12R2.132 NC1COc2ccc(O)cc21 Amb25843807 [0,1,0,1,0,0|2,0,0]=4 12703 B12R2.132 NN1CCc2ccc(F)cc12 Amb18125382 [0,1,0,1,0,0|2,0,0]=4 12704 B12R2.132 N[C@@H]1CCc2ccc(Br)cc21 Amb22899040 [0,1,0,1,0,0|1,0,0]=3 12705 B12R2.132 N[C@@H]1CCc2ccc(Cl)cc21 Amb24523004 [0,1,0,1,0,0|1,0,0]=3 12706 B12R2.132 N[C@@H]1CCc2ccc(F)cc21 Amb22388617 [0,1,0,1,0,0|1,0,0]=3 12707 B12R2.132 N[C@@H]1CCc2ccc(I)cc21 Amb24653732 [0,1,0,1,0,0|1,0,0]=3 12708 B12R2.132 N[C@@H]1COc2ccc(Br)cc21 Amb24756687 [0,1,0,1,0,0|2,0,0]=4 12709 B12R2.132 N[C@@H]1COc2ccc(Cl)cc21 Amb25760690 [0,1,0,1,0,0|2,0,0]=4 12710 B12R2.132 N[C@@H]1COc2ccc(S)cc21 Amb24560332 [0,1,0,1,0,0|2,0,0]=4 12711 B12R2.132 N[C@H]1CCc2ccc(Cl)cc21 Amb24648664 [0,1,0,1,0,0|1,0,0]=3 12712 B12R2.132 N[C@H]1CCc2ccc(F)cc21 Amb22288710 [0,1,0,1,0,0|1,0,0]=3 12713 B12R2.132 N[C@H]1CCc2ccc(O)cc21 Amb19929575 [0,1,0,1,0,0|1,0,0]=3 12714 B12R2.132 N[C@H]1COc2ccc(Cl)cc21 Amb25335375 [0,1,0,1,0,0|2,0,0]=4 12715 B12R2.132 N[C@H]1COc2ccc(I)cc21 Amb24386301 [0,1,0,1,0,0|2,0,0]=4 12716 B12R2.132 N[C@H]1COc2ccc(O)cc21 Amb25829417 [0,1,0,1,0,0|2,0,0]=4 12717 B12R2.132 N[C@H]1COc2ccc(S)cc21 Amb25111596 [0,1,0,1,0,0|2,0,0]=4 12718 B12R2.132 Nc1cc2B(O)OCc2cc1 Amb21963523 [0,1,0,1,0,0|2,0,0]=4 12719 B12R2.132 Nc1ccc2CCC(O)c2c1 Amb22490266 [0,1,0,1,0,0|0,0,0]=2 12720 B12R2.132 Nc1ccc2CCS(=O)c2c1 Amb24358626 [0,1,0,1,0,0|1,0,1]=4 12721 B12R2.132 Nc1ccc2CC[C@@H](N)c2c1 Amb19889681 [0,1,0,1,0,0|1,0,0]=3 12722 B12R2.132 Nc1ccc2CC[C@H](N)c2c1 Amb19889682 [0,1,0,1,0,0|1,0,0]=3 12723 B12R2.132 Nc1ccc2CC[C@H](O)c2c1 Amb24363627 [0,1,0,1,0,0|0,0,0]=2 12724 B12R2.132 Nc1ccc2OC[C@@H](N)c2c1 Amb25073245 [0,1,0,1,0,0|2,0,0]=4 12725 B12R2.132 Nc1ccc2OC[C@H](N)c2c1 Amb25136105 [0,1,0,1,0,0|2,0,0]=4 12726 B12R2.132 Nc1ccc2c(c1)B(O)OC2 Amb10068944 [0,1,0,1,0,0|2,0,0]=4 12727 B12R2.132 Nc1ccc2c(c1)C(=O)CC2 Amb10067747 [0,1,0,1,0,0|0,0,2]=4 12728 B12R2.132 OB1OCc2ccc(Br)cc21 Amb24672400 [0,1,0,1,0,0|2,0,0]=4 12729 B12R2.132 OB1OCc2ccc(Cl)cc21 Amb25330321 [0,1,0,1,0,0|2,0,0]=4 12730 B12R2.132 OB1OCc2ccc(F)cc21 Amb22497413 [0,1,0,1,0,0|2,0,0]=4 12731 B12R2.132 OC1CCc2ccc(Br)cc12 Amb17779324 [0,1,0,1,0,0|0,0,0]=2 12732 B12R2.132 OC1CCc2ccc(I)cc21 Amb25119131 [0,1,0,1,0,0|0,0,0]=2 12733 B12R2.132 OC1CNc2ccc(Br)cc21 Amb25352190 [0,1,0,1,0,0|1,0,0]=3 12734 B12R2.132 OC1COc2ccc(Br)cc21 Amb22059757 [0,1,0,1,0,0|1,0,0]=3 12735 B12R2.132 OC1COc2ccc(Cl)cc21 Amb24104573 [0,1,0,1,0,0|1,0,0]=3 12736 B12R2.132 OC1COc2ccc(F)cc21 Amb22739671 [0,1,0,1,0,0|1,0,0]=3 12737 B12R2.132 OC1OCc2ccc(Br)cc21 Amb22751581 [0,1,0,1,0,0|1,0,0]=3 12738 B12R2.132 O[C@@H]1CCc2ccc(Br)cc21 Amb25147882 [0,1,0,1,0,0|0,0,0]=2 12739 B12R2.132 O[C@H]1CCc2ccc(Br)cc21 Amb25149044 [0,1,0,1,0,0|0,0,0]=2 12740 B12R2.132 O[C@H]1CCc2ccc(Cl)[n]c21 Amb25152676 [0,1,0,1,0,0|1,0,0]=3 12741 B12R2.132 O[C@H]1CCc2ccc(Cl)cc21 Amb25169483 [0,1,0,1,0,0|0,0,0]=2 12742 B12R2.132 O[C@H]1CCc2ccc(I)cc21 Amb25084197 [0,1,0,1,0,0|0,0,0]=2 12743 B12R2.132 Oc1ccc2CCC(O)c2c1 Amb25209331 [0,1,0,1,0,0|0,0,0]=2 12744 B12R2.132 Oc1ccc2COB(O)c2c1 Amb21964578 [0,1,0,1,0,0|2,0,0]=4 12745 B12R2.132 Oc1ccc2OC[C@H](O)c2c1 Amb24408412 [0,1,0,1,0,0|1,0,0]=3 12746 B12R2.132 Oc1ccc2c(c1)[C@H](N)CC2 Amb10608774 [0,1,0,1,0,0|1,0,0]=3 12747 B12R2.132 SC1CCc2ccc(Br)cc21 Amb25150782 [0,1,0,1,0,0|0,1,0]=3 12748 B12R2.294 Brc1ccc(cc1)OC2CC2 Amb22227906 [0,1,0,1,0,0|2,0,0]=4 12749 B12R2.294 Cc1ccc(CC2CO2)c[n]1 Amb25139245 [0,1,0,1,0,0|1,0,0]=3 12750 B12R2.294 Cc1ccc(cc1)NC2CC2 Amb24623216 [0,1,0,1,0,0|2,0,0]=4 12751 B12R2.294 Clc1ccc(CC2CC2)c[n]1 Amb25076931 [0,1,0,1,0,0|2,0,0]=4 12752 B12R2.294 Clc1ccc(CC2CC2)cc1 Amb22751349 [0,1,0,1,0,0|1,0,0]=3 12753 B12R2.294 Clc1ccc(CC2CO2)cc1 Amb24712110 [0,1,0,1,0,0|0,0,0]=2 12754 B12R2.294 Clc1ccc(cc1)NC2CC2 Amb18267475 [0,1,0,1,0,0|2,0,0]=4 12755 B12R2.294 Clc1ccc(cc1)OC2CC2 Amb24406546 [0,1,0,1,0,0|2,0,0]=4 12756 B12R2.294 Fc1ccc(CC2CO2)cc1 Amb24390098 [0,1,0,1,0,0|0,0,0]=2 12757 B12R2.294 Fc1ccc(cc1)NC2CC2 Amb18267946 [0,1,0,1,0,0|2,0,0]=4 12758 B12R2.294 Fc1ccc(cc1)OC2CC2 Amb25829442 [0,1,0,1,0,0|2,0,0]=4 12759 B12R2.294 Fc1ccc(cc1)SC2CC2 Amb24591737 [0,1,0,1,0,0|2,0,0]=4 12760 B12R2.294 Nc1ccc(cc1)OC2CC2 Amb22011836 [0,1,0,1,0,0|2,0,0]=4 12761 B12R2.294 O=C1C=CN(CC2CC2)C=C1 Amb25302664 [0,1,0,1,0,0|2,0,0]=4 12762 B12R2.294 O=C1C=CN(CC2CO2)C=C1 Amb18787427 [0,1,0,1,0,0|1,0,0]=3 12763 B12R2.294 O=C1C=CN(C[C@H]2CO2)C=C1 Amb25284678 [0,1,0,1,0,0|1,0,0]=3 12764 B12R2.294 Oc1ccc(CC2CO2)cc1 Amb25338853 [0,1,0,1,0,0|0,0,0]=2 12765 B12R2.294 Oc1ccc(cc1)OC2CC2 Amb24738590 [0,1,0,1,0,0|2,0,0]=4 12766 B12R2.294 Oc1ccc(cc1)SC2CC2 Amb24487005 [0,1,0,1,0,0|2,0,0]=4 12767 B12R2.294 Sc1ccc(cc1)OC2CC2 Amb24484395 [0,1,0,1,0,0|2,0,0]=4 12768 B12R2.1175 C=C1C=CC2(C=C1)OCCO2 Amb25151338 [0,1,0,1,0,0|1,0,1]=4 12769 B12R2.1175 O=C1C=CC2(C=C1)OCCO2 Amb24060705 [0,1,0,1,0,0|1,0,1]=4 12770 B12R2.1728 CO[C@@H]1Cc2ccc(Br)cc21 Amb24363643 [0,1,0,1,0,0|2,0,0]=4 12771 B12R2.1728 CO[C@H]1Cc2ccc(Br)cc21 Amb24733147 [0,1,0,1,0,0|2,0,0]=4 12772 B12R2.1728 N#CC1Cc2ccc(Cl)cc21 Amb24627225 [0,1,0,1,0,0|1,0,1]=4 12773 B12R2.1728 N#CC1Cc2ccc(O)cc21 Amb25169268 [0,1,0,1,0,0|1,0,1]=4 12774 B12R2.1728 NCC1Cc2ccc(O)cc21 Amb25324245 [0,1,0,1,0,0|1,0,0]=3 12775 B12R2.2302 Brc1ccc([n]c1)C2CCN2 Amb25281396 [0,1,0,1,0,0|2,0,0]=4 12776 B12R2.2302 Brc1ccc(c[n]1)[C@@H]2CCN2 Amb25222622 [0,1,0,1,0,0|2,0,0]=4 12777 B12R2.2302 Brc1ccc(cc1)C2CCC2 Amb20617091 [0,1,0,1,0,0|1,0,0]=3 12778 B12R2.2302 Brc1ccc(cc1)C2CCO2 Amb24414336 [0,1,0,1,0,0|0,0,0]=2 12779 B12R2.2302 Brc1ccc(cc1)C2CNC2 Amb18066312 [0,1,0,1,0,0|2,0,0]=4 12780 B12R2.2302 Brc1ccc(cc1)C2COC2 Amb22737350 [0,1,0,1,0,0|2,0,0]=4 12781 B12R2.2302 Brc1ccc(cn1)C2CCC2 Amb10600539 [0,1,0,1,0,0|2,0,0]=4 12782 B12R2.2302 Brc1ccc(nc1)C2CCC2 Amb10600813 [0,1,0,1,0,0|2,0,0]=4 12783 B12R2.2302 Cc1ccc([n]c1)[C@H]2CCN2 Amb25145691 [0,1,0,1,0,0|2,0,0]=4 12784 B12R2.2302 Cc1ccc(cc1)C2CCC2 Amb25381443 [0,1,0,1,0,0|1,0,0]=3 12785 B12R2.2302 Cc1ccc(cc1)C2CNC2 Amb18065276 [0,1,0,1,0,0|2,0,0]=4 12786 B12R2.2302 Cc1ccc(cc1)C=2CCC2 Amb24672557 [0,1,0,1,0,0|1,0,1]=4 12787 B12R2.2302 Clc1ccc([n]c1)C2CCC2 Amb24083244 [0,1,0,1,0,0|2,0,0]=4 12788 B12R2.2302 Clc1ccc([n]c1)[C@@H]2CCN2 Amb24372993 [0,1,0,1,0,0|2,0,0]=4 12789 B12R2.2302 Clc1ccc(c[n]1)[C@H]2CCN2 Amb25128036 [0,1,0,1,0,0|2,0,0]=4 12790 B12R2.2302 Clc1ccc(cc1)C2CCC2 Amb24713440 [0,1,0,1,0,0|1,0,0]=3 12791 B12R2.2302 Clc1ccc(cc1)C2CCN2 Amb19370175 [0,1,0,1,0,0|1,0,0]=3 12792 B12R2.2302 Clc1ccc(cc1)C2CCN2 Amb22059427 [0,1,0,1,0,0|1,0,0]=3 12793 B12R2.2302 Clc1ccc(cc1)C2CCO2 Amb24369540 [0,1,0,1,0,0|0,0,0]=2 12794 B12R2.2302 Clc1ccc(cc1)C2CCS2 Amb24640005 [0,1,0,1,0,0|0,1,0]=3 12795 B12R2.2302 Clc1ccc(cc1)C2CNC2 Amb18563827 [0,1,0,1,0,0|2,0,0]=4 12796 B12R2.2302 Clc1ccc(cc1)[C@@H]2CCN2 Amb24585046 [0,1,0,1,0,0|1,0,0]=3 12797 B12R2.2302 Fc1ccc([n]c1)[C@@H]2CCN2 Amb24460260 [0,1,0,1,0,0|2,0,0]=4 12798 B12R2.2302 Fc1ccc([n]c1)[C@H]2CCN2 Amb25301987 [0,1,0,1,0,0|2,0,0]=4 12799 B12R2.2302 Fc1ccc(c[n]1)C2CCN2 Amb25721330 [0,1,0,1,0,0|2,0,0]=4 12800 B12R2.2302 Fc1ccc(c[n]1)[C@H]2CCN2 Amb25849271 [0,1,0,1,0,0|2,0,0]=4 12801 B12R2.2302 Fc1ccc(cc1)C2CNC2 Amb18065351 [0,1,0,1,0,0|2,0,0]=4 12802 B12R2.2302 Fc1ccc(cc1)C2CNC2 Amb20669054 [0,1,0,1,0,0|2,0,0]=4 12803 B12R2.2302 Fc1ccc(cc1)C2COC2 Amb22738672 [0,1,0,1,0,0|2,0,0]=4 12804 B12R2.2302 Fc1ccc(cc1)[C@H]2CCN2 Amb25757757 [0,1,0,1,0,0|1,0,0]=3 12805 B12R2.2302 Ic1ccc(c[n]1)C2CCN2 Amb25696096 [0,1,0,1,0,0|2,0,0]=4 12806 B12R2.2302 Ic1ccc(c[n]1)[C@@H]2CCN2 Amb24680001 [0,1,0,1,0,0|2,0,0]=4 12807 B12R2.2302 Ic1ccc(c[n]1)[C@H]2CCN2 Amb25723435 [0,1,0,1,0,0|2,0,0]=4 12808 B12R2.2302 Ic1ccc(cc1)[C@@H]2CCN2 Amb24417322 [0,1,0,1,0,0|1,0,0]=3 12809 B12R2.2302 Nc1ccc([n]c1)C2CCN2 Amb25068406 [0,1,0,1,0,0|2,0,0]=4 12810 B12R2.2302 Nc1ccc(c[n]1)C2CCN2 Amb25680136 [0,1,0,1,0,0|2,0,0]=4 12811 B12R2.2302 Nc1ccc(c[n]1)[C@H]2CCN2 Amb25152746 [0,1,0,1,0,0|2,0,0]=4 12812 B12R2.2302 Nc1ccc(cc1)C2CCC2 Amb20617092 [0,1,0,1,0,0|1,0,0]=3 12813 B12R2.2302 Nc1ccc(cc1)C2CCN2 Amb25843764 [0,1,0,1,0,0|1,0,0]=3 12814 B12R2.2302 Nc1ccc(cc1)C2CCO2 Amb25705796 [0,1,0,1,0,0|0,0,0]=2 12815 B12R2.2302 Nc1ccc(cc1)C2CNC2 Amb25736438 [0,1,0,1,0,0|2,0,0]=4 12816 B12R2.2302 Nc1ccc(cc1)C2COC2 Amb22388448 [0,1,0,1,0,0|2,0,0]=4 12817 B12R2.2302 Nc1ccc(cc1)N2CCC2 Amb22387333 [0,1,0,1,0,0|2,0,0]=4 12818 B12R2.2302 Nc1ccc(cc1)[C@H]2CCN2 Amb24583496 [0,1,0,1,0,0|1,0,0]=3 12819 B12R2.2302 Nc1ccc(cn1)C2CCC2 Amb10600540 [0,1,0,1,0,0|2,0,0]=4 12820 B12R2.2302 Nc1ccc(nc1)C2CCC2 Amb10600814 [0,1,0,1,0,0|2,0,0]=4 12821 B12R2.2302 Oc1ccc(c[n]1)C2CCN2 Amb25680099 [0,1,0,1,0,0|2,0,0]=4 12822 B12R2.2302 Oc1ccc(c[n]1)[C@@H]2CCN2 Amb25698304 [0,1,0,1,0,0|2,0,0]=4 12823 B12R2.2302 Oc1ccc(c[n]1)[C@H]2CCN2 Amb24351653 [0,1,0,1,0,0|2,0,0]=4 12824 B12R2.2302 Oc1ccc(cc1)C2CCC2 Amb20617093 [0,1,0,1,0,0|1,0,0]=3 12825 B12R2.2302 Oc1ccc(cc1)C2CCN2 Amb24533045 [0,1,0,1,0,0|1,0,0]=3 12826 B12R2.2302 Oc1ccc(cc1)N2CCC2 Amb24579625 [0,1,0,1,0,0|2,0,0]=4 12827 B12R2.2302 Oc1ccc(cc1)[C@H]2CCN2 Amb25762318 [0,1,0,1,0,0|1,0,0]=3 12828 B12R2.2302 Oc1ccc(cn1)C2CCC2 Amb10600541 [0,1,0,1,0,0|2,0,0]=4 12829 B12R2.2302 Oc1ccc(nc1)C2CCC2 Amb10600815 [0,1,0,1,0,0|2,0,0]=4 12830 B12R2.2302 Sc1ccc(cc1)C2CCN2 Amb24484464 [0,1,0,1,0,0|1,0,0]=3 12831 B12R2.2 C1=NC(CC1)c2cccnc2 Amb17616205 [0,1,0,1,0,0|2,0,0]=4 12832 B12R2.2 C1C=CC(N1)c2ccccc2 Amb25087257 [0,1,0,1,0,0|1,0,1]=4 12833 B12R2.2 C1C=COC1c2ccccc2 Amb24081226 [0,1,0,1,0,0|0,0,1]=3 12834 B12R2.2 C1C=NC(N1)c2ccccc2 Amb25145901 [0,1,0,1,0,0|1,0,1]=4 12835 B12R2.2 C1C=NC(S1)c2ccccc2 Amb25375170 [0,1,0,1,0,0|0,1,1]=4 12836 B12R2.2 C1C=NOC1c2cccc[n]2 Amb24100585 [0,1,0,1,0,0|1,0,1]=4 12837 B12R2.2 C1CC(ON1)c2cc[n]cc2 Amb24102629 [0,1,0,1,0,0|1,0,0]=3 12838 B12R2.2 C1CC=C(N1)c2ccccc2 Amb17938860 [0,1,0,1,0,0|1,0,1]=4 12839 B12R2.2 C1CCC(N1)c2c[n]ccc2 Amb17659140 [0,1,0,1,0,0|2,0,0]=4 12840 B12R2.2 C1CCC(N1)c2c[n]ccc2 Amb22899128 [0,1,0,1,0,0|2,0,0]=4 12841 B12R2.2 C1CCC(N1)c2cc[n]cc2 Amb17659139 [0,1,0,1,0,0|2,0,0]=4 12842 B12R2.2 C1CCC(N1)c2cccc[n]2 Amb21960411 [0,1,0,1,0,0|2,0,0]=4 12843 B12R2.2 C1CCC(O1)c2cccc[n]2 Amb24729132 [0,1,0,1,0,0|1,0,0]=3 12844 B12R2.2 C1CCC(S1)c2c[n]ccc2 Amb19373816 [0,1,0,1,0,0|1,1,0]=4 12845 B12R2.2 C1CCC(S1)c2cc[n]cc2 Amb19373819 [0,1,0,1,0,0|1,1,0]=4 12846 B12R2.2 C1CCC(S1)c2ccccc2 Amb25801021 [0,1,0,1,0,0|0,1,0]=3 12847 B12R2.2 C1CCC=C1c2c[n]ccc2 Amb25357774 [0,1,0,1,0,0|2,0,0]=4 12848 B12R2.2 C1CCC=C1c2cccc[n]2 Amb24563508 [0,1,0,1,0,0|2,0,0]=4 12849 B12R2.2 C1CCCB1c2ccccc2 Amb25240096 [0,1,0,1,0,0|1,0,0]=3 12850 B12R2.2 C1CCCC1c2c[n]ccc2 Amb25121665 [0,1,0,1,0,0|2,0,0]=4 12851 B12R2.2 C1CCCC1c2cc[n]cc2 Amb25808119 [0,1,0,1,0,0|2,0,0]=4 12852 B12R2.2 C1CCCC1c2cccc[n]2 Amb23589711 [0,1,0,1,0,0|2,0,0]=4 12853 B12R2.2 C1CCCN1c2cccc[n]2 Amb18269671 [0,1,0,1,0,0|2,0,0]=4 12854 B12R2.2 C1CCN(O1)c2[n]ccc[n]2 Amb24751819 [0,1,0,1,0,0|2,0,0]=4 12855 B12R2.2 C1CCN=C1c2c[n]ccc2 Amb21917062 [0,1,0,1,0,0|2,0,0]=4 12856 B12R2.2 C1CC[C@@H](N1)c2c[n]ccc2 Amb22748224 [0,1,0,1,0,0|2,0,0]=4 12857 B12R2.2 C1CC[C@@H](N1)c2c[n]ccc2 Amb22899133 [0,1,0,1,0,0|2,0,0]=4 12858 B12R2.2 C1CC[C@@H](N1)c2cccc[n]2 Amb22747201 [0,1,0,1,0,0|2,0,0]=4 12859 B12R2.2 C1CC[C@@H](N1)c2cccc[n]2 Amb22754028 [0,1,0,1,0,0|2,0,0]=4 12860 B12R2.2 C1CC[C@@H](N1)c2cccc[n]2 Amb22754034 [0,1,0,1,0,0|2,0,0]=4 12861 B12R2.2 C1CC[C@@H](N1)c2ccccc2 Amb20241932 [0,1,0,1,0,0|1,0,0]=3 12862 B12R2.2 C1CC[C@H](N1)c2cccc[n]2 Amb22802416 [0,1,0,1,0,0|2,0,0]=4 12863 B12R2.2 C1CC[C@H](N1)c2ccccc2 Amb20241933 [0,1,0,1,0,0|1,0,0]=3 12864 B12R2.2 C1CC[S+](C1)c2ccccc2 Amb10576181 [0,1,0,1,0,0|1,0,0]=3 12865 B12R2.2 C1CC[S+](C1)c2ccccc2 Amb2447150 [0,1,0,1,0,0|1,0,0]=3 12866 B12R2.2 C1CN(C=N1)c2ccccc2 Amb22527125 [0,1,0,1,0,0|2,0,0]=4 12867 B12R2.2 C1CNC(C1)c2ccccc2 Amb10808365 [0,1,0,1,0,0|1,0,0]=3 12868 B12R2.2 C1CNC(C1)c2ccccc2 Amb1106311 [0,1,0,1,0,0|1,0,0]=3 12869 B12R2.2 C1CNC(C1)c2ccccn2 Amb2235736 [0,1,0,1,0,0|2,0,0]=4 12870 B12R2.2 C1CNC(C1)c2cccnc2 Amb10067968 [0,1,0,1,0,0|2,0,0]=4 12871 B12R2.2 C1CNC(C1)c2cccnc2 Amb2234638 [0,1,0,1,0,0|2,0,0]=4 12872 B12R2.2 C1CNC(C1)c2ccncc2 Amb1162826 [0,1,0,1,0,0|2,0,0]=4 12873 B12R2.2 C1CNC(C1)c2ccncc2 Amb2234645 [0,1,0,1,0,0|2,0,0]=4 12874 B12R2.2 C1CNN=C1c2ccccc2 Amb25354740 [0,1,0,1,0,0|1,0,1]=4 12875 B12R2.2 C1COB(O1)c2c[n]ccc2 Amb25103771 [0,1,0,1,0,0|2,0,0]=4 12876 B12R2.2 C1COB(O1)c2cccc[n]2 Amb22490930 [0,1,0,1,0,0|2,0,0]=4 12877 B12R2.2 C1COC(=C1)c2cccc[n]2 Amb25358340 [0,1,0,1,0,0|1,0,1]=4 12878 B12R2.2 C1COC(=N1)c2cccc[n]2 Amb24100586 [0,1,0,1,0,0|1,0,1]=4 12879 B12R2.2 C1COC(=N1)c2ccccc2 Amb18063911 [0,1,0,1,0,0|0,0,1]=3 12880 B12R2.2 C1COC(C1)c2ccccc2 Amb17334283 [0,1,0,1,0,0|0,0,0]=2 12881 B12R2.2 C1COC(N1)c2ccccc2 Amb17334284 [0,1,0,1,0,0|0,0,0]=2 12882 B12R2.2 C1COC(N1)c2ccccn2 Amb17334298 [0,1,0,1,0,0|1,0,0]=3 12883 B12R2.2 C1COC(N1)c2cccnc2 Amb17334299 [0,1,0,1,0,0|1,0,0]=3 12884 B12R2.2 C1COC(N1)c2ccncc2 Amb17334300 [0,1,0,1,0,0|1,0,0]=3 12885 B12R2.2 C1COC(O1)c2c[n]c[n]c2 Amb25710715 [0,1,0,1,0,0|2,0,0]=4 12886 B12R2.2 C1COC(O1)c2ccccn2 Amb17334307 [0,1,0,1,0,0|1,0,0]=3 12887 B12R2.2 C1COC(O1)c2cccnc2 Amb17334308 [0,1,0,1,0,0|1,0,0]=3 12888 B12R2.2 C1COC(O1)c2ccncc2 Amb17334309 [0,1,0,1,0,0|1,0,0]=3 12889 B12R2.2 C1CSC(N1)c2cccc[n]2 Amb18792844 [0,1,0,1,0,0|1,1,0]=4 12890 B12R2.2 C1CSC(S1)c2ccccc2 Amb23401446 [0,1,0,1,0,0|0,1,0]=3 12891 B12R2.2 C1NC(CO1)c2ccccc2 Amb25258799 [0,1,0,1,0,0|1,0,0]=3 12892 B12R2.2 C1NC(CS1)c2ccccc2 Amb24460745 [0,1,0,1,0,0|1,0,0]=3 12893 B12R2.2 C1NCC(C1)c2ccccc2 Amb10069263 [0,1,0,1,0,0|1,0,0]=3 12894 B12R2.2 C1NCC(C1)c2ccccc2 Amb10072809 [0,1,0,1,0,0|1,0,0]=3 12895 B12R2.2 C1NCC(C1)c2ccccn2 Amb10808435 [0,1,0,1,0,0|2,0,0]=4 12896 B12R2.2 C1NCC(C1)c2ccncc2 Amb10576618 [0,1,0,1,0,0|2,0,0]=4 12897 B12R2.2 C1NCC(O1)c2c[n]ccc2 Amb18065317 [0,1,0,1,0,0|1,0,0]=3 12898 B12R2.2 C1NCC(O1)c2cc[n]cc2 Amb18065319 [0,1,0,1,0,0|1,0,0]=3 12899 B12R2.2 C1NCC(O1)c2cccc[n]2 Amb18065316 [0,1,0,1,0,0|1,0,0]=3 12900 B12R2.2 C1NCC(O1)c2ccccc2 Amb18065307 [0,1,0,1,0,0|0,0,0]=2 12901 B12R2.2 C1NCC=C1c2ccccc2 Amb22059494 [0,1,0,1,0,0|1,0,1]=4 12902 B12R2.2 C1NCCC1c2c[n]ccc2 Amb19958035 [0,1,0,1,0,0|2,0,0]=4 12903 B12R2.2 C1NCCC1c2c[n]ccc2 Amb22490712 [0,1,0,1,0,0|2,0,0]=4 12904 B12R2.2 C1NCCC1c2cc[n]cc2 Amb22233781 [0,1,0,1,0,0|2,0,0]=4 12905 B12R2.2 C1NCC[C@@H]1c2c[n]ccc2 Amb24673743 [0,1,0,1,0,0|2,0,0]=4 12906 B12R2.2 C1NCC[C@@H]1c2cc[n]cc2 Amb24487080 [0,1,0,1,0,0|2,0,0]=4 12907 B12R2.2 C1NCC[C@@H]1c2ccccc2 Amb19887561 [0,1,0,1,0,0|1,0,0]=3 12908 B12R2.2 C1NCC[C@@H]1c2ccccc2 Amb24183516 [0,1,0,1,0,0|1,0,0]=3 12909 B12R2.2 C1NCC[C@H]1c2c[n]ccc2 Amb24085651 [0,1,0,1,0,0|2,0,0]=4 12910 B12R2.2 C1NCC[C@H]1c2cc[n]cc2 Amb25716776 [0,1,0,1,0,0|2,0,0]=4 12911 B12R2.2 C1NCC[C@H]1c2ccccc2 Amb19888399 [0,1,0,1,0,0|1,0,0]=3 12912 B12R2.2 C1OC=NC1c2ccccc2 Amb20247138 [0,1,0,1,0,0|1,0,1]=4 12913 B12R2.2 C1OCCC1c2c[n]ccc2 Amb24320767 [0,1,0,1,0,0|1,0,0]=3 12914 B12R2.2 C1OCCC1c2cc[n]cc2 Amb24320766 [0,1,0,1,0,0|1,0,0]=3 12915 B12R2.2 C1OCCC1c2cccc[n]2 Amb24320768 [0,1,0,1,0,0|1,0,0]=3 12916 B12R2.2 C1OCCC1c2ccccc2 Amb21960825 [0,1,0,1,0,0|0,0,0]=2 12917 B12R2.2 C1OCOC1c2cc[n]cc2 Amb24102637 [0,1,0,1,0,0|1,0,0]=3 12918 B12R2.2 C1OCOC1c2cccc[n]2 Amb24069912 [0,1,0,1,0,0|1,0,0]=3 12919 B12R2.2 C1OCOC1c2ccccc2 Amb24101078 [0,1,0,1,0,0|0,0,0]=2 12920 B12R2.2 N1=CN(CC1)c2ccccc2 Amb16226120 [0,1,0,1,0,0|2,0,0]=4 12921 B12R2.2 c1ccc(cc1)C2=NCCC2 Amb1106418 [0,1,0,1,0,0|1,0,0]=3 12922 B12R2.2 c1ccc(cc1)C2=NCCS2 Amb10572887 [0,1,0,1,0,0|0,1,1]=4 12923 B12R2.2 c1ccc(cn1)C2=NCCO2 Amb10813641 [0,1,0,1,0,0|1,0,1]=4 12924 B12R2.2 c1ccc(nc1)C2=NCCC2 Amb10606648 [0,1,0,1,0,0|2,0,0]=4 12925 B12R2.2 c1ccccc1C2NC=CO2 Amb20621985 [0,1,0,1,0,0|0,0,2]=4 12926 B12R2.2 n1ccc(cc1)C2=NCCC2 Amb10605642 [0,1,0,1,0,0|2,0,0]=4 12927 B12R2.22 BrC1CC(=C1)c2ccccc2 Amb24669104 [0,1,0,1,0,0|1,0,1]=4 12928 B12R2.22 Br[C@@H]1C[C@H](C1)c2ccccc2 Amb25119213 [0,1,0,1,0,0|1,0,0]=3 12929 B12R2.22 NC1CC(C1)c2ccc[n]c2 Amb24178936 [0,1,0,1,0,0|2,0,0]=4 12930 B12R2.22 NC1CC(C1)c2ccc[n]c2 Amb25313817 [0,1,0,1,0,0|2,0,0]=4 12931 B12R2.22 NC1CC(C1)c2ccccc2 Amb19514746 [0,1,0,1,0,0|1,0,0]=3 12932 B12R2.22 NC1CN(C1)c2ccccc2 Amb23598844 [0,1,0,1,0,0|2,0,0]=4 12933 B12R2.22 N[C@@H]1C[C@@H](C1)c2ccc[n]c2 Amb24178917 [0,1,0,1,0,0|2,0,0]=4 12934 B12R2.22 N[C@@H]1C[C@@H](C1)c2ccc[n]c2 Amb24667710 [0,1,0,1,0,0|2,0,0]=4 12935 B12R2.22 N[C@@H]1C[C@@H](C1)c2cccc[n]2 Amb24410945 [0,1,0,1,0,0|2,0,0]=4 12936 B12R2.22 N[C@@H]1C[C@@H](C1)c2ccccc2 Amb23439754 [0,1,0,1,0,0|1,0,0]=3 12937 B12R2.22 N[C@@H]1C[C@H](C1)c2ccc[n]c2 Amb24178920 [0,1,0,1,0,0|2,0,0]=4 12938 B12R2.22 N[C@@H]1C[C@H](C1)c2ccccc2 Amb23439755 [0,1,0,1,0,0|1,0,0]=3 12939 B12R2.22 O=C1CC(N1)c2ccccc2 Amb1993905 [0,1,0,1,0,0|0,0,2]=4 12940 B12R2.22 O=C1C[C@@H](N1)c2ccccc2 Amb24598586 [0,1,0,1,0,0|0,0,2]=4 12941 B12R2.22 OC1CC(=C1)c2ccccc2 Amb25198298 [0,1,0,1,0,0|0,0,1]=3 12942 B12R2.22 OC1CC(C1)c2cc[n]cc2 Amb25737321 [0,1,0,1,0,0|1,0,0]=3 12943 B12R2.22 OC1CC(C1)c2ccc[n]c2 Amb25063552 [0,1,0,1,0,0|1,0,0]=3 12944 B12R2.22 OC1CC(C1)c2cccc[n]2 Amb24759509 [0,1,0,1,0,0|1,0,0]=3 12945 B12R2.22 OC1CC(C1)c2ccccc2 Amb20627950 [0,1,0,1,0,0|0,0,0]=2 12946 B12R2.22 OC1CN(C1)c2c[n]ccc2 Amb23598855 [0,1,0,1,0,0|2,0,0]=4 12947 B12R2.22 OC1CN(C1)c2cc[n]cc2 Amb23598876 [0,1,0,1,0,0|2,0,0]=4 12948 B12R2.22 OC1CN(C1)c2cccc[n]2 Amb23598856 [0,1,0,1,0,0|2,0,0]=4 12949 B12R2.22 OC1CN(C1)c2ccccc2 Amb23598700 [0,1,0,1,0,0|1,0,0]=3 12950 B12R2.22 O[C@@H]1C[C@@H](C1)c2ccc[n]c2 Amb24729402 [0,1,0,1,0,0|1,0,0]=3 12951 B12R2.22 O[C@@H]1C[C@@H](C1)c2cccc[n]2 Amb25082461 [0,1,0,1,0,0|1,0,0]=3 12952 B12R2.22 O[C@@H]1C[C@H](C1)c2ccc[n]c2 Amb25081533 [0,1,0,1,0,0|1,0,0]=3 12953 B12R2.22 O[C@@H]1C[C@H](C1)c2ccccc2 Amb25749083 [0,1,0,1,0,0|0,0,0]=2 12954 B12R2.22 SC1CC(C1)c2ccccc2 Amb24690234 [0,1,0,1,0,0|0,1,0]=3 12955 B12R2.27 BrCC1CC1c2c[n]ccc2 Amb24720135 [0,1,0,1,0,0|2,0,0]=4 12956 B12R2.27 BrCC1CC1c2ccccc2 Amb25099525 [0,1,0,1,0,0|1,0,0]=3 12957 B12R2.27 BrCC1OC1c2ccccc2 Amb25695964 [0,1,0,1,0,0|1,0,0]=3 12958 B12R2.27 BrC[C@@H]1O[C@@H]1c2ccccc2 Amb24540282 [0,1,0,1,0,0|1,0,0]=3 12959 B12R2.27 BrC[C@H]1O[C@@H]1c2ccccc2 Amb25287176 [0,1,0,1,0,0|1,0,0]=3 12960 B12R2.27 C#CC1CC1c2ccccc2 Amb22002424 [0,1,0,1,0,0|1,0,0]=3 12961 B12R2.27 C=CC1CC1c2cc[n]cc2 Amb24102778 [0,1,0,1,0,0|2,0,0]=4 12962 B12R2.27 C=CC1OC1c2ccccc2 Amb24624086 [0,1,0,1,0,0|1,0,1]=4 12963 B12R2.27 CNC1CC1c2ccccc2 Amb18957298 [0,1,0,1,0,0|1,0,0]=3 12964 B12R2.27 CNC1CC1c2ccccc2 Amb20630184 [0,1,0,1,0,0|1,0,0]=3 12965 B12R2.27 COC1OC1c2ccccc2 Amb24613179 [0,1,0,1,0,0|1,0,0]=3 12966 B12R2.27 CSC1CC1c2ccccc2 Amb25086341 [0,1,0,1,0,0|0,1,0]=3 12967 B12R2.27 ClCC1CC1c2c[n]ccc2 Amb25820771 [0,1,0,1,0,0|2,0,0]=4 12968 B12R2.27 ClCC1CC1c2cccc[n]2 Amb24340524 [0,1,0,1,0,0|2,0,0]=4 12969 B12R2.27 ClCC1OC1c2ccccc2 Amb25169273 [0,1,0,1,0,0|1,0,0]=3 12970 B12R2.27 ClC[C@H]1O[C@@H]1c2ccccc2 Amb24568308 [0,1,0,1,0,0|1,0,0]=3 12971 B12R2.27 ClC[C@H]1O[C@H]1c2ccccc2 Amb24562256 [0,1,0,1,0,0|1,0,0]=3 12972 B12R2.27 N#CC1CC1c2ccccc2 Amb17231961 [0,1,0,1,0,0|1,0,0]=3 12973 B12R2.27 N#CC1CC1c2cccnc2 Amb17231984 [0,1,0,1,0,0|2,0,0]=4 12974 B12R2.27 N#CC1OC1c2ccccc2 Amb17593640 [0,1,0,1,0,0|1,0,1]=4 12975 B12R2.27 N#C[C@@H]1C[C@H]1c2ccccc2 Amb25309014 [0,1,0,1,0,0|1,0,0]=3 12976 B12R2.27 N#C[C@H]1CC1c2ccccc2 Amb24544864 [0,1,0,1,0,0|1,0,0]=3 12977 B12R2.27 NCC1CC1c2cc[n]cc2 Amb18963616 [0,1,0,1,0,0|2,0,0]=4 12978 B12R2.27 NCC1CC1c2cccc[n]2 Amb18963618 [0,1,0,1,0,0|2,0,0]=4 12979 B12R2.27 NCC1CC1c2ccccc2 Amb17232030 [0,1,0,1,0,0|1,0,0]=3 12980 B12R2.27 NCC1CC1c2ccccc2 Amb19515036 [0,1,0,1,0,0|1,0,0]=3 12981 B12R2.27 NCC1CC1c2cccnc2 Amb17232044 [0,1,0,1,0,0|2,0,0]=4 12982 B12R2.27 NCC1OC1c2ccccc2 Amb25836323 [0,1,0,1,0,0|1,0,0]=3 12983 B12R2.27 NC[C@@H]1CC1c2ccccc2 Amb17605571 [0,1,0,1,0,0|1,0,0]=3 12984 B12R2.27 NC[C@@H]1C[C@H]1c2c[n]ccc2 Amb25168891 [0,1,0,1,0,0|2,0,0]=4 12985 B12R2.27 NC[C@@H]1C[C@H]1c2cc[n]cc2 Amb25271512 [0,1,0,1,0,0|2,0,0]=4 12986 B12R2.27 NC[C@@H]1C[C@H]1c2ccccc2 Amb24514797 [0,1,0,1,0,0|1,0,0]=3 12987 B12R2.27 NC[C@H]1C[C@@H]1c2ccccc2 Amb24606663 [0,1,0,1,0,0|1,0,0]=3 12988 B12R2.27 NNC1CC1c2ccccc2 Amb25244653 [0,1,0,1,0,0|1,0,0]=3 12989 B12R2.27 O=CC1CC1c2ccccc2 Amb10844842 [0,1,0,1,0,0|0,0,1]=3 12990 B12R2.27 O=CC1C[C@@H]1c2ccccc2 Amb24619601 [0,1,0,1,0,0|0,0,1]=3 12991 B12R2.27 O=CC1OC1c2ccccc2 Amb25737974 [0,1,0,1,0,0|0,0,2]=4 12992 B12R2.27 O=C[C@@H]1CC1c2ccccc2 Amb25128247 [0,1,0,1,0,0|0,0,1]=3 12993 B12R2.27 O=C[C@@H]1C[C@H]1c2cc[n]cc2 Amb25288457 [0,1,0,1,0,0|1,0,1]=4 12994 B12R2.27 O=C[C@@H]1C[C@H]1c2ccccc2 Amb25368620 [0,1,0,1,0,0|0,0,1]=3 12995 B12R2.27 O=C[C@H]1CC1c2ccccc2 Amb24484808 [0,1,0,1,0,0|0,0,1]=3 12996 B12R2.27 OCC1CC1c2c[n]ccc2 Amb23442765 [0,1,0,1,0,0|1,0,0]=3 12997 B12R2.27 OCC1CC1c2cc[n]cc2 Amb23536862 [0,1,0,1,0,0|1,0,0]=3 12998 B12R2.27 OCC1CC1c2cccc[n]2 Amb23536863 [0,1,0,1,0,0|1,0,0]=3 12999 B12R2.27 OCC1CC1c2ccccc2 Amb17605543 [0,1,0,1,0,0|0,0,0]=2 13000 B12R2.27 OCC1OC1c2cccc[n]2 Amb25215385 [0,1,0,1,0,0|1,0,0]=3 13001 B12R2.27 OCC1OC1c2ccccc2 Amb24063567 [0,1,0,1,0,0|0,0,0]=2 13002 B12R2.27 OC[C@@H]1C[C@@H]1c2c[n]ccc2 Amb22744875 [0,1,0,1,0,0|1,0,0]=3 13003 B12R2.27 OC[C@@H]1C[C@H]1c2c[n]ccc2 Amb25339316 [0,1,0,1,0,0|1,0,0]=3 13004 B12R2.27 OC[C@@H]1N=C1c2ccccc2 Amb25346057 [0,1,0,1,0,0|0,0,1]=3 13005 B12R2.27 OC[C@H]1C[C@@H]1c2c[n]ccc2 Amb24632610 [0,1,0,1,0,0|1,0,0]=3 13006 B12R2.27 OC[C@H]1N=C1c2ccccc2 Amb25848732 [0,1,0,1,0,0|0,0,1]=3 13007 B12R2.27 OC[C@H]1O[C@@H]1c2ccccc2 Amb20242388 [0,1,0,1,0,0|0,0,0]=2 13008 B12R2.116 CC1(CCN1)c2c[n]ccc2 Amb24436088 [0,1,0,1,0,0|2,0,0]=4 13009 B12R2.116 CC1(CCO1)c2ccccc2 Amb22497354 [0,1,0,1,0,0|0,0,0]=2 13010 B12R2.116 CC1(CNC1)c2ccccc2 Amb18065223 [0,1,0,1,0,0|2,0,0]=4 13011 B12R2.116 CC1(CNC1)c2ccccc2 Amb22549211 [0,1,0,1,0,0|2,0,0]=4 13012 B12R2.116 CC1(COC1)c2ccccc2 Amb22497353 [0,1,0,1,0,0|2,0,0]=4 13013 B12R2.116 FC1(COC1)c2ccccc2 Amb22738854 [0,1,0,1,0,0|2,0,0]=4 13014 B12R2.116 NC1(CCC1)c2c[n]ccc2 Amb22498055 [0,1,0,1,0,0|2,0,0]=4 13015 B12R2.116 NC1(CCC1)c2cc[n]cc2 Amb22500386 [0,1,0,1,0,0|2,0,0]=4 13016 B12R2.116 NC1(CCC1)c2ccccc2 Amb2371533 [0,1,0,1,0,0|1,0,0]=3 13017 B12R2.116 NC1(CNC1)c2ccccc2 Amb24120649 [0,1,0,1,0,0|2,0,0]=4 13018 B12R2.116 NC1(COC1)c2ccccc2 Amb19892665 [0,1,0,1,0,0|2,0,0]=4 13019 B12R2.116 NC1(COC1)c2ccccc2 Amb22386882 [0,1,0,1,0,0|2,0,0]=4 13020 B12R2.116 OC1(CCC1)c2c[n]ccc2 Amb25123095 [0,1,0,1,0,0|2,0,0]=4 13021 B12R2.116 OC1(CCC1)c2ccccc2 Amb20668463 [0,1,0,1,0,0|1,0,0]=3 13022 B12R2.116 OC1(CNC1)c2ccccc2 Amb22406135 [0,1,0,1,0,0|2,0,0]=4 13023 B12R2.116 OC1(CNC1)c2ccccc2 Amb22496452 [0,1,0,1,0,0|2,0,0]=4 13024 B12R2.116 OC1(COC1)c2ccccc2 Amb21960821 [0,1,0,1,0,0|2,0,0]=4 13025 B12R2.116 OC1(CSC1)c2ccccc2 Amb22386890 [0,1,0,1,0,0|2,0,0]=4 13026 B12R2.235 CC1(CC1Cl)c2ccccc2 Amb25275063 [0,1,0,1,0,0|1,0,0]=3 13027 B12R2.235 CC1(CC1N)c2c[n]ccc2 Amb18947383 [0,1,0,1,0,0|2,0,0]=4 13028 B12R2.235 CC1(CC1N)c2cc[n]cc2 Amb18280066 [0,1,0,1,0,0|2,0,0]=4 13029 B12R2.235 CC1(CC1N)c2cccc[n]2 Amb18280087 [0,1,0,1,0,0|2,0,0]=4 13030 B12R2.235 CC1(CC1N)c2ccccc2 Amb18947391 [0,1,0,1,0,0|1,0,0]=3 13031 B12R2.235 CC1(CC1N)c2ccccc2 Amb19148136 [0,1,0,1,0,0|1,0,0]=3 13032 B12R2.235 CC1CC1(N)c2c[n]ccc2 Amb25194514 [0,1,0,1,0,0|2,0,0]=4 13033 B12R2.235 CC1CC1(N)c2cccc[n]2 Amb25799468 [0,1,0,1,0,0|2,0,0]=4 13034 B12R2.235 CC1CC1(O)c2c[n]ccc2 Amb24653327 [0,1,0,1,0,0|2,0,0]=4 13035 B12R2.235 CC1CC1(O)c2cccc[n]2 Amb25149270 [0,1,0,1,0,0|2,0,0]=4 13036 B12R2.235 C[C@@H]1C[C@@]1(O)c2cccc[n]2 Amb25163570 [0,1,0,1,0,0|2,0,0]=4 13037 B12R2.235 C[C@@H]1C[C@]1(O)c2cccc[n]2 Amb25044984 [0,1,0,1,0,0|2,0,0]=4 13038 B12R2.235 C[C@@]1(C[C@@H]1Br)c2ccccc2 Amb25176508 [0,1,0,1,0,0|1,0,0]=3 13039 B12R2.235 C[C@H]1C[C@]1(O)c2cccc[n]2 Amb24515105 [0,1,0,1,0,0|2,0,0]=4 13040 B12R2.235 C[C@]1(C[C@@H]1Cl)c2ccccc2 Amb24557815 [0,1,0,1,0,0|1,0,0]=3 13041 B12R2.235 NC1(CC1F)c2ccccc2 Amb25194668 [0,1,0,1,0,0|1,0,0]=3 13042 B12R2.235 N[C@@H]1C[C@@]1(F)c2ccccc2 Amb24100224 [0,1,0,1,0,0|1,0,0]=3 13043 B12R2.235 N[C@@H]1C[C@]1(F)c2ccccc2 Amb24100239 [0,1,0,1,0,0|1,0,0]=3 13044 B12R2.235 N[C@@]1(C[C@H]1F)c2ccccc2 Amb24655079 [0,1,0,1,0,0|1,0,0]=3 13045 B12R2.235 N[C@H]1C[C@]1(F)c2ccccc2 Amb24539890 [0,1,0,1,0,0|1,0,0]=3 13046 B12R2.235 N[C@]1(C[C@@H]1F)c2ccccc2 Amb24100238 [0,1,0,1,0,0|1,0,0]=3 13047 B12R2.235 N[C@]1(C[C@H]1F)c2ccccc2 Amb24744741 [0,1,0,1,0,0|1,0,0]=3 13048 B12R2.931 CNCC1Cc2ccccc21 Amb24670284 [0,1,0,1,0,0|1,0,0]=3 13049 B12R2.931 NCCC1Cc2ccccc21 Amb24600610 [0,1,0,1,0,0|1,0,0]=3 13050 B12R2.931 NNCC1Cc2ccccc21 Amb25149107 [0,1,0,1,0,0|1,0,0]=3 13051 B12R2.931 NOCC1Cc2ccccc21 Amb24340346 [0,1,0,1,0,0|0,0,0]=2 13052 B12R2.931 O=C=NC1Cc2ccccc21 Amb25149119 [0,1,0,1,0,0|0,0,2]=4 13053 B12R2.931 O=CCC1Cc2ccccc21 Amb25808254 [0,1,0,1,0,0|0,0,1]=3 13054 B12R2.931 OCCC1=Cc2ccccc21 Amb24414369 [0,1,0,1,0,0|0,0,1]=3 13055 B12R2.1081 BrC1CCCc2c[n]ccc21 Amb23402580 [0,1,0,1,0,0|2,0,0]=4 13056 B12R2.1081 BrC1CCCc2ccc[n]c21 Amb24680202 [0,1,0,1,0,0|2,0,0]=4 13057 B12R2.1081 BrC1CCNc2ccncc12 Amb17748887 [0,1,0,1,0,0|2,0,0]=4 13058 B12R2.1081 BrC1CCOc2[n]cccc21 Amb25149325 [0,1,0,1,0,0|1,0,0]=3 13059 B12R2.1081 BrC1CCOc2ccc[n]c21 Amb24597058 [0,1,0,1,0,0|1,0,0]=3 13060 B12R2.1081 BrC1COCc2ccccc21 Amb25095651 [0,1,0,1,0,0|1,0,0]=3 13061 B12R2.1081 BrC1OCCc2ccccc21 Amb23441457 [0,1,0,1,0,0|1,0,0]=3 13062 B12R2.1081 Brc1[n]ccc2CCCCc21 Amb23439886 [0,1,0,1,0,0|2,0,0]=4 13063 B12R2.1081 Brc1[n]ccc2NCCCc21 Amb25147839 [0,1,0,1,0,0|2,0,0]=4 13064 B12R2.1081 Brc1[n]ccc2OCCNc21 Amb23400109 [0,1,0,1,0,0|2,0,0]=4 13065 B12R2.1081 Brc1c[n]cc2CCCCc21 Amb24065875 [0,1,0,1,0,0|2,0,0]=4 13066 B12R2.1081 Brc1c[n]cc2NCCOc21 Amb23403699 [0,1,0,1,0,0|2,0,0]=4 13067 B12R2.1081 Brc1cc[n]c2CCCCc21 Amb24519031 [0,1,0,1,0,0|2,0,0]=4 13068 B12R2.1081 Brc1cc[n]c2NCCOc21 Amb25070632 [0,1,0,1,0,0|2,0,0]=4 13069 B12R2.1081 Brc1cc[n]c2OCCOc21 Amb22494093 [0,1,0,1,0,0|2,0,0]=4 13070 B12R2.1081 Brc1cccc2C=CCCc21 Amb22500941 [0,1,0,1,0,0|1,0,1]=4 13071 B12R2.1081 Brc1cccc2C=CCOc21 Amb25032493 [0,1,0,1,0,0|0,0,2]=4 13072 B12R2.1081 Brc1cccc2CCCOc21 Amb18769314 [0,1,0,1,0,0|0,0,0]=2 13073 B12R2.1081 Brc1cccc2CCCSc21 Amb18161542 [0,1,0,1,0,0|0,1,0]=3 13074 B12R2.1081 Brc1cccc2CCNCc21 Amb18131355 [0,1,0,1,0,0|2,0,0]=4 13075 B12R2.1081 Brc1cccc2CCOCc21 Amb22886734 [0,1,0,1,0,0|2,0,0]=4 13076 B12R2.1081 Brc1cccc2CNCCc21 Amb22491011 [0,1,0,1,0,0|2,0,0]=4 13077 B12R2.1081 Brc1cccc2NCCNc21 Amb24647259 [0,1,0,1,0,0|2,0,0]=4 13078 B12R2.1081 Brc1cccc2NCCOc21 Amb21964594 [0,1,0,1,0,0|1,0,0]=3 13079 B12R2.1081 Brc1cccc2NCCSc21 Amb25715188 [0,1,0,1,0,0|1,1,0]=4 13080 B12R2.1081 Brc1cccc2OCCCc21 Amb24081434 [0,1,0,1,0,0|0,0,0]=2 13081 B12R2.1081 Brc1cccc2OCCOc21 Amb20171376 [0,1,0,1,0,0|1,0,0]=3 13082 B12R2.1081 Brc1cccc2SCCNc21 Amb22491567 [0,1,0,1,0,0|1,1,0]=4 13083 B12R2.1081 Brc1cccc2SCCSc21 Amb25351754 [0,1,0,1,0,0|1,1,0]=4 13084 B12R2.1081 Brc1cccc2c1CCCN2 Amb16231479 [0,1,0,1,0,0|1,0,0]=3 13085 B12R2.1081 Brc1cccc2c1CCCN2 Amb2383331 [0,1,0,1,0,0|1,0,0]=3 13086 B12R2.1081 Brc1cccc2c1CCNC2 Amb2383351 [0,1,0,1,0,0|2,0,0]=4 13087 B12R2.1081 Brc1cccc2c1CNCC2 Amb10603937 [0,1,0,1,0,0|2,0,0]=4 13088 B12R2.1081 Brc1cccc2c1NCCC2 Amb1134947 [0,1,0,1,0,0|1,0,0]=3 13089 B12R2.1081 Brc1cccc2c1NCCC2 Amb13951989 [0,1,0,1,0,0|1,0,0]=3 13090 B12R2.1081 Brc1cccc2c1OCCN2 Amb2383437 [0,1,0,1,0,0|1,0,0]=3 13091 B12R2.1081 Brc1cncc2c1CCCN2 Amb10602840 [0,1,0,1,0,0|2,0,0]=4 13092 B12R2.1081 Brc1cncc2c1NCCO2 Amb13890267 [0,1,0,1,0,0|2,0,0]=4 13093 B12R2.1081 C=C1CCCc2ccccc21 Amb25736652 [0,1,0,1,0,0|1,0,0]=3 13094 B12R2.1081 C=C1CCOc2[n]cccc21 Amb24414842 [0,1,0,1,0,0|1,0,1]=4 13095 B12R2.1081 C=C1CCOc2cc[n]cc21 Amb25047683 [0,1,0,1,0,0|1,0,1]=4 13096 B12R2.1081 C=C1CCOc2ccc[n]c21 Amb20241442 [0,1,0,1,0,0|1,0,1]=4 13097 B12R2.1081 C=C1CCSc2ccccc21 Amb25088063 [0,1,0,1,0,0|0,1,1]=4 13098 B12R2.1081 C=C1COCc2ccccc21 Amb24486797 [0,1,0,1,0,0|1,0,1]=4 13099 B12R2.1081 C=C1NCCc2ccccc21 Amb24685452 [0,1,0,1,0,0|1,0,1]=4 13100 B12R2.1081 CC1=CCCc2c1cccc2 Amb2439915 [0,1,0,1,0,0|1,0,1]=4 13101 B12R2.1081 CC1=CCOc2ccccc21 Amb25694360 [0,1,0,1,0,0|0,0,2]=4 13102 B12R2.1081 CC1=NCCc2ccccc12 Amb17940779 [0,1,0,1,0,0|1,0,1]=4 13103 B12R2.1081 CC1CCCc2ccccc21 Amb22730060 [0,1,0,1,0,0|1,0,0]=3 13104 B12R2.1081 CC1CCOc2ccc[n]c21 Amb25320654 [0,1,0,1,0,0|1,0,0]=3 13105 B12R2.1081 CC1CCSc2ccccc21 Amb24104681 [0,1,0,1,0,0|0,1,0]=3 13106 B12R2.1081 CC1CNCc2c1cccc2 Amb17399906 [0,1,0,1,0,0|1,0,0]=3 13107 B12R2.1081 CC1CNCc2ccc[n]c21 Amb18124939 [0,1,0,1,0,0|2,0,0]=4 13108 B12R2.1081 CC1CNCc2ccccc21 Amb22275944 [0,1,0,1,0,0|1,0,0]=3 13109 B12R2.1081 CC1COCc2ccccc21 Amb23580749 [0,1,0,1,0,0|1,0,0]=3 13110 B12R2.1081 CC1NCCc2[n]cccc21 Amb18124938 [0,1,0,1,0,0|2,0,0]=4 13111 B12R2.1081 CC1NCCc2[n]cccc21 Amb22899141 [0,1,0,1,0,0|2,0,0]=4 13112 B12R2.1081 CC1NCCc2ccccc21 Amb19514854 [0,1,0,1,0,0|1,0,0]=3 13113 B12R2.1081 CC1NCOc2ccccc21 Amb24637522 [0,1,0,1,0,0|1,0,0]=3 13114 B12R2.1081 CC1OCCc2ccccc21 Amb25773190 [0,1,0,1,0,0|1,0,0]=3 13115 B12R2.1081 CC1OCOc2ccccc21 Amb24070527 [0,1,0,1,0,0|1,0,0]=3 13116 B12R2.1081 CN1CCCc2c1cccc2 Amb15692645 [0,1,0,1,0,0|1,0,0]=3 13117 B12R2.1081 CN1CCCc2c[n]ccc12 Amb24089175 [0,1,0,1,0,0|2,0,0]=4 13118 B12R2.1081 CN1CCCc2ccc[n]c12 Amb24538105 [0,1,0,1,0,0|2,0,0]=4 13119 B12R2.1081 CN1CCNc2c1cccc2 Amb2383679 [0,1,0,1,0,0|2,0,0]=4 13120 B12R2.1081 CN1CCNc2ccccc12 Amb19957895 [0,1,0,1,0,0|2,0,0]=4 13121 B12R2.1081 CN1CCNc2ccccc12 Amb22490719 [0,1,0,1,0,0|2,0,0]=4 13122 B12R2.1081 CN1CCOc2c1cccc2 Amb10569245 [0,1,0,1,0,0|1,0,0]=3 13123 B12R2.1081 CN1CCSc2ccccc12 Amb25220195 [0,1,0,1,0,0|1,1,0]=4 13124 B12R2.1081 C[C@@H]1CCNc2ccccc21 Amb25281259 [0,1,0,1,0,0|1,0,0]=3 13125 B12R2.1081 C[C@@H]1CNCc2ccccc21 Amb22751935 [0,1,0,1,0,0|1,0,0]=3 