0 B10R1.17 BrC=C=Cc1ccccc1 Amb17673290 [0,0,0,0,0,0|2,0,2]=4 1 B10R1.17 BrCC#Cc1cccc[n]1 Amb24482311 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.17 BrCCCc1c[n]c[n]c1 Amb25092294 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.17 BrCCCc1cc[n]cc1 Amb24094393 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.17 BrCCCc1cccnc1 Amb1102301 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.17 BrCCCc1cccnc1 Amb17610084 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.17 BrCCOC1C=CC=CO1 Amb25227874 [0,0,0,0,0,0|2,0,1]=3 7 B10R1.17 BrCCOc1cccc[n]1 Amb25808972 [0,0,0,0,0,0|2,0,0]=2 8 B10R1.17 BrCCOc1ccccc1 Amb1152333 [0,0,0,0,0,0|1,0,0]=1 9 B10R1.17 BrCCSc1c[n]cc[n]1 Amb24476914 [0,0,0,0,0,0|3,1,0]=4 10 B10R1.17 Br[Mg]C#Cc1ccccc1 Amb22353480 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.17 Br[Zn]C#Cc1ccccc1 Amb22898101 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.17 Br[Zn]CCc1ccccc1 Amb22000434 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.17 Br\C=C/Oc1ccccc1 Amb25794486 [0,0,0,0,0,0|1,0,2]=3 15 B10R1.17 Br\C=C\Cc1ccccc1 Amb22053885 [0,0,0,0,0,0|2,0,2]=4 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|2,0,2]=4 19 B10R1.17 C#CCCc1c[n]ccc1 Amb24085226 [0,0,0,0,0,0|3,0,1]=4 20 B10R1.17 C#CCCc1cc[n]cc1 Amb24091331 [0,0,0,0,0,0|3,0,1]=4 21 B10R1.17 C#CCCc1cccc[n]1 Amb24571654 [0,0,0,0,0,0|3,0,1]=4 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#CCO[C@H]1C=CC=CO1 Amb24479666 [0,0,0,0,0,0|2,0,2]=4 27 B10R1.17 C#CCOc1[n]ccc[n]1 Amb24093879 [0,0,0,0,0,0|3,0,1]=4 28 B10R1.17 C#CCOc1c[n]c[n]c1 Amb24098643 [0,0,0,0,0,0|3,0,1]=4 29 B10R1.17 C#CCOc1c[n]ccc1 Amb22586592 [0,0,0,0,0,0|2,0,1]=3 30 B10R1.17 C#CCOc1cc[n]cc1 Amb24117045 [0,0,0,0,0,0|2,0,1]=3 31 B10R1.17 C#CCOc1cccc[n]1 Amb24407701 [0,0,0,0,0,0|2,0,1]=3 32 B10R1.17 C#CCSc1cccc[n]1 Amb24070203 [0,0,0,0,0,0|2,1,1]=4 33 B10R1.17 C#C\C=C\c1ccccc1 Amb25146407 [0,0,0,0,0,0|2,0,2]=4 34 B10R1.17 C=C/C=C/c1ccccc1 Amb17938988 [0,0,0,0,0,0|2,0,2]=4 35 B10R1.17 C=C=COc1ccccc1 Amb17673264 [0,0,0,0,0,0|1,0,2]=3 36 B10R1.17 C=CC#Cc1ccccc1 Amb25696607 [0,0,0,0,0,0|2,0,2]=4 37 B10R1.17 C=CCCc1c[n]ccc1 Amb24477186 [0,0,0,0,0,0|3,0,1]=4 38 B10R1.17 C=CCCc1cc[n]cc1 Amb25719590 [0,0,0,0,0,0|3,0,1]=4 39 B10R1.17 C=CCCc1cccc[n]1 Amb25337662 [0,0,0,0,0,0|3,0,1]=4 40 B10R1.17 C=CCNc1cc[n]cc1 Amb18986519 [0,0,0,0,0,0|3,0,1]=4 41 B10R1.17 C=CCOc1[n]ccc[n]1 Amb24101156 [0,0,0,0,0,0|3,0,1]=4 42 B10R1.17 C=CCOc1c[n]c[n]c1 Amb24098642 [0,0,0,0,0,0|3,0,1]=4 43 B10R1.17 C=CCOc1cc[n]cc1 Amb25234559 [0,0,0,0,0,0|2,0,1]=3 44 B10R1.17 C=CCSc1cc[n]cc1 Amb25725359 [0,0,0,0,0,0|2,1,1]=4 45 B10R1.17 C=CC[Se]c1cccc[n]1 Amb24101157 [0,0,0,0,0,0|2,1,1]=4 46 B10R1.17 C=CC[Se]c1ccccc1 Amb22729991 [0,0,0,0,0,0|1,1,1]=3 47 B10R1.17 C=CNCc1ccccc1 Amb24505107 [0,0,0,0,0,0|3,0,1]=4 48 B10R1.17 C=COCc1ccccc1 Amb17940722 [0,0,0,0,0,0|3,0,1]=4 49 B10R1.17 C=NOCc1ccccc1 Amb24704253 [0,0,0,0,0,0|4,0,0]=4 50 B10R1.17 CC#COc1ccccc1 Amb25146348 [0,0,0,0,0,0|1,0,2]=3 51 B10R1.17 CC/C=C/c1ccccc1 Amb17673826 [0,0,0,0,0,0|2,0,1]=3 52 B10R1.17 CCC#Cc1c[n]ccc1 Amb24085891 [0,0,0,0,0,0|3,0,1]=4 53 B10R1.17 CCC#Cc1cccc[n]1 Amb24069949 [0,0,0,0,0,0|3,0,1]=4 54 B10R1.17 CCC=Cc1c[n]ccc1 Amb24085334 [0,0,0,0,0,0|3,0,1]=4 55 B10R1.17 CCCCC1C=CC=CN1 Amb25721630 [0,0,0,0,0,0|3,0,1]=4 56 B10R1.17 CCCCc1[n]ccc[n]1 Amb24104101 [0,0,0,0,0,0|4,0,0]=4 57 B10R1.17 CCCCc1c[n]c[n]c1 Amb24071084 [0,0,0,0,0,0|4,0,0]=4 58 B10R1.17 CCCCc1cc[n]c[n]1 Amb24091332 [0,0,0,0,0,0|4,0,0]=4 59 B10R1.17 CCCCc1ccc[n][n]1 Amb22235740 [0,0,0,0,0,0|4,0,0]=4 60 B10R1.17 CCCCc1ccccn1 Amb10574134 [0,0,0,0,0,0|3,0,0]=3 61 B10R1.17 CCCCc1ccncc1 Amb10555008 [0,0,0,0,0,0|3,0,0]=3 62 B10R1.17 CCCNc1c[n][n]cc1 Amb23559651 [0,0,0,0,0,0|4,0,0]=4 63 B10R1.17 CCCNc1cc[n]c[n]1 Amb18973881 [0,0,0,0,0,0|4,0,0]=4 64 B10R1.17 CCCNc1ccc[n][n]1 Amb18991535 [0,0,0,0,0,0|4,0,0]=4 65 B10R1.17 CCCNc1ccccc1 Amb22284540 [0,0,0,0,0,0|2,0,0]=2 66 B10R1.17 CCCOc1[n]ccc[n]1 Amb24084957 [0,0,0,0,0,0|3,0,0]=3 67 B10R1.17 CCCOc1c[n]cc[n]1 Amb24061285 [0,0,0,0,0,0|3,0,0]=3 68 B10R1.17 CCCOc1c[n]ccc1 Amb25064833 [0,0,0,0,0,0|2,0,0]=2 69 B10R1.17 CCCOc1cc[n]c[n]1 Amb24070634 [0,0,0,0,0,0|3,0,0]=3 70 B10R1.17 CCCOc1ccc[n][n]1 Amb24062248 [0,0,0,0,0,0|3,0,0]=3 71 B10R1.17 CCCOc1cccc[n]1 Amb24096899 [0,0,0,0,0,0|2,0,0]=2 72 B10R1.17 CCCSc1cc[n]c[n]1 Amb24454548 [0,0,0,0,0,0|3,1,0]=4 73 B10R1.17 CCCSc1ccc[n][n]1 Amb25098258 [0,0,0,0,0,0|3,1,0]=4 74 B10R1.17 CCCSc1cccc[n]1 Amb24733306 [0,0,0,0,0,0|2,1,0]=3 75 B10R1.17 CCN=Cc1ccccc1 Amb15692852 [0,0,0,0,0,0|3,0,0]=3 76 B10R1.17 CCNCc1c[n]ccc1 Amb21972163 [0,0,0,0,0,0|4,0,0]=4 77 B10R1.17 CCNCc1ccncc1 Amb1214646 [0,0,0,0,0,0|4,0,0]=4 78 B10R1.17 CCONc1cccc[n]1 Amb25307411 [0,0,0,0,0,0|4,0,0]=4 79 B10R1.17 CC\C=C/c1c[n]ccc1 Amb24602371 [0,0,0,0,0,0|3,0,1]=4 80 B10R1.17 CC\C=C/c1cc[n]cc1 Amb25831273 [0,0,0,0,0,0|3,0,1]=4 81 B10R1.17 CC\C=C\c1cc[n]cc1 Amb25379243 [0,0,0,0,0,0|3,0,1]=4 82 B10R1.17 CC\C=C\c1cccc[n]1 Amb22170387 [0,0,0,0,0,0|3,0,1]=4 83 B10R1.17 CC\N=C/c1c[n]ccc1 Amb24068896 [0,0,0,0,0,0|4,0,0]=4 84 B10R1.17 CC\N=C/c1cc[n]cc1 Amb25808022 [0,0,0,0,0,0|4,0,0]=4 85 B10R1.17 CC\N=C\c1cccc[n]1 Amb24585676 [0,0,0,0,0,0|4,0,0]=4 86 B10R1.17 CC\N=C\c1ccccc1 Amb10558476 [0,0,0,0,0,0|3,0,0]=3 87 B10R1.17 CN/N=C/c1ccccc1 Amb17867553 [0,0,0,0,0,0|4,0,0]=4 88 B10R1.17 CN=C=Nc1ccccc1 Amb24096797 [0,0,0,0,0,0|3,0,1]=4 89 B10R1.17 CNCCc1cc[n]cc1 Amb19958269 [0,0,0,0,0,0|4,0,0]=4 90 B10R1.17 CNCCc1cccc[n]1 Amb22167479 [0,0,0,0,0,0|4,0,0]=4 91 B10R1.17 CNCCc1ccccc1 Amb1132990 [0,0,0,0,0,0|3,0,0]=3 92 B10R1.17 CNCCc1ccccc1 Amb2119452 [0,0,0,0,0,0|3,0,0]=3 93 B10R1.17 CNCCc1ccccn1 Amb1651624 [0,0,0,0,0,0|4,0,0]=4 94 B10R1.17 CNCCc1cccnc1 Amb10068754 [0,0,0,0,0,0|4,0,0]=4 95 B10R1.17 CNCCc1cccnc1 Amb10576212 [0,0,0,0,0,0|4,0,0]=4 96 B10R1.17 CNCCc1cccnc1 Amb10576410 [0,0,0,0,0,0|4,0,0]=4 97 B10R1.17 CNCCc1ccncc1 Amb10071184 [0,0,0,0,0,0|4,0,0]=4 98 B10R1.17 CNNCc1ccccc1 Amb10553073 [0,0,0,0,0,0|4,0,0]=4 99 B10R1.17 CNOCc1ccccc1 Amb22059601 [0,0,0,0,0,0|4,0,0]=4 100 B10R1.17 CN\C=N\c1ccccc1 Amb25348617 [0,0,0,0,0,0|3,0,1]=4 101 B10R1.17 CN\N=N\c1ccccc1 Amb25720206 [0,0,0,0,0,0|4,0,0]=4 102 B10R1.17 COCC[n+]1ccccc1 Amb10554471 [0,0,0,0,0,0|4,0,0]=4 103 B10R1.17 COCCc1cccc[n]1 Amb24089662 [0,0,0,0,0,0|4,0,0]=4 104 B10R1.17 COCNc1ccccc1 Amb10565397 [0,0,0,0,0,0|3,0,0]=3 105 B10R1.17 COCOc1cccnc1 Amb10561791 [0,0,0,0,0,0|3,0,0]=3 106 B10R1.17 COCSc1cc[n]cc1 Amb25185189 [0,0,0,0,0,0|3,1,0]=4 107 B10R1.17 COCSc1cccc[n]1 Amb24482838 [0,0,0,0,0,0|3,1,0]=4 108 B10R1.17 CON=Cc1ccccc1 Amb22896936 [0,0,0,0,0,0|4,0,0]=4 109 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [0,0,0,0,0,0|3,0,1]=4 110 B10R1.17 CO\N=C\c1ccccc1 Amb25762975 [0,0,0,0,0,0|4,0,0]=4 111 B10R1.17 CSCCc1cccc[n]1 Amb24552366 [0,0,0,0,0,0|4,0,0]=4 112 B10R1.17 CSCCc1ccncc1 Amb1864660 [0,0,0,0,0,0|4,0,0]=4 113 B10R1.17 CSCOc1ccccc1 Amb22231357 [0,0,0,0,0,0|2,0,0]=2 114 B10R1.17 CSCSc1cccc[n]1 Amb24658343 [0,0,0,0,0,0|3,1,0]=4 115 B10R1.17 CSCSc1ccccc1 Amb25162526 [0,0,0,0,0,0|2,1,0]=3 116 B10R1.17 CSSCc1ccccc1 Amb22230274 [0,0,0,0,0,0|4,0,0]=4 117 B10R1.17 C\C=C/Oc1cccc[n]1 Amb24101907 [0,0,0,0,0,0|2,0,2]=4 118 B10R1.17 C\C=C\Oc1cccc[n]1 Amb24101879 [0,0,0,0,0,0|2,0,2]=4 119 B10R1.17 C\C=C\Oc1ccccc1 Amb10564701 [0,0,0,0,0,0|1,0,2]=3 120 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [0,0,0,0,0,0|1,1,2]=4 121 B10R1.17 ClC=C=Cc1ccccc1 Amb17670635 [0,0,0,0,0,0|2,0,2]=4 122 B10R1.17 ClC=CCc1ccccc1 Amb24093913 [0,0,0,0,0,0|2,0,2]=4 123 B10R1.17 ClCC#Cc1c[n]ccc1 Amb18791489 [0,0,0,0,0,0|3,0,1]=4 124 B10R1.17 ClCC#Cc1cc[n]cc1 Amb25047964 [0,0,0,0,0,0|3,0,1]=4 125 B10R1.17 ClCC#Cc1ccccc1 Amb17772264 [0,0,0,0,0,0|2,0,1]=3 126 B10R1.17 ClCC=Cc1c[n]ccc1 Amb24082988 [0,0,0,0,0,0|3,0,1]=4 127 B10R1.17 ClCCC[n+]1ccccc1 Amb24487853 [0,0,0,0,0,0|3,0,0]=3 128 B10R1.17 ClCCCc1[n]ccc[n]1 Amb24657327 [0,0,0,0,0,0|4,0,0]=4 129 B10R1.17 ClCCCc1cc[n]cc1 Amb21961566 [0,0,0,0,0,0|3,0,0]=3 130 B10R1.17 ClCCCc1ccccn1 Amb17477793 [0,0,0,0,0,0|3,0,0]=3 131 B10R1.17 ClCCCc1cccnc1 Amb17477795 [0,0,0,0,0,0|3,0,0]=3 132 B10R1.17 ClCCCc1ccncc1 Amb17477794 [0,0,0,0,0,0|3,0,0]=3 133 B10R1.17 ClCCNc1c[n]cc[n]1 Amb25256817 [0,0,0,0,0,0|4,0,0]=4 134 B10R1.17 ClCCNc1ccc[n][n]1 Amb25740858 [0,0,0,0,0,0|4,0,0]=4 135 B10R1.17 ClCCNc1ccccc1 Amb17334388 [0,0,0,0,0,0|2,0,0]=2 136 B10R1.17 ClCCOc1c[n]ccc1 Amb19878080 [0,0,0,0,0,0|2,0,0]=2 137 B10R1.17 ClCCOc1c[n]ccc1 Amb22052586 [0,0,0,0,0,0|2,0,0]=2 138 B10R1.17 ClCCOc1cccc[n]1 Amb25098766 [0,0,0,0,0,0|2,0,0]=2 139 B10R1.17 ClCCPc1ccccc1 Amb24390336 [0,0,0,0,0,0|2,0,0]=2 140 B10R1.17 ClCCSc1cc[n]c[n]1 Amb18177992 [0,0,0,0,0,0|3,1,0]=4 141 B10R1.17 ClCCSc1ccc[n][n]1 Amb18185675 [0,0,0,0,0,0|3,1,0]=4 142 B10R1.17 ClCSCc1ccccc1 Amb16231183 [0,0,0,0,0,0|3,0,0]=3 143 B10R1.17 ClC[SiH2]Cc1ccccc1 Amb24433498 [0,0,0,0,0,0|2,1,0]=3 144 B10R1.17 ClC\C=C/c1c[n]ccc1 Amb24567985 [0,0,0,0,0,0|3,0,1]=4 145 B10R1.17 ClC\C=C\c1cccc[n]1 Amb24353572 [0,0,0,0,0,0|3,0,1]=4 146 B10R1.17 Cl[Mg]CCc1ccccc1 Amb22338391 [0,0,0,0,0,0|3,0,0]=3 147 B10R1.17 Cl\C=C\Cc1ccccc1 Amb24384369 [0,0,0,0,0,0|2,0,2]=4 148 B10R1.17 FCC#Cc1ccccc1 Amb24586400 [0,0,0,0,0,0|2,0,1]=3 149 B10R1.17 FCCCc1ccccc1 Amb25737014 [0,0,0,0,0,0|2,0,0]=2 150 B10R1.17 FCCNc1c[n]ccc1 Amb24062313 [0,0,0,0,0,0|3,0,0]=3 151 B10R1.17 FCCNc1cc[n]cc1 Amb24099520 [0,0,0,0,0,0|3,0,0]=3 152 B10R1.17 FCCNc1cccc[n]1 Amb24509379 [0,0,0,0,0,0|3,0,0]=3 153 B10R1.17 FCCOc1c[n]ccc1 Amb24750081 [0,0,0,0,0,0|2,0,0]=2 154 B10R1.17 FCCOc1cccc[n]1 Amb24349895 [0,0,0,0,0,0|2,0,0]=2 155 B10R1.17 FCCOc1ccccc1 Amb25350055 [0,0,0,0,0,0|1,0,0]=1 156 B10R1.17 FCCSc1cc[n]c[n]1 Amb24574252 [0,0,0,0,0,0|3,1,0]=4 157 B10R1.17 ICCCc1ccccc1 Amb10605506 [0,0,0,0,0,0|2,0,0]=2 158 B10R1.17 ICCOc1ccccc1 Amb10608588 [0,0,0,0,0,0|1,0,0]=1 159 B10R1.17 ICCSc1[n]ccc[n]1 Amb24540162 [0,0,0,0,0,0|3,1,0]=4 160 B10R1.17 N#CC#Cc1ccccc1 Amb17593333 [0,0,0,0,0,0|2,0,2]=4 161 B10R1.17 N#CCCc1ccccn1 Amb1102488 [0,0,0,0,0,0|3,0,1]=4 162 B10R1.17 N#CCCc1cccnc1 Amb10605345 [0,0,0,0,0,0|3,0,1]=4 163 B10R1.17 N#CCNc1c[n]ccc1 Amb25757230 [0,0,0,0,0,0|3,0,1]=4 164 B10R1.17 N#CCNc1cccc[n]1 Amb22052191 [0,0,0,0,0,0|3,0,1]=4 165 B10R1.17 N#CCNc1ccccc1 Amb1651088 [0,0,0,0,0,0|2,0,1]=3 166 B10R1.17 N#CCOc1ccccn1 Amb2459771 [0,0,0,0,0,0|2,0,1]=3 167 B10R1.17 N#CCOc1cccnc1 Amb17399827 [0,0,0,0,0,0|2,0,1]=3 168 B10R1.17 N#CCSc1cc[n]cc1 Amb25725230 [0,0,0,0,0,0|2,1,1]=4 169 B10R1.17 N#CCSc1ccccn1 Amb2496389 [0,0,0,0,0,0|2,1,1]=4 170 B10R1.17 N#C[Se]Cc1ccccc1 Amb22731764 [0,0,0,0,0,0|3,0,1]=4 171 B10R1.17 N#C\C=C\c1ccccc1 Amb1678044 [0,0,0,0,0,0|2,0,2]=4 172 B10R1.17 N=COCc1ccccc1 Amb22269902 [0,0,0,0,0,0|3,0,1]=4 173 B10R1.17 N=COCc1ccccc1 Amb24652885 [0,0,0,0,0,0|3,0,1]=4 174 B10R1.17 NCC#Cc1c[n]ccc1 Amb18281095 [0,0,0,0,0,0|3,0,1]=4 175 B10R1.17 NCC#Cc1cccc[n]1 Amb20668332 [0,0,0,0,0,0|3,0,1]=4 176 B10R1.17 NCC#Cc1ccccc1 Amb1239477 [0,0,0,0,0,0|2,0,1]=3 177 B10R1.17 NCC#Cc1ccccc1 Amb2371766 [0,0,0,0,0,0|2,0,1]=3 178 B10R1.17 NCCCc1[n]ccc[n]1 Amb18064230 [0,0,0,0,0,0|4,0,0]=4 179 B10R1.17 NCCCc1c[n][n]cc1 Amb23559549 [0,0,0,0,0,0|4,0,0]=4 180 B10R1.17 NCCCc1c[n]c[n]c1 Amb22751643 [0,0,0,0,0,0|4,0,0]=4 181 B10R1.17 NCCCc1c[n]cc[n]1 Amb18832322 [0,0,0,0,0,0|4,0,0]=4 182 B10R1.17 NCCCc1c[n]cc[n]1 Amb20622876 [0,0,0,0,0,0|4,0,0]=4 183 B10R1.17 NCCCc1c[n]ccc1 Amb18363942 [0,0,0,0,0,0|3,0,0]=3 184 B10R1.17 NCCCc1cc[n]c[n]1 Amb18981848 [0,0,0,0,0,0|4,0,0]=4 185 B10R1.17 NCCCc1cc[n]cc1 Amb22490382 [0,0,0,0,0,0|3,0,0]=3 186 B10R1.17 NCCCc1cc[n]cc1 Amb24099592 [0,0,0,0,0,0|3,0,0]=3 187 B10R1.17 NCCCc1ccc[n][n]1 Amb25031583 [0,0,0,0,0,0|4,0,0]=4 188 B10R1.17 NCCCc1cccc[n]1 Amb21954278 [0,0,0,0,0,0|3,0,0]=3 189 B10R1.17 NCCCc1ccccc1 Amb22490482 [0,0,0,0,0,0|2,0,0]=2 190 B10R1.17 NCCCc1ccccn1 Amb1088884 [0,0,0,0,0,0|3,0,0]=3 191 B10R1.17 NCCNc1c[n][n]cc1 Amb25290327 [0,0,0,0,0,0|4,0,0]=4 192 B10R1.17 NCCNc1c[n]c[n]c1 Amb18298014 [0,0,0,0,0,0|4,0,0]=4 193 B10R1.17 NCCNc1cc[n]c[n]1 Amb18973879 [0,0,0,0,0,0|4,0,0]=4 194 B10R1.17 NCCNc1cc[n]cc1 Amb19887545 [0,0,0,0,0,0|3,0,0]=3 195 B10R1.17 NCCNc1ccc[n][n]1 Amb18298689 [0,0,0,0,0,0|4,0,0]=4 196 B10R1.17 NCCNc1ccccc1 Amb23412206 [0,0,0,0,0,0|2,0,0]=2 197 B10R1.17 NCCNc1ccccn1 Amb10608961 [0,0,0,0,0,0|3,0,0]=3 198 B10R1.17 NCCNc1ccccn1 Amb1154294 [0,0,0,0,0,0|3,0,0]=3 199 B10R1.17 NCCNc1cccnc1 Amb10607840 [0,0,0,0,0,0|3,0,0]=3 200 B10R1.17 NCCNc1cnccn1 Amb1108614 [0,0,0,0,0,0|4,0,0]=4 201 B10R1.17 NCCNc1ncccn1 Amb1108055 [0,0,0,0,0,0|4,0,0]=4 202 B10R1.17 NCCNc1ncccn1 Amb15740843 [0,0,0,0,0,0|4,0,0]=4 203 B10R1.17 NCCOc1[n]ccc[n]1 Amb18292247 [0,0,0,0,0,0|3,0,0]=3 204 B10R1.17 NCCOc1c[n]cc[n]1 Amb18296473 [0,0,0,0,0,0|3,0,0]=3 205 B10R1.17 NCCOc1cc[n]c[n]1 Amb18292252 [0,0,0,0,0,0|3,0,0]=3 206 B10R1.17 NCCOc1cc[n]cc1 Amb18988858 [0,0,0,0,0,0|2,0,0]=2 207 B10R1.17 NCCOc1cc[n]cc1 Amb22728098 [0,0,0,0,0,0|2,0,0]=2 208 B10R1.17 NCCOc1cc[n]cc1 Amb24182077 [0,0,0,0,0,0|2,0,0]=2 209 B10R1.17 NCCOc1ccc[n][n]1 Amb18298723 [0,0,0,0,0,0|3,0,0]=3 210 B10R1.17 NCCOc1ccccc1 Amb1214559 [0,0,0,0,0,0|1,0,0]=1 211 B10R1.17 NCCOc1ccccc1 Amb2099529 [0,0,0,0,0,0|1,0,0]=1 212 B10R1.17 NCCOc1ccccn1 Amb2237065 [0,0,0,0,0,0|2,0,0]=2 213 B10R1.17 NCCPc1ccccc1 Amb24482461 [0,0,0,0,0,0|2,0,0]=2 214 B10R1.17 NCCSc1c[n]cc[n]1 Amb18251482 [0,0,0,0,0,0|3,1,0]=4 215 B10R1.17 NCCSc1cc[n]c[n]1 Amb18251484 [0,0,0,0,0,0|3,1,0]=4 216 B10R1.17 NCCSc1cc[n]cc1 Amb21861873 [0,0,0,0,0,0|2,1,0]=3 217 B10R1.17 NCCSc1ccccn1 Amb13949032 [0,0,0,0,0,0|2,1,0]=3 218 B10R1.17 NC\C=C/c1c[n]ccc1 Amb25349251 [0,0,0,0,0,0|3,0,1]=4 219 B10R1.17 NC\C=C/c1cc[n]cc1 Amb25295348 [0,0,0,0,0,0|3,0,1]=4 220 B10R1.17 NC\C=C/c1cccc[n]1 Amb25299216 [0,0,0,0,0,0|3,0,1]=4 221 B10R1.17 NC\C=C/c1ccccc1 Amb24746209 [0,0,0,0,0,0|2,0,1]=3 222 B10R1.17 NC\C=C\c1c[n]ccc1 Amb18063302 [0,0,0,0,0,0|3,0,1]=4 223 B10R1.17 NC\C=C\c1cc[n]cc1 Amb18062333 [0,0,0,0,0,0|3,0,1]=4 224 B10R1.17 NC\C=C\c1cccc[n]1 Amb18063261 [0,0,0,0,0,0|3,0,1]=4 225 B10R1.17 NC\C=C\c1ccccc1 Amb16187112 [0,0,0,0,0,0|2,0,1]=3 226 B10R1.17 NNC#Cc1ccccc1 Amb24443265 [0,0,0,0,0,0|3,0,1]=4 227 B10R1.17 NNCCc1c[n]ccc1 Amb22491198 [0,0,0,0,0,0|4,0,0]=4 228 B10R1.17 NNCCc1cccc[n]1 Amb20669588 [0,0,0,0,0,0|4,0,0]=4 229 B10R1.17 NNCCc1ccccc1 Amb10608987 [0,0,0,0,0,0|3,0,0]=3 230 B10R1.17 NNCCc1ccccc1 Amb1117029 [0,0,0,0,0,0|3,0,0]=3 231 B10R1.17 NOCCc1c[n]ccc1 Amb25779030 [0,0,0,0,0,0|4,0,0]=4 232 B10R1.17 NOCCc1ccccn1 Amb17231907 [0,0,0,0,0,0|4,0,0]=4 233 B10R1.17 NOCCc1ccncc1 Amb17231908 [0,0,0,0,0,0|4,0,0]=4 234 B10R1.17 O=CCCc1ccccn1 Amb17081674 [0,0,0,0,0,0|2,0,2]=4 235 B10R1.17 O=CCCc1cccnc1 Amb17081675 [0,0,0,0,0,0|2,0,2]=4 236 B10R1.17 O=CCNc1cccc[n]1 Amb24100487 [0,0,0,0,0,0|2,0,2]=4 237 B10R1.17 O=CCNc1ccccc1 Amb24566865 [0,0,0,0,0,0|1,0,2]=3 238 B10R1.17 O=CCOc1c[n]c[n]c1 Amb24083667 [0,0,0,0,0,0|2,0,2]=4 239 B10R1.17 O=CCOc1c[n]ccc1 Amb24068437 [0,0,0,0,0,0|1,0,2]=3 240 B10R1.17 O=CCOc1cc[n]c[n]1 Amb24478315 [0,0,0,0,0,0|2,0,2]=4 241 B10R1.17 O=CCOc1cc[n]cc1 Amb24068570 [0,0,0,0,0,0|1,0,2]=3 242 B10R1.17 O=CCSc1cc[n]cc1 Amb24475471 [0,0,0,0,0,0|1,1,2]=4 243 B10R1.17 O=CCSc1cccc[n]1 Amb18799459 [0,0,0,0,0,0|1,1,2]=4 244 B10R1.17 O=CCSc1ccccc1 Amb17082903 [0,0,0,0,0,0|0,1,2]=3 245 B10R1.17 O=CNCc1ccccc1 Amb1916036 [0,0,0,0,0,0|2,0,2]=4 246 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [0,0,0,0,0,0|1,0,3]=4 247 B10R1.17 O=C\C=N\c1ccccc1 Amb24561719 [0,0,0,0,0,0|1,0,3]=4 248 B10R1.17 O=NC#Cc1ccccc1 Amb24068843 [0,0,0,0,0,0|2,0,2]=4 249 B10R1.17 OCC#Cc1[n]ccc[n]1 Amb24068881 [0,0,0,0,0,0|3,0,1]=4 250 B10R1.17 OCC#Cc1ccccn1 Amb2227478 [0,0,0,0,0,0|2,0,1]=3 251 B10R1.17 OCC#Cc1cncnc1 Amb1086948 [0,0,0,0,0,0|3,0,1]=4 252 B10R1.17 OCCCC=1CC=CCC1 Amb22047467 [0,0,0,0,0,0|1,0,2]=3 253 B10R1.17 OCCCc1[n]ccc[n]1 Amb22499265 [0,0,0,0,0,0|3,0,0]=3 254 B10R1.17 OCCCc1c[n][n]cc1 Amb23559794 [0,0,0,0,0,0|3,0,0]=3 255 B10R1.17 OCCCc1c[n]c[n]c1 Amb24063145 [0,0,0,0,0,0|3,0,0]=3 256 B10R1.17 OCCCc1c[n]cc[n]1 Amb22499266 [0,0,0,0,0,0|3,0,0]=3 257 B10R1.17 OCCCc1cc[n]c[n]1 Amb24099660 [0,0,0,0,0,0|3,0,0]=3 258 B10R1.17 OCCCc1cccc[n]1 Amb22749323 [0,0,0,0,0,0|2,0,0]=2 259 B10R1.17 OCCNc1c[n]c[n]c1 Amb18270517 [0,0,0,0,0,0|3,0,0]=3 260 B10R1.17 OCCNc1c[n]ccc1 Amb18266115 [0,0,0,0,0,0|2,0,0]=2 261 B10R1.17 OCCNc1cc[n]c[n]1 Amb18973688 [0,0,0,0,0,0|3,0,0]=3 262 B10R1.17 OCCNc1ccc[n][n]1 Amb18298692 [0,0,0,0,0,0|3,0,0]=3 263 B10R1.17 OCCNc1ccccc1 Amb24065196 [0,0,0,0,0,0|1,0,0]=1 264 B10R1.17 OCCNc1ccccc1 Amb24065197 [0,0,0,0,0,0|1,0,0]=1 265 B10R1.17 OCCNc1ccccn1 Amb10809152 [0,0,0,0,0,0|2,0,0]=2 266 B10R1.17 OCCOC=1CCCCC1 Amb25686133 [0,0,0,0,0,0|0,0,4]=4 267 B10R1.17 OCCOc1c[n]c[n]c1 Amb24095083 [0,0,0,0,0,0|2,0,0]=2 268 B10R1.17 OCCOc1c[n]ccc1 Amb19333986 [0,0,0,0,0,0|1,0,0]=1 269 B10R1.17 OCCOc1ccc[n][n]1 Amb24728293 [0,0,0,0,0,0|2,0,0]=2 270 B10R1.17 OCCOc1cccc[n]1 Amb23598433 [0,0,0,0,0,0|1,0,0]=1 271 B10R1.17 OCCOc1ccccc1 Amb2209344 [0,0,0,0,0,0|0,0,0]=0 272 B10R1.17 OCCOc1ccncc1 Amb10552812 [0,0,0,0,0,0|1,0,0]=1 273 B10R1.17 OCCSc1c[n]ccc1 Amb25343843 [0,0,0,0,0,0|1,1,0]=2 274 B10R1.17 OCCSc1cc[n]c[n]1 Amb18787627 [0,0,0,0,0,0|2,1,0]=3 275 B10R1.17 OCCSc1ccc[n][n]1 Amb18799688 [0,0,0,0,0,0|2,1,0]=3 276 B10R1.17 OCNCc1ccccc1 Amb24756521 [0,0,0,0,0,0|2,0,0]=2 277 B10R1.17 OCOCc1ccccc1 Amb25727798 [0,0,0,0,0,0|2,0,0]=2 278 B10R1.17 OC\C=C\c1cc[n]cc1 Amb22749186 [0,0,0,0,0,0|2,0,1]=3 279 B10R1.17 OC\C=C\c1cccc[n]1 Amb22749315 [0,0,0,0,0,0|2,0,1]=3 280 B10R1.17 OC\C=C\c1cccnc1 Amb17619713 [0,0,0,0,0,0|2,0,1]=3 281 B10R1.17 OC\C=N\c1ccccc1 Amb25740591 [0,0,0,0,0,0|1,0,1]=2 282 B10R1.17 OC\N=C\c1ccccc1 Amb25105990 [0,0,0,0,0,0|2,0,0]=2 283 B10R1.17 ONCCc1ccccc1 Amb24117032 [0,0,0,0,0,0|2,0,0]=2 284 B10R1.17 S=C=CNc1ccccc1 Amb25728146 [0,0,0,0,0,0|1,1,2]=4 285 B10R1.17 S=C=NCc1ccccc1 Amb1102095 [0,0,0,0,0,0|2,1,1]=4 286 B10R1.17 SCCCc1ccccn1 Amb17399950 [0,0,0,0,0,0|2,1,0]=3 287 B10R1.17 SCCCc1cccnc1 Amb17399951 [0,0,0,0,0,0|2,1,0]=3 288 B10R1.17 SCCCc1ccncc1 Amb17399952 [0,0,0,0,0,0|2,1,0]=3 289 B10R1.17 SCCNc1[n]ccc[n]1 Amb24509517 [0,0,0,0,0,0|3,1,0]=4 290 B10R1.17 SCCNc1c[n]c[n]c1 Amb24095074 [0,0,0,0,0,0|3,1,0]=4 291 B10R1.17 SCCNc1cccc[n]1 Amb24340493 [0,0,0,0,0,0|2,1,0]=3 292 B10R1.17 SCCNc1ccccc1 Amb24065195 [0,0,0,0,0,0|1,1,0]=2 293 B10R1.17 SCCOc1c[n]ccc1 Amb25741157 [0,0,0,0,0,0|1,1,0]=2 294 B10R1.17 SCCSc1c[n]cc[n]1 Amb24340187 [0,0,0,0,0,0|2,2,0]=4 295 B10R1.17 SCCSc1ccccc1 Amb13881734 [0,0,0,0,0,0|0,2,0]=2 296 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [0,0,0,0,0,0|3,0,0]=3 297 B10R1.17 [C-]#[N+]CCc1ccncc1 Amb2235948 [0,0,0,0,0,0|4,0,0]=4 298 B10R1.17 [NH-]\[NH+]=N\Cc1ccccc1 Amb25857928 [0,0,0,0,0,0|4,0,0]=4 299 B10R1.17 [NH3+]CC#Cc1ccccc1 Amb10555899 [0,0,0,0,0,0|2,0,1]=3 300 B10R1.17 [SiH3]CCCc1c[n]ccc1 Amb24085247 [0,0,0,0,0,0|3,0,0]=3 301 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [0,0,0,0,0,0|2,0,0]=2 302 B9R1.8 BOCc1cccc[n]1 Amb24406683 [1,0,0,0,0,0|3,0,0]=4 303 B9R1.8 BrC#Cc1ccccc1 Amb16233213 [1,0,0,0,0,0|1,0,2]=4 304 B9R1.8 BrCCc1c[n]c[n]c1 Amb18327370 [1,0,0,0,0,0|3,0,0]=4 305 B9R1.8 BrCCc1c[n]cc[n]1 Amb24652166 [1,0,0,0,0,0|3,0,0]=4 306 B9R1.8 BrCCc1c[n]ccc1 Amb19069960 [1,0,0,0,0,0|2,0,0]=3 307 B9R1.8 BrCCc1c[n]ccc1 Amb19372982 [1,0,0,0,0,0|2,0,0]=3 308 B9R1.8 BrCCc1cc[n]c[n]1 Amb25681855 [1,0,0,0,0,0|3,0,0]=4 309 B9R1.8 BrCCc1cc[n]cc1 Amb18326675 [1,0,0,0,0,0|2,0,0]=3 310 B9R1.8 BrCCc1ccccn1 Amb1102303 [1,0,0,0,0,0|2,0,0]=3 311 B9R1.8 BrCCc1ccccn1 Amb17935743 [1,0,0,0,0,0|2,0,0]=3 312 B9R1.8 BrCNc1ccccc1 Amb25758335 [1,0,0,0,0,0|2,0,0]=3 313 B9R1.8 Br[Mg]Cc1ccccc1 Amb20240676 [1,0,0,0,0,0|2,0,0]=3 314 B9R1.8 Br[Zn]Cc1ccccc1 Amb22000396 [1,0,0,0,0,0|2,0,0]=3 315 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [1,0,0,0,0,0|1,0,2]=4 316 B9R1.8 C#CC[n+]1ccccc1 Amb2227878 [1,0,0,0,0,0|2,0,1]=4 317 B9R1.8 C#CCc1cc[n]cc1 Amb24478677 [1,0,0,0,0,0|2,0,1]=4 318 B9R1.8 C#CCc1cccc[n]1 Amb25759001 [1,0,0,0,0,0|2,0,1]=4 319 B9R1.8 C#CSc1ccccc1 Amb17940373 [1,0,0,0,0,0|0,1,2]=4 320 B9R1.8 C#C[I+]c1ccccc1 Amb19883870 [1,0,0,0,0,0|1,0,2]=4 321 B9R1.8 C=CC[n+]1ccccc1 Amb10554482 [1,0,0,0,0,0|2,0,1]=4 322 B9R1.8 C=CC[n+]1ccccc1 Amb10573243 [1,0,0,0,0,0|2,0,1]=4 323 B9R1.8 C=CCc1c[n]ccc1 Amb24477831 [1,0,0,0,0,0|2,0,1]=4 324 B9R1.8 C=CNc1ccccc1 Amb24476658 [1,0,0,0,0,0|1,0,2]=4 325 B9R1.8 C=COc1c[n]ccc1 Amb24085952 [1,0,0,0,0,0|1,0,2]=4 326 B9R1.8 C=COc1cc[n]cc1 Amb24091446 [1,0,0,0,0,0|1,0,2]=4 327 B9R1.8 C=COc1ccccc1 Amb10564213 [1,0,0,0,0,0|0,0,2]=3 328 B9R1.8 C=NCc1c[n]ccc1 Amb24062506 [1,0,0,0,0,0|3,0,0]=4 329 B9R1.8 CC#Cc1c[n]ccc1 Amb24085144 [1,0,0,0,0,0|2,0,1]=4 330 B9R1.8 CC#Cc1cccc[n]1 Amb25147069 [1,0,0,0,0,0|2,0,1]=4 331 B9R1.8 CCC[n+]1ccccc1 Amb24325390 [1,0,0,0,0,0|2,0,0]=3 332 B9R1.8 CCCc1[n]ccc[n]1 Amb24084965 [1,0,0,0,0,0|3,0,0]=4 333 B9R1.8 CCCc1c[n]c[n]c1 Amb24071652 [1,0,0,0,0,0|3,0,0]=4 334 B9R1.8 CCCc1cc[n]c[n]1 Amb24070638 [1,0,0,0,0,0|3,0,0]=4 335 B9R1.8 CCCc1ccc[n][n]1 Amb24447402 [1,0,0,0,0,0|3,0,0]=4 336 B9R1.8 CCCc1ccccc1 Amb2447143 [1,0,0,0,0,0|1,0,0]=2 337 B9R1.8 CCNc1c[n][n]cc1 Amb23559704 [1,0,0,0,0,0|3,0,0]=4 338 B9R1.8 CCNc1c[n]c[n]c1 Amb18270553 [1,0,0,0,0,0|3,0,0]=4 339 B9R1.8 CCNc1cc[n]c[n]1 Amb18282107 [1,0,0,0,0,0|3,0,0]=4 340 B9R1.8 CCNc1ccc[n][n]1 Amb18286130 [1,0,0,0,0,0|3,0,0]=4 341 B9R1.8 CCNc1ccccc1 Amb22731692 [1,0,0,0,0,0|1,0,0]=2 342 B9R1.8 CCOc1[n]ccc[n]1 Amb22498694 [1,0,0,0,0,0|2,0,0]=3 343 B9R1.8 CCOc1c[n][n]cc1 Amb22500251 [1,0,0,0,0,0|2,0,0]=3 344 B9R1.8 CCOc1c[n]c[n]c1 Amb23412498 [1,0,0,0,0,0|2,0,0]=3 345 B9R1.8 CCOc1cc[n]c[n]1 Amb24091512 [1,0,0,0,0,0|2,0,0]=3 346 B9R1.8 CCOc1ccc[n][n]1 Amb19958352 [1,0,0,0,0,0|2,0,0]=3 347 B9R1.8 CCOc1cccnc1 Amb10573342 [1,0,0,0,0,0|1,0,0]=2 348 B9R1.8 CCSc1c[n]c[n]c1 Amb24070802 [1,0,0,0,0,0|2,1,0]=4 349 B9R1.8 CCSc1cc[n]c[n]1 Amb24102978 [1,0,0,0,0,0|2,1,0]=4 350 B9R1.8 CCSc1ccc[n][n]1 Amb24462843 [1,0,0,0,0,0|2,1,0]=4 351 B9R1.8 CNCc1ccccn1 Amb10068750 [1,0,0,0,0,0|3,0,0]=4 352 B9R1.8 CNCc1ccccn1 Amb10576408 [1,0,0,0,0,0|3,0,0]=4 353 B9R1.8 CNCc1cccnc1 Amb10066918 [1,0,0,0,0,0|3,0,0]=4 354 B9R1.8 CNCc1cccnc1 Amb10576409 [1,0,0,0,0,0|3,0,0]=4 355 B9R1.8 CNCc1cccnc1 Amb1648828 [1,0,0,0,0,0|3,0,0]=4 356 B9R1.8 CNCc1ccncc1 Amb10068773 [1,0,0,0,0,0|3,0,0]=4 357 B9R1.8 CNCc1ccncc1 Amb10576211 [1,0,0,0,0,0|3,0,0]=4 358 B9R1.8 CNCc1ccncc1 Amb1115812 [1,0,0,0,0,0|3,0,0]=4 359 B9R1.8 CNNc1cccc[n]1 Amb25146742 [1,0,0,0,0,0|3,0,0]=4 360 B9R1.8 CNNc1ccccc1 Amb20242875 [1,0,0,0,0,0|2,0,0]=3 361 B9R1.8 CNSc1ccccc1 Amb25811332 [1,0,0,0,0,0|1,1,0]=3 362 B9R1.8 COC[n+]1ccccc1 Amb25309455 [1,0,0,0,0,0|3,0,0]=4 363 B9R1.8 COCc1c[n]ccc1 Amb24106446 [1,0,0,0,0,0|3,0,0]=4 364 B9R1.8 COCc1cc[n]cc1 Amb24075931 [1,0,0,0,0,0|3,0,0]=4 365 B9R1.8 CONc1c[n]ccc1 Amb25347084 [1,0,0,0,0,0|3,0,0]=4 366 B9R1.8 COPc1ccccc1 Amb22729661 [1,0,0,0,0,0|2,0,0]=3 367 B9R1.8 CSCc1c[n]ccc1 Amb24523080 [1,0,0,0,0,0|3,0,0]=4 368 B9R1.8 CSNc1cccc[n]1 Amb24072693 [1,0,0,0,0,0|3,0,0]=4 369 B9R1.8 CSSc1cc[n]cc1 Amb24081959 [1,0,0,0,0,0|2,1,0]=4 370 B9R1.8 CSSc1cccc[n]1 Amb25215539 [1,0,0,0,0,0|2,1,0]=4 371 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [1,0,0,0,0,0|2,0,0]=3 372 B9R1.8 C\C=C/c1c[n]ccc1 Amb25147168 [1,0,0,0,0,0|2,0,1]=4 373 B9R1.8 C\C=C/c1cc[n]cc1 Amb25064785 [1,0,0,0,0,0|2,0,1]=4 374 B9R1.8 C\C=C\[n+]1ccccc1 Amb22485619 [1,0,0,0,0,0|2,0,1]=4 375 B9R1.8 C\C=C\c1c[n]ccc1 Amb25290985 [1,0,0,0,0,0|2,0,1]=4 376 B9R1.8 C\C=N\c1cccc[n]1 Amb24533295 [1,0,0,0,0,0|2,0,1]=4 377 B9R1.8 C\N=C/c1cccc[n]1 Amb25337459 [1,0,0,0,0,0|3,0,0]=4 378 B9R1.8 C\N=C\c1c[n]ccc1 Amb21962079 [1,0,0,0,0,0|3,0,0]=4 379 B9R1.8 C\N=C\c1cc[n]cc1 Amb22330508 [1,0,0,0,0,0|3,0,0]=4 380 B9R1.8 C\N=C\c1cccc[n]1 Amb24553183 [1,0,0,0,0,0|3,0,0]=4 381 B9R1.8 ClC#Cc1ccccc1 Amb17670521 [1,0,0,0,0,0|1,0,2]=4 382 B9R1.8 ClC=Pc1ccccc1 Amb24480023 [1,0,0,0,0,0|2,0,1]=4 383 B9R1.8 ClCCc1[n]ccc[n]1 Amb25845186 [1,0,0,0,0,0|3,0,0]=4 384 B9R1.8 ClCCc1c[n]c[n]c1 Amb24529105 [1,0,0,0,0,0|3,0,0]=4 385 B9R1.8 ClCCc1c[n]cc[n]1 Amb24477833 [1,0,0,0,0,0|3,0,0]=4 386 B9R1.8 ClCCc1c[n]ccc1 Amb20241066 [1,0,0,0,0,0|2,0,0]=3 387 B9R1.8 ClCCc1c[n]ccc1 Amb24061504 [1,0,0,0,0,0|2,0,0]=3 388 B9R1.8 ClCCc1cc[n]c[n]1 Amb25100826 [1,0,0,0,0,0|3,0,0]=4 389 B9R1.8 ClCCc1cc[n]cc1 Amb23400891 [1,0,0,0,0,0|2,0,0]=3 390 B9R1.8 ClCCc1ccc[n][n]1 Amb25373976 [1,0,0,0,0,0|3,0,0]=4 391 B9R1.8 ClCCc1cccc[n]1 Amb19892295 [1,0,0,0,0,0|2,0,0]=3 392 B9R1.8 ClCCc1ccccn1 Amb1102254 [1,0,0,0,0,0|2,0,0]=3 393 B9R1.8 ClCNc1ccccc1 Amb25836772 [1,0,0,0,0,0|2,0,0]=3 394 B9R1.8 ClCOc1c[n]ccc1 Amb25780203 [1,0,0,0,0,0|2,0,0]=3 395 B9R1.8 ClCOc1ccccc1 Amb22059503 [1,0,0,0,0,0|1,0,0]=2 396 B9R1.8 ClCPc1ccccc1 Amb25294535 [1,0,0,0,0,0|2,0,0]=3 397 B9R1.8 ClCSc1c[n]ccc1 Amb25837457 [1,0,0,0,0,0|2,1,0]=4 398 B9R1.8 ClC[SiH2]c1ccccc1 Amb22230170 [1,0,0,0,0,0|1,1,0]=3 399 B9R1.8 ClSSc1ccccc1 Amb25248198 [1,0,0,0,0,0|2,1,0]=4 400 B9R1.8 Cl[Hg]Cc1ccccc1 Amb22360147 [1,0,0,0,0,0|2,0,0]=3 401 B9R1.8 Cl[Zn]Cc1cccc[n]1 Amb22000362 [1,0,0,0,0,0|3,0,0]=4 402 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [1,0,0,0,0,0|1,0,2]=4 403 B9R1.8 Cl\C=N\c1ccccc1 Amb24710175 [1,0,0,0,0,0|2,0,1]=4 404 B9R1.8 FC#Cc1ccccc1 Amb25080554 [1,0,0,0,0,0|1,0,2]=4 405 B9R1.8 FCCc1c[n]ccc1 Amb24085191 [1,0,0,0,0,0|2,0,0]=3 406 B9R1.8 FCCc1cc[n]cc1 Amb24102730 [1,0,0,0,0,0|2,0,0]=3 407 B9R1.8 FCCc1cccc[n]1 Amb24070130 [1,0,0,0,0,0|2,0,0]=3 408 B9R1.8 FCOc1ccccc1 Amb24099991 [1,0,0,0,0,0|1,0,0]=2 409 B9R1.8 FCSc1cccc[n]1 Amb24106749 [1,0,0,0,0,0|2,1,0]=4 410 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [1,0,0,0,0,0|1,0,2]=4 411 B9R1.8 ICCc1cccc[n]1 Amb24573930 [1,0,0,0,0,0|2,0,0]=3 412 B9R1.8 I[Hg]Cc1ccccc1 Amb22347189 [1,0,0,0,0,0|2,0,0]=3 413 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [1,0,0,0,0,0|1,0,2]=4 414 B9R1.8 N#CC[n+]1ccccc1 Amb10554489 [1,0,0,0,0,0|2,0,1]=4 415 B9R1.8 N#COc1cccc[n]1 Amb24364723 [1,0,0,0,0,0|2,0,1]=4 416 B9R1.8 N#COc1ccccc1 Amb15692860 [1,0,0,0,0,0|1,0,1]=3 417 B9R1.8 N#C[13CH2]c1ccccc1 Amb22337751 [1,0,0,0,0,0|1,0,1]=3 418 B9R1.8 N#[13C]Cc1ccccc1 Amb22363279 [1,0,0,0,0,0|1,0,1]=3 419 B9R1.8 N#[13C][13CH2]c1ccccc1 Amb22367491 [1,0,0,0,0,0|1,0,1]=3 420 B9R1.8 NCCc1[n]ccc[n]1 Amb18199432 [1,0,0,0,0,0|3,0,0]=4 421 B9R1.8 NCCc1[n]ccc[n]1 Amb23399636 [1,0,0,0,0,0|3,0,0]=4 422 B9R1.8 NCCc1[n]ccc[n]1 Amb24066982 [1,0,0,0,0,0|3,0,0]=4 423 B9R1.8 NCCc1c[n]cc[n]1 Amb22756001 [1,0,0,0,0,0|3,0,0]=4 424 B9R1.8 NCCc1c[n]cc[n]1 Amb24066949 [1,0,0,0,0,0|3,0,0]=4 425 B9R1.8 NCCc1c[n]ccc1 Amb20241523 [1,0,0,0,0,0|2,0,0]=3 426 B9R1.8 NCCc1cc[n]c[n]1 Amb22899210 [1,0,0,0,0,0|3,0,0]=4 427 B9R1.8 NCCc1cc[n]cc1 Amb20240779 [1,0,0,0,0,0|2,0,0]=3 428 B9R1.8 NCCc1ccc[n][n]1 Amb23592188 [1,0,0,0,0,0|3,0,0]=4 429 B9R1.8 NCCc1cccc[n]1 Amb24065228 [1,0,0,0,0,0|2,0,0]=3 430 B9R1.8 NCCc1cccc[n]1 Amb24066975 [1,0,0,0,0,0|2,0,0]=3 431 B9R1.8 NCCc1ccccc1 Amb17772283 [1,0,0,0,0,0|1,0,0]=2 432 B9R1.8 NCCc1ccccc1 Amb17843439 [1,0,0,0,0,0|1,0,0]=2 433 B9R1.8 NCCc1ccccc1 Amb22360716 [1,0,0,0,0,0|1,0,0]=2 434 B9R1.8 NCCc1ccccc1 Amb24325112 [1,0,0,0,0,0|1,0,0]=2 435 B9R1.8 NCCc1ccccc1 Amb24325408 [1,0,0,0,0,0|1,0,0]=2 436 B9R1.8 NCCc1ccccn1 Amb1156071 [1,0,0,0,0,0|2,0,0]=3 437 B9R1.8 NCCc1cccnc1 Amb1134784 [1,0,0,0,0,0|2,0,0]=3 438 B9R1.8 NCCc1cccnc1 Amb16230500 [1,0,0,0,0,0|2,0,0]=3 439 B9R1.8 NCCc1ccncc1 Amb1102164 [1,0,0,0,0,0|2,0,0]=3 440 B9R1.8 NCCc1cnccn1 Amb10067912 [1,0,0,0,0,0|3,0,0]=4 441 B9R1.8 NCCc1cnccn1 Amb1995199 [1,0,0,0,0,0|3,0,0]=4 442 B9R1.8 NCCc1ncccn1 Amb17074351 [1,0,0,0,0,0|3,0,0]=4 443 B9R1.8 NCNc1ccccc1 Amb17117015 [1,0,0,0,0,0|2,0,0]=3 444 B9R1.8 NCOc1ccccc1 Amb25128781 [1,0,0,0,0,0|1,0,0]=2 445 B9R1.8 NCSc1ccccc1 Amb25128061 [1,0,0,0,0,0|1,1,0]=3 446 B9R1.8 NC[13CH2]c1ccccc1 Amb22367506 [1,0,0,0,0,0|1,0,0]=2 447 B9R1.8 NNCc1c[n]ccc1 Amb19893243 [1,0,0,0,0,0|3,0,0]=4 448 B9R1.8 NNCc1c[n]ccc1 Amb22491471 [1,0,0,0,0,0|3,0,0]=4 449 B9R1.8 NNCc1cc[n]cc1 Amb19893255 [1,0,0,0,0,0|3,0,0]=4 450 B9R1.8 NNCc1cccc[n]1 Amb19893254 [1,0,0,0,0,0|3,0,0]=4 451 B9R1.8 NNCc1ccccc1 Amb1105200 [1,0,0,0,0,0|2,0,0]=3 452 B9R1.8 NNCc1ccccc1 Amb16231890 [1,0,0,0,0,0|2,0,0]=3 453 B9R1.8 NNCc1ccccc1 Amb22492438 [1,0,0,0,0,0|2,0,0]=3 454 B9R1.8 NNCc1ccccn1 Amb1117330 [1,0,0,0,0,0|3,0,0]=4 455 B9R1.8 NNCc1cccnc1 Amb1121062 [1,0,0,0,0,0|3,0,0]=4 456 B9R1.8 NNCc1ccncc1 Amb1118337 [1,0,0,0,0,0|3,0,0]=4 457 B9R1.8 NOCc1c[n]ccc1 Amb22059440 [1,0,0,0,0,0|3,0,0]=4 458 B9R1.8 NOCc1c[n]ccc1 Amb24074265 [1,0,0,0,0,0|3,0,0]=4 459 B9R1.8 NOCc1cc[n]cc1 Amb22397036 [1,0,0,0,0,0|3,0,0]=4 460 B9R1.8 NOCc1cccc[n]1 Amb18642195 [1,0,0,0,0,0|3,0,0]=4 461 B9R1.8 NOCc1ccccc1 Amb1154307 [1,0,0,0,0,0|2,0,0]=3 462 B9R1.8 NOCc1ccccc1 Amb16204809 [1,0,0,0,0,0|2,0,0]=3 463 B9R1.8 NOCc1ccccc1 Amb22489499 [1,0,0,0,0,0|2,0,0]=3 464 B9R1.8 N[13CH2][13CH2]c1ccccc1 Amb22367507 [1,0,0,0,0,0|1,0,0]=2 465 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [1,0,0,0,0,0|2,0,1]=4 466 B9R1.8 N\N=C\c1ccccc1 Amb2539422 [1,0,0,0,0,0|2,0,1]=4 467 B9R1.8 O/N=N/c1ccccn1 Amb17940654 [1,0,0,0,0,0|3,0,0]=4 468 B9R1.8 O=C=Cc1ccccc1 Amb25348365 [1,0,0,0,0,0|0,0,3]=4 469 B9R1.8 O=C=Nc1ccccc1 Amb22336344 [1,0,0,0,0,0|1,0,2]=4 470 B9R1.8 O=CCc1ccccn1 Amb17089528 [1,0,0,0,0,0|1,0,2]=4 471 B9R1.8 O=CCc1ccncc1 Amb17089529 [1,0,0,0,0,0|1,0,2]=4 472 B9R1.8 O=COc1c[n]ccc1 Amb25299157 [1,0,0,0,0,0|1,0,2]=4 473 B9R1.8 O=COc1ccccc1 Amb22002710 [1,0,0,0,0,0|0,0,2]=3 474 B9R1.8 OCC[n+]1ccccc1 Amb22364462 [1,0,0,0,0,0|1,0,0]=2 475 B9R1.8 OCCc1[n]ccc[n]1 Amb22896758 [1,0,0,0,0,0|2,0,0]=3 476 B9R1.8 OCCc1c[n][n]cc1 Amb23559765 [1,0,0,0,0,0|2,0,0]=3 477 B9R1.8 OCCc1c[n]c[n]c1 Amb20240921 [1,0,0,0,0,0|2,0,0]=3 478 B9R1.8 OCCc1cc[n]cc1 Amb24325389 [1,0,0,0,0,0|1,0,0]=2 479 B9R1.8 OCCc1ccc[n][n]1 Amb25086060 [1,0,0,0,0,0|2,0,0]=3 480 B9R1.8 OCCc1ccncn1 Amb17593271 [1,0,0,0,0,0|2,0,0]=3 481 B9R1.8 OCNc1[n]ccc[n]1 Amb24068196 [1,0,0,0,0,0|3,0,0]=4 482 B9R1.8 OCNc1cccc[n]1 Amb25066721 [1,0,0,0,0,0|2,0,0]=3 483 B9R1.8 OCOc1ccccc1 Amb25847006 [1,0,0,0,0,0|0,0,0]=1 484 B9R1.8 ON=Cc1ccccn1 Amb10573542 [1,0,0,0,0,0|2,0,1]=4 485 B9R1.8 ON=Cc1ccncc1 Amb10075320 [1,0,0,0,0,0|2,0,1]=4 486 B9R1.8 ONCc1[n]ccc[n]1 Amb23586395 [1,0,0,0,0,0|3,0,0]=4 487 B9R1.8 ONCc1c[n][n]cc1 Amb23586390 [1,0,0,0,0,0|3,0,0]=4 488 B9R1.8 ONCc1c[n]ccc1 Amb25147084 [1,0,0,0,0,0|2,0,0]=3 489 B9R1.8 ONCc1cc[n]c[n]1 Amb23586394 [1,0,0,0,0,0|3,0,0]=4 490 B9R1.8 ONCc1cc[n]cc1 Amb25851052 [1,0,0,0,0,0|2,0,0]=3 491 B9R1.8 ONCc1ccc[n][n]1 Amb23586391 [1,0,0,0,0,0|3,0,0]=4 492 B9R1.8 ONCc1ccccc1 Amb22001943 [1,0,0,0,0,0|1,0,0]=2 493 B9R1.8 O\N=C/c1c[n]ccc1 Amb24611619 [1,0,0,0,0,0|2,0,1]=4 494 B9R1.8 O\N=C/c1ccccn1 Amb10069892 [1,0,0,0,0,0|2,0,1]=4 495 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [1,0,0,0,0,0|1,0,1]=3 496 B9R1.8 O\N=C\c1ccncc1 Amb1793802 [1,0,0,0,0,0|2,0,1]=4 497 B9R1.8 S=C=Cc1ccccc1 Amb24084687 [1,0,0,0,0,0|0,1,2]=4 498 B9R1.8 S=C=Nc1ccccc1 Amb1161696 [1,0,0,0,0,0|1,1,1]=4 499 B9R1.8 S=CNc1ccccc1 Amb25788857 [1,0,0,0,0,0|1,1,1]=4 500 B9R1.8 SCCc1c[n]ccc1 Amb22008806 [1,0,0,0,0,0|1,1,0]=3 501 B9R1.8 SCCc1ccccn1 Amb17619707 [1,0,0,0,0,0|1,1,0]=3 502 B9R1.8 SCCc1ccncc1 Amb10552830 [1,0,0,0,0,0|1,1,0]=3 503 B9R1.8 [2H]C#Cc1ccccc1 Amb22351662 [1,0,0,0,0,0|1,0,2]=4 504 B9R1.8 [2H]\C=C/c1ccccc1 Amb22338396 [1,0,0,0,0,0|1,0,2]=4 505 B9R1.8 [2H]\C=C\c1ccccc1 Amb22351848 [1,0,0,0,0,0|1,0,2]=4 506 B9R1.8 [C-]#[N+]Cc1ccccc1 Amb2234859 [1,0,0,0,0,0|2,0,0]=3 507 B9R1.8 [C-]#[N+]Cc1ccccn1 Amb1981098 [1,0,0,0,0,0|3,0,0]=4 508 B9R1.8 [C-]#[N+]Cc1cccnc1 Amb1981058 [1,0,0,0,0,0|3,0,0]=4 509 B9R1.8 [C-]#[N+]Cc1ccncc1 Amb1981059 [1,0,0,0,0,0|3,0,0]=4 510 B9R1.8 [CH2-]\C=C\c1ccccc1 Amb22748801 [1,0,0,0,0,0|1,0,2]=4 511 B9R1.8 [Cu]C#Cc1ccccc1 Amb2480676 [1,0,0,0,0,0|1,0,2]=4 512 B9R1.8 [Li]C#Cc1ccccc1 Amb22336681 [1,0,0,0,0,0|1,0,2]=4 513 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [1,0,0,0,0,0|2,0,1]=4 514 B9R1.8 [NH3+]CCc1cc[nH+]cc1 Amb10553712 [1,0,0,0,0,0|2,0,0]=3 515 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [1,0,0,0,0,0|1,0,0]=2 516 B11R1.1 BrCCCc1ccc(I)cc1 Amb25083701 [0,1,0,0,0,0|2,0,0]=3 517 B11R1.1 BrCCCc1ccc(cc1)Br Amb17104577 [0,1,0,0,0,0|2,0,0]=3 518 B11R1.1 BrCCCc1ccc(cc1)C Amb17104554 [0,1,0,0,0,0|2,0,0]=3 519 B11R1.1 BrCCCc1ccc(cc1)Cl Amb17104562 [0,1,0,0,0,0|2,0,0]=3 520 B11R1.1 BrCCCc1ccc(cc1)F Amb17104556 [0,1,0,0,0,0|2,0,0]=3 521 B11R1.1 BrCCOc1ccc(cc1)Br Amb1106775 [0,1,0,0,0,0|1,0,0]=2 522 B11R1.1 BrCCOc1ccc(cc1)C Amb1397755 [0,1,0,0,0,0|1,0,0]=2 523 B11R1.1 BrCCOc1ccc(cc1)Cl Amb1151965 [0,1,0,0,0,0|1,0,0]=2 524 B11R1.1 BrCCOc1ccc(cc1)F Amb1152775 [0,1,0,0,0,0|1,0,0]=2 525 B11R1.1 Br[Zn]CCc1ccc(cc1)Br Amb13890855 [0,1,0,0,0,0|3,0,0]=4 526 B11R1.1 Brc1ccc(c[n]1)OCCBr Amb25716754 [0,1,0,0,0,0|2,0,0]=3 527 B11R1.1 Brc1ccc(cc1)C#CCBr Amb25704336 [0,1,0,0,0,0|2,0,1]=4 528 B11R1.1 C#CCCc1ccc(Br)cc1 Amb18116967 [0,1,0,0,0,0|2,0,1]=4 529 B11R1.1 C#CCCc1ccc(Cl)cc1 Amb18116815 [0,1,0,0,0,0|2,0,1]=4 530 B11R1.1 