13126 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22751772 [0,1,0,1,0,0|1,0,0]=3 13127 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22756655 [0,1,0,1,0,0|1,0,0]=3 13128 B12R2.1081 C[C@H]1CCNc2ccccc21 Amb24375115 [0,1,0,1,0,0|1,0,0]=3 13129 B12R2.1081 C[C@H]1CNCc2ccccc21 Amb22886463 [0,1,0,1,0,0|1,0,0]=3 13130 B12R2.1081 Cc1[n]ccc2NCCCc21 Amb25703147 [0,1,0,1,0,0|2,0,0]=4 13131 B12R2.1081 Cc1[n]ccc2OCCOc21 Amb25169463 [0,1,0,1,0,0|2,0,0]=4 13132 B12R2.1081 Cc1cc[n]c2NCCOc21 Amb25114182 [0,1,0,1,0,0|2,0,0]=4 13133 B12R2.1081 Cc1cccc2C=CCOc21 Amb23441445 [0,1,0,1,0,0|0,0,2]=4 13134 B12R2.1081 Cc1cccc2C=NCCc21 Amb25852737 [0,1,0,1,0,0|2,0,0]=4 13135 B12R2.1081 Cc1cccc2CCCCc21 Amb22731111 [0,1,0,1,0,0|1,0,0]=3 13136 B12R2.1081 Cc1cccc2CCCNc21 Amb22499779 [0,1,0,1,0,0|1,0,0]=3 13137 B12R2.1081 Cc1cccc2CCCOc21 Amb25797643 [0,1,0,1,0,0|0,0,0]=2 13138 B12R2.1081 Cc1cccc2CCN=Cc21 Amb25721127 [0,1,0,1,0,0|2,0,0]=4 13139 B12R2.1081 Cc1cccc2CCNCc21 Amb22500762 [0,1,0,1,0,0|2,0,0]=4 13140 B12R2.1081 Cc1cccc2CNCCc21 Amb19373251 [0,1,0,1,0,0|2,0,0]=4 13141 B12R2.1081 Cc1cccc2COCCc21 Amb24743009 [0,1,0,1,0,0|2,0,0]=4 13142 B12R2.1081 Cc1cccc2COCNc21 Amb25211934 [0,1,0,1,0,0|2,0,0]=4 13143 B12R2.1081 Cc1cccc2NCCCc21 Amb19957907 [0,1,0,1,0,0|1,0,0]=3 13144 B12R2.1081 Cc1cccc2NCCOc21 Amb22230187 [0,1,0,1,0,0|1,0,0]=3 13145 B12R2.1081 Cc1cccc2OCC=Cc21 Amb24484436 [0,1,0,1,0,0|0,0,2]=4 13146 B12R2.1081 Cc1cccc2OCCOc21 Amb25245087 [0,1,0,1,0,0|1,0,0]=3 13147 B12R2.1081 Cc1cccc2OCCSc21 Amb25087100 [0,1,0,1,0,0|1,0,0]=3 13148 B12R2.1081 Cc1cccc2c1CCCN2 Amb2383335 [0,1,0,1,0,0|1,0,0]=3 13149 B12R2.1081 Cc1cccc2c1CCNC2 Amb2383355 [0,1,0,1,0,0|2,0,0]=4 13150 B12R2.1081 Cc1cccc2c1CNCC2 Amb17194044 [0,1,0,1,0,0|2,0,0]=4 13151 B12R2.1081 Cc1cccc2c1NCCC2 Amb1107915 [0,1,0,1,0,0|1,0,0]=3 13152 B12R2.1081 Cc1cccc2c1OCCN2 Amb2383441 [0,1,0,1,0,0|1,0,0]=3 13153 B12R2.1081 Cc1ccnc2c1CCCN2 Amb10879387 [0,1,0,1,0,0|2,0,0]=4 13154 B12R2.1081 ClC1CCCc2[n]cccc21 Amb25152726 [0,1,0,1,0,0|2,0,0]=4 13155 B12R2.1081 ClC1CCCc2c1nccc2 Amb16234115 [0,1,0,1,0,0|2,0,0]=4 13156 B12R2.1081 ClC1CCCc2c[n]ccc21 Amb23412277 [0,1,0,1,0,0|2,0,0]=4 13157 B12R2.1081 ClC1CCCc2cc[n]cc21 Amb25053398 [0,1,0,1,0,0|2,0,0]=4 13158 B12R2.1081 ClC1CCNc2ccccc21 Amb24636938 [0,1,0,1,0,0|1,0,0]=3 13159 B12R2.1081 ClC1COCc2ccccc21 Amb22490656 [0,1,0,1,0,0|1,0,0]=3 13160 B12R2.1081 ClC1SCCc2ccccc21 Amb24634203 [0,1,0,1,0,0|1,0,0]=3 13161 B12R2.1081 ClC=1NC=CC2=NCCCC21 Amb25804833 [0,1,0,1,0,0|2,0,0]=4 13162 B12R2.1081 ClC=1NC=CC2=NCCOC21 Amb24563399 [0,1,0,1,0,0|2,0,0]=4 13163 B12R2.1081 Clc1[n]ccc2CCCCc21 Amb24684179 [0,1,0,1,0,0|2,0,0]=4 13164 B12R2.1081 Clc1[n]ccc2CCCNc21 Amb22756341 [0,1,0,1,0,0|2,0,0]=4 13165 B12R2.1081 Clc1[n]ccc2NCCCc21 Amb20171367 [0,1,0,1,0,0|2,0,0]=4 13166 B12R2.1081 Clc1[n]ccc2NCCOc21 Amb22899316 [0,1,0,1,0,0|2,0,0]=4 13167 B12R2.1081 Clc1[n]ccc2OCCNc21 Amb21964225 [0,1,0,1,0,0|2,0,0]=4 13168 B12R2.1081 Clc1c[n]cc2NCCCc21 Amb24695535 [0,1,0,1,0,0|2,0,0]=4 13169 B12R2.1081 Clc1c[n]cc2NCCOc21 Amb25150559 [0,1,0,1,0,0|2,0,0]=4 13170 B12R2.1081 Clc1c[n]cc2OCCNc21 Amb24485940 [0,1,0,1,0,0|2,0,0]=4 13171 B12R2.1081 Clc1cc[n]c2CCCCc21 Amb21857662 [0,1,0,1,0,0|2,0,0]=4 13172 B12R2.1081 Clc1cc[n]c2NCCCc21 Amb24395295 [0,1,0,1,0,0|2,0,0]=4 13173 B12R2.1081 Clc1cc[n]c2NCCOc21 Amb25709760 [0,1,0,1,0,0|2,0,0]=4 13174 B12R2.1081 Clc1cc[n]c2OCCNc21 Amb25765845 [0,1,0,1,0,0|2,0,0]=4 13175 B12R2.1081 Clc1cccc2C=CCOc21 Amb22586336 [0,1,0,1,0,0|0,0,2]=4 13176 B12R2.1081 Clc1cccc2CCCCc21 Amb25797430 [0,1,0,1,0,0|1,0,0]=3 13177 B12R2.1081 Clc1cccc2CCCNc21 Amb19373263 [0,1,0,1,0,0|1,0,0]=3 13178 B12R2.1081 Clc1cccc2CCN=Cc21 Amb24578663 [0,1,0,1,0,0|2,0,0]=4 13179 B12R2.1081 Clc1cccc2CCNCc21 Amb19889644 [0,1,0,1,0,0|2,0,0]=4 13180 B12R2.1081 Clc1cccc2CCOCc21 Amb24702304 [0,1,0,1,0,0|2,0,0]=4 13181 B12R2.1081 Clc1cccc2NCCCc21 Amb19957902 [0,1,0,1,0,0|1,0,0]=3 13182 B12R2.1081 Clc1cccc2NCCNc21 Amb25282036 [0,1,0,1,0,0|2,0,0]=4 13183 B12R2.1081 Clc1cccc2NCCSc21 Amb22886397 [0,1,0,1,0,0|1,1,0]=4 13184 B12R2.1081 Clc1cccc2OCCCc21 Amb25308190 [0,1,0,1,0,0|0,0,0]=2 13185 B12R2.1081 Clc1cccc2SCCNc21 Amb22886398 [0,1,0,1,0,0|1,1,0]=4 13186 B12R2.1081 Clc1cccc2c1CCC=C2 Amb2383775 [0,1,0,1,0,0|1,0,1]=4 13187 B12R2.1081 Clc1cccc2c1CCCN2 Amb2383329 [0,1,0,1,0,0|1,0,0]=3 13188 B12R2.1081 Clc1cccc2c1CCNC2 Amb13948964 [0,1,0,1,0,0|2,0,0]=4 13189 B12R2.1081 Clc1cccc2c1CCNC2 Amb2383349 [0,1,0,1,0,0|2,0,0]=4 13190 B12R2.1081 Clc1cccc2c1CNCC2 Amb10067198 [0,1,0,1,0,0|2,0,0]=4 13191 B12R2.1081 Clc1cccc2c1NCCC2 Amb1140461 [0,1,0,1,0,0|1,0,0]=3 13192 B12R2.1081 Clc1cccc2c1OCCN2 Amb2383435 [0,1,0,1,0,0|1,0,0]=3 13193 B12R2.1081 Clc1ccnc2c1OCCO2 Amb13889675 [0,1,0,1,0,0|2,0,0]=4 13194 B12R2.1081 FC1CCOc2ccccc21 Amb24396221 [0,1,0,1,0,0|0,0,0]=2 13195 B12R2.1081 FC1CCSc2ccccc21 Amb25249840 [0,1,0,1,0,0|0,1,0]=3 13196 B12R2.1081 FC1CNCc2c1cccc2 Amb10841578 [0,1,0,1,0,0|1,0,0]=3 13197 B12R2.1081 FC1COCc2ccccc21 Amb25768367 [0,1,0,1,0,0|1,0,0]=3 13198 B12R2.1081 FC1OCCc2ccccc21 Amb25073157 [0,1,0,1,0,0|1,0,0]=3 13199 B12R2.1081 Fc1cccc2C=CCOc21 Amb22586337 [0,1,0,1,0,0|0,0,2]=4 13200 B12R2.1081 Fc1cccc2C=NCCc21 Amb24563509 [0,1,0,1,0,0|2,0,0]=4 13201 B12R2.1081 Fc1cccc2CCCCc21 Amb25768617 [0,1,0,1,0,0|1,0,0]=3 13202 B12R2.1081 Fc1cccc2CCCOc21 Amb24554425 [0,1,0,1,0,0|0,0,0]=2 13203 B12R2.1081 Fc1cccc2CCCSc21 Amb25198716 [0,1,0,1,0,0|0,1,0]=3 13204 B12R2.1081 Fc1cccc2CCNCc21 Amb22232787 [0,1,0,1,0,0|2,0,0]=4 13205 B12R2.1081 Fc1cccc2CCOCc21 Amb25720944 [0,1,0,1,0,0|2,0,0]=4 13206 B12R2.1081 Fc1cccc2CNCCc21 Amb21858226 [0,1,0,1,0,0|2,0,0]=4 13207 B12R2.1081 Fc1cccc2COCCc21 Amb25773904 [0,1,0,1,0,0|2,0,0]=4 13208 B12R2.1081 Fc1cccc2NCCCc21 Amb19958505 [0,1,0,1,0,0|1,0,0]=3 13209 B12R2.1081 Fc1cccc2OC=CCc21 Amb25243428 [0,1,0,1,0,0|0,0,2]=4 13210 B12R2.1081 Fc1cccc2OCCCc21 Amb25084997 [0,1,0,1,0,0|0,0,0]=2 13211 B12R2.1081 Fc1cccc2OCCNc21 Amb18831161 [0,1,0,1,0,0|1,0,0]=3 13212 B12R2.1081 Fc1cccc2c1CCC=C2 Amb2383776 [0,1,0,1,0,0|1,0,1]=4 13213 B12R2.1081 Fc1cccc2c1CCCN2 Amb2383330 [0,1,0,1,0,0|1,0,0]=3 13214 B12R2.1081 Fc1cccc2c1CCNC2 Amb2383350 [0,1,0,1,0,0|2,0,0]=4 13215 B12R2.1081 Fc1cccc2c1CNCC2 Amb17194043 [0,1,0,1,0,0|2,0,0]=4 13216 B12R2.1081 Fc1cccc2c1NCCC2 Amb1108527 [0,1,0,1,0,0|1,0,0]=3 13217 B12R2.1081 Fc1cccc2c1NCCC2 Amb13951184 [0,1,0,1,0,0|1,0,0]=3 13218 B12R2.1081 Fc1cccc2c1OCCN2 Amb10603942 [0,1,0,1,0,0|1,0,0]=3 13219 B12R2.1081 Fc1cccc2c1OCCN2 Amb2383436 [0,1,0,1,0,0|1,0,0]=3 13220 B12R2.1081 IC1CCNc2ccccc21 Amb24754405 [0,1,0,1,0,0|1,0,0]=3 13221 B12R2.1081 IC1OCCc2ccccc21 Amb25309346 [0,1,0,1,0,0|1,0,0]=3 13222 B12R2.1081 Ic1cccc2CCNCc21 Amb24756500 [0,1,0,1,0,0|2,0,0]=4 13223 B12R2.1081 Ic1cccc2CCOCc21 Amb25324648 [0,1,0,1,0,0|2,0,0]=4 13224 B12R2.1081 Ic1cccc2CNCCc21 Amb22585545 [0,1,0,1,0,0|2,0,0]=4 13225 B12R2.1081 Ic1cccc2COCCc21 Amb25732468 [0,1,0,1,0,0|2,0,0]=4 13226 B12R2.1081 Ic1cccc2NCCCc21 Amb22586210 [0,1,0,1,0,0|1,0,0]=3 13227 B12R2.1081 Ic1cccc2NCCOc21 Amb22586347 [0,1,0,1,0,0|1,0,0]=3 13228 B12R2.1081 Ic1cccc2OCCCc21 Amb24707108 [0,1,0,1,0,0|0,0,0]=2 13229 B12R2.1081 Ic1cccc2OCCOc21 Amb22499097 [0,1,0,1,0,0|1,0,0]=3 13230 B12R2.1081 Ic1cccc2c1CCCN2 Amb2383337 [0,1,0,1,0,0|1,0,0]=3 13231 B12R2.1081 Ic1cccc2c1CCNC2 Amb2383357 [0,1,0,1,0,0|2,0,0]=4 13232 B12R2.1081 Ic1cccc2c1OCCN2 Amb2383443 [0,1,0,1,0,0|1,0,0]=3 13233 B12R2.1081 Ic1ccnc2c1OCCO2 Amb13889673 [0,1,0,1,0,0|2,0,0]=4 13234 B12R2.1081 Ic1cncc2c1OCCC2 Amb13889665 [0,1,0,1,0,0|1,0,0]=3 13235 B12R2.1081 NC1=CNC=C2CCCN=C21 Amb25330376 [0,1,0,1,0,0|2,0,0]=4 13236 B12R2.1081 NC1=NCCc2ccccc21 Amb18644285 [0,1,0,1,0,0|1,0,1]=4 13237 B12R2.1081 NC1C=CCc2ccccc21 Amb18124751 [0,1,0,1,0,0|1,0,1]=4 13238 B12R2.1081 NC1CC=Cc2ccccc21 Amb24385870 [0,1,0,1,0,0|1,0,1]=4 13239 B12R2.1081 NC1CCCc2[n]cccc21 Amb22499722 [0,1,0,1,0,0|2,0,0]=4 13240 B12R2.1081 NC1CCCc2[n]cccc21 Amb22499726 [0,1,0,1,0,0|2,0,0]=4 13241 B12R2.1081 NC1CCCc2c1cccc2 Amb1154594 [0,1,0,1,0,0|1,0,0]=3 13242 B12R2.1081 NC1CCCc2c[n]ccc21 Amb20622033 [0,1,0,1,0,0|2,0,0]=4 13243 B12R2.1081 NC1CCCc2c[n]ccc21 Amb23399856 [0,1,0,1,0,0|2,0,0]=4 13244 B12R2.1081 NC1CCCc2c[n]ccc21 Amb23412279 [0,1,0,1,0,0|2,0,0]=4 13245 B12R2.1081 NC1CCCc2cc[n]cc21 Amb22751608 [0,1,0,1,0,0|2,0,0]=4 13246 B12R2.1081 NC1CCCc2ccc[n]c21 Amb22371548 [0,1,0,1,0,0|2,0,0]=4 13247 B12R2.1081 NC1CCCc2ccccc21 Amb24273096 [0,1,0,1,0,0|1,0,0]=3 13248 B12R2.1081 NC1CCNc2ccccc21 Amb22233827 [0,1,0,1,0,0|1,0,0]=3 13249 B12R2.1081 NC1CCNc2ccccc21 Amb22757242 [0,1,0,1,0,0|1,0,0]=3 13250 B12R2.1081 NC1CCOc2[n]cccc21 Amb25806168 [0,1,0,1,0,0|1,0,0]=3 13251 B12R2.1081 NC1CCOc2c1cccc2 Amb1107562 [0,1,0,1,0,0|0,0,0]=2 13252 B12R2.1081 NC1CCOc2cc[n]cc21 Amb24591818 [0,1,0,1,0,0|1,0,0]=3 13253 B12R2.1081 NC1CCOc2ccc[n]c21 Amb21858508 [0,1,0,1,0,0|1,0,0]=3 13254 B12R2.1081 NC1CCSc2c1cccc2 Amb1107564 [0,1,0,1,0,0|0,1,0]=3 13255 B12R2.1081 NC1CNCc2ccccc21 Amb19929632 [0,1,0,1,0,0|1,0,0]=3 13256 B12R2.1081 NC1CNCc2ccccc21 Amb22494720 [0,1,0,1,0,0|1,0,0]=3 13257 B12R2.1081 NC1CNCc2ccccc21 Amb22494721 [0,1,0,1,0,0|1,0,0]=3 13258 B12R2.1081 NC1COCc2c1cccc2 Amb10067658 [0,1,0,1,0,0|1,0,0]=3 13259 B12R2.1081 NC1COCc2ccccc21 Amb18202067 [0,1,0,1,0,0|1,0,0]=3 13260 B12R2.1081 NC1CSCc2c1cccc2 Amb10067686 [0,1,0,1,0,0|1,0,0]=3 13261 B12R2.1081 NC1NCCc2ccccc21 Amb22491370 [0,1,0,1,0,0|1,0,0]=3 13262 B12R2.1081 NC1NCCc2ccccc21 Amb25798402 [0,1,0,1,0,0|1,0,0]=3 13263 B12R2.1081 NN1CCOc2ccccc12 Amb18125145 [0,1,0,1,0,0|1,0,0]=3 13264 B12R2.1081 NN1CCOc2ccccc12 Amb22228837 [0,1,0,1,0,0|1,0,0]=3 13265 B12R2.1081 NN1CCSc2ccccc12 Amb24454763 [0,1,0,1,0,0|1,1,0]=4 13266 B12R2.1081 N[C@@H]1CCCc2c1cccc2 Amb10844952 [0,1,0,1,0,0|1,0,0]=3 13267 B12R2.1081 N[C@@H]1CCCc2ccc[n]c21 Amb22748844 [0,1,0,1,0,0|2,0,0]=4 13268 B12R2.1081 N[C@@H]1CCCc2ccc[n]c21 Amb22748845 [0,1,0,1,0,0|2,0,0]=4 13269 B12R2.1081 N[C@@H]1CCCc2ccccc21 Amb22167169 [0,1,0,1,0,0|1,0,0]=3 13270 B12R2.1081 N[C@@H]1CCOc2c1cccc2 Amb13953038 [0,1,0,1,0,0|0,0,0]=2 13271 B12R2.1081 N[C@@H]1CCOc2ccccc21 Amb19515762 [0,1,0,1,0,0|0,0,0]=2 13272 B12R2.1081 N[C@@H]1CCSc2c1cccc2 Amb13952927 [0,1,0,1,0,0|0,1,0]=3 13273 B12R2.1081 N[C@H]1CCCc2[n]cccc21 Amb24068676 [0,1,0,1,0,0|2,0,0]=4 13274 B12R2.1081 N[C@H]1CCCc2cc[n]cc21 Amb25326344 [0,1,0,1,0,0|2,0,0]=4 13275 B12R2.1081 N[C@H]1CCCc2ccccc21 Amb19929634 [0,1,0,1,0,0|1,0,0]=3 13276 B12R2.1081 N[C@H]1CCNc2ccccc21 Amb25697589 [0,1,0,1,0,0|1,0,0]=3 13277 B12R2.1081 N[C@H]1CCOc2c1cccc2 Amb13953039 [0,1,0,1,0,0|0,0,0]=2 13278 B12R2.1081 N[C@H]1CCOc2ccccc21 Amb24052964 [0,1,0,1,0,0|0,0,0]=2 13279 B12R2.1081 N[C@H]1CCSc2c1cccc2 Amb13952928 [0,1,0,1,0,0|0,1,0]=3 13280 B12R2.1081 Nc1[n]c[n]c2CCCOc21 Amb18201709 [0,1,0,1,0,0|2,0,0]=4 13281 B12R2.1081 Nc1c[n]cc2CCCCc21 Amb24070842 [0,1,0,1,0,0|2,0,0]=4 13282 B12R2.1081 Nc1cc[n]c2CCCCc21 Amb25027866 [0,1,0,1,0,0|2,0,0]=4 13283 B12R2.1081 Nc1cc[n]c2OCCNc21 Amb24485900 [0,1,0,1,0,0|2,0,0]=4 13284 B12R2.1081 Nc1cccc2C=CCCc21 Amb18644206 [0,1,0,1,0,0|1,0,1]=4 13285 B12R2.1081 Nc1cccc2CCCNc21 Amb22494247 [0,1,0,1,0,0|1,0,0]=3 13286 B12R2.1081 Nc1cccc2CCCSc21 Amb18126429 [0,1,0,1,0,0|0,1,0]=3 13287 B12R2.1081 Nc1cccc2CCNCc21 Amb18355098 [0,1,0,1,0,0|2,0,0]=4 13288 B12R2.1081 Nc1cccc2CCOCc21 Amb25330800 [0,1,0,1,0,0|2,0,0]=4 13289 B12R2.1081 Nc1cccc2CNCCc21 Amb21858678 [0,1,0,1,0,0|2,0,0]=4 13290 B12R2.1081 Nc1cccc2OCC=Nc21 Amb24093680 [0,1,0,1,0,0|1,0,1]=4 13291 B12R2.1081 Nc1cccc2c1C=CCO2 Amb17569992 [0,1,0,1,0,0|0,0,2]=4 13292 B12R2.1081 Nc1cccc2c1CCCC2 Amb1088906 [0,1,0,1,0,0|1,0,0]=3 13293 B12R2.1081 Nc1cccc2c1CCCN2 Amb17232045 [0,1,0,1,0,0|1,0,0]=3 13294 B12R2.1081 Nc1cccc2c1CCCO2 Amb17570000 [0,1,0,1,0,0|0,0,0]=2 13295 B12R2.1081 Nc1cccc2c1CCNC2 Amb10067205 [0,1,0,1,0,0|2,0,0]=4 13296 B12R2.1081 Nc1cccc2c1COCO2 Amb17570009 [0,1,0,1,0,0|1,0,0]=3 13297 B12R2.1081 Nc1cccc2c1NCCO2 Amb16191975 [0,1,0,1,0,0|1,0,0]=3 13298 B12R2.1081 Nc1cccc2c1OCC=C2 Amb17569990 [0,1,0,1,0,0|0,0,2]=4 13299 B12R2.1081 Nc1cccc2c1OCCC2 Amb17569999 [0,1,0,1,0,0|0,0,0]=2 13300 B12R2.1081 Nc1cccc2c1OCCN2 Amb10067597 [0,1,0,1,0,0|1,0,0]=3 13301 B12R2.1081 Nc1cccc2c1OCCO2 Amb10071734 [0,1,0,1,0,0|1,0,0]=3 13302 B12R2.1081 Nc1cccc2c1OCCS2 Amb17570122 [0,1,0,1,0,0|1,0,0]=3 13303 B12R2.1081 Nc1cccc2c1OCOC2 Amb17570008 [0,1,0,1,0,0|1,0,0]=3 13304 B12R2.1081 Nc1ccnc2c1OCCO2 Amb13889678 [0,1,0,1,0,0|2,0,0]=4 13305 B12R2.1081 Nc1cncc2c1NCCC2 Amb10879382 [0,1,0,1,0,0|2,0,0]=4 13306 B12R2.1081 O=C1C=CC=C2NCCCN21 Amb19516189 [0,1,0,1,0,0|2,0,0]=4 13307 B12R2.1081 O=C1C=CC=C2NCCCN21 Amb19516338 [0,1,0,1,0,0|2,0,0]=4 13308 B12R2.1081 O=C1C=CN=C2OCCCN21 Amb24514543 [0,1,0,1,0,0|2,0,0]=4 13309 B12R2.1081 O=C1C=CNC=2CCCCC21 Amb22749082 [0,1,0,1,0,0|2,0,0]=4 13310 B12R2.1081 O=C1C=CSC=2CCCCC21 Amb25295224 [0,1,0,1,0,0|2,0,0]=4 13311 B12R2.1081 O=C1CCC[13c]2[13cH][13cH][13cH][13cH][13c]21 Amb22056230 [0,1,0,1,0,0|0,0,1]=3 13312 B12R2.1081 O=C1CCC[n+]2c1cccc2 Amb16191924 [0,1,0,1,0,0|1,0,1]=4 13313 B12R2.1081 O=C1CCCc2[n]cccc21 Amb19515604 [0,1,0,1,0,0|1,0,1]=4 13314 B12R2.1081 O=C1CCCc2c1ccnc2 Amb10603887 [0,1,0,1,0,0|1,0,1]=4 13315 B12R2.1081 O=C1CCCc2c[n]ccc21 Amb20621086 [0,1,0,1,0,0|1,0,1]=4 13316 B12R2.1081 O=C1CCCc2cc[n]cc21 Amb19888360 [0,1,0,1,0,0|1,0,1]=4 13317 B12R2.1081 O=C1CCCc2cc[n]cc21 Amb22727966 [0,1,0,1,0,0|1,0,1]=4 13318 B12R2.1081 O=C1CCNc2c1cccc2 Amb10067080 [0,1,0,1,0,0|0,0,2]=4 13319 B12R2.1081 O=C1CCOc2[n]cccc21 Amb24061183 [0,1,0,1,0,0|1,0,1]=4 13320 B12R2.1081 O=C1CCOc2c1cccc2 Amb1153759 [0,1,0,1,0,0|0,0,1]=3 13321 B12R2.1081 O=C1CCOc2c1nccc2 Amb10602517 [0,1,0,1,0,0|1,0,1]=4 13322 B12R2.1081 O=C1CCOc2cc[n]cc21 Amb21857915 [0,1,0,1,0,0|1,0,1]=4 13323 B12R2.1081 O=C1CCSc2c1cccc2 Amb1151631 [0,1,0,1,0,0|0,0,2]=4 13324 B12R2.1081 O=C1CNCc2ccccc21 Amb22494722 [0,1,0,1,0,0|0,0,2]=4 13325 B12R2.1081 O=C1CNOc2ccccc21 Amb25086617 [0,1,0,1,0,0|1,0,1]=4 13326 B12R2.1081 O=C1COCc2c1cccc2 Amb10067824 [0,1,0,1,0,0|0,0,2]=4 13327 B12R2.1081 O=C1NC=CC=2CCCNC21 Amb24340456 [0,1,0,1,0,0|2,0,0]=4 13328 B12R2.1081 O=C1NC=CC=2NCCCC21 Amb22304713 [0,1,0,1,0,0|2,0,0]=4 13329 B12R2.1081 O=C1NCCc2c1cccc2 Amb2502473 [0,1,0,1,0,0|0,0,2]=4 13330 B12R2.1081 O=C1NCOc2ccccc21 Amb24104580 [0,1,0,1,0,0|1,0,1]=4 13331 B12R2.1081 O=C1OCCc2c1cccc2 Amb16232507 [0,1,0,1,0,0|0,0,2]=4 13332 B12R2.1081 O=C1OCOc2ccccc21 Amb24066081 [0,1,0,1,0,0|1,0,1]=4 13333 B12R2.1081 O=C1SCCc2ccccc21 Amb24484481 [0,1,0,1,0,0|0,0,2]=4 13334 B12R2.1081 O=S1CCNc2c1cccc2 Amb1106281 [0,1,0,1,0,0|1,0,1]=4 13335 B12R2.1081 O=c1cccc2NCCC[n]21 Amb22227688 [0,1,0,1,0,0|2,0,0]=4 13336 B12R2.1081 O=c1cccc2NCCC[n]21 Amb22227689 [0,1,0,1,0,0|2,0,0]=4 13337 B12R2.1081 OB1OCCc2c1cccc2 Amb10070693 [0,1,0,1,0,0|1,0,0]=3 13338 B12R2.1081 OC1=COCc2c1cccc2 Amb10603427 [0,1,0,1,0,0|0,0,2]=4 13339 B12R2.1081 OC1C=COc2ccccc21 Amb25758786 [0,1,0,1,0,0|0,0,2]=4 13340 B12R2.1081 OC1CC=Cc2[n]cccc21 Amb24070852 [0,1,0,1,0,0|1,0,1]=4 13341 B12R2.1081 OC1CC=Cc2ccc[n]c21 Amb24091947 [0,1,0,1,0,0|1,0,1]=4 13342 B12R2.1081 OC1CC=Cc2ccccc21 Amb25122696 [0,1,0,1,0,0|0,0,1]=3 13343 B12R2.1081 OC1CCCc2[n]c[n]cc21 Amb25149484 [0,1,0,1,0,0|2,0,0]=4 13344 B12R2.1081 OC1CCCc2c1cccc2 Amb1151324 [0,1,0,1,0,0|0,0,0]=2 13345 B12R2.1081 OC1CCCc2c[n]ccc21 Amb23399822 [0,1,0,1,0,0|1,0,0]=3 13346 B12R2.1081 OC1CCCc2cc[n]cc21 Amb24070835 [0,1,0,1,0,0|1,0,0]=3 13347 B12R2.1081 OC1CCCc2cccnc12 Amb17935812 [0,1,0,1,0,0|1,0,0]=3 13348 B12R2.1081 OC1CCNc2c1cccc2 Amb10553386 [0,1,0,1,0,0|0,0,0]=2 13349 B12R2.1081 OC1CCNc2ccccc21 Amb22276045 [0,1,0,1,0,0|0,0,0]=2 13350 B12R2.1081 OC1CCNc2ccccc21 Amb22497677 [0,1,0,1,0,0|0,0,0]=2 13351 B12R2.1081 OC1CCOc2c1nccc2 Amb16233154 [0,1,0,1,0,0|1,0,0]=3 13352 B12R2.1081 OC1CCOc2cc[n]cc21 Amb25064593 [0,1,0,1,0,0|1,0,0]=3 13353 B12R2.1081 OC1CNCc2[n]c[n]cc21 Amb18201680 [0,1,0,1,0,0|2,0,0]=4 13354 B12R2.1081 OC1CNCc2[n]cccc21 Amb18201914 [0,1,0,1,0,0|1,0,0]=3 13355 B12R2.1081 OC1CNCc2c1cccc2 Amb16233378 [0,1,0,1,0,0|0,0,0]=2 13356 B12R2.1081 OC1CNCc2ccccc21 Amb22587041 [0,1,0,1,0,0|0,0,0]=2 13357 B12R2.1081 OC1COCc2ccccc21 Amb20171360 [0,1,0,1,0,0|0,0,0]=2 13358 B12R2.1081 OC1ON=Cc2ccccc21 Amb25129790 [0,1,0,1,0,0|1,0,1]=4 13359 B12R2.1081 ON1CCCc2ccccc12 Amb24085481 [0,1,0,1,0,0|0,0,0]=2 13360 B12R2.1081 O[C@@H]1C=CCc2ccccc21 Amb25149702 [0,1,0,1,0,0|0,0,1]=3 13361 B12R2.1081 O[C@@H]1C=COc2ccccc21 Amb25108504 [0,1,0,1,0,0|0,0,2]=4 13362 B12R2.1081 O[C@@H]1CCCc2cc[n]cc21 Amb25357624 [0,1,0,1,0,0|1,0,0]=3 13363 B12R2.1081 O[C@@H]1CCCc2ccc[n]c21 Amb24062853 [0,1,0,1,0,0|1,0,0]=3 13364 B12R2.1081 O[C@@H]1CCCc2ccccc21 Amb22337827 [0,1,0,1,0,0|0,0,0]=2 13365 B12R2.1081 O[C@@H]1CCOc2cc[n]cc21 Amb24511691 [0,1,0,1,0,0|1,0,0]=3 13366 B12R2.1081 O[C@@H]1CCSc2c1cccc2 Amb13952924 [0,1,0,1,0,0|0,0,0]=2 13367 B12R2.1081 O[C@@H]1CNCc2ccccc21 Amb24746212 [0,1,0,1,0,0|0,0,0]=2 13368 B12R2.1081 O[C@@H]1COCc2ccccc21 Amb22748516 [0,1,0,1,0,0|0,0,0]=2 13369 B12R2.1081 O[C@H]1CCCc2[n]cccc21 Amb24386952 [0,1,0,1,0,0|1,0,0]=3 13370 B12R2.1081 O[C@H]1CCCc2cc[n]cc21 Amb24340473 [0,1,0,1,0,0|1,0,0]=3 13371 B12R2.1081 O[C@H]1CCCc2ccc[n]c21 Amb24083650 [0,1,0,1,0,0|1,0,0]=3 13372 B12R2.1081 O[C@H]1CCCc2ccccc21 Amb22336192 [0,1,0,1,0,0|0,0,0]=2 13373 B12R2.1081 O[C@H]1CCOc2cc[n]cc21 Amb24579304 [0,1,0,1,0,0|1,0,0]=3 13374 B12R2.1081 O[C@H]1CCSc2c1cccc2 Amb13952926 [0,1,0,1,0,0|0,0,0]=2 13375 B12R2.1081 O[C@H]1CNCc2ccccc21 Amb24533225 [0,1,0,1,0,0|0,0,0]=2 13376 B12R2.1081 O[C@H]1COCc2ccccc21 Amb25748982 [0,1,0,1,0,0|0,0,0]=2 13377 B12R2.1081 Oc1[n]ccc2CCCCc21 Amb22727883 [0,1,0,1,0,0|2,0,0]=4 13378 B12R2.1081 Oc1c[n]cc2CCCCc21 Amb24079649 [0,1,0,1,0,0|2,0,0]=4 13379 B12R2.1081 Oc1c[n]cc2CCCNc21 Amb20241773 [0,1,0,1,0,0|2,0,0]=4 13380 B12R2.1081 Oc1c[n]cc2NCCCc21 Amb18125144 [0,1,0,1,0,0|2,0,0]=4 13381 B12R2.1081 Oc1c[n]cc2OCCCc21 Amb25201780 [0,1,0,1,0,0|1,0,0]=3 13382 B12R2.1081 Oc1cc[n]c2CCCCc21 Amb22728833 [0,1,0,1,0,0|2,0,0]=4 13383 B12R2.1081 Oc1cc[n]c2CCCOc21 Amb24455519 [0,1,0,1,0,0|1,0,0]=3 13384 B12R2.1081 Oc1cccc2C=CCCc21 Amb18644266 [0,1,0,1,0,0|1,0,1]=4 13385 B12R2.1081 Oc1cccc2CCC=Cc21 Amb18644265 [0,1,0,1,0,0|1,0,1]=4 13386 B12R2.1081 Oc1cccc2CCCOc21 Amb25142441 [0,1,0,1,0,0|0,0,0]=2 13387 B12R2.1081 Oc1cccc2CCCSc21 Amb24715725 [0,1,0,1,0,0|0,1,0]=3 13388 B12R2.1081 Oc1cccc2CCNCc21 Amb21858715 [0,1,0,1,0,0|2,0,0]=4 13389 B12R2.1081 Oc1cccc2CCNCc21 Amb22756331 [0,1,0,1,0,0|2,0,0]=4 13390 B12R2.1081 Oc1cccc2CNCCc21 Amb21858675 [0,1,0,1,0,0|2,0,0]=4 13391 B12R2.1081 Oc1cccc2CNCCc21 Amb23403654 [0,1,0,1,0,0|2,0,0]=4 13392 B12R2.1081 Oc1cccc2COCCc21 Amb24417190 [0,1,0,1,0,0|2,0,0]=4 13393 B12R2.1081 Oc1cccc2NCCCc21 Amb18124994 [0,1,0,1,0,0|1,0,0]=3 13394 B12R2.1081 Oc1cccc2NCCNc21 Amb20080169 [0,1,0,1,0,0|2,0,0]=4 13395 B12R2.1081 Oc1cccc2OCC=Cc21 Amb18124878 [0,1,0,1,0,0|0,0,2]=4 13396 B12R2.1081 Oc1cccc2OCOCc21 Amb24566795 [0,1,0,1,0,0|1,0,0]=3 13397 B12R2.1081 Oc1cccc2c1CCCC2 Amb2041248 [0,1,0,1,0,0|1,0,0]=3 13398 B12R2.1081 Oc1cccc2c1CNCC2 Amb10067195 [0,1,0,1,0,0|2,0,0]=4 13399 B12R2.1081 Oc1cccc2c1NCCC2 Amb1057683 [0,1,0,1,0,0|1,0,0]=3 13400 B12R2.1081 Oc1cccc2c1OCCO2 Amb2548386 [0,1,0,1,0,0|1,0,0]=3 13401 B12R2.1081 Oc1ccnc2c1OCCO2 Amb13889680 [0,1,0,1,0,0|2,0,0]=4 13402 B12R2.1081 Sc1cccc2OCCOc21 Amb24688690 [0,1,0,1,0,0|1,0,0]=3 13403 B12R2.1081 [NH3+]C1CCCc2ccccc21 Amb24113843 [0,1,0,1,0,0|1,0,0]=3 13404 B12R2.1081 [NH3+]C1CCOc2ccccc21 Amb21862674 [0,1,0,1,0,0|0,0,0]=2 13405 B12R2.1081 [O-]c1ccc[n+]2c1SCCC2 Amb10552989 [0,1,0,1,0,0|1,1,0]=4 13406 B12R2.2028 C=C1CC(Cl)c2ccccc21 Amb24513606 [0,1,0,1,0,0|1,0,1]=4 13407 B12R2.2028 C=C1C[C@@H](O)c2ccccc21 Amb25149657 [0,1,0,1,0,0|0,0,1]=3 13408 B12R2.2028 CC1=CC(O)c2ccccc12 Amb17778893 [0,1,0,1,0,0|0,0,2]=4 13409 B12R2.2028 CC1CC(Br)c2ccccc21 Amb25131825 [0,1,0,1,0,0|1,0,0]=3 13410 B12R2.2028 CC1CC(N)c2ccccc21 Amb19373084 [0,1,0,1,0,0|1,0,0]=3 13411 B12R2.2028 CC1CC(O)c2[n]cc[n]c21 Amb24092201 [0,1,0,1,0,0|2,0,0]=4 13412 B12R2.2028 CC1CC(O)c2cc[n]cc21 Amb25129412 [0,1,0,1,0,0|1,0,0]=3 13413 B12R2.2028 CC1CC(O)c2ccccc21 Amb25709313 [0,1,0,1,0,0|0,0,0]=2 13414 B12R2.2028 CC1CC(S)c2ccccc21 Amb24465175 [0,1,0,1,0,0|0,1,0]=3 13415 B12R2.2028 CC1CN(N)c2ccccc21 Amb24519067 [0,1,0,1,0,0|2,0,0]=4 13416 B12R2.2028 CC1NC(C)c2ccccc21 Amb20622620 [0,1,0,1,0,0|2,0,0]=4 13417 B12R2.2028 CN1CC(O)c2ccccc12 Amb24632103 [0,1,0,1,0,0|1,0,0]=3 13418 B12R2.2028 C[C@@H]1CC(=O)c2ccccc21 Amb24467053 [0,1,0,1,0,0|0,0,2]=4 13419 B12R2.2028 C[C@@H]1CC(O)c2ccccc21 Amb25188702 [0,1,0,1,0,0|0,0,0]=2 13420 B12R2.2028 C[C@@H]1C[C@@H](O)c2cc[n]cc21 Amb25102087 [0,1,0,1,0,0|1,0,0]=3 13421 B12R2.2028 C[C@@H]1C[C@H](Br)c2ccccc21 Amb24741831 [0,1,0,1,0,0|1,0,0]=3 13422 B12R2.2028 C[C@@H]1C[C@H](O)c2cc[n]cc21 Amb24694361 [0,1,0,1,0,0|1,0,0]=3 13423 B12R2.2028 C[C@H]1CC(=O)c2ccccc21 Amb25768595 [0,1,0,1,0,0|0,0,2]=4 13424 B12R2.2028 C[C@H]1CC(O)c2ccccc21 Amb24533800 [0,1,0,1,0,0|0,0,0]=2 13425 B12R2.2028 C[C@H]1C[C@@H](O)c2cc[n]cc21 Amb24601331 [0,1,0,1,0,0|1,0,0]=3 13426 B12R2.2028 C[C@H]1C[C@@H](O)c2ccccc21 Amb24740911 [0,1,0,1,0,0|0,0,0]=2 13427 B12R2.2028 N=C1CN(O)c2ccccc21 Amb24078909 [0,1,0,1,0,0|1,0,1]=4 13428 B12R2.2028 NC1CC(=O)c2ccccc21 Amb21955324 [0,1,0,1,0,0|0,0,2]=4 13429 B12R2.2028 NC1CC(F)c2ccccc21 Amb24117897 [0,1,0,1,0,0|1,0,0]=3 13430 B12R2.2028 NC1CC(F)c2ccccc21 Amb24361429 [0,1,0,1,0,0|1,0,0]=3 13431 B12R2.2028 N[C@@H]1CC(O)c2ccccc21 Amb25317541 [0,1,0,1,0,0|0,0,0]=2 13432 B12R2.2028 N[C@@H]1C[C@@H](O)c2ccccc21 Amb25213011 [0,1,0,1,0,0|0,0,0]=2 13433 B12R2.2028 N[C@@H]1C[C@H](O)c2ccccc21 Amb24657326 [0,1,0,1,0,0|0,0,0]=2 13434 B12R2.2028 N[C@H]1CC(O)c2ccccc21 Amb25716664 [0,1,0,1,0,0|0,0,0]=2 13435 B12R2.2028 O=C1CC(c2c1cccc2)Br Amb10068269 [0,1,0,1,0,0|0,0,2]=4 13436 B12R2.2028 O=C1CC(c2c1cccc2)N Amb17470381 [0,1,0,1,0,0|0,0,2]=4 13437 B12R2.2028 O=C1NC(c2c1cccc2)O Amb17593710 [0,1,0,1,0,0|1,0,1]=4 13438 B12R2.2028 O=C1OC(c2c1cccc2)O Amb10552913 [0,1,0,1,0,0|1,0,1]=4 13439 B12R2.2028 O=C1OC(c2c1cccc2)O Amb16226896 [0,1,0,1,0,0|1,0,1]=4 13440 B12R2.2028 OC1CC(=O)c2[n]cccc21 Amb22750353 [0,1,0,1,0,0|1,0,1]=4 13441 B12R2.2028 OC1CC(=O)c2c[n]ccc21 Amb24071455 [0,1,0,1,0,0|1,0,1]=4 13442 B12R2.2028 OC1CC(c2c1cccc2)N Amb17470387 [0,1,0,1,0,0|0,0,0]=2 13443 B12R2.2028 OC1CC(c2c1cccc2)O Amb1110942 [0,1,0,1,0,0|0,0,0]=2 13444 B12R2.2028 OC1NC(O)c2ccccc21 Amb24441685 [0,1,0,1,0,0|1,0,0]=3 13445 B12R2.2028 OC1OS(=O)c2ccccc21 Amb25234822 [0,1,0,1,0,0|2,0,0]=4 13446 B12R2.2028 ON1CC(=O)c2ccccc12 Amb24078911 [0,1,0,1,0,0|1,0,1]=4 13447 B12R2.2028 O[C@@H]1CC(=O)c2ccccc21 Amb24724027 [0,1,0,1,0,0|0,0,1]=3 13448 B12R2.2028 O[C@H]1CC(=O)c2ccccc21 Amb25188743 [0,1,0,1,0,0|0,0,1]=3 13449 B12R2.2028 O[C@H]1C[C@@H](O)c2ccccc12 Amb17938072 [0,1,0,1,0,0|0,0,0]=2 13450 B12R2.2028 O[C@H]1C[C@@H](c2c1cccc2)O Amb10068281 [0,1,0,1,0,0|0,0,0]=2 13451 B12R2.2047 CC1C(CO)c2ccccc21 Amb24541544 [0,1,0,1,0,0|0,0,0]=2 13452 B12R2.2047 N#CC1C(Cl)c2ccccc21 Amb25257929 [0,1,0,1,0,0|1,0,1]=4 13453 B12R2.2075 BrC(C1CC1)c2ccccc2 Amb25205179 [0,1,0,1,0,0|1,0,0]=3 13454 B12R2.2075 ClC(C1CC1)c2ccccc2 Amb18792883 [0,1,0,1,0,0|1,0,0]=3 13455 B12R2.2075 FC(C1CO1)c2ccccc2 Amb24611783 [0,1,0,1,0,0|0,0,0]=2 13456 B12R2.2075 NC(C1CC1)c2cc[n]cc2 Amb22497035 [0,1,0,1,0,0|2,0,0]=4 13457 B12R2.2075 NC(c1ccccc1)C2CC2 Amb2371625 [0,1,0,1,0,0|1,0,0]=3 13458 B12R2.2075 N[C@@H](C1CC1)c2ccccc2 Amb22406367 [0,1,0,1,0,0|1,0,0]=3 13459 B12R2.2075 N[C@@H](C1CC1)c2ccccc2 Amb22744981 [0,1,0,1,0,0|1,0,0]=3 13460 B12R2.2075 N[C@H](C1CC1)c2cc[n]cc2 Amb25145869 [0,1,0,1,0,0|2,0,0]=4 13461 B12R2.2075 N[C@H](C1CC1)c2ccc[n]c2 Amb25265270 [0,1,0,1,0,0|2,0,0]=4 13462 B12R2.2075 N[C@H](C1CC1)c2ccccc2 Amb22406366 [0,1,0,1,0,0|1,0,0]=3 13463 B12R2.2075 O=C(C1CO1)c2ccccc2 Amb24376086 [0,1,0,1,0,0|0,0,1]=3 13464 B12R2.2075 O=C([C@@H]1CO1)c2ccccc2 Amb25735777 [0,1,0,1,0,0|0,0,1]=3 13465 B12R2.2075 OC(C1CC1)c2cc[n]cc2 Amb24486009 [0,1,0,1,0,0|2,0,0]=4 13466 B12R2.2075 OC(C1CC1)c2ccc[n]c2 Amb22497231 [0,1,0,1,0,0|2,0,0]=4 13467 B12R2.2075 O[C@@H](C1CC1)c2cc[n]cc2 Amb25149640 [0,1,0,1,0,0|2,0,0]=4 13468 B12R2.2075 O[C@@H](C1CC1)c2cccc[n]2 Amb25296893 [0,1,0,1,0,0|2,0,0]=4 13469 B12R2.2075 O[C@@H]([C@H]1CO1)c2ccccc2 Amb24700386 [0,1,0,1,0,0|0,0,0]=2 13470 B12R2.2075 O[C@H](C1CC1)c2cc[n]cc2 Amb24705928 [0,1,0,1,0,0|2,0,0]=4 13471 B12R2.2075 O[C@H](C1CC1)c2cccc[n]2 Amb25205476 [0,1,0,1,0,0|2,0,0]=4 13472 B12R2.2075 O[C@H](C1CC1)c2ccccc2 Amb25260486 [0,1,0,1,0,0|1,0,0]=3 13473 B12R2.2075 O[C@H]([C@@H]1CO1)c2ccccc2 Amb24718405 [0,1,0,1,0,0|0,0,0]=2 13474 B12R2.2075 SC(C1CC1)c2ccccc2 Amb18788326 [0,1,0,1,0,0|1,0,0]=3 13475 B12R2.7 O=C1C=CC=CC12CCCC2 Amb24709365 [0,1,0,1,0,0|1,0,1]=4 13476 B12R2.32 BrCC1CN2C=CC=CC2=N1 Amb17666323 [0,1,0,1,0,0|2,0,0]=4 13477 B12R2.32 BrCC1CN2C=CC=CC2=N1 Amb17842713 [0,1,0,1,0,0|2,0,0]=4 13478 B12R2.32 BrCC1Cc2c(O1)cccc2 Amb17040446 [0,1,0,1,0,0|1,0,0]=3 13479 B12R2.32 BrCC1Cc2ccccc2C1 Amb22235471 [0,1,0,1,0,0|1,0,0]=3 13480 B12R2.32 BrC[C@H]1Cc2ccccc2O1 Amb25695955 [0,1,0,1,0,0|1,0,0]=3 13481 B12R2.32 C#CC1Cc2ccccc2C1 Amb24074759 [0,1,0,1,0,0|1,0,1]=4 13482 B12R2.32 CCC1Cc2ccc[n]c2N1 Amb24486053 [0,1,0,1,0,0|2,0,0]=4 13483 B12R2.32 CCC1Nc2ccccc2N1 Amb25374201 [0,1,0,1,0,0|2,0,0]=4 13484 B12R2.32 CCC1Nc2ccccc2S1 Amb24086400 [0,1,0,1,0,0|2,0,0]=4 13485 B12R2.32 CCC1Oc2ccccc2O1 Amb24485882 [0,1,0,1,0,0|2,0,0]=4 13486 B12R2.32 CCN1Cc2ccccc2C1 Amb21870754 [0,1,0,1,0,0|2,0,0]=4 13487 B12R2.32 CNC1Cc2ccccc2C1 Amb21955693 [0,1,0,1,0,0|2,0,0]=4 13488 B12R2.32 COC1Cc2ccccc2O1 Amb24084536 [0,1,0,1,0,0|2,0,0]=4 13489 B12R2.32 CSC1Cc2ccccc2C1 Amb25712718 [0,1,0,1,0,0|2,0,0]=4 13490 B12R2.32 ClCC1Cc2ccccc2S1 Amb24688554 [0,1,0,1,0,0|1,0,0]=3 13491 B12R2.32 ClCC1Sc2ccccc2S1 Amb25063644 [0,1,0,1,0,0|2,0,0]=4 13492 B12R2.32 ClCC=1Cc2ccccc2C1 Amb24359917 [0,1,0,1,0,0|1,0,1]=4 13493 B12R2.32 FCC1Cc2ccccc2N1 Amb25276456 [0,1,0,1,0,0|1,0,0]=3 13494 B12R2.32 FC[C@@H]1Cc2ccccc2N1 Amb25041577 [0,1,0,1,0,0|1,0,0]=3 13495 B12R2.32 ICC1Cc2ccccc2N1 Amb24061262 [0,1,0,1,0,0|1,0,0]=3 13496 B12R2.32 ICC1Cc2ccccc2O1 Amb23513694 [0,1,0,1,0,0|1,0,0]=3 13497 B12R2.32 N#CC1Cc2ccccc2O1 Amb24384661 [0,1,0,1,0,0|1,0,1]=4 13498 B12R2.32 N#CC1Cc2ccccc2S1 Amb24465725 [0,1,0,1,0,0|1,0,1]=4 13499 B12R2.32 NCC1Cc2c(O1)cccc2 Amb1088943 [0,1,0,1,0,0|1,0,0]=3 13500 B12R2.32 NCC1Cc2ccc[n]c2C1 Amb25117954 [0,1,0,1,0,0|2,0,0]=4 13501 B12R2.32 NCC1Cc2ccccc2C1 Amb19287049 [0,1,0,1,0,0|1,0,0]=3 13502 B12R2.32 NCC1Nc2ccccc2N1 Amb24334873 [0,1,0,1,0,0|2,0,0]=4 13503 B12R2.32 NCC1Oc2ccccc2O1 Amb24060644 [0,1,0,1,0,0|2,0,0]=4 13504 B12R2.32 NCC=1Cc2ccccc2C1 Amb25178878 [0,1,0,1,0,0|1,0,1]=4 13505 B12R2.32 NNC1Cc2c(C1)cccc2 Amb10071076 [0,1,0,1,0,0|2,0,0]=4 13506 B12R2.32 NNC1Cc2ccccc2C1 Amb19890159 [0,1,0,1,0,0|2,0,0]=4 13507 B12R2.32 NNC1Cc2ccccc2C1 Amb21954062 [0,1,0,1,0,0|2,0,0]=4 13508 B12R2.32 O=CC1Cc2ccccc2C1 Amb18124789 [0,1,0,1,0,0|0,0,2]=4 13509 B12R2.32 OCC1C=C2C=CC=CC2=C1 Amb25151986 [0,1,0,1,0,0|0,0,1]=3 13510 B12R2.32 OCC1Cc2[n]cc[n]c2C1 Amb24071758 [0,1,0,1,0,0|2,0,0]=4 13511 B12R2.32 OCC1Cc2[n]cccc2N1 Amb25311460 [0,1,0,1,0,0|1,0,0]=3 13512 B12R2.32 OCC1Cc2c[n]ccc2C1 Amb24071780 [0,1,0,1,0,0|1,0,0]=3 13513 B12R2.32 OCC1Cc2ccc[n]c2C1 Amb25141923 [0,1,0,1,0,0|1,0,0]=3 13514 B12R2.32 OCC1Cc2ccccc2C1 Amb19516120 [0,1,0,1,0,0|0,0,0]=2 13515 B12R2.32 OCC1Cc2ccccc2S1 Amb24513744 [0,1,0,1,0,0|0,0,0]=2 13516 B12R2.32 OCC1Oc2ccc[n]c2O1 Amb24060666 [0,1,0,1,0,0|2,0,0]=4 13517 B12R2.32 OCC1Oc2ccccc2O1 Amb24060645 [0,1,0,1,0,0|1,0,0]=3 13518 B12R2.32 OCC=1Cc2ccccc2C1 Amb22494117 [0,1,0,1,0,0|0,0,1]=3 13519 B12R2.32 OC[C@@H]1Cc2ccc[n]c2C1 Amb24068721 [0,1,0,1,0,0|1,0,0]=3 13520 B12R2.32 OC[C@@H]1Cc2ccccc2N1 Amb22336386 [0,1,0,1,0,0|0,0,0]=2 13521 B12R2.32 OC[C@H]1Cc2ccccc2N1 Amb24746775 [0,1,0,1,0,0|0,0,0]=2 13522 B12R2.32 OCc1cc2c(o1)cccc2 Amb1156663 [0,1,0,1,0,0|0,0,2]=4 13523 B12R2.32 ONC1Nc2ccccc2O1 Amb24523067 [0,1,0,1,0,0|2,0,0]=4 13524 B12R2.32 O\N=C/1\Cc2ccccc2O1 Amb24727728 [0,1,0,1,0,0|1,0,1]=4 13525 B12R2.32 SCC1Cc2ccccc2S1 Amb25149129 [0,1,0,1,0,0|0,1,0]=3 13526 B12R2.115 BrC1CC1c2ccccc2I Amb25150585 [0,1,0,1,0,0|1,0,0]=3 13527 B12R2.115 Brc1ccccc1C2CC2Br Amb23454930 [0,1,0,1,0,0|1,0,0]=3 13528 B12R2.115 CC1CC1c2ccccc2Br Amb23247715 [0,1,0,1,0,0|1,0,0]=3 13529 B12R2.115 CC1CC1c2ccccc2N Amb24378033 [0,1,0,1,0,0|1,0,0]=3 13530 B12R2.115 CC1OC1c2ccccc2F Amb24433748 [0,1,0,1,0,0|2,0,0]=4 13531 B12R2.115 CC1OC1c2ccccc2O Amb24087256 [0,1,0,1,0,0|2,0,0]=4 13532 B12R2.115 C[C@@H]1C[C@H]1c2ccccc2N Amb24581604 [0,1,0,1,0,0|1,0,0]=3 13533 B12R2.115 C[C@@H]1C[C@H]1c2ccccc2O Amb25373423 [0,1,0,1,0,0|1,0,0]=3 13534 B12R2.115 C[C@H]1C[C@@H]1c2ccccc2N Amb25228469 [0,1,0,1,0,0|1,0,0]=3 13535 B12R2.115 C[C@H]1C[C@H]1c2ccccc2N Amb24514820 [0,1,0,1,0,0|1,0,0]=3 13536 B12R2.115 Cc1cc[n]cc1C2CC2N Amb25824994 [0,1,0,1,0,0|2,0,0]=4 13537 B12R2.115 Cc1ccccc1C2CC2Br Amb24484845 [0,1,0,1,0,0|1,0,0]=3 13538 B12R2.115 Cc1ccccc1C2CC2N Amb19374843 [0,1,0,1,0,0|1,0,0]=3 13539 B12R2.115 Cc1ccccc1C2CC2O Amb24526800 [0,1,0,1,0,0|0,0,0]=2 13540 B12R2.115 Cc1ccccc1[C@@H]2C[C@@H]2Br Amb24718273 [0,1,0,1,0,0|1,0,0]=3 13541 B12R2.115 Cc1ccccc1[C@@H]2C[C@@H]2Cl Amb25176073 [0,1,0,1,0,0|1,0,0]=3 13542 B12R2.115 Cc1ccccc1[C@@H]2C[C@H]2Br Amb24624562 [0,1,0,1,0,0|1,0,0]=3 13543 B12R2.115 Cc1ccccc1[C@@H]2C[C@H]2Cl Amb24540820 [0,1,0,1,0,0|1,0,0]=3 13544 B12R2.115 Cc1ccccc1[C@@H]2C[C@H]2N Amb24560305 [0,1,0,1,0,0|1,0,0]=3 13545 B12R2.115 Clc1ccccc1C2CC2Br Amb23454909 [0,1,0,1,0,0|1,0,0]=3 13546 B12R2.115 Fc1ccccc1C2CC2Br Amb23454901 [0,1,0,1,0,0|1,0,0]=3 13547 B12R2.115 NC1CC1c2ccccc2Br Amb19373270 [0,1,0,1,0,0|1,0,0]=3 13548 B12R2.115 NC1CC1c2ccccc2Cl Amb19346493 [0,1,0,1,0,0|1,0,0]=3 13549 B12R2.115 NC1CC1c2ccccc2F Amb19514922 [0,1,0,1,0,0|1,0,0]=3 13550 B12R2.115 NC1CC1c2ccccc2O Amb25223496 [0,1,0,1,0,0|1,0,0]=3 13551 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2Cl