C#CCCc1ccc(F)cc1 Amb18116891 [0,1,0,0,0,0|2,0,1]=4 531 B11R1.1 C#CCNc1ccc(F)cc1 Amb24070273 [0,1,0,0,0,0|2,0,1]=4 532 B11R1.1 C#CCNc1ccc(I)cc1 Amb25195277 [0,1,0,0,0,0|2,0,1]=4 533 B11R1.1 C#CCNc1ccc(O)cc1 Amb24563278 [0,1,0,0,0,0|2,0,1]=4 534 B11R1.1 C#CCOc1ccc(Br)[n]c1 Amb25365808 [0,1,0,0,0,0|2,0,1]=4 535 B11R1.1 C#CCOc1ccc(Br)c[n]1 Amb24714311 [0,1,0,0,0,0|2,0,1]=4 536 B11R1.1 C#CCOc1ccc(Cl)[n]c1 Amb22642373 [0,1,0,0,0,0|2,0,1]=4 537 B11R1.1 C#CCOc1ccc(F)cc1 Amb18182727 [0,1,0,0,0,0|1,0,1]=3 538 B11R1.1 C#CCOc1ccc(I)cc1 Amb24476574 [0,1,0,0,0,0|1,0,1]=3 539 B11R1.1 C#CCOc1ccc(N)c[n]1 Amb23440814 [0,1,0,0,0,0|2,0,1]=4 540 B11R1.1 C#CCOc1ccc(N)cc1 Amb22587338 [0,1,0,0,0,0|1,0,1]=3 541 B11R1.1 C#CCOc1ccc(cc1)N Amb13783679 [0,1,0,0,0,0|1,0,1]=3 542 B11R1.1 C#CCSc1ccc(Br)cc1 Amb24669370 [0,1,0,0,0,0|1,1,1]=4 543 B11R1.1 C#CCSc1ccc(F)cc1 Amb18801035 [0,1,0,0,0,0|1,1,1]=4 544 B11R1.1 C#CCSc1ccc(O)cc1 Amb18792578 [0,1,0,0,0,0|1,1,1]=4 545 B11R1.1 C=CCCc1ccc(I)cc1 Amb25349986 [0,1,0,0,0,0|2,0,1]=4 546 B11R1.1 C=CCCc1ccc(N)cc1 Amb18124837 [0,1,0,0,0,0|2,0,1]=4 547 B11R1.1 C=CCCc1ccc(O)cc1 Amb25249578 [0,1,0,0,0,0|2,0,1]=4 548 B11R1.1 C=CCNc1ccc(N)cc1 Amb18991898 [0,1,0,0,0,0|2,0,1]=4 549 B11R1.1 C=CCNc1ccc(cc1)Br Amb17306795 [0,1,0,0,0,0|2,0,1]=4 550 B11R1.1 C=CCNc1ccc(cc1)C Amb17306868 [0,1,0,0,0,0|2,0,1]=4 551 B11R1.1 C=CCNc1ccc(cc1)Cl Amb17307236 [0,1,0,0,0,0|2,0,1]=4 552 B11R1.1 C=CCNc1ccc(cc1)F Amb17306180 [0,1,0,0,0,0|2,0,1]=4 553 B11R1.1 C=CCNc1ccc(cc1)I Amb17306247 [0,1,0,0,0,0|2,0,1]=4 554 B11R1.1 C=CCOc1ccc(Br)[n]c1 Amb24434702 [0,1,0,0,0,0|2,0,1]=4 555 B11R1.1 C=CCOc1ccc(Br)c[n]1 Amb25828007 [0,1,0,0,0,0|2,0,1]=4 556 B11R1.1 C=CCOc1ccc(Cl)cc1 Amb17933920 [0,1,0,0,0,0|1,0,1]=3 557 B11R1.1 C=CCOc1ccc(I)cc1 Amb25699607 [0,1,0,0,0,0|1,0,1]=3 558 B11R1.1 C=CCOc1ccc(N)c[n]1 Amb24062310 [0,1,0,0,0,0|2,0,1]=4 559 B11R1.1 C=CCSc1ccc(F)cc1 Amb24615573 [0,1,0,0,0,0|1,1,1]=4 560 B11R1.1 C=NCCc1ccc(O)cc1 Amb25327788 [0,1,0,0,0,0|3,0,0]=4 561 B11R1.1 CCC#Cc1ccc(F)cc1 Amb24730740 [0,1,0,0,0,0|2,0,1]=4 562 B11R1.1 CCCCN1C=CC(=N)C=C1 Amb19805017 [0,1,0,0,0,0|3,0,0]=4 563 B11R1.1 CCCCN1C=CC(=N)C=C1 Amb21922071 [0,1,0,0,0,0|3,0,0]=4 564 B11R1.1 CCCCN1C=CC(=[NH2+])C=C1 Amb22555482 [0,1,0,0,0,0|3,0,0]=4 565 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22350531 [0,1,0,0,0,0|3,0,0]=4 566 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22350545 [0,1,0,0,0,0|3,0,0]=4 567 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22353653 [0,1,0,0,0,0|3,0,0]=4 568 B11R1.1 CCCCc1ccc(Br)c[n]1 Amb24483961 [0,1,0,0,0,0|3,0,0]=4 569 B11R1.1 CCCCc1ccc(Cl)[n]c1 Amb21963887 [0,1,0,0,0,0|3,0,0]=4 570 B11R1.1 CCCCc1ccc(F)cc1 Amb22730516 [0,1,0,0,0,0|2,0,0]=3 571 B11R1.1 CCCCc1ccc(O)c[n]1 Amb25831110 [0,1,0,0,0,0|3,0,0]=4 572 B11R1.1 CCCNc1c[n]c(Cl)cc1 Amb24700682 [0,1,0,0,0,0|3,0,0]=4 573 B11R1.1 CCCNc1ccc(Cl)cc1 Amb19407162 [0,1,0,0,0,0|2,0,0]=3 574 B11R1.1 CCCNc1ccc(F)c[n]1 Amb18975389 [0,1,0,0,0,0|3,0,0]=4 575 B11R1.1 CCCNc1ccc(cn1)N Amb1113758 [0,1,0,0,0,0|3,0,0]=4 576 B11R1.1 CCCOC=1C=CC(=O)NN1 Amb24578937 [0,1,0,0,0,0|3,0,0]=4 577 B11R1.1 CCCOc1[n]cc(I)c[n]1 Amb25237356 [0,1,0,0,0,0|3,0,0]=4 578 B11R1.1 CCCOc1[n]cc(N)c[n]1 Amb18290432 [0,1,0,0,0,0|3,0,0]=4 579 B11R1.1 CCCOc1c[n]c(Br)cc1 Amb20617679 [0,1,0,0,0,0|2,0,0]=3 580 B11R1.1 CCCOc1c[n]c(Cl)[n]c1 Amb24321542 [0,1,0,0,0,0|3,0,0]=4 581 B11R1.1 CCCOc1c[n]c(Cl)c[n]1 Amb25294155 [0,1,0,0,0,0|3,0,0]=4 582 B11R1.1 CCCOc1c[n]c(I)cc1 Amb24450842 [0,1,0,0,0,0|2,0,0]=3 583 B11R1.1 CCCOc1ccc(Br)c[n]1 Amb19959351 [0,1,0,0,0,0|2,0,0]=3 584 B11R1.1 CCCOc1ccc(Cl)cc1 Amb25126411 [0,1,0,0,0,0|1,0,0]=2 585 B11R1.1 CCCOc1ccc(F)cc1 Amb24105714 [0,1,0,0,0,0|1,0,0]=2 586 B11R1.1 CCCOc1ccc(I)c[n]1 Amb24437593 [0,1,0,0,0,0|2,0,0]=3 587 B11R1.1 CCCOc1ccc(I)cc1 Amb24064716 [0,1,0,0,0,0|1,0,0]=2 588 B11R1.1 CCCOc1ccc(S)cc1 Amb25225762 [0,1,0,0,0,0|1,0,0]=2 589 B11R1.1 CCCOc1ccc(cc1)N Amb1125044 [0,1,0,0,0,0|1,0,0]=2 590 B11R1.1 CCCOc1ccc(cc1)O Amb1810008 [0,1,0,0,0,0|1,0,0]=2 591 B11R1.1 CCCOc1ccc(nn1)Br Amb10599688 [0,1,0,0,0,0|3,0,0]=4 592 B11R1.1 CCCOc1ccc(nn1)N Amb10603877 [0,1,0,0,0,0|3,0,0]=4 593 B11R1.1 CCCOc1cnc(cn1)Br Amb10599607 [0,1,0,0,0,0|3,0,0]=4 594 B11R1.1 CCCOc1ncc(cn1)Br Amb13884716 [0,1,0,0,0,0|3,0,0]=4 595 B11R1.1 CCCSc1c[n]c(Cl)cc1 Amb24719868 [0,1,0,0,0,0|2,1,0]=4 596 B11R1.1 CCCSc1ccc(Br)c[n]1 Amb24476580 [0,1,0,0,0,0|2,1,0]=4 597 B11R1.1 CCCSc1ccc(N)cc1 Amb22588114 [0,1,0,0,0,0|1,1,0]=3 598 B11R1.1 CCCSc1ccc(O)cc1 Amb18180159 [0,1,0,0,0,0|1,1,0]=3 599 B11R1.1 CCCSc1ccc(S)cc1 Amb24362640 [0,1,0,0,0,0|1,1,0]=3 600 B11R1.1 CCNCc1ccc(I)cc1 Amb25050868 [0,1,0,0,0,0|3,0,0]=4 601 B11R1.1 CCNCc1ccc(cc1)O Amb13952053 [0,1,0,0,0,0|3,0,0]=4 602 B11R1.1 CCNNc1ccc(F)cc1 Amb24086321 [0,1,0,0,0,0|3,0,0]=4 603 B11R1.1 CCOCc1ccc(Br)cc1 Amb19415022 [0,1,0,0,0,0|3,0,0]=4 604 B11R1.1 CCOCc1ccc(O)cc1 Amb18125402 [0,1,0,0,0,0|3,0,0]=4 605 B11R1.1 CCOCc1ccc(cc1)N Amb1125782 [0,1,0,0,0,0|3,0,0]=4 606 B11R1.1 CCON=C1C=CC(=O)C=C1 Amb25128866 [0,1,0,0,0,0|3,0,0]=4 607 B11R1.1 CCOOc1ccc(O)cc1 Amb24102976 [0,1,0,0,0,0|2,0,0]=3 608 B11R1.1 CCSCc1ccc(Br)cc1 Amb25684606 [0,1,0,0,0,0|3,0,0]=4 609 B11R1.1 CCSCc1ccc(Cl)cc1 Amb24402210 [0,1,0,0,0,0|3,0,0]=4 610 B11R1.1 CCSCc1ccc(F)cc1 Amb24486978 [0,1,0,0,0,0|3,0,0]=4 611 B11R1.1 CCSCc1ccc(O)cc1 Amb18126551 [0,1,0,0,0,0|3,0,0]=4 612 B11R1.1 CCSSc1ccc(N)cc1 Amb24396326 [0,1,0,0,0,0|2,1,0]=4 613 B11R1.1 CC\C=C/c1ccc(F)cc1 Amb24725207 [0,1,0,0,0,0|2,0,1]=4 614 B11R1.1 CC\C=C\c1ccc(O)cc1 Amb24655008 [0,1,0,0,0,0|2,0,1]=4 615 B11R1.1 CC\N=C\c1ccc(cc1)C Amb10553998 [0,1,0,0,0,0|3,0,0]=4 616 B11R1.1 CNCCc1ccc(N)cc1 Amb18290354 [0,1,0,0,0,0|3,0,0]=4 617 B11R1.1 CNCCc1ccc(cc1)O Amb15690577 [0,1,0,0,0,0|3,0,0]=4 618 B11R1.1 COCCc1ccc(Cl)cc1 Amb24118075 [0,1,0,0,0,0|3,0,0]=4 619 B11R1.1 COCCc1ccc(I)cc1 Amb25360538 [0,1,0,0,0,0|3,0,0]=4 620 B11R1.1 COCCc1ccc(cc1)N Amb1139224 [0,1,0,0,0,0|3,0,0]=4 621 B11R1.1 COCNc1ccc(F)cc1 Amb24070274 [0,1,0,0,0,0|3,0,0]=4 622 B11R1.1 COCOc1ccc(Br)c[n]1 Amb22235758 [0,1,0,0,0,0|3,0,0]=4 623 B11R1.1 COCOc1ccc(Br)cc1 Amb22001005 [0,1,0,0,0,0|2,0,0]=3 624 B11R1.1 COCOc1ccc(Cl)[n]c1 Amb22831876 [0,1,0,0,0,0|3,0,0]=4 625 B11R1.1 COCOc1ccc(F)[n]c1 Amb22831877 [0,1,0,0,0,0|3,0,0]=4 626 B11R1.1 COCOc1ccc(F)cc1 Amb22546791 [0,1,0,0,0,0|2,0,0]=3 627 B11R1.1 COCOc1ccc(I)[n]c1 Amb25357043 [0,1,0,0,0,0|3,0,0]=4 628 B11R1.1 COCOc1ccc(N)cc1 Amb24092674 [0,1,0,0,0,0|2,0,0]=3 629 B11R1.1 COCOc1ccc(O)cc1 Amb25268752 [0,1,0,0,0,0|2,0,0]=3 630 B11R1.1 COCSc1ccc(Br)cc1 Amb24473100 [0,1,0,0,0,0|2,1,0]=4 631 B11R1.1 COCSc1ccc(Cl)cc1 Amb24393521 [0,1,0,0,0,0|2,1,0]=4 632 B11R1.1 COCSc1ccc(N)cc1 Amb25714979 [0,1,0,0,0,0|2,1,0]=4 633 B11R1.1 CSCCc1ccc(N)cc1 Amb18971649 [0,1,0,0,0,0|3,0,0]=4 634 B11R1.1 CSCOc1ccc(Cl)cc1 Amb24553356 [0,1,0,0,0,0|2,0,0]=3 635 B11R1.1 CSCOc1ccc(F)cc1 Amb24645973 [0,1,0,0,0,0|2,0,0]=3 636 B11R1.1 CSCOc1ccc(I)[n]c1 Amb24570941 [0,1,0,0,0,0|3,0,0]=4 637 B11R1.1 CSCSc1ccc(Br)cc1 Amb25162619 [0,1,0,0,0,0|2,1,0]=4 638 B11R1.1 CSCSc1ccc(F)cc1 Amb25768258 [0,1,0,0,0,0|2,1,0]=4 639 B11R1.1 C\C=C/Oc1ccc(N)cc1 Amb24103180 [0,1,0,0,0,0|1,0,2]=4 640 B11R1.1 Cc1[n]cc(c[n]1)OCCN Amb24638022 [0,1,0,0,0,0|3,0,0]=4 641 B11R1.1 Cc1c[n]c([n]c1)OCCC Amb22444170 [0,1,0,0,0,0|3,0,0]=4 642 B11R1.1 Cc1c[n]c([n]c1)OCCN Amb24380248 [0,1,0,0,0,0|3,0,0]=4 643 B11R1.1 Cc1c[n]c([n]c1)SCCO Amb18180265 [0,1,0,0,0,0|2,1,0]=4 644 B11R1.1 Cc1cc[n+](CCCO)cc1 Amb24466262 [0,1,0,0,0,0|2,0,0]=3 645 B11R1.1 Cc1ccc(C=CCO)cc1 Amb22345885 [0,1,0,0,0,0|1,0,1]=3 646 B11R1.1 Cc1ccc(CCC#C)cc1 Amb18634818 [0,1,0,0,0,0|2,0,1]=4 647 B11R1.1 Cc1ccc(CCCC)[n]c1 Amb24676615 [0,1,0,0,0,0|3,0,0]=4 648 B11R1.1 Cc1ccc(CCCC)cc1 Amb22002059 [0,1,0,0,0,0|2,0,0]=3 649 B11R1.1 Cc1ccc(CCCN)[n]c1 Amb25348517 [0,1,0,0,0,0|3,0,0]=4 650 B11R1.1 Cc1ccc(CCCN)c[n]1 Amb22886484 [0,1,0,0,0,0|3,0,0]=4 651 B11R1.1 Cc1ccc(CCCN)c[n]1 Amb25069217 [0,1,0,0,0,0|3,0,0]=4 652 B11R1.1 Cc1ccc(CCCO)[n]c1 Amb25073187 [0,1,0,0,0,0|2,0,0]=3 653 B11R1.1 Cc1ccc(CCCO)c[n]1 Amb24533220 [0,1,0,0,0,0|2,0,0]=3 654 B11R1.1 Cc1ccc(CSCC)cc1 Amb24536616 [0,1,0,0,0,0|3,0,0]=4 655 B11R1.1 Cc1ccc(CSCCl)cc1 Amb25108662 [0,1,0,0,0,0|3,0,0]=4 656 B11R1.1 Cc1ccc(NCCCl)[n]c1 Amb25341757 [0,1,0,0,0,0|3,0,0]=4 657 B11R1.1 Cc1ccc(NCCN)[n]c1 Amb19515509 [0,1,0,0,0,0|3,0,0]=4 658 B11R1.1 Cc1ccc(NCCO)[n][n]1 Amb18975347 [0,1,0,0,0,0|3,0,0]=4 659 B11R1.1 Cc1ccc([n][n]1)OCCN Amb18296389 [0,1,0,0,0,0|3,0,0]=4 660 B11R1.1 Cc1ccc([n][n]1)SCCO Amb18177939 [0,1,0,0,0,0|2,1,0]=4 661 B11R1.1 Cc1ccc([n]c1)OCC#C Amb25353105 [0,1,0,0,0,0|2,0,1]=4 662 B11R1.1 Cc1ccc([n]c1)OCC=C Amb24631767 [0,1,0,0,0,0|2,0,1]=4 663 B11R1.1 Cc1ccc([n]c1)OCCN Amb18296482 [0,1,0,0,0,0|2,0,0]=3 664 B11R1.1 Cc1ccc([n]c1)OCOC Amb24386613 [0,1,0,0,0,0|3,0,0]=4 665 B11R1.1 Cc1ccc([n]c1)OCSC Amb25714138 [0,1,0,0,0,0|3,0,0]=4 666 B11R1.1 Cc1ccc([n]c1)SCCC Amb25792073 [0,1,0,0,0,0|2,1,0]=4 667 B11R1.1 Cc1ccc([n]c1)SCCF Amb25717499 [0,1,0,0,0,0|2,1,0]=4 668 B11R1.1 Cc1ccc(\C=C\CBr)cc1 Amb24575176 [0,1,0,0,0,0|2,0,1]=4 669 B11R1.1 Cc1ccc(\C=C\CN)cc1 Amb18563249 [0,1,0,0,0,0|2,0,1]=4 670 B11R1.1 Cc1ccc(\C=C\CO)c[n]1 Amb25790076 [0,1,0,0,0,0|2,0,1]=4 671 B11R1.1 Cc1ccc(\C=C\CO)cc1 Amb23442829 [0,1,0,0,0,0|1,0,1]=3 672 B11R1.1 Cc1ccc(\C=C\NO)cc1 Amb24621859 [0,1,0,0,0,0|2,0,1]=4 673 B11R1.1 Cc1ccc(c[n]1)NCCN Amb24477635 [0,1,0,0,0,0|3,0,0]=4 674 B11R1.1 Cc1ccc(c[n]1)OCC=C Amb25838352 [0,1,0,0,0,0|2,0,1]=4 675 B11R1.1 Cc1ccc(c[n]1)OCCC Amb25111097 [0,1,0,0,0,0|2,0,0]=3 676 B11R1.1 Cc1ccc(c[n]1)OCCN Amb18992842 [0,1,0,0,0,0|2,0,0]=3 677 B11R1.1 Cc1ccc(c[n]1)OCCO Amb23455913 [0,1,0,0,0,0|1,0,0]=2 678 B11R1.1 Cc1ccc(c[n]1)OCOC Amb24070816 [0,1,0,0,0,0|3,0,0]=4 679 B11R1.1 Cc1ccc(cc1)C#CCCl Amb18792612 [0,1,0,0,0,0|2,0,1]=4 680 B11R1.1 Cc1ccc(cc1)C#CCN Amb18281200 [0,1,0,0,0,0|2,0,1]=4 681 B11R1.1 Cc1ccc(cc1)NCC#C Amb21953776 [0,1,0,0,0,0|2,0,1]=4 682 B11R1.1 Cc1ccc(cc1)NCCBr Amb24575185 [0,1,0,0,0,0|2,0,0]=3 683 B11R1.1 Cc1ccc(cc1)NCCS Amb24538179 [0,1,0,0,0,0|1,1,0]=3 684 B11R1.1 Cc1ccc(cc1)NCOC Amb25301269 [0,1,0,0,0,0|3,0,0]=4 685 B11R1.1 Cc1ccc(cc1)OCC#C Amb19373357 [0,1,0,0,0,0|1,0,1]=3 686 B11R1.1 Cc1ccc(cc1)OCOC Amb20241783 [0,1,0,0,0,0|2,0,0]=3 687 B11R1.1 Cc1ccc(cc1)SCOC Amb25032720 [0,1,0,0,0,0|2,1,0]=4 688 B11R1.1 Cc1ccc(cc1)\N=C\CCl Amb25791668 [0,1,0,0,0,0|2,0,1]=4 689 B11R1.1 Cc1ccc(cc1)\N=C\CO Amb24430956 [0,1,0,0,0,0|1,0,1]=3 690 B11R1.1 ClCCCc1ccc(cc1)Br Amb17104549 [0,1,0,0,0,0|2,0,0]=3 691 B11R1.1 ClCCCc1ccc(cc1)C Amb17104527 [0,1,0,0,0,0|2,0,0]=3 692 B11R1.1 ClCCCc1ccc(cc1)F Amb17104529 [0,1,0,0,0,0|2,0,0]=3 693 B11R1.1 ClCCCc1ccc(cc1)N Amb17477708 [0,1,0,0,0,0|2,0,0]=3 694 B11R1.1 ClCCCc1ccc(cc1)O Amb17477722 [0,1,0,0,0,0|2,0,0]=3 695 B11R1.1 ClCCNc1ccc(cc1)Br Amb17346195 [0,1,0,0,0,0|2,0,0]=3 696 B11R1.1 ClCCNc1ccc(cc1)C Amb17334787 [0,1,0,0,0,0|2,0,0]=3 697 B11R1.1 ClCCNc1ccc(cc1)Cl Amb17336182 [0,1,0,0,0,0|2,0,0]=3 698 B11R1.1 ClCCNc1ccc(cc1)F Amb17334965 [0,1,0,0,0,0|2,0,0]=3 699 B11R1.1 ClCCSc1ccc(cc1)C Amb1657286 [0,1,0,0,0,0|1,1,0]=3 700 B11R1.1 ClCCSc1ccc(cc1)Cl Amb1154201 [0,1,0,0,0,0|1,1,0]=3 701 B11R1.1 ClCOCc1ccc(Br)cc1 Amb24376347 [0,1,0,0,0,0|3,0,0]=4 702 B11R1.1 ClC\C=C\c1ccc(Br)cc1 Amb21926649 [0,1,0,0,0,0|2,0,1]=4 703 B11R1.1 ClC\C=C\c1ccc(I)cc1 Amb24614945 [0,1,0,0,0,0|2,0,1]=4 704 B11R1.1 Clc1ccc(CC[Mg]Cl)cc1 Amb22897275 [0,1,0,0,0,0|3,0,0]=4 705 B11R1.1 Clc1ccc(CC[Zn]Br)cc1 Amb22000488 [0,1,0,0,0,0|3,0,0]=4 706 B11R1.1 Clc1ccc(CC[Zn]Cl)cc1 Amb22897728 [0,1,0,0,0,0|3,0,0]=4 707 B11R1.1 Clc1ccc(CSCCl)cc1 Amb25704966 [0,1,0,0,0,0|3,0,0]=4 708 B11R1.1 Clc1ccc(NCCCl)[n]c1 Amb25191177 [0,1,0,0,0,0|3,0,0]=4 709 B11R1.1 Clc1ccc([n]c1)SCCBr Amb24509249 [0,1,0,0,0,0|2,1,0]=4 710 B11R1.1 Clc1ccc(\C=C\CBr)cc1 Amb22007806 [0,1,0,0,0,0|2,0,1]=4 711 B11R1.1 Clc1ccc(\C=C\CCl)cc1 Amb25185292 [0,1,0,0,0,0|2,0,1]=4 712 B11R1.1 Clc1ccc(cc1)C#CCBr Amb24384136 [0,1,0,0,0,0|2,0,1]=4 713 B11R1.1 Clc1ccc(cc1)C#CCCl Amb18319781 [0,1,0,0,0,0|2,0,1]=4 714 B11R1.1 Clc1ccc(cc1)C#CCI Amb25353537 [0,1,0,0,0,0|2,0,1]=4 715 B11R1.1 Clc1ccc(cc1)OCCI Amb25833023 [0,1,0,0,0,0|1,0,0]=2 716 B11R1.1 Clc1ccc(cc1)O\C=C/Cl Amb24533093 [0,1,0,0,0,0|1,0,2]=4 717 B11R1.1 FCC#Cc1ccc(Cl)cc1 Amb25825390 [0,1,0,0,0,0|2,0,1]=4 718 B11R1.1 FCC#Cc1ccc(I)cc1 Amb25353811 [0,1,0,0,0,0|2,0,1]=4 719 B11R1.1 FCCOc1ccc(Br)c[n]1 Amb25301795 [0,1,0,0,0,0|2,0,0]=3 720 B11R1.1 FCCOc1ccc(Br)cc1 Amb22227902 [0,1,0,0,0,0|1,0,0]=2 721 B11R1.1 FCCOc1ccc(Cl)[n][n]1 Amb24741962 [0,1,0,0,0,0|3,0,0]=4 722 B11R1.1 FCCOc1ccc(I)cc1 Amb22227565 [0,1,0,0,0,0|1,0,0]=2 723 B11R1.1 FCCOc1ccc(S)cc1 Amb23580141 [0,1,0,0,0,0|1,0,0]=2 724 B11R1.1 FCCSc1ccc(Br)c[n]1 Amb24734597 [0,1,0,0,0,0|2,1,0]=4 725 B11R1.1 FCCSc1ccc(Cl)cc1 Amb24644973 [0,1,0,0,0,0|1,1,0]=3 726 B11R1.1 FCSCc1ccc(Cl)cc1 Amb24437363 [0,1,0,0,0,0|3,0,0]=4 727 B11R1.1 Fc1ccc(CC[Zn]Br)cc1 Amb22000495 [0,1,0,0,0,0|3,0,0]=4 728 B11R1.1 Fc1ccc(NCCF)[n]c1 Amb25831303 [0,1,0,0,0,0|3,0,0]=4 729 B11R1.1 Fc1ccc([n]c1)SCCCl Amb18317647 [0,1,0,0,0,0|2,1,0]=4 730 B11R1.1 Fc1ccc(\C=C\CCl)cc1 Amb25074621 [0,1,0,0,0,0|2,0,1]=4 731 B11R1.1 Fc1ccc(c[n]1)OCCF Amb24395747 [0,1,0,0,0,0|2,0,0]=3 732 B11R1.1 Fc1ccc(cc1)C#CCBr Amb25737916 [0,1,0,0,0,0|2,0,1]=4 733 B11R1.1 Fc1ccc(cc1)C#CCCl Amb18180184 [0,1,0,0,0,0|2,0,1]=4 734 B11R1.1 Fc1ccc(cc1)NCCS Amb24545874 [0,1,0,0,0,0|1,1,0]=3 735 B11R1.1 Fc1ccc(cc1)OCCF Amb24686958 [0,1,0,0,0,0|1,0,0]=2 736 B11R1.1 Fc1ccc(cc1)SCCF Amb24484072 [0,1,0,0,0,0|1,1,0]=3 737 B11R1.1 Fc1ccc(cc1)SCCS Amb24689240 [0,1,0,0,0,0|0,2,0]=3 738 B11R1.1 N#CCCc1ccc(I)cc1 Amb25785381 [0,1,0,0,0,0|2,0,1]=4 739 B11R1.1 N#CCCc1ccc(cc1)C Amb17204297 [0,1,0,0,0,0|2,0,1]=4 740 B11R1.1 N#CCCc1ccc(cc1)F Amb17204299 [0,1,0,0,0,0|2,0,1]=4 741 B11R1.1 N#CCOc1ccc(Cl)[n]c1 Amb25823494 [0,1,0,0,0,0|2,0,1]=4 742 B11R1.1 N#CCOc1ccc(F)[n]c1 Amb25677155 [0,1,0,0,0,0|2,0,1]=4 743 B11R1.1 N#CCOc1ccc(I)[n]c1 Amb24485330 [0,1,0,0,0,0|2,0,1]=4 744 B11R1.1 N#CCSc1ccc(O)cc1 Amb18180090 [0,1,0,0,0,0|1,1,1]=4 745 B11R1.1 N#CCSc1ccc(cc1)Br Amb17644 [0,1,0,0,0,0|1,1,1]=4 746 B11R1.1 N#CCSc1ccc(cc1)Cl Amb1156063 [0,1,0,0,0,0|1,1,1]=4 747 B11R1.1 N#CCSc1ccc(cc1)F Amb1152494 [0,1,0,0,0,0|1,1,1]=4 748 B11R1.1 N=C=COc1ccc(F)cc1 Amb24100657 [0,1,0,0,0,0|1,0,2]=4 749 B11R1.1 NCC#Cc1ccc(Br)cc1 Amb18253475 [0,1,0,0,0,0|2,0,1]=4 750 B11R1.1 NCC#Cc1ccc(Cl)cc1 Amb18950127 [0,1,0,0,0,0|2,0,1]=4 751 B11R1.1 NCC#Cc1ccc(F)cc1 Amb18949804 [0,1,0,0,0,0|2,0,1]=4 752 B11R1.1 NCCCN1C=CC(=O)C=C1 Amb18029471 [0,1,0,0,0,0|3,0,0]=4 753 B11R1.1 NCCCc1cc[n+]([O-])cc1 Amb25145870 [0,1,0,0,0,0|3,0,0]=4 754 B11R1.1 NCCCc1ccc(Br)[n]c1 Amb24453424 [0,1,0,0,0,0|3,0,0]=4 755 B11R1.1 NCCCc1ccc(Cl)[n]c1 Amb25849321 [0,1,0,0,0,0|3,0,0]=4 756 B11R1.1 NCCCc1ccc(I)cc1 Amb25172834 [0,1,0,0,0,0|2,0,0]=3 757 B11R1.1 NCCCc1ccc(S)cc1 Amb25228495 [0,1,0,0,0,0|2,0,0]=3 758 B11R1.1 NCCCc1ccc(cc1)Cl Amb1092541 [0,1,0,0,0,0|2,0,0]=3 759 B11R1.1 NCCCc1ccc(cc1)Cl Amb13952055 [0,1,0,0,0,0|2,0,0]=3 760 B11R1.1 NCCCc1ccc(cc1)N Amb17477693 [0,1,0,0,0,0|2,0,0]=3 761 B11R1.1 NCCCc1ccc(cc1)O Amb10066893 [0,1,0,0,0,0|2,0,0]=3 762 B11R1.1 NCCCc1ccc(cc1)O Amb17598403 [0,1,0,0,0,0|2,0,0]=3 763 B11R1.1 NCCNc1ccc(F)c[n]1 Amb18291560 [0,1,0,0,0,0|3,0,0]=4 764 B11R1.1 NCCNc1ccc(F)cc1 Amb17845075 [0,1,0,0,0,0|2,0,0]=3 765 B11R1.1 NCCNc1ccc(cc1)Br Amb17057752 [0,1,0,0,0,0|2,0,0]=3 766 B11R1.1 NCCNc1ccc(cc1)C Amb17057746 [0,1,0,0,0,0|2,0,0]=3 767 B11R1.1 NCCNc1ccc(cc1)Cl Amb17057751 [0,1,0,0,0,0|2,0,0]=3 768 B11R1.1 NCCOc1[n]cc(Br)c[n]1 Amb25743579 [0,1,0,0,0,0|3,0,0]=4 769 B11R1.1 NCCOc1[n]cc(F)c[n]1 Amb24528952 [0,1,0,0,0,0|3,0,0]=4 770 B11R1.1 NCCOc1[n]cc(I)c[n]1 Amb25710188 [0,1,0,0,0,0|3,0,0]=4 771 B11R1.1 NCCOc1c[n]c(Cl)c[n]1 Amb24550752 [0,1,0,0,0,0|3,0,0]=4 772 B11R1.1 NCCOc1c[n]c(I)cc1 Amb24707119 [0,1,0,0,0,0|2,0,0]=3 773 B11R1.1 NCCOc1ccc(Br)c[n]1 Amb18988876 [0,1,0,0,0,0|2,0,0]=3 774 B11R1.1 NCCOc1ccc(Br)cc1 Amb19338687 [0,1,0,0,0,0|1,0,0]=2 775 B11R1.1 NCCOc1ccc(Cl)[n][n]1 Amb18988870 [0,1,0,0,0,0|3,0,0]=4 776 B11R1.1 NCCOc1ccc(Cl)c[n]1 Amb18988875 [0,1,0,0,0,0|2,0,0]=3 777 B11R1.1 NCCOc1ccc(Cl)c[n]1 Amb20631070 [0,1,0,0,0,0|2,0,0]=3 778 B11R1.1 NCCOc1ccc(F)c[n]1 Amb18296419 [0,1,0,0,0,0|2,0,0]=3 779 B11R1.1 NCCOc1ccc(O)cc1 Amb18125536 [0,1,0,0,0,0|1,0,0]=2 780 B11R1.1 NCCOc1ccc(cc1)Br Amb1098668 [0,1,0,0,0,0|1,0,0]=2 781 B11R1.1 NCCOc1ccc(cc1)C Amb1101721 [0,1,0,0,0,0|1,0,0]=2 782 B11R1.1 NCCOc1ccc(cc1)C Amb2196480 [0,1,0,0,0,0|1,0,0]=2 783 B11R1.1 NCCOc1ccc(cc1)Cl Amb1153919 [0,1,0,0,0,0|1,0,0]=2 784 B11R1.1 NCCOc1ccc(cc1)F Amb1102015 [0,1,0,0,0,0|1,0,0]=2 785 B11R1.1 NCCSc1ccc(Br)c[n]1 Amb24509248 [0,1,0,0,0,0|2,1,0]=4 786 B11R1.1 NCCSc1ccc(Cl)c[n]1 Amb18252999 [0,1,0,0,0,0|2,1,0]=4 787 B11R1.1 NCCSc1ccc(O)cc1 Amb18971693 [0,1,0,0,0,0|1,1,0]=3 788 B11R1.1 NCCSc1ccc(cc1)Br Amb1105170 [0,1,0,0,0,0|1,1,0]=3 789 B11R1.1 NCCSc1ccc(cc1)Cl Amb2236679 [0,1,0,0,0,0|1,1,0]=3 790 B11R1.1 NC\C=C/c1ccc(cc1)C Amb10560257 [0,1,0,0,0,0|2,0,1]=4 791 B11R1.1 NC\C=C\c1ccc(Br)cc1 Amb18066634 [0,1,0,0,0,0|2,0,1]=4 792 B11R1.1 NC\C=C\c1ccc(Cl)cc1 Amb18563824 [0,1,0,0,0,0|2,0,1]=4 793 B11R1.1 NC\C=C\c1ccc(F)cc1 Amb18065348 [0,1,0,0,0,0|2,0,1]=4 794 B11R1.1 NC\C=C\c1ccc(O)cc1 Amb18124993 [0,1,0,0,0,0|2,0,1]=4 795 B11R1.1 NOCCc1ccc(F)cc1 Amb22896631 [0,1,0,0,0,0|3,0,0]=4 796 B11R1.1 NOCCc1ccc(O)cc1 Amb25053130 [0,1,0,0,0,0|3,0,0]=4 797 B11R1.1 Nc1[n]cc(CCCO)c[n]1 Amb22394981 [0,1,0,0,0,0|3,0,0]=4 798 B11R1.1 Nc1[n]cc(c[n]1)NCCO Amb25268650 [0,1,0,0,0,0|3,0,0]=4 799 B11R1.1 Nc1[n]cc(c[n]1)OCCO Amb24649854 [0,1,0,0,0,0|2,0,0]=3 800 B11R1.1 Nc1c[n]c(NCCO)[n]c1 Amb18972657 [0,1,0,0,0,0|3,0,0]=4 801 B11R1.1 Nc1c[n]c([n]c1)OCCO Amb18290429 [0,1,0,0,0,0|2,0,0]=3 802 B11R1.1 Nc1c[n]c([n]c1)SCCO Amb18972723 [0,1,0,0,0,0|2,1,0]=4 803 B11R1.1 Nc1c[n]c(c[n]1)NCCO Amb22495878 [0,1,0,0,0,0|3,0,0]=4 804 B11R1.1 Nc1c[n]c(c[n]1)SCCO Amb24487958 [0,1,0,0,0,0|2,1,0]=4 805 B11R1.1 Nc1ccc(CCCBr)cc1 Amb22229466 [0,1,0,0,0,0|2,0,0]=3 806 B11R1.1 Nc1ccc(CCCF)cc1 Amb25697152 [0,1,0,0,0,0|2,0,0]=3 807 B11R1.1 Nc1ccc(CCCO)cc1 Amb21964655 [0,1,0,0,0,0|1,0,0]=2 808 B11R1.1 Nc1ccc(COCF)cc1 Amb25764872 [0,1,0,0,0,0|3,0,0]=4 809 B11R1.1 Nc1ccc(NCCF)[n]c1 Amb24725236 [0,1,0,0,0,0|3,0,0]=4 810 B11R1.1 Nc1ccc(NCCO)[n]c1 Amb24080718 [0,1,0,0,0,0|2,0,0]=3 811 B11R1.1 Nc1ccc([n]c1)OCCF Amb24484769 [0,1,0,0,0,0|2,0,0]=3 812 B11R1.1 Nc1ccc([n]c1)SCCN Amb18291131 [0,1,0,0,0,0|2,1,0]=4 813 B11R1.1 Nc1ccc(\C=C\CN)cc1 Amb24527675 [0,1,0,0,0,0|2,0,1]=4 814 B11R1.1 Nc1ccc(c[n]1)NCCF Amb25150683 [0,1,0,0,0,0|3,0,0]=4 815 B11R1.1 Nc1ccc(c[n]1)NCCN Amb18991503 [0,1,0,0,0,0|3,0,0]=4 816 B11R1.1 Nc1ccc(c[n]1)SCCF Amb24562126 [0,1,0,0,0,0|2,1,0]=4 817 B11R1.1 Nc1ccc(c[n]1)SCCN Amb18291321 [0,1,0,0,0,0|2,1,0]=4 818 B11R1.1 Nc1ccc(cc1)C#CCBr Amb25188870 [0,1,0,0,0,0|2,0,1]=4 819 B11R1.1 Nc1ccc(cc1)C#CCF Amb24554108 [0,1,0,0,0,0|2,0,1]=4 820 B11R1.1 Nc1ccc(cc1)C#CCO Amb22228978 [0,1,0,0,0,0|1,0,1]=3 821 B11R1.1 Nc1ccc(cc1)NCC#N Amb24089891 [0,1,0,0,0,0|2,0,1]=4 822 B11R1.1 Nc1ccc(cc1)NCCF Amb25804656 [0,1,0,0,0,0|2,0,0]=3 823 B11R1.1 Nc1ccc(cc1)NCCN Amb18298668 [0,1,0,0,0,0|2,0,0]=3 824 B11R1.1 Nc1ccc(cc1)OCCBr Amb20620461 [0,1,0,0,0,0|1,0,0]=2 825 B11R1.1 Nc1ccc(cc1)OCCCl Amb18126855 [0,1,0,0,0,0|1,0,0]=2 826 B11R1.1 Nc1ccc(cc1)OCCF Amb23579951 [0,1,0,0,0,0|1,0,0]=2 827 B11R1.1 Nc1ccc(cc1)OCCN Amb23401881 [0,1,0,0,0,0|1,0,0]=2 828 B11R1.1 Nc1ccc(cc1)SCCN Amb18975711 [0,1,0,0,0,0|1,1,0]=3 829 B11R1.1 O=C1C=CN(C=C1)SCCF Amb24357187 [0,1,0,0,0,0|2,1,0]=4 830 B11R1.1 O=C1C=CN(CCCBr)C=C1 Amb24350690 [0,1,0,0,0,0|3,0,0]=4 831 B11R1.1 O=C1C=CN(CCCCl)C=C1 Amb18178000 [0,1,0,0,0,0|3,0,0]=4 832 B11R1.1 O=C1C=CN(CCCF)C=C1 Amb24453605 [0,1,0,0,0,0|3,0,0]=4 833 B11R1.1 O=C1C=CN(CCCS)C=C1 Amb25792215 [0,1,0,0,0,0|2,1,0]=4 834 B11R1.1 O=CCCc1ccc(cc1)Br Amb10602155 [0,1,0,0,0,0|1,0,2]=4 835 B11R1.1 O=CCCc1ccc(cc1)F Amb10602156 [0,1,0,0,0,0|1,0,2]=4 836 B11R1.1 O=CCCc1ccc(cc1)O Amb17081693 [0,1,0,0,0,0|1,0,2]=4 837 B11R1.1 O=CCOc1ccc(cc1)Br Amb17099949 [0,1,0,0,0,0|0,0,2]=3 838 B11R1.1 O=CCSc1ccc(cc1)Br Amb17082907 [0,1,0,0,0,0|0,1,2]=4 839 B11R1.1 O=CCSc1ccc(cc1)C Amb17082904 [0,1,0,0,0,0|0,1,2]=4 840 B11R1.1 O=CCSc1ccc(cc1)Cl Amb17082906 [0,1,0,0,0,0|0,1,2]=4 841 B11R1.1 O=CCSc1ccc(cc1)F Amb17082905 [0,1,0,0,0,0|0,1,2]=4 842 B11R1.1 OCCCC=1C=CC(=O)NN1 Amb25762182 [0,1,0,0,0,0|3,0,0]=4 843 B11R1.1 OCCCN1C=CC(=O)C=C1 Amb18041267 [0,1,0,0,0,0|2,0,0]=3 844 B11R1.1 OCCCc1c[n]c(S)[n]c1 Amb22394982 [0,1,0,0,0,0|3,0,0]=4 845 B11R1.1 OCCCc1ccc(Br)[n]c1 Amb21963678 [0,1,0,0,0,0|2,0,0]=3 846 B11R1.1 OCCCc1ccc(Br)c[n]1 Amb25309177 [0,1,0,0,0,0|2,0,0]=3 847 B11R1.1 OCCCc1ccc(Cl)[n]c1 Amb21963672 [0,1,0,0,0,0|2,0,0]=3 848 B11R1.1 OCCCc1ccc(F)[n][n]1 Amb24062291 [0,1,0,0,0,0|3,0,0]=4 849 B11R1.1 OCCCc1ccc(F)[n]c1 Amb24085299 [0,1,0,0,0,0|2,0,0]=3 850 B11R1.1 OCCCc1ccc(I)cc1 Amb24406298 [0,1,0,0,0,0|1,0,0]=2 851 B11R1.1 OCCCc1ccc(cc1)Br Amb13883587 [0,1,0,0,0,0|1,0,0]=2 852 B11R1.1 OCCCc1ccc(cc1)F Amb17089497 [0,1,0,0,0,0|1,0,0]=2 853 B11R1.1 OCCCc1ccc(cc1)N Amb17477700 [0,1,0,0,0,0|1,0,0]=2 854 B11R1.1 OCCCc1ncc(cn1)S Amb1971490 [0,1,0,0,0,0|3,0,0]=4 855 B11R1.1 OCCNc1[n]cc(Br)c[n]1 Amb22233773 [0,1,0,0,0,0|3,0,0]=4 856 B11R1.1 OCCNc1[n]cc(F)c[n]1 Amb24486783 [0,1,0,0,0,0|3,0,0]=4 857 B11R1.1 OCCNc1[n]cc(I)c[n]1 Amb24488137 [0,1,0,0,0,0|3,0,0]=4 858 B11R1.1 OCCNc1c[n]c(Br)c[n]1 Amb24413181 [0,1,0,0,0,0|3,0,0]=4 859 B11R1.1 OCCNc1ccc(F)c[n]1 Amb18975393 [0,1,0,0,0,0|2,0,0]=3 860 B11R1.1 OCCNc1ccc(I)c[n]1 Amb25301350 [0,1,0,0,0,0|2,0,0]=3 861 B11R1.1 OCCOc1[n]cc(Br)c[n]1 Amb25117502 [0,1,0,0,0,0|2,0,0]=3 862 B11R1.1 OCCOc1c[n]c(Br)c[n]1 Amb25150720 [0,1,0,0,0,0|2,0,0]=3 863 B11R1.1 OCCOc1c[n]c(Br)cc1 Amb24434701 [0,1,0,0,0,0|1,0,0]=2 864 B11R1.1 OCCOc1c[n]c(Cl)cc1 Amb24607926 [0,1,0,0,0,0|1,0,0]=2 865 B11R1.1 OCCOc1c[n]c(F)cc1 Amb24447457 [0,1,0,0,0,0|1,0,0]=2 866 B11R1.1 OCCOc1c[n]c(I)cc1 Amb25316966 [0,1,0,0,0,0|1,0,0]=2 867 B11R1.1 OCCOc1ccc(Br)c[n]1 Amb19515691 [0,1,0,0,0,0|1,0,0]=2 868 B11R1.1 OCCOc1ccc(Cl)c[n]1 Amb23598439 [0,1,0,0,0,0|1,0,0]=2 869 B11R1.1 OCCOc1ccc(S)cc1 Amb24100726 [0,1,0,0,0,0|0,0,0]=1 870 B11R1.1 OCCOc1ccc(cc1)C Amb2209347 [0,1,0,0,0,0|0,0,0]=1 871 B11R1.1 OCCOc1ccc(cc1)Cl Amb2209356 [0,1,0,0,0,0|0,0,0]=1 872 B11R1.1 OCCOc1ccc(cc1)N Amb15740917 [0,1,0,0,0,0|0,0,0]=1 873 B11R1.1 OCCSN1C=CC(=O)C=C1 Amb25151653 [0,1,0,0,0,0|1,1,0]=3 874 B11R1.1 OCCSc1[n]cc(I)c[n]1 Amb25125772 [0,1,0,0,0,0|2,1,0]=4 875 B11R1.1 OCCSc1ccc(F)c[n]1 Amb18789954 [0,1,0,0,0,0|1,1,0]=3 876 B11R1.1 OCCSc1ccc(cc1)O Amb10575943 [0,1,0,0,0,0|0,1,0]=2 877 B11R1.1 OC\C=C\c1ccc(Cl)cc1 Amb21964138 [0,1,0,0,0,0|1,0,1]=3 878 B11R1.1 OC\C=C\c1ccc(F)cc1 Amb23442931 [0,1,0,0,0,0|1,0,1]=3 879 B11R1.1 OC\C=C\c1ccc(I)cc1 Amb24418980 [0,1,0,0,0,0|1,0,1]=3 880 B11R1.1 OC\C=C\c1ccc(cc1)O Amb2445151 [0,1,0,0,0,0|1,0,1]=3 881 B11R1.1 OC\N=C\c1ccc(Cl)cc1 Amb24466242 [0,1,0,0,0,0|2,0,0]=3 882 B11R1.1 Oc1[n]cc(CCCO)c[n]1 Amb25150392 [0,1,0,0,0,0|3,0,0]=4 883 B11R1.1 Oc1ccc(CCCBr)cc1 Amb25703932 [0,1,0,0,0,0|2,0,0]=3 884 B11R1.1 Oc1ccc(C\C=N\O)cc1 Amb25705671 [0,1,0,0,0,0|2,0,1]=4 885 B11R1.1 Oc1ccc(NCCO)[n][n]1 Amb21984450 [0,1,0,0,0,0|3,0,0]=4 886 B11R1.1 Oc1ccc(NCCO)[n]c1 Amb24458585 [0,1,0,0,0,0|2,0,0]=3 887 B11R1.1 Oc1ccc([n]c1)OCCO Amb24433383 [0,1,0,0,0,0|1,0,0]=2 888 B11R1.1 Oc1ccc(\C=C/CO)cc1 Amb25720012 [0,1,0,0,0,0|1,0,1]=3 889 B11R1.1 Oc1ccc(\C=C\CCl)cc1 Amb24598884 [0,1,0,0,0,0|2,0,1]=4 890 B11R1.1 Oc1ccc(cc1)C#CCCl Amb25315448 [0,1,0,0,0,0|2,0,1]=4 891 B11R1.1 Oc1ccc(cc1)C#CCI Amb25341074 [0,1,0,0,0,0|2,0,1]=4 892 B11R1.1 Oc1ccc(cc1)OCC=O Amb18125345 [0,1,0,0,0,0|0,0,2]=3 893 B11R1.1 Oc1ccc(cc1)OCCCl Amb18126982 [0,1,0,0,0,0|1,0,0]=2 894 B11R1.1 Oc1ccc(cc1)OCCF Amb24543531 [0,1,0,0,0,0|1,0,0]=2 895 B11R1.1 Oc1ccc(cc1)SCCCl Amb18650050 [0,1,0,0,0,0|1,1,0]=3 896 B11R1.1 Oc1ccc(cc1)SCCF Amb25699332 [0,1,0,0,0,0|1,1,0]=3 897 B11R1.1 SCCCc1ccc(cc1)Br Amb17407562 [0,1,0,0,0,0|1,1,0]=3 898 B11R1.1 SCCCc1ccc(cc1)C Amb17400220 [0,1,0,0,0,0|1,1,0]=3 899 B11R1.1 SCCCc1ccc(cc1)Cl Amb17401097 [0,1,0,0,0,0|1,1,0]=3 900 B11R1.1 SCCCc1ccc(cc1)F Amb17400333 [0,1,0,0,0,0|1,1,0]=3 901 B11R1.1 SCCNc1ccc(Cl)cc1 Amb25696044 [0,1,0,0,0,0|1,1,0]=3 902 B11R1.1 SCCOc1ccc(cc1)F Amb17232868 [0,1,0,0,0,0|0,1,0]=2 903 B11R1.1 SCCOc1ccc(cc1)N Amb17504126 [0,1,0,0,0,0|0,1,0]=2 904 B11R1.1 SCCSc1ccc(Cl)c[n]1 Amb24354265 [0,1,0,0,0,0|1,2,0]=4 905 B11R1.1 SCCSc1ccc(cc1)C Amb13881735 [0,1,0,0,0,0|0,2,0]=3 906 B11R1.1 SCCSc1ccc(cc1)Cl Amb13881736 [0,1,0,0,0,0|0,2,0]=3 907 B11R1.1 [C-]#[N+]CCc1ccc(O)cc1 Amb25730088 [0,1,0,0,0,0|3,0,0]=4 908 B11R1.1 [C-]#[N+]CSc1ccc(C)cc1 Amb25777926 [0,1,0,0,0,0|2,1,0]=4 909 B11R1.1 [NH3+]c1ccc(cc1)OCCF Amb22455028 [0,1,0,0,0,0|1,0,0]=2 910 B11R1.16 BrCCC(Br)c1ccccc1 Amb23456167 [0,1,0,0,0,0|2,0,0]=3 911 B11R1.16 C#CCC(Cl)c1ccccc1 Amb25264417 [0,1,0,0,0,0|2,0,1]=4 912 B11R1.16 C#CCC(N)c1ccccc1 Amb18959773 [0,1,0,0,0,0|2,0,1]=4 913 B11R1.16 C#CCS(=O)c1ccccc1 Amb25241742 [0,1,0,0,0,0|1,1,1]=4 914 B11R1.16 C#CC[C@@H](N)c1ccccc1 Amb24181858 [0,1,0,0,0,0|2,0,1]=4 915 B11R1.16 C#CC[C@H](N)c1ccccc1 Amb25169470 [0,1,0,0,0,0|2,0,1]=4 916 B11R1.16 C=CCC(=O)c1ccccc1 Amb17334260 [0,1,0,0,0,0|2,0,1]=4 917 B11R1.16 C=CCC(Br)c1ccccc1 Amb24668989 [0,1,0,0,0,0|2,0,1]=4 918 B11R1.16 C=CCC(N)c1ccccc1 Amb22831520 [0,1,0,0,0,0|2,0,1]=4 919 B11R1.16 C=CCC(O)c1ccccc1 Amb22228007 [0,1,0,0,0,0|2,0,1]=4 920 B11R1.16 C=CCC(c1ccccc1)N Amb17226687 [0,1,0,0,0,0|2,0,1]=4 921 B11R1.16 C=CCC(c1ccccc1)O Amb2389146 [0,1,0,0,0,0|2,0,1]=4 922 B11R1.16 C=CCN(c1ccccc1)N Amb17226668 [0,1,0,0,0,0|2,0,1]=4 923 B11R1.16 C=CCS(=O)c1ccccc1 Amb17933936 [0,1,0,0,0,0|1,1,1]=4 924 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22829899 [0,1,0,0,0,0|2,0,1]=4 925 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22831832 [0,1,0,0,0,0|2,0,1]=4 926 B11R1.16 C=CC[C@@H](O)c1ccccc1 Amb24726216 [0,1,0,0,0,0|2,0,1]=4 927 B11R1.16 C=CC[S@@](=O)c1ccccc1 Amb22747466 [0,1,0,0,0,0|1,1,1]=4 928 B11R1.16 CC(=CCC)c1ccccc1 Amb22228912 [0,1,0,0,0,0|2,0,1]=4 929 B11R1.16 CC(CC#C)c1ccccc1 Amb18117214 [0,1,0,0,0,0|2,0,1]=4 930 B11R1.16 CC(CC=C)c1ccccc1 Amb25829403 [0,1,0,0,0,0|2,0,1]=4 931 B11R1.16 CC(CCN)c1c[n]ccc1 Amb18293554 [0,1,0,0,0,0|3,0,0]=4 932 B11R1.16 CC(CCN)c1cc[n]cc1 Amb18293553 [0,1,0,0,0,0|3,0,0]=4 933 B11R1.16 CC(CCN)c1cccc[n]1 Amb18981390 [0,1,0,0,0,0|3,0,0]=4 934 B11R1.16 CC(CCN)c1ccccc1 Amb17991256 [0,1,0,0,0,0|2,0,0]=3 935 B11R1.16 CC(CCO)c1c[n]ccc1 Amb25808756 [0,1,0,0,0,0|2,0,0]=3 936 B11R1.16 CC(CNN)c1ccccc1 Amb18791463 [0,1,0,0,0,0|3,0,0]=4 937 B11R1.16 CC(C[Zn]Br)c1ccccc1 Amb22897843 [0,1,0,0,0,0|3,0,0]=4 938 B11R1.16 CC(OCO)c1ccccc1 Amb24613529 [0,1,0,0,0,0|2,0,0]=3 939 B11R1.16 CC(SCCl)c1ccccc1 Amb24487902 [0,1,0,0,0,0|3,0,0]=4 940 B11R1.16 CC(c1ccccc1)CC#N Amb17593643 [0,1,0,0,0,0|2,0,1]=4 941 B11R1.16 CCCC(=C)c1ccccc1 Amb24669524 [0,1,0,0,0,0|2,0,0]=3 942 B11R1.16 CCCC(=O)c1cc[n]cc1 Amb22235246 [0,1,0,0,0,0|3,0,0]=4 943 B11R1.16 CCCC(=O)c1cccnc1 Amb17232054 [0,1,0,0,0,0|3,0,0]=4 944 B11R1.16 CCCC(Br)c1cccc[n]1 Amb25675709 [0,1,0,0,0,0|3,0,0]=4 945 B11R1.16 CCCC(Cl)c1cc[n]cc1 Amb24102654 [0,1,0,0,0,0|3,0,0]=4 946 B11R1.16 CCCC(N)c1c[n]ccc1 Amb18984960 [0,1,0,0,0,0|3,0,0]=4 947 B11R1.16 CCCC(N)c1cc[n]cc1 Amb18984961 [0,1,0,0,0,0|3,0,0]=4 948 B11R1.16 CCCC(N)c1cccc[n]1 Amb18984959 [0,1,0,0,0,0|3,0,0]=4 949 B11R1.16 CCCC(O)c1cc[n]cc1 Amb18179398 [0,1,0,0,0,0|3,0,0]=4 950 B11R1.16 CCCC(O)c1cccc[n]1 Amb18179397 [0,1,0,0,0,0|3,0,0]=4 951 B11R1.16 CCCC(c1ccccc1)[NH3+] Amb10560246 [0,1,0,0,0,0|2,0,0]=3 952 B11R1.16 CCCC(c1cccnc1)O Amb17232090 [0,1,0,0,0,0|3,0,0]=4 953 B11R1.16 CCCN(C)c1cccc[n]1 Amb24719444 [0,1,0,0,0,0|3,0,0]=4 954 B11R1.16 CCCN(O)c1ccccc1 Amb25349642 [0,1,0,0,0,0|2,0,0]=3 955 B11R1.16 CCC[C@@H](N)c1c[n]ccc1 Amb24617547 [0,1,0,0,0,0|3,0,0]=4 956 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb22388605 [0,1,0,0,0,0|2,0,0]=3 957 B11R1.16 CCC[C@@H](O)c1cc[n]cc1 Amb24429371 [0,1,0,0,0,0|3,0,0]=4 958 B11R1.16 CCC[C@@H](O)c1cccc[n]1 Amb25795692 [0,1,0,0,0,0|3,0,0]=4 959 B11R1.16 CCC[C@@H](O)c1ccccc1 Amb22338826 [0,1,0,0,0,0|2,0,0]=3 960 B11R1.16 CCC[C@H](N)c1cccc[n]1 Amb25836783 [0,1,0,0,0,0|3,0,0]=4 961 B11R1.16 CCC[C@H](N)c1ccccc1 Amb20241164 [0,1,0,0,0,0|2,0,0]=3 962 B11R1.16 CCC[C@H](N)c1ccccc1 Amb23385315 [0,1,0,0,0,0|2,0,0]=3 963 B11R1.16 CCC[C@H](O)c1c[n]ccc1 Amb25845549 [0,1,0,0,0,0|3,0,0]=4 964 B11R1.16 CCC[C@H](O)c1cc[n]cc1 Amb24414462 [0,1,0,0,0,0|3,0,0]=4 965 B11R1.16 CCC[C@H](O)c1ccccc1 Amb22338698 [0,1,0,0,0,0|2,0,0]=3 966 B11R1.16 CCC[C@H](c1ccccc1)N Amb16233791 [0,1,0,0,0,0|2,0,0]=3 967 B11R1.16 CCNC(=N)c1ccccc1 Amb23447118 [0,1,0,0,0,0|3,0,0]=4 968 B11R1.16 CCNC(c1ccccc1)C Amb1771733 [0,1,0,0,0,0|3,0,0]=4 969 B11R1.16 CCN[C@H](C)c1ccccc1 Amb24363134 [0,1,0,0,0,0|3,0,0]=4 970 B11R1.16 CCOC(=C)c1ccccc1 Amb24495644 [0,1,0,0,0,0|3,0,0]=4 971 B11R1.16 CCOC(=N)c1ccccc1 Amb17666955 [0,1,0,0,0,0|3,0,0]=4 972 B11R1.16 CCOC(=O)c1ccccc1 Amb22367067 [0,1,0,0,0,0|3,0,0]=4 973 B11R1.16 CCOC(=[NH2+])c1ccccc1 Amb22445379 [0,1,0,0,0,0|3,0,0]=4 974 B11R1.16 CCOC(C)c1ccccc1 Amb17940188 [0,1,0,0,0,0|3,0,0]=4 975 B11R1.16 CCOC(Cl)c1ccccc1 Amb24419639 [0,1,0,0,0,0|3,0,0]=4 976 B11R1.16 CCOP(=O)c1ccccc1 Amb10601587 [0,1,0,0,0,0|3,0,0]=4 977 B11R1.16 CCSC(Cl)c1ccccc1 Amb25109977 [0,1,0,0,0,0|3,0,0]=4 978 B11R1.16 CC\N=C(\Cl)/c1ccccc1 Amb24463735 [0,1,0,0,0,0|3,0,0]=4 979 B11R1.16 CN(CC#C)c1ccccc1 Amb19514873 [0,1,0,0,0,0|2,0,1]=4 980 B11R1.16 CN(CCBr)c1ccccc1 Amb24477466 [0,1,0,0,0,0|2,0,0]=3 981 B11R1.16 CN(CCCl)c1cccc[n]1 Amb24695070 [0,1,0,0,0,0|3,0,0]=4 982 B11R1.16 CN(CCF)c1ccccc1 Amb24485344 [0,1,0,0,0,0|2,0,0]=3 983 B11R1.16 CN(CCN)c1cc[n]cc1 Amb18993102 [0,1,0,0,0,0|3,0,0]=4 984 B11R1.16 CN(CCN)c1cccc[n]1 Amb18302344 [0,1,0,0,0,0|3,0,0]=4 985 B11R1.16 CN(CCO)c1[n]ccc[n]1 Amb18182843 [0,1,0,0,0,0|3,0,0]=4 986 B11R1.16 CN(CCO)c1c[n][n]cc1 Amb24618695 [0,1,0,0,0,0|3,0,0]=4 987 B11R1.16 CN(CCO)c1cc[n]c[n]1 Amb18177262 [0,1,0,0,0,0|3,0,0]=4 988 B11R1.16 CN(CCO)c1cc[n]cc1 Amb18179433 [0,1,0,0,0,0|2,0,0]=3 989 B11R1.16 CN(CCO)c1cc[n]cc1 Amb19373596 [0,1,0,0,0,0|2,0,0]=3 990 B11R1.16 CN(CCO)c1ccc[n][n]1 Amb18182850 [0,1,0,0,0,0|3,0,0]=4 991 B11R1.16 CN(CCO)c1cccc[n]1 Amb21955495 [0,1,0,0,0,0|2,0,0]=3 992 B11R1.16 CN(c1cnccn1)CCO Amb2445427 [0,1,0,0,0,0|3,0,0]=4 993 B11R1.16 CNCC(=C)c1ccccc1 Amb18124860 [0,1,0,0,0,0|3,0,0]=4 994 B11R1.16 CNCC(Br)c1ccccc1 Amb25224394 [0,1,0,0,0,0|3,0,0]=4 995 B11R1.16 CNCC(F)c1ccccc1 Amb24710254 [0,1,0,0,0,0|3,0,0]=4 996 B11R1.16 CNCC(N)c1ccccc1 Amb18290185 [0,1,0,0,0,0|3,0,0]=4 997 B11R1.16 CNCC(S)c1ccccc1 Amb25685409 [0,1,0,0,0,0|3,0,0]=4 998 B11R1.16 CNCC(c1ccccc1)C Amb17619365 [0,1,0,0,0,0|3,0,0]=4 999 B11R1.16 CNCC(c1ccccc1)N Amb13883001 [0,1,0,0,0,0|3,0,0]=4 1000 B11R1.16 CNC[C@@H](N)c1ccccc1 Amb24487965 [0,1,0,0,0,0|3,0,0]=4 1001 B11R1.16 CNC[C@H](C)c1ccccc1 Amb24399611 [0,1,0,0,0,0|3,0,0]=4 1002 B11R1.16 CNC[C@H](N)c1ccccc1 Amb25040662 [0,1,0,0,0,0|3,0,0]=4 1003 B11R1.16 CNC[C@H](O)c1ccccc1 Amb25674653 [0,1,0,0,0,0|3,0,0]=4 1004 B11R1.16 COCC(C)c1ccccc1 Amb24079980 [0,1,0,0,0,0|3,0,0]=4 1005 B11R1.16 COCC(Cl)c1ccccc1 Amb24509304 [0,1,0,0,0,0|3,0,0]=4 1006 B11R1.16 COCC(O)c1ccccc1 Amb18791504 [0,1,0,0,0,0|3,0,0]=4 1007 B11R1.16 COCC(S)c1ccccc1 Amb25698414 [0,1,0,0,0,0|3,0,0]=4 1008 B11R1.16 COCC(c1ccccc1)N Amb1134749 [0,1,0,0,0,0|3,0,0]=4 1009 B11R1.16 COCC(c1ccccc1)N Amb13952604 [0,1,0,0,0,0|3,0,0]=4 1010 B11R1.16 COC[C@@H](O)c1ccccc1 Amb22746575 [0,1,0,0,0,0|3,0,0]=4 1011 B11R1.16 COC[C@H](N)c1ccccc1 Amb22737495 [0,1,0,0,0,0|3,0,0]=4 1012 B11R1.16 COC[C@H](c1ccccc1)N Amb17061641 [0,1,0,0,0,0|3,0,0]=4 1013 B11R1.16 CP(CCN)c1ccccc1 Amb25685240 [0,1,0,0,0,0|2,0,0]=3 1014 B11R1.16 CSCC(C)c1ccccc1 Amb25143821 [0,1,0,0,0,0|3,0,0]=4 1015 B11R1.16 CSCC(N)c1ccccc1 Amb18300065 [0,1,0,0,0,0|3,0,0]=4 1016 B11R1.16 CSCC(O)c1ccccc1 Amb18793198 [0,1,0,0,0,0|3,0,0]=4 1017 B11R1.16 CSC[C@@H](N)c1ccccc1 Amb25368447 [0,1,0,0,0,0|3,0,0]=4 1018 B11R1.16 C[C@@H](CCBr)c1ccccc1 Amb24395063 [0,1,0,0,0,0|2,0,0]=3 1019 B11R1.16 C[C@H](CC=O)c1ccccc1 Amb25843699 [0,1,0,0,0,0|1,0,2]=4 1020 B11R1.16 C[C@H](CCBr)c1ccccc1 Amb25690423 [0,1,0,0,0,0|2,0,0]=3 1021 B11R1.16 C[C@H](CCO)c1ccccc1 Amb24371178 [0,1,0,0,0,0|1,0,0]=2 1022 B11R1.16 C\C(=C/CC)\c1ccccc1 Amb25151168 [0,1,0,0,0,0|2,0,1]=4 1023 B11R1.16 C\C(=C/CN)\c1ccccc1 Amb23555622 [0,1,0,0,0,0|2,0,1]=4 1024 B11R1.16 C\C(=C/CO)\c1cccc[n]1 Amb24373086 [0,1,0,0,0,0|2,0,1]=4 1025 B11R1.16 C\C(=C\CCl)\c1ccccc1 Amb24579744 [0,1,0,0,0,0|2,0,1]=4 1026 B11R1.16 C\C(=C\CN)\c1ccccc1 Amb25145810 [0,1,0,0,0,0|2,0,1]=4 1027 B11R1.16 C\C(=C\CO)\c1cccc[n]1 Amb24563551 [0,1,0,0,0,0|2,0,1]=4 1028 B11R1.16 C\C(=N\CO)\c1cccc[n]1 Amb24069128 [0,1,0,0,0,0|3,0,0]=4 1029 B11R1.16 ClCCC(Br)c1ccccc1 Amb21856734 [0,1,0,0,0,0|2,0,0]=3 1030 B11R1.16 ClCCC(Cl)c1ccccc1 Amb17872667 [0,1,0,0,0,0|2,0,0]=3 1031 B11R1.16 ClCCC(c1ccccc1)C Amb17232691 [0,1,0,0,0,0|2,0,0]=3 1032 B11R1.16 ClCCC(c1ccccc1)O Amb17611064 [0,1,0,0,0,0|2,0,0]=3 1033 B11R1.16 ClCCN(c1ccccc1)C Amb17334788 [0,1,0,0,0,0|2,0,0]=3 1034 B11R1.16 ClCCP(Cl)c1ccccc1 Amb24398805 [0,1,0,0,0,0|2,0,0]=3 1035 B11R1.16 ClCC[C@@H](c1ccccc1)O Amb17611058 [0,1,0,0,0,0|2,0,0]=3 1036 B11R1.16 ClC\C=C(\Br)/c1ccccc1 Amb25777111 [0,1,0,0,0,0|2,0,1]=4 1037 B11R1.16 FCCC(=O)c1ccccc1 Amb10603695 [0,1,0,0,0,0|2,0,0]=3 1038 B11R1.16 N#CCC(=O)c1ccccc1 Amb1644485 [0,1,0,0,0,0|2,0,1]=4 1039 B11R1.16 N#CCC(Cl)c1ccccc1 Amb25238256 [0,1,0,0,0,0|2,0,1]=4 1040 B11R1.16 N#CCC(F)c1ccccc1 Amb25127669 [0,1,0,0,0,0|2,0,1]=4 1041 B11R1.16 N#CCS(=O)c1ccccc1 Amb22505329 [0,1,0,0,0,0|1,1,1]=4 1042 B11R1.16 N#CC[C@@H](O)c1ccccc1 Amb25680039 [0,1,0,0,0,0|2,0,1]=4 1043 B11R1.16 N#CC[C@H](O)c1ccccc1 Amb24617537 [0,1,0,0,0,0|2,0,1]=4 1044 B11R1.16 N=CCC(=O)c1ccccc1 Amb24408300 [0,1,0,0,0,0|2,0,1]=4 1045 B11R1.16 NC(CC#N)c1ccccc1 Amb18964887 [0,1,0,0,0,0|2,0,1]=4 1046 B11R1.16 NC(CC#N)c1ccccc1 Amb20632783 [0,1,0,0,0,0|2,0,1]=4 1047 B11R1.16 NC(CCCl)c1cccc[n]1 Amb24355932 [0,1,0,0,0,0|3,0,0]=4 1048 B11R1.16 NC(CCO)c1c[n]cc[n]1 Amb22296969 [0,1,0,0,0,0|3,0,0]=4 1049 B11R1.16 NC(CCO)c1cc[n]c[n]1 Amb25093068 [0,1,0,0,0,0|3,0,0]=4 1050 B11R1.16 NC(CCO)c1cccc[n]1 Amb18120551 [0,1,0,0,0,0|2,0,0]=3 1051 B11R1.16 NC(CCO)c1ccccc1 Amb22730035 [0,1,0,0,0,0|1,0,0]=2 1052 B11R1.16 NCCC(=O)c1cc[n]cc1 Amb18639595 [0,1,0,0,0,0|3,0,0]=4 1053 B11R1.16 NCCC(=O)c1ccc[n]c1 Amb18121496 [0,1,0,0,0,0|3,0,0]=4 1054 B11R1.16 NCCC(=O)c1cccc[n]1 Amb18121375 [0,1,0,0,0,0|3,0,0]=4 1055 B11R1.16 NCCC(Cl)c1ccccc1 Amb24487859 [0,1,0,0,0,0|2,0,0]=3 1056 B11R1.16 NCCC(F)c1cc[n]cc1 Amb25329368 [0,1,0,0,0,0|3,0,0]=4 1057 B11R1.16 NCCC(N)c1cccc[n]1 Amb24580750 [0,1,0,0,0,0|3,0,0]=4 1058 B11R1.16 NCCC(N)c1ccccc1 Amb18972395 [0,1,0,0,0,0|2,0,0]=3 1059 B11R1.16 NCCC(O)c1c[n]ccc1 Amb18639338 [0,1,0,0,0,0|3,0,0]=4 1060 B11R1.16 NCCC(O)c1cc[n]cc1 Amb18121042 [0,1,0,0,0,0|3,0,0]=4 1061 B11R1.16 NCCC(O)c1cccc[n]1 Amb18121017 [0,1,0,0,0,0|3,0,0]=4 1062 B11R1.16 NCCC(O)c1ccccc1 Amb21984527 [0,1,0,0,0,0|2,0,0]=3 1063 B11R1.16 NCCC(S)c1ccccc1 Amb18251942 [0,1,0,0,0,0|2,0,0]=3 1064 B11R1.16 NCCC(c1ccccc1)O Amb2383139 [0,1,0,0,0,0|2,0,0]=3 1065 B11R1.16 NCCN(c1ccccc1)C Amb13949227 [0,1,0,0,0,0|2,0,0]=3 1066 B11R1.16 NCCN(c1ccccc1)C Amb2371516 [0,1,0,0,0,0|2,0,0]=3 1067 B11R1.16 NCCS(=O)c1ccccc1 Amb18974516 [0,1,0,0,0,0|1,1,0]=3 1068 B11R1.16 NCCS(=O)c1ccccc1 Amb19349568 [0,1,0,0,0,0|1,1,0]=3 1069 B11R1.16 NCC[C@@H](N)c1ccccc1 Amb25210474 [0,1,0,0,0,0|2,0,0]=3 1070 B11R1.16 NCC[C@@H](O)c1ccccc1 Amb22225304 [0,1,0,0,0,0|2,0,0]=3 1071 B11R1.16 NCC[C@H](N)c1cccc[n]1 Amb25326719 [0,1,0,0,0,0|3,0,0]=4 1072 B11R1.16 NCC[C@H](O)c1ccccc1 Amb22226644 [0,1,0,0,0,0|2,0,0]=3 1073 B11R1.16 NCNC(=O)c1ccccc1 Amb24072660 [0,1,0,0,0,0|3,0,0]=4 1074 B11R1.16 NN(CCO)c1ccccc1 Amb24555138 [0,1,0,0,0,0|1,0,0]=2 1075 B11R1.16 NNCC(=O)c1ccccc1 Amb18125154 [0,1,0,0,0,0|3,0,0]=4 1076 B11R1.16 NNCC(F)c1ccccc1 Amb25061630 [0,1,0,0,0,0|3,0,0]=4 1077 B11R1.16 NNCC(c1ccccc1)O Amb17232104 [0,1,0,0,0,0|3,0,0]=4 1078 B11R1.16 NNC[C@@H](O)c1ccccc1 Amb24466315 [0,1,0,0,0,0|3,0,0]=4 1079 B11R1.16 NNC[C@H](O)c1ccccc1 Amb25236157 [0,1,0,0,0,0|3,0,0]=4 1080 B11R1.16 NOCC(=O)c1ccccc1 Amb22729387 [0,1,0,0,0,0|3,0,0]=4 1081 B11R1.16 NOCC(c1ccccc1)O Amb17334342 [0,1,0,0,0,0|3,0,0]=4 1082 B11R1.16 NOC[C@@H](O)c1ccccc1 Amb25152160 [0,1,0,0,0,0|3,0,0]=4 1083 B11R1.16 NSCC(=O)c1ccccc1 Amb24564884 [0,1,0,0,0,0|3,0,0]=4 1084 B11R1.16 N[C@@H](CCO)c1cc[n]cc1 Amb25131721 [0,1,0,0,0,0|2,0,0]=3 1085 B11R1.16 N[C@H](CCO)c1c[n]cc[n]1 Amb25328092 [0,1,0,0,0,0|3,0,0]=4 1086 B11R1.16 N[C@H](CCO)c1cc[n]cc1 Amb25843798 [0,1,0,0,0,0|2,0,0]=3 1087 B11R1.16 N[C@H](CCO)c1cccc[n]1 Amb25789774 [0,1,0,0,0,0|2,0,0]=3 1088 B11R1.16 N[C@H](CCO)c1ccccc1 Amb22265524 [0,1,0,0,0,0|1,0,0]=2 1089 B11R1.16 O=C(CCCl)c1cc[n]cc1 Amb24117884 [0,1,0,0,0,0|3,0,0]=4 1090 B11R1.16 O=C(CCCl)c1cccc[n]1 Amb24422601 [0,1,0,0,0,0|3,0,0]=4 1091 B11R1.16 O=C(CN=O)c1ccccc1 Amb25821412 [0,1,0,0,0,0|2,0,1]=4 1092 B11R1.16 O=C(NCBr)c1ccccc1 Amb25772077 [0,1,0,0,0,0|3,0,0]=4 1093 B11R1.16 O=C(OCCl)c1ccccc1 Amb19958719 [0,1,0,0,0,0|3,0,0]=4 1094 B11R1.16 O=C(OCI)c1ccccc1 Amb25148286 [0,1,0,0,0,0|3,0,0]=4 1095 B11R1.16 O=CCC(=S)c1ccccc1 Amb25351016 [0,1,0,0,0,0|1,0,2]=4 1096 B11R1.16 O=CCC(Cl)c1ccccc1 Amb24470053 [0,1,0,0,0,0|1,0,2]=4 1097 B11R1.16 O=CCC(S)c1ccccc1 Amb18126455 [0,1,0,0,0,0|1,0,2]=4 1098 B11R1.16 O=CCS(=O)c1ccccc1 Amb25674931 [0,1,0,0,0,0|0,1,2]=4 1099 B11R1.16 O=NCC(Cl)c1ccccc1 Amb25177516 [0,1,0,0,0,0|2,0,1]=4 1100 B11R1.16 OC(CC=O)c1ccccc1 Amb18125126 [0,1,0,0,0,0|1,0,2]=4 1101 B11R1.16 OC(CCF)c1ccccc1 Amb24412986 [0,1,0,0,0,0|2,0,0]=3 1102 B11R1.16 OC(CCS)c1ccccc1 Amb25837914 [0,1,0,0,0,0|1,1,0]=3 1103 B11R1.16 OC(CNO)c1ccccc1 Amb22366087 [0,1,0,0,0,0|2,0,0]=3 1104 B11R1.16 OCCC(=C)c1ccncc1 Amb10573777 [0,1,0,0,0,0|2,0,0]=3 1105 B11R1.16 OCCC(=O)c1cc[n]cc1 Amb24544067 [0,1,0,0,0,0|2,0,0]=3 1106 B11R1.16 OCCC(=O)c1ccccc1 Amb16231606 [0,1,0,0,0,0|1,0,0]=2 1107 B11R1.16 OCCC(O)c1c[n]cc[n]1 Amb22298360 [0,1,0,0,0,0|3,0,0]=4 1108 B11R1.16 OCCC(O)c1cc[n]cc1 Amb25760239 [0,1,0,0,0,0|2,0,0]=3 1109 B11R1.16 OCCC(O)c1cccc[n]1 Amb22756156 [0,1,0,0,0,0|2,0,0]=3 1110 B11R1.16 OCCC(O)c1ccccc1 Amb17777842 [0,1,0,0,0,0|1,0,0]=2 1111 B11R1.16 OCCC(c1ccccc1)N Amb1993953 [0,1,0,0,0,0|1,0,0]=2 1112 B11R1.16 OCCN(c1ccccn1)C Amb2445428 [0,1,0,0,0,0|2,0,0]=3 1113 B11R1.16 OCC[C@H](O)c1cc[n]cc1 Amb24715913 [0,1,0,0,0,0|2,0,0]=3 1114 B11R1.16 OCNC(=O)c1ccccc1 Amb1200467 [0,1,0,0,0,0|2,0,0]=3 1115 B11R1.16 OCNC(=S)c1ccc[n]c1 Amb24523133 [0,1,0,0,0,0|3,0,0]=4 1116 B11R1.16 OCNC(=S)c1ccccc1 Amb25289021 [0,1,0,0,0,0|2,0,0]=3 1117 B11R1.16 OCOC(=O)c1ccc[n]c1 Amb24062492 [0,1,0,0,0,0|3,0,0]=4 1118 B11R1.16 OCOC(=O)c1ccccc1 Amb25115920 [0,1,0,0,0,0|2,0,0]=3 1119 B11R1.16 OCSC(=S)c1ccccc1 Amb25806661 [0,1,0,0,0,0|2,0,0]=3 1120 B11R1.16 OC\C=C(\Cl)/c1ccccc1 Amb24748632 [0,1,0,0,0,0|1,0,1]=3 1121 B11R1.16 OC\C=C(\F)/c1ccccc1 Amb24355216 [0,1,0,0,0,0|1,0,1]=3 1122 B11R1.16 ONCC(c1ccccn1)O Amb17334345 [0,1,0,0,0,0|3,0,0]=4 1123 B11R1.16 ONCC(c1cccnc1)O Amb17334346 [0,1,0,0,0,0|3,0,0]=4 1124 B11R1.16 ONCC(c1ccncc1)O Amb17334347 [0,1,0,0,0,0|3,0,0]=4 1125 B11R1.16 OSCC(O)c1ccccc1 Amb25686224 [0,1,0,0,0,0|2,0,0]=3 1126 B11R1.16 OSC[C@@H](O)c1ccccc1 Amb25787381 [0,1,0,0,0,0|2,0,0]=3 1127 B11R1.16 O[C@H](CC=O)c1ccccc1 Amb24533175 [0,1,0,0,0,0|1,0,2]=4 1128 B11R1.16 O\C=C\C(=S)c1ccccc1 Amb24645164 [0,1,0,0,0,0|1,0,2]=4 1129 B11R1.16 O\N=C/C(=O)c1ccccc1 Amb25767720 [0,1,0,0,0,0|2,0,1]=4 1130 B11R1.16 O\N=C\C(O)c1ccccc1 Amb25149681 [0,1,0,0,0,0|2,0,1]=4 1131 B11R1.16 SCCC(=O)c1ccccc1 Amb17400214 [0,1,0,0,0,0|1,1,0]=3 1132 B11R1.16 SCCN(c1ccccc1)C Amb13881732 [0,1,0,0,0,0|1,1,0]=3 1133 B11R1.17 BrCCCc1ccccc1C Amb17104552 [0,1,0,0,0,0|2,0,0]=3 1134 B11R1.17 BrCCCc1ccccc1Cl Amb17104560 [0,1,0,0,0,0|2,0,0]=3 1135 B11R1.17 BrCCCc1ccccc1F Amb17104555 [0,1,0,0,0,0|2,0,0]=3 1136 B11R1.17 BrCCOc1ccccc1C Amb1105693 [0,1,0,0,0,0|1,0,0]=2 1137 B11R1.17 BrCCOc1ccccc1Cl Amb1150980 [0,1,0,0,0,0|1,0,0]=2 1138 B11R1.17 BrCCOc1ccccc1F Amb1103643 [0,1,0,0,0,0|1,0,0]=2 1139 B11R1.17 Br[Mg]CCc1ccccc1F Amb13890864 [0,1,0,0,0,0|3,0,0]=4 1140 B11R1.17 Br[Zn]CCc1ccccc1F Amb13890853 [0,1,0,0,0,0|3,0,0]=4 1141 B11R1.17 Brc1c[n]ccc1CCCBr Amb24416596 [0,1,0,0,0,0|3,0,0]=4 1142 B11R1.17 Brc1ccccc1CCCI Amb25329656 [0,1,0,0,0,0|2,0,0]=3 1143 B11R1.17 Brc1ccccc1\C=C\CBr Amb25149093 [0,1,0,0,0,0|2,0,1]=4 1144 B11R1.17 C#CCCc1ccccc1Cl Amb18116938 [0,1,0,0,0,0|2,0,1]=4 1145 B11R1.17 C#CCCc1ccccc1F Amb18636110 [0,1,0,0,0,0|2,0,1]=4 1146 B11R1.17 C#CCNc1ccccc1Br Amb25790145 [0,1,0,0,0,0|2,0,1]=4 1147 B11R1.17 C#CCNc1ccccc1Cl Amb18800988 [0,1,0,0,0,0|2,0,1]=4 1148 B11R1.17 C#CCNc1ccccc1N Amb24060500 [0,1,0,0,0,0|2,0,1]=4 1149 B11R1.17 C#CCOc1cc[n]cc1N Amb25039815 [0,1,0,0,0,0|2,0,1]=4 1150 B11R1.17 C#CCOc1ccc[n]c1Br Amb22642319 [0,1,0,0,0,0|2,0,1]=4 1151 B11R1.17 C#CCOc1ccc[n]c1Cl Amb22642159 [0,1,0,0,0,0|2,0,1]=4 1152 B11R1.17 C#CCOc1ccc[n]c1F Amb25823493 [0,1,0,0,0,0|2,0,1]=4 1153 B11R1.17 C#CCOc1ccc[n]c1I Amb24638460 [0,1,0,0,0,0|2,0,1]=4 1154 B11R1.17 C#CCOc1ccc[n]c1N Amb18286131 [0,1,0,0,0,0|2,0,1]=4 1155 B11R1.17 C#CCOc1ccccc1Cl Amb18183540 [0,1,0,0,0,0|1,0,1]=3 1156 B11R1.17 C#CCOc1ccccc1F Amb18799352 [0,1,0,0,0,0|1,0,1]=3 1157 B11R1.17 C#CCOc1ccccc1N Amb22492402 [0,1,0,0,0,0|1,0,1]=3 1158 B11R1.17 C#CCSc1ccccc1Cl Amb18325307 [0,1,0,0,0,0|1,1,1]=4 1159 B11R1.17 C#CCSc1ccccc1F Amb18801036 [0,1,0,0,0,0|1,1,1]=4 1160 B11R1.17 C#CCSc1ccccc1O Amb18788312 [0,1,0,0,0,0|1,1,1]=4 1161 B11R1.17 C=CCCc1ccccc1N Amb18124836 [0,1,0,0,0,0|2,0,1]=4 1162 B11R1.17 C=CCCc1ccccc1O Amb18124913 [0,1,0,0,0,0|2,0,1]=4 1163 B11R1.17 C=CCNc1ccccc1Br Amb17306217 [0,1,0,0,0,0|2,0,1]=4 1164 B11R1.17 C=CCNc1ccccc1Cl Amb18185559 [0,1,0,0,0,0|2,0,1]=4 1165 B11R1.17 C=CCNc1ccccc1F Amb17306139 [0,1,0,0,0,0|2,0,1]=4 1166 B11R1.17 C=CCNc1ccccc1N Amb18992164 [0,1,0,0,0,0|2,0,1]=4 1167 B11R1.17 C=CCOC1=CC=CNC1=O Amb18034612 [0,1,0,0,0,0|2,0,1]=4 1168 B11R1.17 C=CCON1C=CC=CC1=O Amb22364567 [0,1,0,0,0,0|2,0,1]=4 1169 B11R1.17 C=CCOc1[n]cccc1Br Amb24476578 [0,1,0,0,0,0|2,0,1]=4 1170 B11R1.17 C=CCOc1c[n]ccc1I Amb24759266 [0,1,0,0,0,0|2,0,1]=4 1171 B11R1.17 C=CCOc1cc[n]cc1Br Amb24486834 [0,1,0,0,0,0|2,0,1]=4 1172 B11R1.17 C=CCOc1cc[n]cc1I Amb25239642 [0,1,0,0,0,0|2,0,1]=4 1173 B11R1.17 C=CCOc1ccc[n]c1F Amb25318069 [0,1,0,0,0,0|2,0,1]=4 1174 B11R1.17 C=CCOc1cccc[n+]1[O-] Amb25083853 [0,1,0,0,0,0|2,0,1]=4 1175 B11R1.17 C=CCOc1ccccc1I Amb24384940 [0,1,0,0,0,0|1,0,1]=3 1176 B11R1.17 C=CCOc1ccccc1N Amb2081548 [0,1,0,0,0,0|1,0,1]=3 1177 B11R1.17 C=CCSc1ccccc1Br Amb25188543 [0,1,0,0,0,0|1,1,1]=4 1178 B11R1.17 C=CCSc1ccccc1N Amb22462667 [0,1,0,0,0,0|1,1,1]=4 1179 B11R1.17 C=CCSc1ccccc1O Amb18788504 [0,1,0,0,0,0|1,1,1]=4 1180 B11R1.17 CCC#Cc1ccccc1Cl Amb25198269 [0,1,0,0,0,0|2,0,1]=4 1181 B11R1.17 CCC#Cc1ccccc1I Amb24447638 [0,1,0,0,0,0|2,0,1]=4 1182 B11R1.17 CCC#Cc1ccccc1N Amb24670207 [0,1,0,0,0,0|2,0,1]=4 1183 B11R1.17 CCC#Cc1ccccc1O Amb25320119 [0,1,0,0,0,0|2,0,1]=4 1184 B11R1.17 CCCCC1=CC=CNC1=O Amb25270944 [0,1,0,0,0,0|3,0,0]=4 1185 B11R1.17 CCCCN1C=CC=CC1=O Amb22739996 [0,1,0,0,0,0|3,0,0]=4 1186 B11R1.17 CCCCN1C=CC=CC1=S Amb24415294 [0,1,0,0,0,0|3,0,0]=4 1187 B11R1.17 CCCC[n+]1ccccc1C Amb25794246 [0,1,0,0,0,0|3,0,0]=4 1188 B11R1.17 CCCCc1c[n]ccc1N Amb25785815 [0,1,0,0,0,0|3,0,0]=4 1189 B11R1.17 CCCCc1cc[n]cc1Cl Amb24086569 [0,1,0,0,0,0|3,0,0]=4 1190 B11R1.17 CCCCc1ccc[n]c1Cl Amb24538109 [0,1,0,0,0,0|3,0,0]=4 1191 B11R1.17 CCCCc1ccccc1Br Amb15690808 [0,1,0,0,0,0|2,0,0]=3 1192 B11R1.17 CCCCc1ccccc1F Amb24426932 [0,1,0,0,0,0|2,0,0]=3 1193 B11R1.17 CCCCc1ccccc1O Amb25744605 [0,1,0,0,0,0|2,0,0]=3 1194 B11R1.17 CCCCn1ccccc1=O Amb10553753 [0,1,0,0,0,0|3,0,0]=4 1195 B11R1.17 CCCNc1[n]cccc1Br Amb18292051 [0,1,0,0,0,0|3,0,0]=4 1196 B11R1.17 CCCNc1[n]cccc1F Amb18300627 [0,1,0,0,0,0|3,0,0]=4 1197 B11R1.17 CCCNc1[n]cccc1N Amb20668081 [0,1,0,0,0,0|3,0,0]=4 1198 B11R1.17 CCCNc1[n]cccc1N Amb24077822 [0,1,0,0,0,0|3,0,0]=4 1199 B11R1.17 CCCNc1c[n]ccc1N Amb24379469 [0,1,0,0,0,0|3,0,0]=4 1200 B11R1.17 CCCNc1c[n]ccc1O Amb24554848 [0,1,0,0,0,0|3,0,0]=4 1201 B11R1.17 CCCNc1cc[n]cc1Cl Amb24742794 [0,1,0,0,0,0|3,0,0]=4 1202 B11R1.17 CCCNc1cc[n]cc1N Amb24077829 [0,1,0,0,0,0|3,0,0]=4 1203 B11R1.17 CCCNc1ccc[n]c1N Amb23557985 [0,1,0,0,0,0|3,0,0]=4 1204 B11R1.17 CCCNc1ccccc1O Amb18644480 [0,1,0,0,0,0|2,0,0]=3 1205 B11R1.17 CCCOC1=CC=CNC1=O Amb18034627 [0,1,0,0,0,0|2,0,0]=3 1206 B11R1.17 CCCOc1[n]c[n]cc1N Amb23558041 [0,1,0,0,0,0|3,0,0]=4 1207 B11R1.17 CCCOc1[n]cc[n]c1Cl Amb18183731 [0,1,0,0,0,0|3,0,0]=4 1208 B11R1.17 CCCOc1[n]cc[n]c1N Amb24533690 [0,1,0,0,0,0|3,0,0]=4 1209 B11R1.17 CCCOc1[n]cccc1Br Amb19959527 [0,1,0,0,0,0|2,0,0]=3 1210 B11R1.17 CCCOc1c[n]ccc1Cl Amb24055245 [0,1,0,0,0,0|2,0,0]=3 1211 B11R1.17 CCCOc1c[n]ccc1N Amb24320961 [0,1,0,0,0,0|2,0,0]=3 1212 B11R1.17 CCCOc1cc[n]cc1Br Amb24320776 [0,1,0,0,0,0|2,0,0]=3 1213 B11R1.17 CCCOc1ccc[n]c1Br Amb24321030 [0,1,0,0,0,0|2,0,0]=3 1214 B11R1.17 CCCOc1ccccc1Cl Amb25216415 [0,1,0,0,0,0|1,0,0]=2 1215 B11R1.17 CCCOc1ccccc1F Amb21856719 [0,1,0,0,0,0|1,0,0]=2 1216 B11R1.17 CCCOc1ccccc1N Amb1210617 [0,1,0,0,0,0|1,0,0]=2 1217 B11R1.17 CCCOc1ncccc1I Amb10844704 [0,1,0,0,0,0|2,0,0]=3 1218 B11R1.17 CCCSc1[n]cccc1Cl Amb24485285 [0,1,0,0,0,0|2,1,0]=4 1219 B11R1.17 CCCSc1ccc[n]c1N Amb25301401 [0,1,0,0,0,0|2,1,0]=4 1220 B11R1.17 CCCSc1ccccc1N Amb22588094 [0,1,0,0,0,0|1,1,0]=3 1221 B11R1.17 CCCSc1ccccc1O Amb18177881 [0,1,0,0,0,0|1,1,0]=3 1222 B11R1.17 CCNCc1ccccc1I Amb21861742 [0,1,0,0,0,0|3,0,0]=4 1223 B11R1.17 CCOCc1ccccc1Br Amb22227882 [0,1,0,0,0,0|3,0,0]=4 1224 B11R1.17 CCOCc1ccccc1O Amb10560038 [0,1,0,0,0,0|3,0,0]=4 1225 B11R1.17 CCO\C=C/1\C=CC=CC1=O Amb24645462 [0,1,0,0,0,0|3,0,0]=4 1226 B11R1.17 CCSCc1ccccc1Br Amb22228180 [0,1,0,0,0,0|3,0,0]=4 1227 B11R1.17 CCSCc1ccccc1Cl Amb25676288 [0,1,0,0,0,0|3,0,0]=4 1228 B11R1.17 CCSCc1ccccc1O Amb18126550 [0,1,0,0,0,0|3,0,0]=4 1229 B11R1.17 CC\C=C/c1ccccc1O Amb25713551 [0,1,0,0,0,0|2,0,1]=4 1230 B11R1.17 CC\C=C\c1ccccc1N Amb22751020 [0,1,0,0,0,0|2,0,1]=4 1231 B11R1.17 CC\C=C\c1ccccc1O Amb18124914 [0,1,0,0,0,0|2,0,1]=4 1232 B11R1.17 CC\C=N\c1ccccc1N Amb24060501 [0,1,0,0,0,0|2,0,1]=4 1233 B11R1.17 CC\C=N\c1ccccc1O Amb24486452 [0,1,0,0,0,0|2,0,1]=4 1234 B11R1.17 CC\N=C\c1ccccc1Br Amb25250885 [0,1,0,0,0,0|3,0,0]=4 1235 B11R1.17 CC\N=C\c1ccccc1O Amb25793010 [0,1,0,0,0,0|3,0,0]=4 1236 B11R1.17 CN/1C=CC=C\C1=N\CCO Amb25264302 [0,1,0,0,0,0|2,0,0]=3 1237 B11R1.17 CNCCc1ccccc1Br Amb18299468 [0,1,0,0,0,0|3,0,0]=4 1238 B11R1.17 CNCCc1ccccc1N Amb24106838 [0,1,0,0,0,0|3,0,0]=4 1239 B11R1.17 CNCCc1ccccc1O Amb18560895 [0,1,0,0,0,0|3,0,0]=4 1240 B11R1.17 COCCc1ccccc1Cl Amb24518157 [0,1,0,0,0,0|3,0,0]=4 1241 B11R1.17 COCCc1ccccc1I Amb24483388 [0,1,0,0,0,0|3,0,0]=4 1242 B11R1.17 COCCc1ccccc1N Amb18992153 [0,1,0,0,0,0|3,0,0]=4 1243 B11R1.17 COCCc1ccccc1O Amb22055702 [0,1,0,0,0,0|3,0,0]=4 1244 B11R1.17 COCNc1ccccc1F Amb24084241 [0,1,0,0,0,0|3,0,0]=4 1245 B11R1.17 COCOC1=CC=CNC1=O Amb25699879 [0,1,0,0,0,0|3,0,0]=4 1246 B11R1.17 COCOc1c[n]ccc1I Amb24593865 [0,1,0,0,0,0|3,0,0]=4 1247 B11R1.17 COCOc1ccc[n]c1Br Amb22044236 [0,1,0,0,0,0|3,0,0]=4 1248 B11R1.17 COCOc1ccc[n]c1I Amb21927966 [0,1,0,0,0,0|3,0,0]=4 1249 B11R1.17 COCOc1ccc[n]c1N Amb25731711 [0,1,0,0,0,0|3,0,0]=4 1250 B11R1.17 COCOc1ccccc1Br Amb21912438 [0,1,0,0,0,0|2,0,0]=3 1251 B11R1.17 COCOc1ccccc1C Amb10559613 [0,1,0,0,0,0|2,0,0]=3 1252 B11R1.17 COCOc1ccccc1Cl Amb25840223 [0,1,0,0,0,0|2,0,0]=3 1253 B11R1.17 COCOc1ccccc1F Amb22546792 [0,1,0,0,0,0|2,0,0]=3 1254 B11R1.17 COCOc1ccccc1I Amb22284514 [0,1,0,0,0,0|2,0,0]=3 1255 B11R1.17 COCOc1ccccc1N Amb23599107 [0,1,0,0,0,0|2,0,0]=3 1256 B11R1.17 COCOc1ccccc1O Amb24486480 [0,1,0,0,0,0|2,0,0]=3 1257 B11R1.17 COCSc1ccccc1N Amb17305638 [0,1,0,0,0,0|2,1,0]=4 1258 B11R1.17 CSCCc1ccccc1Cl Amb25222784 [0,1,0,0,0,0|3,0,0]=4 1259 B11R1.17 CSCCc1ccccc1N Amb18299122 [0,1,0,0,0,0|3,0,0]=4 1260 B11R1.17 CSCOc1ccc[n]c1Cl Amb25286252 [0,1,0,0,0,0|3,0,0]=4 1261 B11R1.17 CSCOc1ccccc1Br Amb25358756 [0,1,0,0,0,0|2,0,0]=3 1262 B11R1.17 CSCOc1ccccc1Cl Amb24459326 [0,1,0,0,0,0|2,0,0]=3 1263 B11R1.17 CSCSc1ccccc1Br Amb24516501 [0,1,0,0,0,0|2,1,0]=4 1264 B11R1.17 C[n]1ccccc1=NCCO Amb24106772 [0,1,0,0,0,0|2,0,0]=3 1265 B11R1.17 C\C=C\Oc1ccccc1O Amb25143344 [0,1,0,0,0,0|1,0,2]=4 1266 B11R1.17 Cc1[n]cc[n]c1SCCO Amb25759766 [0,1,0,0,0,0|2,1,0]=4 1267 B11R1.17 Cc1[n]cccc1CCCCl Amb25847080 [0,1,0,0,0,0|3,0,0]=4 1268 B11R1.17 Cc1[n]cccc1CCCO Amb24360630 [0,1,0,0,0,0|2,0,0]=3 1269 B11R1.17 Cc1[n]cccc1NCCC Amb24386233 [0,1,0,0,0,0|3,0,0]=4 1270 B11R1.17 Cc1[n]cccc1OCC#C Amb25717490 [0,1,0,0,0,0|2,0,1]=4 1271 B11R1.17 Cc1[n]cccc1OCC=C Amb25066204 [0,1,0,0,0,0|2,0,1]=4 1272 B11R1.17 Cc1[n]cccc1OCCBr Amb25046512 [0,1,0,0,0,0|2,0,0]=3 1273 B11R1.17 Cc1[n]cccc1OCCCl Amb24441294 [0,1,0,0,0,0|2,0,0]=3 1274 B11R1.17 Cc1[n]cccc1OCCO Amb24101976 [0,1,0,0,0,0|1,0,0]=2 1275 B11R1.17 Cc1c[n]ccc1CCCBr Amb24611779 [0,1,0,0,0,0|3,0,0]=4 1276 B11R1.17 Cc1c[n]ccc1NCCF Amb25850522 [0,1,0,0,0,0|3,0,0]=4 1277 B11R1.17 Cc1c[n]ccc1NCCO Amb24689647 [0,1,0,0,0,0|2,0,0]=3 1278 B11R1.17 Cc1c[n]ccc1OCCC Amb25829970 [0,1,0,0,0,0|2,0,0]=3 1279 B11R1.17 Cc1c[n]ccc1SCCC Amb25262403 [0,1,0,0,0,0|2,1,0]=4 1280 B11R1.17 Cc1c[n]ccc1SCCCl Amb25305371 [0,1,0,0,0,0|2,1,0]=4 1281 B11R1.17 Cc1c[n]ccc1\C=C\CO Amb25262595 [0,1,0,0,0,0|2,0,1]=4 1282 B11R1.17 Cc1cc[n]cc1C#CCO Amb24472696 [0,1,0,0,0,0|2,0,1]=4 1283 B11R1.17 Cc1cc[n]cc1CCCBr Amb25089629 [0,1,0,0,0,0|3,0,0]=4 1284 B11R1.17 Cc1cc[n]cc1CCCC Amb25075221 [0,1,0,0,0,0|3,0,0]=4 1285 B11R1.17 Cc1cc[n]cc1CCCO Amb25717118 [0,1,0,0,0,0|2,0,0]=3 1286 B11R1.17 Cc1cc[n]cc1OCOC Amb24698750 [0,1,0,0,0,0|3,0,0]=4 1287 B11R1.17 Cc1ccc[n]c1CCCC Amb24062201 [0,1,0,0,0,0|3,0,0]=4 1288 B11R1.17 Cc1ccc[n]c1CCCN Amb22886485 [0,1,0,0,0,0|3,0,0]=4 1289 B11R1.17 Cc1ccc[n]c1CCCO Amb24685021 [0,1,0,0,0,0|2,0,0]=3 1290 B11R1.17 Cc1ccc[n]c1NCCC Amb18987728 [0,1,0,0,0,0|3,0,0]=4 1291 B11R1.17 Cc1ccc[n]c1NCCF Amb25152259 [0,1,0,0,0,0|3,0,0]=4 1292 B11R1.17 Cc1ccc[n]c1NCCO Amb18987733 [0,1,0,0,0,0|2,0,0]=3 1293 B11R1.17 Cc1ccc[n]c1OCCN Amb18988881 [0,1,0,0,0,0|2,0,0]=3 1294 B11R1.17 Cc1ccc[n]c1OCCO Amb24102036 [0,1,0,0,0,0|1,0,0]=2 1295 B11R1.17 Cc1ccc[n]c1SCCCl Amb18329822 [0,1,0,0,0,0|2,1,0]=4 1296 B11R1.17 Cc1ccc[n]c1SCCF Amb25668642 [0,1,0,0,0,0|2,1,0]=4 1297 B11R1.17 Cc1ccc[n]c1SCCN Amb18908765 [0,1,0,0,0,0|2,1,0]=4 1298 B11R1.17 Cc1ccc[n]c1SCCO Amb18185610 [0,1,0,0,0,0|1,1,0]=3 1299 B11R1.17 Cc1ccccc1C#CCBr Amb25032502 [0,1,0,0,0,0|2,0,1]=4 1300 B11R1.17 Cc1ccccc1C#CCCl Amb18792614 [0,1,0,0,0,0|2,0,1]=4 1301 B11R1.17 Cc1ccccc1C#CCF Amb25026923 [0,1,0,0,0,0|2,0,1]=4 1302 B11R1.17 Cc1ccccc1C#CCN Amb18949803 [0,1,0,0,0,0|2,0,1]=4 1303 B11R1.17 Cc1ccccc1C#CCO Amb25117588 [0,1,0,0,0,0|1,0,1]=3 1304 B11R1.17 Cc1ccccc1CCC#C Amb18636111 [0,1,0,0,0,0|2,0,1]=4 1305 B11R1.17 Cc1ccccc1CCCC Amb25825024 [0,1,0,0,0,0|2,0,0]=3 1306 B11R1.17 Cc1ccccc1CCNC Amb19959980 [0,1,0,0,0,0|3,0,0]=4 1307 B11R1.17 Cc1ccccc1CC[Zn]Br Amb22000497 [0,1,0,0,0,0|3,0,0]=4 1308 B11R1.17 Cc1ccccc1COCCl Amb24352480 [0,1,0,0,0,0|3,0,0]=4 1309 B11R1.17 Cc1ccccc1CSCC Amb24690023 [0,1,0,0,0,0|3,0,0]=4 1310 B11R1.17 Cc1ccccc1NCC#C Amb25677805 [0,1,0,0,0,0|2,0,1]=4 1311 B11R1.17 Cc1ccccc1NCCF Amb24560861 [0,1,0,0,0,0|2,0,0]=3 1312 B11R1.17 Cc1ccccc1NCOC Amb25690923 [0,1,0,0,0,0|3,0,0]=4 1313 B11R1.17 Cc1ccccc1OCC#C Amb19373366 [0,1,0,0,0,0|1,0,1]=3 1314 B11R1.17 Cc1ccccc1O\C=C/Cl Amb25796451 [0,1,0,0,0,0|1,0,2]=4 1315 B11R1.17 Cc1ccccc1SCC#C Amb18788142 [0,1,0,0,0,0|1,1,1]=4 1316 B11R1.17 Cc1ccccc1SCC#N Amb18792512 [0,1,0,0,0,0|1,1,1]=4 1317 B11R1.17 Cc1ccccc1SCC=C Amb25231651 [0,1,0,0,0,0|1,1,1]=4 1318 B11R1.17 Cc1ccccc1SCC=O Amb18183536 [0,1,0,0,0,0|0,1,2]=4 1319 B11R1.17 Cc1ccccc1SCCC Amb24674923 [0,1,0,0,0,0|1,1,0]=3 1320 B11R1.17 Cc1ccccc1SCCCl Amb19059017 [0,1,0,0,0,0|1,1,0]=3 1321 B11R1.17 Cc1ccccc1SCCN Amb18992759 [0,1,0,0,0,0|1,1,0]=3 1322 B11R1.17 Cc1ccccc1SCCO Amb18180155 [0,1,0,0,0,0|0,1,0]=2 1323 B11R1.17 Cc1ccccc1SCSC Amb24631994 [0,1,0,0,0,0|2,1,0]=4 1324 B11R1.17 Cc1ccccc1\C=C\CBr Amb25169542 [0,1,0,0,0,0|2,0,1]=4 1325 B11R1.17 Cc1ccccc1\C=C\CN Amb18065178 [0,1,0,0,0,0|2,0,1]=4 1326 B11R1.17 Cc1ccccc1\C=C\CO Amb23442935 [0,1,0,0,0,0|1,0,1]=3 1327 B11R1.17 ClCCCc1[n]cccc1Br Amb25089986 [0,1,0,0,0,0|3,0,0]=4 1328 B11R1.17 ClCCCc1ccccc1C Amb17104525 [0,1,0,0,0,0|2,0,0]=3 1329 B11R1.17 ClCCCc1ccccc1Cl Amb17104533 [0,1,0,0,0,0|2,0,0]=3 1330 B11R1.17 ClCCCc1ccccc1F Amb17104528 [0,1,0,0,0,0|2,0,0]=3 1331 B11R1.17 ClCCCc1ccccc1N Amb17477710 [0,1,0,0,0,0|2,0,0]=3 1332 B11R1.17 ClCCCc1ccccc1O Amb17477721 [0,1,0,0,0,0|2,0,0]=3 1333 B11R1.17 ClCCNc1[n]cccc1Br Amb25846546 [0,1,0,0,0,0|3,0,0]=4 1334 B11R1.17 ClCCNc1ccccc1Br Amb17346196 [0,1,0,0,0,0|2,0,0]=3 1335 B11R1.17 ClCCNc1ccccc1C Amb17334785 [0,1,0,0,0,0|2,0,0]=3 1336 B11R1.17 ClCCNc1ccccc1Cl Amb17336180 [0,1,0,0,0,0|2,0,0]=3 1337 B11R1.17 ClCCNc1ccccc1F Amb17334964 [0,1,0,0,0,0|2,0,0]=3 1338 B11R1.17 ClCCSc1ccccc1F Amb1154202 [0,1,0,0,0,0|1,1,0]=3 1339 B11R1.17 ClCOCc1ccccc1Br Amb25679464 [0,1,0,0,0,0|3,0,0]=4 1340 B11R1.17 Clc1c[n]ccc1CCCBr Amb25851696 [0,1,0,0,0,0|3,0,0]=4 1341 B11R1.17 Clc1c[n]ccc1CCCCl Amb25344160 [0,1,0,0,0,0|3,0,0]=4 1342 B11R1.17 Clc1c[n]ccc1NCCCl Amb25225122 [0,1,0,0,0,0|3,0,0]=4 1343 B11R1.17 Clc1ccc[n]c1NCCCl Amb25144899 [0,1,0,0,0,0|3,0,0]=4 1344 B11R1.17 Clc1ccccc1C#CCCl Amb18319857 [0,1,0,0,0,0|2,0,1]=4 1345 B11R1.17 Clc1ccccc1C#CCI Amb24447633 [0,1,0,0,0,0|2,0,1]=4 1346 B11R1.17 Clc1ccccc1CC[Zn]Br Amb22898141 [0,1,0,0,0,0|3,0,0]=4 1347 B11R1.17 Clc1ccccc1CC[Zn]Cl Amb22897727 [0,1,0,0,0,0|3,0,0]=4 1348 B11R1.17 FCC#Cc1ccccc1Br Amb25252787 [0,1,0,0,0,0|2,0,1]=4 1349 B11R1.17 FCC#Cc1ccccc1Cl Amb25330678 [0,1,0,0,0,0|2,0,1]=4 1350 B11R1.17 FCC#Cc1ccccc1I Amb25027319 [0,1,0,0,0,0|2,0,1]=4 1351 B11R1.17 FCCSc1[n]cccc1Br Amb24370858 [0,1,0,0,0,0|2,1,0]=4 1352 B11R1.17 FCCSc1[n]cccc1Cl Amb24440047 [0,1,0,0,0,0|2,1,0]=4 1353 B11R1.17 FCCSc1ccccc1Br Amb22227854 [0,1,0,0,0,0|1,1,0]=3 1354 B11R1.17 Fc1[n]cccc1OCCF Amb25120849 [0,1,0,0,0,0|2,0,0]=3 1355 B11R1.17 Fc1c[n]ccc1CCCBr Amb24486812 [0,1,0,0,0,0|3,0,0]=4 1356 B11R1.17 Fc1ccc[n]c1NCCF Amb24425884 [0,1,0,0,0,0|3,0,0]=4 1357 B11R1.17 Fc1ccc[n]c1SCCCl Amb18325303 [0,1,0,0,0,0|2,1,0]=4 1358 B11R1.17 Fc1ccccc1C#CCCl Amb18185585 [0,1,0,0,0,0|2,0,1]=4 1359 B11R1.17 Fc1ccccc1OCCF Amb25692641 [0,1,0,0,0,0|1,0,0]=2 1360 B11R1.17 Fc1ccccc1OCCI Amb25151268 [0,1,0,0,0,0|1,0,0]=2 1361 B11R1.17 Fc1ccccc1\C=C\CBr Amb24374006 [0,1,0,0,0,0|2,0,1]=4 1362 B11R1.17 Ic1ccccc1C#CCI Amb24509627 [0,1,0,0,0,0|2,0,1]=4 1363 B11R1.17 N#CCCc1ccccc1Br Amb17204424 [0,1,0,0,0,0|2,0,1]=4 1364 B11R1.17 N#CCCc1ccccc1C Amb17204295 [0,1,0,0,0,0|2,0,1]=4 1365 B11R1.17 N#CCCc1ccccc1F Amb17204298 [0,1,0,0,0,0|2,0,1]=4 1366 B11R1.17 N#CCCc1ccccc1O Amb17509008 [0,1,0,0,0,0|2,0,1]=4 1367 B11R1.17 N#CCOC1=CC=CNC1=O Amb18537474 [0,1,0,0,0,0|2,0,1]=4 1368 B11R1.17 N#CCOc1ccc[n]c1Br Amb24486664 [0,1,0,0,0,0|2,0,1]=4 1369 B11R1.17 N#CCOc1ccc[n]c1F Amb25739807 [0,1,0,0,0,0|2,0,1]=4 1370 B11R1.17 N#CCOc1cccc[n+]1[O-] Amb25316751 [0,1,0,0,0,0|2,0,1]=4 1371 B11R1.17 N#CCSc1ccccc1O Amb18177810 [0,1,0,0,0,0|1,1,1]=4 1372 B11R1.17 NCC#Cc1ccccc1Br Amb25727777 [0,1,0,0,0,0|2,0,1]=4 1373 B11R1.17 NCC#Cc1ccccc1Cl Amb18281655 [0,1,0,0,0,0|2,0,1]=4 1374 B11R1.17 NCC#Cc1ccccc1F Amb18962138 [0,1,0,0,0,0|2,0,1]=4 1375 B11R1.17 NCC#Cc1ccccc1I Amb24454628 [0,1,0,0,0,0|2,0,1]=4 1376 B11R1.17 NCC#Cc1ccccc1O Amb25304022 [0,1,0,0,0,0|2,0,1]=4 1377 B11R1.17 NCCCN1C=CC=CC1=O Amb18535490 [0,1,0,0,0,0|3,0,0]=4 1378 B11R1.17 NCCCN1C=CC=CC1=O Amb19514396 [0,1,0,0,0,0|3,0,0]=4 1379 B11R1.17 NCCCc1[n]cccc1Br Amb25771023 [0,1,0,0,0,0|3,0,0]=4 1380 B11R1.17 NCCCc1[n]cccc1F Amb25032548 [0,1,0,0,0,0|3,0,0]=4 1381 B11R1.17 NCCCc1[n]cccc1O Amb25111600 [0,1,0,0,0,0|3,0,0]=4 1382 B11R1.17 NCCCc1cc[n]cc1Cl Amb23596508 [0,1,0,0,0,0|3,0,0]=4 1383 B11R1.17 NCCCc1cc[n]cc1F Amb25111554 [0,1,0,0,0,0|3,0,0]=4 1384 B11R1.17 NCCCc1ccccc1Cl Amb1090913 [0,1,0,0,0,0|2,0,0]=3 1385 B11R1.17 NCCCc1ccccc1Cl Amb19373405 [0,1,0,0,0,0|2,0,0]=3 1386 B11R1.17 NCCCc1ccccc1F Amb13949158 [0,1,0,0,0,0|2,0,0]=3 1387 B11R1.17 NCCCc1ccccc1N Amb17477695 [0,1,0,0,0,0|2,0,0]=3 1388 B11R1.17 NCCNc1[n]cccc1Br Amb18979379 [0,1,0,0,0,0|3,0,0]=4 1389 B11R1.17 NCCNc1[n]cccc1F Amb18996005 [0,1,0,0,0,0|3,0,0]=4 1390 B11R1.17 NCCNc1cc[n]cc1Br Amb24768461 [0,1,0,0,0,0|3,0,0]=4 1391 B11R1.17 NCCNc1cc[n]cc1F Amb24739193 [0,1,0,0,0,0|3,0,0]=4 1392 B11R1.17 NCCNc1ccc[n]c1Br Amb24729303 [0,1,0,0,0,0|3,0,0]=4 1393 B11R1.17 NCCNc1ccc[n]c1Cl Amb25187389 [0,1,0,0,0,0|3,0,0]=4 1394 B11R1.17 NCCNc1cccc[n+]1[O-] Amb24726506 [0,1,0,0,0,0|3,0,0]=4 1395 B11R1.17 NCCNc1ccccc1Br Amb17091073 [0,1,0,0,0,0|2,0,0]=3 1396 B11R1.17 NCCNc1ccccc1C Amb17057744 [0,1,0,0,0,0|2,0,0]=3 1397 B11R1.17 NCCNc1ccccc1Cl Amb17057749 [0,1,0,0,0,0|2,0,0]=3 1398 B11R1.17 NCCNc1ccccc1F Amb17057747 [0,1,0,0,0,0|2,0,0]=3 1399 B11R1.17 NCCNc1ccccc1N Amb1397489 [0,1,0,0,0,0|2,0,0]=3 1400 B11R1.17 NCCNc1ccccc1O Amb18251377 [0,1,0,0,0,0|2,0,0]=3 1401 B11R1.17 NCCNc1ncccc1C Amb10607838 [0,1,0,0,0,0|3,0,0]=4 1402 B11R1.17 NCCOC1=NC=CNC1=O Amb25720047 [0,1,0,0,0,0|3,0,0]=4 1403 B11R1.17 NCCOc1[n]c[n]cc1Br Amb24703385 [0,1,0,0,0,0|3,0,0]=4 1404 B11R1.17 NCCOc1[n]c[n]cc1Cl Amb25045442 [0,1,0,0,0,0|3,0,0]=4 1405 B11R1.17 NCCOc1[n]cccc1Br Amb18988886 [0,1,0,0,0,0|2,0,0]=3 1406 B11R1.17 NCCOc1[n]cccc1Cl Amb18988869 [0,1,0,0,0,0|2,0,0]=3 1407 B11R1.17 NCCOc1[n]cccc1Cl Amb20631069 [0,1,0,0,0,0|2,0,0]=3 1408 B11R1.17 NCCOc1[n]cccc1F Amb18996066 [0,1,0,0,0,0|2,0,0]=3 1409 B11R1.17 NCCOc1[n]cccc1I Amb25208739 [0,1,0,0,0,0|2,0,0]=3 1410 B11R1.17 NCCOc1cc[n]cc1Br Amb24353235 [0,1,0,0,0,0|2,0,0]=3 1411 B11R1.17 NCCOc1ccccc1Br Amb10609932 [0,1,0,0,0,0|1,0,0]=2 1412 B11R1.17 NCCOc1ccccc1C Amb1098984 [0,1,0,0,0,0|1,0,0]=2 1413 B11R1.17 NCCOc1ccccc1C Amb2052283 [0,1,0,0,0,0|1,0,0]=2 1414 B11R1.17 NCCOc1ccccc1Cl Amb2137131 [0,1,0,0,0,0|1,0,0]=2 1415 B11R1.17 NCCOc1ccccc1F Amb1105167 [0,1,0,0,0,0|1,0,0]=2 1416 B11R1.17 NCCOc1ccccc1O Amb17615721 [0,1,0,0,0,0|1,0,0]=2 1417 B11R1.17 NCCSc1[n]cccc1Cl Amb18252966 [0,1,0,0,0,0|2,1,0]=4 1418 B11R1.17 NCCSc1ccccc1O Amb18984794 [0,1,0,0,0,0|1,1,0]=3 1419 B11R1.17 NC\C=C\c1ccccc1Br Amb18569373 [0,1,0,0,0,0|2,0,1]=4 1420 B11R1.17 NC\C=C\c1ccccc1Cl Amb18065473 [0,1,0,0,0,0|2,0,1]=4 1421 B11R1.17 NC\C=C\c1ccccc1F Amb18065347 [0,1,0,0,0,0|2,0,1]=4 1422 B11R1.17 NNCCc1ccccc1Br Amb24701935 [0,1,0,0,0,0|3,0,0]=4 1423 B11R1.17 NNCCc1ccccc1F Amb20668135 [0,1,0,0,0,0|3,0,0]=4 1424 B11R1.17 NOCCc1ccccc1Br Amb18657908 [0,1,0,0,0,0|3,0,0]=4 1425 B11R1.17 NOCCc1ccccc1Cl Amb18647570 [0,1,0,0,0,0|3,0,0]=4 1426 B11R1.17 NOCCc1ccccc1F Amb22896629 [0,1,0,0,0,0|3,0,0]=4 1427 B11R1.17 Nc1[n]cccc1CCCBr Amb25763348 [0,1,0,0,0,0|3,0,0]=4 1428 B11R1.17 Nc1[n]cccc1CCCCl Amb24486006 [0,1,0,0,0,0|3,0,0]=4 1429 B11R1.17 Nc1[n]cccc1NCCF Amb25744595 [0,1,0,0,0,0|3,0,0]=4 1430 B11R1.17 Nc1[n]cccc1NCCN Amb24486768 [0,1,0,0,0,0|3,0,0]=4 1431 B11R1.17 Nc1c[n]ccc1NCCF Amb24406413 [0,1,0,0,0,0|3,0,0]=4 1432 B11R1.17 Nc1c[n]ccc1NCCN Amb18991504 [0,1,0,0,0,0|3,0,0]=4 1433 B11R1.17 Nc1c[n]ccc1SCCCl Amb24532971 [0,1,0,0,0,0|2,1,0]=4 1434 B11R1.17 Nc1c[n]ccc1SCCF Amb24624556 [0,1,0,0,0,0|2,1,0]=4 1435 B11R1.17 Nc1c[n]ccc1SCCN Amb18291318 [0,1,0,0,0,0|2,1,0]=4 1436 B11R1.17 Nc1cc[n]cc1CCCO Amb24355779 [0,1,0,0,0,0|2,0,0]=3 1437 B11R1.17 Nc1cc[n]cc1NCCN Amb25682895 [0,1,0,0,0,0|3,0,0]=4 1438 B11R1.17 Nc1cc[n]cc1SCCO Amb24414275 [0,1,0,0,0,0|1,1,0]=3 1439 B11R1.17 Nc1ccc[n]c1NCCN Amb18991500 [0,1,0,0,0,0|3,0,0]=4 1440 B11R1.17 Nc1ccc[n]c1OCCN Amb25858100 [0,1,0,0,0,0|2,0,0]=3 1441 B11R1.17 Nc1ccc[n]c1SCCN Amb18291324 [0,1,0,0,0,0|2,1,0]=4 1442 B11R1.17 Nc1ccccc1C#CCCl Amb24462871 [0,1,0,0,0,0|2,0,1]=4 1443 B11R1.17 Nc1ccccc1C#CCF Amb24509437 [0,1,0,0,0,0|2,0,1]=4 1444 B11R1.17 Nc1ccccc1C#CCO Amb22228947 [0,1,0,0,0,0|1,0,1]=3 1445 B11R1.17 Nc1ccccc1CCC#N Amb18124793 [0,1,0,0,0,0|2,0,1]=4 1446 B11R1.17 Nc1ccccc1CCC=O Amb25208520 [0,1,0,0,0,0|1,0,2]=4 1447 B11R1.17 Nc1ccccc1CCCBr Amb22228093 [0,1,0,0,0,0|2,0,0]=3 1448 B11R1.17 Nc1ccccc1CCCBr Amb25217893 [0,1,0,0,0,0|2,0,0]=3 1449 B11R1.17 Nc1ccccc1OCCF Amb23579999 [0,1,0,0,0,0|1,0,0]=2 1450 B11R1.17 Nc1ccccc1OCCN Amb18251366 [0,1,0,0,0,0|1,0,0]=2 1451 B11R1.17 Nc1ccccc1SCCCl Amb18129706 [0,1,0,0,0,0|1,1,0]=3 1452 B11R1.17 Nc1ccccc1SCCF Amb24533142 [0,1,0,0,0,0|1,1,0]=3 1453 B11R1.17 Nc1ccccc1SCCN Amb18291073 [0,1,0,0,0,0|1,1,0]=3 1454 B11R1.17 Nc1ccccc1\C=C\CO Amb25353301 [0,1,0,0,0,0|1,0,1]=3 1455 B11R1.17 Nc1ncccc1CCCO Amb13890002 [0,1,0,0,0,0|2,0,0]=3 1456 B11R1.17 Nc1ncccc1OCC=C Amb10608175 [0,1,0,0,0,0|2,0,1]=4 1457 B11R1.17 O=C1C=CC=CN1CCCCl Amb18183682 [0,1,0,0,0,0|3,0,0]=4 1458 B11R1.17 O=C1C=CC=CN1OCCBr Amb24743344 [0,1,0,0,0,0|2,0,0]=3 1459 B11R1.17 O=CCCc1ccccc1Br Amb22498060 [0,1,0,0,0,0|1,0,2]=4 1460 B11R1.17 O=CCCc1ccccc1Cl Amb17081678 [0,1,0,0,0,0|1,0,2]=4 1461 B11R1.17 O=CCCc1ccccc1F Amb10602147 [0,1,0,0,0,0|1,0,2]=4 1462 B11R1.17 O=CCCc1ccccc1I Amb24093007 [0,1,0,0,0,0|1,0,2]=4 1463 B11R1.17 O=CCCc1ccccc1S Amb25325144 [0,1,0,0,0,0|1,0,2]=4 1464 B11R1.17 O=CCOc1ccccc1Br Amb17099950 [0,1,0,0,0,0|0,0,2]=3 1465 B11R1.17 O=CCOc1ccccc1F Amb18182892 [0,1,0,0,0,0|0,0,2]=3 1466 B11R1.17 O=CCSc1ccccc1Cl Amb19075897 [0,1,0,0,0,0|0,1,2]=4 1467 B11R1.17 O=CCSc1ccccc1F Amb18185632 [0,1,0,0,0,0|0,1,2]=4 1468 B11R1.17 OCC#Cc1ccccc1I Amb24731810 [0,1,0,0,0,0|1,0,1]=3 1469 B11R1.17 OCC#Cc1cnccc1Cl Amb13889957 [0,1,0,0,0,0|2,0,1]=4 1470 B11R1.17 OCC=Cc1ccccc1F Amb22228953 [0,1,0,0,0,0|1,0,1]=3 1471 B11R1.17 OCCCN1C=CC=CC1=O Amb18041289 [0,1,0,0,0,0|2,0,0]=3 1472 B11R1.17 OCCCN1C=CC=NC1=O Amb18177313 [0,1,0,0,0,0|3,0,0]=4 1473 B11R1.17 OCCCN1C=NC=CC1=O Amb25771228 [0,1,0,0,0,0|3,0,0]=4 1474 B11R1.17 OCCCN1N=CC=CC1=O Amb18179507 [0,1,0,0,0,0|3,0,0]=4 1475 B11R1.17 OCCCc1[n]cccc1Br Amb25273165 [0,1,0,0,0,0|2,0,0]=3 1476 B11R1.17 OCCCc1cc[n]cc1Cl Amb23596495 [0,1,0,0,0,0|2,0,0]=3 1477 B11R1.17 OCCCc1cc[n]cc1F Amb25825625 [0,1,0,0,0,0|2,0,0]=3 1478 B11R1.17 OCCCc1ccccc1Br Amb15692692 [0,1,0,0,0,0|1,0,0]=2 1479 B11R1.17 OCCCc1ccccc1C Amb17089494 [0,1,0,0,0,0|1,0,0]=2 1480 B11R1.17 OCCCc1ccccc1Cl Amb17089499 [0,1,0,0,0,0|1,0,0]=2 1481 B11R1.17 OCCCc1ccccc1F Amb17089496 [0,1,0,0,0,0|1,0,0]=2 1482 B11R1.17 OCCCc1ccccc1N Amb17477702 [0,1,0,0,0,0|1,0,0]=2 1483 B11R1.17 OCCCc1ccccc1O Amb17477714 [0,1,0,0,0,0|1,0,0]=2 1484 B11R1.17 OCCCc1ccncc1C Amb10573523 [0,1,0,0,0,0|2,0,0]=3 1485 B11R1.17 OCCNc1[n]c[n]cc1Br Amb25131996 [0,1,0,0,0,0|3,0,0]=4 1486 B11R1.17 OCCNc1[n]c[n]cc1I Amb25149249 [0,1,0,0,0,0|3,0,0]=4 1487 B11R1.17 OCCNc1[n]cccc1Br Amb18292072 [0,1,0,0,0,0|2,0,0]=3 1488 B11R1.17 OCCNc1[n]cccc1F Amb18300634 [0,1,0,0,0,0|2,0,0]=3 1489 B11R1.17 OCCNc1ncccc1I Amb10844707 [0,1,0,0,0,0|2,0,0]=3 1490 B11R1.17 OCCOc1[n]c[n]cc1Br Amb25149255 [0,1,0,0,0,0|2,0,0]=3 1491 B11R1.17 OCCOc1[n]cc[n]c1Cl Amb18183884 [0,1,0,0,0,0|2,0,0]=3 1492 B11R1.17 OCCOc1[n]cccc1Br Amb23598436 [0,1,0,0,0,0|1,0,0]=2 1493 B11R1.17 OCCOc1[n]cccc1Cl Amb23598430 [0,1,0,0,0,0|1,0,0]=2 1494 B11R1.17 OCCOc1cc[n]cc1Br Amb24703549 [0,1,0,0,0,0|1,0,0]=2 1495 B11R1.17 OCCOc1ccc[n]c1Br Amb22493971 [0,1,0,0,0,0|1,0,0]=2 1496 B11R1.17 OCCOc1ccc[n]c1Cl Amb24486639 [0,1,0,0,0,0|1,0,0]=2 1497 B11R1.17 OCCOc1ccccc1C Amb2209345 [0,1,0,0,0,0|0,0,0]=1 1498 B11R1.17 OCCOc1ccccc1Cl Amb2209355 [0,1,0,0,0,0|0,0,0]=1 1499 B11R1.17 OCCOc1ccccc1I Amb25761613 [0,1,0,0,0,0|0,0,0]=1 1500 B11R1.17 OCCOc1ccccc1O Amb1144452 [0,1,0,0,0,0|0,0,0]=1 1501 B11R1.17 OCCOc1ncccc1O Amb13889705 [0,1,0,0,0,0|1,0,0]=2 1502 B11R1.17 OCCSC1=NC=CNC1=O Amb25235802 [0,1,0,0,0,0|2,1,0]=4 1503 B11R1.17 OCCSc1[n]c[n]cc1Cl Amb25188801 [0,1,0,0,0,0|2,1,0]=4 1504 B11R1.17 OCCSc1[n]cc[n]c1Cl Amb18325156 [0,1,0,0,0,0|2,1,0]=4 1505 B11R1.17 OCCSc1[n]cccc1Br Amb25702235 [0,1,0,0,0,0|1,1,0]=3 1506 B11R1.17 OCCSc1[n]cccc1F Amb18803328 [0,1,0,0,0,0|1,1,0]=3 1507 B11R1.17 OCCSc1cc[n]cc1Br Amb25333968 [0,1,0,0,0,0|1,1,0]=3 1508 B11R1.17 OC\C=C\c1ccccc1Br Amb25149289 [0,1,0,0,0,0|1,0,1]=3 1509 B11R1.17 OC\C=C\c1ccccc1F Amb23442840 [0,1,0,0,0,0|1,0,1]=3 1510 B11R1.17 O\N=C/Cc1ccccc1F Amb24100286 [0,1,0,0,0,0|2,0,1]=4 1511 B11R1.17 O\N=C\Cc1ccccc1F Amb25206635 [0,1,0,0,0,0|2,0,1]=4 1512 B11R1.17 Oc1[n]cccc1OCCO Amb25106031 [0,1,0,0,0,0|1,0,0]=2 1513 B11R1.17 Oc1ccc[n]c1CCCO Amb18125538 [0,1,0,0,0,0|2,0,0]=3 1514 B11R1.17 Oc1ccc[n]c1SCCO Amb18126792 [0,1,0,0,0,0|1,1,0]=3 1515 B11R1.17 Oc1ccccc1C#CCO Amb23412359 [0,1,0,0,0,0|1,0,1]=3 1516 B11R1.17 Oc1ccccc1CCC=O Amb22228954 [0,1,0,0,0,0|1,0,2]=4 1517 B11R1.17 Oc1ccccc1CCCF Amb24100539 [0,1,0,0,0,0|2,0,0]=3 1518 B11R1.17 Oc1ccccc1NCC=O Amb24096359 [0,1,0,0,0,0|1,0,2]=4 1519 B11R1.17 Oc1ccccc1NCCO Amb18644558 [0,1,0,0,0,0|1,0,0]=2 1520 B11R1.17 Oc1ccccc1OCCBr Amb25189201 [0,1,0,0,0,0|1,0,0]=2 1521 B11R1.17 Oc1ccccc1SCC=O Amb25290203 [0,1,0,0,0,0|0,1,2]=4 1522 B11R1.17 Oc1ccccc1SCCO Amb18177935 [0,1,0,0,0,0|0,1,0]=2 1523 B11R1.17 Oc1ccccc1\C=C/CCl Amb24401534 [0,1,0,0,0,0|2,0,1]=4 1524 B11R1.17 Oc1ccccc1\C=C/CO Amb18125107 [0,1,0,0,0,0|1,0,1]=3 1525 B11R1.17 Oc1ccccc1\C=C\CBr Amb25225899 [0,1,0,0,0,0|2,0,1]=4 1526 B11R1.17 Oc1ccccc1\C=C\CO Amb25300470 [0,1,0,0,0,0|1,0,1]=3 1527 B11R1.17 Oc1ccncc1CCCO Amb13889999 [0,1,0,0,0,0|2,0,0]=3 1528 B11R1.17 SCCCc1ccccc1Br Amb18070447 [0,1,0,0,0,0|1,1,0]=3 1529 B11R1.17 SCCCc1ccccc1C Amb17400218 [0,1,0,0,0,0|1,1,0]=3 1530 B11R1.17 SCCCc1ccccc1Cl Amb17401095 [0,1,0,0,0,0|1,1,0]=3 1531 B11R1.17 SCCCc1ccccc1F Amb17400332 [0,1,0,0,0,0|1,1,0]=3 1532 B11R1.17 SCCOc1ccccc1Br Amb17250554 [0,1,0,0,0,0|0,1,0]=2 1533 B11R1.17 SCCSc1[n]cccc1Br Amb24363354 [0,1,0,0,0,0|1,2,0]=4 1534 B11R1.17 SCCSc1[n]cccc1Cl Amb25191223 [0,1,0,0,0,0|1,2,0]=4 1535 B11R1.17 SCCSc1ccccc1Br Amb25306099 [0,1,0,0,0,0|0,2,0]=3 1536 B11R1.17 Sc1ccccc1CCCBr Amb25196016 [0,1,0,0,0,0|2,0,0]=3 1537 B11R1.17 Sc1ccccc1NCCS