Amb25095403 [0,1,0,1,0,0|1,0,0]=3 13552 B12R2.196 C=C1CCc2c(Br)cccc21 Amb24380342 [0,1,0,1,0,0|1,0,1]=4 13553 B12R2.196 C=C1CCc2c(Cl)cccc21 Amb22229727 [0,1,0,1,0,0|1,0,1]=4 13554 B12R2.196 C=C1CCc2c(F)cccc21 Amb24334153 [0,1,0,1,0,0|1,0,1]=4 13555 B12R2.196 CC1CCc2c(O)cccc21 Amb24099162 [0,1,0,1,0,0|1,0,0]=3 13556 B12R2.196 CC1CNc2c(Cl)cccc21 Amb18063135 [0,1,0,1,0,0|2,0,0]=4 13557 B12R2.196 CC1CNc2c(F)cccc21 Amb18063405 [0,1,0,1,0,0|2,0,0]=4 13558 B12R2.196 CC1CNc2c1cccc2C Amb17040659 [0,1,0,1,0,0|2,0,0]=4 13559 B12R2.196 CC1NCc2c(Br)cccc21 Amb24730648 [0,1,0,1,0,0|2,0,0]=4 13560 B12R2.196 CC1NCc2c(F)cccc21 Amb25198238 [0,1,0,1,0,0|2,0,0]=4 13561 B12R2.196 CC1NCc2c(I)cccc21 Amb24437406 [0,1,0,1,0,0|2,0,0]=4 13562 B12R2.196 CC1NCc2c(O)cccc21 Amb24601012 [0,1,0,1,0,0|2,0,0]=4 13563 B12R2.196 CN1CCc2c(Br)cccc12 Amb24396224 [0,1,0,1,0,0|2,0,0]=4 13564 B12R2.196 CN1CCc2c(N)cccc12 Amb18669647 [0,1,0,1,0,0|2,0,0]=4 13565 B12R2.196 CN1CCc2c1cccc2O Amb17593716 [0,1,0,1,0,0|2,0,0]=4 13566 B12R2.196 C[C@@H]1NCc2c(Cl)cccc21 Amb25825909 [0,1,0,1,0,0|2,0,0]=4 13567 B12R2.196 C[C@@H]1NCc2c(N)cccc21 Amb25133622 [0,1,0,1,0,0|2,0,0]=4 13568 B12R2.196 C[C@H]1NCc2c(Cl)cccc21 Amb24669653 [0,1,0,1,0,0|2,0,0]=4 13569 B12R2.196 C[C@H]1NCc2c(F)cccc21 Amb24436830 [0,1,0,1,0,0|2,0,0]=4 13570 B12R2.196 Cc1c[n]cc2C(C)CCc12 Amb24724547 [0,1,0,1,0,0|2,0,0]=4 13571 B12R2.196 Cc1cc[n]c2C(N)CCc21 Amb25769226 [0,1,0,1,0,0|2,0,0]=4 13572 B12R2.196 Cc1cc[n]c2C(O)CCc21 Amb25151969 [0,1,0,1,0,0|1,0,0]=3 13573 B12R2.196 Cc1cc[n]c2[C@H](O)CCc21 Amb25077951 [0,1,0,1,0,0|1,0,0]=3 13574 B12R2.196 Cc1cccc2B(O)OCc21 Amb24591278 [0,1,0,1,0,0|2,0,0]=4 13575 B12R2.196 Cc1cccc2C(=C)CCc21 Amb25071609 [0,1,0,1,0,0|1,0,1]=4 13576 B12R2.196 Cc1cccc2C(Br)CCc21 Amb25319083 [0,1,0,1,0,0|1,0,0]=3 13577 B12R2.196 Cc1cccc2C(N)CCc21 Amb19514831 [0,1,0,1,0,0|1,0,0]=3 13578 B12R2.196 Cc1cccc2C(O)COc21 Amb24431963 [0,1,0,1,0,0|1,0,0]=3 13579 B12R2.196 Cc1cccc2[C@@H](N)CCc21 Amb25145813 [0,1,0,1,0,0|1,0,0]=3 13580 B12R2.196 Cc1cccc2[C@@H](N)COc21 Amb24589207 [0,1,0,1,0,0|2,0,0]=4 13581 B12R2.196 Cc1cccc2[C@H](N)COc21 Amb25689740 [0,1,0,1,0,0|2,0,0]=4 13582 B12R2.196 ClC1CCc2c(Br)cccc21 Amb22059235 [0,1,0,1,0,0|1,0,0]=3 13583 B12R2.196 ClC1CCc2c1cccc2C Amb17087981 [0,1,0,1,0,0|1,0,0]=3 13584 B12R2.196 ClC1CCc2c1cccc2Cl Amb17087984 [0,1,0,1,0,0|1,0,0]=3 13585 B12R2.196 ClC1CCc2c1cccc2F Amb17087983 [0,1,0,1,0,0|1,0,0]=3 13586 B12R2.196 Clc1cc[n]c2C(Cl)CCc12 Amb22491387 [0,1,0,1,0,0|2,0,0]=4 13587 B12R2.196 Fc1cccc2C(Br)CCc21 Amb20623563 [0,1,0,1,0,0|1,0,0]=3 13588 B12R2.196 Fc1cccc2C(F)CCc12 Amb24514103 [0,1,0,1,0,0|1,0,0]=3 13589 B12R2.196 NC1CCN2C(=O)C=CC=C21 Amb24514617 [0,1,0,1,0,0|2,0,0]=4 13590 B12R2.196 NC1CCc2c(Br)cccc21 Amb19342600 [0,1,0,1,0,0|1,0,0]=3 13591 B12R2.196 NC1CCc2c(I)cccc21 Amb25691610 [0,1,0,1,0,0|1,0,0]=3 13592 B12R2.196 NC1CCc2c1cccc2Cl Amb10609924 [0,1,0,1,0,0|1,0,0]=3 13593 B12R2.196 NC1CCc2c1cccc2Cl Amb2383228 [0,1,0,1,0,0|1,0,0]=3 13594 B12R2.196 NC1CCc2c1cccc2F Amb10609944 [0,1,0,1,0,0|1,0,0]=3 13595 B12R2.196 NC1CCc2c1cccc2F Amb2383229 [0,1,0,1,0,0|1,0,0]=3 13596 B12R2.196 NC1COc2c(Cl)cccc21 Amb20626374 [0,1,0,1,0,0|2,0,0]=4 13597 B12R2.196 NC1COc2c(F)cccc21 Amb22586304 [0,1,0,1,0,0|2,0,0]=4 13598 B12R2.196 NC1COc2c(S)cccc21 Amb24533042 [0,1,0,1,0,0|2,0,0]=4 13599 B12R2.196 NC1COc2c1cccc2Cl Amb2383238 [0,1,0,1,0,0|2,0,0]=4 13600 B12R2.196 NC1COc2c1cccc2F Amb2383239 [0,1,0,1,0,0|2,0,0]=4 13601 B12R2.196 N[C@@H]1CCc2c(Br)cccc21 Amb22288665 [0,1,0,1,0,0|1,0,0]=3 13602 B12R2.196 N[C@@H]1CCc2c(F)cccc21 Amb22288666 [0,1,0,1,0,0|1,0,0]=3 13603 B12R2.196 N[C@@H]1CCc2c(F)cccc21 Amb22746050 [0,1,0,1,0,0|1,0,0]=3 13604 B12R2.196 N[C@@H]1CCc2c(I)cccc21 Amb25697307 [0,1,0,1,0,0|1,0,0]=3 13605 B12R2.196 N[C@@H]1CCc2c(S)cccc21 Amb24484494 [0,1,0,1,0,0|1,0,0]=3 13606 B12R2.196 N[C@@H]1CCc2c1cccc2Cl Amb13953028 [0,1,0,1,0,0|1,0,0]=3 13607 B12R2.196 N[C@@H]1COc2c(Br)cccc21 Amb25055297 [0,1,0,1,0,0|2,0,0]=4 13608 B12R2.196 N[C@@H]1COc2c(F)cccc21 Amb25060202 [0,1,0,1,0,0|2,0,0]=4 13609 B12R2.196 N[C@@H]1COc2c(I)cccc21 Amb24561110 [0,1,0,1,0,0|2,0,0]=4 13610 B12R2.196 N[C@@H]1COc2c(O)cccc21 Amb25837299 [0,1,0,1,0,0|2,0,0]=4 13611 B12R2.196 N[C@@H]1COc2c(S)cccc21 Amb24484516 [0,1,0,1,0,0|2,0,0]=4 13612 B12R2.196 N[C@H]1CCc2c(Br)cccc21 Amb22288709 [0,1,0,1,0,0|1,0,0]=3 13613 B12R2.196 N[C@H]1CCc2c(F)cccc21 Amb22388651 [0,1,0,1,0,0|1,0,0]=3 13614 B12R2.196 N[C@H]1CCc2c1cccc2Cl Amb13953027 [0,1,0,1,0,0|1,0,0]=3 13615 B12R2.196 N[C@H]1CCc2c1cccc2F Amb16233799 [0,1,0,1,0,0|1,0,0]=3 13616 B12R2.196 N[C@H]1COc2c(S)cccc21 Amb25791602 [0,1,0,1,0,0|2,0,0]=4 13617 B12R2.196 Nc1[n]c[n]c2C(O)CCc21 Amb25327515 [0,1,0,1,0,0|2,0,0]=4 13618 B12R2.196 Nc1cccc2C(N)CCc12 Amb24436510 [0,1,0,1,0,0|1,0,0]=3 13619 B12R2.196 Nc1cccc2C(N)COc12 Amb24671202 [0,1,0,1,0,0|2,0,0]=4 13620 B12R2.196 Nc1cccc2[C@H](N)COc12 Amb24484515 [0,1,0,1,0,0|2,0,0]=4 13621 B12R2.196 O=C1CCc2c1cccc2Cl Amb2383535 [0,1,0,1,0,0|0,0,2]=4 13622 B12R2.196 O=C1CCc2c1cccc2F Amb2383536 [0,1,0,1,0,0|0,0,2]=4 13623 B12R2.196 O=C1CCc2c1cccc2I Amb10602518 [0,1,0,1,0,0|0,0,2]=4 13624 B12R2.196 O=C1CCc2c1cccc2N Amb10067615 [0,1,0,1,0,0|0,0,2]=4 13625 B12R2.196 O=C1CCc2c1cccc2O Amb1158068 [0,1,0,1,0,0|0,0,2]=4 13626 B12R2.196 OC1CCc2c(Br)cccc21 Amb20171517 [0,1,0,1,0,0|0,0,0]=2 13627 B12R2.196 OC1CCc2c(Cl)cc[n]c21 Amb19957874 [0,1,0,1,0,0|1,0,0]=3 13628 B12R2.196 OC1CCc2c1cccc2C Amb17087931 [0,1,0,1,0,0|0,0,0]=2 13629 B12R2.196 OC1CCc2c1cccc2Cl Amb17087934 [0,1,0,1,0,0|0,0,0]=2 13630 B12R2.196 OC1CCc2c1cccc2F Amb17087933 [0,1,0,1,0,0|0,0,0]=2 13631 B12R2.196 OC1COc2c(Br)cccc21 Amb22751583 [0,1,0,1,0,0|1,0,0]=3 13632 B12R2.196 OC1COc2c(F)cccc21 Amb24504909 [0,1,0,1,0,0|1,0,0]=3 13633 B12R2.196 OC1CSc2c(Cl)cccc21 Amb25356310 [0,1,0,1,0,0|1,0,0]=3 13634 B12R2.196 OC1OCc2c(F)cccc21 Amb25266840 [0,1,0,1,0,0|1,0,0]=3 13635 B12R2.196 O[C@@H]1CCc2c(Br)cccc21 Amb22756414 [0,1,0,1,0,0|0,0,0]=2 13636 B12R2.196 O[C@@H]1CCc2c(F)cccc21 Amb24432762 [0,1,0,1,0,0|0,0,0]=2 13637 B12R2.196 O[C@@H]1CCc2c1cccc2Cl Amb13953026 [0,1,0,1,0,0|0,0,0]=2 13638 B12R2.196 O[C@H]1CCc2c1cccc2Cl Amb13953025 [0,1,0,1,0,0|0,0,0]=2 13639 B12R2.196 Oc1cccc2B(O)OCc12 Amb25319915 [0,1,0,1,0,0|2,0,0]=4 13640 B12R2.196 Oc1cccc2C(F)CCc21 Amb24511704 [0,1,0,1,0,0|1,0,0]=3 13641 B12R2.196 Oc1cccc2C(O)CCc12 Amb18179372 [0,1,0,1,0,0|0,0,0]=2 13642 B12R2.196 Oc1cccc2C(O)COc12 Amb24388501 [0,1,0,1,0,0|1,0,0]=3 13643 B12R2.196 Oc1cccc2[C@@H](O)CCc12 Amb25032411 [0,1,0,1,0,0|0,0,0]=2 13644 B12R2.196 SC1CCc2c(Br)cccc21 Amb24352616 [0,1,0,1,0,0|0,1,0]=3 13645 B12R2.225 Brc1ccccc1OC2CC2 Amb25771923 [0,1,0,1,0,0|2,0,0]=4 13646 B12R2.225 Cc1cc[n]cc1CC2CO2 Amb25784408 [0,1,0,1,0,0|1,0,0]=3 13647 B12R2.225 Cc1ccccc1CC2CO2 Amb25122222 [0,1,0,1,0,0|0,0,0]=2 13648 B12R2.225 Cc1ccccc1SC2CC2 Amb25149493 [0,1,0,1,0,0|2,0,0]=4 13649 B12R2.225 Clc1ccccc1CC2CO2 Amb25094935 [0,1,0,1,0,0|0,0,0]=2 13650 B12R2.225 Clc1ccccc1NC2CC2 Amb18267914 [0,1,0,1,0,0|2,0,0]=4 13651 B12R2.225 Fc1ccccc1NC2CC2 Amb18930891 [0,1,0,1,0,0|2,0,0]=4 13652 B12R2.225 Fc1ccccc1SC2CC2 Amb24717992 [0,1,0,1,0,0|2,0,0]=4 13653 B12R2.225 Ic1ccccc1NC2CC2 Amb25213888 [0,1,0,1,0,0|2,0,0]=4 13654 B12R2.225 Nc1ccccc1CC2CC2 Amb24117001 [0,1,0,1,0,0|1,0,0]=3 13655 B12R2.225 Nc1ccccc1SC2CC2 Amb25302953 [0,1,0,1,0,0|2,0,0]=4 13656 B12R2.225 O=C1C=CC=CN1CC2CC2 Amb25789797 [0,1,0,1,0,0|2,0,0]=4 13657 B12R2.225 O=C1C=CC=CN1CC2CO2 Amb18181684 [0,1,0,1,0,0|1,0,0]=3 13658 B12R2.225 O=C1C=CC=CN1C[C@H]2CO2 Amb24501797 [0,1,0,1,0,0|1,0,0]=3 13659 B12R2.225 O=C1C=CC=NN1CC2CO2 Amb18179414 [0,1,0,1,0,0|2,0,0]=4 13660 B12R2.225 O=C1C=CN=CN1CC2CO2 Amb24689772 [0,1,0,1,0,0|2,0,0]=4 13661 B12R2.225 O=C1C=NC=CN1C[C@@H]2CO2 Amb25837501 [0,1,0,1,0,0|2,0,0]=4 13662 B12R2.225 O=C1N=CC=CN1CC2CO2 Amb18181707 [0,1,0,1,0,0|2,0,0]=4 13663 B12R2.225 O=C1N=CC=CN1C[C@H]2CO2 Amb25132503 [0,1,0,1,0,0|2,0,0]=4 13664 B12R2.225 Oc1ccccc1CC2CC2 Amb22752448 [0,1,0,1,0,0|1,0,0]=3 13665 B12R2.225 Oc1ccccc1CC2CO2 Amb24364096 [0,1,0,1,0,0|0,0,0]=2 13666 B12R2.225 Oc1ccccc1C[C@@H]2CO2 Amb24724020 [0,1,0,1,0,0|0,0,0]=2 13667 B12R2.225 Oc1ccccc1SC2CC2 Amb25287926 [0,1,0,1,0,0|2,0,0]=4 13668 B12R2.517 Brc1[n]cccc1C2CCC2 Amb24319276 [0,1,0,1,0,0|2,0,0]=4 13669 B12R2.517 Brc1[n]cccc1C2CCN2 Amb24663934 [0,1,0,1,0,0|2,0,0]=4 13670 B12R2.517 Brc1[n]cccc1[C@@H]2CCN2 Amb25083253 [0,1,0,1,0,0|2,0,0]=4 13671 B12R2.517 Brc1c[n]ccc1C2CCC2 Amb24082792 [0,1,0,1,0,0|2,0,0]=4 13672 B12R2.517 Brc1c[n]ccc1C2CCN2 Amb25103778 [0,1,0,1,0,0|2,0,0]=4 13673 B12R2.517 Brc1cc[n]cc1C2CCC2 Amb20617516 [0,1,0,1,0,0|2,0,0]=4 13674 B12R2.517 Brc1cc[n]cc1[C@@H]2CCN2 Amb24628506 [0,1,0,1,0,0|2,0,0]=4 13675 B12R2.517 Brc1ccc[n]c1C2CCC2 Amb24320672 [0,1,0,1,0,0|2,0,0]=4 13676 B12R2.517 Brc1ccccc1C2CCC2 Amb20617096 [0,1,0,1,0,0|1,0,0]=3 13677 B12R2.517 Brc1ccccc1C2CCN2 Amb22054565 [0,1,0,1,0,0|1,0,0]=3 13678 B12R2.517 Brc1ccccc1N2CCC2 Amb25247790 [0,1,0,1,0,0|2,0,0]=4 13679 B12R2.517 Brc1ccccc1[C@@H]2CCN2 Amb25301204 [0,1,0,1,0,0|1,0,0]=3 13680 B12R2.517 Brc1ccccc1[C@H]2CCN2 Amb25805155 [0,1,0,1,0,0|1,0,0]=3 13681 B12R2.517 Cc1[n]cccc1[C@@H]2CCN2 Amb24715914 [0,1,0,1,0,0|2,0,0]=4 13682 B12R2.517 Cc1c[n]ccc1[C@H]2CCN2 Amb24376720 [0,1,0,1,0,0|2,0,0]=4 13683 B12R2.517 Cc1cc[n]cc1C2CCN2 Amb24597648 [0,1,0,1,0,0|2,0,0]=4 13684 B12R2.517 Cc1ccc[n]c1C2CCN2 Amb24715730 [0,1,0,1,0,0|2,0,0]=4 13685 B12R2.517 Cc1ccc[n]c1[C@@H]2CCN2 Amb25836870 [0,1,0,1,0,0|2,0,0]=4 13686 B12R2.517 Cc1ccccc1C2CNC2 Amb18065237 [0,1,0,1,0,0|2,0,0]=4 13687 B12R2.517 Cc1ccccc1[C@@H]2CCN2 Amb24446967 [0,1,0,1,0,0|1,0,0]=3 13688 B12R2.517 Cc1ccccc1[C@H]2CCN2 Amb25694410 [0,1,0,1,0,0|1,0,0]=3 13689 B12R2.517 Clc1[n]cccc1C2CCC2 Amb24319277 [0,1,0,1,0,0|2,0,0]=4 13690 B12R2.517 Clc1[n]cccc1C2CCN2 Amb25118003 [0,1,0,1,0,0|2,0,0]=4 13691 B12R2.517 Clc1[n]cccc1[C@H]2CCN2 Amb25367237 [0,1,0,1,0,0|2,0,0]=4 13692 B12R2.517 Clc1c[n]ccc1[C@@H]2CCN2 Amb25836880 [0,1,0,1,0,0|2,0,0]=4 13693 B12R2.517 Clc1c[n]ccc1[C@H]2CCN2 Amb25191270 [0,1,0,1,0,0|2,0,0]=4 13694 B12R2.517 Clc1ccc[n]c1C2CCC2 Amb24082820 [0,1,0,1,0,0|2,0,0]=4 13695 B12R2.517 Clc1ccc[n]c1[C@@H]2CCN2 Amb25113502 [0,1,0,1,0,0|2,0,0]=4 13696 B12R2.517 Clc1ccccc1C2CCN2 Amb23555564 [0,1,0,1,0,0|1,0,0]=3 13697 B12R2.517 Clc1ccccc1C2CNC2 Amb18563825 [0,1,0,1,0,0|2,0,0]=4 13698 B12R2.517 Clc1ccccc1C2COC2 Amb25266061 [0,1,0,1,0,0|2,0,0]=4 13699 B12R2.517 Clc1ccccc1[C@@H]2CCN2 Amb25840853 [0,1,0,1,0,0|1,0,0]=3 13700 B12R2.517 Fc1[n]cccc1C2CCN2 Amb25694371 [0,1,0,1,0,0|2,0,0]=4 13701 B12R2.517 Fc1[n]cccc1[C@H]2CCN2 Amb25368243 [0,1,0,1,0,0|2,0,0]=4 13702 B12R2.517 Fc1c[n]ccc1[C@@H]2CCN2 Amb24351191 [0,1,0,1,0,0|2,0,0]=4 13703 B12R2.517 Fc1c[n]ccc1[C@H]2CCN2 Amb25145701 [0,1,0,1,0,0|2,0,0]=4 13704 B12R2.517 Fc1ccc[n]c1C2CCN2 Amb25151355 [0,1,0,1,0,0|2,0,0]=4 13705 B12R2.517 Fc1ccc[n]c1[C@H]2CCN2 Amb25843221 [0,1,0,1,0,0|2,0,0]=4 13706 B12R2.517 Fc1ccccc1C2CCN2 Amb20623300 [0,1,0,1,0,0|1,0,0]=3 13707 B12R2.517 Fc1ccccc1C2CCN2 Amb22059455 [0,1,0,1,0,0|1,0,0]=3 13708 B12R2.517 Fc1ccccc1C2CNC2 Amb18065350 [0,1,0,1,0,0|2,0,0]=4 13709 B12R2.517 Fc1ccccc1[C@@H]2CCN2 Amb25145827 [0,1,0,1,0,0|1,0,0]=3 13710 B12R2.517 Ic1ccccc1C2CCN2 Amb25047375 [0,1,0,1,0,0|1,0,0]=3 13711 B12R2.517 Ic1ccccc1[C@@H]2CCN2 Amb25858528 [0,1,0,1,0,0|1,0,0]=3 13712 B12R2.517 Ic1ccccc1[C@H]2CCN2 Amb25116697 [0,1,0,1,0,0|1,0,0]=3 13713 B12R2.517 Nc1[n]cccc1C2CCC2 Amb24319278 [0,1,0,1,0,0|2,0,0]=4 13714 B12R2.517 Nc1[n]cccc1[C@H]2CCN2 Amb25152813 [0,1,0,1,0,0|2,0,0]=4 13715 B12R2.517 Nc1c[n]ccc1C2CCC2 Amb24083030 [0,1,0,1,0,0|2,0,0]=4 13716 B12R2.517 Nc1c[n]ccc1C2CCN2 Amb24654762 [0,1,0,1,0,0|2,0,0]=4 13717 B12R2.517 Nc1c[n]ccc1[C@@H]2CCN2 Amb25121090 [0,1,0,1,0,0|2,0,0]=4 13718 B12R2.517 Nc1cc[n]cc1C2CCC2 Amb22737144 [0,1,0,1,0,0|2,0,0]=4 13719 B12R2.517 Nc1ccc[n]c1C2CCC2 Amb22737142 [0,1,0,1,0,0|2,0,0]=4 13720 B12R2.517 Nc1ccc[n]c1[C@@H]2CCN2 Amb25072758 [0,1,0,1,0,0|2,0,0]=4 13721 B12R2.517 Nc1ccccc1C2CCC2 Amb20617097 [0,1,0,1,0,0|1,0,0]=3 13722 B12R2.517 Nc1ccccc1C2CCN2 Amb24484457 [0,1,0,1,0,0|1,0,0]=3 13723 B12R2.517 Nc1ccccc1C2CNC2 Amb25744446 [0,1,0,1,0,0|2,0,0]=4 13724 B12R2.517 Nc1ccccc1N2CCC2 Amb25824180 [0,1,0,1,0,0|2,0,0]=4 13725 B12R2.517 Oc1[n]cccc1C2CCC2 Amb24319279 [0,1,0,1,0,0|2,0,0]=4 13726 B12R2.517 Oc1[n]cccc1C2CCN2 Amb24484517 [0,1,0,1,0,0|2,0,0]=4 13727 B12R2.517 Oc1[n]cccc1[C@@H]2CCN2 Amb24599397 [0,1,0,1,0,0|2,0,0]=4 13728 B12R2.517 Oc1[n]cccc1[C@H]2CCN2 Amb25064322 [0,1,0,1,0,0|2,0,0]=4 13729 B12R2.517 Oc1c[n]ccc1C2CCN2 Amb24670199 [0,1,0,1,0,0|2,0,0]=4 13730 B12R2.517 Oc1c[n]ccc1[C@@H]2CCN2 Amb24484440 [0,1,0,1,0,0|2,0,0]=4 13731 B12R2.517 Oc1c[n]ccc1[C@H]2CCN2 Amb24604348 [0,1,0,1,0,0|2,0,0]=4 13732 B12R2.517 Oc1ccc[n]c1C2CCC2 Amb24062587 [0,1,0,1,0,0|2,0,0]=4 13733 B12R2.517 Oc1ccc[n]c1C2CCN2 Amb25703086 [0,1,0,1,0,0|2,0,0]=4 13734 B12R2.517 Oc1ccc[n]c1[C@H]2CCN2 Amb25191269 [0,1,0,1,0,0|2,0,0]=4 13735 B12R2.517 Oc1ccccc1C2CCC2 Amb20617098 [0,1,0,1,0,0|1,0,0]=3 13736 B12R2.517 Oc1ccccc1C2CCN2 Amb24715881 [0,1,0,1,0,0|1,0,0]=3 13737 B12R2.517 Oc1ccccc1C2CNC2 Amb22228635 [0,1,0,1,0,0|2,0,0]=4 13738 B12R2.517 Oc1ccccc1C2COC2 Amb22737352 [0,1,0,1,0,0|2,0,0]=4 13739 B12R2.517 Oc1ccccc1[C@H]2CCN2 Amb25111618 [0,1,0,1,0,0|1,0,0]=3 13740 B12R2.517 Sc1ccccc1[C@@H]2CCN2 Amb25736329 [0,1,0,1,0,0|1,0,0]=3 13741 B12R2.517 Sc1ccccc1[C@H]2CCN2 Amb25152747 [0,1,0,1,0,0|1,0,0]=3 13742 B12R2.80 Brc1cccc(c1)C2CC2Br Amb23454931 [0,1,0,1,0,0|1,0,0]=3 13743 B12R2.80 CC1CC1c2cc(O)ccc2 Amb24662408 [0,1,0,1,0,0|1,0,0]=3 13744 B12R2.80 CC1OC1c2cc(Br)ccc2 Amb24731635 [0,1,0,1,0,0|2,0,0]=4 13745 B12R2.80 CC1OC1c2cc(F)ccc2 Amb25114831 [0,1,0,1,0,0|2,0,0]=4 13746 B12R2.80 CC1OC1c2cccc(c2)Cl Amb1138203 [0,1,0,1,0,0|2,0,0]=4 13747 B12R2.80 Cc1cc(ccc1)[C@@H]2C[C@@H]2Br Amb24519928 [0,1,0,1,0,0|1,0,0]=3 13748 B12R2.80 Cc1cc(ccc1)[C@@H]2C[C@H]2N Amb24100230 [0,1,0,1,0,0|1,0,0]=3 13749 B12R2.80 Cc1cccc(c1)C2OC2C Amb25131968 [0,1,0,1,0,0|2,0,0]=4 13750 B12R2.80 Clc1cc(ccc1)C2CC2Br Amb23454924 [0,1,0,1,0,0|1,0,0]=3 13751 B12R2.80 Clc1cccc(c1)C2OC2Cl Amb24441572 [0,1,0,1,0,0|2,0,0]=4 13752 B12R2.80 Clc1cccc(c1)[C@@H]2O[C@H]2Cl Amb25179053 [0,1,0,1,0,0|2,0,0]=4 13753 B12R2.80 Fc1cc(c[n]c1)C2CC2Br Amb25806922 [0,1,0,1,0,0|2,0,0]=4 13754 B12R2.80 Fc1cc(ccc1)C2CC2Br Amb23454927 [0,1,0,1,0,0|1,0,0]=3 13755 B12R2.80 Fc1cc(ccc1)[C@@H]2C[C@@H]2Br Amb24671390 [0,1,0,1,0,0|1,0,0]=3 13756 B12R2.80 NC1CC1c2cc(Br)ccc2 Amb19346489 [0,1,0,1,0,0|1,0,0]=3 13757 B12R2.80 NC1CC1c2cc(Cl)ccc2 Amb19374842 [0,1,0,1,0,0|1,0,0]=3 13758 B12R2.80 NC1CC1c2cc(F)ccc2 Amb19514818 [0,1,0,1,0,0|1,0,0]=3 13759 B12R2.80 NC1CC1c2cccc(c2)O Amb17568188 [0,1,0,1,0,0|1,0,0]=3 13760 B12R2.80 N[C@@H]1C[C@H]1c2cc(Br)ccc2 Amb25307909 [0,1,0,1,0,0|1,0,0]=3 13761 B12R2.80 N[C@@H]1C[C@H]1c2cc(Cl)ccc2 Amb25683521 [0,1,0,1,0,0|1,0,0]=3 13762 B12R2.80 N[C@@H]1C[C@H]1c2cc(F)ccc2 Amb24100228 [0,1,0,1,0,0|1,0,0]=3 