Amb25118736 [0,1,0,0,0,0|1,1,0]=3 1538 B11R1.17 [C-]#[N+]CCc1ccccc1O Amb24644224 [0,1,0,0,0,0|3,0,0]=4 1539 B11R1.17 [O-][n+]1ccccc1OCCF Amb24464395 [0,1,0,0,0,0|2,0,0]=3 1540 B11R1.17 [O-][n+]1ccccc1OCCO Amb25279652 [0,1,0,0,0,0|1,0,0]=2 1541 B11R1.17 [O-][n+]1ccccc1SCCO Amb25380962 [0,1,0,0,0,0|1,1,0]=3 1542 B11R1.24 BrCC#Cc1cc(I)ccc1 Amb25308173 [0,1,0,0,0,0|2,0,1]=4 1543 B11R1.24 BrCCCc1cccc(c1)Br Amb17104576 [0,1,0,0,0,0|2,0,0]=3 1544 B11R1.24 BrCCCc1cccc(c1)C Amb17104553 [0,1,0,0,0,0|2,0,0]=3 1545 B11R1.24 BrCCCc1cccc(c1)Cl Amb17104561 [0,1,0,0,0,0|2,0,0]=3 1546 B11R1.24 BrCCOc1cccc(c1)Br Amb1150981 [0,1,0,0,0,0|1,0,0]=2 1547 B11R1.24 BrCCOc1cccc(c1)C Amb1643479 [0,1,0,0,0,0|1,0,0]=2 1548 B11R1.24 BrCCOc1cccc(c1)Cl Amb1152965 [0,1,0,0,0,0|1,0,0]=2 1549 B11R1.24 Br[Zn]CCc1cccc(c1)Br Amb13890856 [0,1,0,0,0,0|3,0,0]=4 1550 B11R1.24 Brc1cc(ccc1)C#CCI Amb24447534 [0,1,0,0,0,0|2,0,1]=4 1551 B11R1.24 Brc1cc(ccc1)OCCI Amb25151269 [0,1,0,0,0,0|1,0,0]=2 1552 B11R1.24 C#CCCc1cccc(Cl)c1 Amb18116942 [0,1,0,0,0,0|2,0,1]=4 1553 B11R1.24 C#CCCc1cccc(F)c1 Amb18118085 [0,1,0,0,0,0|2,0,1]=4 1554 B11R1.24 C#CCNc1cccc(Cl)c1 Amb18800989 [0,1,0,0,0,0|2,0,1]=4 1555 B11R1.24 C#CCNc1cccc(F)c1 Amb24102181 [0,1,0,0,0,0|2,0,1]=4 1556 B11R1.24 C#CCNc1cccc(I)c1 Amb25312865 [0,1,0,0,0,0|2,0,1]=4 1557 B11R1.24 C#CCNc1cccc(O)c1 Amb25138473 [0,1,0,0,0,0|2,0,1]=4 1558 B11R1.24 C#CCOc1c[n]cc(Cl)c1 Amb25151317 [0,1,0,0,0,0|2,0,1]=4 1559 B11R1.24 C#CCOc1cc(N)cc[n]1 Amb24574011 [0,1,0,0,0,0|2,0,1]=4 1560 B11R1.24 C#CCOc1cccc(Br)[n]1 Amb24370366 [0,1,0,0,0,0|2,0,1]=4 1561 B11R1.24 C#CCOc1cccc(Cl)[n]1 Amb25678008 [0,1,0,0,0,0|2,0,1]=4 1562 B11R1.24 C#CCOc1cccc(Cl)c1 Amb18183541 [0,1,0,0,0,0|1,0,1]=3 1563 B11R1.24 C#CCOc1cccc(F)[n]1 Amb18787410 [0,1,0,0,0,0|2,0,1]=4 1564 B11R1.24 C#CCOc1cccc(F)c1 Amb18182728 [0,1,0,0,0,0|1,0,1]=3 1565 B11R1.24 C#CCOc1cccc(N)[n]1 Amb24391284 [0,1,0,0,0,0|2,0,1]=4 1566 B11R1.24 C#CCOc1cccc(c1)N Amb13783680 [0,1,0,0,0,0|1,0,1]=3 1567 B11R1.24 C#CCSc1cccc(Cl)c1 Amb19068162 [0,1,0,0,0,0|1,1,1]=4 1568 B11R1.24 C#CCSc1cccc(N)c1 Amb25675317 [0,1,0,0,0,0|1,1,1]=4 1569 B11R1.24 C#CCSc1cccc(O)c1 Amb24657054 [0,1,0,0,0,0|1,1,1]=4 1570 B11R1.24 C=CCCc1cccc(O)c1 Amb25275934 [0,1,0,0,0,0|2,0,1]=4 1571 B11R1.24 C=CCNc1cccc(c1)Br Amb17306222 [0,1,0,0,0,0|2,0,1]=4 1572 B11R1.24 C=CCNc1cccc(c1)C Amb17306547 [0,1,0,0,0,0|2,0,1]=4 1573 B11R1.24 C=CCNc1cccc(c1)Cl Amb17307127 [0,1,0,0,0,0|2,0,1]=4 1574 B11R1.24 C=CCNc1cccc(c1)F Amb17306228 [0,1,0,0,0,0|2,0,1]=4 1575 B11R1.24 C=CCOc1c[n]cc(Br)c1 Amb25128103 [0,1,0,0,0,0|2,0,1]=4 1576 B11R1.24 C=CCOc1c[n]cc(N)c1 Amb24486698 [0,1,0,0,0,0|2,0,1]=4 1577 B11R1.24 C=CCOc1cc[n]c(Cl)c1 Amb25145756 [0,1,0,0,0,0|2,0,1]=4 1578 B11R1.24 C=CCOc1cc[n]c(F)c1 Amb24572940 [0,1,0,0,0,0|2,0,1]=4 1579 B11R1.24 C=CCOc1cccc(Cl)[n]1 Amb24642240 [0,1,0,0,0,0|2,0,1]=4 1580 B11R1.24 C=CCOc1cccc(F)[n]1 Amb18177246 [0,1,0,0,0,0|2,0,1]=4 1581 B11R1.24 C=CCOc1cccc(F)c1 Amb24649594 [0,1,0,0,0,0|1,0,1]=3 1582 B11R1.24 C=CCOc1cccc(I)c1 Amb22896684 [0,1,0,0,0,0|1,0,1]=3 1583 B11R1.24 C=CCOc1cccc(N)[n]1 Amb25189199 [0,1,0,0,0,0|2,0,1]=4 1584 B11R1.24 C=CCOc1cccc(c1)N Amb2094493 [0,1,0,0,0,0|1,0,1]=3 1585 B11R1.24 C=CCSc1cccc(N)c1 Amb24707774 [0,1,0,0,0,0|1,1,1]=4 1586 B11R1.24 CCC#Cc1cc(O)ccc1 Amb25139990 [0,1,0,0,0,0|2,0,1]=4 1587 B11R1.24 CCCCC1=CC=CC(=S)N1 Amb25720838 [0,1,0,0,0,0|3,0,0]=4 1588 B11R1.24 CCCC[n+]1cc(C)ccc1 Amb22047356 [0,1,0,0,0,0|3,0,0]=4 1589 B11R1.24 CCCC[n+]1cc(C)ccc1 Amb22264602 [0,1,0,0,0,0|3,0,0]=4 1590 B11R1.24 CCCC[n+]1cc(C)ccc1 Amb22411627 [0,1,0,0,0,0|3,0,0]=4 1591 B11R1.24 CCCC[n+]1cc(C)ccc1 Amb24323548 [0,1,0,0,0,0|3,0,0]=4 1592 B11R1.24 CCCCc1c[n]cc(N)c1 Amb24757999 [0,1,0,0,0,0|3,0,0]=4 1593 B11R1.24 CCCCc1cc(Br)cc[n]1 Amb24083005 [0,1,0,0,0,0|3,0,0]=4 1594 B11R1.24 CCCCc1cc(O)cc[n]1 Amb25109626 [0,1,0,0,0,0|3,0,0]=4 1595 B11R1.24 CCCCc1cc[n]c(N)c1 Amb24629138 [0,1,0,0,0,0|3,0,0]=4 1596 B11R1.24 CCCCc1cc[n]c(O)c1 Amb22749775 [0,1,0,0,0,0|3,0,0]=4 1597 B11R1.24 CCCCc1cccc(Br)c1 Amb19944057 [0,1,0,0,0,0|2,0,0]=3 1598 B11R1.24 CCCCc1cccc(I)c1 Amb19944046 [0,1,0,0,0,0|2,0,0]=3 1599 B11R1.24 CCCCc1cccc(N)[n]1 Amb18644442 [0,1,0,0,0,0|3,0,0]=4 1600 B11R1.24 CCCCc1cccc(S)c1 Amb24415059 [0,1,0,0,0,0|2,0,0]=3 1601 B11R1.24 CCCCc1cccc(c1)N Amb17593719 [0,1,0,0,0,0|2,0,0]=3 1602 B11R1.24 CCCNc1cc(Br)c[n]c1 Amb23450119 [0,1,0,0,0,0|3,0,0]=4 1603 B11R1.24 CCCNc1cc(Br)cc[n]1 Amb19959557 [0,1,0,0,0,0|3,0,0]=4 1604 B11R1.24 CCCNc1cc(Cl)c[n]c1 Amb25312529 [0,1,0,0,0,0|3,0,0]=4 1605 B11R1.24 CCCNc1cc(F)c[n]c1 Amb25151999 [0,1,0,0,0,0|3,0,0]=4 1606 B11R1.24 CCCNc1cc(N)[n]cc1 Amb25341378 [0,1,0,0,0,0|3,0,0]=4 1607 B11R1.24 CCCNc1cc(N)c[n]c1 Amb24468291 [0,1,0,0,0,0|3,0,0]=4 1608 B11R1.24 CCCNc1cc(N)ccn1 Amb17334314 [0,1,0,0,0,0|3,0,0]=4 1609 B11R1.24 CCCNc1cc(O)cc[n]1 Amb25678446 [0,1,0,0,0,0|3,0,0]=4 1610 B11R1.24 CCCNc1cccc(Br)[n]1 Amb22831396 [0,1,0,0,0,0|3,0,0]=4 1611 B11R1.24 CCCNc1cccc(Br)[n]1 Amb25145786 [0,1,0,0,0,0|3,0,0]=4 1612 B11R1.24 CCCNc1cccc(Cl)[n]1 Amb21958678 [0,1,0,0,0,0|3,0,0]=4 1613 B11R1.24 CCCNc1cccc(F)[n]1 Amb18973532 [0,1,0,0,0,0|3,0,0]=4 1614 B11R1.24 CCCNc1cccc(O)[n]1 Amb25850757 [0,1,0,0,0,0|3,0,0]=4 1615 B11R1.24 CCCOC1=CC(=O)NC=C1 Amb25729079 [0,1,0,0,0,0|2,0,0]=3 1616 B11R1.24 CCCOC1=CC(=O)NC=N1 Amb25715335 [0,1,0,0,0,0|3,0,0]=4 1617 B11R1.24 CCCOC1=CC(=S)NC=N1 Amb25301430 [0,1,0,0,0,0|3,0,0]=4 1618 B11R1.24 CCCOC=1C=NNC(=O)C1 Amb22276772 [0,1,0,0,0,0|3,0,0]=4 1619 B11R1.24 CCCOc1[n]c(Cl)cc[n]1 Amb24319622 [0,1,0,0,0,0|3,0,0]=4 1620 B11R1.24 CCCOc1[n]c(N)cc[n]1 Amb23437548 [0,1,0,0,0,0|3,0,0]=4 1621 B11R1.24 CCCOc1c[n][n]c(Cl)c1 Amb22276394 [0,1,0,0,0,0|3,0,0]=4 1622 B11R1.24 CCCOc1c[n]cc(Br)c1 Amb19959579 [0,1,0,0,0,0|2,0,0]=3 1623 B11R1.24 CCCOc1c[n]cc(N)[n]1 Amb20617837 [0,1,0,0,0,0|3,0,0]=4 1624 B11R1.24 CCCOc1c[n]cc(N)c1 Amb24320310 [0,1,0,0,0,0|2,0,0]=3 1625 B11R1.24 CCCOc1cc(Br)[n]c[n]1 Amb24692399 [0,1,0,0,0,0|3,0,0]=4 1626 B11R1.24 CCCOc1cc(Br)ccn1 Amb10599830 [0,1,0,0,0,0|2,0,0]=3 1627 B11R1.24 CCCOc1cc(Cl)[n]c[n]1 Amb18178035 [0,1,0,0,0,0|3,0,0]=4 1628 B11R1.24 CCCOc1cc(Cl)[n]cc1 Amb24065113 [0,1,0,0,0,0|2,0,0]=3 1629 B11R1.24 CCCOc1cc(Cl)cc[n]1 Amb22276515 [0,1,0,0,0,0|2,0,0]=3 1630 B11R1.24 CCCOc1cc(Cl)ccc1 Amb25787001 [0,1,0,0,0,0|1,0,0]=2 1631 B11R1.24 CCCOc1cc(F)[n]cc1 Amb24084203 [0,1,0,0,0,0|2,0,0]=3 1632 B11R1.24 CCCOc1cc(F)ccc1 Amb25700428 [0,1,0,0,0,0|1,0,0]=2 1633 B11R1.24 CCCOc1cc(I)cc[n]1 Amb25352720 [0,1,0,0,0,0|2,0,0]=3 1634 B11R1.24 CCCOc1cc(N)[n]c[n]1 Amb18217168 [0,1,0,0,0,0|3,0,0]=4 1635 B11R1.24 CCCOc1cc(N)[n]cc1 Amb20617625 [0,1,0,0,0,0|2,0,0]=3 1636 B11R1.24 CCCOc1cc(N)cc[n]1 Amb18981543 [0,1,0,0,0,0|2,0,0]=3 1637 B11R1.24 CCCOc1cc[n]c(Cl)[n]1 Amb18803313 [0,1,0,0,0,0|3,0,0]=4 1638 B11R1.24 CCCOc1cc[n]c(N)[n]1 Amb25719528 [0,1,0,0,0,0|3,0,0]=4 1639 B11R1.24 CCCOc1cccc(Cl)[n]1 Amb25757082 [0,1,0,0,0,0|2,0,0]=3 1640 B11R1.24 CCCOc1cccc(F)[n]1 Amb18787563 [0,1,0,0,0,0|2,0,0]=3 1641 B11R1.24 CCCOc1cccc(c1)C Amb10573406 [0,1,0,0,0,0|1,0,0]=2 1642 B11R1.24 CCCOc1cccc(c1)N Amb1138945 [0,1,0,0,0,0|1,0,0]=2 1643 B11R1.24 CCCOc1cccc(n1)Br Amb10599306 [0,1,0,0,0,0|2,0,0]=3 1644 B11R1.24 CCCOc1ccnc(c1)Br Amb10599900 [0,1,0,0,0,0|2,0,0]=3 1645 B11R1.24 CCCOc1ccnc(n1)S Amb1935164 [0,1,0,0,0,0|3,0,0]=4 1646 B11R1.24 CCCOc1cncc(n1)Br Amb10600300 [0,1,0,0,0,0|3,0,0]=4 1647 B11R1.24 CCCOc1nccc(n1)Br Amb10599666 [0,1,0,0,0,0|3,0,0]=4 1648 B11R1.24 CCCSc1cc(Br)ccc1 Amb24538191 [0,1,0,0,0,0|1,1,0]=3 1649 B11R1.24 CCCSc1cc(Cl)cc[n]1 Amb22276429 [0,1,0,0,0,0|2,1,0]=4 1650 B11R1.24 CCCSc1cc(Cl)ccc1 Amb25801816 [0,1,0,0,0,0|1,1,0]=3 1651 B11R1.24 CCCSc1cc(F)[n]cc1 Amb25338743 [0,1,0,0,0,0|2,1,0]=4 1652 B11R1.24 CCCSc1cc(F)ccc1 Amb25806371 [0,1,0,0,0,0|1,1,0]=3 1653 B11R1.24 CCCSc1cc(N)cc[n]1 Amb18293405 [0,1,0,0,0,0|2,1,0]=4 1654 B11R1.24 CCCSc1cc(N)ccc1 Amb18289141 [0,1,0,0,0,0|1,1,0]=3 1655 B11R1.24 CCCSc1cc(O)ccc1 Amb18126556 [0,1,0,0,0,0|1,1,0]=3 1656 B11R1.24 CCCSc1cccc(Br)[n]1 Amb25134245 [0,1,0,0,0,0|2,1,0]=4 1657 B11R1.24 CCCSc1cccc(F)[n]1 Amb18177984 [0,1,0,0,0,0|2,1,0]=4 1658 B11R1.24 CCCSc1cccc(O)[n]1 Amb18126626 [0,1,0,0,0,0|2,1,0]=4 1659 B11R1.24 CCNCc1cc(I)ccc1 Amb24066806 [0,1,0,0,0,0|3,0,0]=4 1660 B11R1.24 CCNCc1cc(I)ccc1 Amb24066807 [0,1,0,0,0,0|3,0,0]=4 1661 B11R1.24 CCNCc1cc(N)ccc1 Amb18290000 [0,1,0,0,0,0|3,0,0]=4 1662 B11R1.24 CCNCc1cc(S)ccc1 Amb25705598 [0,1,0,0,0,0|3,0,0]=4 1663 B11R1.24 CCNCc1cccc(c1)Br Amb13949217 [0,1,0,0,0,0|3,0,0]=4 1664 B11R1.24 CCOCc1cc(Br)ccc1 Amb23512545 [0,1,0,0,0,0|3,0,0]=4 1665 B11R1.24 CCOCc1cc(Cl)ccc1 Amb24486866 [0,1,0,0,0,0|3,0,0]=4 1666 B11R1.24 CCOCc1cc(O)ccc1 Amb23443319 [0,1,0,0,0,0|3,0,0]=4 1667 B11R1.24 CCSCc1cc(Br)ccc1 Amb24476579 [0,1,0,0,0,0|3,0,0]=4 1668 B11R1.24 CCSCc1cc(O)ccc1 Amb18126555 [0,1,0,0,0,0|3,0,0]=4 1669 B11R1.24 CC\C=C\c1cccc(Br)c1 Amb25132907 [0,1,0,0,0,0|2,0,1]=4 1670 B11R1.24 CC\C=C\c1cccc(c1)O Amb16231489 [0,1,0,0,0,0|2,0,1]=4 1671 B11R1.24 CC\N=C\c1cccc(O)c1 Amb24662288 [0,1,0,0,0,0|3,0,0]=4 1672 B11R1.24 CNCCc1cccc(I)c1 Amb25187651 [0,1,0,0,0,0|3,0,0]=4 1673 B11R1.24 CNCCc1cccc(N)c1 Amb18550411 [0,1,0,0,0,0|3,0,0]=4 1674 B11R1.24 CNCCc1cccc(O)c1 Amb18560894 [0,1,0,0,0,0|3,0,0]=4 1675 B11R1.24 CNCCc1cccc(c1)Br Amb16230486 [0,1,0,0,0,0|3,0,0]=4 1676 B11R1.24 CNCCc1cccc(c1)C Amb16230487 [0,1,0,0,0,0|3,0,0]=4 1677 B11R1.24 COCCc1cccc(N)c1 Amb24373231 [0,1,0,0,0,0|3,0,0]=4 1678 B11R1.24 COCCc1cccc(O)c1 Amb22055706 [0,1,0,0,0,0|3,0,0]=4 1679 B11R1.24 COCNc1cccc(F)c1 Amb24102182 [0,1,0,0,0,0|3,0,0]=4 1680 B11R1.24 COCOc1cc(Br)c[n]c1 Amb25742269 [0,1,0,0,0,0|3,0,0]=4 1681 B11R1.24 COCOc1cc(Br)ccc1 Amb25810590 [0,1,0,0,0,0|2,0,0]=3 1682 B11R1.24 COCOc1cc(Cl)ccc1 Amb24551706 [0,1,0,0,0,0|2,0,0]=3 1683 B11R1.24 COCOc1cc(F)c[n]c1 Amb24551415 [0,1,0,0,0,0|3,0,0]=4 1684 B11R1.24 COCOc1cc(F)ccc1 Amb21858121 [0,1,0,0,0,0|2,0,0]=3 1685 B11R1.24 COCOc1cc(N)ccc1 Amb25096531 [0,1,0,0,0,0|2,0,0]=3 1686 B11R1.24 COCSc1cccc(Cl)c1 Amb24706398 [0,1,0,0,0,0|2,1,0]=4 1687 B11R1.24 COCSc1cccc(N)c1 Amb24532948 [0,1,0,0,0,0|2,1,0]=4 1688 B11R1.24 CSCCc1cccc(N)c1 Amb25364016 [0,1,0,0,0,0|3,0,0]=4 1689 B11R1.24 CSCOc1cccc(Cl)c1 Amb24516553 [0,1,0,0,0,0|2,0,0]=3 1690 B11R1.24 CSCSc1cc(Cl)ccc1 Amb24631399 [0,1,0,0,0,0|2,1,0]=4 1691 B11R1.24 Cc1[n]c(cc[n]1)NCCO Amb18997333 [0,1,0,0,0,0|3,0,0]=4 1692 B11R1.24 Cc1[n]c(cc[n]1)OCCN Amb18301185 [0,1,0,0,0,0|3,0,0]=4 1693 B11R1.24 Cc1[n]c(cc[n]1)SCCO Amb18183600 [0,1,0,0,0,0|2,1,0]=4 1694 B11R1.24 Cc1c[n]cc(CCCC)c1 Amb24062203 [0,1,0,0,0,0|3,0,0]=4 1695 B11R1.24 Cc1c[n]cc(NCCO)[n]1 Amb24476282 [0,1,0,0,0,0|3,0,0]=4 1696 B11R1.24 Cc1cc(CCCCl)c[n]c1 Amb24538216 [0,1,0,0,0,0|3,0,0]=4 1697 B11R1.24 Cc1cc(CCCN)[n]cc1 Amb18201862 [0,1,0,0,0,0|3,0,0]=4 1698 B11R1.24 Cc1cc(CCCN)[n]cc1 Amb22886487 [0,1,0,0,0,0|3,0,0]=4 1699 B11R1.24 Cc1cc(CCCN)c[n]c1 Amb24509275 [0,1,0,0,0,0|3,0,0]=4 1700 B11R1.24 Cc1cc(CCCN)cc[n]1 Amb18201861 [0,1,0,0,0,0|3,0,0]=4 1701 B11R1.24 Cc1cc(CCON)ccc1 Amb25704227 [0,1,0,0,0,0|3,0,0]=4 1702 B11R1.24 Cc1cc(COCCl)ccc1 Amb24443129 [0,1,0,0,0,0|3,0,0]=4 1703 B11R1.24 Cc1cc(CSCCl)ccc1 Amb25732759 [0,1,0,0,0,0|3,0,0]=4 1704 B11R1.24 Cc1cc(NCCBr)[n]cc1 Amb25798519 [0,1,0,0,0,0|3,0,0]=4 1705 B11R1.24 Cc1cc(NCCCl)[n]cc1 Amb25374118 [0,1,0,0,0,0|3,0,0]=4 1706 B11R1.24 Cc1cc(NCCN)ncc1 Amb10607842 [0,1,0,0,0,0|3,0,0]=4 1707 B11R1.24 Cc1cc(NCCO)[n]cc1 Amb18981411 [0,1,0,0,0,0|2,0,0]=3 1708 B11R1.24 Cc1cc(NCCO)[n]cc1 Amb19374562 [0,1,0,0,0,0|2,0,0]=3 1709 B11R1.24 Cc1cc(NCCS)[n]cc1 Amb25189649 [0,1,0,0,0,0|2,1,0]=4 1710 B11R1.24 Cc1cc([n][n]c1)SCCO Amb24397096 [0,1,0,0,0,0|2,1,0]=4 1711 B11R1.24 Cc1cc([n]c[n]1)OCCN Amb18988884 [0,1,0,0,0,0|3,0,0]=4 1712 B11R1.24 Cc1cc([n]c[n]1)SCCO Amb18177938 [0,1,0,0,0,0|2,1,0]=4 1713 B11R1.24 Cc1cc([n]cc1)OCCN Amb18988887 [0,1,0,0,0,0|2,0,0]=3 1714 B11R1.24 Cc1cc([n]cc1)SCCCl Amb19071517 [0,1,0,0,0,0|2,1,0]=4 1715 B11R1.24 Cc1cc([n]cc1)SCCN Amb18908763 [0,1,0,0,0,0|2,1,0]=4 1716 B11R1.24 Cc1cc([n]cc1)SCCO Amb18801394 [0,1,0,0,0,0|1,1,0]=3 1717 B11R1.24 Cc1cc(\C=C\CBr)ccc1 Amb25068031 [0,1,0,0,0,0|2,0,1]=4 1718 B11R1.24 Cc1cc(\C=C\CN)ccc1 Amb18065182 [0,1,0,0,0,0|2,0,1]=4 1719 B11R1.24 Cc1cc(\C=C\CO)ccc1 Amb23442940 [0,1,0,0,0,0|1,0,1]=3 1720 B11R1.24 Cc1cc(c[n]c1)C#CCO Amb25251691 [0,1,0,0,0,0|2,0,1]=4 1721 B11R1.24 Cc1cc(c[n]c1)NCCN Amb24731510 [0,1,0,0,0,0|3,0,0]=4 1722 B11R1.24 Cc1cc(cc[n]1)NCCF Amb25152258 [0,1,0,0,0,0|3,0,0]=4 1723 B11R1.24 Cc1cc(cc[n]1)NCCN Amb24383516 [0,1,0,0,0,0|3,0,0]=4 1724 B11R1.24 Cc1cc(cc[n]1)SCCO Amb25712261 [0,1,0,0,0,0|1,1,0]=3 1725 B11R1.24 Cc1cc(ccc1)C#CCCl Amb18792611 [0,1,0,0,0,0|2,0,1]=4 1726 B11R1.24 Cc1cc(ccc1)C#CCI Amb25260706 [0,1,0,0,0,0|2,0,1]=4 1727 B11R1.24 Cc1cc(ccc1)C#CCN Amb18949797 [0,1,0,0,0,0|2,0,1]=4 1728 B11R1.24 Cc1cc(ccc1)OCC#C Amb19373318 [0,1,0,0,0,0|1,0,1]=3 1729 B11R1.24 Cc1cc(ccc1)OCC=C Amb25688938 [0,1,0,0,0,0|1,0,1]=3 1730 B11R1.24 Cc1cc(ccc1)OCCF Amb25711593 [0,1,0,0,0,0|1,0,0]=2 1731 B11R1.24 Cc1cc(ccc1)SCC#C Amb18788143 [0,1,0,0,0,0|1,1,1]=4 1732 B11R1.24 Cc1cc(ccc1)SCC#N Amb18788233 [0,1,0,0,0,0|1,1,1]=4 1733 B11R1.24 Cc1cc(ccc1)SCCBr Amb24753608 [0,1,0,0,0,0|1,1,0]=3 1734 B11R1.24 Cc1cc(ccc1)SCCCl Amb18316731 [0,1,0,0,0,0|1,1,0]=3 1735 B11R1.24 Cc1cc(ccc1)SCCF Amb25307210 [0,1,0,0,0,0|1,1,0]=3 1736 B11R1.24 Cc1cc[n]c(CCCC)c1 Amb24065447 [0,1,0,0,0,0|3,0,0]=4 1737 B11R1.24 Cc1cc[n]c(NCCO)[n]1 Amb19000715 [0,1,0,0,0,0|3,0,0]=4 1738 B11R1.24 Cc1cc[n]c([n]1)OCCN Amb19000779 [0,1,0,0,0,0|3,0,0]=4 1739 B11R1.24 Cc1cc[n]c([n]1)OCCO Amb25221475 [0,1,0,0,0,0|2,0,0]=3 1740 B11R1.24 Cc1cc[n]c([n]1)SCCO Amb18185639 [0,1,0,0,0,0|2,1,0]=4 1741 B11R1.24 Cc1cc[n]c(c1)NCCC Amb18293521 [0,1,0,0,0,0|3,0,0]=4 1742 B11R1.24 Cc1cccc(C#CCO)[n]1 Amb25169280 [0,1,0,0,0,0|2,0,1]=4 1743 B11R1.24 Cc1cccc(CCCC)[n]1 Amb24065450 [0,1,0,0,0,0|3,0,0]=4 1744 B11R1.24 Cc1cccc(CCCC)c1 Amb22730119 [0,1,0,0,0,0|2,0,0]=3 1745 B11R1.24 Cc1cccc(CSCC)c1 Amb25838308 [0,1,0,0,0,0|3,0,0]=4 1746 B11R1.24 Cc1cccc(NCCCl)[n]1 Amb25846545 [0,1,0,0,0,0|3,0,0]=4 1747 B11R1.24 Cc1cccc(NCCF)[n]1 Amb25274531 [0,1,0,0,0,0|3,0,0]=4 1748 B11R1.24 Cc1cccc(NCCN)[n]1 Amb18970380 [0,1,0,0,0,0|3,0,0]=4 1749 B11R1.24 Cc1cccc(NCCN)[n]1 Amb19440303 [0,1,0,0,0,0|3,0,0]=4 1750 B11R1.24 Cc1cccc(NCCO)[n]1 Amb18290373 [0,1,0,0,0,0|2,0,0]=3 1751 B11R1.24 Cc1cccc(NCCS)[n]1 Amb25065548 [0,1,0,0,0,0|2,1,0]=4 1752 B11R1.24 Cc1cccc([n]1)OCC=C Amb25752190 [0,1,0,0,0,0|2,0,1]=4 1753 B11R1.24 Cc1cccc([n]1)OCCC Amb25097663 [0,1,0,0,0,0|2,0,0]=3 1754 B11R1.24 Cc1cccc([n]1)OCCN Amb18296490 [0,1,0,0,0,0|2,0,0]=3 1755 B11R1.24 Cc1cccc([n]1)OCCO Amb22900069 [0,1,0,0,0,0|1,0,0]=2 1756 B11R1.24 Cc1cccc([n]1)SCCCl Amb19059627 [0,1,0,0,0,0|2,1,0]=4 1757 B11R1.24 Cc1cccc([n]1)SCCN Amb18908762 [0,1,0,0,0,0|2,1,0]=4 1758 B11R1.24 Cc1cccc([n]1)SCCO Amb18180212 [0,1,0,0,0,0|1,1,0]=3 1759 B11R1.24 Cc1cccc(c1)SCOC Amb25235859 [0,1,0,0,0,0|2,1,0]=4 1760 B11R1.24 ClCC#Cc1cc(Br)ccc1 Amb25132294 [0,1,0,0,0,0|2,0,1]=4 1761 B11R1.24 ClCC#Cc1cc(I)ccc1 Amb25282204 [0,1,0,0,0,0|2,0,1]=4 1762 B11R1.24 ClCCCc1cccc(I)c1 Amb25239109 [0,1,0,0,0,0|2,0,0]=3 1763 B11R1.24 ClCCCc1cccc(c1)Br Amb17104548 [0,1,0,0,0,0|2,0,0]=3 1764 B11R1.24 ClCCCc1cccc(c1)C Amb17104526 [0,1,0,0,0,0|2,0,0]=3 1765 B11R1.24 ClCCCc1cccc(c1)Cl Amb17104534 [0,1,0,0,0,0|2,0,0]=3 1766 B11R1.24 ClCCCc1cccc(c1)N Amb17477709 [0,1,0,0,0,0|2,0,0]=3 1767 B11R1.24 ClCCCc1cccc(c1)O Amb17477723 [0,1,0,0,0,0|2,0,0]=3 1768 B11R1.24 ClCCNc1cccc(c1)Br Amb17346197 [0,1,0,0,0,0|2,0,0]=3 1769 B11R1.24 ClCCNc1cccc(c1)C Amb17334786 [0,1,0,0,0,0|2,0,0]=3 1770 B11R1.24 ClCCNc1cccc(c1)Cl Amb17336181 [0,1,0,0,0,0|2,0,0]=3 1771 B11R1.24 ClCCNc1cccc(c1)F Amb17334966 [0,1,0,0,0,0|2,0,0]=3 1772 B11R1.24 ClCCOc1cccc(c1)N Amb10608112 [0,1,0,0,0,0|1,0,0]=2 1773 B11R1.24 ClC\C=C\c1cccc(Br)c1 Amb25149089 [0,1,0,0,0,0|2,0,1]=4 1774 B11R1.24 Clc1cc(\C=C\CBr)ccc1 Amb25117084 [0,1,0,0,0,0|2,0,1]=4 1775 B11R1.24 Clc1cc(ccc1)C#CCBr Amb24437476 [0,1,0,0,0,0|2,0,1]=4 1776 B11R1.24 Clc1cc(ccc1)C#CCCl Amb19067004 [0,1,0,0,0,0|2,0,1]=4 1777 B11R1.24 Clc1cc(ccc1)OCCI Amb25334122 [0,1,0,0,0,0|1,0,0]=2 1778 B11R1.24 Clc1cccc(c1)SCCCl Amb25857042 [0,1,0,0,0,0|1,1,0]=3 1779 B11R1.24 Clc1cccc(c1)\C=C\CCl Amb25858073 [0,1,0,0,0,0|2,0,1]=4 1780 B11R1.24 FCC#Cc1cc(I)ccc1 Amb25342342 [0,1,0,0,0,0|2,0,1]=4 1781 B11R1.24 FCCNc1cc(Br)cc[n]1 Amb25852545 [0,1,0,0,0,0|3,0,0]=4 1782 B11R1.24 FCCNc1cc(Br)ccc1 Amb25307539 [0,1,0,0,0,0|2,0,0]=3 1783 B11R1.24 FCCNc1cc(Cl)ccc1 Amb24427077 [0,1,0,0,0,0|2,0,0]=3 1784 B11R1.24 FCCOc1c[n][n]c(Cl)c1 Amb22276569 [0,1,0,0,0,0|3,0,0]=4 1785 B11R1.24 FCCOc1c[n]cc(Cl)[n]1 Amb25363509 [0,1,0,0,0,0|3,0,0]=4 1786 B11R1.24 FCCOc1cc(Br)cc[n]1 Amb24458653 [0,1,0,0,0,0|2,0,0]=3 1787 B11R1.24 FCCOc1cc(Br)ccc1 Amb22227889 [0,1,0,0,0,0|1,0,0]=2 1788 B11R1.24 FCCOc1cc(Cl)ccc1 Amb24659046 [0,1,0,0,0,0|1,0,0]=2 1789 B11R1.24 FCCOc1cc[n]c(Cl)[n]1 Amb25363520 [0,1,0,0,0,0|3,0,0]=4 1790 B11R1.24 FCCSc1cc(Cl)ccc1 Amb25266256 [0,1,0,0,0,0|1,1,0]=3 1791 B11R1.24 Fc1cc(CCCBr)ccc1 Amb22886712 [0,1,0,0,0,0|2,0,0]=3 1792 B11R1.24 Fc1cc(CCCCl)c[n]c1 Amb24486007 [0,1,0,0,0,0|3,0,0]=4 1793 B11R1.24 Fc1cc(CCCCl)ccc1 Amb18803316 [0,1,0,0,0,0|2,0,0]=3 1794 B11R1.24 Fc1cc(CCCS)ccc1 Amb18065480 [0,1,0,0,0,0|1,1,0]=3 1795 B11R1.24 Fc1cc(CC[Zn]Br)ccc1 Amb22000496 [0,1,0,0,0,0|3,0,0]=4 1796 B11R1.24 Fc1cc(\C=C\CCl)ccc1 Amb25103585 [0,1,0,0,0,0|2,0,1]=4 1797 B11R1.24 Fc1cc(c[n]c1)OCCBr Amb25088521 [0,1,0,0,0,0|2,0,0]=3 1798 B11R1.24 Fc1cc(c[n]c1)OCCCl Amb24425626 [0,1,0,0,0,0|2,0,0]=3 1799 B11R1.24 Fc1cc(c[n]c1)OCCS Amb24651743 [0,1,0,0,0,0|1,1,0]=3 1800 B11R1.24 Fc1cc(ccc1)C#CCCl Amb18180185 [0,1,0,0,0,0|2,0,1]=4 1801 B11R1.24 Fc1cc(ccc1)C#CCI Amb25797661 [0,1,0,0,0,0|2,0,1]=4 1802 B11R1.24 Fc1cc(ccc1)NCCBr Amb25311264 [0,1,0,0,0,0|2,0,0]=3 1803 B11R1.24 Fc1cc(ccc1)SCCCl Amb25779976 [0,1,0,0,0,0|1,1,0]=3 1804 B11R1.24 Fc1cccc(NCCF)[n]1 Amb24501811 [0,1,0,0,0,0|3,0,0]=4 1805 B11R1.24 Fc1cccc(c1)OCCF Amb22232794 [0,1,0,0,0,0|1,0,0]=2 1806 B11R1.24 Ic1cc(ccc1)C#CCI Amb24729732 [0,1,0,0,0,0|2,0,1]=4 1807 B11R1.24 N#CCCc1cccc(I)c1 Amb25312666 [0,1,0,0,0,0|2,0,1]=4 1808 B11R1.24 N#CCCc1cccc(c1)C Amb17204296 [0,1,0,0,0,0|2,0,1]=4 1809 B11R1.24 N#CCCc1cccc(c1)Cl Amb17204310 [0,1,0,0,0,0|2,0,1]=4 1810 B11R1.24 N#CCCc1cccc(c1)F Amb10841716 [0,1,0,0,0,0|2,0,1]=4 1811 B11R1.24 N#CCOc1c[n]cc(F)c1 Amb25823177 [0,1,0,0,0,0|2,0,1]=4 1812 B11R1.24 N#CCOc1cccc(Br)[n]1 Amb22236337 [0,1,0,0,0,0|2,0,1]=4 1813 B11R1.24 N#CCSc1cccc(Br)c1 Amb20642031 [0,1,0,0,0,0|1,1,1]=4 1814 B11R1.24 N#CCSc1cccc(Cl)c1 Amb18324763 [0,1,0,0,0,0|1,1,1]=4 1815 B11R1.24 N#CCSc1cccc(O)c1 Amb25748990 [0,1,0,0,0,0|1,1,1]=4 1816 B11R1.24 NCC#Cc1cc(Cl)ccc1 Amb18957240 [0,1,0,0,0,0|2,0,1]=4 1817 B11R1.24 NCC#Cc1cc(F)ccc1 Amb18949810 [0,1,0,0,0,0|2,0,1]=4 1818 B11R1.24 NCC#Cc1cc(O)ccc1 Amb25084990 [0,1,0,0,0,0|2,0,1]=4 1819 B11R1.24 NCCCc1c[n]cc(Br)c1 Amb25277365 [0,1,0,0,0,0|3,0,0]=4 1820 B11R1.24 NCCCc1c[n]cc(Cl)c1 Amb25793558 [0,1,0,0,0,0|3,0,0]=4 1821 B11R1.24 NCCCc1c[n]cc(F)c1 Amb25204369 [0,1,0,0,0,0|3,0,0]=4 1822 B11R1.24 NCCCc1cc(Cl)cc[n]1 Amb24432795 [0,1,0,0,0,0|3,0,0]=4 1823 B11R1.24 NCCCc1cc[n]c(Br)c1 Amb25686087 [0,1,0,0,0,0|3,0,0]=4 1824 B11R1.24 NCCCc1cc[n]c(Cl)c1 Amb25340473 [0,1,0,0,0,0|3,0,0]=4 1825 B11R1.24 NCCCc1cccc(Br)[n]1 Amb25055843 [0,1,0,0,0,0|3,0,0]=4 1826 B11R1.24 NCCCc1cccc(Br)c1 Amb19373503 [0,1,0,0,0,0|2,0,0]=3 1827 B11R1.24 NCCCc1cccc(c1)Cl Amb13951536 [0,1,0,0,0,0|2,0,0]=3 1828 B11R1.24 NCCCc1cccc(c1)F Amb13949159 [0,1,0,0,0,0|2,0,0]=3 1829 B11R1.24 NCCCc1cccc(c1)N Amb17477694 [0,1,0,0,0,0|2,0,0]=3 1830 B11R1.24 NCCCc1cccc(c1)O Amb17101314 [0,1,0,0,0,0|2,0,0]=3 1831 B11R1.24 NCCNc1cc(Br)c[n]c1 Amb24440030 [0,1,0,0,0,0|3,0,0]=4 1832 B11R1.24 NCCNc1cc(F)c[n]c1 Amb18999334 [0,1,0,0,0,0|3,0,0]=4 1833 B11R1.24 NCCNc1cccc(F)[n]1 Amb24072626 [0,1,0,0,0,0|3,0,0]=4 1834 B11R1.24 NCCNc1cccc(c1)Br Amb17091074 [0,1,0,0,0,0|2,0,0]=3 1835 B11R1.24 NCCNc1cccc(c1)C Amb17057745 [0,1,0,0,0,0|2,0,0]=3 1836 B11R1.24 NCCNc1cccc(c1)Cl Amb17057750 [0,1,0,0,0,0|2,0,0]=3 1837 B11R1.24 NCCNc1cccc(c1)F Amb17057748 [0,1,0,0,0,0|2,0,0]=3 1838 B11R1.24 NCCOC1=CC(=O)NC=N1 Amb24509683 [0,1,0,0,0,0|3,0,0]=4 1839 B11R1.24 NCCOC=1C=NNC(=O)C1 Amb25214159 [0,1,0,0,0,0|3,0,0]=4 1840 B11R1.24 NCCOc1c[n]cc(Br)c1 Amb22275981 [0,1,0,0,0,0|2,0,0]=3 1841 B11R1.24 NCCOc1c[n]cc(Br)c1 Amb22275982 [0,1,0,0,0,0|2,0,0]=3 1842 B11R1.24 NCCOc1cc(Br)cc[n]1 Amb24334875 [0,1,0,0,0,0|2,0,0]=3 1843 B11R1.24 NCCOc1cc(Cl)cc[n]1 Amb22236327 [0,1,0,0,0,0|2,0,0]=3 1844 B11R1.24 NCCOc1cc(O)ccc1 Amb24085157 [0,1,0,0,0,0|1,0,0]=2 1845 B11R1.24 NCCOc1cccc(c1)Br Amb10609758 [0,1,0,0,0,0|1,0,0]=2 1846 B11R1.24 NCCOc1cccc(c1)Br Amb1111484 [0,1,0,0,0,0|1,0,0]=2 1847 B11R1.24 NCCOc1cccc(c1)C Amb1098983 [0,1,0,0,0,0|1,0,0]=2 1848 B11R1.24 NCCOc1cccc(c1)Cl Amb1098576 [0,1,0,0,0,0|1,0,0]=2 1849 B11R1.24 NCCOc1cccc(c1)F Amb1126100 [0,1,0,0,0,0|1,0,0]=2 1850 B11R1.24 NCCSc1cc(Br)ccc1 Amb18998111 [0,1,0,0,0,0|1,1,0]=3 1851 B11R1.24 NCCSc1cc(Cl)[n]cc1 Amb24533119 [0,1,0,0,0,0|2,1,0]=4 1852 B11R1.24 NCCSc1cc(F)ccc1 Amb21861531 [0,1,0,0,0,0|1,1,0]=3 1853 B11R1.24 NCCSc1cccc(c1)C Amb17083043 [0,1,0,0,0,0|1,1,0]=3 1854 B11R1.24 NCCSc1cccc(c1)Cl Amb17083052 [0,1,0,0,0,0|1,1,0]=3 1855 B11R1.24 NC\C=C\c1cccc(Br)c1 Amb18066633 [0,1,0,0,0,0|2,0,1]=4 1856 B11R1.24 NC\C=C\c1cccc(Cl)c1 Amb18065474 [0,1,0,0,0,0|2,0,1]=4 1857 B11R1.24 NC\C=C\c1cccc(F)c1 Amb18065349 [0,1,0,0,0,0|2,0,1]=4 1858 B11R1.24 NNCCc1cccc(Cl)c1 Amb24064170 [0,1,0,0,0,0|3,0,0]=4 1859 B11R1.24 NNCCc1cccc(c1)Br Amb17404394 [0,1,0,0,0,0|3,0,0]=4 1860 B11R1.24 NNCCc1cccc(c1)C Amb17399915 [0,1,0,0,0,0|3,0,0]=4 1861 B11R1.24 NNCCc1cccc(c1)Cl Amb17400340 [0,1,0,0,0,0|3,0,0]=4 1862 B11R1.24 NOCCc1cccc(Cl)c1 Amb25152729 [0,1,0,0,0,0|3,0,0]=4 1863 B11R1.24 NOCCc1cccc(F)c1 Amb22896630 [0,1,0,0,0,0|3,0,0]=4 1864 B11R1.24 Nc1[n]c(cc[n]1)NCCO Amb25780024 [0,1,0,0,0,0|3,0,0]=4 1865 B11R1.24 Nc1[n]c(cc[n]1)OCCO Amb24101939 [0,1,0,0,0,0|2,0,0]=3 1866 B11R1.24 Nc1[n]c(cc[n]1)SCCO Amb25304642 [0,1,0,0,0,0|2,1,0]=4 1867 B11R1.24 Nc1c[n]cc(NCCO)[n]1 Amb25060539 [0,1,0,0,0,0|3,0,0]=4 1868 B11R1.24 Nc1c[n]cc([n]1)SCCO Amb25360755 [0,1,0,0,0,0|2,1,0]=4 1869 B11R1.24 Nc1cc(CCC=O)ccc1 Amb24486988 [0,1,0,0,0,0|1,0,2]=4 1870 B11R1.24 Nc1cc(NCCF)[n]cc1 Amb24501789 [0,1,0,0,0,0|3,0,0]=4 1871 B11R1.24 Nc1cc(NCCO)[n]cc1 Amb18981464 [0,1,0,0,0,0|2,0,0]=3 1872 B11R1.24 Nc1cc([n]c[n]1)OCCO Amb24106711 [0,1,0,0,0,0|2,0,0]=3 1873 B11R1.24 Nc1cc([n]cc1)OCCO Amb18293320 [0,1,0,0,0,0|1,0,0]=2 1874 B11R1.24 Nc1cc([n]cc1)SCCO Amb18293590 [0,1,0,0,0,0|1,1,0]=3 1875 B11R1.24 Nc1cc(\C=C\CO)ccc1 Amb24462850 [0,1,0,0,0,0|1,0,1]=3 1876 B11R1.24 Nc1cc(c[n]c1)NCCO Amb24347580 [0,1,0,0,0,0|2,0,0]=3 1877 B11R1.24 Nc1cc(cc[n]1)SCCO Amb24543690 [0,1,0,0,0,0|1,1,0]=3 1878 B11R1.24 Nc1cc(ccc1)C#CCCl Amb25229635 [0,1,0,0,0,0|2,0,1]=4 1879 B11R1.24 Nc1cc(ccc1)C#CCI Amb25213585 [0,1,0,0,0,0|2,0,1]=4 1880 B11R1.24 Nc1cc(ccc1)C#CCO Amb22228962 [0,1,0,0,0,0|1,0,1]=3 1881 B11R1.24 Nc1cc(ccc1)OCCCl Amb22587140 [0,1,0,0,0,0|1,0,0]=2 1882 B11R1.24 Nc1cc(ccc1)OCCF Amb20669100 [0,1,0,0,0,0|1,0,0]=2 1883 B11R1.24 Nc1cc(ccc1)SCCO Amb18289366 [0,1,0,0,0,0|0,1,0]=2 1884 B11R1.24 Nc1cc[n]c(c1)NCCN Amb18298681 [0,1,0,0,0,0|3,0,0]=4 1885 B11R1.24 Nc1cccc(CCCN)[n]1 Amb24411537 [0,1,0,0,0,0|3,0,0]=4 1886 B11R1.24 Nc1cccc(NCCCl)[n]1 Amb25060780 [0,1,0,0,0,0|3,0,0]=4 1887 B11R1.24 Nc1cccc(NCCO)[n]1 Amb25771408 [0,1,0,0,0,0|2,0,0]=3 1888 B11R1.24 Nc1cccc([n]1)SCCO Amb24626988 [0,1,0,0,0,0|1,1,0]=3 1889 B11R1.24 Nc1cccc(c1)NCCN Amb18991498 [0,1,0,0,0,0|2,0,0]=3 1890 B11R1.24 Nc1cccc(c1)OCCN Amb18251365 [0,1,0,0,0,0|1,0,0]=2 1891 B11R1.24 Nc1cccc(c1)SCCN Amb25149157 [0,1,0,0,0,0|1,1,0]=3 1892 B11R1.24 O=C1C=C(C=NN1)OCCF Amb22276584 [0,1,0,0,0,0|3,0,0]=4 1893 B11R1.24 O=C1C=CC=C(CCCBr)N1 Amb25679555 [0,1,0,0,0,0|3,0,0]=4 1894 B11R1.24 O=C1C=CC=C(CCCCl)O1 Amb25279515 [0,1,0,0,0,0|3,0,0]=4 1895 B11R1.24 O=CCCc1cccc(I)c1 Amb24637998 [0,1,0,0,0,0|1,0,2]=4 1896 B11R1.24 O=CCCc1cccc(S)c1 Amb24615973 [0,1,0,0,0,0|1,0,2]=4 1897 B11R1.24 O=CCCc1cccc(c1)Br Amb17081695 [0,1,0,0,0,0|1,0,2]=4 1898 B11R1.24 O=CCCc1cccc(c1)O Amb17081694 [0,1,0,0,0,0|1,0,2]=4 1899 B11R1.24 O=CCOc1cccc(Cl)c1 Amb18806821 [0,1,0,0,0,0|0,0,2]=3 1900 B11R1.24 O=CCOc1cccc(F)c1 Amb18182893 [0,1,0,0,0,0|0,0,2]=3 1901 B11R1.24 O=CCOc1cccc(c1)Br Amb17099951 [0,1,0,0,0,0|0,0,2]=3 1902 B11R1.24 O=CCSc1cccc(c1)C Amb17082932 [0,1,0,0,0,0|0,1,2]=4 1903 B11R1.24 O=CCSc1cccc(c1)Cl Amb17082942 [0,1,0,0,0,0|0,1,2]=4 1904 B11R1.24 OCC#Cc1c[n]cc(F)c1 Amb18179385 [0,1,0,0,0,0|2,0,1]=4 1905 B11R1.24 OCC#Cc1cc(I)ccc1 Amb25742450 [0,1,0,0,0,0|1,0,1]=3 1906 B11R1.24 OCCCc1cc[n]c(Br)c1 Amb24763525 [0,1,0,0,0,0|2,0,0]=3 1907 B11R1.24 OCCCc1cccc(F)[n]1 Amb24546387 [0,1,0,0,0,0|2,0,0]=3 1908 B11R1.24 OCCCc1cccc(I)c1 Amb25075756 [0,1,0,0,0,0|1,0,0]=2 1909 B11R1.24 OCCCc1cccc(c1)Br Amb17089515 [0,1,0,0,0,0|1,0,0]=2 1910 B11R1.24 OCCCc1cccc(c1)C Amb17089495 [0,1,0,0,0,0|1,0,0]=2 1911 B11R1.24 OCCCc1cccc(c1)Cl Amb17089500 [0,1,0,0,0,0|1,0,0]=2 1912 B11R1.24 OCCCc1cccc(c1)F Amb17605781 [0,1,0,0,0,0|1,0,0]=2 1913 B11R1.24 OCCCc1cccc(c1)N Amb17477701 [0,1,0,0,0,0|1,0,0]=2 1914 B11R1.24 OCCCc1cccc(c1)O Amb17089514 [0,1,0,0,0,0|1,0,0]=2 1915 B11R1.24 OCCNC=1C=CNC(=S)N1 Amb25375753 [0,1,0,0,0,0|3,0,0]=4 1916 B11R1.24 OCCNC=1C=NNC(=O)C1 Amb25048056 [0,1,0,0,0,0|3,0,0]=4 1917 B11R1.24 OCCNc1[n]c(Cl)cc[n]1 Amb25275738 [0,1,0,0,0,0|3,0,0]=4 1918 B11R1.24 OCCNc1c[n]cc(Cl)[n]1 Amb18292859 [0,1,0,0,0,0|3,0,0]=4 1919 B11R1.24 OCCNc1cc(Br)c[n]c1 Amb23744553 [0,1,0,0,0,0|2,0,0]=3 1920 B11R1.24 OCCNc1cc(Br)cc[n]1 Amb24429841 [0,1,0,0,0,0|2,0,0]=3 1921 B11R1.24 OCCNc1cc(Cl)cc[n]1 Amb25191172 [0,1,0,0,0,0|2,0,0]=3 1922 B11R1.24 OCCNc1cc(F)[n]c[n]1 Amb25799261 [0,1,0,0,0,0|3,0,0]=4 1923 B11R1.24 OCCNc1cccc(Cl)[n]1 Amb21958722 [0,1,0,0,0,0|2,0,0]=3 1924 B11R1.24 OCCNc1cccc(F)[n]1 Amb18973531 [0,1,0,0,0,0|2,0,0]=3 1925 B11R1.24 OCCOC1=CC=NC(=O)N1 Amb25270319 [0,1,0,0,0,0|2,0,0]=3 1926 B11R1.24 OCCOC=1CCCC(=O)C1 Amb25028191 [0,1,0,0,0,0|0,0,3]=4 1927 B11R1.24 OCCOc1[n]c(Cl)cc[n]1 Amb25195613 [0,1,0,0,0,0|2,0,0]=3 1928 B11R1.24 OCCOc1c[n]cc(Cl)c1 Amb25151315 [0,1,0,0,0,0|1,0,0]=2 1929 B11R1.24 OCCOc1c[n]cc(F)c1 Amb25274170 [0,1,0,0,0,0|1,0,0]=2 1930 B11R1.24 OCCOc1cc(Br)[n]c[n]1 Amb25362958 [0,1,0,0,0,0|2,0,0]=3 1931 B11R1.24 OCCOc1cc(Cl)[n]c[n]1 Amb18178158 [0,1,0,0,0,0|2,0,0]=3 1932 B11R1.24 OCCOc1cc(Cl)[n]cc1 Amb22059320 [0,1,0,0,0,0|1,0,0]=2 1933 B11R1.24 OCCOc1cc(F)[n]cc1 Amb24487065 [0,1,0,0,0,0|1,0,0]=2 1934 B11R1.24 OCCOc1cc[n]c(Cl)[n]1 Amb18804288 [0,1,0,0,0,0|2,0,0]=3 1935 B11R1.24 OCCOc1cccc(F)[n]1 Amb18787672 [0,1,0,0,0,0|1,0,0]=2 1936 B11R1.24 OCCOc1cccc(c1)C Amb2209346 [0,1,0,0,0,0|0,0,0]=1 1937 B11R1.24 OCCSc1c[n]cc(Br)c1 Amb24582105 [0,1,0,0,0,0|1,1,0]=3 1938 B11R1.24 OCCSc1cc(Br)ccc1 Amb21861665 [0,1,0,0,0,0|0,1,0]=2 1939 B11R1.24 OCCSc1cc(Cl)[n]c[n]1 Amb18330226 [0,1,0,0,0,0|2,1,0]=4 1940 B11R1.24 OCCSc1cc(F)[n]c[n]1 Amb24356835 [0,1,0,0,0,0|2,1,0]=4 1941 B11R1.24 OCCSc1cc[n]c(Cl)[n]1 Amb18330225 [0,1,0,0,0,0|2,1,0]=4 1942 B11R1.24 OCCSc1cccc(Br)[n]1 Amb24458936 [0,1,0,0,0,0|1,1,0]=3 1943 B11R1.24 OCCSc1cccc(Cl)[n]1 Amb24477644 [0,1,0,0,0,0|1,1,0]=3 1944 B11R1.24 OCCSc1cccc(F)[n]1 Amb18789953 [0,1,0,0,0,0|1,1,0]=3 1945 B11R1.24 OC\C=C\c1c[n]cc(Br)c1 Amb25065053 [0,1,0,0,0,0|2,0,1]=4 1946 B11R1.24 OC\C=C\c1cccc(Br)[n]1 Amb20248560 [0,1,0,0,0,0|2,0,1]=4 1947 B11R1.24 OC\C=C\c1cccc(Br)c1 Amb19516160 [0,1,0,0,0,0|1,0,1]=3 1948 B11R1.24 OC\C=C\c1cccc(Cl)c1 Amb23442783 [0,1,0,0,0,0|1,0,1]=3 1949 B11R1.24 OC\C=C\c1cccc(F)c1 Amb23442888 [0,1,0,0,0,0|1,0,1]=3 1950 B11R1.24 Oc1cc(CCCBr)ccc1 Amb18657769 [0,1,0,0,0,0|2,0,0]=3 1951 B11R1.24 Oc1cc(ccc1)C#CCBr Amb24471318 [0,1,0,0,0,0|2,0,1]=4 1952 B11R1.24 Oc1cc(ccc1)C#CCF Amb24427468 [0,1,0,0,0,0|2,0,1]=4 1953 B11R1.24 Oc1cc(ccc1)C#CCI Amb25793030 [0,1,0,0,0,0|2,0,1]=4 1954 B11R1.24 Oc1cc(ccc1)C#CCO Amb24085233 [0,1,0,0,0,0|1,0,1]=3 1955 B11R1.24 Oc1cc(ccc1)OCCF Amb24484451 [0,1,0,0,0,0|1,0,0]=2 1956 B11R1.24 Oc1cc(ccc1)SCCF Amb24486779 [0,1,0,0,0,0|1,1,0]=3 1957 B11R1.24 Oc1cccc(c1)\C=C\CO Amb18125120 [0,1,0,0,0,0|1,0,1]=3 1958 B11R1.24 SCCCc1cccc(c1)Br Amb17407561 [0,1,0,0,0,0|1,1,0]=3 1959 B11R1.24 SCCCc1cccc(c1)C Amb17400219 [0,1,0,0,0,0|1,1,0]=3 1960 B11R1.24 SCCCc1cccc(c1)Cl Amb17401096 [0,1,0,0,0,0|1,1,0]=3 1961 B11R1.24 SCCOc1cc(I)ccc1 Amb25189185 [0,1,0,0,0,0|0,1,0]=2 1962 B11R1.24 SCCOc1cccc(c1)C Amb17232680 [0,1,0,0,0,0|0,1,0]=2 1963 B11R1.24 SCCOc1cccc(c1)F Amb17232867 [0,1,0,0,0,0|0,1,0]=2 1964 B11R1.24 SCCOc1cccc(c1)N Amb17504035 [0,1,0,0,0,0|0,1,0]=2 1965 B11R1.24 SCCSc1cc(Br)ccc1 Amb25058330 [0,1,0,0,0,0|0,2,0]=3 1966 B11R1.24 [NH3+]c1cc(ccc1)OCCF Amb22455032 [0,1,0,0,0,0|1,0,0]=2 1967 B11R1.28 BrCC=C=Cc1ccccc1 Amb24624052 [0,1,0,0,0,0|2,0,1]=4 1968 B11R1.28 BrCCCCc1cc[n]cc1 Amb24102841 [0,1,0,0,0,0|3,0,0]=4 1969 B11R1.28 BrCCCOc1c[n]ccc1 Amb22900113 [0,1,0,0,0,0|2,0,0]=3 1970 B11R1.28 BrCCCOc1ccccc1 Amb1154134 [0,1,0,0,0,0|1,0,0]=2 1971 B11R1.28 BrCCNCc1ccccc1 Amb18131678 [0,1,0,0,0,0|2,0,0]=3 1972 B11R1.28 BrCC\C=C\c1ccccc1 Amb17140564 [0,1,0,0,0,0|2,0,0]=3 1973 B11R1.28 BrCC\N=C\c1ccccc1 Amb25076253 [0,1,0,0,0,0|2,0,0]=3 1974 B11R1.28 BrC\C=C\Cc1ccccc1 Amb25039914 [0,1,0,0,0,0|2,0,1]=4 1975 B11R1.28 Br[Zn]CCCc1ccccc1 Amb22000503 [0,1,0,0,0,0|2,0,0]=3 1976 B11R1.28 Br\C=C/CNc1ccccc1 Amb25063133 [0,1,0,0,0,0|2,0,1]=4 1977 B11R1.28 C#CCC#Cc1ccccc1 Amb16233222 [0,1,0,0,0,0|2,0,1]=4 1978 B11R1.28 C#CCCCc1ccccc1 Amb10071067 [0,1,0,0,0,0|2,0,0]=3 1979 B11R1.28 C#CCCNc1cccc[n]1 Amb25189260 [0,1,0,0,0,0|3,0,0]=4 1980 B11R1.28 C#CCCNc1ccccc1 Amb25063678 [0,1,0,0,0,0|2,0,0]=3 1981 B11R1.28 C#CCCOc1[n]ccc[n]1 Amb24100514 [0,1,0,0,0,0|3,0,0]=4 1982 B11R1.28 C#CCCOc1c[n]ccc1 Amb25151770 [0,1,0,0,0,0|2,0,0]=3 1983 B11R1.28 C#CCCSc1cccc[n]1 Amb25783289 [0,1,0,0,0,0|2,1,0]=4 1984 B11R1.28 C#CCCSc1ccccc1 Amb24477610 [0,1,0,0,0,0|1,1,0]=3 1985 B11R1.28 C#CCNCc1ccccc1 Amb21972217 [0,1,0,0,0,0|2,0,1]=4 1986 B11R1.28 C#CCOCc1cccc[n]1 Amb24101369 [0,1,0,0,0,0|2,0,1]=4 1987 B11R1.28 C#CCONc1cc[n]cc1 Amb25680343 [0,1,0,0,0,0|2,0,1]=4 1988 B11R1.28 C#CCONc1cccc[n]1 Amb24370983 [0,1,0,0,0,0|2,0,1]=4 1989 B11R1.28 C#CCSCc1ccccc1 Amb18800670 [0,1,0,0,0,0|1,1,1]=4 1990 B11R1.28 C#CC\N=C\c1ccccc1 Amb17609064 [0,1,0,0,0,0|2,0,1]=4 1991 B11R1.28 C/C=C/CCc1ccccc1 Amb17940149 [0,1,0,0,0,0|2,0,1]=4 1992 B11R1.28 C=CCC#Cc1ccccc1 Amb10571530 [0,1,0,0,0,0|2,0,1]=4 1993 B11R1.28 C=CCCCc1ccccc1 Amb24062985 [0,1,0,0,0,0|2,0,0]=3 1994 B11R1.28 C=CCCNc1cc[n]cc1 Amb25853434 [0,1,0,0,0,0|3,0,0]=4 1995 B11R1.28 C=CCCOc1[n]ccc[n]1 Amb24100507 [0,1,0,0,0,0|3,0,0]=4 1996 B11R1.28 C=CCCOc1c[n]ccc1 Amb24085225 [0,1,0,0,0,0|2,0,0]=3 1997 B11R1.28 C=CCCOc1cc[n]cc1 Amb24750926 [0,1,0,0,0,0|2,0,0]=3 1998 B11R1.28 C=CCOCc1cc[n]cc1 Amb24103231 [0,1,0,0,0,0|2,0,1]=4 1999 B11R1.28 C=CCOCc1cccc[n]1 Amb24106728 [0,1,0,0,0,0|2,0,1]=4 2000 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [0,1,0,0,0,0|1,0,1]=3 2001 B11R1.28 C=CCSCc1ccccc1 Amb17799426 [0,1,0,0,0,0|1,1,1]=4 2002 B11R1.28 C=CC\C=N\c1ccccc1 Amb10574759 [0,1,0,0,0,0|2,0,1]=4 2003 B11R1.28 C=CC\N=C/c1ccccc1 Amb24108502 [0,1,0,0,0,0|2,0,1]=4 2004 B11R1.28 C=NCCNc1ccccc1 Amb24486057 [0,1,0,0,0,0|2,0,0]=3 2005 B11R1.28 CC#CCNc1ccccc1 Amb21953777 [0,1,0,0,0,0|2,0,1]=4 2006 B11R1.28 CC#CCOc1ccccc1 Amb25119404 [0,1,0,0,0,0|1,0,1]=3 2007 B11R1.28 CC=CCCc1ccccc1 Amb24062987 [0,1,0,0,0,0|2,0,1]=4 2008 B11R1.28 CCCC#Cc1cccc[n]1 Amb24070018 [0,1,0,0,0,0|3,0,0]=4 2009 B11R1.28 CCCC=Cc1cc[n]cc1 Amb24073920 [0,1,0,0,0,0|3,0,0]=4 2010 B11R1.28 CCCCC[n+]1ccccc1 Amb24754723 [0,1,0,0,0,0|3,0,0]=4 2011 B11R1.28 CCCCCc1cccnc1 Amb17672949 [0,1,0,0,0,0|3,0,0]=4 2012 B11R1.28 CCCCCc1ccncc1 Amb17672950 [0,1,0,0,0,0|3,0,0]=4 2013 B11R1.28 CCCCOc1c[n]ccc1 Amb25382997 [0,1,0,0,0,0|2,0,0]=3 2014 B11R1.28 CCCCOc1cc[n]cc1 Amb25383158 [0,1,0,0,0,0|2,0,0]=3 2015 B11R1.28 CCCCSc1cccc[n]1 Amb25383894 [0,1,0,0,0,0|2,1,0]=4 2016 B11R1.28 CCCNCc1c[n]ccc1 Amb19890575 [0,1,0,0,0,0|3,0,0]=4 2017 B11R1.28 CCCNCc1cc[n]cc1 Amb19890591 [0,1,0,0,0,0|3,0,0]=4 2018 B11R1.28 CCCNCc1cccc[n]1 Amb19890306 [0,1,0,0,0,0|3,0,0]=4 2019 B11R1.28 CCCNCc1cccc[n]1 Amb19890563 [0,1,0,0,0,0|3,0,0]=4 2020 B11R1.28 CCCNCc1ccccc1 Amb1105937 [0,1,0,0,0,0|2,0,0]=3 2021 B11R1.28 CCCSSc1ccccc1 Amb25383743 [0,1,0,0,0,0|1,1,0]=3 2022 B11R1.28 CCC\C=C/c1cccc[n]1 Amb24101905 [0,1,0,0,0,0|3,0,0]=4 2023 B11R1.28 CCC\C=C\c1cc[n]cc1 Amb24103147 [0,1,0,0,0,0|3,0,0]=4 2024 B11R1.28 CCC\C=C\c1cccc[n]1 Amb22170161 [0,1,0,0,0,0|3,0,0]=4 2025 B11R1.28 CCC\C=N\c1ccccc1 Amb16231172 [0,1,0,0,0,0|2,0,0]=3 2026 B11R1.28 CCNCC[n+]1ccccc1 Amb25383240 [0,1,0,0,0,0|3,0,0]=4 2027 B11R1.28 CCNCCc1c[n]ccc1 Amb18303850 [0,1,0,0,0,0|3,0,0]=4 2028 B11R1.28 CCNCCc1ccccc1 Amb2119468 [0,1,0,0,0,0|2,0,0]=3 2029 B11R1.28 CCOCC[n+]1ccccc1 Amb24762647 [0,1,0,0,0,0|3,0,0]=4 2030 B11R1.28 CCOCNc1ccccc1 Amb25856976 [0,1,0,0,0,0|2,0,0]=3 