13763 B12R2.80 N[C@H]1C[C@@H]1c2cc(F)ccc2 Amb24552874 [0,1,0,1,0,0|1,0,0]=3 13764 B12R2.80 OC1CC1c2cc(F)ccc2 Amb24756969 [0,1,0,1,0,0|0,0,0]=2 13765 B12R2.203 CC1CCc2cccc(N)c21 Amb24654837 [0,1,0,1,0,0|1,0,0]=3 13766 B12R2.203 CC1CCc2cccc(O)c21 Amb24631584 [0,1,0,1,0,0|1,0,0]=3 13767 B12R2.203 CC1CNc2cccc(F)c21 Amb24596681 [0,1,0,1,0,0|2,0,0]=4 13768 B12R2.203 CC1CNc2cccc(O)c21 Amb18124995 [0,1,0,1,0,0|2,0,0]=4 13769 B12R2.203 CC1COc2cccc(N)c21 Amb25694320 [0,1,0,1,0,0|2,0,0]=4 13770 B12R2.203 CC1NCc2cccc(N)c21 Amb25315263 [0,1,0,1,0,0|2,0,0]=4 13771 B12R2.203 CC1NCc2cccc(O)c21 Amb25188765 [0,1,0,1,0,0|2,0,0]=4 13772 B12R2.203 CN1CCc2cccc(Br)c12 Amb18770838 [0,1,0,1,0,0|2,0,0]=4 13773 B12R2.203 CN1CCc2cccc(N)c12 Amb18202211 [0,1,0,1,0,0|2,0,0]=4 13774 B12R2.203 C[C@@H]1NCc2cccc(F)c21 Amb25692606 [0,1,0,1,0,0|2,0,0]=4 13775 B12R2.203 C[C@@H]1NCc2cccc(I)c21 Amb25197963 [0,1,0,1,0,0|2,0,0]=4 13776 B12R2.203 C[C@@H]1NCc2cccc(N)c21 Amb24623869 [0,1,0,1,0,0|2,0,0]=4 13777 B12R2.203 C[C@H]1NCc2cccc(Cl)c21 Amb25121260 [0,1,0,1,0,0|2,0,0]=4 13778 B12R2.203 C[C@H]1NCc2cccc(O)c21 Amb24730569 [0,1,0,1,0,0|2,0,0]=4 13779 B12R2.203 Cc1c[n]cc2CCC(C)c12 Amb24103079 [0,1,0,1,0,0|2,0,0]=4 13780 B12R2.203 Cc1cccc2CCC(F)c21 Amb25207950 [0,1,0,1,0,0|1,0,0]=3 13781 B12R2.203 Cc1cccc2CCC(O)c21 Amb22886909 [0,1,0,1,0,0|0,0,0]=2 13782 B12R2.203 Cc1cccc2CCN(C)c12 Amb24351888 [0,1,0,1,0,0|2,0,0]=4 13783 B12R2.203 Cc1cccc2CC[C@@H](N)c21 Amb24398373 [0,1,0,1,0,0|1,0,0]=3 13784 B12R2.203 Cc1cccc2CC[C@@H](O)c21 Amb25032595 [0,1,0,1,0,0|0,0,0]=2 13785 B12R2.203 Cc1cccc2CC[C@H](O)c21 Amb24412154 [0,1,0,1,0,0|0,0,0]=2 13786 B12R2.203 Cc1cccc2CNC(C)c12 Amb25244716 [0,1,0,1,0,0|2,0,0]=4 13787 B12R2.203 Cc1cccc2CN[C@@H](C)c12 Amb24731811 [0,1,0,1,0,0|2,0,0]=4 13788 B12R2.203 Cc1cccc2COB(O)c21 Amb25726432 [0,1,0,1,0,0|2,0,0]=4 13789 B12R2.203 NC1CCc2cccc(Br)c21 Amb24667972 [0,1,0,1,0,0|1,0,0]=3 13790 B12R2.203 NC1CCc2cccc(F)c21 Amb25279315 [0,1,0,1,0,0|1,0,0]=3 13791 B12R2.203 NC1CCc2cccc(O)c21 Amb25800015 [0,1,0,1,0,0|1,0,0]=3 13792 B12R2.203 NC1CCc2cccc(S)c21 Amb25702433 [0,1,0,1,0,0|1,0,0]=3 13793 B12R2.203 NC1COc2cccc(Br)c21 Amb24428244 [0,1,0,1,0,0|2,0,0]=4 13794 B12R2.203 N[C@@H]1CCc2cccc(Cl)c21 Amb25073529 [0,1,0,1,0,0|1,0,0]=3 13795 B12R2.203 N[C@@H]1CCc2cccc(I)c21 Amb25685478 [0,1,0,1,0,0|1,0,0]=3 13796 B12R2.203 N[C@@H]1CCc2cccc(O)c21 Amb24700449 [0,1,0,1,0,0|1,0,0]=3 13797 B12R2.203 N[C@@H]1COc2cccc(Cl)c21 Amb25335511 [0,1,0,1,0,0|2,0,0]=4 13798 B12R2.203 N[C@@H]1COc2cccc(F)c21 Amb24377677 [0,1,0,1,0,0|2,0,0]=4 13799 B12R2.203 N[C@@H]1COc2cccc(I)c21 Amb24663226 [0,1,0,1,0,0|2,0,0]=4 13800 B12R2.203 N[C@H]1CCc2cccc(Br)c21 Amb24728314 [0,1,0,1,0,0|1,0,0]=3 13801 B12R2.203 N[C@H]1CCc2cccc(I)c21 Amb25780692 [0,1,0,1,0,0|1,0,0]=3 13802 B12R2.203 N[C@H]1CCc2cccc(O)c21 Amb25068419 [0,1,0,1,0,0|1,0,0]=3 13803 B12R2.203 N[C@H]1CCc2cccc(S)c21 Amb24726197 [0,1,0,1,0,0|1,0,0]=3 13804 B12R2.203 N[C@H]1COc2cccc(Br)c21 Amb25322414 [0,1,0,1,0,0|2,0,0]=4 13805 B12R2.203 N[C@H]1COc2cccc(I)c21 Amb25147881 [0,1,0,1,0,0|2,0,0]=4 13806 B12R2.203 N[C@H]1COc2cccc(O)c21 Amb25152826 [0,1,0,1,0,0|2,0,0]=4 13807 B12R2.203 Nc1cccc2CC[C@@H](N)c12 Amb25066858 [0,1,0,1,0,0|1,0,0]=3 13808 B12R2.203 Nc1cccc2OC[C@@H](N)c12 Amb25277392 [0,1,0,1,0,0|2,0,0]=4 13809 B12R2.203 O=C1CCc2c1c(Br)ccc2 Amb16232616 [0,1,0,1,0,0|0,0,2]=4 13810 B12R2.203 O=C1CCc2c1c(C)ccc2 Amb16232631 [0,1,0,1,0,0|0,0,2]=4 13811 B12R2.203 O=C1CCc2c1c(F)ccc2 Amb10603926 [0,1,0,1,0,0|0,0,2]=4 13812 B12R2.203 O=C1CCc2c1c(I)ccc2 Amb10602520 [0,1,0,1,0,0|0,0,2]=4 13813 B12R2.203 O=C1CCc2c1c(N)ccc2 Amb10603890 [0,1,0,1,0,0|0,0,2]=4 13814 B12R2.203 OB1OCc2cccc(Br)c21 Amb24340409 [0,1,0,1,0,0|2,0,0]=4 13815 B12R2.203 OB1OCc2cccc(Cl)c21 Amb24644214 [0,1,0,1,0,0|2,0,0]=4 13816 B12R2.203 OC1CCC2=CC=CC(=O)N21 Amb25734398 [0,1,0,1,0,0|1,0,0]=3 13817 B12R2.203 OC1CCc2cccc(Br)c21 Amb24439435 [0,1,0,1,0,0|0,0,0]=2 13818 B12R2.203 OC1COc2cccc(Cl)c21 Amb25806676 [0,1,0,1,0,0|1,0,0]=3 13819 B12R2.203 OC1CSc2cccc(Cl)c21 Amb24386853 [0,1,0,1,0,0|1,0,0]=3 13820 B12R2.203 Oc1ccc[n+]2CCC(O)c21 Amb25156843 [0,1,0,1,0,0|1,0,0]=3 13821 B12R2.203 Oc1cccc2CCC(O)c12 Amb18125105 [0,1,0,1,0,0|0,0,0]=2 13822 B12R2.203 Oc1cccc2CC[C@@H](O)c12 Amb24449232 [0,1,0,1,0,0|0,0,0]=2 13823 B12R2.203 Oc1cccc2CC[C@H](O)c12 Amb24746238 [0,1,0,1,0,0|0,0,0]=2 13824 B12R2.203 Oc1cccc2COB(O)c12 Amb24396270 [0,1,0,1,0,0|2,0,0]=4 13825 B12R2.203 Oc1cccc2OCC(O)c12 Amb25334991 [0,1,0,1,0,0|1,0,0]=3 13826 B12R2.612 Brc1ccc2c(c1)CCC2N Amb10609946 [0,1,0,1,0,0|1,0,0]=3 13827 B12R2.612 C=C1CCc2cc(Br)ccc21 Amb22229945 [0,1,0,1,0,0|1,0,1]=4 13828 B12R2.612 C=C1CCc2cc(Cl)ccc21 Amb24369315 [0,1,0,1,0,0|1,0,1]=4 13829 B12R2.612 C=C1CCc2cc(F)ccc21 Amb24411882 [0,1,0,1,0,0|1,0,1]=4 13830 B12R2.612 C=C1CCc2cc(N)ccc21 Amb25837088 [0,1,0,1,0,0|1,0,1]=4 13831 B12R2.612 CC1CCc2cc(N)ccc21 Amb25150570 [0,1,0,1,0,0|1,0,0]=3 13832 B12R2.612 CC1CCc2cc(O)ccc21 Amb24099163 [0,1,0,1,0,0|1,0,0]=3 13833 B12R2.612 CC1CNc2cc(Br)ccc21 Amb25103823 [0,1,0,1,0,0|2,0,0]=4 13834 B12R2.612 CC1CNc2cc(O)ccc21 Amb24401085 [0,1,0,1,0,0|2,0,0]=4 13835 B12R2.612 CC1COc2cc(F)ccc21 Amb24438567 [0,1,0,1,0,0|2,0,0]=4 13836 B12R2.612 CC1COc2cc(O)ccc21 Amb18125119 [0,1,0,1,0,0|2,0,0]=4 13837 B12R2.612 CC1NCc2cc(Br)ccc21 Amb19516198 [0,1,0,1,0,0|2,0,0]=4 13838 B12R2.612 CC1NCc2cc(Br)ccc21 Amb20242991 [0,1,0,1,0,0|2,0,0]=4 13839 B12R2.612 CC1NCc2cc(Cl)ccc21 Amb24683804 [0,1,0,1,0,0|2,0,0]=4 13840 B12R2.612 CC1NCc2cc(N)ccc21 Amb25842482 [0,1,0,1,0,0|2,0,0]=4 13841 B12R2.612 CC1NCc2cc(O)ccc21 Amb24730776 [0,1,0,1,0,0|2,0,0]=4 13842 B12R2.612 CC1OCc2cc(O)ccc21 Amb24486465 [0,1,0,1,0,0|2,0,0]=4 13843 B12R2.612 CN1CCc2cc(O)ccc12 Amb24606547 [0,1,0,1,0,0|2,0,0]=4 13844 B12R2.612 C[C@@H]1NCc2cc(Br)ccc21 Amb24561131 [0,1,0,1,0,0|2,0,0]=4 13845 B12R2.612 C[C@H]1NCc2cc(Br)ccc21 Amb20242968 [0,1,0,1,0,0|2,0,0]=4 13846 B12R2.612 C[C@H]1NCc2cc(F)ccc21 Amb24403085 [0,1,0,1,0,0|2,0,0]=4 13847 B12R2.612 C[C@H]1NCc2cc(N)ccc21 Amb24642600 [0,1,0,1,0,0|2,0,0]=4 13848 B12R2.612 Cc1cc2CCC(=S)c2cc1 Amb25151236 [0,1,0,1,0,0|0,1,1]=4 13849 B12R2.612 Cc1cc2CCC(Cl)c2cc1 Amb24484465 [0,1,0,1,0,0|1,0,0]=3 13850 B12R2.612 Cc1cc2CCC(N)c2[n]c1 Amb24630389 [0,1,0,1,0,0|2,0,0]=4 13851 B12R2.612 Cc1cc2CCC(O)c2cc1 Amb21964865 [0,1,0,1,0,0|0,0,0]=2 13852 B12R2.612 Cc1cc2CCN(N)c2cc1 Amb24569532 [0,1,0,1,0,0|2,0,0]=4 13853 B12R2.612 Cc1cc2CC[C@H](N)c2[n]c1 Amb24447124 [0,1,0,1,0,0|2,0,0]=4 13854 B12R2.612 Cc1cc2OCC(O)c2cc1 Amb25136134 [0,1,0,1,0,0|1,0,0]=3 13855 B12R2.612 Cc1cc2OC[C@@H](N)c2cc1 Amb24365216 [0,1,0,1,0,0|2,0,0]=4 13856 B12R2.612 Cc1cc2OC[C@H](N)c2cc1 Amb25335510 [0,1,0,1,0,0|2,0,0]=4 13857 B12R2.612 Cc1ccc2B(O)OCc2c1 Amb25771094 [0,1,0,1,0,0|2,0,0]=4 13858 B12R2.612 Cc1ccc2C(O)OCc2c1 Amb24354413 [0,1,0,1,0,0|1,0,0]=3 13859 B12R2.612 Cc1ccc2c(CCN2C)c1 Amb25318233 [0,1,0,1,0,0|2,0,0]=4 13860 B12R2.612 Cc1ccc2c(c1)CCC2N Amb10609950 [0,1,0,1,0,0|1,0,0]=3 13861 B12R2.612 ClC1CCc2cc(Br)ccc21 Amb22001687 [0,1,0,1,0,0|1,0,0]=3 13862 B12R2.612 Clc1ccc2C(Cl)CCc2c1 Amb25351129 [0,1,0,1,0,0|1,0,0]=3 13863 B12R2.612 Clc1ccc2c(c1)CCC2N Amb10609861 [0,1,0,1,0,0|1,0,0]=3 13864 B12R2.612 Clc1ccc2c(c1)CC[C@@H]2N Amb13953031 [0,1,0,1,0,0|1,0,0]=3 13865 B12R2.612 Clc1ccc2c(c1)CC[C@@H]2O Amb13953030 [0,1,0,1,0,0|0,0,0]=2 13866 B12R2.612 Clc1ccc2c(c1)CC[C@H]2N Amb13953032 [0,1,0,1,0,0|1,0,0]=3 13867 B12R2.612 Clc1ccc2c(c1)CC[C@H]2O Amb13953029 [0,1,0,1,0,0|0,0,0]=2 13868 B12R2.612 FC1CCc2cc(Cl)ccc21 Amb24513908 [0,1,0,1,0,0|1,0,0]=3 13869 B12R2.612 Fc1cc2CCC(Br)c2cc1 Amb24461653 [0,1,0,1,0,0|1,0,0]=3 13870 B12R2.612 Fc1ccc2c(c1)CCC2N Amb10609896 [0,1,0,1,0,0|1,0,0]=3 13871 B12R2.612 Fc1ccc2c(c1)CC[C@@H]2N Amb13953037 [0,1,0,1,0,0|1,0,0]=3 13872 B12R2.612 Fc1ccc2c(c1)CC[C@@H]2O Amb13953033 [0,1,0,1,0,0|0,0,0]=2 13873 B12R2.612 Fc1ccc2c(c1)CC[C@H]2N Amb13953036 [0,1,0,1,0,0|1,0,0]=3 13874 B12R2.612 Fc1ccc2c(c1)CC[C@H]2O Amb13953035 [0,1,0,1,0,0|0,0,0]=2 13875 B12R2.612 Ic1ccc2c(c1)CCC2=O Amb10602519 [0,1,0,1,0,0|0,0,2]=4 13876 B12R2.612 NC1CCc2[n]c(Br)ccc21 Amb25735551 [0,1,0,1,0,0|2,0,0]=4 13877 B12R2.612 NC1CCc2cc(I)ccc21 Amb25215234 [0,1,0,1,0,0|1,0,0]=3 13878 B12R2.612 NC1CCc2cc(S)ccc21 Amb25378804 [0,1,0,1,0,0|1,0,0]=3 13879 B12R2.612 NC1CNc2cc(Br)ccc21 Amb25311429 [0,1,0,1,0,0|2,0,0]=4 13880 B12R2.612 NC1COc2cc(Br)ccc21 Amb19516088 [0,1,0,1,0,0|2,0,0]=4 13881 B12R2.612 NC1COc2cc(Br)ccc21 Amb21962144 [0,1,0,1,0,0|2,0,0]=4 13882 B12R2.612 NC1COc2cc(I)ccc21 Amb25731928 [0,1,0,1,0,0|2,0,0]=4 13883 B12R2.612 NC1COc2cc(S)ccc21 Amb24484478 [0,1,0,1,0,0|2,0,0]=4 13884 B12R2.612 NN1CCc2cc(F)ccc12 Amb25178613 [0,1,0,1,0,0|2,0,0]=4 13885 B12R2.612 N[C@@H]1CCc2cc(Br)ccc21 Amb22745142 [0,1,0,1,0,0|1,0,0]=3 13886 B12R2.612 N[C@@H]1CCc2cc(Br)ccc21 Amb22745143 [0,1,0,1,0,0|1,0,0]=3 13887 B12R2.612 N[C@@H]1CCc2cc(F)ccc21 Amb22288667 [0,1,0,1,0,0|1,0,0]=3 13888 B12R2.612 N[C@@H]1CCc2cc(I)ccc21 Amb25726414 [0,1,0,1,0,0|1,0,0]=3 13889 B12R2.612 N[C@@H]1CCc2cc(O)ccc21 Amb25841173 [0,1,0,1,0,0|1,0,0]=3 13890 B12R2.612 N[C@@H]1COc2cc(Br)ccc21 Amb24462735 [0,1,0,1,0,0|2,0,0]=4 13891 B12R2.612 N[C@@H]1COc2cc(O)ccc21 Amb24418721 [0,1,0,1,0,0|2,0,0]=4 13892 B12R2.612 N[C@H]1CCc2cc(F)ccc21 Amb22270166 [0,1,0,1,0,0|1,0,0]=3 13893 B12R2.612 N[C@H]1COc2cc(I)ccc21 Amb25764549 [0,1,0,1,0,0|2,0,0]=4 13894 B12R2.612 N[C@H]1COc2cc(O)ccc21 Amb25737189 [0,1,0,1,0,0|2,0,0]=4 13895 B12R2.612 Nc1cc2CCC(O)c2cc1 Amb24386265 [0,1,0,1,0,0|0,0,0]=2 13896 B12R2.612 Nc1cc2CC[C@@H](O)c2cc1 Amb24474275 [0,1,0,1,0,0|0,0,0]=2 13897 B12R2.612 Nc1cc2CC[C@H](O)c2cc1 Amb24733416 [0,1,0,1,0,0|0,0,0]=2 13898 B12R2.612 Nc1ccc2C(N)COc2c1 Amb24763672 [0,1,0,1,0,0|2,0,0]=4 13899 B12R2.612 Nc1ccc2[C@@H](N)COc2c1 Amb25719428 [0,1,0,1,0,0|2,0,0]=4 13900 B12R2.612 Nc1ccc2c(c1)CCC2=O Amb1348304 [0,1,0,1,0,0|0,0,2]=4 13901 B12R2.612 Nc1ccc2c(c1)CCC2N Amb13952222 [0,1,0,1,0,0|1,0,0]=3 13902 B12R2.612 Nc1ccc2c(c1)CCN2C Amb13952548 [0,1,0,1,0,0|2,0,0]=4 13903 B12R2.612 Nc1ccc2c(c1)CCN2C Amb13998577 [0,1,0,1,0,0|2,0,0]=4 13904 B12R2.612 O=C1CCc2cc(S)ccc21 Amb24458838 [0,1,0,1,0,0|0,0,2]=4 13905 B12R2.612 OB1OCc2cc(Cl)ccc21 Amb24271171 [0,1,0,1,0,0|2,0,0]=4 13906 B12R2.612 OB1OCc2cc(F)ccc21 Amb22740055 [0,1,0,1,0,0|2,0,0]=4 13907 B12R2.612 OC1CCc2[n]c(Br)ccc21 Amb25723038 [0,1,0,1,0,0|1,0,0]=3 13908 B12R2.612 OC1CCc2[n]c(Cl)ccc21 Amb25735914 [0,1,0,1,0,0|1,0,0]=3 13909 B12R2.612 OC1CCc2cc(Br)c[n]c21 Amb24451685 [0,1,0,1,0,0|1,0,0]=3 13910 B12R2.612 OC1CCc2cc(Cl)ccc21 Amb22001631 [0,1,0,1,0,0|0,0,0]=2 13911 B12R2.612 OC1CCc2cc(F)ccc21 Amb22756387 [0,1,0,1,0,0|0,0,0]=2 13912 B12R2.612 OC1COc2cc(Br)ccc21 Amb22751582 [0,1,0,1,0,0|1,0,0]=3 13913 B12R2.612 OC1OCc2cc(Cl)ccc21 Amb22751579 [0,1,0,1,0,0|1,0,0]=3 13914 B12R2.612 O[C@@H]1CCc2cc(Br)ccc21 Amb22886733 [0,1,0,1,0,0|0,0,0]=2 13915 B12R2.612 O[C@H]1CCc2cc(Br)ccc21 Amb24420879 [0,1,0,1,0,0|0,0,0]=2 13916 B12R2.612 Oc1ccc2B(O)OCc2c1 Amb24665939 [0,1,0,1,0,0|2,0,0]=4 13917 B12R2.612 Oc1ccc2C(O)CCc2c1 Amb22001818 [0,1,0,1,0,0|0,0,0]=2 13918 B12R2.612 Oc1ccc2c(c1)OCC2N Amb1131908 [0,1,0,1,0,0|2,0,0]=4 13919 B12R2.612 S=C1CCc2cc(Br)ccc21 Amb24361326 [0,1,0,1,0,0|0,1,1]=4 13920 B12R2.612 SC1CCc2cc(Br)ccc21 Amb25821808 [0,1,0,1,0,0|0,1,0]=3 13921 B12R2.612 SC1CCc2cc(Cl)ccc21 Amb24639650 [0,1,0,1,0,0|0,1,0]=3 13922 B12R2.1286 Brc1cc(ccc1)NC2CC2 Amb24622562 [0,1,0,1,0,0|2,0,0]=4 13923 B12R2.1286 Brc1cc(ccc1)OC2CC2 Amb22057669 [0,1,0,1,0,0|2,0,0]=4 13924 B12R2.1286 Brc1cc(ccc1)SC2CC2 Amb22831516 [0,1,0,1,0,0|2,0,0]=4 13925 B12R2.1286 Cc1cc(ccc1)NC2CC2 Amb25068491 [0,1,0,1,0,0|2,0,0]=4 13926 B12R2.1286 Cc1cc(ccc1)OC2CC2 Amb24753468 [0,1,0,1,0,0|2,0,0]=4 13927 B12R2.1286 Clc1cc(ccc1)NC2CC2 Amb18930890 [0,1,0,1,0,0|2,0,0]=4 13928 B12R2.1286 Fc1cc(CC2CO2)c[n]c1 Amb25211203 [0,1,0,1,0,0|1,0,0]=3 13929 B12R2.1286 Fc1cc(CC2CO2)ccc1 Amb24558530 [0,1,0,1,0,0|0,0,0]=2 13930 B12R2.1286 Fc1cc(ccc1)NC2CC2 Amb18270328 [0,1,0,1,0,0|2,0,0]=4 13931 B12R2.1286 Fc1cc(ccc1)OC2CC2 Amb25798491 [0,1,0,1,0,0|2,0,0]=4 13932 B12R2.1286 Nc1cc(CC2CC2)cc[n]1 Amb24353777 [0,1,0,1,0,0|2,0,0]=4 13933 B12R2.1286 Nc1cc(ccc1)OC2CC2 Amb22011837 [0,1,0,1,0,0|2,0,0]=4 13934 B12R2.1286 Oc1cc(ccc1)NC2CC2 Amb24464849 [0,1,0,1,0,0|2,0,0]=4 13935 B12R2.1286 Oc1cc(ccc1)OC2CC2 Amb24085348 [0,1,0,1,0,0|2,0,0]=4 13936 B12R2.1286 Oc1cc(ccc1)SC2CC2 Amb24695084 [0,1,0,1,0,0|2,0,0]=4 13937 B12R2.1286 Sc1cc(ccc1)OC2CC2 Amb25831029 [0,1,0,1,0,0|2,0,0]=4 13938 B12R2.1783 N#CC1Cc2cccc(F)c21 Amb25681332 [0,1,0,1,0,0|1,0,1]=4 13939 B12R2.2313 Brc1cc([n]cc1)[C@@H]2CCN2 Amb24668866 [0,1,0,1,0,0|2,0,0]=4 13940 B12R2.2313 Brc1cc(c[n]c1)C2CCC2 Amb20617714 [0,1,0,1,0,0|2,0,0]=4 13941 B12R2.2313 Brc1cc(c[n]c1)[C@@H]2CCN2 Amb24522968 [0,1,0,1,0,0|2,0,0]=4 13942 B12R2.2313 Brc1cc(c[n]c1)[C@H]2CCN2 Amb25149065 [0,1,0,1,0,0|2,0,0]=4 13943 B12R2.2313 Brc1cc(cc[n]1)[C@H]2CCN2 Amb25739247 [0,1,0,1,0,0|2,0,0]=4 13944 B12R2.2313 Brc1cc(ccc1)C2CCC2 Amb20617094 [0,1,0,1,0,0|1,0,0]=3 13945 B12R2.2313 Brc1cc(ccc1)C2CNC2 Amb18066357 [0,1,0,1,0,0|2,0,0]=4 13946 B12R2.2313 Brc1cc(ccc1)C2COC2 Amb22737351 [0,1,0,1,0,0|2,0,0]=4 13947 B12R2.2313 Brc1cc(ccc1)C=2CCC2 Amb24707396 [0,1,0,1,0,0|1,0,1]=4 13948 B12R2.2313 Brc1cc(ccc1)[C@H]2CCN2 Amb25149014 [0,1,0,1,0,0|1,0,0]=3 13949 B12R2.2313 Brc1cccc([n]1)[C@H]2CCN2 Amb25800124 [0,1,0,1,0,0|2,0,0]=4 13950 B12R2.2313 Brc1cccc(n1)C2CCC2 Amb10599978 [0,1,0,1,0,0|2,0,0]=4 13951 B12R2.2313 Brc1ccnc(c1)C2CCC2 Amb10599776 [0,1,0,1,0,0|2,0,0]=4 13952 B12R2.2313 Brc1nccc(c1)C2CCC2 Amb10599981 [0,1,0,1,0,0|2,0,0]=4 13953 B12R2.2313 Cc1cc(c[n]c1)[C@@H]2CCN2 Amb24470667 [0,1,0,1,0,0|2,0,0]=4 13954 B12R2.2313 Cc1cc(c[n]c1)[C@H]2CCN2 Amb24715915 [0,1,0,1,0,0|2,0,0]=4 13955 B12R2.2313 Cc1cc(cc[n]1)C2CCN2 Amb25041966 [0,1,0,1,0,0|2,0,0]=4 13956 B12R2.2313 Cc1cc(cc[n]1)[C@@H]2CCN2 Amb25145702 [0,1,0,1,0,0|2,0,0]=4 13957 B12R2.2313 Cc1cc(cc[n]1)[C@H]2CCN2 Amb25063620 [0,1,0,1,0,0|2,0,0]=4 13958 B12R2.2313 Cc1cc(ccc1)C2CNC2 Amb18065251 [0,1,0,1,0,0|2,0,0]=4 13959 B12R2.2313 Clc1cc([n]cc1)C2CCC2 Amb24083020 [0,1,0,1,0,0|2,0,0]=4 13960 B12R2.2313 Clc1cc([n]cc1)[C@@H]2CCN2 Amb24738587 [0,1,0,1,0,0|2,0,0]=4 13961 B12R2.2313 Clc1cc(c[n]c1)C2CCC2 Amb24082822 [0,1,0,1,0,0|2,0,0]=4 13962 B12R2.2313 Clc1cc(c[n]c1)[C@@H]2CCN2 Amb25145842 [0,1,0,1,0,0|2,0,0]=4 13963 B12R2.2313 Clc1cc(c[n]c1)[C@H]2CCN2 Amb24427269 [0,1,0,1,0,0|2,0,0]=4 13964 B12R2.2313 Clc1cc(cc[n]1)C2CCN2 Amb24687212 [0,1,0,1,0,0|2,0,0]=4 13965 B12R2.2313 Clc1cc(ccc1)C2CNC2 Amb18563826 [0,1,0,1,0,0|2,0,0]=4 13966 B12R2.2313 Clc1cc(ccc1)C2COC2 Amb24739899 [0,1,0,1,0,0|2,0,0]=4 13967 B12R2.2313 Clc1cccc([n]1)C2CCC2 Amb24082413 [0,1,0,1,0,0|2,0,0]=4 13968 B12R2.2313 Clc1cccc([n]1)C2CCN2 Amb24484519 [0,1,0,1,0,0|2,0,0]=4 13969 B12R2.2313 Clc1cccc([n]1)[C@H]2CCN2 Amb25831545 [0,1,0,1,0,0|2,0,0]=4 13970 B12R2.2313 Fc1cc([n]cc1)C2CCC2 Amb24319239 [0,1,0,1,0,0|2,0,0]=4 13971 B12R2.2313 Fc1cc(c[n]c1)[C@@H]2CCN2 