2031 B11R1.28 CCOCOc1c[n]ccc1 Amb25383033 [0,1,0,0,0,0|2,0,0]=3 2032 B11R1.28 CCOCSc1cc[n]cc1 Amb24762594 [0,1,0,0,0,0|2,1,0]=4 2033 B11R1.28 CCOCSc1cccc[n]1 Amb24762592 [0,1,0,0,0,0|2,1,0]=4 2034 B11R1.28 CCOCSc1ccccc1 Amb24762591 [0,1,0,0,0,0|1,1,0]=3 2035 B11R1.28 CCONCc1ccccc1 Amb25151184 [0,1,0,0,0,0|3,0,0]=4 2036 B11R1.28 CCO\N=C\c1ccccc1 Amb25712631 [0,1,0,0,0,0|3,0,0]=4 2037 B11R1.28 CCSCSc1ccccc1 Amb25380606 [0,1,0,0,0,0|1,1,0]=3 2038 B11R1.28 CC\N=C\Nc1ccccc1 Amb24384245 [0,1,0,0,0,0|2,0,1]=4 2039 B11R1.28 CNCC#Cc1ccccc1 Amb18296119 [0,1,0,0,0,0|2,0,1]=4 2040 B11R1.28 CNCCCc1c[n]ccc1 Amb23442716 [0,1,0,0,0,0|3,0,0]=4 2041 B11R1.28 CNCCCc1cc[n]cc1 Amb19025185 [0,1,0,0,0,0|3,0,0]=4 2042 B11R1.28 CNCCCc1cccc[n]1 Amb18312462 [0,1,0,0,0,0|3,0,0]=4 2043 B11R1.28 CNCCCc1ccccc1 Amb21954280 [0,1,0,0,0,0|2,0,0]=3 2044 B11R1.28 CNCCNc1cc[n]cc1 Amb18313323 [0,1,0,0,0,0|3,0,0]=4 2045 B11R1.28 CNCCNc1cccc[n]1 Amb18313466 [0,1,0,0,0,0|3,0,0]=4 2046 B11R1.28 CNCCOc1[n]ccc[n]1 Amb19020814 [0,1,0,0,0,0|3,0,0]=4 2047 B11R1.28 CNCCOc1c[n]c[n]c1 Amb24095071 [0,1,0,0,0,0|3,0,0]=4 2048 B11R1.28 CNCCOc1c[n]cc[n]1 Amb19020813 [0,1,0,0,0,0|3,0,0]=4 2049 B11R1.28 CNCCOc1c[n]ccc1 Amb18312519 [0,1,0,0,0,0|2,0,0]=3 2050 B11R1.28 CNCCOc1cc[n]c[n]1 Amb19020825 [0,1,0,0,0,0|3,0,0]=4 2051 B11R1.28 CNCCOc1cc[n]cc1 Amb19020798 [0,1,0,0,0,0|2,0,0]=3 2052 B11R1.28 CNCCOc1ccc[n][n]1 Amb19023212 [0,1,0,0,0,0|3,0,0]=4 2053 B11R1.28 CNCCOc1cccc[n]1 Amb19020802 [0,1,0,0,0,0|2,0,0]=3 2054 B11R1.28 CNCCOc1ccccc1 Amb1105525 [0,1,0,0,0,0|1,0,0]=2 2055 B11R1.28 CNCCSc1cccc[n]1 Amb19024669 [0,1,0,0,0,0|2,1,0]=4 2056 B11R1.28 CNCCSc1ccccc1 Amb10608735 [0,1,0,0,0,0|1,1,0]=3 2057 B11R1.28 CNCCSc1ccccc1 Amb17622507 [0,1,0,0,0,0|1,1,0]=3 2058 B11R1.28 CNC\C=C\c1ccccc1 Amb2114273 [0,1,0,0,0,0|2,0,1]=4 2059 B11R1.28 COCC#Cc1cccc[n]1 Amb24100550 [0,1,0,0,0,0|2,0,1]=4 2060 B11R1.28 COCC#Cc1ccccc1 Amb25308232 [0,1,0,0,0,0|1,0,1]=3 2061 B11R1.28 COCCCc1c[n]ccc1 Amb25382996 [0,1,0,0,0,0|2,0,0]=3 2062 B11R1.28 COCCCc1cc[n]c[n]1 Amb23453461 [0,1,0,0,0,0|3,0,0]=4 2063 B11R1.28 COCCCc1cccc[n]1 Amb25383067 [0,1,0,0,0,0|2,0,0]=3 2064 B11R1.28 COCCNc1c[n]c[n]c1 Amb18268244 [0,1,0,0,0,0|3,0,0]=4 2065 B11R1.28 COCCNc1c[n]ccc1 Amb18268638 [0,1,0,0,0,0|2,0,0]=3 2066 B11R1.28 COCCNc1cc[n]c[n]1 Amb18305870 [0,1,0,0,0,0|3,0,0]=4 2067 B11R1.28 COCCNc1ccc[n][n]1 Amb19023323 [0,1,0,0,0,0|3,0,0]=4 2068 B11R1.28 COCCOc1c[n]ccc1 Amb25383068 [0,1,0,0,0,0|1,0,0]=2 2069 B11R1.28 COCCOc1cc[n]cc1 Amb25383069 [0,1,0,0,0,0|1,0,0]=2 2070 B11R1.28 COCCOc1cccc[n]1 Amb24070160 [0,1,0,0,0,0|1,0,0]=2 2071 B11R1.28 COCCSc1ccccn1 Amb17760116 [0,1,0,0,0,0|1,1,0]=3 2072 B11R1.28 COCCSc1ncccn1 Amb17740914 [0,1,0,0,0,0|2,1,0]=4 2073 B11R1.28 COCNCc1ccccc1 Amb25053350 [0,1,0,0,0,0|2,0,0]=3 2074 B11R1.28 COC\C=C\c1cccc[n]1 Amb24101883 [0,1,0,0,0,0|2,0,1]=4 2075 B11R1.28 CONCCc1cccc[n]1 Amb24763045 [0,1,0,0,0,0|3,0,0]=4 2076 B11R1.28 CONCCc1ccccc1 Amb22897018 [0,1,0,0,0,0|2,0,0]=3 2077 B11R1.28 CONCOc1ccccc1 Amb24096695 [0,1,0,0,0,0|1,0,0]=2 2078 B11R1.28 CO\C=C/Oc1ccccc1 Amb24069136 [0,1,0,0,0,0|0,0,2]=3 2079 B11R1.28 CO\C=C\Oc1ccccc1 Amb24069134 [0,1,0,0,0,0|0,0,2]=3 2080 B11R1.28 CSCCCc1cc[n]cc1 Amb25382938 [0,1,0,0,0,0|2,1,0]=4 2081 B11R1.28 CSCCCc1ccccc1 Amb25383748 [0,1,0,0,0,0|1,1,0]=3 2082 B11R1.28 CSCCNc1ccccc1 Amb17307504 [0,1,0,0,0,0|1,1,0]=3 2083 B11R1.28 CSCSCc1ccccc1 Amb25380610 [0,1,0,0,0,0|2,1,0]=4 2084 B11R1.28 C\C=C\COc1c[n]ccc1 Amb25151771 [0,1,0,0,0,0|2,0,1]=4 2085 B11R1.28 C\C=C\COc1cccc[n]1 Amb24101955 [0,1,0,0,0,0|2,0,1]=4 2086 B11R1.28 C\C=N\OCc1ccccc1 Amb24334870 [0,1,0,0,0,0|2,0,1]=4 2087 B11R1.28 ClCC#CCc1ccccc1 Amb24453719 [0,1,0,0,0,0|2,0,1]=4 2088 B11R1.28 ClCC#CSc1ccccc1 Amb24660042 [0,1,0,0,0,0|1,1,1]=4 2089 B11R1.28 ClCCC#Cc1c[n]ccc1 Amb18792718 [0,1,0,0,0,0|3,0,0]=4 2090 B11R1.28 ClCCC#Cc1cccc[n]1 Amb25073108 [0,1,0,0,0,0|3,0,0]=4 2091 B11R1.28 ClCCC#Cc1ccccc1 Amb18792613 [0,1,0,0,0,0|2,0,0]=3 2092 B11R1.28 ClCCCCc1c[n]ccc1 Amb24762958 [0,1,0,0,0,0|3,0,0]=4 2093 B11R1.28 ClCCCCc1cc[n]cc1 Amb20622009 [0,1,0,0,0,0|3,0,0]=4 2094 B11R1.28 ClCCCCc1cc[n]cc1 Amb21962609 [0,1,0,0,0,0|3,0,0]=4 2095 B11R1.28 ClCCCCc1cccc[n]1 Amb24762960 [0,1,0,0,0,0|3,0,0]=4 2096 B11R1.28 ClCCCNc1cc[n]cc1 Amb25246119 [0,1,0,0,0,0|3,0,0]=4 2097 B11R1.28 ClCCCOc1ccccc1 Amb1128627 [0,1,0,0,0,0|1,0,0]=2 2098 B11R1.28 ClCCCSc1cc[n]cc1 Amb25386236 [0,1,0,0,0,0|2,1,0]=4 2099 B11R1.28 ClCCCSc1ccccc1 Amb1132759 [0,1,0,0,0,0|1,1,0]=3 2100 B11R1.28 ClCCNCc1ccccn1 Amb17334832 [0,1,0,0,0,0|3,0,0]=4 2101 B11R1.28 ClCCNCc1cccnc1 Amb17334833 [0,1,0,0,0,0|3,0,0]=4 2102 B11R1.28 ClCCNCc1ccncc1 Amb17334834 [0,1,0,0,0,0|3,0,0]=4 2103 B11R1.28 ClCC\C=C\c1ccccc1 Amb17232628 [0,1,0,0,0,0|2,0,0]=3 2104 B11R1.28 ClCO\N=C\c1ccccc1 Amb25838175 [0,1,0,0,0,0|3,0,0]=4 2105 B11R1.28 ClCSC#Cc1ccccc1 Amb17670553 [0,1,0,0,0,0|2,0,1]=4 2106 B11R1.28 ClC\C=C\Cc1ccccc1 Amb24462747 [0,1,0,0,0,0|2,0,1]=4 2107 B11R1.28 ClC\C=C\Oc1ccccc1 Amb24548862 [0,1,0,0,0,0|1,0,1]=3 2108 B11R1.28 Cl[Mg]CCCc1ccccc1 Amb19928784 [0,1,0,0,0,0|2,0,0]=3 2109 B11R1.28 Cl[Zn]C\C=C\c1ccccc1 Amb22897734 [0,1,0,0,0,0|2,0,1]=4 2110 B11R1.28 Cl\C=C/CNc1ccccc1 Amb25241241 [0,1,0,0,0,0|2,0,1]=4 2111 B11R1.28 Cl\C=C\CNc1ccccc1 Amb25148081 [0,1,0,0,0,0|2,0,1]=4 2112 B11R1.28 Cl\C=C\COc1c[n]ccc1 Amb25733978 [0,1,0,0,0,0|2,0,1]=4 2113 B11R1.28 FCCCOc1c[n]ccc1 Amb25379590 [0,1,0,0,0,0|2,0,0]=3 2114 B11R1.28 FCCCOc1cccc[n]1 Amb24762368 [0,1,0,0,0,0|2,0,0]=3 2115 B11R1.28 FCCCOc1ccccc1 Amb22008296 [0,1,0,0,0,0|1,0,0]=2 2116 B11R1.28 FCCCSc1cc[n]cc1 Amb25382657 [0,1,0,0,0,0|2,1,0]=4 2117 B11R1.28 FCCCSc1cccc[n]1 Amb25382655 [0,1,0,0,0,0|2,1,0]=4 2118 B11R1.28 FCCCSc1ccccc1 Amb25382654 [0,1,0,0,0,0|1,1,0]=3 2119 B11R1.28 FCCNCc1ccccc1 Amb24611358 [0,1,0,0,0,0|2,0,0]=3 2120 B11R1.28 ICCCCc1ccccc1 Amb25380384 [0,1,0,0,0,0|2,0,0]=3 2121 B11R1.28 ICCNCc1ccccc1 Amb25188796 [0,1,0,0,0,0|2,0,0]=3 2122 B11R1.28 ICCOCc1ccccc1 Amb16191915 [0,1,0,0,0,0|1,0,0]=2 2123 B11R1.28 N#CCC#Cc1ccccc1 Amb25705489 [0,1,0,0,0,0|2,0,1]=4 2124 B11R1.28 N#CCCC[n+]1ccccc1 Amb22339033 [0,1,0,0,0,0|3,0,0]=4 2125 B11R1.28 N#CCCCc1c[n]ccc1 Amb18124797 [0,1,0,0,0,0|3,0,0]=4 2126 B11R1.28 N#CCCCc1cc[n]cc1 Amb24083114 [0,1,0,0,0,0|3,0,0]=4 2127 B11R1.28 N#CCCCc1ccccn1 Amb1102455 [0,1,0,0,0,0|3,0,0]=4 2128 B11R1.28 N#CCCNc1c[n]ccc1 Amb24085246 [0,1,0,0,0,0|3,0,0]=4 2129 B11R1.28 N#CCCNc1ccccc1 Amb1645915 [0,1,0,0,0,0|2,0,0]=3 2130 B11R1.28 N#CCCOc1ccccc1 Amb1202508 [0,1,0,0,0,0|1,0,0]=2 2131 B11R1.28 N#CCNCc1ccccc1 Amb22491357 [0,1,0,0,0,0|2,0,1]=4 2132 B11R1.28 N#CCOCc1c[n]ccc1 Amb24068451 [0,1,0,0,0,0|2,0,1]=4 2133 B11R1.28 N#CCOCc1cccc[n]1 Amb24100494 [0,1,0,0,0,0|2,0,1]=4 2134 B11R1.28 N#CC[NH2+]Cc1ccccc1 Amb24113886 [0,1,0,0,0,0|2,0,1]=4 2135 B11R1.28 N=N=NCSc1ccccc1 Amb22360722 [0,1,0,0,0,0|2,1,0]=4 2136 B11R1.28 NCC#CCc1ccccc1 Amb25104593 [0,1,0,0,0,0|2,0,1]=4 2137 B11R1.28 NCC#CSc1ccccc1 Amb24468721 [0,1,0,0,0,0|1,1,1]=4 2138 B11R1.28 NCCC#Cc1c[n]ccc1 Amb24484386 [0,1,0,0,0,0|3,0,0]=4 2139 B11R1.28 NCCC#Cc1ccccc1 Amb18993041 [0,1,0,0,0,0|2,0,0]=3 2140 B11R1.28 NCCCCc1cc[n]cc1 Amb17991253 [0,1,0,0,0,0|3,0,0]=4 2141 B11R1.28 NCCCCc1ccccc1 Amb1227740 [0,1,0,0,0,0|2,0,0]=3 2142 B11R1.28 NCCCCc1ccccc1 Amb19929939 [0,1,0,0,0,0|2,0,0]=3 2143 B11R1.28 NCCCCc1ccccn1 Amb1102767 [0,1,0,0,0,0|3,0,0]=4 2144 B11R1.28 NCCCNc1ccccc1 Amb10086594 [0,1,0,0,0,0|2,0,0]=3 2145 B11R1.28 NCCCNc1cccnc1 Amb10607841 [0,1,0,0,0,0|3,0,0]=4 2146 B11R1.28 NCCCOc1[n]ccc[n]1 Amb18308494 [0,1,0,0,0,0|3,0,0]=4 2147 B11R1.28 NCCCOc1c[n]cc[n]1 Amb18308518 [0,1,0,0,0,0|3,0,0]=4 2148 B11R1.28 NCCCOc1cc[n]c[n]1 Amb18308503 [0,1,0,0,0,0|3,0,0]=4 2149 B11R1.28 NCCCOc1cc[n]cc1 Amb18308513 [0,1,0,0,0,0|2,0,0]=3 2150 B11R1.28 NCCCOc1ccc[n][n]1 Amb18311417 [0,1,0,0,0,0|3,0,0]=4 2151 B11R1.28 NCCCOc1cccc[n]1 Amb19020881 [0,1,0,0,0,0|2,0,0]=3 2152 B11R1.28 NCCCOc1ccccc1 Amb1108619 [0,1,0,0,0,0|1,0,0]=2 2153 B11R1.28 NCCCSc1ccccc1 Amb1089343 [0,1,0,0,0,0|1,1,0]=3 2154 B11R1.28 NCCCSc1ccccc1 Amb2099802 [0,1,0,0,0,0|1,1,0]=3 2155 B11R1.28 NCCNCc1ccccn1 Amb17091028 [0,1,0,0,0,0|3,0,0]=4 2156 B11R1.28 NCCNCc1cccnc1 Amb17091029 [0,1,0,0,0,0|3,0,0]=4 2157 B11R1.28 NCCNCc1ccncc1 Amb17091030 [0,1,0,0,0,0|3,0,0]=4 2158 B11R1.28 NCCNNc1ccccc1 Amb24763429 [0,1,0,0,0,0|2,0,0]=3 2159 B11R1.28 NCCOCc1[n]ccc[n]1 Amb19028700 [0,1,0,0,0,0|3,0,0]=4 2160 B11R1.28 NCCOCc1c[n]ccc1 Amb18307736 [0,1,0,0,0,0|2,0,0]=3 2161 B11R1.28 NCCOCc1cc[n]cc1 Amb19020767 [0,1,0,0,0,0|2,0,0]=3 2162 B11R1.28 NCCOCc1cccc[n]1 Amb18181726 [0,1,0,0,0,0|2,0,0]=3 2163 B11R1.28 NCCOCc1ccccc1 Amb1081962 [0,1,0,0,0,0|1,0,0]=2 2164 B11R1.28 NCCOCc1ccccc1 Amb2137059 [0,1,0,0,0,0|1,0,0]=2 2165 B11R1.28 NCCSSc1cc[n]cc1 Amb24764696 [0,1,0,0,0,0|2,1,0]=4 2166 B11R1.28 NCCSSc1cccc[n]1 Amb22523455 [0,1,0,0,0,0|2,1,0]=4 2167 B11R1.28 NCCSSc1ccccn1 Amb17619715 [0,1,0,0,0,0|2,1,0]=4 2168 B11R1.28 NCC\C=C\c1c[n]ccc1 Amb25061778 [0,1,0,0,0,0|3,0,0]=4 2169 B11R1.28 NCC\C=C\c1cc[n]cc1 Amb24678309 [0,1,0,0,0,0|3,0,0]=4 2170 B11R1.28 NCC\C=C\c1cccc[n]1 Amb24383569 [0,1,0,0,0,0|3,0,0]=4 2171 B11R1.28 NCC\C=C\c1ccccc1 Amb17138419 [0,1,0,0,0,0|2,0,0]=3 2172 B11R1.28 NCC\N=C\c1cc[n]cc1 Amb24486118 [0,1,0,0,0,0|3,0,0]=4 2173 B11R1.28 NCNCCc1ccccc1 Amb25385258 [0,1,0,0,0,0|2,0,0]=3 2174 B11R1.28 NC\C=C\Cc1ccccc1 Amb24351087 [0,1,0,0,0,0|2,0,1]=4 2175 B11R1.28 NNCCCc1c[n]ccc1 Amb18125323 [0,1,0,0,0,0|3,0,0]=4 2176 B11R1.28 NNCCCc1ccccc1 Amb19373221 [0,1,0,0,0,0|2,0,0]=3 2177 B11R1.28 NNCCSc1ccccc1 Amb18126564 [0,1,0,0,0,0|1,1,0]=3 2178 B11R1.28 NNC\C=C\c1ccccc1 Amb24563952 [0,1,0,0,0,0|2,0,1]=4 2179 B11R1.28 NNNCNc1ccccc1 Amb25251558 [0,1,0,0,0,0|3,0,0]=4 2180 B11R1.28 NOCC#Cc1c[n]ccc1 Amb24085699 [0,1,0,0,0,0|2,0,1]=4 2181 B11R1.28 NOCC#Cc1cccc[n]1 Amb22896641 [0,1,0,0,0,0|2,0,1]=4 2182 B11R1.28 NOCC#Cc1cccc[n]1 Amb24600127 [0,1,0,0,0,0|2,0,1]=4 2183 B11R1.28 NOCCCc1ccccc1 Amb22231356 [0,1,0,0,0,0|1,0,0]=2 2184 B11R1.28 NOCCCc1ccccn1 Amb17089546 [0,1,0,0,0,0|2,0,0]=3 2185 B11R1.28 NOCCCc1cccnc1 Amb17089547 [0,1,0,0,0,0|2,0,0]=3 2186 B11R1.28 NOCCCc1ccncc1 Amb17089548 [0,1,0,0,0,0|2,0,0]=3 2187 B11R1.28 NOCCNc1ccccc1 Amb24486573 [0,1,0,0,0,0|1,0,0]=2 2188 B11R1.28 NOCCOc1ccccc1 Amb17088287 [0,1,0,0,0,0|0,0,0]=1 2189 B11R1.28 NOCCOc1ccccc1 Amb19894640 [0,1,0,0,0,0|0,0,0]=1 2190 B11R1.28 NOCCSc1[n]ccc[n]1 Amb24762884 [0,1,0,0,0,0|2,1,0]=4 2191 B11R1.28 NOCCSc1c[n]cc[n]1 Amb24762811 [0,1,0,0,0,0|2,1,0]=4 2192 B11R1.28 NOCCSc1cc[n]c[n]1 Amb24762817 [0,1,0,0,0,0|2,1,0]=4 2193 B11R1.28 NOCCSc1cc[n]cc1 Amb24762878 [0,1,0,0,0,0|1,1,0]=3 2194 B11R1.28 NOCCSc1cccc[n]1 Amb24762881 [0,1,0,0,0,0|1,1,0]=3 2195 B11R1.28 NOCOCc1ccccc1 Amb10606697 [0,1,0,0,0,0|2,0,0]=3 2196 B11R1.28 NOC\C=C\c1c[n]ccc1 Amb24085612 [0,1,0,0,0,0|2,0,1]=4 2197 B11R1.28 NOC\C=C\c1ccccc1 Amb18124997 [0,1,0,0,0,0|1,0,1]=3 2198 B11R1.28 O=C=NCCc1ccccc1 Amb2092802 [0,1,0,0,0,0|1,0,2]=4 2199 B11R1.28 O=C=NCOc1ccccc1 Amb20668487 [0,1,0,0,0,0|0,0,2]=3 2200 B11R1.28 O=CCCCc1c[n]ccc1 Amb24099514 [0,1,0,0,0,0|2,0,1]=4 2201 B11R1.28 O=CCCCc1cc[n]cc1 Amb24099515 [0,1,0,0,0,0|2,0,1]=4 2202 B11R1.28 O=CCCCc1cccc[n]1 Amb22897023 [0,1,0,0,0,0|2,0,1]=4 2203 B11R1.28 O=CCCOc1cccc[n]1 Amb24762999 [0,1,0,0,0,0|1,0,1]=3 2204 B11R1.28 O=CCCSc1cccc[n]1 Amb18177861 [0,1,0,0,0,0|1,1,1]=4 2205 B11R1.28 O=CCCSc1ccccc1 Amb17082943 [0,1,0,0,0,0|0,1,1]=3 2206 B11R1.28 O=CCNCc1ccccc1 Amb19886524 [0,1,0,0,0,0|1,0,2]=4 2207 B11R1.28 O=CCONc1ccccc1 Amb24434643 [0,1,0,0,0,0|0,0,2]=3 2208 B11R1.28 O=CCSCc1ccccc1 Amb18801121 [0,1,0,0,0,0|0,1,2]=4 2209 B11R1.28 O=CC\C=C\c1ccccc1 Amb18644267 [0,1,0,0,0,0|1,0,2]=4 2210 B11R1.28 O=CNCCc1ccccc1 Amb10559023 [0,1,0,0,0,0|1,0,2]=4 2211 B11R1.28 O=CNCSc1ccccc1 Amb24382608 [0,1,0,0,0,0|0,1,2]=4 2212 B11R1.28 O=C\C=C\Oc1ccccc1 Amb24585165 [0,1,0,0,0,0|0,0,3]=4 2213 B11R1.28 OCC#CCc1c[n]ccc1 Amb24651956 [0,1,0,0,0,0|2,0,1]=4 2214 B11R1.28 OCC#CCc1cc[n]cc1 Amb25771948 [0,1,0,0,0,0|2,0,1]=4 2215 B11R1.28 OCC#COc1ccccc1 Amb25058509 [0,1,0,0,0,0|0,0,1]=2 2216 B11R1.28 OCC=C=Cc1ccccc1 Amb24398063 [0,1,0,0,0,0|1,0,1]=3 2217 B11R1.28 OCCC#Cc1[n]ccc[n]1 Amb25374912 [0,1,0,0,0,0|3,0,0]=4 2218 B11R1.28 OCCC#Cc1c[n]ccc1 Amb22749317 [0,1,0,0,0,0|2,0,0]=3 2219 B11R1.28 OCCC#Cc1cc[n]cc1 Amb22749294 [0,1,0,0,0,0|2,0,0]=3 2220 B11R1.28 OCCC#Cc1cccc[n]1 Amb22749318 [0,1,0,0,0,0|2,0,0]=3 2221 B11R1.28 OCCCCc1c[n]c[n]c1 Amb25383777 [0,1,0,0,0,0|3,0,0]=4 2222 B11R1.28 OCCCCc1c[n]ccc1 Amb22732495 [0,1,0,0,0,0|2,0,0]=3 2223 B11R1.28 OCCCCc1cccc[n]1 Amb21520414 [0,1,0,0,0,0|2,0,0]=3 2224 B11R1.28 OCCCCc1ccncc1 Amb17740015 [0,1,0,0,0,0|2,0,0]=3 2225 B11R1.28 OCCCNc1c[n]c[n]c1 Amb18267814 [0,1,0,0,0,0|3,0,0]=4 2226 B11R1.28 OCCCNc1c[n]ccc1 Amb18267758 [0,1,0,0,0,0|2,0,0]=3 2227 B11R1.28 OCCCNc1cc[n]c[n]1 Amb18305868 [0,1,0,0,0,0|3,0,0]=4 2228 B11R1.28 OCCCNc1ccc[n][n]1 Amb19023330 [0,1,0,0,0,0|3,0,0]=4 2229 B11R1.28 OCCCNc1ccccc1 Amb17307125 [0,1,0,0,0,0|1,0,0]=2 2230 B11R1.28 OCCCNc1ccccc1 Amb17772314 [0,1,0,0,0,0|1,0,0]=2 2231 B11R1.28 OCCCOc1cccc[n]1 Amb25383036 [0,1,0,0,0,0|1,0,0]=2 2232 B11R1.28 OCCN=Cc1ccccc1 Amb24065097 [0,1,0,0,0,0|1,0,0]=2 2233 B11R1.28 OCCNCc1[n]ccc[n]1 Amb18313677 [0,1,0,0,0,0|3,0,0]=4 2234 B11R1.28 OCCNCc1c[n]c[n]c1 Amb19030147 [0,1,0,0,0,0|3,0,0]=4 2235 B11R1.28 OCCNCc1c[n]cc[n]1 Amb18314235 [0,1,0,0,0,0|3,0,0]=4 2236 B11R1.28 OCCNCc1cc[n]c[n]1 Amb18314306 [0,1,0,0,0,0|3,0,0]=4 2237 B11R1.28 OCCNCc1cccc[n]1 Amb21955286 [0,1,0,0,0,0|2,0,0]=3 2238 B11R1.28 OCCNCc1ccccc1 Amb1835287 [0,1,0,0,0,0|1,0,0]=2 2239 B11R1.28 OCCSCc1[n]ccc[n]1 Amb18183594 [0,1,0,0,0,0|2,1,0]=4 2240 B11R1.28 OCC\C=C\c1cc[n]cc1 Amb24666733 [0,1,0,0,0,0|2,0,0]=3 2241 B11R1.28 OCC\C=C\c1cccc[n]1 Amb25233577 [0,1,0,0,0,0|2,0,0]=3 2242 B11R1.28 OCC\C=C\c1ccccc1 Amb24756581 [0,1,0,0,0,0|1,0,0]=2 2243 B11R1.28 OCC\N=C/c1cc[n]cc1 Amb24106776 [0,1,0,0,0,0|2,0,0]=3 2244 B11R1.28 OCC\N=C\c1ccccc1 Amb20622247 [0,1,0,0,0,0|1,0,0]=2 2245 B11R1.28 OC\C=C\Cc1ccccc1 Amb25074433 [0,1,0,0,0,0|1,0,1]=3 2246 B11R1.28 OC\C=C\Nc1ccccc1 Amb25228349 [0,1,0,0,0,0|1,0,1]=3 2247 B11R1.28 OC\C=C\Oc1ccccc1 Amb25283274 [0,1,0,0,0,0|0,0,1]=2 2248 B11R1.28 OC\C=C\Sc1cccc[n]1 Amb24719685 [0,1,0,0,0,0|1,1,1]=4 2249 B11R1.28 OC\C=N\Nc1ccccc1 Amb25801902 [0,1,0,0,0,0|1,0,1]=3 2250 B11R1.28 ONCCOc1ccccc1 Amb17088413 [0,1,0,0,0,0|0,0,0]=1 2251 B11R1.28 O\N=C\C=C/c1ccccc1 Amb24668019 [0,1,0,0,0,0|1,0,2]=4 2252 B11R1.28 O\N=C\CNc1ccccc1 Amb25211715 [0,1,0,0,0,0|1,0,1]=3 2253 B11R1.28 O\N=C\N=N\c1ccccc1 Amb2228038 [0,1,0,0,0,0|2,0,1]=4 2254 B11R1.28 SCCCCc1c[n]ccc1 Amb18563823 [0,1,0,0,0,0|2,1,0]=4 2255 B11R1.28 SCCCCc1cc[n]cc1 Amb18065469 [0,1,0,0,0,0|2,1,0]=4 2256 B11R1.28 SCCCCc1cccc[n]1 Amb18563822 [0,1,0,0,0,0|2,1,0]=4 2257 B11R1.28 SCCCCc1ccccc1 Amb17400224 [0,1,0,0,0,0|1,1,0]=3 2258 B11R1.28 SCCCNc1c[n]ccc1 Amb25059157 [0,1,0,0,0,0|2,1,0]=4 2259 B11R1.28 SCC\C=C\c1ccccc1 Amb24390438 [0,1,0,0,0,0|1,1,0]=3 2260 B11R1.28 [N-]=[N+]=NCCc1ccccc1 Amb19149244 [0,1,0,0,0,0|3,0,0]=4 2261 B11R1.28 [N-]=[N+]=NCSc1ccccc1 Amb22735141 [0,1,0,0,0,0|2,1,0]=4 2262 B11R1.28 [NH3+]CCCCc1ccccc1 Amb22733934 [0,1,0,0,0,0|2,0,0]=3 2263 B11R1.28 [NH3+]OCCOc1ccccc1 Amb2420800 [0,1,0,0,0,0|0,0,0]=1 2264 B11R1.40 BrC(Cc1ccccc1)C#N Amb1154191 [0,1,0,0,0,0|2,0,1]=4 2265 B11R1.40 BrCC(=O)Cc1ccccc1 Amb17569850 [0,1,0,0,0,0|2,0,1]=4 2266 B11R1.40 BrCC(=O)Nc1ccccc1 Amb2222053 [0,1,0,0,0,0|2,0,1]=4 2267 B11R1.40 BrCC(C[n+]1ccccc1)Br Amb1154041 [0,1,0,0,0,0|3,0,0]=4 2268 B11R1.40 BrCC(Cc1ccccc1)O Amb17595843 [0,1,0,0,0,0|2,0,0]=3 2269 B11R1.40 BrCC(Oc1ccccc1)C Amb17241866 [0,1,0,0,0,0|1,0,0]=2 2270 B11R1.40 C#CC(Cl)Cc1ccccc1 Amb24398624 [0,1,0,0,0,0|2,0,1]=4 2271 B11R1.40 C#CC(N)Cc1ccccc1 Amb24699229 [0,1,0,0,0,0|2,0,1]=4 2272 B11R1.40 C#CC(O)Nc1ccccc1 Amb24561876 [0,1,0,0,0,0|2,0,1]=4 2273 B11R1.40 C#C[C@@H](O)Cc1ccccc1 Amb25056589 [0,1,0,0,0,0|2,0,1]=4 2274 B11R1.40 C=C(C=O)Oc1ccccc1 Amb18124880 [0,1,0,0,0,0|0,0,3]=4 2275 B11R1.40 C=C(Cc1ccccc1)CCl Amb25185403 [0,1,0,0,0,0|2,0,1]=4 2276 B11R1.40 C=CC(=O)Oc1ccccc1 Amb17934129 [0,1,0,0,0,0|1,0,2]=4 2277 B11R1.40 C=CC(Cl)Oc1ccccc1 Amb25363210 [0,1,0,0,0,0|1,0,1]=3 2278 B11R1.40 C=CC(N)Cc1ccccc1 Amb25064298 [0,1,0,0,0,0|2,0,1]=4 2279 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [0,1,0,0,0,0|2,0,1]=4 2280 B11R1.40 C=C[C@H](Cc1ccccc1)N Amb10982592 [0,1,0,0,0,0|2,0,1]=4 2281 B11R1.40 C=C[C@H](N)Cc1ccccc1 Amb19929662 [0,1,0,0,0,0|2,0,1]=4 2282 B11R1.40 CC(=NC)Oc1ccccc1 Amb24066830 [0,1,0,0,0,0|2,0,1]=4 2283 B11R1.40 CC(C#N)Sc1ccccc1 Amb18800724 [0,1,0,0,0,0|1,1,1]=4 2284 B11R1.40 CC(C=C)Nc1ccccc1 Amb24122661 [0,1,0,0,0,0|2,0,1]=4 2285 B11R1.40 CC(C=C)Oc1ccccc1 Amb25151239 [0,1,0,0,0,0|1,0,1]=3 2286 B11R1.40 CC(C=C)Sc1ccccc1 Amb25787941 [0,1,0,0,0,0|1,1,1]=4 2287 B11R1.40 CC(C=O)Oc1ccccc1 Amb22011729 [0,1,0,0,0,0|0,0,2]=3 2288 B11R1.40 CC(C=O)Sc1ccccc1 Amb18646621 [0,1,0,0,0,0|0,1,2]=4 2289 B11R1.40 CC(CBr)Cc1c[n]ccc1 Amb25345425 [0,1,0,0,0,0|3,0,0]=4 2290 B11R1.40 CC(CBr)Cc1ccccc1 Amb25151397 [0,1,0,0,0,0|2,0,0]=3 2291 B11R1.40 CC(CCl)Nc1cc[n]cc1 Amb24420964 [0,1,0,0,0,0|3,0,0]=4 2292 B11R1.40 CC(CCl)Sc1cccc[n]1 Amb25122218 [0,1,0,0,0,0|2,1,0]=4 2293 B11R1.40 CC(CCl)Sc1ccccc1 Amb25772834 [0,1,0,0,0,0|1,1,0]=3 2294 B11R1.40 CC(CN)Cc1ccccc1 Amb18010535 [0,1,0,0,0,0|2,0,0]=3 2295 B11R1.40 CC(CN)Nc1cc[n]cc1 Amb18908422 [0,1,0,0,0,0|3,0,0]=4 2296 B11R1.40 CC(CN)Nc1cccc[n]1 Amb24477483 [0,1,0,0,0,0|3,0,0]=4 2297 B11R1.40 CC(CN)Nc1ccccc1 Amb18644448 [0,1,0,0,0,0|2,0,0]=3 2298 B11R1.40 CC(CN)Oc1[n]ccc[n]1 Amb23589261 [0,1,0,0,0,0|3,0,0]=4 2299 B11R1.40 CC(CN)Oc1cccc[n]1 Amb22522747 [0,1,0,0,0,0|2,0,0]=3 2300 B11R1.40 CC(CN)Sc1cc[n]cc1 Amb18252034 [0,1,0,0,0,0|2,1,0]=4 2301 B11R1.40 CC(CN)Sc1cccc[n]1 Amb18992825 [0,1,0,0,0,0|2,1,0]=4 2302 B11R1.40 CC(CO)Cc1c[n]c[n]c1 Amb25731190 [0,1,0,0,0,0|3,0,0]=4 2303 B11R1.40 CC(CO)Cc1c[n]cc[n]1 Amb25728470 [0,1,0,0,0,0|3,0,0]=4 2304 B11R1.40 CC(CO)Cc1cc[n]cc1 Amb25374015 [0,1,0,0,0,0|2,0,0]=3 2305 B11R1.40 CC(CO)Nc1cc[n]c[n]1 Amb18290773 [0,1,0,0,0,0|3,0,0]=4 2306 B11R1.40 CC(CO)Nc1ccc[n][n]1 Amb18991550 [0,1,0,0,0,0|3,0,0]=4 2307 B11R1.40 CC(CO)Nc1ccccc1 Amb18971804 [0,1,0,0,0,0|1,0,0]=2 2308 B11R1.40 CC(CO)Sc1[n]ccc[n]1 Amb24486923 [0,1,0,0,0,0|2,1,0]=4 2309 B11R1.40 CC(CO)Sc1c[n]cc[n]1 Amb25139648 [0,1,0,0,0,0|2,1,0]=4 2310 B11R1.40 CC(CO)Sc1cc[n]c[n]1 Amb24397457 [0,1,0,0,0,0|2,1,0]=4 2311 B11R1.40 CC(CO)Sc1ccc[n][n]1 Amb24742809 [0,1,0,0,0,0|2,1,0]=4 2312 B11R1.40 CC(CO)Sc1cccc[n]1 Amb24486922 [0,1,0,0,0,0|1,1,0]=3 2313 B11R1.40 CC(CO)Sc1ccccc1 Amb23449852 [0,1,0,0,0,0|0,1,0]=2 2314 B11R1.40 CC(Cc1ccccc1)C#N Amb24402121 [0,1,0,0,0,0|2,0,1]=4 2315 B11R1.40 CC(Cc1ccccc1)C=C Amb25850978 [0,1,0,0,0,0|2,0,1]=4 2316 B11R1.40 CC(Cc1ccccc1)NN Amb22487303 [0,1,0,0,0,0|3,0,0]=4 2317 B11R1.40 CC(Cc1ccccc1)[Mg]Br Amb22897350 [0,1,0,0,0,0|3,0,0]=4 2318 B11R1.40 CC(Cc1ccccc1)[Zn]Br Amb22897866 [0,1,0,0,0,0|3,0,0]=4 2319 B11R1.40 CC(Nc1ccccc1)C#N Amb17399903 [0,1,0,0,0,0|2,0,1]=4 2320 B11R1.40 CCC(=O)Oc1ccc[n]c1 Amb24674574 [0,1,0,0,0,0|2,0,1]=4 2321 B11R1.40 CCC(=O)Oc1cccc[n]1 Amb25264358 [0,1,0,0,0,0|2,0,1]=4 2322 B11R1.40 CCC(=S)Nc1ccccc1 Amb24757738 [0,1,0,0,0,0|2,0,1]=4 2323 B11R1.40 CCC(Br)Cc1cc[n]cc1 Amb24353281 [0,1,0,0,0,0|3,0,0]=4 2324 B11R1.40 CCC(Br)Cc1ccccc1 Amb25189250 [0,1,0,0,0,0|2,0,0]=3 2325 B11R1.40 CCC(C)Cc1c[n]ccc1 Amb24085206 [0,1,0,0,0,0|3,0,0]=4 2326 B11R1.40 CCC(C)Cc1cccc[n]1 Amb24089681 [0,1,0,0,0,0|3,0,0]=4 2327 B11R1.40 CCC(C)Oc1ccccc1 Amb24350256 [0,1,0,0,0,0|1,0,0]=2 2328 B11R1.40 CCC(C)Sc1cccc[n]1 Amb25822094 [0,1,0,0,0,0|2,1,0]=4 2329 B11R1.40 CCC(C)Sc1ccccc1 Amb25698974 [0,1,0,0,0,0|1,1,0]=3 2330 B11R1.40 CCC(Cc1ccccn1)Cl Amb17477711 [0,1,0,0,0,0|3,0,0]=4 2331 B11R1.40 CCC(Cc1ccccn1)O Amb17477703 [0,1,0,0,0,0|3,0,0]=4 2332 B11R1.40 CCC(Cc1cccnc1)Cl Amb17477713 [0,1,0,0,0,0|3,0,0]=4 2333 B11R1.40 CCC(Cc1cccnc1)O Amb17477705 [0,1,0,0,0,0|3,0,0]=4 2334 B11R1.40 CCC(Cc1ccncc1)Cl Amb17477712 [0,1,0,0,0,0|3,0,0]=4 2335 B11R1.40 CCC(Cc1ccncc1)O Amb17477704 [0,1,0,0,0,0|3,0,0]=4 2336 B11R1.40 CCC(Cl)Cc1ccccc1 Amb18177890 [0,1,0,0,0,0|2,0,0]=3 2337 B11R1.40 CCN(Cc1ccccc1)C Amb10807414 [0,1,0,0,0,0|3,0,0]=4 2338 B11R1.40 CCN(Cc1ccccc1)N Amb17232076 [0,1,0,0,0,0|3,0,0]=4 2339 B11R1.40 CCP(=O)Oc1ccccc1 Amb21963209 [0,1,0,0,0,0|2,0,0]=3 2340 B11R1.40 CCS(=O)Cc1ccccc1 Amb24485048 [0,1,0,0,0,0|3,0,0]=4 2341 B11R1.40 CCS(=O)Nc1ccccc1 Amb24752666 [0,1,0,0,0,0|3,0,0]=4 2342 B11R1.40 CC[C@@H](Br)Cc1ccccc1 Amb25770013 [0,1,0,0,0,0|2,0,0]=3 2343 B11R1.40 CC[C@@H](Cl)Cc1ccccc1 Amb24710145 [0,1,0,0,0,0|2,0,0]=3 2344 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb22748727 [0,1,0,0,0,0|2,0,0]=3 2345 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb25141525 [0,1,0,0,0,0|2,0,0]=3 2346 B11R1.40 CC[C@@H](O)Cc1ccccc1 Amb19375372 [0,1,0,0,0,0|2,0,0]=3 2347 B11R1.40 CC[C@H](C)Oc1c[n]cc[n]1 Amb25073944 [0,1,0,0,0,0|3,0,0]=4 2348 B11R1.40 CC[C@H](Cl)Cc1ccccc1 Amb25765719 [0,1,0,0,0,0|2,0,0]=3 2349 B11R1.40 CC[C@H](N)Cc1cccc[n]1 Amb24432851 [0,1,0,0,0,0|3,0,0]=4 2350 B11R1.40 CC[C@H](N)Cc1ccccc1 Amb19929690 [0,1,0,0,0,0|2,0,0]=3 2351 B11R1.40 CC\C(\I)=C/c1ccccc1 Amb22641702 [0,1,0,0,0,0|2,0,1]=4 2352 B11R1.40 CC\C(\N)=N\c1ccccc1 Amb24453266 [0,1,0,0,0,0|2,0,1]=4 2353 B11R1.40 CN(CCl)Cc1ccccc1 Amb25324443 [0,1,0,0,0,0|3,0,0]=4 2354 B11R1.40 CN(CO)Cc1ccccc1 Amb24555500 [0,1,0,0,0,0|2,0,0]=3 2355 B11R1.40 CNC(Cc1ccccc1)C Amb17616872 [0,1,0,0,0,0|3,0,0]=4 2356 B11R1.40 CN[C@H](Cc1ccccc1)C Amb17616868 [0,1,0,0,0,0|3,0,0]=4 2357 B11R1.40 COC(=O)Oc1ccccc1 Amb10807421 [0,1,0,0,0,0|2,0,1]=4 2358 B11R1.40 COC(Cl)Cc1ccccc1 Amb24711453 [0,1,0,0,0,0|3,0,0]=4 2359 B11R1.40 COC(O)Cc1ccccc1 Amb24659514 [0,1,0,0,0,0|3,0,0]=4 2360 B11R1.40 C[C@@H](C=O)Nc1ccccc1 Amb25836355 [0,1,0,0,0,0|1,0,2]=4 2361 B11R1.40 C[C@@H](C=O)Oc1ccccc1 Amb24504931 [0,1,0,0,0,0|0,0,2]=3 2362 B11R1.40 C[C@@H](CN)Cc1ccccc1 Amb24615612 [0,1,0,0,0,0|2,0,0]=3 2363 B11R1.40 C[C@@H](CO)Nc1cc[n]c[n]1 Amb24676486 [0,1,0,0,0,0|3,0,0]=4 2364 B11R1.40 C[C@@H](CO)Nc1cccc[n]1 Amb25205329 [0,1,0,0,0,0|2,0,0]=3 2365 B11R1.40 C[C@@H](CO)Sc1ccccc1 Amb25043604 [0,1,0,0,0,0|0,1,0]=2 2366 B11R1.40 C[C@H](CN)Cc1cc[n]cc1 Amb24745496 [0,1,0,0,0,0|3,0,0]=4 2367 B11R1.40 C[C@H](CO)Cc1ccccc1 Amb25266388 [0,1,0,0,0,0|1,0,0]=2 2368 B11R1.40 C[C@H](CO)Nc1cccc[n]1 Amb25275075 [0,1,0,0,0,0|2,0,0]=3 2369 B11R1.40 C[C@H](Cc1ccccc1)C=O Amb25255421 [0,1,0,0,0,0|1,0,2]=4 2370 B11R1.40 C\C(\CBr)=C/c1ccccc1 Amb24605004 [0,1,0,0,0,0|2,0,1]=4 2371 B11R1.40 C\C(\CC)=C\c1ccccc1 Amb22546773 [0,1,0,0,0,0|2,0,1]=4 2372 B11R1.40 C\C(\CN)=C/c1ccccc1 Amb25076849 [0,1,0,0,0,0|2,0,1]=4 2373 B11R1.40 C\C(\CN)=C\c1ccccc1 Amb24634730 [0,1,0,0,0,0|2,0,1]=4 2374 B11R1.40 C\C(\CO)=C/c1cccc[n]1 Amb25060585 [0,1,0,0,0,0|2,0,1]=4 2375 B11R1.40 C\C(\CO)=C\c1ccc[n]c1 Amb24730218 [0,1,0,0,0,0|2,0,1]=4 2376 B11R1.40 C\C(\CO)=C\c1cccc[n]1 Amb25149286 [0,1,0,0,0,0|2,0,1]=4 2377 B11R1.40 ClC(Cc1ccccc1)C#N Amb1103676 [0,1,0,0,0,0|2,0,1]=4 2378 B11R1.40 ClCC(=O)Cc1ccccc1 Amb2371529 [0,1,0,0,0,0|2,0,1]=4 2379 B11R1.40 ClCC(=O)Oc1ccccc1 Amb1914503 [0,1,0,0,0,0|1,0,1]=3 2380 B11R1.40 ClCC(Cc1ccccc1)C Amb17477588 [0,1,0,0,0,0|2,0,0]=3 2381 B11R1.40 ClCC(Cl)Cc1ccccc1 Amb25061392 [0,1,0,0,0,0|2,0,0]=3 2382 B11R1.40 ClCC(Cl)Oc1ccccc1 Amb24358073 [0,1,0,0,0,0|1,0,0]=2 2383 B11R1.40 ClCC(Cl)Sc1ccccc1 Amb24653564 [0,1,0,0,0,0|1,1,0]=3 2384 B11R1.40 ClCC(Oc1ccccc1)C Amb17232796 [0,1,0,0,0,0|1,0,0]=2 2385 B11R1.40 ClC\C(\Br)=C\c1ccccc1 Amb25283246 [0,1,0,0,0,0|2,0,1]=4 2386 B11R1.40 Cl\C(\CCl)=C/c1ccccc1 Amb25362063 [0,1,0,0,0,0|2,0,1]=4 2387 B11R1.40 FC(CCl)Sc1ccccc1 Amb24390863 [0,1,0,0,0,0|1,1,0]=3 2388 B11R1.40 FCC(Br)Cc1ccccc1 Amb24611243 [0,1,0,0,0,0|2,0,0]=3 2389 B11R1.40 FCC(Cc1ccccc1)N Amb17614462 [0,1,0,0,0,0|2,0,0]=3 2390 B11R1.40 FCC(F)Cc1ccccc1 Amb22641518 [0,1,0,0,0,0|2,0,0]=3 2391 B11R1.40 F\C(\CBr)=C\c1ccccc1 Amb24745736 [0,1,0,0,0,0|2,0,1]=4 2392 B11R1.40 N#CC(F)Sc1ccccc1 Amb24323242 [0,1,0,0,0,0|1,1,1]=4 2393 B11R1.40 N#C[C@@H](O)Cc1ccccc1 Amb24715921 [0,1,0,0,0,0|2,0,1]=4 2394 B11R1.40 N#C[C@H](O)Cc1ccccc1 Amb25846935 [0,1,0,0,0,0|2,0,1]=4 2395 B11R1.40 N=C(CS)Nc1ccccc1 Amb25194642 [0,1,0,0,0,0|1,1,1]=4 2396 B11R1.40 N=C(Cc1ccccc1)NO Amb20671380 [0,1,0,0,0,0|2,0,1]=4 2397 B11R1.40 NC(CBr)Cc1ccccc1 Amb22489725 [0,1,0,0,0,0|2,0,0]=3 2398 B11R1.40 NC(CO)Cc1cc[n]c[n]1 Amb24099661 [0,1,0,0,0,0|3,0,0]=4 2399 B11R1.40 NC(Cc1ccccc1)C#N Amb1127111 [0,1,0,0,0,0|2,0,1]=4 2400 B11R1.40 NC(Cc1ccccc1)NO Amb25047325 [0,1,0,0,0,0|2,0,0]=3 2401 B11R1.40 NC(Nc1ccccc1)=NO Amb18799378 [0,1,0,0,0,0|2,0,1]=4 2402 B11R1.40 NCC(=N)Nc1ccccc1 Amb24746458 [0,1,0,0,0,0|2,0,1]=4 2403 B11R1.40 NCC(=O)Cc1ccccc1 Amb18202084 [0,1,0,0,0,0|2,0,1]=4 2404 B11R1.40 NCC(=O)Cc1ccccc1 Amb19516183 [0,1,0,0,0,0|2,0,1]=4 2405 B11R1.40 NCC(=O)Nc1ccccc1 Amb10609338 [0,1,0,0,0,0|2,0,1]=4 2406 B11R1.40 NCC(=O)Oc1ccccc1 Amb17334310 [0,1,0,0,0,0|1,0,1]=3 2407 B11R1.40 NCC(=S)Nc1ccccc1 Amb25128037 [0,1,0,0,0,0|2,0,1]=4 2408 B11R1.40 NCC(Cc1cccnc1)O Amb17232103 [0,1,0,0,0,0|3,0,0]=4 2409 B11R1.40 NCC(Cl)Cc1ccccc1 Amb24740670 [0,1,0,0,0,0|2,0,0]=3 2410 B11R1.40 NCC(F)Cc1c[n]ccc1 Amb25757490 [0,1,0,0,0,0|3,0,0]=4 2411 B11R1.40 NCC(F)Cc1ccccc1 Amb24434017 [0,1,0,0,0,0|2,0,0]=3 2412 B11R1.40 NCC(O)Cc1cc[n]cc1 Amb18201350 [0,1,0,0,0,0|3,0,0]=4 2413 B11R1.40 NCC(O)Cc1cccc[n]1 Amb18201349 [0,1,0,0,0,0|3,0,0]=4 2414 B11R1.40 NCC(O)Cc1cccc[n]1 Amb22898917 [0,1,0,0,0,0|3,0,0]=4 2415 B11R1.40 NCC(S)Cc1ccccc1 Amb18251941 [0,1,0,0,0,0|2,0,0]=3 2416 B11R1.40 NCC(Sc1ccccc1)C Amb17485971 [0,1,0,0,0,0|1,1,0]=3 2417 B11R1.40 NC[C@@H](Cc1ccccc1)N Amb17619359 [0,1,0,0,0,0|2,0,0]=3 2418 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb22746804 [0,1,0,0,0,0|2,0,0]=3 2419 B11R1.40 NC[C@H](Cc1ccccc1)N Amb17619360 [0,1,0,0,0,0|2,0,0]=3 2420 B11R1.40 NC[C@H](O)Cc1ccccc1 Amb24538166 [0,1,0,0,0,0|2,0,0]=3 2421 B11R1.40 NC\C(\Cl)=C\c1ccccc1 Amb25259250 [0,1,0,0,0,0|2,0,1]=4 2422 B11R1.40 N[C@@H](CBr)Cc1ccccc1 Amb22747782 [0,1,0,0,0,0|2,0,0]=3 2423 B11R1.40 N[C@@H](CCl)Cc1ccccc1 Amb24758237 [0,1,0,0,0,0|2,0,0]=3 2424 B11R1.40 N[C@@H](CF)Cc1ccccc1 Amb24484482 [0,1,0,0,0,0|2,0,0]=3 2425 B11R1.40 N[C@@H](CO)Cc1ccccc1 Amb20242871 [0,1,0,0,0,0|1,0,0]=2 2426 B11R1.40 N[C@@H](CS)Cc1ccccc1 Amb25073967 [0,1,0,0,0,0|1,1,0]=3 2427 B11R1.40 N[C@@H](Cc1ccccc1)C#N Amb17399902 [0,1,0,0,0,0|2,0,1]=4 2428 B11R1.40 N[C@H](CCl)Cc1ccccc1 Amb24533056 [0,1,0,0,0,0|2,0,0]=3 2429 B11R1.40 N[C@H](CF)Cc1ccccc1 Amb25151303 [0,1,0,0,0,0|2,0,0]=3 2430 B11R1.40 N[C@H](CS)Cc1ccccc1 Amb25765677 [0,1,0,0,0,0|1,1,0]=3 2431 B11R1.40 N[C@H](Cc1ccccc1)C=O Amb24746755 [0,1,0,0,0,0|1,0,2]=4 2432 B11R1.40 N\C(\Cc1ccccc1)=C\O Amb25152159 [0,1,0,0,0,0|1,0,2]=4 2433 B11R1.40 O=C(C=O)Oc1ccccc1 Amb18125060 [0,1,0,0,0,0|0,0,3]=4 2434 B11R1.40 O=C(CBr)Sc1ccccc1 Amb24730786 [0,1,0,0,0,0|1,1,1]=4 2435 B11R1.40 O=C(CCl)Sc1ccccc1 Amb24712200 [0,1,0,0,0,0|1,1,1]=4 2436 B11R1.40 O=C(CF)Nc1ccccc1 Amb20246909 [0,1,0,0,0,0|2,0,1]=4 2437 B11R1.40 O=C(CI)Nc1ccccc1 Amb21964671 [0,1,0,0,0,0|2,0,1]=4 2438 B11R1.40 O=C(CP)Nc1ccccc1 Amb25032359 [0,1,0,0,0,0|2,0,1]=4 2439 B11R1.40 O=C(Cc1ccccc1)CF Amb22234964 [0,1,0,0,0,0|2,0,1]=4 2440 B11R1.40 O=C(Cc1ccccc1)CS Amb25294429 [0,1,0,0,0,0|1,1,1]=4 2441 B11R1.40 O=CC(Br)Cc1ccccc1 Amb18657408 [0,1,0,0,0,0|1,0,2]=4 2442 B11R1.40 O=CC(Cc1ccccc1)Cl Amb17204312 [0,1,0,0,0,0|1,0,2]=4 2443 B11R1.40 O=CC(F)Cc1ccccc1 Amb24714702 [0,1,0,0,0,0|1,0,2]=4 2444 B11R1.40 O=C[C@@H](Br)Cc1ccccc1 Amb24461614 [0,1,0,0,0,0|1,0,2]=4 2445 B11R1.40 O=C[C@@H](F)Cc1ccccc1 Amb24724556 [0,1,0,0,0,0|1,0,2]=4 2446 B11R1.40 O=C[C@H](Br)Cc1ccccc1 Amb25778238 [0,1,0,0,0,0|1,0,2]=4 2447 B11R1.40 O=S(CCl)Cc1ccccc1 Amb24373167 [0,1,0,0,0,0|3,0,0]=4 2448 B11R1.40 OC(CBr)Oc1ccccc1 Amb24724811 [0,1,0,0,0,0|1,0,0]=2 2449 B11R1.40 OC(CBr)Sc1ccccc1 Amb24065441 [0,1,0,0,0,0|1,1,0]=3 2450 B11R1.40 OC(CCl)C[n+]1ccccc1 Amb22346544 [0,1,0,0,0,0|3,0,0]=4 2451 B11R1.40 OC(CCl)Cc1c[n]ccc1 Amb25189476 [0,1,0,0,0,0|3,0,0]=4 2452 B11R1.40 OC(CCl)Oc1ccccc1 Amb24635839 [0,1,0,0,0,0|1,0,0]=2 2453 B11R1.40 OC(CF)Cc1ccccc1 Amb24733743 [0,1,0,0,0,0|2,0,0]=3 2454 B11R1.40 OC(CS)Cc1ccccc1 Amb25740621 [0,1,0,0,0,0|1,1,0]=3 2455 B11R1.40 OC(Cc1ccccc1)C=O Amb25065752 [0,1,0,0,0,0|1,0,2]=4 2456 B11R1.40 OCC(=O)Cc1ccccc1 Amb18182729 [0,1,0,0,0,0|1,0,1]=3 2457 B11R1.40 OCC(=O)Nc1ccccc1 Amb1110212 [0,1,0,0,0,0|1,0,1]=3 2458 B11R1.40 OCC(=O)Oc1ccccc1 Amb25149728 [0,1,0,0,0,0|0,0,1]=2 2459 B11R1.40 OCC(Cc1ccccc1)C Amb17477578 [0,1,0,0,0,0|1,0,0]=2 2460 B11R1.40 OCC(Cc1ccccc1)O Amb17593786 [0,1,0,0,0,0|1,0,0]=2 2461 B11R1.40 OCC(Cc1ccccn1)N Amb17062682 [0,1,0,0,0,0|2,0,0]=3 2462 B11R1.40 OCC(Cc1cccnc1)N Amb17062683 [0,1,0,0,0,0|2,0,0]=3 2463 B11R1.40 OCC(Cc1ccncc1)N Amb17062684 [0,1,0,0,0,0|2,0,0]=3 2464 B11R1.40 OCC(Cl)Cc1ccccc1 Amb24373181 [0,1,0,0,0,0|1,0,0]=2 2465 B11R1.40 OCC(F)Cc1ccccc1 Amb25225922 [0,1,0,0,0,0|1,0,0]=2 2466 B11R1.40 OCC(O)Cc1cc[n]c[n]1 Amb24353125 [0,1,0,0,0,0|3,0,0]=4 2467 B11R1.40 OCC(O)Nc1ccccc1 Amb25369775 [0,1,0,0,0,0|1,0,0]=2 2468 B11R1.40 OCC(Oc1ccccc1)C Amb17232100 [0,1,0,0,0,0|0,0,0]=1 2469 B11R1.40 OC[C@@H](O)Cc1ccccc1 Amb25204361 [0,1,0,0,0,0|1,0,0]=2 2470 B11R1.40 OC[C@H](Br)Cc1ccccc1 Amb24639076 [0,1,0,0,0,0|1,0,0]=2 2471 B11R1.40 OC[C@H](O)Cc1ccccc1 Amb24392862 [0,1,0,0,0,0|1,0,0]=2 2472 B11R1.40 OC\C(\Br)=C\c1ccccc1 Amb25187542 [0,1,0,0,0,0|1,0,1]=3 2473 B11R1.40 OC\C(\F)=C\c1cccc[n]1 Amb24354427 [0,1,0,0,0,0|2,0,1]=4 2474 B11R1.40 ONC(=O)Oc1ccccc1 Amb22493600 [0,1,0,0,0,0|1,0,1]=3 2475 B11R1.40 O[C@@H](CCl)Cc1ccccc1 Amb19929327 [0,1,0,0,0,0|2,0,0]=3 2476 B11R1.40 O[C@H](CBr)Cc1ccccc1 Amb24392488 [0,1,0,0,0,0|2,0,0]=3 2477 B11R1.40 O[C@H](CCl)Cc1ccccc1 Amb19929332 [0,1,0,0,0,0|2,0,0]=3 2478 B11R1.40 O[C@H](Cc1ccccc1)C=O Amb25683436 [0,1,0,0,0,0|1,0,2]=4 2479 B11R1.40 O\C(\Cc1ccccc1)=N/O Amb19986986 [0,1,0,0,0,0|2,0,1]=4 2480 B11R1.40 O\N=C(/Cc1ccccc1)\N Amb1106303 [0,1,0,0,0,0|2,0,1]=4 2481 B11R1.40 O\N=C(\Cc1ccccc1)/N Amb1159399 [0,1,0,0,0,0|2,0,1]=4 2482 B11R1.40 O\N=C(\Cl)/Cc1ccccc1 Amb25721012 [0,1,0,0,0,0|2,0,1]=4 2483 B11R1.40 SCC(=O)Nc1ccccc1 Amb1349645 [0,1,0,0,0,0|1,1,1]=4 2484 B11R1.91 C=C(Br)CSc1ccccc1 Amb24458275 [0,1,0,0,0,0|1,1,1]=4 2485 B11R1.91 C=C(Cl)CNc1ccccc1 Amb18289308 [0,1,0,0,0,0|2,0,1]=4 2486 B11R1.91 CC(=C)COc1cc[n]cc1 Amb24690034 [0,1,0,0,0,0|2,0,1]=4 2487 B11R1.91 CC(=C)COc1cccc[n]1 Amb25084698 [0,1,0,0,0,0|2,0,1]=4 2488 B11R1.91 CC(=C)COc1ccccc1 Amb10601706 [0,1,0,0,0,0|1,0,1]=3 2489 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [0,1,0,0,0,0|1,0,2]=4 2490 B11R1.91 CC(=O)NOc1ccccc1 Amb24104585 [0,1,0,0,0,0|1,0,2]=4 2491 B11R1.91 CC(Br)C#Cc1ccccc1 Amb25827119 [0,1,0,0,0,0|2,0,1]=4 2492 B11R1.91 CC(Br)COc1ccccc1 Amb25278262 [0,1,0,0,0,0|1,0,0]=2 2493 B11R1.91 CC(C#Cc1ccccn1)O Amb1039303 [0,1,0,0,0,0|2,0,1]=4 2494 B11R1.91 CC(C)COc1cc[n]cc1 Amb24377931 [0,1,0,0,0,0|2,0,0]=3 2495 B11R1.91 CC(C)CSc1cc[n]cc1 Amb25163189 [0,1,0,0,0,0|2,1,0]=4 2496 B11R1.91 CC(C)CSc1cccc[n]1 Amb25091920 [0,1,0,0,0,0|2,1,0]=4 2497 B11R1.91 CC(C)NNc1ccccc1 Amb24586606 [0,1,0,0,0,0|3,0,0]=4 2498 B11R1.91 CC(C)\C=C/c1ccccc1 Amb22546593 [0,1,0,0,0,0|2,0,1]=4 2499 B11R1.91 CC(C)\N=C\c1ccccc1 Amb22734192 [0,1,0,0,0,0|3,0,0]=4 2500 B11R1.91 CC(CCc1ccccn1)N Amb17507327 [0,1,0,0,0,0|3,0,0]=4 2501 B11R1.91 CC(CCc1ccccn1)O Amb17507263 [0,1,0,0,0,0|2,0,0]=3 2502 B11R1.91 CC(CCc1cccnc1)N Amb17507328 [0,1,0,0,0,0|3,0,0]=4 2503 B11R1.91 CC(CCc1cccnc1)O Amb17507264 [0,1,0,0,0,0|2,0,0]=3 2504 B11R1.91 CC(CCc1ccncc1)N Amb17507329 [0,1,0,0,0,0|3,0,0]=4 2505 B11R1.91 CC(CCc1ccncc1)O Amb17507265 [0,1,0,0,0,0|2,0,0]=3 2506 B11R1.91 CC(CNc1ccccn1)C Amb1843155 [0,1,0,0,0,0|3,0,0]=4 2507 B11R1.91 CC(CNc1cnccn1)O Amb2445430 [0,1,0,0,0,0|3,0,0]=4 2508 B11R1.91 CC(COc1ccccc1)N Amb10609380 [0,1,0,0,0,0|1,0,0]=2 2509 B11R1.91 CC(COc1ccccc1)N Amb1126967 [0,1,0,0,0,0|1,0,0]=2 2510 B11R1.91 CC(Cl)CCc1c[n]ccc1 Amb24486010 [0,1,0,0,0,0|3,0,0]=4 2511 B11R1.91 CC(Cl)CCc1cc[n]cc1 Amb24369393 [0,1,0,0,0,0|3,0,0]=4 2512 B11R1.91 CC(Cl)COc1ccccc1 Amb20248050 [0,1,0,0,0,0|1,0,0]=2 2513 B11R1.91 CC(Cl)CSc1ccccc1 Amb25361088 [0,1,0,0,0,0|1,1,0]=3 2514 B11R1.91 CC(N)C=Cc1ccccc1 Amb23536549 [0,1,0,0,0,0|2,0,1]=4 2515 B11R1.91 CC(N)CNc1cc[n]cc1 Amb25288005 [0,1,0,0,0,0|3,0,0]=4 2516 B11R1.91 CC(N)CNc1cccc[n]1 Amb18125324 [0,1,0,0,0,0|3,0,0]=4 2517 B11R1.91 CC(N)CNc1ccccc1 Amb18972362 [0,1,0,0,0,0|2,0,0]=3 2518 B11R1.91 CC(N)CSc1cccc[n]1 Amb22642666 [0,1,0,0,0,0|2,1,0]=4 2519 B11R1.91 CC(N)CSc1ccccc1 Amb18065472 [0,1,0,0,0,0|1,1,0]=3 2520 B11R1.91 CC(N)CSc1ccccc1 Amb21988436 [0,1,0,0,0,0|1,1,0]=3 2521 B11R1.91 CC(N)\C=C\c1ccccc1 Amb18124854 [0,1,0,0,0,0|2,0,1]=4 2522 B11R1.91 CC(N)\C=C\c1ccccc1 Amb21961471 [0,1,0,0,0,0|2,0,1]=4 2523 B11R1.91 CC(NCc1ccccc1)C Amb2118435 [0,1,0,0,0,0|3,0,0]=4 2524 B11R1.91 CC(O)C#Cc1ccccc1 Amb24101080 [0,1,0,0,0,0|1,0,1]=3 2525 B11R1.91 CC(O)CNc1c[n]c[n]c1 Amb18270237 [0,1,0,0,0,0|3,0,0]=4 2526 B11R1.91 CC(O)CNc1c[n]ccc1 Amb18933159 [0,1,0,0,0,0|2,0,0]=3 2527 B11R1.91 CC(O)CNc1cc[n]c[n]1 Amb18973902 [0,1,0,0,0,0|3,0,0]=4 2528 B11R1.91 CC(O)CNc1ccc[n][n]1 Amb18991549 [0,1,0,0,0,0|3,0,0]=4 2529 B11R1.91 CC(O)COc1c[n]ccc1 Amb24538290 [0,1,0,0,0,0|1,0,0]=2 2530 B11R1.91 CC(O)CSc1[n]ccc[n]1 Amb18180264 [0,1,0,0,0,0|2,1,0]=4 2531 B11R1.91 CC(O)CSc1cccc[n]1 Amb18180213 [0,1,0,0,0,0|1,1,0]=3 2532 B11R1.91 CC(O)CSc1ccccc1 Amb18793066 [0,1,0,0,0,0|0,1,0]=2 2533 B11R1.91 CC(O)OCc1ccccc1 Amb25070837 [0,1,0,0,0,0|2,0,0]=3 2534 B11R1.91 CC(O)\C=C\c1c[n]ccc1 Amb25847379 [0,1,0,0,0,0|2,0,1]=4 2535 B11R1.91 CC(S)CNc1ccccc1 Amb25701720 [0,1,0,0,0,0|1,1,0]=3 2536 B11R1.91 CC(\C=C\c1ccccc1)O Amb17593695 [0,1,0,0,0,0|1,0,1]=3 2537 B11R1.91 CN(C)CCc1ccccc1 Amb22350299 [0,1,0,0,0,0|3,0,0]=4 2538 B11R1.91 CN(N)CCc1ccccc1 Amb18064284 [0,1,0,0,0,0|3,0,0]=4 2539 B11R1.91 CN(O)CCc1cc[n]cc1 Amb25684228 [0,1,0,0,0,0|3,0,0]=4 2540 B11R1.91 CN(O)N=Nc1ccccc1 Amb24064881 [0,1,0,0,0,0|3,0,0]=4 2541 B11R1.91 C[C@@H](COc1ccccc1)N Amb17232092 [0,1,0,0,0,0|1,0,0]=2 2542 B11R1.91 C[C@@H](N)CCc1cc[n]cc1 Amb24551017 [0,1,0,0,0,0|3,0,0]=4 2543 B11R1.91 C[C@@H](N)CCc1cccc[n]1 Amb25076768 [0,1,0,0,0,0|3,0,0]=4 2544 B11R1.91 C[C@@H](N)CNc1cccc[n]1 Amb25320231 [0,1,0,0,0,0|3,0,0]=4 2545 B11R1.91 C[C@@H](N)CNc1ccccc1 Amb24392348 [0,1,0,0,0,0|2,0,0]=3 2546 B11R1.91 C[C@@H](N)COc1ccccc1 Amb18538481 [0,1,0,0,0,0|1,0,0]=2 2547 B11R1.91 C[C@@H](N)CSc1cccc[n]1 Amb24488293 [0,1,0,0,0,0|2,1,0]=4 2548 B11R1.91 C[C@@H](N)CSc1ccccc1 Amb24692771 [0,1,0,0,0,0|1,1,0]=3 2549 B11R1.91 C[C@@H](N)\C=C\c1ccccc1 Amb24359903 [0,1,0,0,0,0|2,0,1]=4 2550 B11R1.91 C[C@@H](O)C#Cc1cccc[n]1 Amb25299246 [0,1,0,0,0,0|2,0,1]=4 2551 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [0,1,0,0,0,0|1,0,0]=2 2552 B11R1.91 C[C@@H](O)CNc1[n]ccc[n]1 Amb24369939 [0,1,0,0,0,0|3,0,0]=4 2553 B11R1.91 C[C@@H](O)CNc1c[n]cc[n]1 Amb24631782 [0,1,0,0,0,0|3,0,0]=4 2554 B11R1.91 C[C@@H](O)CNc1cc[n]cc1 Amb24422164 [0,1,0,0,0,0|2,0,0]=3 2555 B11R1.91 C[C@@H](O)CNc1ccc[n][n]1 Amb24484066 [0,1,0,0,0,0|3,0,0]=4 2556 B11R1.91 C[C@@H](O)CNc1cccc[n]1 Amb24633004 [0,1,0,0,0,0|2,0,0]=3 2557 B11R1.91 C[C@@H](O)CSc1c[n]cc[n]1 Amb24739282 [0,1,0,0,0,0|2,1,0]=4 2558 B11R1.91 C[C@@H](O)CSc1c[n]ccc1 Amb25306432 [0,1,0,0,0,0|1,1,0]=3 2559 B11R1.91 C[C@@H](O)CSc1cc[n]c[n]1 Amb25782462 [0,1,0,0,0,0|2,1,0]=4 2560 B11R1.91 C[C@@H](O)CSc1cc[n]cc1 Amb25374733 [0,1,0,0,0,0|1,1,0]=3 2561 B11R1.91 C[C@@H](O)CSc1ccccc1 Amb25148170 [0,1,0,0,0,0|0,1,0]=2 2562 B11R1.91 C[C@@H](O)\C=C\c1c[n]ccc1 Amb24698684 [0,1,0,0,0,0|2,0,1]=4 2563 B11R1.91 C[C@H](N)C#Cc1ccccc1 Amb24408567 [0,1,0,0,0,0|2,0,1]=4 2564 B11R1.91 C[C@H](N)CCc1cc[n]cc1 Amb24715801 [0,1,0,0,0,0|3,0,0]=4 2565 B11R1.91 C[C@H](N)CNc1cccc[n]1 Amb24620429 [0,1,0,0,0,0|3,0,0]=4 2566 B11R1.91 C[C@H](N)CNc1ccccc1 Amb24423922 [0,1,0,0,0,0|2,0,0]=3 2567 B11R1.91 C[C@H](N)CSc1cc[n]cc1 Amb25051842 [0,1,0,0,0,0|2,1,0]=4 2568 B11R1.91 C[C@H](N)CSc1cccc[n]1 Amb24488292 [0,1,0,0,0,0|2,1,0]=4 2569 B11R1.91 C[C@H](N)CSc1ccccc1 Amb24486596 [0,1,0,0,0,0|1,1,0]=3 2570 B11R1.91 C[C@H](N)\C=C\c1ccccc1 Amb25809484 [0,1,0,0,0,0|2,0,1]=4 2571 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [0,1,0,0,0,0|1,0,0]=2 2572 B11R1.91 C[C@H](O)CNc1c[n]cc[n]1 Amb25318452 [0,1,0,0,0,0|3,0,0]=4 2573 B11R1.91 C[C@H](O)CNc1cc[n]cc1 Amb25838422 [0,1,0,0,0,0|2,0,0]=3 2574 B11R1.91 C[C@H](O)CNc1ccc[n][n]1 Amb24448830 [0,1,0,0,0,0|3,0,0]=4 2575 B11R1.91 C[C@H](O)CNc1cccc[n]1 Amb25698310 [0,1,0,0,0,0|2,0,0]=3 2576 B11R1.91 C[C@H](O)CNc1ccccc1 Amb25060992 [0,1,0,0,0,0|1,0,0]=2 2577 B11R1.91 C[C@H](O)COc1c[n]ccc1 Amb25148164 [0,1,0,0,0,0|1,0,0]=2 2578 B11R1.91 C[C@H](O)COc1ccccc1 Amb25786939 [0,1,0,0,0,0|0,0,0]=1 2579 B11R1.91 C[C@H](O)CSc1[n]ccc[n]1 Amb25675970 [0,1,0,0,0,0|2,1,0]=4 2580 B11R1.91 C[C@H](O)CSc1cc[n]c[n]1 Amb25211625 [0,1,0,0,0,0|2,1,0]=4 2581 B11R1.91 C[C@H](O)CSc1cc[n]cc1 Amb25073090 [0,1,0,0,0,0|1,1,0]=3 2582 B11R1.91 C[C@H](O)CSc1ccccc1 Amb25852129 [0,1,0,0,0,0|0,1,0]=2 2583 B11R1.91 C[SiH](C)CCc1ccccc1 Amb22338692 [0,1,0,0,0,0|2,1,0]=4 2584 B11R1.91 C\C(\N)=C\Oc1ccccc1 Amb24674154 [0,1,0,0,0,0|1,0,2]=4 2585 B11R1.91 C\C(\N)=N\Oc1ccccc1 Amb25042875 [0,1,0,0,0,0|2,0,1]=4 2586 B11R1.91 ClC(Cl)CNc1ccccc1 Amb24720107 [0,1,0,0,0,0|2,0,0]=3 2587 B11R1.91 ClC(Cl)COc1ccccc1 Amb24417608 [0,1,0,0,0,0|1,0,0]=2 2588 B11R1.91 ClC(Cl)CSc1cccc[n]1 Amb25717407 [0,1,0,0,0,0|2,1,0]=4 2589 B11R1.91 ClC(Cl)\C=C\c1ccccc1 Amb24634340 [0,1,0,0,0,0|2,0,1]=4 2590 B11R1.91 FC(Cl)C#Cc1ccccc1 Amb24538299 [0,1,0,0,0,0|2,0,1]=4 2591 B11R1.91 FC(F)CNc1cccc[n]1 Amb24374282 [0,1,0,0,0,0|3,0,0]=4 2592 B11R1.91 FC(F)CNc1ccccc1 Amb18791799 [0,1,0,0,0,0|2,0,0]=3 2593 B11R1.91 FC(F)CNc1ccccc1 Amb20623918 [0,1,0,0,0,0|2,0,0]=3 2594 B11R1.91 FC(F)COc1c[n]ccc1 Amb24607865 [0,1,0,0,0,0|2,0,0]=3 2595 B11R1.91 FC(F)COc1cc[n]cc1 Amb24350681 [0,1,0,0,0,0|2,0,0]=3 2596 B11R1.91 FC(F)COc1ccccc1 Amb22008298 [0,1,0,0,0,0|1,0,0]=2 2597 B11R1.91 FC(F)CSc1cc[n]cc1 Amb24423058 [0,1,0,0,0,0|2,1,0]=4 2598 B11R1.91 FC(F)CSc1ccccc1 Amb25668847 [0,1,0,0,0,0|1,1,0]=3 2599 B11R1.91 NC(=N)CNc1ccccc1 Amb24426634 [0,1,0,0,0,0|2,0,1]=4 2600 B11R1.91 NC(=O)NOc1ccccc1 Amb24726052 [0,1,0,0,0,0|1,0,2]=4 2601 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [0,1,0,0,0,0|1,1,1]=4 2602 B11R1.91 NC(=S)CNc1ccccc1 Amb17232624 [0,1,0,0,0,0|1,1,1]=4 2603 B11R1.91 NC(=S)COc1ccccc1 Amb1155418 [0,1,0,0,0,0|0,1,1]=3 2604 B11R1.91 O=C(S)CCc1ccccc1 Amb24733716 [0,1,0,0,0,0|1,0,2]=4 2605 B11R1.91 O=S(Cl)CCc1ccccc1 Amb25371638 [0,1,0,0,0,0|2,0,1]=4 2606 B11R1.91 OB(CCc1ccccc1)O Amb2456045 [0,1,0,0,0,0|2,0,0]=3 2607 B11R1.91 OB(O)C#Cc1ccccc1 Amb25151882 [0,1,0,0,0,0|2,0,1]=4 2608 B11R1.91 OB(O)CCc1c[n]ccc1 Amb25259201 [0,1,0,0,0,0|3,0,0]=4 2609 B11R1.91 OB(O)CCc1cccc[n]1 Amb24392967 [0,1,0,0,0,0|3,0,0]=4 2610 B11R1.91 OB(O)CSc1cccc[n]1 Amb22388601 [0,1,0,0,0,0|2,1,0]=4 2611 B11R1.91 OB(O)O[Hg]c1ccccc1 Amb22345921 [0,1,0,0,0,0|3,0,0]=4 2612 B11R1.91 OB(O)\C=C/c1ccccc1 Amb24117859 [0,1,0,0,0,0|2,0,1]=4 2613 B11R1.91 OB(\C=C\c1ccccc1)O Amb2447227 [0,1,0,0,0,0|2,0,1]=4 2614 B11R1.91 OC(=O)CCc1ccccc1 Amb22366916 [0,1,0,0,0,0|1,0,1]=3 2615 B11R1.91 OC(=O)CCc1ccccn1 Amb1102533 [0,1,0,0,0,0|2,0,1]=4 2616 B11R1.91 OC(=O)CCc1cccnc1 Amb1214870 [0,1,0,0,0,0|2,0,1]=4 2617 B11R1.91 OC(=O)CCc1ccncc1 Amb1090849 [0,1,0,0,0,0|2,0,1]=4 2618 B11R1.91 OC(=O)CNc1cc[n]cc1 Amb21955325 [0,1,0,0,0,0|2,0,1]=4 2619 B11R1.91 OC(=O)CNc1ccc[n]c1 Amb22035240 [0,1,0,0,0,0|2,0,1]=4 2620 B11R1.91 OC(=O)CNc1cccc[nH+]1 Amb10564534 [0,1,0,0,0,0|2,0,1]=4 2621 B11R1.91 OC(=O)CNc1cccc[n]1 Amb22495404 [0,1,0,0,0,0|2,0,1]=4 2622 B11R1.91 OC(=O)CNc1cccnc1 Amb17593781 [0,1,0,0,0,0|2,0,1]=4 2623 B11R1.91 OC(=O)COc1c[n]ccc1 Amb22738612 [0,1,0,0,0,0|1,0,1]=3 2624 B11R1.91 OC(=O)COc1cc[n]cc1 Amb18125520 [0,1,0,0,0,0|1,0,1]=3 2625 B11R1.91 OC(=O)COc1ccc[nH+]c1 Amb22370885 [0,1,0,0,0,0|1,0,1]=3 2626 B11R1.91 OC(=O)COc1ccccc1 Amb1213413 [0,1,0,0,0,0|0,0,1]=2 2627 B11R1.91 OC(=O)COc1ccccc1 Amb22274444 [0,1,0,0,0,0|0,0,1]=2 2628 B11R1.91 OC(=O)CPc1ccccc1 Amb24487808 [0,1,0,0,0,0|1,0,1]=3 2629 B11R1.91 OC(=O)CSc1cc[n]cc1 Amb24053001 [0,1,0,0,0,0|1,1,1]=4 2630 B11R1.91 OC(=O)CSc1ccc[n]c1 Amb24692785 [0,1,0,0,0,0|1,1,1]=4 2631 B11R1.91 OC(=O)CSc1ccccc1 Amb1038999 [0,1,0,0,0,0|0,1,1]=3 2632 B11R1.91 OC(=O)CSc1ccccn1 Amb1130490 [0,1,0,0,0,0|1,1,1]=4 2633 B11R1.91 OC(=O)NCc1ccccc1 Amb10603977 [0,1,0,0,0,0|2,0,1]=4 2634 B11R1.91 OC(=O)[13CH2][13CH2]c1ccccc1 Amb22336575 [0,1,0,0,0,0|1,0,1]=3 2635 B11R1.91 OC(=O)\C=C\c1ccccc1 Amb22366387 [0,1,0,0,0,0|1,0,2]=4 2636 B11R1.91 OC(=O)\C=N\c1ccccc1 Amb25243930 [0,1,0,0,0,0|1,0,2]=4 2637 B11R1.91 OC(O)CCc1ccccc1 Amb25829695 [0,1,0,0,0,0|1,0,0]=2 2638 B11R1.91 OS(=O)CCc1cc[n]cc1 Amb24546017 [0,1,0,0,0,0|3,0,0]=4 2639 B11R1.91 OS(=O)CNc1ccccc1 Amb25798133 [0,1,0,0,0,0|2,0,0]=3 2640 B11R1.91 O[13C](=O)[13CH2][13CH2]c1ccccc1 Amb22336771 [0,1,0,0,0,0|1,0,1]=3 2641 B11R1.91 SC(=S)CCc1ccccc1 Amb24439493 [0,1,0,0,0,0|1,1,1]=4 2642 B11R1.91 [O-]C(=O)CCc1ccccc1 Amb22233349 [0,1,0,0,0,0|1,0,2]=4 2643 B11R1.91 [O-]C(=O)CNc1ccccc1 Amb21520409 [0,1,0,0,0,0|1,0,2]=4 2644 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22167530 [0,1,0,0,0,0|0,0,2]=3 2645 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22734447 [0,1,0,0,0,0|0,0,2]=3 2646 B11R1.91 [O-][N+](=O)CCc1ccccc1 Amb16192705 [0,1,0,0,0,0|2,0,1]=4 2647 B11R1.91 [O-][N+](=O)CSc1ccccc1 Amb25689622 [0,1,0,0,0,0|1,1,1]=4 2648 B9R0.18 C=CCNC(=O)OCCO Amb24478916 [0,0,1,0,0,0|2,0,1]=4 2649 B9R0.18 C=C\C=C\P(=O)OCCCl Amb24519201 [0,0,1,0,0,0|3,0,0]=4 2650 B9R0.18 CC(\C=C\C=C)OCCCl Amb24428942 [0,0,1,0,0,0|1,0,2]=4 2651 B9R0.18 CCCCC(=C)\C=C\C=O Amb18124519 [0,0,1,0,0,0|3,0,0]=4 2652 B9R0.18 CCCCC(=O)\C=C\C=C Amb25338203 [0,0,1,0,0,0|3,0,0]=4 2653 B9R0.18 CCCOC(=O)\C=C\C=O Amb24478353 [0,0,1,0,0,0|3,0,0]=4 2654 B9R0.18 CC\C=C\C(=O)OCCO Amb25080636 [0,0,1,0,0,0|1,0,2]=4 2655 B9R0.18 CS\C=C\C(=O)OCCO Amb24476257 [0,0,1,0,0,0|2,0,1]=4 2656 B9R0.40 C=CC(CCCO)CC=C Amb24613508 [0,0,1,0,0,0|1,0,2]=4 2657 B9R0.40 C=C\C(\CCCCl)=C/C=O Amb24478178 [0,0,1,0,0,0|3,0,0]=4 2658 B9R0.45 C=CC=CC=CC=CCO Amb25052157 [0,0,1,0,0,0|1,0,1]=3 2659 B9R0.45 CC=CC=CC=CCCO Amb25129709 [0,0,1,0,0,0|1,0,1]=3 2660 B9R0.45 CC=CC=CC=NCCO Amb24442192 [0,0,1,0,0,0|1,0,1]=3 2661 B9R0.45 CC=CC=CCCCCO Amb22231339 [0,0,1,0,0,0|1,0,2]=4 2662 B9R0.45 CCCC\C=C/C=C/C=O Amb25770096 [0,0,1,0,0,0|3,0,0]=4 2663 B9R0.45 CC\C=C\C=CCCCO Amb24466260 [0,0,1,0,0,0|1,0,2]=4 2664 B9R0.45 C\C=C\C=C/C=C/CCC Amb22641677 [0,0,1,0,0,0|2,0,1]=4 2665 B9R0.45 C\C=C\C=C=CCCCO Amb25058490 [0,0,1,0,0,0|1,0,2]=4 2666 B9R0.45 C\C=C\C=CCCCCO Amb25238019 [0,0,1,0,0,0|1,0,2]=4 2667 B9R0.45 C\C=C\C=COCCCO Amb24474136 [0,0,1,0,0,0|2,0,1]=4 2668 B11R2.1 BN1CCc2ccccc12 Amb25180693 [0,0,0,1,0,0|3,0,0]=4 2669 B11R2.1 BrC1C=Cc2ccccc21 Amb25101590 [0,0,0,1,0,0|2,0,1]=4 2670 B11R2.1 BrC1N=Nc2ccccc21 Amb20246825 [0,0,0,1,0,0|3,0,0]=4 2671 B11R2.1 BrC1NCc2ccccc21 Amb22500144 [0,0,0,1,0,0|3,0,0]=4 2672 B11R2.1 Brc1[n]oc2ccccc21 Amb18187786 [0,0,0,1,0,0|2,0,1]=4 2673 B11R2.1 C=C1CCc2ccccc21 Amb24458532 [0,0,0,1,0,0|2,0,1]=4 2674 B11R2.1 CC1C=Cc2ccccc12 Amb17844052 [0,0,0,1,0,0|2,0,1]=4 2675 B11R2.1 CC1CCc2[n]cccc21 Amb24071595 [0,0,0,1,0,0|3,0,0]=4 2676 B11R2.1 CC1CCc2c[n]ccc21 Amb25691244 [0,0,0,1,0,0|3,0,0]=4 2677 B11R2.1 CC1CNc2ccccc21 Amb20241016 [0,0,0,1,0,0|2,0,0]=3 2678 B11R2.1 CC1COc2ccc[n]c21 Amb24102372 [0,0,0,1,0,0|2,0,0]=3 2679 B11R2.1 CC1CSc2ccccc12 Amb17939280 [0,0,0,1,0,0|1,1,0]=3 2680 B11R2.1 CC1NCc2ccccc21 Amb20623497 [0,0,0,1,0,0|3,0,0]=4 2681 B11R2.1 CC1SCc2ccccc21 Amb24092837 [0,0,0,1,0,0|3,0,0]=4 2682 B11R2.1 CN1CCc2c1cccc2 Amb15691717 [0,0,0,1,0,0|3,0,0]=4 2683 B11R2.1 CN1CNc2ccccc12 Amb25260683 [0,0,0,1,0,0|3,0,0]=4 2684 B11R2.1 C[C@@H]1CNc2ccccc21 Amb25069285 [0,0,0,1,0,0|2,0,0]=3 2685 B11R2.1 C[C@@H]1NCc2ccccc21 Amb25353679 [0,0,0,1,0,0|3,0,0]=4 2686 B11R2.1 C[SiH]1CCc2ccccc12 Amb24065297 [0,0,0,1,0,0|2,1,0]=4 2687 B11R2.1 ClC1C=Nc2ccccc21 Amb24078935 [0,0,0,1,0,0|2,0,1]=4 2688 B11R2.1 ClC1CCc2[n]cccc21 Amb25321724 [0,0,0,1,0,0|3,0,0]=4 2689 B11R2.1 Cl[C@@H]1C=Cc2ccccc21 Amb24518031 [0,0,0,1,0,0|2,0,1]=4 2690 B11R2.1 Cl[C@H]1C=Cc2ccccc21 Amb25783948 [0,0,0,1,0,0|2,0,1]=4 2691 B11R2.1 Clc1coc2ccccc21 Amb21963868 [0,0,0,1,0,0|1,0,2]=4 2692 B11R2.1 FC1CCc2ccccc21 Amb25311534 [0,0,0,1,0,0|2,0,0]=3 2693 B11R2.1 FC1CNc2ccccc21 Amb20242176 [0,0,0,1,0,0|2,0,0]=3 2694 B11R2.1 FC1NCc2ccccc21 Amb22504231 [0,0,0,1,0,0|3,0,0]=4 2695 B11R2.1 Fc1coc2ccccc21 Amb24409168 [0,0,0,1,0,0|1,0,2]=4 2696 B11R2.1 Ic1[n]oc2ccccc21 Amb25320384 [0,0,0,1,0,0|2,0,1]=4 2697 B11R2.1 Ic1coc2ccccc21 Amb24622374 [0,0,0,1,0,0|1,0,2]=4 2698 B11R2.1 N=S1CNc2ccccc12 Amb24465157 [0,0,0,1,0,0|3,0,0]=4 2699 B11R2.1 NC1C=Cc2c1cccc2 Amb17470367 [0,0,0,1,0,0|2,0,1]=4 2700 B11R2.1 NC1CCc2[n]cccc21 Amb21858247 [0,0,0,1,0,0|3,0,0]=4 2701 B11R2.1 NC1CCc2[n]cccc21 Amb22490383 [0,0,0,1,0,0|3,0,0]=4 2702 B11R2.1 NC1CCc2c1cccc2 Amb1158023 [0,0,0,1,0,0|2,0,0]=3 2703 B11R2.1 NC1CCc2c1cccc2 Amb16233857 [0,0,0,1,0,0|2,0,0]=3 2704 B11R2.1 NC1CCc2c[n]ccc21 Amb22900659 [0,0,0,1,0,0|3,0,0]=4 2705 B11R2.1 NC1CCc2cc[n]cc21 Amb24738463 [0,0,0,1,0,0|3,0,0]=4 2706 B11R2.1 NC1CCc2ccc[n]c21 Amb21858242 [0,0,0,1,0,0|3,0,0]=4 2707 B11R2.1 NC1CCc2ccc[n]c21 Amb22436792 [0,0,0,1,0,0|3,0,0]=4 2708 B11R2.1 NC1CCc2ccccc21 Amb24078253 [0,0,0,1,0,0|2,0,0]=3 2709 B11R2.1 NC1CNc2ccccc21 Amb24555894 [0,0,0,1,0,0|2,0,0]=3 2710 B11R2.1 NC1COc2[n][n]ccc21 Amb25846154 [0,0,0,1,0,0|3,0,0]=4 2711 B11R2.1 NC1COc2[n]cccc21 Amb25324317 [0,0,0,1,0,0|2,0,0]=3 2712 B11R2.1 NC1COc2c1cccc2 Amb13951643 [0,0,0,1,0,0|1,0,0]=2 2713 B11R2.1 NC1COc2c1cccc2 Amb2383232 [0,0,0,1,0,0|1,0,0]=2 2714 B11R2.1 N[C@@H]1CCc2c1cccc2 Amb16233854 [0,0,0,1,0,0|2,0,0]=3 2715 B11R2.1 N[C@@H]1CCc2ccc[n]c21 Amb22748121 [0,0,0,1,0,0|3,0,0]=4 2716 B11R2.1 N[C@@H]1COc2ccccc21 Amb23440344 [0,0,0,1,0,0|1,0,0]=2 2717 B11R2.1 N[C@@H]1COc2ccccc21 Amb24426876 [0,0,0,1,0,0|1,0,0]=2 2718 B11R2.1 N[C@H]1CCc2cc[n]cc21 Amb24502269 [0,0,0,1,0,0|3,0,0]=4 2719 B11R2.1 N[C@H]1CCc2ccccc21 Amb20242239 [0,0,0,1,0,0|2,0,0]=3 2720 B11R2.1 N[C@H]1COc2ccccc21 Amb25147252 [0,0,0,1,0,0|1,0,0]=2 2721 B11R2.1 Nc1coc2ccccc21 Amb24371464 [0,0,0,1,0,0|1,0,2]=4 2722 B11R2.1 Nc1noc2c1cccc2 Amb1323334 [0,0,0,1,0,0|2,0,1]=4 2723 B11R2.1 O=C1CNc2c1cccc2 Amb17593399 [0,0,0,1,0,0|1,0,2]=4 2724 B11R2.1 O=C1CNc2ccccc21 Amb22899450 [0,0,0,1,0,0|1,0,2]=4 2725 B11R2.1 O=C1COc2[n]cccc21 Amb20242022 [0,0,0,1,0,0|1,0,2]=4 2726 B11R2.1 O=C1COc2c1cccc2 Amb2383539 [0,0,0,1,0,0|0,0,2]=3 2727 B11R2.1 O=C1COc2c[n]ccc21 Amb20242099 [0,0,0,1,0,0|1,0,2]=4 2728 B11R2.1 O=C1COc2c[n]ccc21 Amb22728783 [0,0,0,1,0,0|1,0,2]=4 2729 B11R2.1 O=C1COc2cc[n]cc21 Amb20242098 [0,0,0,1,0,0|1,0,2]=4 2730 B11R2.1 O=C1COc2ccc[n]c21 Amb22372216 [0,0,0,1,0,0|1,0,2]=4 2731 B11R2.1 O=S1CNc2ccccc12 Amb24091032 [0,0,0,1,0,0|2,0,1]=4 2732 B11R2.1 OB1COc2ccccc21 Amb25132941 [0,0,0,1,0,0|1,0,0]=2 2733 B11R2.1 OB1OCc2c1cccc2 Amb1027843 [0,0,0,1,0,0|3,0,0]=4 2734 B11R2.1 OC1C=Cc2ccccc21 Amb24479258 [0,0,0,1,0,0|1,0,1]=3 2735 B11R2.1 OC1CCc2[n]cc[n]c21 Amb25285703 [0,0,0,1,0,0|3,0,0]=4 2736 B11R2.1 OC1CCc2c1cccn2 Amb16231393 [0,0,0,1,0,0|2,0,0]=3 2737 B11R2.1 OC1CCc2ccc[n]c21 Amb19958431 [0,0,0,1,0,0|2,0,0]=3 2738 B11R2.1 OC1COc2[n]cccc21 Amb21963377 [0,0,0,1,0,0|1,0,0]=2 2739 B11R2.1 OC1COc2c[n]ccc21 Amb24101551 [0,0,0,1,0,0|1,0,0]=2 2740 B11R2.1 OC1COc2ccc[n]c21 Amb24101560 [0,0,0,1,0,0|1,0,0]=2 2741 B11R2.1 OC1COc2ccccc21 Amb24104532 [0,0,0,1,0,0|0,0,0]=1 2742 B11R2.1 OC1OCc2ccc[n]c21 Amb25266798 [0,0,0,1,0,0|3,0,0]=4 2743 B11R2.1 OC1OCc2ccccc21 Amb21858794 [0,0,0,1,0,0|2,0,0]=3 2744 B11R2.1 O[C@@H]1CCc2[n]cccc21 Amb24511690 [0,0,0,1,0,0|2,0,0]=3 2745 B11R2.1 O[C@@H]1CCc2c1cccc2 Amb13953023 [0,0,0,1,0,0|1,0,0]=2 2746 B11R2.1 O[C@@H]1CCc2ccc[n]c21 Amb22745812 [0,0,0,1,0,0|2,0,0]=3 2747 B11R2.1 O[C@H]1C=Cc2ccccc21 Amb24748284 [0,0,0,1,0,0|1,0,1]=3 2748 B11R2.1 O[C@H]1CCc2c1cccc2 Amb13953022 [0,0,0,1,0,0|1,0,0]=2 2749 B11R2.1 O[C@H]1CSc2ccccc21 Amb25356604 [0,0,0,1,0,0|0,1,0]=2 2750 B11R2.1 O[n+]1c[nH]c2ccccc12 Amb24729556 [0,0,0,1,0,0|2,0,1]=4 2751 B11R2.1 Oc1[n][s]c2ccccc21 Amb22166851 [0,0,0,1,0,0|1,1,1]=4 2752 B11R2.1 Oc1[s][n]c2ccccc21 Amb22059084 [0,0,0,1,0,0|2,0,1]=4 2753 B11R2.1 Oc1coc2ccc[n]c21 Amb21963453 [0,0,0,1,0,0|1,0,2]=4 2754 B11R2.1 Oc1coc2ccccc21 Amb24097480 [0,0,0,1,0,0|0,0,2]=3 2755 B11R2.1 Oc1noc2c1ccnc2 Amb10975477 [0,0,0,1,0,0|2,0,1]=4 2756 B11R2.1 On1nnc2c1cccc2 Amb1151367 [0,0,0,1,0,0|3,0,0]=4 2757 B11R2.1 S=c1[nH]oc2ccccc21 Amb24060603 [0,0,0,1,0,0|1,1,1]=4 2758 B11R2.1 SC1CCc2ccc[n]c21 Amb24071779 [0,0,0,1,0,0|2,1,0]=4 2759 B11R2.1 Sc1coc2ccccc21 Amb24061893 [0,0,0,1,0,0|0,1,2]=4 2760 B11R2.1 [Ti+3]C1C=Cc2ccccc21 Amb22053615 [0,0,0,1,0,0|2,0,1]=4 2761 B11R2.4 BrC1CC1c2ccc[n]c2 Amb24411334 [0,0,0,1,0,0|3,0,0]=4 2762 B11R2.4 BrC1CC1c2ccccc2 Amb23454923 [0,0,0,1,0,0|2,0,0]=3 2763 B11R2.4 Br[C@@H]1C[C@H]1c2cc[n]cc2 Amb24673977 [0,0,0,1,0,0|3,0,0]=4 2764 B11R2.4 Br[C@@H]1C[C@H]1c2cccc[n]2 Amb25840547 [0,0,0,1,0,0|3,0,0]=4 2765 B11R2.4 Br[C@@H]1C[C@H]1c2ccccc2 Amb25791511 [0,0,0,1,0,0|2,0,0]=3 2766 B11R2.4 C=C1CC1c2ccccc2 Amb22733871 [0,0,0,1,0,0|2,0,1]=4 2767 B11R2.4 CC1CC1c2ccccc2 Amb16236859 [0,0,0,1,0,0|2,0,0]=3 2768 B11R2.4 CC1NC1c2ccccc2 Amb24056775 [0,0,0,1,0,0|3,0,0]=4 2769 B11R2.4 CC1OC1c2ccccc2 Amb1129298 [0,0,0,1,0,0|3,0,0]=4 2770 B11R2.4 C[C@@H]1O[C@H]1c2ccccc2 Amb22367029 [0,0,0,1,0,0|3,0,0]=4 2771 B11R2.4 C[C@H]1O[C@@H]1c2ccccc2 Amb22224838 [0,0,0,1,0,0|3,0,0]=4 2772 B11R2.4 ClC1OC1c2ccccc2 Amb24372881 [0,0,0,1,0,0|3,0,0]=4 2773 B11R2.4 FC1CC1c2ccccc2 Amb25267358 [0,0,0,1,0,0|2,0,0]=3 2774 B11R2.4 F[C@@H]1C[C@@H]1c2ccccc2 Amb24600206 [0,0,0,1,0,0|2,0,0]=3 2775 B11R2.4 F[C@@H]1C[C@H]1c2ccccc2 Amb24538986 [0,0,0,1,0,0|2,0,0]=3 2776 B11R2.4 NC1CC1c2ccccc2 Amb19514914 [0,0,0,1,0,0|2,0,0]=3 2777 B11R2.4 NC1CC1c2ccccc2 Amb22729761 [0,0,0,1,0,0|2,0,0]=3 2778 B11R2.4 NC1OC1c2ccccc2 Amb25724793 [0,0,0,1,0,0|3,0,0]=4 2779 B11R2.4 NN1CC1c2ccccc2 Amb17593419 [0,0,0,1,0,0|3,0,0]=4 2780 B11R2.4 N[C@@H]1CC1c2ccccc2 Amb25077262 [0,0,0,1,0,0|2,0,0]=3 2781 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24183509 [0,0,0,1,0,0|2,0,0]=3 2782 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24579866 [0,0,0,1,0,0|2,0,0]=3 2783 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb22231696 [0,0,0,1,0,0|2,0,0]=3 2784 B11R2.4 N[C@H]1C[C@@H]1c2ccc[n]c2 Amb24604839 [0,0,0,1,0,0|3,0,0]=4 2785 B11R2.4 N[C@H]1C[C@@H]1c2ccccc2 Amb22735917 [0,0,0,1,0,0|2,0,0]=3 2786 B11R2.4 O=C1CC1c2ccccc2 Amb25689197 [0,0,0,1,0,0|1,0,2]=4 2787 B11R2.4 OC1CC1c2ccccc2 Amb17593413 [0,0,0,1,0,0|1,0,0]=2 2788 B11R2.4 O[C@H]1C[C@@H]1c2ccccc2 Amb17689138 [0,0,0,1,0,0|1,0,0]=2 2789 B11R2.20 B1OCc2ccccc2O1 Amb25185117 [0,0,0,1,0,0|3,0,0]=4 2790 B11R2.20 C1=Cc2c(CC1)cccc2 Amb1162229 [0,0,0,1,0,0|2,0,1]=4 2791 B11R2.20 C1=Cc2c(NC1)cccc2 Amb17593383 [0,0,0,1,0,0|2,0,1]=4 2792 B11R2.20 C1=Nc2c(NC1)cccc2 Amb10174686 [0,0,0,1,0,0|2,0,1]=4 2793 B11R2.20 C1=Nc2c(SC1)cccc2 Amb10976509 [0,0,0,1,0,0|1,1,1]=4 2794 B11R2.20 C1C=COc2ccccc21 Amb24715811 [0,0,0,1,0,0|1,0,2]=4 2795 B11R2.20 C1C=Cc2[n]cccc2O1 Amb22896485 [0,0,0,1,0,0|2,0,1]=4 2796 B11R2.20 C1C=Cc2c[n]ccc2O1 Amb24665756 [0,0,0,1,0,0|2,0,1]=4 2797 B11R2.20 C1C=Cc2cc[n]cc2O1 Amb24065645 [0,0,0,1,0,0|2,0,1]=4 2798 B11R2.20 C1C=Nc2[n]cccc2O1 Amb25707817 [0,0,0,1,0,0|2,0,1]=4 2799 B11R2.20 C1CC=C2C=NC=CC2=C1 Amb24612787 [0,0,0,1,0,0|3,0,0]=4 2800 B11R2.20 C1CCCc2ccccc21 Amb22351371 [0,0,0,1,0,0|2,0,0]=3 2801 B11R2.20 C1CCN2C=CC=CC2=N1 Amb22055140 [0,0,0,1,0,0|3,0,0]=4 2802 B11R2.20 C1CCNc2c[n]ccc21 Amb21864834 [0,0,0,1,0,0|3,0,0]=4 2803 B11R2.20 C1CCNc2c[n]ccc21 Amb22491315 [0,0,0,1,0,0|3,0,0]=4 2804 B11R2.20 C1CCNc2c[n]ccc21 Amb22751690 [0,0,0,1,0,0|3,0,0]=4 2805 B11R2.20 C1CCOc2[n]cccc21 Amb22753924 [0,0,0,1,0,0|2,0,0]=3 2806 B11R2.20 C1CCc2c(C1)nccc2 Amb2390042 [0,0,0,1,0,0|3,0,0]=4 2807 B11R2.20 C1CCc2c(N1)cccc2 Amb10072811 [0,0,0,1,0,0|2,0,0]=3 2808 B11R2.20 C1CCc2c(N1)cccc2 Amb1869492 [0,0,0,1,0,0|2,0,0]=3 2809 B11R2.20 C1CCc2c(S1)cccc2 Amb2237019 [0,0,0,1,0,0|1,1,0]=3 2810 B11R2.20 C1CNNc2ccccc21 Amb24564127 [0,0,0,1,0,0|3,0,0]=4 2811 B11R2.20 C1CNc2c(C1)cccn2 Amb15692065 [0,0,0,1,0,0|3,0,0]=4 2812 B11R2.20 C1CNc2c(N1)nccc2 Amb10603351 [0,0,0,1,0,0|3,0,0]=4 2813 B11R2.20 C1CNc2c(O1)cccc2 Amb2371970 [0,0,0,1,0,0|1,0,0]=2 2814 B11R2.20 C1CNc2c(S1)cccc2 Amb1104964 [0,0,0,1,0,0|1,1,0]=3 2815 B11R2.20 C1CNc2c[n]ccc2N1 Amb20622788 [0,0,0,1,0,0|3,0,0]=4 2816 B11R2.20 C1COc2[n]cc[n]c2N1 Amb24520491 [0,0,0,1,0,0|3,0,0]=4 2817 B11R2.20 C1COc2c(C1)cncc2 Amb13889664 [0,0,0,1,0,0|2,0,0]=3 2818 B11R2.20 C1COc2c(C1)nccc2 Amb13889663 [0,0,0,1,0,0|2,0,0]=3 2819 B11R2.20 C1COc2c(N1)cccn2 Amb13890253 [0,0,0,1,0,0|2,0,0]=3 2820 B11R2.20 C1COc2c(N1)ccnc2 Amb13890252 [0,0,0,1,0,0|2,0,0]=3 2821 B11R2.20 C1COc2c(O1)nccc2 Amb13889670 [0,0,0,1,0,0|1,0,0]=2 2822 B11R2.20 C1COc2c[n]c[n]c2N1 Amb25097976 [0,0,0,1,0,0|3,0,0]=4 2823 B11R2.20 C1COc2cc[n]cc2N1 Amb20622566 [0,0,0,1,0,0|2,0,0]=3 2824 B11R2.20 C1COc2ccccc2N1 Amb18090793 [0,0,0,1,0,0|1,0,0]=2 2825 B11R2.20 C1CSC2=CC=CNC2=N1 Amb24423182 [0,0,0,1,0,0|2,1,0]=4 2826 B11R2.20 C1CSc2[n]cccc2N1 Amb19148121 [0,0,0,1,0,0|2,1,0]=4 2827 B11R2.20 C1CSc2cc[n]cc2N1 Amb20667582 [0,0,0,1,0,0|2,1,0]=4 2828 B11R2.20 C1CSc2ccccc2O1 Amb19374957 [0,0,0,1,0,0|0,1,0]=2 2829 B11R2.20 C1C[NH+]=Cc2ccccc21 Amb23569648 [0,0,0,1,0,0|3,0,0]=4 2830 B11R2.20 C1N=Cc2[n]cccc2O1 Amb24424648 [0,0,0,1,0,0|3,0,0]=4 2831 B11R2.20 C1NCNc2ccccc21 Amb25147572 [0,0,0,1,0,0|3,0,0]=4 2832 B11R2.20 C1NCOc2ccccc21 Amb24087478 [0,0,0,1,0,0|2,0,0]=3 2833 B11R2.20 C1Nc2ccccc2C=N1 Amb25147432 [0,0,0,1,0,0|3,0,0]=4 2834 B11R2.20 C1OCOc2[n]cccc21 Amb24079202 [0,0,0,1,0,0|3,0,0]=4 2835 B11R2.20 C1OCOc2c[n]ccc21 Amb24079203 [0,0,0,1,0,0|3,0,0]=4 2836 B11R2.20 C1OCOc2ccccc21 Amb24066080 [0,0,0,1,0,0|2,0,0]=3 2837 B11R2.20 C1Oc2ccccc2C=C1 Amb17844055 [0,0,0,1,0,0|1,0,1]=3 2838 B11R2.20 C1PCNc2ccccc21 Amb25737691 [0,0,0,1,0,0|3,0,0]=4 2839 B11R2.20 C1SCCc2ccccc21 Amb24085482 [0,0,0,1,0,0|3,0,0]=4 2840 B11R2.20 N1CCc2c(C1)cccc2 Amb2383348 [0,0,0,1,0,0|3,0,0]=4 2841 B11R2.20 c1ccc2c(c1)C=NCC2 Amb10603654 [0,0,0,1,0,0|3,0,0]=4 2842 B11R2.20 c1ccc2c(c1)C=[NH+]CC2 Amb10553686 [0,0,0,1,0,0|3,0,0]=4 2843 B11R2.238 C(C1CC1)c2ccccc2 Amb22490220 [0,0,0,1,0,0|2,0,0]=3 2844 B11R2.238 C1CC1=Cc2ccccc2 Amb19515480 [0,0,0,1,0,0|2,0,1]=4 2845 B11R2.238 C1CC1C[n+]2ccccc2 Amb10554474 [0,0,0,1,0,0|3,0,0]=4 2846 B11R2.238 C1CC1C[n+]2ccccc2 Amb10554486 [0,0,0,1,0,0|3,0,0]=4 2847 B11R2.238 C1CC1Nc2c[n]ccc2 Amb18270523 [0,0,0,1,0,0|3,0,0]=4 2848 B11R2.238 C1CC1Nc2ccccc2 Amb18270529 [0,0,0,1,0,0|2,0,0]=3 2849 B11R2.238 C1CC1Oc2[n]ccc[n]2 Amb24404876 [0,0,0,1,0,0|3,0,0]=4 2850 B11R2.238 C1CC1Oc2cccc[n]2 Amb25697005 [0,0,0,1,0,0|2,0,0]=3 2851 B11R2.238 C1N=C1Cc2ccccc2 Amb22498074 [0,0,0,1,0,0|2,0,1]=4 2852 B11R2.238 C1OC1Cc2c[n]c[n]c2 Amb24426064 [0,0,0,1,0,0|3,0,0]=4 2853 B11R2.238 C1OC1Cc2cc[n]cc2 Amb24677560 [0,0,0,1,0,0|2,0,0]=3 2854 B11R2.238 C1OC1Cc2cccc[n]2 Amb24649901 [0,0,0,1,0,0|2,0,0]=3 2855 B11R2.238 C1OC1Oc2cc[n]cc2 Amb24102767 [0,0,0,1,0,0|1,0,0]=2 2856 B11R2.238 N1CC1Cc2ccccc2 Amb10072810 [0,0,0,1,0,0|2,0,0]=3 2857 B11R2.238 N1C[C@@H]1Cc2ccccc2 Amb15690958 [0,0,0,1,0,0|2,0,0]=3 2858 B11R2.238 N1C[C@H]1Cc2ccccc2 Amb10603217 [0,0,0,1,0,0|2,0,0]=3 2859 B11R2.239 C1CC(N1)c2cccc[n]2 Amb25849292 [0,0,0,1,0,0|3,0,0]=4 2860 B11R2.239 C1CC(O1)c2ccccc2 Amb22298601 [0,0,0,1,0,0|1,0,0]=2 2861 B11R2.239 C1CC=C1c2cccc[n]2 Amb24069951 [0,0,0,1,0,0|3,0,0]=4 2862 B11R2.239 C1CCC1c2cc[n]cc2 Amb22898826 [0,0,0,1,0,0|3,0,0]=4 2863 B11R2.239 C1CCN1c2cccc[n]2 Amb24069933 [0,0,0,1,0,0|3,0,0]=4 2864 B11R2.239 C1C[C@@H](N1)c2cc[n]cc2 Amb25761359 [0,0,0,1,0,0|3,0,0]=4 2865 B11R2.239 C1C[C@@H](O1)c2ccccc2 Amb24479262 [0,0,0,1,0,0|1,0,0]=2 2866 B11R2.239 C1C[C@H](N1)c2cccc[n]2 Amb24732378 [0,0,0,1,0,0|3,0,0]=4 2867 B11R2.239 C1C[C@H](O1)c2ccccc2 Amb25721124 [0,0,0,1,0,0|1,0,0]=2 2868 B11R2.239 C1OCC1c2ccccc2 Amb21963191 [0,0,0,1,0,0|3,0,0]=4 2869 B11R2.239 N1CC(C1)c2ccccc2 Amb10603719 [0,0,0,1,0,0|3,0,0]=4 2870 B11R2.988 C=CC1Cc2ccccc12 Amb17778869 [0,0,0,1,0,0|2,0,1]=4 2871 B11R2.988 CCC1Cc2ccccc21 Amb24647895 [0,0,0,1,0,0|2,0,0]=3 2872 B11R2.988 COC1Cc2ccccc21 Amb24455687 [0,0,0,1,0,0|3,0,0]=4 2873 B11R2.988 ClCC1Cc2ccccc21 Amb24588110 [0,0,0,1,0,0|2,0,0]=3 2874 B11R2.988 ICC1Cc2ccccc21 Amb24354685 [0,0,0,1,0,0|2,0,0]=3 2875 B11R2.988 NCC1=Cc2ccccc21 Amb24596883 [0,0,0,1,0,0|2,0,1]=4 2876 B11R2.988 NCC1Cc2c1cccc2 Amb10609227 [0,0,0,1,0,0|2,0,0]=3 2877 B11R2.988 NC[C@@H]1Cc2ccccc21 Amb24182000 [0,0,0,1,0,0|2,0,0]=3 2878 B11R2.988 NNC1Cc2ccccc21 Amb25326415 [0,0,0,1,0,0|3,0,0]=4 2879 B11R2.988 O=CC1Cc2c1cccc2 Amb16230472 [0,0,0,1,0,0|1,0,2]=4 2880 B11R2.988 OCC1=Cc2c1cccc2 Amb15691967 [0,0,0,1,0,0|1,0,1]=3 2881 B11R2.1037 C1COc2cc[n]c([n]2)O1 Amb24093493 [0,0,0,1,0,0|2,0,0]=3 2882 B9R1.12 BrCCCc1ccco1 Amb17104550 [0,0,0,0,1,0|3,0,0]=4 2883 B9R1.12 BrCCCc1cccs1 Amb17104551 [0,0,0,0,1,0|3,0,0]=4 2884 B9R1.12 BrCCCc1cocc1 Amb24593084 [0,0,0,0,1,0|3,0,0]=4 2885 B9R1.12 BrCCCn1cccc1 Amb10608810 [0,0,0,0,1,0|3,0,0]=4 2886 B9R1.12 BrCCOc1c[s]cc1 Amb25698109 [0,0,0,0,1,0|2,0,0]=3 2887 B9R1.12 C#CCOc1c[s]cc1 Amb24653309 [0,0,0,0,1,0|2,0,1]=4 2888 B9R1.12 CCCCC1C=CC=C1 Amb21962871 [0,0,0,0,1,0|2,0,1]=4 2889 B9R1.12 CCCCc1c[nH]cc1 Amb25771565 [0,0,0,0,1,0|3,0,0]=4 2890 B9R1.12 CCCCc1ccco1 Amb10070290 [0,0,0,0,1,0|3,0,0]=4 2891 B9R1.12 CCCCc1ccsc1 Amb17779303 [0,0,0,0,1,0|3,0,0]=4 2892 B9R1.12 CCCOc1c[nH][n]c1 Amb23556503 [0,0,0,0,1,0|3,0,0]=4 2893 B9R1.12 CCCOc1c[s]cc1 Amb25268417 [0,0,0,0,1,0|2,0,0]=3 2894 B9R1.12 CCCSc1c[s]cc1 Amb25352161 [0,0,0,0,1,0|2,1,0]=4 2895 B9R1.12 CCCSc1ccc[nH]1 Amb24453201 [0,0,0,0,1,0|2,1,0]=4 2896 B9R1.12 CCCSc1ccco1 Amb25249856 [0,0,0,0,1,0|2,1,0]=4 2897 B9R1.12 COCOc1ccco1 Amb25312610 [0,0,0,0,1,0|3,0,0]=4 2898 B9R1.12 ClCCC[n]1cccc1 Amb21912596 [0,0,0,0,1,0|3,0,0]=4 2899 B9R1.12 ClCCCc1c[s]cc1 Amb18797934 [0,0,0,0,1,0|3,0,0]=4 2900 B9R1.12 ClCCCc1ccc[nH]1 Amb24502221 [0,0,0,0,1,0|3,0,0]=4 2901 B9R1.12 ClCCCc1cccs1 Amb17104524 [0,0,0,0,1,0|3,0,0]=4 2902 B9R1.12 ClCCCc1cocc1 Amb25720433 [0,0,0,0,1,0|3,0,0]=4 2903 B9R1.12 ClCCOc1cc[s][n]1 Amb25360467 [0,0,0,0,1,0|3,0,0]=4 2904 B9R1.12 ClCCOc1ccc[s]1 Amb24674144 [0,0,0,0,1,0|2,0,0]=3 2905 B9R1.12 FCCC[n]1cccc1 Amb24659970 [0,0,0,0,1,0|3,0,0]=4 2906 B9R1.12 FCCNc1c[s]cc1 Amb24339309 [0,0,0,0,1,0|3,0,0]=4 2907 B9R1.12 ICCOc1c[s]cc1 Amb24727505 [0,0,0,0,1,0|2,0,0]=3 2908 B9R1.12 NCCCc1c[nH]cc1 Amb18560456 [0,0,0,0,1,0|3,0,0]=4 2909 B9R1.12 NCCCc1c[s]cc1 Amb19373237 [0,0,0,0,1,0|3,0,0]=4 2910 B9R1.12 NCCCc1ccc[nH]1 Amb25076791 [0,0,0,0,1,0|3,0,0]=4 2911 B9R1.12 NCCCc1ccc[s]1 Amb24094214 [0,0,0,0,1,0|3,0,0]=4 2912 B9R1.12 NCCCc1cocc1 Amb25789662 [0,0,0,0,1,0|3,0,0]=4 2913 B9R1.12 NCCNc1c[s]cc1 Amb25794987 [0,0,0,0,1,0|3,0,0]=4 2914 B9R1.12 NCCNc1ccc[s]1 Amb18299161 [0,0,0,0,1,0|3,0,0]=4 2915 B9R1.12 NCCOc1[n]cc[s]1 Amb18523783 [0,0,0,0,1,0|3,0,0]=4 2916 B9R1.12 NCCOc1cco[n]1 Amb25177581 [0,0,0,0,1,0|3,0,0]=4 2917 B9R1.12 OCC#Cc1c[s]cc1 Amb24709250 [0,0,0,0,1,0|2,0,1]=4 2918 B9R1.12 OCCCC=1CC=CC1 Amb25851384 [0,0,0,0,1,0|1,0,1]=3 2919 B9R1.12 OCCCc1c[nH][n]c1 Amb22279568 [0,0,0,0,1,0|3,0,0]=4 2920 B9R1.12 OCCCc1c[nH]c[n]1 Amb19316315 [0,0,0,0,1,0|3,0,0]=4 2921 B9R1.12 OCCCc1c[nH]cc1 Amb18222128 [0,0,0,0,1,0|2,0,0]=3 2922 B9R1.12 OCCCc1c[n]c[nH]1 Amb22899104 [0,0,0,0,1,0|3,0,0]=4 2923 B9R1.12 OCCCc1c[s]c[n]1 Amb24099813 [0,0,0,0,1,0|3,0,0]=4 2924 B9R1.12 OCCCc1cc[nH][n]1 Amb25132262 [0,0,0,0,1,0|3,0,0]=4 2925 B9R1.12 OCCCc1ccc[nH]1 Amb24428704 [0,0,0,0,1,0|2,0,0]=3 2926 B9R1.12 OCCCc1cccs1 Amb17089493 [0,0,0,0,1,0|2,0,0]=3 2927 B9R1.12 OCCCc1cscc1 Amb17605794 [0,0,0,0,1,0|2,0,0]=3 2928 B9R1.12 OCCCn1cccc1 Amb17593298 [0,0,0,0,1,0|2,0,0]=3 2929 B9R1.12 OCCCn1cncc1 Amb11012596 [0,0,0,0,1,0|3,0,0]=4 2930 B9R1.12 OCCN[n]1cccc1 Amb25756597 [0,0,0,0,1,0|2,0,0]=3 2931 B9R1.12 OCCNc1c[nH][n]c1 Amb24477676 [0,0,0,0,1,0|3,0,0]=4 2932 B9R1.12 OCCNc1c[nH]c[n]1 Amb24733354 [0,0,0,0,1,0|3,0,0]=4 2933 B9R1.12 OCCNc1c[nH]cc1 Amb24472507 [0,0,0,0,1,0|2,0,0]=3 2934 B9R1.12 OCCNc1ccc[nH]1 Amb24704389 [0,0,0,0,1,0|2,0,0]=3 2935 B9R1.12 OCCOC=1CCCC1 Amb25697596 [0,0,0,0,1,0|0,0,3]=4 2936 B9R1.12 OCCOc1[n]cc[s]1 Amb24069917 [0,0,0,0,1,0|2,0,0]=3 2937 B9R1.12 OCCOc1c[nH]cc1 Amb25309374 [0,0,0,0,1,0|1,0,0]=2 2938 B9R1.12 OCOC[n]1cccc1 Amb25788107 [0,0,0,0,1,0|3,0,0]=4 2939 B9R1.12 OC\C=C/c1ccc[nH]1 Amb24744418 [0,0,0,0,1,0|2,0,1]=4 2940 B9R1.12 OC\C=C\c1c[nH]cc1 Amb24454320 [0,0,0,0,1,0|2,0,1]=4 2941 B9R1.12 OC\C=C\c1c[s]cc1 Amb25315908 [0,0,0,0,1,0|2,0,1]=4 2942 B9R1.12 OC\C=C\c1ccc[nH]1 Amb25090739 [0,0,0,0,1,0|2,0,1]=4 2943 B9R1.12 OC\C=C\c1ccc[s]1 Amb23555588 [0,0,0,0,1,0|2,0,1]=4 2944 B9R1.12 OC\C=C\c1cocc1 Amb25177010 [0,0,0,0,1,0|2,0,1]=4 2945 B9R1.12 SCCCc1c[s]cc1 Amb25180709 [0,0,0,0,1,0|2,1,0]=4 2946 B9R1.12 SCCCc1ccc[nH]1 Amb24722505 [0,0,0,0,1,0|2,1,0]=4 2947 B9R1.12 SCCCc1ccco1 Amb17399874 [0,0,0,0,1,0|2,1,0]=4 2948 B9R1.12 SCCCc1cccs1 Amb17400036 [0,0,0,0,1,0|2,1,0]=4 2949 B9R1.12 SCCSc1ccc[s]1 Amb25031295 [0,0,0,0,1,0|1,2,0]=4 2950 B11R1.203 NCCCC1=CNC=CC=C1 Amb25114442 [0,0,0,0,0,1|2,0,0]=3 2951 B11R1.203 OCCCC1CCC=CC=C1 Amb25058570 [0,0,0,0,0,1|1,0,2]=4 2952 B11R1.203 OCCOC=1C=CNC=CC1 Amb24069979 [0,0,0,0,0,1|0,0,0]=1 2953 B8R0.1 CC(CCO)\C=C\C=C Amb24404810 [1,0,1,0,0,0|0,0,2]=4 2954 B8R0.1 CCCC(=O)\C=C\C=C Amb25233730 [1,0,1,0,0,0|2,0,0]=4 2955 B8R0.1 CCOC(=O)\C=C/C=O Amb25032138 [1,0,1,0,0,0|2,0,0]=4 2956 B8R0.1 CCOC(=O)\C=C\C=C Amb10552844 [1,0,1,0,0,0|1,0,0]=3 2957 B8R0.1 CCOC(=O)\C=C\C=O Amb18642570 [1,0,1,0,0,0|2,0,0]=4 2958 B8R0.1 C\C(\CCCO)=C\C=C Amb24718346 [1,0,1,0,0,0|1,0,1]=4 2959 B8R0.1 C\C(\CCO)=C/C=C/Br Amb25162309 [1,0,1,0,0,0|1,0,1]=4 2960 B8R0.1 C\C(\CCO)=C\C=CCl Amb24635144 [1,0,1,0,0,0|1,0,1]=4 2961 B8R0.1 C\C=C\C(=O)OCCO Amb25332335 [1,0,1,0,0,0|1,0,1]=4 2962 B8R0.1 OCCC(=O)\C=C\C=O Amb24668888 [1,0,1,0,0,0|2,0,0]=4 2963 B8R0.4 C=CC\C=C\CCCO Amb25845279 [1,0,1,0,0,0|0,0,2]=4 2964 B8R0.4 C=C\C=C\C#CCCO Amb25788123 [1,0,1,0,0,0|0,0,2]=4 2965 B8R0.4 C=C\C=C\OCCCO Amb25332487 [1,0,1,0,0,0|1,0,1]=4 2966 B8R0.4 CC=CC=CC=CCO Amb25741427 [1,0,1,0,0,0|0,0,2]=4 2967 B8R0.4 CCC\C=C\C=C\C=C Amb22641675 [1,0,1,0,0,0|1,0,0]=3 2968 B8R0.4 CCO\C=C\C=CC=O Amb24587787 [1,0,1,0,0,0|1,0,0]=3 2969 B8R0.4 CCO\C=C\C=C\C=O Amb25054124 [1,0,1,0,0,0|1,0,0]=3 2970 B8R0.4 CC\C=C\C=CCCO Amb24576345 [1,0,1,0,0,0|0,0,2]=4 2971 B8R0.4 C\C=C\C=C\CCCO Amb17593323 [1,0,1,0,0,0|0,0,2]=4 2972 B8R0.4 C\C=C\C=NOCCO Amb25206534 [1,0,1,0,0,0|1,0,1]=4 2973 B8R0.4 OCC=CC=CC=CBr Amb24565670 [1,0,1,0,0,0|1,0,1]=4 2974 B8R0.4 OCC=C\C=C\CCO Amb25106338 [1,0,1,0,0,0|1,0,1]=4 2975 B8R0.4 OC\C=C\C=C\C=C\Br Amb25092806 [1,0,1,0,0,0|1,0,1]=4 2976 B8R0.11 C=CC(=CCCN)C=C Amb25368455 [1,0,1,0,0,0|2,0,0]=4 2977 B8R0.22 C=CC\C(\CCO)=C/Br Amb24480219 [1,0,1,0,0,0|1,0,1]=4 2978 B8R0.22 CC=C(CCO)\C=C\C Amb24354337 [1,0,1,0,0,0|0,0,2]=4 2979 B8R0.22 CCO\C(\CO)=C\C=C Amb25240257 [1,0,1,0,0,0|1,0,1]=4 2980 B8R0.22 C\C=C(/CC=C)\CCO Amb25098644 [1,0,1,0,0,0|0,0,2]=4 2981 B8R1.2 BrC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367404 [2,0,0,0,0,0|1,0,0]=3 2982 B8R1.2 BrC[13c]1ccccc1 Amb22367396 [2,0,0,0,0,0|1,0,0]=3 2983 B8R1.2 BrCc1cc[n]cc1 Amb22753071 [2,0,0,0,0,0|2,0,0]=4 2984 B8R1.2 BrCc1cccc[n]1 Amb22751621 [2,0,0,0,0,0|2,0,0]=4 2985 B8R1.2 Br[13CH2]c1ccccc1 Amb22366910 [2,0,0,0,0,0|1,0,0]=3 2986 B8R1.2 Br[Hg]c1ccccc1 Amb22369231 [2,0,0,0,0,0|2,0,0]=4 2987 B8R1.2 C#[13C]c1ccccc1 Amb22367126 [2,0,0,0,0,0|0,0,2]=4 2988 B8R1.2 C=Cc1ccccc1 Amb22337033 [2,0,0,0,0,0|0,0,2]=4 2989 B8R1.2 C=Cc1ccccc1 Amb22337871 [2,0,0,0,0,0|0,0,2]=4 2990 B8R1.2 C=Cc1ccccc1 Amb22337937 [2,0,0,0,0,0|0,0,2]=4 2991 B8R1.2 C=Cc1ccccc1 Amb22338204 [2,0,0,0,0,0|0,0,2]=4 2992 B8R1.2 C=Cc1ccccc1 Amb22338475 [2,0,0,0,0,0|0,0,2]=4 2993 B8R1.2 C=Cc1ccccc1 Amb22351316 [2,0,0,0,0,0|0,0,2]=4 2994 B8R1.2 C=Cc1ccccc1 Amb22731028 [2,0,0,0,0,0|0,0,2]=4 2995 B8R1.2 C=Cc1ccccc1 Amb22733123 [2,0,0,0,0,0|0,0,2]=4 2996 B8R1.2 C=Nc1ccccc1 Amb24605672 [2,0,0,0,0,0|1,0,1]=4 2997 B8R1.2 CCC1=CCC=CN1 Amb24524490 [2,0,0,0,0,0|1,0,1]=4 2998 B8R1.2 CCC=1CC=CCC1 Amb22227940 [2,0,0,0,0,0|0,0,2]=4 2999 B8R1.2 CC[n+]1ccccc1 Amb22739693 [2,0,0,0,0,0|1,0,0]=3 3000 B8R1.2 CCc1[n]ccc[n]1 Amb24095641 [2,0,0,0,0,0|2,0,0]=4 3001 B8R1.2 CCc1c[n]c[n]c1 Amb24097063 [2,0,0,0,0,0|2,0,0]=4 3002 B8R1.2 CCc1c[n]cc[n]1 Amb20620291 [2,0,0,0,0,0|2,0,0]=4 3003 B8R1.2 CCc1cc[n]c[n]1 Amb20242304 [2,0,0,0,0,0|2,0,0]=4 3004 B8R1.2 CCc1ccccc1 Amb22336270 [2,0,0,0,0,0|0,0,0]=2 3005 B8R1.2 CCc1ccccc1 Amb22366965 [2,0,0,0,0,0|0,0,0]=2 3006 B8R1.2 CCc1ccccc1 Amb2447474 [2,0,0,0,0,0|0,0,0]=2 3007 B8R1.2 COC1=CCC=CC1 Amb10842162 [2,0,0,0,0,0|0,0,2]=4 3008 B8R1.2 COC=1CCC=CC1 Amb22348084 [2,0,0,0,0,0|0,0,2]=4 3009 B8R1.2 CO[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17608460 [2,0,0,0,0,0|0,0,0]=2 3010 B8R1.2 CO[13c]1ccccc1 Amb22362658 [2,0,0,0,0,0|0,0,0]=2 3011 B8R1.2 CO[n+]1ccccc1 Amb10552605 [2,0,0,0,0,0|1,0,0]=3 3012 B8R1.2 COc1c[n][n]cc1 Amb21857844 [2,0,0,0,0,0|2,0,0]=4 3013 B8R1.2 COc1cc[n]cc1 Amb24079672 [2,0,0,0,0,0|1,0,0]=3 3014 B8R1.2 COc1cccnc1 Amb10573360 [2,0,0,0,0,0|1,0,0]=3 3015 B8R1.2 COc1ccncn1 Amb15692928 [2,0,0,0,0,0|2,0,0]=4 3016 B8R1.2 CPc1ccccc1 Amb25341327 [2,0,0,0,0,0|1,0,0]=3 3017 B8R1.2 CSc1c[n]ccc1 Amb24087396 [2,0,0,0,0,0|1,1,0]=4 3018 B8R1.2 CSc1cc[n]cc1 Amb24103013 [2,0,0,0,0,0|1,1,0]=4 3019 B8R1.2 CSc1cccc[n]1 Amb24081200 [2,0,0,0,0,0|1,1,0]=4 3020 B8R1.2 C[13CH2]c1ccccc1 Amb22362696 [2,0,0,0,0,0|0,0,0]=2 3021 B8R1.2 C[SiH2]c1ccccc1 Amb19893954 [2,0,0,0,0,0|0,1,0]=3 3022 B8R1.2 ClC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367253 [2,0,0,0,0,0|1,0,0]=3 3023 B8R1.2 ClCc1cccc[n]1 Amb22489454 [2,0,0,0,0,0|2,0,0]=4 3024 B8R1.2 ClCc1ccccc1 Amb22363332 [2,0,0,0,0,0|1,0,0]=3 3025 B8R1.2 ClCc1ccncc1 Amb1933717 [2,0,0,0,0,0|2,0,0]=4 