Amb24745651 [0,1,0,1,0,0|2,0,0]=4 13972 B12R2.2313 Fc1cc(c[n]c1)[C@H]2CCN2 Amb25145700 [0,1,0,1,0,0|2,0,0]=4 13973 B12R2.2313 Fc1cc(cc[n]1)C2CCN2 Amb25340514 [0,1,0,1,0,0|2,0,0]=4 13974 B12R2.2313 Fc1cc(cc[n]1)[C@@H]2CCN2 Amb24427252 [0,1,0,1,0,0|2,0,0]=4 13975 B12R2.2313 Fc1cc(cc[n]1)[C@H]2CCN2 Amb25292217 [0,1,0,1,0,0|2,0,0]=4 13976 B12R2.2313 Fc1cc(ccc1)C2CCN2 Amb19375411 [0,1,0,1,0,0|1,0,0]=3 13977 B12R2.2313 Fc1cc(ccc1)C2CCN2 Amb25273667 [0,1,0,1,0,0|1,0,0]=3 13978 B12R2.2313 Fc1cc(ccc1)C2CNC2 Amb20669554 [0,1,0,1,0,0|2,0,0]=4 13979 B12R2.2313 Fc1cc(ccc1)C2CNC2 Amb22055311 [0,1,0,1,0,0|2,0,0]=4 13980 B12R2.2313 Fc1cc(ccc1)C2COC2 Amb25219965 [0,1,0,1,0,0|2,0,0]=4 13981 B12R2.2313 Fc1cc(ccc1)[C@@H]2CCN2 Amb24753481 [0,1,0,1,0,0|1,0,0]=3 13982 B12R2.2313 Fc1cccc([n]1)C2CCC2 Amb24319187 [0,1,0,1,0,0|2,0,0]=4 13983 B12R2.2313 Fc1cccc([n]1)C2CCN2 Amb25046608 [0,1,0,1,0,0|2,0,0]=4 13984 B12R2.2313 Fc1cccc([n]1)[C@@H]2CCN2 Amb25145692 [0,1,0,1,0,0|2,0,0]=4 13985 B12R2.2313 Fc1cccc([n]1)[C@H]2CCN2 Amb24349712 [0,1,0,1,0,0|2,0,0]=4 13986 B12R2.2313 Ic1cc(ccc1)C2CCN2 Amb24444284 [0,1,0,1,0,0|1,0,0]=3 13987 B12R2.2313 Nc1cc([n]cc1)C2CCN2 Amb24453203 [0,1,0,1,0,0|2,0,0]=4 13988 B12R2.2313 Nc1cc([n]cc1)[C@@H]2CCN2 Amb24466115 [0,1,0,1,0,0|2,0,0]=4 13989 B12R2.2313 Nc1cc([n]cc1)[C@H]2CCN2 Amb25044374 [0,1,0,1,0,0|2,0,0]=4 13990 B12R2.2313 Nc1cc(c[n]c1)C2CCC2 Amb20617715 [0,1,0,1,0,0|2,0,0]=4 13991 B12R2.2313 Nc1cc(c[n]c1)C2CCN2 Amb24622460 [0,1,0,1,0,0|2,0,0]=4 13992 B12R2.2313 Nc1cc(c[n]c1)[C@H]2CCN2 Amb25808528 [0,1,0,1,0,0|2,0,0]=4 13993 B12R2.2313 Nc1cc(cc[n]1)[C@H]2CCN2 Amb24736128 [0,1,0,1,0,0|2,0,0]=4 13994 B12R2.2313 Nc1cc(ccc1)C2CCC2 Amb20617095 [0,1,0,1,0,0|1,0,0]=3 13995 B12R2.2313 Nc1cc(ccc1)C2CNC2 Amb25292216 [0,1,0,1,0,0|2,0,0]=4 13996 B12R2.2313 Nc1cc(ccc1)[C@@H]2CCN2 Amb25152853 [0,1,0,1,0,0|1,0,0]=3 13997 B12R2.2313 Nc1cc(ccc1)[C@H]2CCN2 Amb25839840 [0,1,0,1,0,0|1,0,0]=3 13998 B12R2.2313 Nc1cccc([n]1)C2CCN2 Amb25727312 [0,1,0,1,0,0|2,0,0]=4 13999 B12R2.2313 Nc1cccc([n]1)[C@@H]2CCN2 Amb25830500 [0,1,0,1,0,0|2,0,0]=4 14000 B12R2.2313 Nc1cccc([n]1)[C@H]2CCN2 Amb24753227 [0,1,0,1,0,0|2,0,0]=4 14001 B12R2.2313 Nc1cccc(n1)C2CCC2 Amb10599979 [0,1,0,1,0,0|2,0,0]=4 14002 B12R2.2313 Nc1ccnc(c1)C2CCC2 Amb10599777 [0,1,0,1,0,0|2,0,0]=4 14003 B12R2.2313 Nc1nccc(c1)C2CCC2 Amb10599982 [0,1,0,1,0,0|2,0,0]=4 14004 B12R2.2313 Oc1cc(c[n]c1)C2CCC2 Amb20617716 [0,1,0,1,0,0|2,0,0]=4 14005 B12R2.2313 Oc1cc(ccc1)C2CCC2 Amb20617090 [0,1,0,1,0,0|1,0,0]=3 14006 B12R2.2313 Oc1cc(ccc1)C2CCN2 Amb24085164 [0,1,0,1,0,0|1,0,0]=3 14007 B12R2.2313 Oc1cc(ccc1)[C@@H]2CCN2 Amb25064272 [0,1,0,1,0,0|1,0,0]=3 14008 B12R2.2313 Oc1cccc(n1)C2CCC2 Amb10599980 [0,1,0,1,0,0|2,0,0]=4 14009 B12R2.2313 Oc1ccnc(c1)C2CCC2 Amb10599778 [0,1,0,1,0,0|2,0,0]=4 14010 B12R2.2313 Oc1nccc(c1)C2CCC2 Amb10599983 [0,1,0,1,0,0|2,0,0]=4 14011 B12R2.2313 Sc1cc(ccc1)C2CNC2 Amb25152864 [0,1,0,1,0,0|2,0,0]=4 14012 B12R2.2313 Sc1cc(ccc1)[C@@H]2CCN2 Amb24465071 [0,1,0,1,0,0|1,0,0]=3 14013 B12R2.1 BrCC1C=Cc2ccccc21 Amb25095724 [0,1,0,1,0,0|1,0,1]=4 14014 B12R2.1 BrCC1CCc2ccccc21 Amb22500999 [0,1,0,1,0,0|1,0,0]=3 14015 B12R2.1 BrCC1COc2ccccc21 Amb25063018 [0,1,0,1,0,0|1,0,0]=3 14016 B12R2.1 BrCC1CSc2ccccc21 Amb25720096 [0,1,0,1,0,0|1,0,0]=3 14017 B12R2.1 BrC[C@@H]1COc2ccccc21 Amb25694007 [0,1,0,1,0,0|1,0,0]=3 14018 B12R2.1 BrC[C@H]1COc2ccccc21 Amb24368636 [0,1,0,1,0,0|1,0,0]=3 14019 B12R2.1 C=CC1CNc2ccccc21 Amb24486031 [0,1,0,1,0,0|1,0,1]=4 14020 B12R2.1 CCC1CCc2ccccc21 Amb20248519 [0,1,0,1,0,0|1,0,0]=3 14021 B12R2.1 CCC1NCc2ccccc21 Amb24377125 [0,1,0,1,0,0|1,0,0]=3 14022 B12R2.1 CCC1SCc2ccccc21 Amb24092839 [0,1,0,1,0,0|1,0,0]=3 14023 B12R2.1 CCN1CCc2ccccc12 Amb17689295 [0,1,0,1,0,0|1,0,0]=3 14024 B12R2.1 CCN1CNc2ccccc12 Amb24064698 [0,1,0,1,0,0|2,0,0]=4 14025 B12R2.1 CCN1COc2ccccc12 Amb24102073 [0,1,0,1,0,0|2,0,0]=4 14026 B12R2.1 CCN1CSc2c1cccc2 Amb10571430 [0,1,0,1,0,0|2,0,0]=4 14027 B12R2.1 CNC1CCc2c1cccc2 Amb1117068 [0,1,0,1,0,0|1,0,0]=3 14028 B12R2.1 CNC1CCc2c[n]ccc21 Amb24679526 [0,1,0,1,0,0|2,0,0]=4 14029 B12R2.1 CNC1CCc2ccccc21 Amb22757336 [0,1,0,1,0,0|1,0,0]=3 14030 B12R2.1 CN[C@@H]1CCc2ccccc21 Amb25808104 [0,1,0,1,0,0|1,0,0]=3 14031 B12R2.1 COC1=CCc2ccccc12 Amb17778910 [0,1,0,1,0,0|0,0,2]=4 14032 B12R2.1 COC1=NCc2ccccc12 Amb24527731 [0,1,0,1,0,0|1,0,1]=4 14033 B12R2.1 COC1COc2ccccc21 Amb24102318 [0,1,0,1,0,0|1,0,0]=3 14034 B12R2.1 COC1OCc2ccccc21 Amb24323529 [0,1,0,1,0,0|1,0,0]=3 14035 B12R2.1 CSC1CCc2ccccc21 Amb24684843 [0,1,0,1,0,0|0,1,0]=3 14036 B12R2.1 ClCC1C=Cc2ccccc21 Amb24556989 [0,1,0,1,0,0|1,0,1]=4 14037 B12R2.1 ClCC1CCc2[n]cccc21 Amb24609570 [0,1,0,1,0,0|2,0,0]=4 14038 B12R2.1 ClCC1CCc2ccc[n]c21 Amb24674205 [0,1,0,1,0,0|2,0,0]=4 14039 B12R2.1 ClCC1CCc2ccccc21 Amb22500998 [0,1,0,1,0,0|1,0,0]=3 14040 B12R2.1 ClC[N+]1=c2ccccc2=NC1 Amb10552956 [0,1,0,1,0,0|2,0,0]=4 14041 B12R2.1 Cl\C=C/1\CCc2ccccc21 Amb24519209 [0,1,0,1,0,0|1,0,1]=4 14042 B12R2.1 FCC1CNc2ccccc21 Amb25178926 [0,1,0,1,0,0|1,0,0]=3 14043 B12R2.1 ICC1CCc2ccccc21 Amb24721376 [0,1,0,1,0,0|1,0,0]=3 14044 B12R2.1 ICC1COc2ccccc21 Amb24060947 [0,1,0,1,0,0|1,0,0]=3 14045 B12R2.1 ICC1CSc2ccccc21 Amb24513745 [0,1,0,1,0,0|1,0,0]=3 14046 B12R2.1 N#CC1CNc2ccccc21 Amb18063484 [0,1,0,1,0,0|1,0,1]=4 14047 B12R2.1 N#CC1COc2ccccc21 Amb23586274 [0,1,0,1,0,0|1,0,1]=4 14048 B12R2.1 N#CC1CSc2ccccc21 Amb18126297 [0,1,0,1,0,0|1,0,1]=4 14049 B12R2.1 N#CN1CCc2ccccc12 Amb24484539 [0,1,0,1,0,0|1,0,1]=4 14050 B12R2.1 NCC1=CCc2ccccc12 Amb18560208 [0,1,0,1,0,0|1,0,1]=4 14051 B12R2.1 NCC1C=Cc2c1cccc2 Amb17470375 [0,1,0,1,0,0|1,0,1]=4 14052 B12R2.1 NCC1CCc2ccc[n]c21 Amb24561429 [0,1,0,1,0,0|2,0,0]=4 14053 B12R2.1 NCC1CCc2ccccc21 Amb22500956 [0,1,0,1,0,0|1,0,0]=3 14054 B12R2.1 NCC1CNc2ccccc21 Amb18063038 [0,1,0,1,0,0|1,0,0]=3 14055 B12R2.1 NCC1COc2c[n]ccc21 Amb22756834 [0,1,0,1,0,0|2,0,0]=4 14056 B12R2.1 NCC1COc2ccccc21 Amb18644395 [0,1,0,1,0,0|1,0,0]=3 14057 B12R2.1 NCC1COc2ccccc21 Amb20668243 [0,1,0,1,0,0|1,0,0]=3 14058 B12R2.1 NNC1CCc2[n]cccc21 Amb24453229 [0,1,0,1,0,0|2,0,0]=4 14059 B12R2.1 NNC1CCc2cc[n]cc21 Amb24484405 [0,1,0,1,0,0|2,0,0]=4 14060 B12R2.1 NNC1CCc2ccc[n]c21 Amb24745581 [0,1,0,1,0,0|2,0,0]=4 14061 B12R2.1 NOC1CCc2ccccc21 Amb25808729 [0,1,0,1,0,0|0,0,0]=2 14062 B12R2.1 N\N=C/1\CCc2c1cccc2 Amb2384463 [0,1,0,1,0,0|1,0,1]=4 14063 B12R2.1 O=CC1CCc2ccccc21 Amb18644272 [0,1,0,1,0,0|0,0,1]=3 14064 B12R2.1 O=CC1CNc2ccccc21 Amb23590098 [0,1,0,1,0,0|0,0,2]=4 14065 B12R2.1 O=CC1COc2ccccc21 Amb23586276 [0,1,0,1,0,0|0,0,2]=4 14066 B12R2.1 O=NN1CCc2ccccc12 Amb17689298 [0,1,0,1,0,0|1,0,1]=4 14067 B12R2.1 OCC1=CCc2ccccc12 Amb25797665 [0,1,0,1,0,0|0,0,1]=3 14068 B12R2.1 OCC1CCc2[n]cc[n]c21 Amb24071769 [0,1,0,1,0,0|2,0,0]=4 14069 B12R2.1 OCC1CCc2[n]cccc21 Amb24616681 [0,1,0,1,0,0|1,0,0]=3 14070 B12R2.1 OCC1CCc2ccccc21 Amb19329220 [0,1,0,1,0,0|0,0,0]=2 14071 B12R2.1 OCC1CNc2ccccc21 Amb18063448 [0,1,0,1,0,0|0,0,0]=2 14072 B12R2.1 OCC1COc2ccccc21 Amb22224879 [0,1,0,1,0,0|0,0,0]=2 14073 B12R2.1 OCC1CSc2ccccc21 Amb24615579 [0,1,0,1,0,0|0,0,0]=2 14074 B12R2.1 OCC1NCc2ccccc21 Amb25736151 [0,1,0,1,0,0|0,0,0]=2 14075 B12R2.1 OC[C@@H]1COc2ccccc21 Amb24487044 [0,1,0,1,0,0|0,0,0]=2 14076 B12R2.1 OC[C@H]1OCc2ccccc21 Amb24412216 [0,1,0,1,0,0|0,0,0]=2 14077 B12R2.1 OC[N]1=c2ccccc2=NN1 Amb17918406 [0,1,0,1,0,0|2,0,0]=4 14078 B12R2.1 OC[n]1[n]cc2ccccc12 Amb23441644 [0,1,0,1,0,0|1,0,1]=4 14079 B12R2.1 OC[n]1ccc2ccccc12 Amb25374111 [0,1,0,1,0,0|0,0,2]=4 14080 B12R2.1 OCc1[n]oc2ccccc21 Amb22498744 [0,1,0,1,0,0|1,0,1]=4 14081 B12R2.1 OCc1c[nH]c2c1cccc2 Amb1153804 [0,1,0,1,0,0|0,0,2]=4 14082 B12R2.1 OCc1c[nH]c2c1cccc2 Amb16231311 [0,1,0,1,0,0|0,0,2]=4 14083 B12R2.1 OCc1coc2c1cccc2 Amb10572402 [0,1,0,1,0,0|0,0,2]=4 14084 B12R2.1 OCc1n[nH]c2c1cccc2 Amb1070698 [0,1,0,1,0,0|1,0,1]=4 14085 B12R2.1 OCn1cnc2c1cccc2 Amb1151978 [0,1,0,1,0,0|1,0,1]=4 14086 B12R2.1 OCn1nnc2c1cccc2 Amb1350546 [0,1,0,1,0,0|2,0,0]=4 14087 B12R2.1 O\N=C/1\CCc2[n]cccc12 Amb24068690 [0,1,0,1,0,0|1,0,1]=4 14088 B12R2.1 O\N=C/1\CCc2cc[n]cc12 Amb24612371 [0,1,0,1,0,0|1,0,1]=4 14089 B12R2.1 O\N=C/1\CCc2ccccc21 Amb24121339 [0,1,0,1,0,0|0,0,1]=3 14090 B12R2.1 O\N=C/1\CSc2ccccc21 Amb24611046 [0,1,0,1,0,0|1,0,1]=4 14091 B12R2.1 O\N=C\1/CCc2ccccc21 Amb22731286 [0,1,0,1,0,0|0,0,1]=3 14092 B12R2.1 O\N=C\1/COc2ccccc21 Amb19650724 [0,1,0,1,0,0|1,0,1]=4 14093 B12R2.1 O\N=C\1/NCc2ccccc12 Amb24746464 [0,1,0,1,0,0|1,0,1]=4 14094 B12R2.11 Br[C@@H]1C[C@@H]1Cc2ccccc2 Amb25280103 [0,1,0,1,0,0|1,0,0]=3 14095 B12R2.11 CC1CC1Nc2cc[n]cc2 Amb18961534 [0,1,0,1,0,0|2,0,0]=4 14096 B12R2.11 CC1CC1Nc2cccc[n]2 Amb18962548 [0,1,0,1,0,0|2,0,0]=4 14097 B12R2.11 CC1CC1Nc2ccccc2 Amb24743217 [0,1,0,1,0,0|1,0,0]=3 14098 B12R2.11 C[C@@H]1C[C@H]1Nc2cccc[n]2 Amb24458447 [0,1,0,1,0,0|2,0,0]=4 14099 B12R2.11 C[C@H]1C[C@@H]1Nc2ccccc2 Amb24581235 [0,1,0,1,0,0|1,0,0]=3 14100 B12R2.11 ClC1CC1Oc2ccccc2 Amb25799021 [0,1,0,1,0,0|1,0,0]=3 14101 B12R2.11 Cl[C@@H]1C[C@@H]1Oc2ccccc2 Amb24652641 [0,1,0,1,0,0|1,0,0]=3 14102 B12R2.11 NC1CC1Cc2ccccc2 Amb18960797 [0,1,0,1,0,0|1,0,0]=3 14103 B12R2.11 NC1CC1Cc2ccccc2 Amb19375025 [0,1,0,1,0,0|1,0,0]=3 14104 B12R2.11 NC1CC1Oc2ccccc2 Amb24761155 [0,1,0,1,0,0|1,0,0]=3 14105 B12R2.11 OC1CC1Cc2ccccc2 Amb25145316 [0,1,0,1,0,0|0,0,0]=2 14106 B12R2.11 OC1CC1Sc2ccccc2 Amb25788139 [0,1,0,1,0,0|0,0,0]=2 14107 B12R2.11 O[C@H]1C[C@@H]1Cc2ccccc2 Amb25326057 [0,1,0,1,0,0|0,0,0]=2 14108 B12R2.11 O[C@H]1C[C@@H]1Sc2ccccc2 Amb24745857 [0,1,0,1,0,0|0,0,0]=2 14109 B12R2.23 BrC1COC1c2ccccc2 Amb24484887 [0,1,0,1,0,0|0,0,0]=2 14110 B12R2.23 Br[C@@H]1CO[C@H]1c2ccccc2 Amb25198843 [0,1,0,1,0,0|0,0,0]=2 14111 B12R2.23 CC1CNC1c2ccccc2 Amb19338009 [0,1,0,1,0,0|1,0,0]=3 14112 B12R2.23 CC1NCC1c2ccccc2 Amb25842786 [0,1,0,1,0,0|1,0,0]=3 14113 B12R2.23 C[C@@H]1NC[C@H]1c2ccccc2 Amb24618159 [0,1,0,1,0,0|1,0,0]=3 14114 B12R2.23 NC1CCC1c2ccccc2 Amb19335290 [0,1,0,1,0,0|1,0,0]=3 14115 B12R2.23 NC1CCC1c2ccccc2 Amb24120632 [0,1,0,1,0,0|1,0,0]=3 14116 B12R2.23 NC1CSC1c2ccccc2 Amb25076286 [0,1,0,1,0,0|0,1,0]=3 14117 B12R2.23 N[C@@H]1CC[C@H]1c2ccccc2 Amb25174969 [0,1,0,1,0,0|1,0,0]=3 14118 B12R2.23 O=C1CCC1c2ccc[n]c2 Amb24472315 [0,1,0,1,0,0|1,0,1]=4 14119 B12R2.23 O=C1CCC1c2ccccc2 Amb19515483 [0,1,0,1,0,0|0,0,1]=3 14120 B12R2.23 O=C1CCN1c2ccccc2 Amb16191926 [0,1,0,1,0,0|0,0,2]=4 14121 B12R2.23 O=C1CNC1c2ccccc2 Amb24449898 [0,1,0,1,0,0|0,0,2]=4 14122 B12R2.23 O=C1COC1c2ccccc2 Amb23456091 [0,1,0,1,0,0|0,0,1]=3 14123 B12R2.23 OC1CCC1c2ccccc2 Amb19374437 [0,1,0,1,0,0|0,0,0]=2 14124 B12R2.23 OC1CNC1c2ccc[n]c2 Amb25145873 [0,1,0,1,0,0|1,0,0]=3 14125 B12R2.23 OC1CNC1c2ccccc2 Amb25680030 [0,1,0,1,0,0|0,0,0]=2 14126 B12R2.23 O[C@@H]1CC[C@H]1c2ccccc2 Amb24620488 [0,1,0,1,0,0|0,0,0]=2 14127 B12R2.23 O[C@@H]1CS[C@H]1c2ccccc2 Amb25334761 [0,1,0,1,0,0|0,0,0]=2 14128 B12R2.23 O[C@H]1CS[C@H]1c2ccccc2 Amb25176781 [0,1,0,1,0,0|0,0,0]=2 14129 B12R2.23 S=C1CCN1c2ccccc2 Amb24709242 [0,1,0,1,0,0|0,1,1]=4 14130 B12R2.2057 C(NC1CC1)c2c[n]ccc2 Amb22587112 [0,1,0,1,0,0|2,0,0]=4 14131 B12R2.2057 C(NC1CC1)c2cc[n]cc2 Amb22587107 [0,1,0,1,0,0|2,0,0]=4 14132 B12R2.2057 C(NC1CC1)c2ccccc2 Amb19515725 [0,1,0,1,0,0|1,0,0]=3 14133 B12R2.2057 C(Nc1c[n]ccc1)C2CC2 Amb22586376 [0,1,0,1,0,0|2,0,0]=4 14134 B12R2.2057 C(Nc1cc[n]cc1)C2CC2 Amb22586408 [0,1,0,1,0,0|2,0,0]=4 14135 B12R2.2057 C(Nc1cccc[n]1)C2CC2 Amb22586406 [0,1,0,1,0,0|2,0,0]=4 14136 B12R2.2057 C(Nc1ccccc1)C2CC2 Amb22586372 [0,1,0,1,0,0|1,0,0]=3 14137 B12R2.2057 C(Oc1cc[n]cc1)C2CC2 Amb25368058 [0,1,0,1,0,0|2,0,0]=4 14138 B12R2.2057 C(Oc1cccc[n]1)C2CC2 Amb24725808 [0,1,0,1,0,0|2,0,0]=4 14139 B12R2.2057 C(Oc1ccccc1)C2CC2 Amb22752457 [0,1,0,1,0,0|1,0,0]=3 14140 B12R2.2057 C(Oc1ccccc1)C2CO2 Amb22366990 [0,1,0,1,0,0|0,0,0]=2 14141 B12R2.2057 C(SC1CC1)c2ccccc2 Amb25824339 [0,1,0,1,0,0|1,0,0]=3 14142 B12R2.2057 C(Sc1cccc[n]1)C2CC2 Amb24590799 [0,1,0,1,0,0|2,0,0]=4 14143 B12R2.2057 C1C=C1CNc2ccccc2 Amb25824311 [0,1,0,1,0,0|1,0,1]=4 14144 B12R2.2057 C1CC1CNc2ccccc2 Amb2383311 [0,1,0,1,0,0|1,0,0]=3 14145 B12R2.2057 C1CC1CNc2ccncc2 Amb2383010 [0,1,0,1,0,0|2,0,0]=4 14146 B12R2.2057 C1OC1C#Cc2ccccc2 Amb25309852 [0,1,0,1,0,0|0,0,1]=3 14147 B12R2.2057 C1OC1CCc2c[n]ccc2 Amb24085696 [0,1,0,1,0,0|1,0,0]=3 14148 B12R2.2057 C1OC1CCc2cc[n]cc2 Amb24356834 [0,1,0,1,0,0|1,0,0]=3 14149 B12R2.2057 C1OC1CCc2cccc[n]2 Amb24450397 [0,1,0,1,0,0|1,0,0]=3 14150 B12R2.2057 C1OC1CCc2ccccc2 Amb24105379 [0,1,0,1,0,0|0,0,0]=2 14151 B12R2.2057 C1OC1CSc2c[n]cc[n]2 Amb24477595 [0,1,0,1,0,0|2,0,0]=4 14152 B12R2.2057 C1OC1CSc2cc[n]c[n]2 Amb24477646 [0,1,0,1,0,0|2,0,0]=4 14153 B12R2.2057 C1OC1CSc2cc[n]cc2 Amb24673368 [0,1,0,1,0,0|1,0,0]=3 14154 B12R2.2057 C1OC1\C=C\c2cccc[n]2 Amb24411009 [0,1,0,1,0,0|1,0,1]=4 14155 B12R2.2057 C1OC1\C=C\c2ccccc2 Amb24418540 [0,1,0,1,0,0|0,0,1]=3 14156 B12R2.2057 C1O[C@@H]1CSc2[n]ccc[n]2 Amb25150472 [0,1,0,1,0,0|2,0,0]=4 14157 B12R2.2057 C1O[C@@H]1CSc2cc[n]c[n]2 Amb24703609 [0,1,0,1,0,0|2,0,0]=4 14158 B12R2.2057 C1O[C@@H]1CSc2ccccc2 Amb25680899 [0,1,0,1,0,0|0,0,0]=2 14159 B12R2.2057 C1O[C@@H]1OCc2ccccc2 Amb24631881 [0,1,0,1,0,0|0,0,0]=2 14160 B12R2.2057 C1O[C@H]1CSc2c[n]cc[n]2 Amb24458688 [0,1,0,1,0,0|2,0,0]=4 14161 B12R2.2057 c1ccc(cn1)NCC2CC2 Amb2382997 [0,1,0,1,0,0|2,0,0]=4 14162 B12R2.2057 c1ccc(nc1)NCC2CC2 Amb2382987 [0,1,0,1,0,0|2,0,0]=4 14163 B12R2.2058 B1CC(C1)Cc2ccccc2 Amb25243383 [0,1,0,1,0,0|1,0,0]=3 14164 B12R2.2058 C(C1CCN1)c2ccccc2 Amb20623701 [0,1,0,1,0,0|1,0,0]=3 14165 B12R2.2058 C(c1cc[n]cc1)N2CCC2 Amb25694575 [0,1,0,1,0,0|2,0,0]=4 14166 B12R2.2058 C1CC(C1)C[n+]2ccccc2 Amb10554487 [0,1,0,1,0,0|2,0,0]=4 14167 B12R2.2058 C1CC(C1)Sc2ccccc2 Amb10976023 [0,1,0,1,0,0|1,0,0]=3 14168 B12R2.2058 C1CCC1Nc2c[n]ccc2 Amb18957036 [0,1,0,1,0,0|2,0,0]=4 14169 B12R2.2058 C1CCC1Nc2cc[n]cc2 Amb18285881 [0,1,0,1,0,0|2,0,0]=4 14170 B12R2.2058 C1CCC1Nc2cccc[n]2 Amb18285901 [0,1,0,1,0,0|2,0,0]=4 14171 B12R2.2058 C1CCC1Nc2ccccc2 Amb18283820 [0,1,0,1,0,0|1,0,0]=3 14172 B12R2.2058 C1N=CN1Cc2ccccc2 Amb25709568 [0,1,0,1,0,0|2,0,0]=4 14173 B12R2.2058 C1NCC1Cc2c[n]ccc2 Amb23598850 [0,1,0,1,0,0|2,0,0]=4 14174 B12R2.2058 C1NCC1Cc2cc[n]cc2 Amb23598871 [0,1,0,1,0,0|2,0,0]=4 14175 B12R2.2058 C1NCC1Cc2cccc[n]2 Amb23598870 [0,1,0,1,0,0|2,0,0]=4 14176 B12R2.2058 C1NCC1Cc2ccccc2 Amb19373673 [0,1,0,1,0,0|1,0,0]=3 14177 B12R2.2058 C1NCC1Oc2ccccc2 Amb19312256 [0,1,0,1,0,0|2,0,0]=4 14178 B12R2.2058 C1NCC1Sc2ccccc2 Amb18798478 [0,1,0,1,0,0|2,0,0]=4 14179 B12R2.2058 C1OCC1Nc2ccccc2 Amb22737358 [0,1,0,1,0,0|1,0,0]=3 14180 B12R2.2058 C1OCC1Sc2cccc[n]2 Amb24354925 [0,1,0,1,0,0|2,0,0]=4 14181 B12R2.2058 C1OCC1Sc2ccccc2 Amb25145934 [0,1,0,1,0,0|1,0,0]=3 14182 B12R2.2058 C1SCC1Nc2ccccc2 Amb25362257 [0,1,0,1,0,0|1,1,0]=4 14183 B12R2.2058 N1CC(C1)Cc2ccccc2 Amb1123190 [0,1,0,1,0,0|1,0,0]=3 14184 B12R2.2058 N1CC(C1)Oc2ccccc2 Amb15701497 [0,1,0,1,0,0|2,0,0]=4 14185 B12R2.18 BrC1Oc2ccccc2C1Br Amb25694128 [0,1,0,1,0,0|2,0,0]=4 14186 B12R2.18 C=C1C(O)Cc2ccccc21 Amb24576594 [0,1,0,1,0,0|1,0,1]=4 14187 B12R2.18 C=C1Cc2ccccc2C1O Amb25045696 [0,1,0,1,0,0|0,0,1]=3 14188 B12R2.18 C=C1Oc2ccccc2C1O Amb25852741 [0,1,0,1,0,0|1,0,1]=4 14189 B12R2.18 CC1=Cc2ccccc2C1O Amb17778950 [0,1,0,1,0,0|0,0,2]=4 14190 B12R2.18 CC1C(=O)Cc2ccccc21 Amb20622460 [0,1,0,1,0,0|1,0,1]=4 14191 B12R2.18 CC1C(C)Nc2c1cccc2 Amb17593676 [0,1,0,1,0,0|2,0,0]=4 14192 B12R2.18 CC1C(N)Cc2ccccc21 Amb18124847 [0,1,0,1,0,0|1,0,0]=3 14193 B12R2.18 CC1C(O)Cc2ccccc21 Amb20622729 [0,1,0,1,0,0|1,0,0]=3 14194 B12R2.18 CC1Cc2ccccc2C1Br Amb25106421 [0,1,0,1,0,0|1,0,0]=3 14195 B12R2.18 CC1Cc2ccccc2C1Cl Amb18183547 [0,1,0,1,0,0|1,0,0]=3 14196 B12R2.18 CC1Cc2ccccc2C1N Amb19373701 [0,1,0,1,0,0|1,0,0]=3 14197 B12R2.18 CC1Cc2ccccc2N1N Amb24065299 [0,1,0,1,0,0|2,0,0]=4 14198 B12R2.18 CC1Oc2[n]cccc2C1O Amb22372218 [0,1,0,1,0,0|2,0,0]=4 14199 B12R2.18 CC1Oc2ccccc2C1N Amb18943788 [0,1,0,1,0,0|2,0,0]=4 14200 B12R2.18 CC1Oc2ccccc2C1O Amb24572207 [0,1,0,1,0,0|1,0,0]=3 14201 B12R2.18 CC1Sc2ccccc2C1N Amb18278067 [0,1,0,1,0,0|2,0,0]=4 14202 B12R2.18 CC1c2ccccc2CN1N Amb25255493 [0,1,0,1,0,0|2,0,0]=4 14203 B12R2.18 CN1[C@H](C)Cc2ccccc12 Amb24068204 [0,1,0,1,0,0|2,0,0]=4 14204 B12R2.18 C[C@@H]1Cc2ccccc2C1=O Amb25282759 [0,1,0,1,0,0|0,0,2]=4 14205 B12R2.18 C[C@@H]1Cc2ccccc2[C@@H]1N Amb24578752 [0,1,0,1,0,0|1,0,0]=3 14206 B12R2.18 C[C@@H]1Oc2ccccc2[C@@H]1O Amb25344981 [0,1,0,1,0,0|1,0,0]=3 14207 B12R2.18 C[C@@H]1[C@@H](O)Cc2ccccc21 Amb25176418 [0,1,0,1,0,0|1,0,0]=3 14208 B12R2.18 C[C@@H]1[C@H](O)Cc2cc[n]cc21 Amb23604478 [0,1,0,1,0,0|2,0,0]=4 14209 B12R2.18 C[C@@H]1[C@H](O)Cc2ccccc21 Amb24546023 [0,1,0,1,0,0|1,0,0]=3 14210 B12R2.18 C[C@H]1Nc2ccccc2[C@@H]1O Amb24629727 [0,1,0,1,0,0|1,0,0]=3 14211 B12R2.18 C[C@H]1[C@@H](N)Cc2ccccc21 Amb24562844 [0,1,0,1,0,0|1,0,0]=3 14212 B12R2.18 ClC1Cc2ccccc2C1Cl Amb25770688 [0,1,0,1,0,0|1,0,0]=3 14213 B12R2.18 Cl[C@@H]1Cc2ccccc2[C@@H]1Cl Amb25366590 [0,1,0,1,0,0|1,0,0]=3 14214 B12R2.18 Cl[C@@H]1Cc2ccccc2[C@H]1Cl Amb25242520 [0,1,0,1,0,0|1,0,0]=3 14215 B12R2.18 Cl[C@@H]1Oc2ccccc2[C@@H]1Cl Amb24563414 [0,1,0,1,0,0|2,0,0]=4 14216 B12R2.18 Cl[C@H]1Oc2ccccc2[C@@H]1Cl Amb25258397 [0,1,0,1,0,0|2,0,0]=4 14217 B12R2.18 Cl[C@H]1Oc2ccccc2[C@H]1Cl Amb24711440 [0,1,0,1,0,0|2,0,0]=4 14218 B12R2.18 FC1C(Br)Cc2ccccc21 Amb25857057 [0,1,0,1,0,0|1,0,0]=3 14219 B12R2.18 FC1Oc2ccccc2C1F Amb24101526 [0,1,0,1,0,0|2,0,0]=4 14220 B12R2.18 NC1C(C)Cc2c1cccc2 Amb17232033 [0,1,0,1,0,0|1,0,0]=3 14221 B12R2.18 NC1C(F)Cc2ccccc21 Amb24459876 [0,1,0,1,0,0|1,0,0]=3 14222 B12R2.18 NC1C(N)Cc2c1cccc2 Amb13953204 [0,1,0,1,0,0|1,0,0]=3 14223 B12R2.18 NC1C(O)Nc2ccccc21 Amb25722216 [0,1,0,1,0,0|2,0,0]=4 14224 B12R2.18 NC1Cc2[n]cccc2C1O Amb25364253 [0,1,0,1,0,0|1,0,0]=3 14225 B12R2.18 NC1Cc2ccccc2C1=O Amb19958907 [0,1,0,1,0,0|0,0,2]=4 14226 B12R2.18 NC1Cc2ccccc2C1F Amb24655749 [0,1,0,1,0,0|1,0,0]=3 14227 B12R2.18 NC1Cc2ccccc2C1O Amb20623676 [0,1,0,1,0,0|0,0,0]=2 14228 B12R2.18 NC1[C@H](O)Cc2ccccc21 Amb24401902 [0,1,0,1,0,0|1,0,0]=3 14229 B12R2.18 N[C@@H]1Cc2ccccc2C1=O Amb22747360 [0,1,0,1,0,0|0,0,2]=4 14230 B12R2.18 N[C@@H]1Cc2ccccc2C1=O Amb24390795 [0,1,0,1,0,0|0,0,2]=4 14231 B12R2.18 N[C@@H]1Cc2ccccc2C1O Amb25209005 [0,1,0,1,0,0|0,0,0]=2 14232 B12R2.18 N[C@@H]1Cc2ccccc2[C@@H]1N Amb22745804 [0,1,0,1,0,0|1,0,0]=3 14233 B12R2.18 N[C@@H]1Cc2ccccc2[C@@H]1O Amb24501357 [0,1,0,1,0,0|0,0,0]=2 14234 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1N Amb22748292 [0,1,0,1,0,0|1,0,0]=3 14235 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb22388538 [0,1,0,1,0,0|0,0,0]=2 14236 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb25379044 [0,1,0,1,0,0|0,0,0]=2 14237 B12R2.18 N[C@@H]1[C@@H](Cl)Cc2ccccc21 Amb24519208 [0,1,0,1,0,0|1,0,0]=3 14238 B12R2.18 N[C@@H]1[C@@H](F)Cc2ccccc21 Amb25252184 [0,1,0,1,0,0|1,0,0]=3 14239 B12R2.18 N[C@@H]1[C@@H](O)Cc2c1cccc2 Amb10842191 [0,1,0,1,0,0|1,0,0]=3 14240 B12R2.18 N[C@@H]1[C@H](Cl)Cc2ccccc21 Amb24641556 [0,1,0,1,0,0|1,0,0]=3 14241 B12R2.18 N[C@@H]1[C@H](O)Cc2ccccc12 Amb17779311 [0,1,0,1,0,0|1,0,0]=3 14242 B12R2.18 N[C@H]1C(O)Cc2ccccc21 Amb24427360 [0,1,0,1,0,0|1,0,0]=3 14243 B12R2.18 N[C@H]1Cc2ccccc2[C@@H]1N Amb24624674 [0,1,0,1,0,0|1,0,0]=3 14244 B12R2.18 N[C@H]1Cc2ccccc2[C@H]1O Amb24540566 [0,1,0,1,0,0|0,0,0]=2 14245 B12R2.18 N[C@H]1[C@H](O)Cc2c1cccc2 Amb10842210 [0,1,0,1,0,0|1,0,0]=3 14246 B12R2.18 O=C1C(F)Cc2c1cccc2 Amb17593723 [0,1,0,1,0,0|0,0,2]=4 14247 B12R2.18 O=C1C(I)Cc2c1cccc2 Amb16232280 [0,1,0,1,0,0|0,0,2]=4 14248 B12R2.18 O=C1C(N)Cc2c1cccc2 Amb17470380 [0,1,0,1,0,0|0,0,2]=4 14249 B12R2.18 O=C1Cc2ccccc2C1Br Amb21987890 [0,1,0,1,0,0|1,0,1]=4 14250 B12R2.18 O=C1Cc2ccccc2C1F Amb25142685 [0,1,0,1,0,0|1,0,1]=4 14251 B12R2.18 O=C1Cc2ccccc2C1[Na] Amb24605330 [0,1,0,1,0,0|1,0,1]=4 14252 B12R2.18 O=C1[C@@H](Br)Cc2ccccc21 Amb24669064 [0,1,0,1,0,0|0,0,2]=4 14253 B12R2.18 O=C1[C@H](Br)Cc2ccccc21 Amb25827588 [0,1,0,1,0,0|0,0,2]=4 14254 B12R2.18 OC1C(=O)Oc2ccccc21 Amb24102222 [0,1,0,1,0,0|1,0,1]=4 14255 B12R2.18 OC1C(Br)Cc2c1cccc2 Amb1159074 [0,1,0,1,0,0|0,0,0]=2 14256 B12R2.18 OC1C(F)Cc2ccccc21 Amb24423988 [0,1,0,1,0,0|0,0,0]=2 14257 B12R2.18 OC1C(N)Cc2c1cccc2 Amb2383051 [0,1,0,1,0,0|0,0,0]=2 14258 B12R2.18 OC1C(O)C[n+]2ccccc21 Amb25739707 [0,1,0,1,0,0|1,0,0]=3 14259 B12R2.18 OC1Cc2ccccc2C1=O Amb25342077 [0,1,0,1,0,0|0,0,2]=4 14260 B12R2.18 OC1Cc2ccccc2C1Br Amb25785578 [0,1,0,1,0,0|1,0,0]=3 14261 B12R2.18 OC1Cc2ccccc2C1F Amb24672733 [0,1,0,1,0,0|1,0,0]=3 14262 B12R2.18 OC1Cc2ccccc2C1O Amb24323306 [0,1,0,1,0,0|0,0,0]=2 14263 B12R2.18 OC1Cc2ccccc2C1S Amb24430077 [0,1,0,1,0,0|0,1,0]=3 14264 B12R2.18 OC1Nc2ccccc2C1O Amb24090494 [0,1,0,1,0,0|1,0,0]=3 14265 B12R2.18 ON1C(=O)Cc2ccccc12 Amb17940424 [0,1,0,1,0,0|1,0,1]=4 14266 B12R2.18 O[C@@H]1C(Br)Cc2ccccc21 Amb25061997 [0,1,0,1,0,0|0,0,0]=2 14267 B12R2.18 O[C@@H]1Cc2ccccc2C1=O Amb24725355 [0,1,0,1,0,0|0,0,2]=4 14268 B12R2.18 O[C@@H]1Cc2ccccc2[C@@H]1Cl Amb24650956 [0,1,0,1,0,0|1,0,0]=3 14269 B12R2.18 O[C@@H]1Cc2ccccc2[C@@H]1O Amb22800784 [0,1,0,1,0,0|0,0,0]=2 14270 B12R2.18 O[C@@H]1Oc2ccccc2[C@H]1O Amb25284399 [0,1,0,1,0,0|1,0,0]=3 14271 B12R2.18 O[C@@H]1Sc2ccccc2[C@@H]1O Amb25215688 [0,1,0,1,0,0|1,0,0]=3 14272 B12R2.18 O[C@@H]1[C@@H](Br)CN2C=CC=CC21 Amb24638001 [0,1,0,1,0,0|1,0,1]=4 14273 B12R2.18 O[C@@H]1[C@@H](F)Cc2ccccc21 Amb25200299 [0,1,0,1,0,0|0,0,0]=2 14274 B12R2.18 O[C@@H]1[C@H](F)Cc2ccccc21 Amb25176954 [0,1,0,1,0,0|0,0,0]=2 14275 B12R2.18 O[C@H]1C(=O)Nc2ccccc21 Amb25152859 [0,1,0,1,0,0|1,0,1]=4 14276 B12R2.18 O[C@H]1Cc2ccccc2[C@@H]1Br Amb24682797 [0,1,0,1,0,0|1,0,0]=3 14277 B12R2.18 O[C@H]1Cc2ccccc2[C@@H]1F Amb25240021 [0,1,0,1,0,0|1,0,0]=3 14278 B12R2.18 O[C@H]1Cc2ccccc2[C@H]1O Amb22230411 [0,1,0,1,0,0|0,0,0]=2 14279 B12R2.18 O[C@H]1Sc2ccccc2[C@H]1O Amb25256602 [0,1,0,1,0,0|1,0,0]=3 14280 B12R2.18 O[C@H]1[C@H](Cl)Cc2ccccc21 Amb24519428 [0,1,0,1,0,0|0,0,0]=2 14281 B12R2.18 O[C@H]1[C@H](O)Cc2c1cccc2 Amb10982589 [0,1,0,1,0,0|0,0,0]=2 14282 B12R2.18 [NH3+][C@@H]1Cc2ccccc2[C@H]1O Amb22224837 [0,1,0,1,0,0|0,0,0]=2 14283 B12R2.37 CC1C(O)C1c2ccccc2 Amb24457875 [0,1,0,1,0,0|0,0,0]=2 14284 B12R2.37 C[C@@H]1C(c2ccccc2)[N@@]1C Amb23513697 [0,1,0,1,0,0|2,0,0]=4 14285 B12R2.37 C[C@@H]1[C@H](Cl)[C@@H]1c2ccccc2 Amb25321015 [0,1,0,1,0,0|1,0,0]=3 14286 B12R2.37 C[C@@H]1[C@H](Cl)[C@H]1c2ccccc2 Amb24511894 [0,1,0,1,0,0|1,0,0]=3 14287 B12R2.37 C[C@H]1C(Cl)[C@@H]1c2ccccc2 Amb25173083 [0,1,0,1,0,0|1,0,0]=3 14288 B12R2.37 C[C@H]1[C@H](Cl)[C@@H]1c2ccccc2 Amb25320879 [0,1,0,1,0,0|1,0,0]=3 14289 B12R2.37 N[C@@H]1[C@H]([C@@H]1N)c2ccccc2 Amb24761507 [0,1,0,1,0,0|1,0,0]=3 14290 B12R2.37 N[C@H]1C([C@@H]1N)c2ccccc2 Amb25230184 [0,1,0,1,0,0|1,0,0]=3 14291 B12R2.94 CC1(Cc2ccccc2)NN1 Amb24672487 [0,1,0,1,0,0|2,0,0]=4 14292 B12R2.94 FC1(Cc2ccccc2)N=N1 Amb24425472 [0,1,0,1,0,0|2,0,0]=4 14293 B12R2.94 IC1(CC1)Sc2ccccc2 Amb25163645 [0,1,0,1,0,0|2,0,0]=4 14294 B12R2.94 NC1(Cc2c[n]ccc2)CC1 Amb18286910 [0,1,0,1,0,0|2,0,0]=4 14295 B12R2.94 NC1(Cc2cc[n]cc2)CC1 Amb18286716 [0,1,0,1,0,0|2,0,0]=4 14296 B12R2.94 NC1(Cc2cccc[n]2)CC1 Amb18963284 [0,1,0,1,0,0|2,0,0]=4 14297 B12R2.94 NC1(Cc2ccccc2)CC1 Amb22587208 [0,1,0,1,0,0|1,0,0]=3 14298 B12R2.94 OC1(Cc2cc[n]cc2)CC1 Amb25768733 [0,1,0,1,0,0|2,0,0]=4 14299 B12R2.94 OC1(Cc2ccccc2)CC1 Amb19374431 [0,1,0,1,0,0|1,0,0]=3 14300 B12R2.2051 CC1(Cc2ccccc12)C=C Amb17778871 [0,1,0,1,0,0|1,0,1]=4 14301 B12R2.2051 ClC1(Cc2ccccc12)C#N Amb17844057 [0,1,0,1,0,0|1,0,1]=4 14302 B12R2.92 BrC1(Br)CC1c2c[n]ccc2 Amb25730424 [0,1,0,1,0,0|2,0,0]=4 14303 B12R2.92 BrC1(Br)CC1c2ccccc2 Amb22363907 [0,1,0,1,0,0|1,0,0]=3 14304 B12R2.92 CC1(C)CC1c2ccccc2 Amb22052702 [0,1,0,1,0,0|1,0,0]=3 14305 B12R2.92 CC1(C)NC1c2ccccc2 Amb24056776 [0,1,0,1,0,0|2,0,0]=4 14306 B12R2.92 CC1(C)OC1c2ccccc2 Amb21964286 [0,1,0,1,0,0|2,0,0]=4 14307 B12R2.92 CC1(O)OC1c2ccccc2 Amb24353312 [0,1,0,1,0,0|1,0,0]=3 14308 B12R2.92 C[C@@]1(N)C[C@H]1c2ccccc2 Amb25378765 [0,1,0,1,0,0|1,0,0]=3 14309 B12R2.92 C[C@]1(N)C[C@@H]1c2ccccc2 Amb24613115 [0,1,0,1,0,0|1,0,0]=3 14310 B12R2.92 FC1(F)CC1c2ccccc2 Amb22227684 [0,1,0,1,0,0|1,0,0]=3 14311 B12R2.2403 CC1(C)CCc2ccccc12 Amb24657207 [0,1,0,1,0,0|1,0,0]=3 14312 B12R2.2403 CC1(C)CNc2c1cccc2 Amb17232031 [0,1,0,1,0,0|2,0,0]=4 14313 B12R2.2403 CC1(C)CNc2ccccc12 Amb20630653 [0,1,0,1,0,0|2,0,0]=4 14314 B12R2.2403 CC1(C)NCc2ccccc12 Amb23439228 [0,1,0,1,0,0|2,0,0]=4 14315 B12R2.2403 CC1(C)OCc2ccccc12 Amb23558274 [0,1,0,1,0,0|2,0,0]=4 14316 B12R2.2403 N[C@]1(O)CCc2ccccc12 Amb24472858 [0,1,0,1,0,0|0,0,0]=2 14317 B12R2.2403 OC1(Br)CNc2ccccc12 Amb25195439 [0,1,0,1,0,0|1,0,0]=3 14318 B12R2.2403 OP1(=O)OCc2ccccc12 Amb25149207 [0,1,0,1,0,0|2,0,0]=4 14319 B12R2.3190 CC(O)C1Cc2ccccc21 Amb24538275 [0,1,0,1,0,0|0,0,0]=2 14320 B12R2.3190 C[C@@H](N)C1Cc2ccccc21 Amb25047176 [0,1,0,1,0,0|1,0,0]=3 14321 B12R2.3190 C[C@@H](O)C1Cc2ccccc21 Amb25151401 [0,1,0,1,0,0|0,0,0]=2 14322 B12R2.3190 C[C@H](O)C1Cc2ccccc21 Amb25172779 [0,1,0,1,0,0|0,0,0]=2 14323 B12R2.3190 NC(=N)C1Cc2ccccc21 Amb25152697 [0,1,0,1,0,0|1,0,1]=4 14324 B12R2.3190 NC(=O)C1Cc2ccccc21 Amb25064297 [0,1,0,1,0,0|0,0,2]=4 14325 B12R2.3190 NC(=S)C1Cc2ccccc21 Amb25152696 [0,1,0,1,0,0|0,1,1]=4 14326 B12R2.3190 O=C(Cl)C1Cc2ccccc21 Amb24745572 [0,1,0,1,0,0|0,0,2]=4 14327 B12R3.12 c1ccc2c(c1)C3OC3C2 Amb1131588 [0,0,0,2,0,0|0,0,0]=2 14328 B12R3.1604 C1C=2COC3=CN1C=CC23 Amb24100739 [0,0,0,2,0,0|1,0,1]=4 14329 B8R1.8 BrCC[n]1cccc1 Amb17933298 [1,0,0,0,1,0|2,0,0]=4 14330 B8R1.8 BrCCc1c[nH]cc1 Amb18862863 [1,0,0,0,1,0|2,0,0]=4 14331 B8R1.8 BrCCc1c[s]cc1 Amb18325324 [1,0,0,0,1,0|2,0,0]=4 14332 B8R1.8 BrCCc1ccc[nH]1 Amb25312927 [1,0,0,0,1,0|2,0,0]=4 14333 B8R1.8 BrCCc1ccco1 Amb22752866 [1,0,0,0,1,0|2,0,0]=4 14334 B8R1.8 BrCCc1cccs1 Amb16234134 [1,0,0,0,1,0|2,0,0]=4 14335 B8R1.8 BrCCc1cocc1 Amb19374721 [1,0,0,0,1,0|2,0,0]=4 14336 B8R1.8 CCCc1c[nH][n]c1 Amb19516672 [1,0,0,0,1,0|2,0,0]=4 14337 B8R1.8 CCCc1cc[nH][n]1 Amb22059626 [1,0,0,0,1,0|2,0,0]=4 14338 B8R1.8 CCCc1ccco1 Amb10070288 [1,0,0,0,1,0|1,0,0]=3 14339 B8R1.8 CCCc1ccsc1 Amb17689448 [1,0,0,0,1,0|1,0,0]=3 14340 B8R1.8 CCCc1cocc1 Amb24332079 [1,0,0,0,1,0|1,0,0]=3 14341 B8R1.8 CCCc1cscn1 Amb13884094 [1,0,0,0,1,0|2,0,0]=4 14342 B8R1.8 CCN[n]1cccc1 Amb25277204 [1,0,0,0,1,0|2,0,0]=4 14343 B8R1.8 CCNc1c[nH]cc1 Amb25717948 [1,0,0,0,1,0|2,0,0]=4 14344 B8R1.8 CCNc1c[s]cc1 Amb25743947 [1,0,0,0,1,0|2,0,0]=4 14345 B8R1.8 CCNc1ccc[s]1 Amb18055004 [1,0,0,0,1,0|2,0,0]=4 14346 B8R1.8 CCOc1ccc[nH]1 Amb22756799 [1,0,0,0,1,0|2,0,0]=4 14347 B8R1.8 CCOc1ccco1 Amb25222294 [1,0,0,0,1,0|2,0,0]=4 14348 B8R1.8 CCSc1c[nH]cc1 Amb24481314 [1,0,0,0,1,0|2,0,0]=4 14349 B8R1.8 CCSc1cccs1 Amb17845323 [1,0,0,0,1,0|2,0,0]=4 14350 B8R1.8 CNCc1c[nH]cc1 Amb18062155 [1,0,0,0,1,0|2,0,0]=4 14351 B8R1.8 CNCc1ccco1 Amb1153202 [1,0,0,0,1,0|2,0,0]=4 14352 B8R1.8 CNCc1cccs1 Amb1152299 [1,0,0,0,1,0|2,0,0]=4 14353 B8R1.8 CNCc1cocc1 Amb17658965 [1,0,0,0,1,0|2,0,0]=4 14354 B8R1.8 CNCc1cscc1 Amb1154137 [1,0,0,0,1,0|2,0,0]=4 14355 B8R1.8 COC[n]1cccc1 Amb23401113 [1,0,0,0,1,0|2,0,0]=4 14356 B8R1.8 COCc1ccc[nH]1 Amb24715907 [1,0,0,0,1,0|2,0,0]=4 14357 B8R1.8 COCc1ccc[s]1 Amb25169518 [1,0,0,0,1,0|2,0,0]=4 14358 B8R1.8 COCc1ccco1 Amb24116969 [1,0,0,0,1,0|2,0,0]=4 14359 B8R1.8 COCc1cocc1 Amb25180531 [1,0,0,0,1,0|2,0,0]=4 14360 B8R1.8 CSCc1ccc[nH]1 Amb25082991 [1,0,0,0,1,0|2,0,0]=4 14361 B8R1.8 ClCC[n]1cccc1 Amb19944678 [1,0,0,0,1,0|2,0,0]=4 14362 B8R1.8 ClCCc1c[nH]cc1 Amb18222716 [1,0,0,0,1,0|2,0,0]=4 14363 B8R1.8 ClCCc1ccco1 Amb24555129 [1,0,0,0,1,0|2,0,0]=4 14364 B8R1.8 ICCc1c[s]cc1 Amb25857183 [1,0,0,0,1,0|2,0,0]=4 14365 B8R1.8 ICCc1ccc[s]1 Amb25106538 [1,0,0,0,1,0|2,0,0]=4 14366 B8R1.8 NCC[n]1cccc1 Amb22757166 [1,0,0,0,1,0|2,0,0]=4 14367 B8R1.8 NCC[n]1cccc1 Amb22904207 [1,0,0,0,1,0|2,0,0]=4 14368 B8R1.8 NCCc1c[nH]cc1 Amb18061637 [1,0,0,0,1,0|2,0,0]=4 14369 B8R1.8 NCCc1ccc[nH]1 Amb18281448 [1,0,0,0,1,0|2,0,0]=4 14370 B8R1.8 NCCc1ccc[nH]1 Amb22497242 [1,0,0,0,1,0|2,0,0]=4 14371 B8R1.8 NCCc1ccc[nH]1 Amb22751407 [1,0,0,0,1,0|2,0,0]=4 14372 B8R1.8 NCCc1ccco1 Amb1080943 [1,0,0,0,1,0|2,0,0]=4 14373 B8R1.8 NCCc1ccco1 Amb22587649 [1,0,0,0,1,0|2,0,0]=4 14374 B8R1.8 NCCc1cccs1 Amb1073690 [1,0,0,0,1,0|2,0,0]=4 14375 B8R1.8 NCCc1cocc1 Amb18833105 [1,0,0,0,1,0|2,0,0]=4 14376 B8R1.8 NCCc1cscc1 Amb2236392 [1,0,0,0,1,0|2,0,0]=4 14377 B8R1.8 NCCn1cccc1 Amb2422800 [1,0,0,0,1,0|2,0,0]=4 14378 B8R1.8 OCCC1=CCC=C1 Amb25700126 [1,0,0,0,1,0|0,0,1]=3 14379 B8R1.8 OCCC1C=CC=C1 Amb25356398 [1,0,0,0,1,0|0,0,1]=3 14380 B8R1.8 OCCC=1CC=CC1 Amb25795365 [1,0,0,0,1,0|0,0,1]=3 14381 B8R1.8 OCC[n+]1c[s]cc1 Amb24518966 [1,0,0,0,1,0|2,0,0]=4 14382 B8R1.8 OCCc1[n]cc[s]1 Amb22235225 [1,0,0,0,1,0|2,0,0]=4 14383 B8R1.8 OCCc1c[nH]cc1 Amb18860246 [1,0,0,0,1,0|1,0,0]=3 14384 B8R1.8 OCCc1c[nH]nc1 Amb1935046 [1,0,0,0,1,0|2,0,0]=4 14385 B8R1.8 OCCc1c[n]c[nH]1 Amb22436833 [1,0,0,0,1,0|2,0,0]=4 14386 B8R1.8 OCCc1c[n]c[s]1 Amb22371829 [1,0,0,0,1,0|2,0,0]=4 14387 B8R1.8 OCCc1c[s]c[n]1 Amb23536235 [1,0,0,0,1,0|2,0,0]=4 14388 B8R1.8 OCCc1cc[nH][n]1 Amb22728903 [1,0,0,0,1,0|2,0,0]=4 14389 B8R1.8 OCCc1cc[n][s]1 Amb23441022 [1,0,0,0,1,0|2,0,0]=4 14390 B8R1.8 OCCc1ccc[nH]1 Amb17593146 [1,0,0,0,1,0|1,0,0]=3 14391 B8R1.8 OCCc1ccco1 Amb17089516 [1,0,0,0,1,0|1,0,0]=3 14392 B8R1.8 OCCc1cccs1 Amb2099445 [1,0,0,0,1,0|1,0,0]=3 14393 B8R1.8 OCCc1cocc1 Amb25802261 [1,0,0,0,1,0|1,0,0]=3 14394 B8R1.8 OCCc1cocn1 Amb17399797 [1,0,0,0,1,0|2,0,0]=4 14395 B8R1.8 OCCc1conc1 Amb1971497 [1,0,0,0,1,0|2,0,0]=4 14396 B8R1.8 ONCc1c[nH]cc1 Amb25677397 [1,0,0,0,1,0|2,0,0]=4 14397 B8R1.8 ONCc1ccc[nH]1 Amb25071150 [1,0,0,0,1,0|2,0,0]=4 14398 B8R1.8 ONCc1ccc[s]1 Amb23449451 [1,0,0,0,1,0|2,0,0]=4 14399 B8R1.8 ONCc1ccco1 Amb23449450 [1,0,0,0,1,0|2,0,0]=4 14400 B8R1.8 SCCc1c[nH]cc1 Amb18560654 [1,0,0,0,1,0|1,1,0]=4 14401 B8R1.8 SCCc1c[s]cc1 Amb25300451 [1,0,0,0,1,0|1,1,0]=4 14402 B8R1.8 SCCc1ccco1 Amb24511324 [1,0,0,0,1,0|1,1,0]=4 14403 B8R1.8 SCCc1cccs1 Amb17399886 [1,0,0,0,1,0|1,1,0]=4 14404 B8R1.10 OCCCC1CC=C1 Amb25092021 [0,0,0,0,2,0|0,0,2]=4 14405 B12R1.329 OCCCC=1C=CC=CC=CC1 Amb25225983 [0,0,0,0,0,2|0,0,0]=2