3026 B8R1.2 ClSc1ccccc1 Amb10575597 [2,0,0,0,0,0|1,1,0]=4 3027 B8R1.2 Cl[13CH2]c1ccccc1 Amb22351323 [2,0,0,0,0,0|1,0,0]=3 3028 B8R1.2 Cl[SiH2]c1ccccc1 Amb22351128 [2,0,0,0,0,0|1,1,0]=4 3029 B8R1.2 FCc1c[n]ccc1 Amb25259171 [2,0,0,0,0,0|2,0,0]=4 3030 B8R1.2 FCc1cc[n]cc1 Amb22372287 [2,0,0,0,0,0|2,0,0]=4 3031 B8R1.2 FCc1cccc[n]1 Amb24093657 [2,0,0,0,0,0|2,0,0]=4 3032 B8R1.2 FCc1ccccc1 Amb10838335 [2,0,0,0,0,0|1,0,0]=3 3033 B8R1.2 FSc1ccccc1 Amb25198589 [2,0,0,0,0,0|1,1,0]=4 3034 B8R1.2 ICc1cc[n]cc1 Amb22489735 [2,0,0,0,0,0|2,0,0]=4 3035 B8R1.2 ICc1cc[n]cc1 Amb22748952 [2,0,0,0,0,0|2,0,0]=4 3036 B8R1.2 ICc1cccnc1 Amb10602162 [2,0,0,0,0,0|2,0,0]=4 3037 B8R1.2 I[Hg]c1ccccc1 Amb22347346 [2,0,0,0,0,0|2,0,0]=4 3038 B8R1.2 I[Mg]c1ccccc1 Amb22730124 [2,0,0,0,0,0|2,0,0]=4 3039 B8R1.2 I[Se]c1ccccc1 Amb10601593 [2,0,0,0,0,0|1,1,0]=4 3040 B8R1.2 N#Cc1ccccc1 Amb21864642 [2,0,0,0,0,0|1,0,1]=4 3041 B8R1.2 N#Cc1ccccc1 Amb22167299 [2,0,0,0,0,0|1,0,1]=4 3042 B8R1.2 N#[N+]c1ccccc1 Amb10564805 [2,0,0,0,0,0|2,0,0]=4 3043 B8R1.2 NC[n+]1ccccc1 Amb24716810 [2,0,0,0,0,0|2,0,0]=4 3044 B8R1.2 NCc1cc[n]cc1 Amb20620293 [2,0,0,0,0,0|2,0,0]=4 3045 B8R1.2 NCc1cc[n]cc1 Amb20622010 [2,0,0,0,0,0|2,0,0]=4 3046 B8R1.2 NCc1cccc[n]1 Amb20620292 [2,0,0,0,0,0|2,0,0]=4 3047 B8R1.2 NCc1cccc[n]1 Amb22274458 [2,0,0,0,0,0|2,0,0]=4 3048 B8R1.2 NCc1ccccc1 Amb19958612 [2,0,0,0,0,0|1,0,0]=3 3049 B8R1.2 NCc1ccccc1 Amb22052549 [2,0,0,0,0,0|1,0,0]=3 3050 B8R1.2 NCc1ccccc1 Amb23459863 [2,0,0,0,0,0|1,0,0]=3 3051 B8R1.2 NCc1ccccc1 Amb24325406 [2,0,0,0,0,0|1,0,0]=3 3052 B8R1.2 NCc1cccnc1 Amb1481403 [2,0,0,0,0,0|2,0,0]=4 3053 B8R1.2 NCc1cccnc1 Amb2189172 [2,0,0,0,0,0|2,0,0]=4 3054 B8R1.2 NCc1ccncc1 Amb1156526 [2,0,0,0,0,0|2,0,0]=4 3055 B8R1.2 NNc1ccccc1 Amb22002446 [2,0,0,0,0,0|2,0,0]=4 3056 B8R1.2 NNc1ccccc1 Amb22166856 [2,0,0,0,0,0|2,0,0]=4 3057 B8R1.2 NNc1ccccc1 Amb22731573 [2,0,0,0,0,0|2,0,0]=4 3058 B8R1.2 NOc1cccc[n]1 Amb24101187 [2,0,0,0,0,0|2,0,0]=4 3059 B8R1.2 NOc1ccccc1 Amb18123833 [2,0,0,0,0,0|1,0,0]=3 3060 B8R1.2 NOc1ccccc1 Amb22231364 [2,0,0,0,0,0|1,0,0]=3 3061 B8R1.2 O=Bc1ccccc1 Amb25221658 [2,0,0,0,0,0|1,0,1]=4 3062 B8R1.2 O=C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367549 [2,0,0,0,0,0|0,0,2]=4 3063 B8R1.2 O=[13CH]c1ccccc1 Amb22349200 [2,0,0,0,0,0|0,0,2]=4 3064 B8R1.2 O=[I]c1ccccc1 Amb15692855 [2,0,0,0,0,0|1,0,1]=4 3065 B8R1.2 OCC1=CCNC=C1 Amb25662609 [2,0,0,0,0,0|1,0,1]=4 3066 B8R1.2 OCN1C=CNC=C1 Amb17938355 [2,0,0,0,0,0|2,0,0]=4 3067 B8R1.2 OC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367395 [2,0,0,0,0,0|0,0,0]=2 3068 B8R1.2 OCc1c[n][n]cc1 Amb21856410 [2,0,0,0,0,0|2,0,0]=4 3069 B8R1.2 OCc1c[n]ccc1 Amb20622013 [2,0,0,0,0,0|1,0,0]=3 3070 B8R1.2 OCc1c[n]ccc1 Amb22434305 [2,0,0,0,0,0|1,0,0]=3 3071 B8R1.2 OCc1cc[n]cc1 Amb24183964 [2,0,0,0,0,0|1,0,0]=3 3072 B8R1.2 OCc1ccccn1 Amb16231923 [2,0,0,0,0,0|1,0,0]=3 3073 B8R1.2 OCc1ccncc1 Amb16231990 [2,0,0,0,0,0|1,0,0]=3 3074 B8R1.2 ONc1cccc[n]1 Amb25057797 [2,0,0,0,0,0|2,0,0]=4 3075 B8R1.2 ONc1ccccc1 Amb17672282 [2,0,0,0,0,0|1,0,0]=3 3076 B8R1.2 ONc1ccccc1 Amb22445293 [2,0,0,0,0,0|1,0,0]=3 3077 B8R1.2 OSc1cccc[n]1 Amb24061294 [2,0,0,0,0,0|1,1,0]=4 3078 B8R1.2 OSc1ccccc1 Amb25200260 [2,0,0,0,0,0|0,1,0]=3 3079 B8R1.2 O[13CH2]c1ccccc1 Amb22363258 [2,0,0,0,0,0|0,0,0]=2 3080 B8R1.2 O[14CH2]c1ccccc1 Amb22733558 [2,0,0,0,0,0|0,0,0]=2 3081 B8R1.2 O[Hg]c1ccccc1 Amb17940723 [2,0,0,0,0,0|1,0,0]=3 3082 B8R1.2 SCc1c[n]ccc1 Amb21984718 [2,0,0,0,0,0|1,1,0]=4 3083 B8R1.2 SCc1cc[n]cc1 Amb22008603 [2,0,0,0,0,0|1,1,0]=4 3084 B8R1.2 SCc1cccc[n]1 Amb20622005 [2,0,0,0,0,0|1,1,0]=4 3085 B8R1.2 [13CH3]Cc1ccccc1 Amb22353602 [2,0,0,0,0,0|0,0,0]=2 3086 B8R1.2 [15NH2]Cc1ccccc1 Amb22351500 [2,0,0,0,0,0|1,0,0]=3 3087 B8R1.2 [C-]#Cc1ccccc1 Amb22731283 [2,0,0,0,0,0|0,0,2]=4 3088 B8R1.2 [C-]#Cc1ccccc1 Amb22731714 [2,0,0,0,0,0|0,0,2]=4 3089 B8R1.2 [C-]#Cc1ccccc1 Amb22733589 [2,0,0,0,0,0|0,0,2]=4 3090 B8R1.2 [C-]#[N+]c1ccccc1 Amb1107613 [2,0,0,0,0,0|1,0,1]=4 3091 B8R1.2 [Li]Sc1ccccc1 Amb17939763 [2,0,0,0,0,0|1,1,0]=4 3092 B8R1.2 [Mg+]Cc1ccccc1 Amb22043988 [2,0,0,0,0,0|1,0,0]=3 3093 B8R1.2 [NH3+]Cc1ccccc1 Amb10555897 [2,0,0,0,0,0|1,0,0]=3 3094 B8R1.2 [NH3+]Oc1ccccc1 Amb10552602 [2,0,0,0,0,0|1,0,0]=3 3095 B8R1.2 [Na]Oc1ccccn1 Amb10552457 [2,0,0,0,0,0|2,0,0]=4 3096 B8R1.2 [Na]Sc1ccccc1 Amb22353443 [2,0,0,0,0,0|1,1,0]=4 3097 B8R1.2 [O-]Cc1ccccc1 Amb22367041 [2,0,0,0,0,0|0,0,1]=3 3098 B8R1.2 [SiH3]Cc1ccccc1 Amb22347052 [2,0,0,0,0,0|0,1,0]=3 3099 B8R1.2 [Tl]Sc1ccccc1 Amb22366489 [2,0,0,0,0,0|1,1,0]=4 3100 B10R0.71 CCCCC\C=C/C=CC=C Amb22336558 [0,1,1,0,0,0|2,0,0]=4 3101 B10R0.71 CCCCC\C=C\C=C/C=C Amb22546765 [0,1,1,0,0,0|2,0,0]=4 3102 B10R0.71 CCCCC\C=C\C=C\C=C Amb22730166 [0,1,1,0,0,0|2,0,0]=4 3103 B10R1.1 BrCC[n+]1ccc(cc1)C Amb2228343 [1,1,0,0,0,0|2,0,0]=4 3104 B10R1.1 BrCCc1ccc(I)cc1 Amb25266376 [1,1,0,0,0,0|1,0,0]=3 3105 B10R1.1 BrCCc1ccc(cc1)N Amb17595296 [1,1,0,0,0,0|1,0,0]=3 3106 B10R1.1 Br[Zn]Cc1ccc(I)cc1 Amb22000470 [1,1,0,0,0,0|2,0,0]=4 3107 B10R1.1 Brc1ccc(CCBr)[n]c1 Amb25187280 [1,1,0,0,0,0|2,0,0]=4 3108 B10R1.1 Brc1ccc(CCI)cc1 Amb22002540 [1,1,0,0,0,0|1,0,0]=3 3109 B10R1.1 Brc1ccc(C[Mg]Br)cc1 Amb22000536 [1,1,0,0,0,0|2,0,0]=4 3110 B10R1.1 Brc1ccc(C[Zn]Br)cc1 Amb22000432 [1,1,0,0,0,0|2,0,0]=4 3111 B10R1.1 C#CCc1ccc(F)cc1 Amb25679386 [1,1,0,0,0,0|1,0,1]=4 3112 B10R1.1 C=CCc1ccc(O)cc1 Amb18124422 [1,1,0,0,0,0|1,0,1]=4 3113 B10R1.1 C=COc1ccc(Br)cc1 Amb24366552 [1,1,0,0,0,0|0,0,2]=4 3114 B10R1.1 C=COc1ccc(I)cc1 Amb24753381 [1,1,0,0,0,0|0,0,2]=4 3115 B10R1.1 C=COc1ccc(O)cc1 Amb25134046 [1,1,0,0,0,0|0,0,2]=4 3116 B10R1.1 CC#Cc1ccc(Br)cc1 Amb24524445 [1,1,0,0,0,0|1,0,1]=4 3117 B10R1.1 CC#Cc1ccc(N)cc1 Amb24102696 [1,1,0,0,0,0|1,0,1]=4 3118 B10R1.1 CC#Cc1ccc(O)cc1 Amb24102701 [1,1,0,0,0,0|1,0,1]=4 3119 B10R1.1 CCCN1C=CC(=N)C=C1 Amb19805039 [1,1,0,0,0,0|2,0,0]=4 3120 B10R1.1 CCCN1C=CC(=N)C=C1 Amb21922068 [1,1,0,0,0,0|2,0,0]=4 3121 B10R1.1 CCCN1C=CC(=[NH2+])C=C1 Amb22553587 [1,1,0,0,0,0|2,0,0]=4 3122 B10R1.1 CCC[n+]1ccc(C)cc1 Amb22346436 [1,1,0,0,0,0|2,0,0]=4 3123 B10R1.1 CCC[n+]1ccc(N)cc1 Amb25292318 [1,1,0,0,0,0|2,0,0]=4 3124 B10R1.1 CCCc1ccc(Br)c[n]1 Amb24321438 [1,1,0,0,0,0|2,0,0]=4 3125 B10R1.1 CCCc1ccc(cc1)F Amb10845722 [1,1,0,0,0,0|1,0,0]=3 3126 B10R1.1 CCCc1ccc(cn1)N Amb10600808 [1,1,0,0,0,0|2,0,0]=4 3127 B10R1.1 CCCc1ccc(cn1)O Amb10553035 [1,1,0,0,0,0|2,0,0]=4 3128 B10R1.1 CCCc1ccc(nc1)Br Amb10600786 [1,1,0,0,0,0|2,0,0]=4 3129 B10R1.1 CCCc1ccc(nc1)N Amb10600788 [1,1,0,0,0,0|2,0,0]=4 3130 B10R1.1 CCCc1ccc(nc1)O Amb10600789 [1,1,0,0,0,0|2,0,0]=4 3131 B10R1.1 CCNC=1C=CC(=O)NC1 Amb24472745 [1,1,0,0,0,0|2,0,0]=4 3132 B10R1.1 CCNc1ccc(Br)cc1 Amb19959109 [1,1,0,0,0,0|1,0,0]=3 3133 B10R1.1 CCNc1ccc(Cl)[n]c1 Amb24672881 [1,1,0,0,0,0|2,0,0]=4 3134 B10R1.1 CCNc1ccc(F)[n]c1 Amb25073571 [1,1,0,0,0,0|2,0,0]=4 3135 B10R1.1 CCNc1ccc(F)c[n]1 Amb18281102 [1,1,0,0,0,0|2,0,0]=4 3136 B10R1.1 CCNc1ccc(I)c[n]1 Amb24636305 [1,1,0,0,0,0|2,0,0]=4 3137 B10R1.1 CCNc1ccc(N)c[n]1 Amb22295808 [1,1,0,0,0,0|2,0,0]=4 3138 B10R1.1 CCNc1ccc(N)c[n]1 Amb22737072 [1,1,0,0,0,0|2,0,0]=4 3139 B10R1.1 CCNc1ccc(cc1)F Amb1214999 [1,1,0,0,0,0|1,0,0]=3 3140 B10R1.1 CCNc1ccc(cn1)N Amb1117844 [1,1,0,0,0,0|2,0,0]=4 3141 B10R1.1 CCOC=1C=CC(=S)NN1 Amb25234282 [1,1,0,0,0,0|2,0,0]=4 3142 B10R1.1 CCOc1[n]cc(Cl)c[n]1 Amb22274169 [1,1,0,0,0,0|2,0,0]=4 3143 B10R1.1 CCOc1[n]cc(F)c[n]1 Amb20618662 [1,1,0,0,0,0|2,0,0]=4 3144 B10R1.1 CCOc1[n]cc(N)c[n]1 Amb18951527 [1,1,0,0,0,0|2,0,0]=4 3145 B10R1.1 CCOc1c[n]c(Br)[n]c1 Amb23440204 [1,1,0,0,0,0|2,0,0]=4 3146 B10R1.1 CCOc1c[n]c(Cl)[n]c1 Amb22234786 [1,1,0,0,0,0|2,0,0]=4 3147 B10R1.1 CCOc1c[n]c(Cl)c[n]1 Amb22234024 [1,1,0,0,0,0|2,0,0]=4 3148 B10R1.1 CCOc1c[n]c(N)c[n]1 Amb19894964 [1,1,0,0,0,0|2,0,0]=4 3149 B10R1.1 CCOc1c[n]c(O)[n]c1 Amb18643500 [1,1,0,0,0,0|2,0,0]=4 3150 B10R1.1 CCOc1cc[n+](cc1)C Amb10553055 [1,1,0,0,0,0|1,0,0]=3 3151 B10R1.1 CCOc1cc[n+](cc1)[O-] Amb10552815 [1,1,0,0,0,0|1,0,0]=3 3152 B10R1.1 CCOc1ccc(F)c[n]1 Amb21857676 [1,1,0,0,0,0|1,0,0]=3 3153 B10R1.1 CCOc1ccc(I)[n][n]1 Amb24478409 [1,1,0,0,0,0|2,0,0]=4 3154 B10R1.1 CCOc1ccc(I)[n]c1 Amb24690931 [1,1,0,0,0,0|1,0,0]=3 3155 B10R1.1 CCOc1ccc(N)[n][n]1 Amb19957599 [1,1,0,0,0,0|2,0,0]=4 3156 B10R1.1 CCOc1ccc(O)[n][n]1 Amb21984428 [1,1,0,0,0,0|2,0,0]=4 3157 B10R1.1 CCOc1ccc(O)c[n]1 Amb18643366 [1,1,0,0,0,0|1,0,0]=3 3158 B10R1.1 CCOc1ccc(S)c[n]1 Amb24062572 [1,1,0,0,0,0|1,0,0]=3 3159 B10R1.1 CCOc1ccc(cc1)N Amb1235495 [1,1,0,0,0,0|0,0,0]=2 3160 B10R1.1 CCOc1ccc(cc1)O Amb1808385 [1,1,0,0,0,0|0,0,0]=2 3161 B10R1.1 CCOc1ccc(cn1)I Amb10844711 [1,1,0,0,0,0|1,0,0]=3 3162 B10R1.1 CCOc1ccc(cn1)N Amb1132257 [1,1,0,0,0,0|1,0,0]=3 3163 B10R1.1 CCOc1ccc(nc1)Br Amb10070294 [1,1,0,0,0,0|1,0,0]=3 3164 B10R1.1 CCOc1ccc(nc1)Cl Amb15691050 [1,1,0,0,0,0|1,0,0]=3 3165 B10R1.1 CCOc1ccc(nn1)Br Amb10599626 [1,1,0,0,0,0|2,0,0]=4 3166 B10R1.1 CCOc1cnc(cn1)Br Amb10599257 [1,1,0,0,0,0|2,0,0]=4 3167 B10R1.1 CCOc1ncc(cn1)Br Amb2455917 [1,1,0,0,0,0|2,0,0]=4 3168 B10R1.1 CCSC=1C=CC(=O)NC1 Amb25232467 [1,1,0,0,0,0|1,1,0]=4 3169 B10R1.1 CCSc1cc[n+](C)cc1 Amb24553014 [1,1,0,0,0,0|1,1,0]=4 3170 B10R1.1 CCSc1ccc(Br)c[n]1 Amb20628984 [1,1,0,0,0,0|1,1,0]=4 3171 B10R1.1 CCSc1ccc(F)cc1 Amb24621814 [1,1,0,0,0,0|0,1,0]=3 3172 B10R1.1 CCSc1ccc(cc1)N Amb13949222 [1,1,0,0,0,0|0,1,0]=3 3173 B10R1.1 CCSc1ccc(cc1)N Amb2099645 [1,1,0,0,0,0|0,1,0]=3 3174 B10R1.1 CCSc1ccc(cc1)O Amb17202382 [1,1,0,0,0,0|0,1,0]=3 3175 B10R1.1 CNC=C1C=CC(=O)C=C1 Amb24459841 [1,1,0,0,0,0|2,0,0]=4 3176 B10R1.1 CNCc1ccc(Br)cc1 Amb17739893 [1,1,0,0,0,0|2,0,0]=4 3177 B10R1.1 CNCc1ccc(Cl)cc1 Amb17935917 [1,1,0,0,0,0|2,0,0]=4 3178 B10R1.1 CNCc1ccc(I)cc1 Amb23569028 [1,1,0,0,0,0|2,0,0]=4 3179 B10R1.1 CNCc1ccc(cc1)Br Amb1209641 [1,1,0,0,0,0|2,0,0]=4 3180 B10R1.1 CNCc1ccc(cc1)C Amb1241142 [1,1,0,0,0,0|2,0,0]=4 3181 B10R1.1 CNCc1ccc(cc1)Cl Amb1648458 [1,1,0,0,0,0|2,0,0]=4 3182 B10R1.1 CNCc1ccc(cc1)F Amb1105922 [1,1,0,0,0,0|2,0,0]=4 3183 B10R1.1 CNCc1ccc(cc1)O Amb1116278 [1,1,0,0,0,0|2,0,0]=4 3184 B10R1.1 COCc1ccc(Br)cc1 Amb18320178 [1,1,0,0,0,0|2,0,0]=4 3185 B10R1.1 COCc1ccc(Cl)cc1 Amb22497336 [1,1,0,0,0,0|2,0,0]=4 3186 B10R1.1 COCc1ccc(F)cc1 Amb24064703 [1,1,0,0,0,0|2,0,0]=4 3187 B10R1.1 COCc1ccc(I)cc1 Amb22234050 [1,1,0,0,0,0|2,0,0]=4 3188 B10R1.1 COCc1ccc(S)cc1 Amb19149369 [1,1,0,0,0,0|2,0,0]=4 3189 B10R1.1 COCc1ccc(cc1)N Amb1137167 [1,1,0,0,0,0|2,0,0]=4 3190 B10R1.1 CONc1ccc(N)cc1 Amb25823742 [1,1,0,0,0,0|2,0,0]=4 3191 B10R1.1 CSCc1ccc(Br)cc1 Amb19373540 [1,1,0,0,0,0|2,0,0]=4 3192 B10R1.1 CSCc1ccc(I)cc1 Amb25799869 [1,1,0,0,0,0|2,0,0]=4 3193 B10R1.1 CSCc1ccc(N)cc1 Amb18544980 [1,1,0,0,0,0|2,0,0]=4 3194 B10R1.1 CSCc1ccc(O)cc1 Amb18644673 [1,1,0,0,0,0|2,0,0]=4 3195 B10R1.1 CSCc1ccc(cc1)C Amb16185125 [1,1,0,0,0,0|2,0,0]=4 3196 B10R1.1 CSSc1ccc(N)cc1 Amb25264019 [1,1,0,0,0,0|1,1,0]=4 3197 B10R1.1 C\C=C\c1ccc(Br)cc1 Amb25698766 [1,1,0,0,0,0|1,0,1]=4 3198 B10R1.1 C\C=C\c1ccc(O)cc1 Amb18124423 [1,1,0,0,0,0|1,0,1]=4 3199 B10R1.1 C\N=C\c1ccc(O)cc1 Amb25179792 [1,1,0,0,0,0|2,0,0]=4 3200 B10R1.1 Cc1[n]cc(c[n]1)OCC Amb23412494 [1,1,0,0,0,0|2,0,0]=4 3201 B10R1.1 Cc1c[n]c(CCO)c[n]1 Amb25077347 [1,1,0,0,0,0|2,0,0]=4 3202 B10R1.1 Cc1c[n]c([n]c1)OCC Amb24083930 [1,1,0,0,0,0|2,0,0]=4 3203 B10R1.1 Cc1c[n]c(c[n]1)OCC Amb20621607 [1,1,0,0,0,0|2,0,0]=4 3204 B10R1.1 Cc1cc[n+](CC[O-])cc1 Amb24509510 [1,1,0,0,0,0|1,0,1]=4 3205 B10R1.1 Cc1ccc(CCBr)c[n]1 Amb24066233 [1,1,0,0,0,0|2,0,0]=4 3206 B10R1.1 Cc1ccc(CCC)cc1 Amb22227992 [1,1,0,0,0,0|1,0,0]=3 3207 B10R1.1 Cc1ccc(CCCl)[n]c1 Amb24479231 [1,1,0,0,0,0|2,0,0]=4 3208 B10R1.1 Cc1ccc(CCCl)c[n]1 Amb24658933 [1,1,0,0,0,0|2,0,0]=4 3209 B10R1.1 Cc1ccc(CCF)cc1 Amb24659769 [1,1,0,0,0,0|1,0,0]=3 3210 B10R1.1 Cc1ccc(CCI)cc1 Amb25096362 [1,1,0,0,0,0|1,0,0]=3 3211 B10R1.1 Cc1ccc(CCN)[n]c1 Amb24065042 [1,1,0,0,0,0|2,0,0]=4 3212 B10R1.1 Cc1ccc(CCN)cc1 Amb19261118 [1,1,0,0,0,0|1,0,0]=3 3213 B10R1.1 Cc1ccc(CCS)c[n]1 Amb24583128 [1,1,0,0,0,0|1,1,0]=4 3214 B10R1.1 Cc1ccc(CNN)cc1 Amb19890079 [1,1,0,0,0,0|2,0,0]=4 3215 B10R1.1 Cc1ccc(CNN)cc1 Amb21954052 [1,1,0,0,0,0|2,0,0]=4 3216 B10R1.1 Cc1ccc(CNO)[n]c1 Amb25145636 [1,1,0,0,0,0|2,0,0]=4 3217 B10R1.1 Cc1ccc(CNO)c[n]1 Amb25305252 [1,1,0,0,0,0|2,0,0]=4 3218 B10R1.1 Cc1ccc(CNO)cc1 Amb25798742 [1,1,0,0,0,0|1,0,0]=3 3219 B10R1.1 Cc1ccc(CON)cc1 Amb21929103 [1,1,0,0,0,0|2,0,0]=4 3220 B10R1.1 Cc1ccc(C[Mg]Cl)cc1 Amb19928780 [1,1,0,0,0,0|2,0,0]=4 3221 B10R1.1 Cc1ccc(C[Zn]Cl)cc1 Amb22000457 [1,1,0,0,0,0|2,0,0]=4 3222 B10R1.1 Cc1ccc(OC=C)cc1 Amb17674188 [1,1,0,0,0,0|0,0,2]=4 3223 B10R1.1 Cc1ccc([n][n]1)OCC Amb25253661 [1,1,0,0,0,0|2,0,0]=4 3224 B10R1.1 Cc1ccc([n]c1)OCC Amb24524393 [1,1,0,0,0,0|1,0,0]=3 3225 B10R1.1 Cc1ccc([n]c1)SCC Amb25762078 [1,1,0,0,0,0|1,1,0]=4 3226 B10R1.1 Cc1ccc(\C=N\C)cc1 Amb24589231 [1,1,0,0,0,0|2,0,0]=4 3227 B10R1.1 Cc1ccc(c[n]1)OCC Amb24057171 [1,1,0,0,0,0|1,0,0]=3 3228 B10R1.1 Cc1ccc(cc1)C[N+]#[C-] Amb1981066 [1,1,0,0,0,0|2,0,0]=4 3229 B10R1.1 Cc1ccc(cc1)NCO Amb24745213 [1,1,0,0,0,0|1,0,0]=3 3230 B10R1.1 Cc1ccc(cc1)OC#N Amb24742509 [1,1,0,0,0,0|1,0,1]=4 3231 B10R1.1 Cc1ccc(cc1)OC=O Amb25248584 [1,1,0,0,0,0|0,0,2]=4 3232 B10R1.1 Cc1ccc(cc1)OCCl Amb24620445 [1,1,0,0,0,0|1,0,0]=3 3233 B10R1.1 Cc1ccc(cc1)PCCl Amb24538070 [1,1,0,0,0,0|2,0,0]=4 3234 B10R1.1 ClCSc1ccc(Br)cc1 Amb25237152 [1,1,0,0,0,0|1,1,0]=4 3235 B10R1.1 Clc1ccc(CCBr)c[n]1 Amb24741687 [1,1,0,0,0,0|2,0,0]=4 3236 B10R1.1 Clc1ccc(CCCl)c[n]1 Amb25144552 [1,1,0,0,0,0|2,0,0]=4 3237 B10R1.1 Clc1ccc(CCI)cc1 Amb25363991 [1,1,0,0,0,0|1,0,0]=3 3238 B10R1.1 Clc1ccc(C[Zn]Cl)cc1 Amb22000429 [1,1,0,0,0,0|2,0,0]=4 3239 B10R1.1 Clc1ccc(cc1)C[N+]#[C-] Amb2235910 [1,1,0,0,0,0|2,0,0]=4 3240 B10R1.1 Clc1ccc(cc1)SCBr Amb24658657 [1,1,0,0,0,0|1,1,0]=4 3241 B10R1.1 Clc1ccc(cc1)SCCl Amb22351380 [1,1,0,0,0,0|1,1,0]=4 3242 B10R1.1 FCCc1ccc(Br)cc1 Amb25047426 [1,1,0,0,0,0|1,0,0]=3 3243 B10R1.1 Fc1ccc(C[Mg]Cl)cc1 Amb17938181 [1,1,0,0,0,0|2,0,0]=4 3244 B10R1.1 Fc1ccc(C[Zn]Cl)cc1 Amb17938179 [1,1,0,0,0,0|2,0,0]=4 3245 B10R1.1 Fc1ccc(cc1)C[N+]#[C-] Amb1981065 [1,1,0,0,0,0|2,0,0]=4 3246 B10R1.1 Fc1ccc(cc1)OCCl Amb24538040 [1,1,0,0,0,0|1,0,0]=3 3247 B10R1.1 N#CCc1ccc(S)cc1 Amb24509708 [1,1,0,0,0,0|1,0,1]=4 3248 B10R1.1 N#CCc1ccc(cc1)Br Amb1130758 [1,1,0,0,0,0|1,0,1]=4 3249 B10R1.1 N#CCc1ccc(cc1)Cl Amb1883007 [1,1,0,0,0,0|1,0,1]=4 3250 B10R1.1 N#CCc1ccc(cc1)F Amb1154069 [1,1,0,0,0,0|1,0,1]=4 3251 B10R1.1 N#CCc1ccc(cc1)N Amb1215260 [1,1,0,0,0,0|1,0,1]=4 3252 B10R1.1 N#CCc1ccc(cc1)O Amb1154109 [1,1,0,0,0,0|1,0,1]=4 3253 B10R1.1 N#COc1ccc(Cl)cc1 Amb24478481 [1,1,0,0,0,0|1,0,1]=4 3254 B10R1.1 NCCC=1C=CC(=O)NC1 Amb18908312 [1,1,0,0,0,0|2,0,0]=4 3255 B10R1.1 NCCN1C=CC(=O)C=C1 Amb18534867 [1,1,0,0,0,0|2,0,0]=4 3256 B10R1.1 NCCc1cc[n+]([O-])cc1 Amb24471141 [1,1,0,0,0,0|2,0,0]=4 3257 B10R1.1 NCCc1ccc(Br)[n]c1 Amb22233813 [1,1,0,0,0,0|2,0,0]=4 3258 B10R1.1 NCCc1ccc(Br)c[n]1 Amb22751436 [1,1,0,0,0,0|2,0,0]=4 3259 B10R1.1 NCCc1ccc(Cl)[n]c1 Amb19516101 [1,1,0,0,0,0|2,0,0]=4 3260 B10R1.1 NCCc1ccc(Cl)c[n]1 Amb22751421 [1,1,0,0,0,0|2,0,0]=4 3261 B10R1.1 NCCc1ccc(Cl)c[n]1 Amb22899099 [1,1,0,0,0,0|2,0,0]=4 3262 B10R1.1 NCCc1ccc(Cl)c[n]1 Amb22899100 [1,1,0,0,0,0|2,0,0]=4 3263 B10R1.1 NCCc1ccc(Cl)cc1 Amb22497649 [1,1,0,0,0,0|1,0,0]=3 3264 B10R1.1 NCCc1ccc(F)[n]c1 Amb25678845 [1,1,0,0,0,0|2,0,0]=4 3265 B10R1.1 NCCc1ccc(F)c[n]1 Amb22899431 [1,1,0,0,0,0|2,0,0]=4 3266 B10R1.1 NCCc1ccc(I)cc1 Amb19516023 [1,1,0,0,0,0|1,0,0]=3 3267 B10R1.1 NCCc1ccc(N)cc1 Amb17772211 [1,1,0,0,0,0|1,0,0]=3 3268 B10R1.1 NCCc1ccc(O)cc1 Amb17778990 [1,1,0,0,0,0|1,0,0]=3 3269 B10R1.1 NCCc1ccc(S)cc1 Amb25700837 [1,1,0,0,0,0|1,0,0]=3 3270 B10R1.1 NCCc1ccc(cc1)Br Amb10808111 [1,1,0,0,0,0|1,0,0]=3 3271 B10R1.1 NCCc1ccc(cc1)C Amb1129454 [1,1,0,0,0,0|1,0,0]=3 3272 B10R1.1 NCCc1ccc(cc1)Cl Amb1212558 [1,1,0,0,0,0|1,0,0]=3 3273 B10R1.1 NCCc1ccc(cc1)F Amb1215262 [1,1,0,0,0,0|1,0,0]=3 3274 B10R1.1 NCCc1ccc(nc1)C Amb10610554 [1,1,0,0,0,0|2,0,0]=4 3275 B10R1.1 NCNc1ccc(cc1)C Amb17117016 [1,1,0,0,0,0|2,0,0]=4 3276 B10R1.1 NNCc1ccc(Br)cc1 Amb19893264 [1,1,0,0,0,0|2,0,0]=4 3277 B10R1.1 NNCc1ccc(Br)cc1 Amb23439145 [1,1,0,0,0,0|2,0,0]=4 3278 B10R1.1 NNCc1ccc(Cl)cc1 Amb19890158 [1,1,0,0,0,0|2,0,0]=4 3279 B10R1.1 NNCc1ccc(Cl)cc1 Amb20668069 [1,1,0,0,0,0|2,0,0]=4 3280 B10R1.1 NNCc1ccc(Cl)cc1 Amb21954056 [1,1,0,0,0,0|2,0,0]=4 3281 B10R1.1 NNCc1ccc(F)cc1 Amb19893258 [1,1,0,0,0,0|2,0,0]=4 3282 B10R1.1 NNCc1ccc(I)cc1 Amb25794991 [1,1,0,0,0,0|2,0,0]=4 3283 B10R1.1 NNCc1ccc(cc1)Br Amb1114984 [1,1,0,0,0,0|2,0,0]=4 3284 B10R1.1 NNCc1ccc(cc1)C Amb1112560 [1,1,0,0,0,0|2,0,0]=4 3285 B10R1.1 NNCc1ccc(cc1)Cl Amb1121233 [1,1,0,0,0,0|2,0,0]=4 3286 B10R1.1 NNCc1ccc(cc1)F Amb10841872 [1,1,0,0,0,0|2,0,0]=4 3287 B10R1.1 NNCc1ccc(cc1)F Amb1112880 [1,1,0,0,0,0|2,0,0]=4 3288 B10R1.1 NOCc1ccc(Br)cc1 Amb22234858 [1,1,0,0,0,0|2,0,0]=4 3289 B10R1.1 NOCc1ccc(Cl)cc1 Amb19889791 [1,1,0,0,0,0|2,0,0]=4 3290 B10R1.1 NOCc1ccc(F)cc1 Amb19883929 [1,1,0,0,0,0|2,0,0]=4 3291 B10R1.1 NOCc1ccc(cc1)C Amb1946246 [1,1,0,0,0,0|2,0,0]=4 3292 B10R1.1 NOCc1ccc(cc1)Cl Amb10607411 [1,1,0,0,0,0|2,0,0]=4 3293 B10R1.1 NOCc1ccc(cc1)F Amb17091427 [1,1,0,0,0,0|2,0,0]=4 3294 B10R1.1 Nc1ccc(CC=O)cc1 Amb22831156 [1,1,0,0,0,0|0,0,2]=4 3295 B10R1.1 Nc1ccc(CCBr)cc1 Amb24066884 [1,1,0,0,0,0|1,0,0]=3 3296 B10R1.1 Nc1ccc(CCCl)cc1 Amb18125908 [1,1,0,0,0,0|1,0,0]=3 3297 B10R1.1 Nc1ccc(CCF)cc1 Amb24655949 [1,1,0,0,0,0|1,0,0]=3 3298 B10R1.1 Nc1ccc(CCO)[n]c1 Amb24593512 [1,1,0,0,0,0|1,0,0]=3 3299 B10R1.1 Nc1ccc(CCO)c[n]1 Amb23446333 [1,1,0,0,0,0|1,0,0]=3 3300 B10R1.1 Nc1ccc(CNO)cc1 Amb25835653 [1,1,0,0,0,0|1,0,0]=3 3301 B10R1.1 Nc1ccc(C[PH2]=O)cc1 Amb25118632 [1,1,0,0,0,0|1,0,1]=4 3302 B10R1.1 Nc1ccc(cc1)ON=O Amb25147338 [1,1,0,0,0,0|1,0,1]=4 3303 B10R1.1 Nc1ccc(cc1)SCCl Amb25281595 [1,1,0,0,0,0|1,1,0]=4 3304 B10R1.1 O=C1C=CC(CCCl)=CN1 Amb25060213 [1,1,0,0,0,0|2,0,0]=4 3305 B10R1.1 O=C1C=CN(CCCl)C=C1 Amb18177573 [1,1,0,0,0,0|2,0,0]=4 3306 B10R1.1 O=C1C=CN(CCF)C=C1 Amb25713562 [1,1,0,0,0,0|2,0,0]=4 3307 B10R1.1 O=CCc1ccc(I)cc1 Amb24079622 [1,1,0,0,0,0|0,0,2]=4 3308 B10R1.1 O=CCc1ccc(cc1)Br Amb16230450 [1,1,0,0,0,0|0,0,2]=4 3309 B10R1.1 O=CCc1ccc(cc1)Cl Amb10603161 [1,1,0,0,0,0|0,0,2]=4 3310 B10R1.1 O=CCc1ccc(cc1)F Amb16230451 [1,1,0,0,0,0|0,0,2]=4 3311 B10R1.1 O=COc1ccc(Cl)cc1 Amb24436068 [1,1,0,0,0,0|0,0,2]=4 3312 B10R1.1 OCCN1C=CC(=O)C=C1 Amb18041230 [1,1,0,0,0,0|1,0,0]=3 3313 B10R1.1 OCCN1C=CC(=S)C=C1 Amb25739794 [1,1,0,0,0,0|1,0,0]=3 3314 B10R1.1 OCCc1[n]cc(Br)c[n]1 Amb22896759 [1,1,0,0,0,0|2,0,0]=4 3315 B10R1.1 OCCc1c[n]c(Cl)[n]c1 Amb25211893 [1,1,0,0,0,0|2,0,0]=4 3316 B10R1.1 OCCc1ccc(Br)[n]c1 Amb23569407 [1,1,0,0,0,0|1,0,0]=3 3317 B10R1.1 OCCc1ccc(Br)c[n]1 Amb21858814 [1,1,0,0,0,0|1,0,0]=3 3318 B10R1.1 OCCc1ccc(Cl)[n]c1 Amb22752853 [1,1,0,0,0,0|1,0,0]=3 3319 B10R1.1 OCCc1ccc(F)[n]c1 Amb25063775 [1,1,0,0,0,0|1,0,0]=3 3320 B10R1.1 OCCc1ccc(F)c[n]1 Amb24426849 [1,1,0,0,0,0|1,0,0]=3 3321 B10R1.1 OCCc1ccc(I)[n]c1 Amb23446988 [1,1,0,0,0,0|1,0,0]=3 3322 B10R1.1 OCCc1ccc(I)cc1 Amb19668873 [1,1,0,0,0,0|0,0,0]=2 3323 B10R1.1 OCCc1ccc(S)[n]c1 Amb23446733 [1,1,0,0,0,0|1,0,0]=3 3324 B10R1.1 OCCc1ccc(S)cc1 Amb24379931 [1,1,0,0,0,0|0,0,0]=2 3325 B10R1.1 OCCc1ccc(nc1)C Amb10603991 [1,1,0,0,0,0|1,0,0]=3 3326 B10R1.1 OCCc1ncc(cn1)S Amb1971491 [1,1,0,0,0,0|2,0,0]=4 3327 B10R1.1 OCNc1ccc(Cl)cc1 Amb24702524 [1,1,0,0,0,0|1,0,0]=3 3328 B10R1.1 ONCc1ccc(Br)cc1 Amb23449447 [1,1,0,0,0,0|1,0,0]=3 3329 B10R1.1 ONCc1ccc(Cl)cc1 Amb25145635 [1,1,0,0,0,0|1,0,0]=3 3330 B10R1.1 ONCc1ccc(F)cc1 Amb22157298 [1,1,0,0,0,0|1,0,0]=3 3331 B10R1.1 ONCc1ccc(I)cc1 Amb24529167 [1,1,0,0,0,0|1,0,0]=3 3332 B10R1.1 O\N=C\c1ccc(cc1)Br Amb1152409 [1,1,0,0,0,0|1,0,1]=4 3333 B10R1.1 O\N=C\c1ccc(cc1)C Amb1152459 [1,1,0,0,0,0|1,0,1]=4 3334 B10R1.1 O\N=C\c1ccc(cc1)Cl Amb1152205 [1,1,0,0,0,0|1,0,1]=4 3335 B10R1.1 O\N=C\c1ccc(cc1)F Amb1152218 [1,1,0,0,0,0|1,0,1]=4 3336 B10R1.1 Oc1c[n]c(CCO)[n]c1 Amb22886930 [1,1,0,0,0,0|2,0,0]=4 3337 B10R1.1 Oc1ccc(CCCl)cc1 Amb25709371 [1,1,0,0,0,0|1,0,0]=3 3338 B10R1.1 Oc1ccc(CCF)cc1 Amb25735077 [1,1,0,0,0,0|1,0,0]=3 3339 B10R1.1 Oc1ccc(CCI)cc1 Amb24094233 [1,1,0,0,0,0|1,0,0]=3 3340 B10R1.1 Oc1ccc(CCO)c[n]1 Amb23446664 [1,1,0,0,0,0|1,0,0]=3 3341 B10R1.1 Oc1ccc(CCS)cc1 Amb25767004 [1,1,0,0,0,0|0,1,0]=3 3342 B10R1.1 Oc1ccc(CNO)cc1 Amb23449449 [1,1,0,0,0,0|1,0,0]=3 3343 B10R1.1 Oc1ccc(cc1)OC=O Amb18643207 [1,1,0,0,0,0|0,0,2]=4 3344 B10R1.1 Oc1ccc(cc1)ON=O Amb25729156 [1,1,0,0,0,0|1,0,1]=4 3345 B10R1.1 Oc1ccc(cc1)SCO Amb24631003 [1,1,0,0,0,0|0,1,0]=3 3346 B10R1.1 SCCc1ccc(cc1)Br Amb17404679 [1,1,0,0,0,0|0,1,0]=3 3347 B10R1.1 SCCc1ccc(cc1)C Amb16183304 [1,1,0,0,0,0|0,1,0]=3 3348 B10R1.1 SCCc1ccc(cc1)Cl Amb17400376 [1,1,0,0,0,0|0,1,0]=3 3349 B10R1.1 SCCc1ccc(cc1)F Amb17400005 [1,1,0,0,0,0|0,1,0]=3 3350 B10R1.1 Sc1ccc(CCBr)cc1 Amb24428628 [1,1,0,0,0,0|1,0,0]=3 3351 B10R1.1 Sc1ccc(CCCl)cc1 Amb24482361 [1,1,0,0,0,0|1,0,0]=3 3352 B10R1.1 [C-]#[N+]Oc1ccc(N)cc1 Amb25309436 [1,1,0,0,0,0|1,0,1]=4 3353 B10R1.1 [NH3+]OCc1ccc(cc1)Cl Amb2427236 [1,1,0,0,0,0|2,0,0]=4 3354 B10R1.1 [NH3+]OCc1ccc(cc1)F Amb2420803 [1,1,0,0,0,0|2,0,0]=4 3355 B10R1.1 [O-][n+]1ccc(CCO)cc1 Amb25236037 [1,1,0,0,0,0|1,0,0]=3 3356 B10R1.4 Bc1ccccc1CCN Amb24629754 [1,1,0,0,0,0|1,0,0]=3 3357 B10R1.4 BrCCc1ccccc1I Amb25742518 [1,1,0,0,0,0|1,0,0]=3 3358 B10R1.4 Brc1ccccc1CCBr Amb19515770 [1,1,0,0,0,0|1,0,0]=3 3359 B10R1.4 Brc1ccccc1CCI Amb25255595 [1,1,0,0,0,0|1,0,0]=3 3360 B10R1.4 Brc1ccccc1C[Mg]Br Amb22000538 [1,1,0,0,0,0|2,0,0]=4 3361 B10R1.4 Brc1ccccc1C[Zn]Br Amb22000430 [1,1,0,0,0,0|2,0,0]=4 3362 B10R1.4 C#CCc1ccccc1O Amb24478360 [1,1,0,0,0,0|1,0,1]=4 3363 B10R1.4 C=CCc1ccccc1N Amb18642928 [1,1,0,0,0,0|1,0,1]=4 3364 B10R1.4 C=CCc1ccccc1O Amb1971446 [1,1,0,0,0,0|1,0,1]=4 3365 B10R1.4 C=COc1ccccc1Br Amb25095432 [1,1,0,0,0,0|0,0,2]=4 3366 B10R1.4 C=COc1ccccc1N Amb18124449 [1,1,0,0,0,0|0,0,2]=4 3367 B10R1.4 C=COc1ccccc1O Amb18643057 [1,1,0,0,0,0|0,0,2]=4 3368 B10R1.4 CC#Cc1ccccc1N Amb24070024 [1,1,0,0,0,0|1,0,1]=4 3369 B10R1.4 CC#Cc1ccccc1O Amb25706906 [1,1,0,0,0,0|1,0,1]=4 3370 B10R1.4 CCCN1C=CC=CC1=O Amb22730334 [1,1,0,0,0,0|2,0,0]=4 3371 B10R1.4 CCCN1C=CC=CC1=S Amb24480486 [1,1,0,0,0,0|2,0,0]=4 3372 B10R1.4 CCC[n+]1ccccc1C Amb25326000 [1,1,0,0,0,0|2,0,0]=4 3373 B10R1.4 CCCc1[n]cccc1Br Amb24320669 [1,1,0,0,0,0|2,0,0]=4 3374 B10R1.4 CCCc1[n]cccc1F Amb25716946 [1,1,0,0,0,0|2,0,0]=4 3375 B10R1.4 CCCc1[n]cccc1N Amb18832434 [1,1,0,0,0,0|2,0,0]=4 3376 B10R1.4 CCCc1[n]cccc1O Amb24320670 [1,1,0,0,0,0|2,0,0]=4 3377 B10R1.4 CCCc1c[n]ccc1Br Amb20617515 [1,1,0,0,0,0|2,0,0]=4 3378 B10R1.4 CCCc1c[n]ccc1N Amb22522169 [1,1,0,0,0,0|2,0,0]=4 3379 B10R1.4 CCCc1cc[n]cc1Br Amb24320559 [1,1,0,0,0,0|2,0,0]=4 3380 B10R1.4 CCCc1cc[n]cc1N Amb18203088 [1,1,0,0,0,0|2,0,0]=4 3381 B10R1.4 CCCc1cc[n]cc1O Amb24398292 [1,1,0,0,0,0|2,0,0]=4 3382 B10R1.4 CCCc1ccc[n]c1Br Amb24319271 [1,1,0,0,0,0|2,0,0]=4 3383 B10R1.4 CCCc1ccc[n]c1Cl Amb24319272 [1,1,0,0,0,0|2,0,0]=4 3384 B10R1.4 CCCc1ccc[n]c1F Amb25054844 [1,1,0,0,0,0|2,0,0]=4 3385 B10R1.4 CCCc1ccc[n]c1O Amb24319273 [1,1,0,0,0,0|2,0,0]=4 3386 B10R1.4 CCCc1ccccc1I Amb20622716 [1,1,0,0,0,0|1,0,0]=3 3387 B10R1.4 CCNC1=CC=CNC1=O Amb25063603 [1,1,0,0,0,0|2,0,0]=4 3388 B10R1.4 CCNc1[n]cccc1Br Amb18955277 [1,1,0,0,0,0|2,0,0]=4 3389 B10R1.4 CCNc1[n]cccc1F Amb18963791 [1,1,0,0,0,0|2,0,0]=4 3390 B10R1.4 CCNc1[n]cccc1I Amb24352750 [1,1,0,0,0,0|2,0,0]=4 3391 B10R1.4 CCNc1c[n]ccc1N Amb17933377 [1,1,0,0,0,0|2,0,0]=4 3392 B10R1.4 CCNc1cc[n]cc1Cl Amb25839408 [1,1,0,0,0,0|2,0,0]=4 3393 B10R1.4 CCNc1cc[n]cc1O Amb24744478 [1,1,0,0,0,0|2,0,0]=4 3394 B10R1.4 CCNc1ccc[n]c1N Amb23557979 [1,1,0,0,0,0|2,0,0]=4 3395 B10R1.4 CCNc1ccccc1O Amb18643152 [1,1,0,0,0,0|1,0,0]=3 3396 B10R1.4 CCNc1ccccc1P Amb24563425 [1,1,0,0,0,0|1,0,0]=3 3397 B10R1.4 CCNc1ccccc1S Amb24382138 [1,1,0,0,0,0|1,0,0]=3 3398 B10R1.4 CCNc1ncccc1N Amb10609970 [1,1,0,0,0,0|2,0,0]=4 3399 B10R1.4 CCOC1=CC=CNC1=O Amb18537475 [1,1,0,0,0,0|1,0,0]=3 3400 B10R1.4 CCOC1=COC=CC1=O Amb24454331 [1,1,0,0,0,0|1,0,0]=3 3401 B10R1.4 CCOC1=NC=CNC1=O Amb23450342 [1,1,0,0,0,0|2,0,0]=4 3402 B10R1.4 CCON1C=CC=CC1=S Amb25257642 [1,1,0,0,0,0|1,0,0]=3 3403 B10R1.4 CCOc1[n]c[n]cc1I Amb25041670 [1,1,0,0,0,0|2,0,0]=4 3404 B10R1.4 CCOc1[n]c[n]cc1N Amb23558036 [1,1,0,0,0,0|2,0,0]=4 3405 B10R1.4 CCOc1[n]cc[n]c1Br Amb24524317 [1,1,0,0,0,0|2,0,0]=4 3406 B10R1.4 CCOc1[n]cc[n]c1Cl Amb18797491 [1,1,0,0,0,0|2,0,0]=4 3407 B10R1.4 CCOc1[n]cccc1Br Amb20242466 [1,1,0,0,0,0|1,0,0]=3 3408 B10R1.4 CCOc1[n]cccc1F Amb21857675 [1,1,0,0,0,0|1,0,0]=3 3409 B10R1.4 CCOc1[n]cccc1O Amb19895105 [1,1,0,0,0,0|1,0,0]=3 3410 B10R1.4 CCOc1c[n]c[n]c1N Amb22641452 [1,1,0,0,0,0|2,0,0]=4 3411 B10R1.4 CCOc1c[n]ccc1Br Amb23402582 [1,1,0,0,0,0|1,0,0]=3 3412 B10R1.4 CCOc1c[n]ccc1Cl Amb20242807 [1,1,0,0,0,0|1,0,0]=3 3413 B10R1.4 CCOc1c[n]ccc1N Amb21857560 [1,1,0,0,0,0|1,0,0]=3 3414 B10R1.4 CCOc1cc[n][n]c1Cl Amb24082821 [1,1,0,0,0,0|2,0,0]=4 3415 B10R1.4 CCOc1cc[n]cc1Cl Amb25829530 [1,1,0,0,0,0|1,0,0]=3 3416 B10R1.4 CCOc1cc[n]cc1F Amb22495229 [1,1,0,0,0,0|1,0,0]=3 3417 B10R1.4 CCOc1cc[n]cc1I Amb24536249 [1,1,0,0,0,0|1,0,0]=3 3418 B10R1.4 CCOc1cc[n]cc1O Amb24454081 [1,1,0,0,0,0|1,0,0]=3 3419 B10R1.4 CCOc1ccc[n]c1I Amb25681793 [1,1,0,0,0,0|1,0,0]=3 3420 B10R1.4 CCOc1ccc[n]c1S Amb24478413 [1,1,0,0,0,0|1,0,0]=3 3421 B10R1.4 CCOc1cccc[n+]1[O-] Amb25116884 [1,1,0,0,0,0|1,0,0]=3 3422 B10R1.4 CCOc1ccccc1I Amb19888234 [1,1,0,0,0,0|0,0,0]=2 3423 B10R1.4 CCOc1ccccc1N Amb22733118 [1,1,0,0,0,0|0,0,0]=2 3424 B10R1.4 CCOc1ccccc1S Amb20242711 [1,1,0,0,0,0|0,0,0]=2 3425 B10R1.4 CCOc1cccnc1N Amb1102343 [1,1,0,0,0,0|1,0,0]=3 3426 B10R1.4 CCOc1cnccc1Br Amb15691031 [1,1,0,0,0,0|1,0,0]=3 3427 B10R1.4 CCOc1ncccc1N Amb1136817 [1,1,0,0,0,0|1,0,0]=3 3428 B10R1.4 CCOc1nccnc1N Amb10601935 [1,1,0,0,0,0|2,0,0]=4 3429 B10R1.4 CCSC1=CC=CNC1=O Amb24478310 [1,1,0,0,0,0|1,1,0]=4 3430 B10R1.4 CCSc1[n]cccc1Br Amb25075348 [1,1,0,0,0,0|1,1,0]=4 3431 B10R1.4 CCSc1[n]cccc1Cl Amb24403624 [1,1,0,0,0,0|1,1,0]=4 3432 B10R1.4 CCSc1c[n]ccc1Cl Amb24549425 [1,1,0,0,0,0|1,1,0]=4 3433 B10R1.4 CCSc1ccc[n]c1Cl Amb25837979 [1,1,0,0,0,0|1,1,0]=4 3434 B10R1.4 CCSc1ccc[n]c1F Amb24085371 [1,1,0,0,0,0|1,1,0]=4 3435 B10R1.4 CCSc1ccccc1Br Amb20242712 [1,1,0,0,0,0|0,1,0]=3 3436 B10R1.4 CCSc1ccccc1F Amb24480376 [1,1,0,0,0,0|0,1,0]=3 3437 B10R1.4 CCSc1ccccc1N Amb10609429 [1,1,0,0,0,0|0,1,0]=3 3438 B10R1.4 CCSc1ncccc1O Amb10552831 [1,1,0,0,0,0|1,1,0]=4 3439 B10R1.4 CNCc1ccccc1Br Amb1210073 [1,1,0,0,0,0|2,0,0]=4 3440 B10R1.4 CNCc1ccccc1C Amb1648007 [1,1,0,0,0,0|2,0,0]=4 3441 B10R1.4 CNCc1ccccc1Cl Amb1694838 [1,1,0,0,0,0|2,0,0]=4 3442 B10R1.4 CNCc1ccccc1F Amb10609411 [1,1,0,0,0,0|2,0,0]=4 3443 B10R1.4 CNCc1ccccc1F Amb1675335 [1,1,0,0,0,0|2,0,0]=4 3444 B10R1.4 CNCc1ccccc1I Amb21861741 [1,1,0,0,0,0|2,0,0]=4 3445 B10R1.4 CNCc1ccccc1O Amb1113119 [1,1,0,0,0,0|2,0,0]=4 3446 B10R1.4 CNCc1ccccc1O Amb19930187 [1,1,0,0,0,0|2,0,0]=4 3447 B10R1.4 CNNc1ccccc1Cl Amb22469809 [1,1,0,0,0,0|2,0,0]=4 3448 B10R1.4 CNNc1ccccc1N Amb24654786 [1,1,0,0,0,0|2,0,0]=4 3449 B10R1.4 CN\C=C/1\C=CC=CC1=N Amb24392543 [1,1,0,0,0,0|2,0,0]=4 3450 B10R1.4 COCc1ccccc1I Amb19373361 [1,1,0,0,0,0|2,0,0]=4 3451 B10R1.4 COCc1ccccc1O Amb22751673 [1,1,0,0,0,0|2,0,0]=4 3452 B10R1.4 CO\N=C/1\C=CC=CC1=O Amb25340128 [1,1,0,0,0,0|2,0,0]=4 3453 B10R1.4 CO\N=C\1/C=CC=CC1=O Amb25146545 [1,1,0,0,0,0|2,0,0]=4 3454 B10R1.4 CSCc1ccccc1N Amb18951025 [1,1,0,0,0,0|2,0,0]=4 3455 B10R1.4 CSCc1ccccc1O Amb18125792 [1,1,0,0,0,0|2,0,0]=4 3456 B10R1.4 C[n+]1ccccc1CCF Amb24667673 [1,1,0,0,0,0|2,0,0]=4 3457 B10R1.4 C\C=C/c1ccccc1O Amb24422361 [1,1,0,0,0,0|1,0,1]=4 3458 B10R1.4 C\C=C\c1ccccc1Cl Amb22054732 [1,1,0,0,0,0|1,0,1]=4 3459 B10R1.4 C\C=C\c1ccccc1N Amb18642929 [1,1,0,0,0,0|1,0,1]=4 3460 B10R1.4 C\C=N\c1ccccc1N Amb24715815 [1,1,0,0,0,0|1,0,1]=4 3461 B10R1.4 C\C=N\c1ccccc1O Amb25296771 [1,1,0,0,0,0|1,0,1]=4 3462 B10R1.4 C\N=C\c1ccccc1O Amb25179640 [1,1,0,0,0,0|2,0,0]=4 3463 B10R1.4 C\N=N\c1ccccc1N Amb25316282 [1,1,0,0,0,0|2,0,0]=4 3464 B10R1.4 Cc1[n]c[n]cc1CCO Amb24063133 [1,1,0,0,0,0|2,0,0]=4 3465 B10R1.4 Cc1[n]cccc1CCC Amb24724101 [1,1,0,0,0,0|2,0,0]=4 3466 B10R1.4 Cc1[n]cccc1CCCl Amb24085167 [1,1,0,0,0,0|2,0,0]=4 3467 B10R1.4 Cc1[n]cccc1CCCl Amb25087825 [1,1,0,0,0,0|2,0,0]=4 3468 B10R1.4 Cc1[n]cccc1CCN Amb18203091 [1,1,0,0,0,0|2,0,0]=4 3469 B10R1.4 Cc1[n]cccc1CCO Amb24061576 [1,1,0,0,0,0|1,0,0]=3 3470 B10R1.4 Cc1[n]cccc1OCC Amb24057152 [1,1,0,0,0,0|1,0,0]=3 3471 B10R1.4 Cc1[n]cccc1OCCl Amb25215269 [1,1,0,0,0,0|2,0,0]=4 3472 B10R1.4 Cc1c[n]ccc1CCBr Amb24548352 [1,1,0,0,0,0|2,0,0]=4 3473 B10R1.4 Cc1c[n]ccc1CCI Amb24560492 [1,1,0,0,0,0|2,0,0]=4 3474 B10R1.4 Cc1c[n]ccc1CCN Amb22059435 [1,1,0,0,0,0|2,0,0]=4 3475 B10R1.4 Cc1c[n]ccc1CCS Amb25197336 [1,1,0,0,0,0|1,1,0]=4 3476 B10R1.4 Cc1c[n]ccc1OCC Amb24062205 [1,1,0,0,0,0|1,0,0]=3 3477 B10R1.4 Cc1cc[n][n]c1OCC Amb25254275 [1,1,0,0,0,0|2,0,0]=4 3478 B10R1.4 Cc1cc[n]cc1CCBr Amb24693233 [1,1,0,0,0,0|2,0,0]=4 3479 B10R1.4 Cc1cc[n]cc1CCN Amb18832435 [1,1,0,0,0,0|2,0,0]=4 3480 B10R1.4 Cc1cc[n]cc1CNO Amb25135601 [1,1,0,0,0,0|2,0,0]=4 3481 B10R1.4 Cc1ccc[n]c1CCBr Amb24641164 [1,1,0,0,0,0|2,0,0]=4 3482 B10R1.4 Cc1ccc[n]c1NCC Amb18959725 [1,1,0,0,0,0|2,0,0]=4 3483 B10R1.4 Cc1ccc[n]c1OCC Amb25198320 [1,1,0,0,0,0|1,0,0]=3 3484 B10R1.4 Cc1cccc[n+]1CCF Amb25048247 [1,1,0,0,0,0|2,0,0]=4 3485 B10R1.4 Cc1ccccc1C#CC Amb24092689 [1,1,0,0,0,0|1,0,1]=4 3486 B10R1.4 Cc1ccccc1C=NO Amb24084825 [1,1,0,0,0,0|1,0,1]=4 3487 B10R1.4 Cc1ccccc1CCC Amb22227985 [1,1,0,0,0,0|1,0,0]=3 3488 B10R1.4 Cc1ccccc1CCN Amb20622598 [1,1,0,0,0,0|1,0,0]=3 3489 B10R1.4 Cc1ccccc1CNN Amb21954057 [1,1,0,0,0,0|2,0,0]=4 3490 B10R1.4 Cc1ccccc1CNO Amb25343987 [1,1,0,0,0,0|1,0,0]=3 3491 B10R1.4 Cc1ccccc1CSC Amb24370548 [1,1,0,0,0,0|2,0,0]=4 3492 B10R1.4 Cc1ccccc1C[Mg]Cl Amb22000539 [1,1,0,0,0,0|2,0,0]=4 3493 B10R1.4 Cc1ccccc1C[Zn]Cl Amb22000455 [1,1,0,0,0,0|2,0,0]=4 3494 B10R1.4 Cc1ccccc1OC#N Amb24371118 [1,1,0,0,0,0|1,0,1]=4 3495 B10R1.4 Cc1ccccc1OC=C Amb17674186 [1,1,0,0,0,0|0,0,2]=4 3496 B10R1.4 ClCCc1ccccc1Br Amb24644893 [1,1,0,0,0,0|1,0,0]=3 3497 B10R1.4 ClCCc1ccccc1I Amb24742826 [1,1,0,0,0,0|1,0,0]=3 3498 B10R1.4 Clc1c[n]ccc1CCBr Amb25076266 [1,1,0,0,0,0|2,0,0]=4 3499 B10R1.4 Clc1ccccc1CCI Amb25048390 [1,1,0,0,0,0|1,0,0]=3 3500 B10R1.4 Clc1ccccc1C[Mg]Cl Amb19928783 [1,1,0,0,0,0|2,0,0]=4 3501 B10R1.4 Clc1ccccc1C[Zn]Cl Amb22000427 [1,1,0,0,0,0|2,0,0]=4 3502 B10R1.4 Clc1ccccc1OCCl Amb22227923 [1,1,0,0,0,0|1,0,0]=3 3503 B10R1.4 FCCc1ccccc1Br Amb24754179 [1,1,0,0,0,0|1,0,0]=3 3504 B10R1.4 FCCc1ccccc1I Amb22739042 [1,1,0,0,0,0|1,0,0]=3 3505 B10R1.4 FCOc1ccc[n]c1Cl Amb25855246 [1,1,0,0,0,0|2,0,0]=4 3506 B10R1.4 Fc1c[n]ccc1CCBr Amb25172854 [1,1,0,0,0,0|2,0,0]=4 3507 B10R1.4 Fc1ccccc1C[Zn]Cl Amb17672035 [1,1,0,0,0,0|2,0,0]=4 3508 B10R1.4 Fc1ccccc1OCCl Amb25356820 [1,1,0,0,0,0|1,0,0]=3 3509 B10R1.4 N#CCc1ccccc1Br Amb1140623 [1,1,0,0,0,0|1,0,1]=4 3510 B10R1.4 N#CCc1ccccc1C Amb1651450 [1,1,0,0,0,0|1,0,1]=4 3511 B10R1.4 N#CCc1ccccc1Cl Amb1644930 [1,1,0,0,0,0|1,0,1]=4 3512 B10R1.4 N#CCc1ccccc1N Amb17607888 [1,1,0,0,0,0|1,0,1]=4 3513 B10R1.4 N#CCc1ccccc1O Amb18642921 [1,1,0,0,0,0|1,0,1]=4 3514 B10R1.4 N=C1C=CC=CN1CCO Amb18548415 [1,1,0,0,0,0|1,0,0]=3 3515 B10R1.4 N=C1N=CC=CN1CCO Amb25294330 [1,1,0,0,0,0|2,0,0]=4 3516 B10R1.4 NCCC1=CC=CCC1=S Amb24664855 [1,1,0,0,0,0|1,0,1]=4 3517 B10R1.4 NCCN1C=CC=CC1=O Amb18535437 [1,1,0,0,0,0|2,0,0]=4 3518 B10R1.4 NCCN1C=CC=CC1=O Amb19514535 [1,1,0,0,0,0|2,0,0]=4 3519 B10R1.4 NCCN1C=CC=CC1=O Amb20668789 [1,1,0,0,0,0|2,0,0]=4 3520 B10R1.4 NCCc1[n]cccc1Br Amb24183541 [1,1,0,0,0,0|2,0,0]=4 3521 B10R1.4 NCCc1[n]cccc1Cl Amb18200051 [1,1,0,0,0,0|2,0,0]=4 3522 B10R1.4 NCCc1c[n]ccc1F Amb25721852 [1,1,0,0,0,0|2,0,0]=4 3523 B10R1.4 NCCc1cc[n]cc1Cl Amb23596506 [1,1,0,0,0,0|2,0,0]=4 3524 B10R1.4 NCCc1cc[n]cc1F Amb24383725 [1,1,0,0,0,0|2,0,0]=4 3525 B10R1.4 NCCc1cc[n]cc1O Amb24357020 [1,1,0,0,0,0|2,0,0]=4 3526 B10R1.4 NCCc1ccc[n]c1Br Amb25190186 [1,1,0,0,0,0|2,0,0]=4 3527 B10R1.4 NCCc1ccc[n]c1Cl Amb24551153 [1,1,0,0,0,0|2,0,0]=4 3528 B10R1.4 NCCc1ccc[n]c1F Amb24062493 [1,1,0,0,0,0|2,0,0]=4 3529 B10R1.4 NCCc1ccccc1Br Amb22395128 [1,1,0,0,0,0|1,0,0]=3 3530 B10R1.4 NCCc1ccccc1C Amb1212557 [1,1,0,0,0,0|1,0,0]=3 3531 B10R1.4 NCCc1ccccc1Cl Amb22490604 [1,1,0,0,0,0|1,0,0]=3 3532 B10R1.4 NCCc1ccccc1F Amb22039505 [1,1,0,0,0,0|1,0,0]=3 3533 B10R1.4 NCCc1ccccc1O Amb10609215 [1,1,0,0,0,0|1,0,0]=3 3534 B10R1.4 NCCc1ccccc1S Amb25831177 [1,1,0,0,0,0|1,0,0]=3 3535 B10R1.4 NCCc1ncccc1C Amb1995200 [1,1,0,0,0,0|2,0,0]=4 3536 B10R1.4 NCOc1ccccc1O Amb24502152 [1,1,0,0,0,0|1,0,0]=3 3537 B10R1.4 NNCc1ccccc1Br Amb1116234 [1,1,0,0,0,0|2,0,0]=4 3538 B10R1.4 NNCc1ccccc1Br Amb19893262 [1,1,0,0,0,0|2,0,0]=4 3539 B10R1.4 NNCc1ccccc1C Amb1118964 [1,1,0,0,0,0|2,0,0]=4 3540 B10R1.4 NNCc1ccccc1Cl Amb21959997 [1,1,0,0,0,0|2,0,0]=4 3541 B10R1.4 NNCc1ccccc1F Amb19893256 [1,1,0,0,0,0|2,0,0]=4 3542 B10R1.4 NNCc1ccccc1O Amb24681968 [1,1,0,0,0,0|2,0,0]=4 3543 B10R1.4 NOCc1ccccc1Br Amb17091454 [1,1,0,0,0,0|2,0,0]=4 3544 B10R1.4 NOCc1ccccc1Br Amb21929112 [1,1,0,0,0,0|2,0,0]=4 3545 B10R1.4 NOCc1ccccc1C Amb17091424 [1,1,0,0,0,0|2,0,0]=4 3546 B10R1.4 NOCc1ccccc1Cl Amb19889789 [1,1,0,0,0,0|2,0,0]=4 3547 B10R1.4 NOCc1ccccc1F Amb19894376 [1,1,0,0,0,0|2,0,0]=4 3548 B10R1.4 NOCc1ccccc1I Amb22235087 [1,1,0,0,0,0|2,0,0]=4 3549 B10R1.4 NOCc1ccccc1O Amb24502260 [1,1,0,0,0,0|2,0,0]=4 3550 B10R1.4 Nc1[n]cccc1CCN Amb25714008 [1,1,0,0,0,0|2,0,0]=4 3551 B10R1.4 Nc1[n]cccc1CCO Amb21858404 [1,1,0,0,0,0|1,0,0]=3 3552 B10R1.4 Nc1c[n]ccc1CCN Amb22491934 [1,1,0,0,0,0|2,0,0]=4 3553 B10R1.4 Nc1c[n]ccc1CCO Amb25291562 [1,1,0,0,0,0|1,0,0]=3 3554 B10R1.4 Nc1cc[n]cc1CCCl Amb25027844 [1,1,0,0,0,0|2,0,0]=4 3555 B10R1.4 Nc1cc[n]cc1CCN Amb25063861 [1,1,0,0,0,0|2,0,0]=4 3556 B10R1.4 Nc1cc[n]cc1CCO Amb24062498 [1,1,0,0,0,0|1,0,0]=3 3557 B10R1.4 Nc1cc[n]cc1OCF Amb25144533 [1,1,0,0,0,0|2,0,0]=4 3558 B10R1.4 Nc1ccccc1CCBr Amb24079731 [1,1,0,0,0,0|1,0,0]=3 3559 B10R1.4 Nc1ccccc1CCBr Amb24573051 [1,1,0,0,0,0|1,0,0]=3 3560 B10R1.4 Nc1ccccc1CCF Amb24554505 [1,1,0,0,0,0|1,0,0]=3 3561 B10R1.4 Nc1ccccc1CCN Amb20670599 [1,1,0,0,0,0|1,0,0]=3 3562 B10R1.4 Nc1ccccc1CCP Amb25808564 [1,1,0,0,0,0|1,0,0]=3 3563 B10R1.4 Nc1ccccc1CCS Amb25114690 [1,1,0,0,0,0|0,1,0]=3 3564 B10R1.4 Nc1ccccc1CNN Amb25294794 [1,1,0,0,0,0|2,0,0]=4 3565 B10R1.4 Nc1ccccc1CNO Amb25345206 [1,1,0,0,0,0|1,0,0]=3 3566 B10R1.4 Nc1ccccc1OCF Amb25112317 [1,1,0,0,0,0|1,0,0]=3 3567 B10R1.4 Nc1ccccc1SCCl Amb25720293 [1,1,0,0,0,0|1,1,0]=4 3568 B10R1.4 O=C1C=CC=CN1CCBr Amb19514604 [1,1,0,0,0,0|2,0,0]=4 3569 B10R1.4 O=C1C=CC=CN1CCCl Amb18787739 [1,1,0,0,0,0|2,0,0]=4 3570 B10R1.4 O=CCc1ccccc1Br Amb18634182 [1,1,0,0,0,0|0,0,2]=4 3571 B10R1.4 O=CCc1ccccc1C Amb10844840 [1,1,0,0,0,0|0,0,2]=4 3572 B10R1.4 O=CCc1ccccc1Cl Amb16230448 [1,1,0,0,0,0|0,0,2]=4 3573 B10R1.4 O=CCc1ccccc1F Amb10844839 [1,1,0,0,0,0|0,0,2]=4 3574 B10R1.4 O=CCc1ccccc1I Amb25377055 [1,1,0,0,0,0|0,0,2]=4 3575 B10R1.4 O=COc1ccccc1O Amb17593488 [1,1,0,0,0,0|0,0,2]=4 3576 B10R1.4 O=c1cccc[n]1CCCl Amb22274576 [1,1,0,0,0,0|2,0,0]=4 3577 B10R1.4 OCCN1C=CC=CC1=O Amb18041231 [1,1,0,0,0,0|1,0,0]=3 3578 B10R1.4 OCCN1C=CC=CC1=S Amb25065240 [1,1,0,0,0,0|1,0,0]=3 3579 B10R1.4 OCCN1C=NC=CC1=O Amb25263218 [1,1,0,0,0,0|2,0,0]=4 3580 B10R1.4 OCCN1N=CC=CC1=O Amb24591459 [1,1,0,0,0,0|2,0,0]=4 3581 B10R1.4 OCCc1[n]cccc1Br Amb22896751 [1,1,0,0,0,0|1,0,0]=3 3582 B10R1.4 OCCc1c[n]ccc1Cl Amb24364650 [1,1,0,0,0,0|1,0,0]=3 3583 B10R1.4 OCCc1cc[n]cc1Br Amb24482101 [1,1,0,0,0,0|1,0,0]=3 3584 B10R1.4 OCCc1cc[n]cc1F Amb25776747 [1,1,0,0,0,0|1,0,0]=3 3585 B10R1.4 OCCc1ccc[n]c1F Amb24513826 [1,1,0,0,0,0|1,0,0]=3 3586 B10R1.4 OCCc1ccccc1I Amb22753529 [1,1,0,0,0,0|0,0,0]=2 3587 B10R1.4 OCCc1ccccc1S Amb24672563 [1,1,0,0,0,0|0,0,0]=2 3588 B10R1.4 ONCc1ccc[n]c1Cl Amb21847006 [1,1,0,0,0,0|2,0,0]=4 3589 B10R1.4 ONCc1ccccc1Br Amb23449448 [1,1,0,0,0,0|1,0,0]=3 3590 B10R1.4 ONCc1ccccc1Cl Amb25729506 [1,1,0,0,0,0|1,0,0]=3 3591 B10R1.4 O\N=C/c1ccccc1Br Amb25247795 [1,1,0,0,0,0|1,0,1]=4 3592 B10R1.4 O\N=C\c1ccccc1Br Amb1152031 [1,1,0,0,0,0|1,0,1]=4 3593 B10R1.4 O\N=C\c1ccccc1C Amb1647706 [1,1,0,0,0,0|1,0,1]=4 3594 B10R1.4 O\N=C\c1ccccc1Cl Amb1152026 [1,1,0,0,0,0|1,0,1]=4 3595 B10R1.4 O\N=C\c1ccccc1F Amb1152952 [1,1,0,0,0,0|1,0,1]=4 3596 B10R1.4 O\N=C\c1ccccc1I Amb1782090 [1,1,0,0,0,0|1,0,1]=4 3597 B10R1.4 O\N=C\c1ccccc1O Amb1159212 [1,1,0,0,0,0|1,0,1]=4 3598 B10R1.4 Oc1[n]c[n]cc1CCO Amb24063132 [1,1,0,0,0,0|2,0,0]=4 3599 B10R1.4 Oc1ccc[n]c1CCO Amb24062095 [1,1,0,0,0,0|1,0,0]=3 3600 B10R1.4 Oc1ccccc1CCBr Amb18130684 [1,1,0,0,0,0|1,0,0]=3 3601 B10R1.4 Oc1ccccc1CCCl Amb25790019 [1,1,0,0,0,0|1,0,0]=3 3602 B10R1.4 Oc1ccccc1CCF Amb25768394 [1,1,0,0,0,0|1,0,0]=3 3603 B10R1.4 Oc1ccccc1CCI Amb25208761 [1,1,0,0,0,0|1,0,0]=3 3604 B10R1.4 Oc1ccccc1CCS Amb24362789 [1,1,0,0,0,0|0,1,0]=3 3605 B10R1.4 Oc1ccccc1CNO Amb25128279 [1,1,0,0,0,0|1,0,0]=3 3606 B10R1.4 Oc1ccccc1OCS Amb25070463 [1,1,0,0,0,0|0,1,0]=3 3607 B10R1.4 SCCc1ccccc1Br Amb25851259 [1,1,0,0,0,0|0,1,0]=3 3608 B10R1.4 SCCc1ccccc1C Amb17399938 [1,1,0,0,0,0|0,1,0]=3 3609 B10R1.4 SCCc1ccccc1Cl Amb17400374 [1,1,0,0,0,0|0,1,0]=3 3610 B10R1.4 SCCc1ccccc1F Amb17400004 [1,1,0,0,0,0|0,1,0]=3 3611 B10R1.4 SCCc1ccccc1I Amb24089655 [1,1,0,0,0,0|0,1,0]=3 3612 B10R1.4 [NH3+]OCc1ccccc1Br Amb2414824 [1,1,0,0,0,0|2,0,0]=4 3613 B10R1.4 [NH3+]OCc1ccccc1Cl Amb2437206 [1,1,0,0,0,0|2,0,0]=4 3614 B10R1.10 BrCCc1cc(I)ccc1 Amb25137377 [1,1,0,0,0,0|1,0,0]=3 3615 B10R1.10 Br[Zn]Cc1cccc(I)c1 Amb22000468 [1,1,0,0,0,0|2,0,0]=4 3616 B10R1.10 Brc1c[n]cc(CCBr)c1 Amb25147780 [1,1,0,0,0,0|2,0,0]=4 3617 B10R1.10 Brc1cccc(CCBr)c1 Amb18048758 [1,1,0,0,0,0|1,0,0]=3 3618 B10R1.10 Brc1cccc(C[Mg]Br)c1 Amb22000537 [1,1,0,0,0,0|2,0,0]=4 3619 B10R1.10 Brc1cccc(C[Zn]Br)c1 Amb22000431 [1,1,0,0,0,0|2,0,0]=4 3620 B10R1.10 C#COc1cccc(O)c1 Amb25130634 [1,1,0,0,0,0|0,0,2]=4 3621 B10R1.10 C=CCc1cccc(N)c1 Amb25147344 [1,1,0,0,0,0|1,0,1]=4 3622 B10R1.10 C=CCc1cccc(O)c1 Amb22735821 [1,1,0,0,0,0|1,0,1]=4 3623 B10R1.10 C=COc1cccc(Br)c1 Amb25248086 [1,1,0,0,0,0|0,0,2]=4 3624 B10R1.10 C=COc1cccc(Cl)c1 Amb24092694 [1,1,0,0,0,0|0,0,2]=4 3625 B10R1.10 C=COc1cccc(I)c1 Amb25144604 [1,1,0,0,0,0|0,0,2]=4 3626 B10R1.10 C=COc1cccc(N)c1 Amb18124447 [1,1,0,0,0,0|0,0,2]=4 3627 B10R1.10 CC#Cc1cc(Br)ccc1 Amb22491725 [1,1,0,0,0,0|1,0,1]=4 3628 B10R1.10 CC#Cc1cc(N)ccc1 Amb24085142 [1,1,0,0,0,0|1,0,1]=4 3629 B10R1.10 CC#Cc1cc(O)ccc1 Amb24102493 [1,1,0,0,0,0|1,0,1]=4 3630 B10R1.10 CCCC1=CC(=O)C=CO1 Amb25262571 [1,1,0,0,0,0|2,0,0]=4 3631 B10R1.10 CCCC1=CC=CC(=S)N1 Amb25081453 [1,1,0,0,0,0|2,0,0]=4 3632 B10R1.10 CCC[n+]1cc(C)ccc1 Amb24451271 [1,1,0,0,0,0|2,0,0]=4 3633 B10R1.10 CCC[n+]1cc(O)ccc1 Amb25134204 [1,1,0,0,0,0|2,0,0]=4 3634 B10R1.10 CCCc1cc(Br)c[n]c1 Amb20617637 [1,1,0,0,0,0|2,0,0]=4 3635 B10R1.10 CCCc1cc(Br)ccc1 Amb25736130 [1,1,0,0,0,0|1,0,0]=3 3636 B10R1.10 CCCc1cc(Br)ccn1 Amb10599773 [1,1,0,0,0,0|2,0,0]=4 3637 B10R1.10 CCCc1cc(Cl)c[n]c1 Amb20620848 [1,1,0,0,0,0|2,0,0]=4 3638 B10R1.10 CCCc1cc(Cl)cc[n]1 Amb22756169 [1,1,0,0,0,0|2,0,0]=4 3639 B10R1.10 CCCc1cc(F)cc[n]1 Amb24318797 [1,1,0,0,0,0|2,0,0]=4 3640 B10R1.10 CCCc1cc(F)ccc1 Amb22235098 [1,1,0,0,0,0|1,0,0]=3 3641 B10R1.10 CCCc1cc(N)[n]cc1 Amb22491555 [1,1,0,0,0,0|2,0,0]=4 3642 B10R1.10 CCCc1cc(N)c[n]c1 Amb18832432 [1,1,0,0,0,0|2,0,0]=4 3643 B10R1.10 CCCc1cc(N)ccc1 Amb18643014 [1,1,0,0,0,0|1,0,0]=3 3644 B10R1.10 CCCc1cc(N)ccn1 Amb10599774 [1,1,0,0,0,0|2,0,0]=4 3645 B10R1.10 CCCc1cc(O)c[n]c1 Amb20617709 [1,1,0,0,0,0|2,0,0]=4 3646 B10R1.10 CCCc1cc(O)ccn1 Amb10599775 [1,1,0,0,0,0|2,0,0]=4 3647 B10R1.10 CCCc1cccc(F)[n]1 Amb24319133 [1,1,0,0,0,0|2,0,0]=4 3648 B10R1.10 CCCc1cccc(n1)Br Amb10600122 [1,1,0,0,0,0|2,0,0]=4 3649 B10R1.10 CCCc1cccc(n1)O Amb10600153 [1,1,0,0,0,0|2,0,0]=4 3650 B10R1.10 CCCc1ccnc(c1)Br Amb10599856 [1,1,0,0,0,0|2,0,0]=4 3651 B10R1.10 CCCc1ccnc(c1)O Amb10599858 [1,1,0,0,0,0|2,0,0]=4 3652 B10R1.10 CCNc1c[n]cc(Br)c1 Amb23450116 [1,1,0,0,0,0|2,0,0]=4 3653 B10R1.10 CCNc1c[n]cc(F)c1 Amb25357603 [1,1,0,0,0,0|2,0,0]=4 3654 B10R1.10 CCNc1c[n]cc(N)c1 Amb25331613 [1,1,0,0,0,0|2,0,0]=4 3655 B10R1.10 CCNc1cc(Cl)ccn1 Amb15692076 [1,1,0,0,0,0|2,0,0]=4 3656 B10R1.10 CCNc1cc(F)cc[n]1 Amb24703961 [1,1,0,0,0,0|2,0,0]=4 3657 B10R1.10 CCNc1cc(N)ccn1 Amb17334158 [1,1,0,0,0,0|2,0,0]=4 3658 B10R1.10 CCNc1cc(O)ccc1 Amb22168804 [1,1,0,0,0,0|1,0,0]=3 3659 B10R1.10 CCNc1cc[n]c(Br)c1 Amb24534676 [1,1,0,0,0,0|2,0,0]=4 3660 B10R1.10 CCNc1cc[n]c(F)c1 Amb25107899 [1,1,0,0,0,0|2,0,0]=4 3661 B10R1.10 CCNc1cccc(Br)[n]1 Amb22271124 [1,1,0,0,0,0|2,0,0]=4 3662 B10R1.10 CCNc1cccc(Br)[n]1 Amb22411595 [1,1,0,0,0,0|2,0,0]=4 3663 B10R1.10 CCNc1cccc(Cl)[n]1 Amb21956629 [1,1,0,0,0,0|2,0,0]=4 3664 B10R1.10 CCNc1cccc(F)[n]1 Amb18951804 [1,1,0,0,0,0|2,0,0]=4 3665 B10R1.10 CCNc1cccc(N)[n]1 Amb25147360 [1,1,0,0,0,0|2,0,0]=4 3666 B10R1.10 CCNc1cccc(c1)F Amb10609458 [1,1,0,0,0,0|1,0,0]=3 3667 B10R1.10 CCNc1cccc(n1)C Amb10553057 [1,1,0,0,0,0|2,0,0]=4 3668 B10R1.10 CCNc1ccnc(c1)Cl Amb13952186 [1,1,0,0,0,0|2,0,0]=4 3669 B10R1.10 CCOC1=CC(=O)NC=N1 Amb24356773 [1,1,0,0,0,0|2,0,0]=4 3670 B10R1.10 CCOC1=CC(=S)NC=N1 Amb24505286 [1,1,0,0,0,0|2,0,0]=4 3671 B10R1.10 CCOC=1C=CNC(=S)N1 Amb24480619 [1,1,0,0,0,0|2,0,0]=4 3672 B10R1.10 CCOC=1C=NNC(=O)C1 Amb22276548 [1,1,0,0,0,0|2,0,0]=4 3673 B10R1.10 CCOc1[n]c(O)cc[n]1 Amb22396480 [1,1,0,0,0,0|2,0,0]=4 3674 B10R1.10 CCOc1c[n+]([O-])ccc1 Amb25206359 [1,1,0,0,0,0|1,0,0]=3 3675 B10R1.10 CCOc1c[n][n]c(Cl)c1 Amb22276390 [1,1,0,0,0,0|2,0,0]=4 3676 B10R1.10 CCOc1c[n]c[n+]([O-])c1 Amb24725929 [1,1,0,0,0,0|2,0,0]=4 3677 B10R1.10 CCOc1c[n]cc(Cl)c1 Amb20242819 [1,1,0,0,0,0|1,0,0]=3 3678 B10R1.10 CCOc1c[n]cc(F)c1 Amb24085977 [1,1,0,0,0,0|1,0,0]=3 3679 B10R1.10 CCOc1c[n]cc(N)[n]1 Amb18643400 [1,1,0,0,0,0|2,0,0]=4 3680 B10R1.10 CCOc1c[n]cc(O)c1 Amb23455720 [1,1,0,0,0,0|1,0,0]=3 3681 B10R1.10 CCOc1cc(Br)ccn1 Amb10576613 [1,1,0,0,0,0|1,0,0]=3 3682 B10R1.10 CCOc1cc(Cl)cc[n]1 Amb19957988 [1,1,0,0,0,0|1,0,0]=3 3683 B10R1.10 CCOc1cc(Cl)ncn1 Amb10576559 [1,1,0,0,0,0|2,0,0]=4 3684 B10R1.10 CCOc1cc(F)[n]c[n]1 Amb24524327 [1,1,0,0,0,0|2,0,0]=4 3685 B10R1.10 CCOc1cc(F)cc[n]1 Amb24317829 [1,1,0,0,0,0|1,0,0]=3 3686 B10R1.10 CCOc1cc(I)cc[n]1 Amb22498330 [1,1,0,0,0,0|1,0,0]=3 3687 B10R1.10 CCOc1cc(N)[n]c[n]1 Amb18854351 [1,1,0,0,0,0|2,0,0]=4 3688 B10R1.10 CCOc1cc(O)cc[n]1 Amb21857254 [1,1,0,0,0,0|1,0,0]=3 3689 B10R1.10 CCOc1cc[nH]c(=O)n1 Amb10552632 [1,1,0,0,0,0|2,0,0]=4 3690 B10R1.10 CCOc1cc[n]c(N)[n]1 Amb21984141 [1,1,0,0,0,0|2,0,0]=4 3691 B10R1.10 CCOc1cccc(Cl)c1 Amb20242486 [1,1,0,0,0,0|0,0,0]=2 3692 B10R1.10 CCOc1cccc(F)[n]1 Amb22641531 [1,1,0,0,0,0|1,0,0]=3 3693 B10R1.10 CCOc1cccc(I)[n]1 Amb25725603 [1,1,0,0,0,0|1,0,0]=3 3694 B10R1.10 CCOc1cccc(I)c1 Amb19196001 [1,1,0,0,0,0|0,0,0]=2 3695 B10R1.10 CCOc1cccc(c1)N Amb1124598 [1,1,0,0,0,0|0,0,0]=2 3696 B10R1.10 CCOc1cccc(c1)S Amb10070967 [1,1,0,0,0,0|0,0,0]=2 3697 B10R1.10 CCOc1ccnc(c1)F Amb15691032 [1,1,0,0,0,0|1,0,0]=3 3698 B10R1.10 CCOc1cncc(c1)Br Amb15691049 [1,1,0,0,0,0|1,0,0]=3 3699 B10R1.10 CCOc1cncc(n1)Br Amb10600298 [1,1,0,0,0,0|2,0,0]=4 3700 B10R1.10 CCOc1nccc(=O)[nH]1 Amb10552629 [1,1,0,0,0,0|2,0,0]=4 3701 B10R1.10 CCOc1nccc(n1)Br Amb10599662 [1,1,0,0,0,0|2,0,0]=4 3702 B10R1.10 CCOc1nccc(n1)Cl Amb10597610 [1,1,0,0,0,0|2,0,0]=4 3703 B10R1.10 CCSc1cc(Cl)cc[n]1 Amb22276362 [1,1,0,0,0,0|1,1,0]=4 3704 B10R1.10 CCSc1cc(N)cc[n]1 Amb18956447 [1,1,0,0,0,0|1,1,0]=4 3705 B10R1.10 CCSc1cc[n]c(Br)c1 Amb25178860 [1,1,0,0,0,0|1,1,0]=4 3706 B10R1.10 CCSc1cc[n]c(Cl)c1 Amb19149189 [1,1,0,0,0,0|1,1,0]=4 3707 B10R1.10 CCSc1cc[n]c(N)c1 Amb25065714 [1,1,0,0,0,0|1,1,0]=4 3708 B10R1.10 CCSc1cccc(Cl)[n]1 Amb24476954 [1,1,0,0,0,0|1,1,0]=4 3709 B10R1.10 CCSc1cccc(F)[n]1 Amb18787681 [1,1,0,0,0,0|1,1,0]=4 3710 B10R1.10 CCSc1cccc(F)c1 Amb25063729 [1,1,0,0,0,0|0,1,0]=3 3711 B10R1.10 CCSc1cccc(I)c1 Amb25162722 [1,1,0,0,0,0|0,1,0]=3 3712 B10R1.10 CCSc1cccc(N)c1 Amb18950176 [1,1,0,0,0,0|0,1,0]=3 3713 B10R1.10 CCSc1cccc(O)[n]1 Amb18644748 [1,1,0,0,0,0|1,1,0]=4 3714 B10R1.10 CCSc1cccc(O)c1 Amb18644674 [1,1,0,0,0,0|0,1,0]=3 3715 B10R1.10 CCSc1cccc(c1)Br Amb10067418 [1,1,0,0,0,0|0,1,0]=3 3716 B10R1.10 CNCc1cccc(Br)c1 Amb17935918 [1,1,0,0,0,0|2,0,0]=4 3717 B10R1.10 CNCc1cccc(Cl)c1 Amb19958745 [1,1,0,0,0,0|2,0,0]=4 3718 B10R1.10 CNCc1cccc(I)c1 Amb23569027 [1,1,0,0,0,0|2,0,0]=4 3719 B10R1.10 CNCc1cccc(O)c1 Amb19115406 [1,1,0,0,0,0|2,0,0]=4 3720 B10R1.10 CNCc1cccc(c1)Br Amb1114712 [1,1,0,0,0,0|2,0,0]=4 3721 B10R1.10 CNCc1cccc(c1)C Amb1116082 [1,1,0,0,0,0|2,0,0]=4 3722 B10R1.10 CNCc1cccc(c1)Cl Amb1648830 [1,1,0,0,0,0|2,0,0]=4 3723 B10R1.10 CNCc1cccc(c1)F Amb1647905 [1,1,0,0,0,0|2,0,0]=4 3724 B10R1.10 CNCc1cccc(c1)O Amb1131158 [1,1,0,0,0,0|2,0,0]=4 3725 B10R1.10 COCc1cccc(Br)c1 Amb18320155 [1,1,0,0,0,0|2,0,0]=4 3726 B10R1.10 COCc1cccc(Cl)c1 Amb24092696 [1,1,0,0,0,0|2,0,0]=4 3727 B10R1.10 COCc1cccc(F)c1 Amb20241023 [1,1,0,0,0,0|2,0,0]=4 3728 B10R1.10 COCc1cccc(I)c1 Amb24478076 [1,1,0,0,0,0|2,0,0]=4 3729 B10R1.10 COCc1cccc(O)c1 Amb19301751 [1,1,0,0,0,0|2,0,0]=4 3730 B10R1.10 CSCc1cccc(Br)c1 Amb22058705 [1,1,0,0,0,0|2,0,0]=4 3731 B10R1.10 CSCc1cccc(N)c1 Amb18951026 [1,1,0,0,0,0|2,0,0]=4 3732 B10R1.10 CSCc1cccc(O)c1 Amb23443323 [1,1,0,0,0,0|2,0,0]=4 3733 B10R1.10 CSSc1cc(O)ccc1 Amb25102858 [1,1,0,0,0,0|1,1,0]=4 3734 B10R1.10 C[n+]1cc(CCF)ccc1 Amb24759041 [1,1,0,0,0,0|2,0,0]=4 3735 B10R1.10 C\C=C\c1cccc(O)c1 Amb18124427 [1,1,0,0,0,0|1,0,1]=4 3736 B10R1.10 C\N=C\c1cccc(O)c1 Amb19115409 [1,1,0,0,0,0|2,0,0]=4 3737 B10R1.10 Cc1[n]c(CCO)cc[n]1 Amb25857537 [1,1,0,0,0,0|2,0,0]=4 3738 B10R1.10 Cc1c[n+](CCF)ccc1 Amb25762734 [1,1,0,0,0,0|2,0,0]=4 3739 B10R1.10 Cc1c[n]cc([n]1)OCC Amb20621608 [1,1,0,0,0,0|2,0,0]=4 3740 B10R1.10 Cc1c[n]cc(c1)NCC Amb24480940 [1,1,0,0,0,0|2,0,0]=4 3741 B10R1.10 Cc1c[n]cc(c1)OCC Amb24350527 [1,1,0,0,0,0|1,0,0]=3 3742 B10R1.10 Cc1cc(CCBr)c[n]c1 Amb24562207 [1,1,0,0,0,0|2,0,0]=4 3743 B10R1.10 Cc1cc(CCCl)[n]cc1 Amb24098630 [1,1,0,0,0,0|2,0,0]=4 3744 B10R1.10 Cc1cc(CCCl)c[n]c1 Amb25032253 [1,1,0,0,0,0|2,0,0]=4 3745 B10R1.10 Cc1cc(CCCl)ccc1 Amb18181942 [1,1,0,0,0,0|1,0,0]=3 3746 B10R1.10 Cc1cc(CCN)[n]cc1 Amb22899172 [1,1,0,0,0,0|2,0,0]=4 3747 B10R1.10 Cc1cc(CCN)c[n]c1 Amb18203095 [1,1,0,0,0,0|2,0,0]=4 3748 B10R1.10 Cc1cc(CCN)cc[n]1 Amb18203094 [1,1,0,0,0,0|2,0,0]=4 3749 B10R1.10 Cc1cc(CCN)ncc1 Amb1995201 [1,1,0,0,0,0|2,0,0]=4 3750 B10R1.10 Cc1cc(CCO)[n]cc1 Amb25679639 [1,1,0,0,0,0|1,0,0]=3 3751 B10R1.10 Cc1cc(CCO)cc[n]1 Amb24568116 [1,1,0,0,0,0|1,0,0]=3 3752 B10R1.10 Cc1cc(CNN)ccc1 Amb19890111 [1,1,0,0,0,0|2,0,0]=4 3753 B10R1.10 Cc1cc(CNO)ccc1 Amb25784359 [1,1,0,0,0,0|1,0,0]=3 3754 B10R1.10 Cc1cc(C[Zn]Cl)ccc1 Amb22000456 [1,1,0,0,0,0|2,0,0]=4 3755 B10R1.10 Cc1cc(\C=N\O)ccc1 Amb18041948 [1,1,0,0,0,0|1,0,1]=4 3756 B10R1.10 Cc1cc(cc[n]1)NCC Amb25110541 [1,1,0,0,0,0|2,0,0]=4 3757 B10R1.10 Cc1cc(cc[n]1)OCC Amb24687076 [1,1,0,0,0,0|1,0,0]=3 3758 B10R1.10 Cc1cc(ccc1)SCCl Amb24423887 [1,1,0,0,0,0|1,1,0]=4 3759 B10R1.10 Cc1cc[n]c(CCC)c1 Amb25844521 [1,1,0,0,0,0|2,0,0]=4 3760 B10R1.10 Cc1cc[n]c([n]1)OCC Amb24104374 [1,1,0,0,0,0|2,0,0]=4 3761 B10R1.10 Cc1cc[n]c(c1)NCC Amb18283607 [1,1,0,0,0,0|2,0,0]=4 3762 B10R1.10 Cc1cc[n]c(c1)SCC Amb24480868 [1,1,0,0,0,0|1,1,0]=4 3763 B10R1.10 Cc1cccc(CCC)[n]1 Amb24065788 [1,1,0,0,0,0|2,0,0]=4 3764 B10R1.10 Cc1cccc(CCC)c1 Amb22232362 [1,1,0,0,0,0|1,0,0]=3 3765 B10R1.10 Cc1cccc(CCCl)[n]1 Amb24090268 [1,1,0,0,0,0|2,0,0]=4 3766 B10R1.10 Cc1cccc(CCCl)[n]1 Amb24480495 [1,1,0,0,0,0|2,0,0]=4 3767 B10R1.10 Cc1cccc(CCS)[n]1 Amb24388552 [1,1,0,0,0,0|1,1,0]=4 3768 B10R1.10 Cc1cccc(CSC)c1 Amb24416576 [1,1,0,0,0,0|2,0,0]=4 3769 B10R1.10 Cc1cccc(OC=C)c1 Amb17674187 [1,1,0,0,0,0|0,0,2]=4 3770 B10R1.10 Cc1cccc([n]1)SCC Amb24105686 [1,1,0,0,0,0|1,1,0]=4 3771 B10R1.10 Cc1cccc(c1)C#CC Amb24092690 [1,1,0,0,0,0|1,0,1]=4 3772 B10R1.10 Cc1cccc(c1)SCC Amb25328608 [1,1,0,0,0,0|0,1,0]=3 3773 B10R1.10 Cc1cccc(c1)\C=N\C Amb24524529 [1,1,0,0,0,0|2,0,0]=4 3774 B10R1.10 Cc1cccc(n1)CCN Amb1995202 [1,1,0,0,0,0|2,0,0]=4 3775 B10R1.10 ClCCc1cc(Br)ccc1 Amb24502263 [1,1,0,0,0,0|1,0,0]=3 3776 B10R1.10 ClCOc1cccc(I)c1 Amb25272062 [1,1,0,0,0,0|1,0,0]=3 3777 B10R1.10 ClCSc1cccc(Br)c1 Amb24479383 [1,1,0,0,0,0|1,1,0]=4 3778 B10R1.10 Clc1c[n]cc(c1)OCCl Amb25344278 [1,1,0,0,0,0|2,0,0]=4 3779 B10R1.10 Clc1cccc(CCCl)c1 Amb18185798 [1,1,0,0,0,0|1,0,0]=3 3780 B10R1.10 Clc1cccc(C[Mg]Cl)c1 Amb19928782 [1,1,0,0,0,0|2,0,0]=4 3781 B10R1.10 Clc1cccc(C[Zn]Cl)c1 Amb22000428 [1,1,0,0,0,0|2,0,0]=4 3782 B10R1.10 Clc1cccc(c1)OCCl Amb24482267 [1,1,0,0,0,0|1,0,0]=3 3783 B10R1.10 FCCc1cccc(Br)[n]1 Amb25228145 [1,1,0,0,0,0|2,0,0]=4 3784 B10R1.10 Fc1cc(CCBr)c[n]c1 Amb25210409 [1,1,0,0,0,0|2,0,0]=4 3785 B10R1.10 Fc1cc(CCCl)c[n]c1 Amb18797759 [1,1,0,0,0,0|2,0,0]=4 3786 B10R1.10 Fc1cc(CCI)ccc1 Amb25766475 [1,1,0,0,0,0|1,0,0]=3 3787 B10R1.10 Fc1cc(ccc1)OCCl Amb24401502 [1,1,0,0,0,0|1,0,0]=3 3788 B10R1.10 Fc1cccc(C[Mg]Cl)c1 Amb17672020 [1,1,0,0,0,0|2,0,0]=4 3789 B10R1.10 Fc1cccc(C[Zn]Cl)c1 Amb17938200 [1,1,0,0,0,0|2,0,0]=4 3790 B10R1.10 N#CCc1cccc(c1)Br Amb1138679 [1,1,0,0,0,0|1,0,1]=4 3791 B10R1.10 N#CCc1cccc(c1)Cl Amb1651451 [1,1,0,0,0,0|1,0,1]=4 3792 B10R1.10 N#CCc1cccc(c1)N Amb1215231 [1,1,0,0,0,0|1,0,1]=4 3793 B10R1.10 NCCC1=CC(=O)NC=C1 Amb22277083 [1,1,0,0,0,0|2,0,0]=4 3794 B10R1.10 NCCC1=CC(=O)NC=C1 Amb22490205 [1,1,0,0,0,0|2,0,0]=4 3795 B10R1.10 NCCC1=CC(=O)NC=C1 Amb22899249 [1,1,0,0,0,0|2,0,0]=4 3796 B10R1.10 NCCC1=CC=CC(=O)N1 Amb22492307 [1,1,0,0,0,0|2,0,0]=4 3797 B10R1.10 NCCC1=CC=CC(=O)N1 Amb22587551 [1,1,0,0,0,0|2,0,0]=4 3798 B10R1.10 NCC[n+]1cc(O)ccc1 Amb24427344 [1,1,0,0,0,0|2,0,0]=4 3799 B10R1.10 NCCc1c[n](=O)ccc1 Amb20621202 [1,1,0,0,0,0|2,0,0]=4 3800 B10R1.10 NCCc1cc(Br)cc[n]1 Amb25839315 [1,1,0,0,0,0|2,0,0]=4 3801 B10R1.10 NCCc1cc(Br)ccc1 Amb22900947 [1,1,0,0,0,0|1,0,0]=3 3802 B10R1.10 NCCc1cc(Cl)[n]cc1 Amb22751657 [1,1,0,0,0,0|2,0,0]=4 3803 B10R1.10 NCCc1cc(Cl)ccc1 Amb22490605 [1,1,0,0,0,0|1,0,0]=3 3804 B10R1.10 NCCc1cc(F)c[n]c1 Amb18286591 [1,1,0,0,0,0|2,0,0]=4 3805 B10R1.10 NCCc1cc(I)ccc1 Amb25096322 [1,1,0,0,0,0|1,0,0]=3 3806 B10R1.10 NCCc1cc(O)c[n]c1 Amb25744014 [1,1,0,0,0,0|2,0,0]=4 3807 B10R1.10 NCCc1cc(O)cc[n]1 Amb24479633 [1,1,0,0,0,0|2,0,0]=4 3808 B10R1.10 NCCc1cccc(Br)[n]1 Amb21856983 [1,1,0,0,0,0|2,0,0]=4 3809 B10R1.10 NCCc1cccc(Br)[n]1 Amb21857736 [1,1,0,0,0,0|2,0,0]=4 3810 B10R1.10 NCCc1cccc(Cl)[n]1 Amb21857720 [1,1,0,0,0,0|2,0,0]=4 3811 B10R1.10 NCCc1cccc(Cl)[n]1 Amb21857735 [1,1,0,0,0,0|2,0,0]=4 3812 B10R1.10 NCCc1cccc(F)[n]1 Amb20669134 [1,1,0,0,0,0|2,0,0]=4 3813 B10R1.10 NCCc1cccc(c1)C Amb1126573 [1,1,0,0,0,0|1,0,0]=3 3814 B10R1.10 NCCc1cccc(c1)C Amb13952645 [1,1,0,0,0,0|1,0,0]=3 3815 B10R1.10 NCCc1cccc(c1)Cl Amb1212556 [1,1,0,0,0,0|1,0,0]=3 3816 B10R1.10 NCCc1cccc(c1)F Amb1216921 [1,1,0,0,0,0|1,0,0]=3 3817 B10R1.10 NCCc1cccc(n1)N Amb1100181 [1,1,0,0,0,0|2,0,0]=4 3818 B10R1.10 NCCc1ccnc(c1)O Amb10576299 [1,1,0,0,0,0|2,0,0]=4 3819 B10R1.10 NNCc1cccc(Br)c1 Amb19893263 [1,1,0,0,0,0|2,0,0]=4 3820 B10R1.10 NNCc1cccc(Br)c1 Amb20667747 [1,1,0,0,0,0|2,0,0]=4 3821 B10R1.10 NNCc1cccc(F)c1 Amb19893257 [1,1,0,0,0,0|2,0,0]=4 3822 B10R1.10 NNCc1cccc(F)c1 Amb20669586 [1,1,0,0,0,0|2,0,0]=4 3823 B10R1.10 NNCc1cccc(I)c1 Amb25355316 [1,1,0,0,0,0|2,0,0]=4 3824 B10R1.10 NNCc1cccc(c1)Br Amb1119246 [1,1,0,0,0,0|2,0,0]=4 3825 B10R1.10 NNCc1cccc(c1)C Amb1116333 [1,1,0,0,0,0|2,0,0]=4 3826 B10R1.10 NNCc1cccc(c1)Cl Amb1111798 [1,1,0,0,0,0|2,0,0]=4 3827 B10R1.10 NNCc1cccc(c1)Cl Amb13949121 [1,1,0,0,0,0|2,0,0]=4 3828 B10R1.10 NNCc1cccc(c1)F Amb1121411 [1,1,0,0,0,0|2,0,0]=4 3829 B10R1.10 NOCc1cccc(Br)c1 Amb22231355 [1,1,0,0,0,0|2,0,0]=4 3830 B10R1.10 NOCc1cccc(Cl)c1 Amb19889790 [1,1,0,0,0,0|2,0,0]=4 3831 B10R1.10 NOCc1cccc(F)c1 Amb19883930 [1,1,0,0,0,0|2,0,0]=4 3832 B10R1.10 NOCc1cccc(c1)Br Amb17091429 [1,1,0,0,0,0|2,0,0]=4 3833 B10R1.10 NOCc1cccc(c1)C Amb17091425 [1,1,0,0,0,0|2,0,0]=4 3834 B10R1.10 NOCc1cccc(c1)Cl Amb17091428 [1,1,0,0,0,0|2,0,0]=4 3835 B10R1.10 NOCc1cccc(c1)F Amb17091426 [1,1,0,0,0,0|2,0,0]=4 3836 B10R1.10 Nc1[n]c(CCO)cc[n]1 Amb24566497 [1,1,0,0,0,0|2,0,0]=4 3837 B10R1.10 Nc1c[n+](CCS)ccc1 Amb24695154 [1,1,0,0,0,0|1,1,0]=4 3838 B10R1.10 Nc1cc(CC#N)ccc1 Amb21857787 [1,1,0,0,0,0|1,0,1]=4 3839 B10R1.10 Nc1cc(CC=O)ccc1 Amb25147333 [1,1,0,0,0,0|0,0,2]=4 3840 B10R1.10 Nc1cc(CCCl)ccc1 Amb24748802 [1,1,0,0,0,0|1,0,0]=3 3841 B10R1.10 Nc1cc(CCN)cc[n]1 Amb25146265 [1,1,0,0,0,0|2,0,0]=4 3842 B10R1.10 Nc1cc(CCO)[n]cc1 Amb25027828 [1,1,0,0,0,0|1,0,0]=3 3843 B10R1.10 Nc1cc(CCO)cc[n]1 Amb25146377 [1,1,0,0,0,0|1,0,0]=3 3844 B10R1.10 Nc1cc(CCO)ccc1 Amb21857105 [1,1,0,0,0,0|0,0,0]=2 3845 B10R1.10 Nc1cc(CCS)ccc1 Amb22728749 [1,1,0,0,0,0|0,1,0]=3 3846 B10R1.10 Nc1cc[n]c(CCO)[n]1 Amb24583224 [1,1,0,0,0,0|2,0,0]=4 3847 B10R1.10 Nc1cccc(CCN)[n]1 Amb21959697 [1,1,0,0,0,0|2,0,0]=4 3848 B10R1.10 Nc1cccc(CCN)c1 Amb22733355 [1,1,0,0,0,0|1,0,0]=3 3849 B10R1.10 Nc1cccc(CCO)[n]1 Amb24401500 [1,1,0,0,0,0|1,0,0]=3 3850 B10R1.10 Nc1cccc(CCS)[n]1 Amb25835198 [1,1,0,0,0,0|1,1,0]=4 3851 B10R1.10 O=C1C=C(CCCl)C=CN1 Amb25097138 [1,1,0,0,0,0|2,0,0]=4 3852 B10R1.10 O=C1C=C(CCCl)C=CO1 Amb25060579 [1,1,0,0,0,0|2,0,0]=4 3853 B10R1.10 O=CCc1cccc(F)c1 Amb19929928 [1,1,0,0,0,0|0,0,2]=4 3854 B10R1.10 O=CCc1cccc(c1)Br Amb16230449 [1,1,0,0,0,0|0,0,2]=4 3855 B10R1.10 O=CCc1cccc(c1)C Amb16230453 [1,1,0,0,0,0|0,0,2]=4 3856 B10R1.10 O=CCc1cccc(c1)Cl Amb10844835 [1,1,0,0,0,0|0,0,2]=4 3857 B10R1.10 O=CCc1cccc(c1)O Amb17089543 [1,1,0,0,0,0|0,0,2]=4 3858 B10R1.10 OCCC=1C=CNC(=O)N1 Amb24639313 [1,1,0,0,0,0|2,0,0]=4 3859 B10R1.10 OCC[n+]1cc(S)ccc1 Amb25831912 [1,1,0,0,0,0|1,0,0]=3 3860 B10R1.10 OCC[n+]1cccc(c1)C Amb10553046 [1,1,0,0,0,0|1,0,0]=3 3861 B10R1.10 OCCc1cc(Br)[n]cc1 Amb25773220 [1,1,0,0,0,0|1,0,0]=3 3862 B10R1.10 OCCc1cc(Br)c[n]c1 Amb25114229 [1,1,0,0,0,0|1,0,0]=3 3863 B10R1.10 OCCc1cc(Br)cc[n]1 Amb24065849 [1,1,0,0,0,0|1,0,0]=3 3864 B10R1.10 OCCc1cc(Cl)[n]cc1 Amb22754705 [1,1,0,0,0,0|1,0,0]=3 3865 B10R1.10 OCCc1cc(F)cc[n]1 Amb25032462 [1,1,0,0,0,0|1,0,0]=3 3866 B10R1.10 OCCc1cc(I)ccc1 Amb24524319 [1,1,0,0,0,0|0,0,0]=2 3867 B10R1.10 OCCc1cccc(F)[n]1 Amb25076783 [1,1,0,0,0,0|1,0,0]=3 3868 B10R1.10 OCCc1cccc(n1)Br Amb13883481 [1,1,0,0,0,0|1,0,0]=3 3869 B10R1.10 OCNc1cccc(Cl)c1 Amb25804223 [1,1,0,0,0,0|1,0,0]=3 3870 B10R1.10 ONCc1cccc(Br)[n]1 Amb24647347 [1,1,0,0,0,0|2,0,0]=4 3871 B10R1.10 ONCc1cccc(Br)c1 Amb23449439 [1,1,0,0,0,0|1,0,0]=3 3872 B10R1.10 ONCc1cccc(Cl)c1 Amb25210787 [1,1,0,0,0,0|1,0,0]=3 3873 B10R1.10 O\N=C\c1cccc(c1)Cl Amb1776533 [1,1,0,0,0,0|1,0,1]=4 3874 B10R1.10 O\N=C\c1cccc(c1)F Amb1152958 [1,1,0,0,0,0|1,0,1]=4 3875 B10R1.10 O\N=C\c1cccc(c1)I Amb1831123 [1,1,0,0,0,0|1,0,1]=4 3876 B10R1.10 Oc1c[n]cc(CCO)c1 Amb24757058 [1,1,0,0,0,0|1,0,0]=3 3877 B10R1.10 Oc1cc(CCBr)ccc1 Amb18130690 [1,1,0,0,0,0|1,0,0]=3 3878 B10R1.10 Oc1cc(CCO)[n]c[n]1 Amb25377230 [1,1,0,0,0,0|2,0,0]=4 3879 B10R1.10 Oc1cc(ccc1)OC=O Amb18643208 [1,1,0,0,0,0|0,0,2]=4 3880 B10R1.10 Oc1cc(ccc1)OCBr Amb24099888 [1,1,0,0,0,0|1,0,0]=3 3881 B10R1.10 Oc1cc(ccc1)SCCl Amb24368844 [1,1,0,0,0,0|1,1,0]=4 3882 B10R1.10 Oc1cc[n]c(CCO)[n]1 Amb24454001 [1,1,0,0,0,0|2,0,0]=4 3883 B10R1.10 Oc1cc[n]c(CCO)c1 Amb24544455 [1,1,0,0,0,0|1,0,0]=3 3884 B10R1.10 Oc1cccc(CNO)c1 Amb24524626 [1,1,0,0,0,0|1,0,0]=3 3885 B10R1.10 Oc1cccc(c1)OCO Amb25712897 [1,1,0,0,0,0|0,0,0]=2 3886 B10R1.10 Oc1cccc(c1)\C=N/O Amb25162781 [1,1,0,0,0,0|1,0,1]=4 3887 B10R1.10 SCCc1cccc(c1)Br Amb17404678 [1,1,0,0,0,0|0,1,0]=3 3888 B10R1.10 SCCc1cccc(c1)C Amb17399939 [1,1,0,0,0,0|0,1,0]=3 3889 B10R1.10 SCCc1cccc(c1)Cl Amb17400375 [1,1,0,0,0,0|0,1,0]=3 3890 B10R1.10 SCCc1cccc(c1)F Amb17400006 [1,1,0,0,0,0|0,1,0]=3 3891 B10R1.10 Sc1cc(CCCl)ccc1 Amb24627571 [1,1,0,0,0,0|1,0,0]=3 3892 B10R1.10 [NH3+]OCc1cccc(c1)Br Amb2444298 [1,1,0,0,0,0|2,0,0]=4 3893 B10R1.10 [NH3+]OCc1cccc(c1)Cl Amb2405661 [1,1,0,0,0,0|2,0,0]=4 3894 B10R1.10 [NH3+]OCc1cccc(c1)F Amb2424153 [1,1,0,0,0,0|2,0,0]=4 3895 B10R1.10 [O-]c1c[n+](CCO)ccc1 Amb24464239 [1,1,0,0,0,0|1,0,0]=3 3896 B10R1.15 BrCC(=O)c1ccccc1 Amb1102084 [1,1,0,0,0,0|1,0,1]=4 3897 B10R1.15 BrCC(c1ccccc1)O Amb17206105 [1,1,0,0,0,0|1,0,0]=3 3898 B10R1.15 Br[13CH2]C(Br)c1ccccc1 Amb22367266 [1,1,0,0,0,0|1,0,0]=3 3899 B10R1.15 C#CC(N)c1ccccc1 Amb23504019 [1,1,0,0,0,0|1,0,1]=4 3900 B10R1.15 C#C[C@@H](Cl)c1ccccc1 Amb25114793 [1,1,0,0,0,0|1,0,1]=4 3901 B10R1.15 C#C[C@H](N)c1ccccc1 Amb25757944 [1,1,0,0,0,0|1,0,1]=4 3902 B10R1.15 C#C[C@H](O)c1ccccc1 Amb22360907 [1,1,0,0,0,0|1,0,1]=4 3903 B10R1.15 C/C=C(\C)c1ccccc1 Amb17940650 [1,1,0,0,0,0|1,0,1]=4 3904 B10R1.15 C=C(CO)c1ccc[n]c1 Amb25829121 [1,1,0,0,0,0|1,0,1]=4 3905 B10R1.15 C=CC(N)c1ccccc1 Amb18642931 [1,1,0,0,0,0|1,0,1]=4 3906 B10R1.15 C=CC(N)c1ccccc1 Amb22584092 [1,1,0,0,0,0|1,0,1]=4 3907 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [1,1,0,0,0,0|1,0,1]=4 3908 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [1,1,0,0,0,0|1,0,1]=4 3909 B10R1.15 C=C[C@H](O)c1ccccc1 Amb22348430 [1,1,0,0,0,0|1,0,1]=4 3910 B10R1.15 CC(C#C)c1ccccc1 Amb24106607 [1,1,0,0,0,0|1,0,1]=4 3911 B10R1.15 CC(CCl)c1c[n]ccc1 Amb24085112 [1,1,0,0,0,0|2,0,0]=4 3912 B10R1.15 CC(CCl)c1cccc[n]1 Amb25791960 [1,1,0,0,0,0|2,0,0]=4 3913 B10R1.15 CC(CN)c1ccccc1 Amb19958781 [1,1,0,0,0,0|1,0,0]=3 3914 B10R1.15 CC(CO)c1[n]ccc[n]1 Amb24397210 [1,1,0,0,0,0|2,0,0]=4 3915 B10R1.15 CC(CO)c1cc[n]cc1 Amb24480432 [1,1,0,0,0,0|1,0,0]=3 3916 B10R1.15 CC(CO)c1cccc[n]1 Amb22896757 [1,1,0,0,0,0|1,0,0]=3 3917 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [1,1,0,0,0,0|2,0,0]=4 3918 B10R1.15 CC([Zn]Br)c1ccccc1 Amb22000433 [1,1,0,0,0,0|2,0,0]=4 3919 B10R1.15 CC([Zn]Cl)c1ccccc1 Amb22052836 [1,1,0,0,0,0|2,0,0]=4 3920 B10R1.15 CC(c1ccccc1)C#N Amb2387010 [1,1,0,0,0,0|1,0,1]=4 3921 B10R1.15 CC=C(F)c1ccccc1 Amb22008093 [1,1,0,0,0,0|1,0,1]=4 3922 B10R1.15 CCB(N)c1ccccc1 Amb25269618 [1,1,0,0,0,0|1,0,0]=3 3923 B10R1.15 CCB(O)c1ccccc1 Amb25174287 [1,1,0,0,0,0|1,0,0]=3 3924 B10R1.15 CCC(=C)c1cccc[n]1 Amb24467663 [1,1,0,0,0,0|2,0,0]=4 3925 B10R1.15 CCC(=C)c1ccccc1 Amb22234837 [1,1,0,0,0,0|1,0,0]=3 3926 B10R1.15 CCC(=N)c1cc[n]cc1 Amb25303409 [1,1,0,0,0,0|2,0,0]=4 3927 B10R1.15 CCC(=O)c1ccncc1 Amb10576400 [1,1,0,0,0,0|2,0,0]=4 3928 B10R1.15 CCC(=S)c1ccc[n]c1 Amb25837178 [1,1,0,0,0,0|2,0,0]=4 3929 B10R1.15 CCC(Br)c1c[n]ccc1 Amb24556035 [1,1,0,0,0,0|2,0,0]=4 3930 B10R1.15 CCC(C)c1c[n]ccc1 Amb24690132 [1,1,0,0,0,0|2,0,0]=4 3931 B10R1.15 CCC(Cl)[n+]1ccccc1 Amb24365361 [1,1,0,0,0,0|2,0,0]=4 3932 B10R1.15 CCC(Cl)c1c[n]ccc1 Amb25708334 [1,1,0,0,0,0|2,0,0]=4 3933 B10R1.15 CCC(N)c1cccc[n]1 Amb22587075 [1,1,0,0,0,0|2,0,0]=4 3934 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [1,1,0,0,0,0|1,0,0]=3 3935 B10R1.15 CCC(c1ccccc1)N Amb1108026 [1,1,0,0,0,0|1,0,0]=3 3936 B10R1.15 CCC(c1ccccn1)N Amb10607917 [1,1,0,0,0,0|2,0,0]=4 3937 B10R1.15 CCC(c1cccnc1)N Amb10607957 [1,1,0,0,0,0|2,0,0]=4 3938 B10R1.15 CCC(c1cccnc1)O Amb17231904 [1,1,0,0,0,0|2,0,0]=4 3939 B10R1.15 CCC(c1ccncc1)O Amb16233288 [1,1,0,0,0,0|2,0,0]=4 3940 B10R1.15 CCN(N)c1cccc[n]1 Amb18643189 [1,1,0,0,0,0|2,0,0]=4 3941 B10R1.15 CCN(O)c1ccccc1 Amb25223262 [1,1,0,0,0,0|1,0,0]=3 3942 B10R1.15 CCS(=O)c1ccccc1 Amb22234834 [1,1,0,0,0,0|0,1,0]=3 3943 B10R1.15 CCS(=O)c1ccccc1 Amb22500370 [1,1,0,0,0,0|0,1,0]=3 3944 B10R1.15 CC[C@@H](N)c1c[n]ccc1 Amb23401519 [1,1,0,0,0,0|2,0,0]=4 3945 B10R1.15 CC[C@@H](N)c1c[n]ccc1 Amb25805543 [1,1,0,0,0,0|2,0,0]=4 3946 B10R1.15 CC[C@@H](N)c1cc[n]cc1 Amb23401520 [1,1,0,0,0,0|2,0,0]=4 3947 B10R1.15 CC[C@@H](N)c1cc[n]cc1 Amb24744408 [1,1,0,0,0,0|2,0,0]=4 3948 B10R1.15 CC[C@@H](N)c1cccc[n]1 Amb23440390 [1,1,0,0,0,0|2,0,0]=4 3949 B10R1.15 CC[C@@H](N)c1cccc[n]1 Amb25797820 [1,1,0,0,0,0|2,0,0]=4 3950 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [1,1,0,0,0,0|1,0,0]=3 3951 B10R1.15 CC[C@@H](O)c1cccc[n]1 Amb25717055 [1,1,0,0,0,0|2,0,0]=4 3952 B10R1.15 CC[C@H](C)c1cc[n]cc1 Amb24599884 [1,1,0,0,0,0|2,0,0]=4 3953 B10R1.15 CC[C@H](Cl)c1ccccc1 Amb24429104 [1,1,0,0,0,0|1,0,0]=3 3954 B10R1.15 CC[C@H](N)c1c[n]ccc1 Amb25277011 [1,1,0,0,0,0|2,0,0]=4 3955 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [1,1,0,0,0,0|1,0,0]=3 3956 B10R1.15 CC[C@H](O)c1c[n]ccc1 Amb24432697 [1,1,0,0,0,0|2,0,0]=4 3957 B10R1.15 CC[S@@](=O)c1ccccc1 Amb22747460 [1,1,0,0,0,0|0,1,0]=3 3958 B10R1.15 CN(CCl)c1ccccc1 Amb24479224 [1,1,0,0,0,0|2,0,0]=4 3959 B10R1.15 CN(CO)c1cc[n]cc1 Amb24481124 [1,1,0,0,0,0|2,0,0]=4 3960 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [1,1,0,0,0,0|2,0,0]=4 3961 B10R1.15 CNC(=O)c1ccccc1 Amb1793916 [1,1,0,0,0,0|2,0,0]=4 3962 B10R1.15 CNC(=S)c1ccccc1 Amb10552988 [1,1,0,0,0,0|2,0,0]=4 3963 B10R1.15 CNC(c1ccccc1)C Amb1215689 [1,1,0,0,0,0|2,0,0]=4 3964 B10R1.15 CNS(=O)c1ccccc1 Amb24606698 [1,1,0,0,0,0|1,1,0]=4 3965 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [1,1,0,0,0,0|2,0,0]=4 3966 B10R1.15 CN[C@@H](C)c1ccccc1 Amb22899444 [1,1,0,0,0,0|2,0,0]=4 3967 B10R1.15 CN[C@@H](c1ccccc1)C Amb10844610 [1,1,0,0,0,0|2,0,0]=4 3968 B10R1.15 COC(=C)c1ccccc1 Amb10558859 [1,1,0,0,0,0|2,0,0]=4 3969 B10R1.15 COC(=S)c1ccccc1 Amb10569749 [1,1,0,0,0,0|2,0,0]=4 3970 B10R1.15 COC(=[NH2+])c1ccccc1 Amb10241351 [1,1,0,0,0,0|2,0,0]=4 3971 B10R1.15 COC(C)c1ccccc1 Amb23568513 [1,1,0,0,0,0|2,0,0]=4 3972 B10R1.15 COC(Cl)c1ccccc1 Amb17940179 [1,1,0,0,0,0|2,0,0]=4 3973 B10R1.15 COC(O)c1ccccc1 Amb25225981 [1,1,0,0,0,0|2,0,0]=4 3974 B10R1.15 CO[13C](=O)c1ccccc1 Amb22363354 [1,1,0,0,0,0|2,0,0]=4 3975 B10R1.15 CO[C@@H](Cl)c1ccccc1 Amb25108131 [1,1,0,0,0,0|2,0,0]=4 3976 B10R1.15 CPC(O)c1ccccc1 Amb25144461 [1,1,0,0,0,0|2,0,0]=4 3977 B10R1.15 CSC(=N)c1ccccc1 Amb22488568 [1,1,0,0,0,0|2,0,0]=4 3978 B10R1.15 CSC(=N)c1ccccc1 Amb24542868 [1,1,0,0,0,0|2,0,0]=4 3979 B10R1.15 CSC(=S)c1ccccc1 Amb24395059 [1,1,0,0,0,0|2,0,0]=4 3980 B10R1.15 C[C@@H](C=O)c1ccccc1 Amb24399258 [1,1,0,0,0,0|0,0,2]=4 3981 B10R1.15 C[C@@H](CBr)c1ccccc1 Amb25786304 [1,1,0,0,0,0|1,0,0]=3 3982 B10R1.15 C[C@@H](CCl)c1ccccc1 Amb24632311 [1,1,0,0,0,0|1,0,0]=3 3983 B10R1.15 C[C@@H](NN)c1ccccc1 Amb25824988 [1,1,0,0,0,0|2,0,0]=4 3984 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [1,1,0,0,0,0|1,0,0]=3 3985 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [1,1,0,0,0,0|1,0,0]=3 3986 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [1,1,0,0,0,0|2,0,0]=4 3987 B10R1.15 C[C@H](C=O)c1ccccc1 Amb24476962 [1,1,0,0,0,0|0,0,2]=4 3988 B10R1.15 C[C@H](CCl)c1ccccc1 Amb24658260 [1,1,0,0,0,0|1,0,0]=3 3989 B10R1.15 C[C@H](NO)c1cc[n]cc1 Amb24630448 [1,1,0,0,0,0|2,0,0]=4 3990 B10R1.15 C[C@H](NO)c1ccccc1 Amb20670900 [1,1,0,0,0,0|1,0,0]=3 3991 B10R1.15 C[C@H](NO)c1ccccc1 Amb22736688 [1,1,0,0,0,0|1,0,0]=3 3992 B10R1.15 C[SiH](CCl)c1ccccc1 Amb25053449 [1,1,0,0,0,0|1,1,0]=4 3993 B10R1.15 C\N=C(\Cl)/c1ccccc1 Amb25835717 [1,1,0,0,0,0|2,0,0]=4 3994 B10R1.15 ClC(C#C)c1ccccc1 Amb17670636 [1,1,0,0,0,0|1,0,1]=4 3995 B10R1.15 ClC(C=C)c1ccccc1 Amb17943120 [1,1,0,0,0,0|1,0,1]=4 3996 B10R1.15 ClC(CBr)c1ccccc1 Amb24079929 [1,1,0,0,0,0|1,0,0]=3 3997 B10R1.15 ClCC(Cl)c1cccc[n]1 Amb24652322 [1,1,0,0,0,0|2,0,0]=4 3998 B10R1.15 ClCC(c1ccccc1)C Amb17232147 [1,1,0,0,0,0|1,0,0]=3 3999 B10R1.15 ClCP(Cl)c1ccccc1 Amb25725059 [1,1,0,0,0,0|2,0,0]=4 4000 B10R1.15 ClC[C@@H](c1ccccc1)O Amb16231709 [1,1,0,0,0,0|1,0,0]=3 4001 B10R1.15 ClC[C@@H](c1cccnc1)O Amb16231938 [1,1,0,0,0,0|2,0,0]=4 4002 B10R1.15 ClC[C@H](Cl)c1ccccc1 Amb25131628 [1,1,0,0,0,0|1,0,0]=3 4003 B10R1.15 ClC[SiH](Cl)c1ccccc1 Amb25061252 [1,1,0,0,0,0|1,1,0]=4 4004 B10R1.15 FC(CBr)c1ccccc1 Amb20075900 [1,1,0,0,0,0|1,0,0]=3 4005 B10R1.15 FCC(=O)c1ccccc1 Amb10603600 [1,1,0,0,0,0|1,0,1]=4 4006 B10R1.15 FCC(Br)c1ccccc1 Amb25366148 [1,1,0,0,0,0|1,0,0]=3 4007 B10R1.15 FCC(Cl)c1ccccc1 Amb25361037 [1,1,0,0,0,0|1,0,0]=3 4008 B10R1.15 FCC(c1ccccc1)N Amb2372575 [1,1,0,0,0,0|1,0,0]=3 4009 B10R1.15 N#CC(Cl)c1ccccc1 Amb18787437 [1,1,0,0,0,0|1,0,1]=4 4010 B10R1.15 N#CC(F)c1ccccc1 Amb22747439 [1,1,0,0,0,0|1,0,1]=4 4011 B10R1.15 N#C[C@@H](Br)c1ccccc1 Amb24479015 [1,1,0,0,0,0|1,0,1]=4 4012 B10R1.15 N#C[C@@H](O)c1ccccc1 Amb22744732 [1,1,0,0,0,0|1,0,1]=4 4013 B10R1.15 N#C[C@H](O)c1ccccc1 Amb21618705 [1,1,0,0,0,0|1,0,1]=4 4014 B10R1.15 NC(CBr)c1ccccc1 Amb25690830 [1,1,0,0,0,0|1,0,0]=3 4015 B10R1.15 NC(CI)c1ccccc1 Amb24404731 [1,1,0,0,0,0|1,0,0]=3 4016 B10R1.15 NC(CO)c1c[n]cc[n]1 Amb18832035 [1,1,0,0,0,0|2,0,0]=4 4017 B10R1.15 NC(CO)c1c[n]ccc1 Amb22756404 [1,1,0,0,0,0|1,0,0]=3 4018 B10R1.15 NC(CO)c1cc[n]c[n]1 Amb25761050 [1,1,0,0,0,0|2,0,0]=4 4019 B10R1.15 NC(CO)c1cc[n]cc1 Amb18561776 [1,1,0,0,0,0|1,0,0]=3 4020 B10R1.15 NC(CO)c1cccc[n]1 Amb18560041 [1,1,0,0,0,0|1,0,0]=3 4021 B10R1.15 NC(CO)c1ccccn1 Amb17935880 [1,1,0,0,0,0|1,0,0]=3 4022 B10R1.15 NC(CO)c1ccncc1 Amb17935881 [1,1,0,0,0,0|1,0,0]=3 4023 B10R1.15 NC(CS)c1ccccc1 Amb25061358 [1,1,0,0,0,0|0,1,0]=3 4024 B10R1.15 NCC(=C)c1ccccc1 Amb10609068 [1,1,0,0,0,0|1,0,1]=4 4025 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [1,1,0,0,0,0|1,0,1]=4 4026 B10R1.15 NCC(Br)c1ccccc1 Amb19516007 [1,1,0,0,0,0|1,0,0]=3 4027 B10R1.15 NCC(F)c1cccc[n]1 Amb24473175 [1,1,0,0,0,0|2,0,0]=4 4028 B10R1.15 NCC(F)c1ccccc1 Amb23454844 [1,1,0,0,0,0|1,0,0]=3 4029 B10R1.15 NCC(N)c1cc[n]cc1 Amb18063802 [1,1,0,0,0,0|2,0,0]=4 4030 B10R1.15 NCC(N)c1ccccc1 Amb21857142 [1,1,0,0,0,0|1,0,0]=3 4031 B10R1.15 NCC(O)c1cc[n]cc1 Amb22755845 [1,1,0,0,0,0|2,0,0]=4 4032 B10R1.15 NCC(O)c1cccc[n]1 Amb20622942 [1,1,0,0,0,0|2,0,0]=4 4033 B10R1.15 NCC(O)c1ccccc1 Amb21961704 [1,1,0,0,0,0|1,0,0]=3 4034 B10R1.15 NCC(S)c1ccccc1 Amb18125608 [1,1,0,0,0,0|1,0,0]=3 4035 B10R1.15 NCC(S)c1ccccc1 Amb24106048 [1,1,0,0,0,0|1,0,0]=3 4036 B10R1.15 NCC(c1ccccc1)C Amb1085937 [1,1,0,0,0,0|1,0,0]=3 4037 B10R1.15 NCC(c1ccccc1)O Amb2383121 [1,1,0,0,0,0|1,0,0]=3 4038 B10R1.15 NCC(c1ccccn1)O Amb1109027 [1,1,0,0,0,0|2,0,0]=4 4039 B10R1.15 NCC(c1cccnc1)O Amb10068830 [1,1,0,0,0,0|2,0,0]=4 4040 B10R1.15 NCC(c1cccnc1)O Amb1108854 [1,1,0,0,0,0|2,0,0]=4 4041 B10R1.15 NCC(c1ccncc1)O Amb1108372 [1,1,0,0,0,0|2,0,0]=4 4042 B10R1.15 NC[C@@H](Cl)c1ccccc1 Amb24717355 [1,1,0,0,0,0|1,0,0]=3 4043 B10R1.15 NC[C@@H](F)c1ccccc1 Amb25279947 [1,1,0,0,0,0|1,0,0]=3 4044 B10R1.15 NC[C@@H](N)c1cccc[n]1 Amb25104764 [1,1,0,0,0,0|2,0,0]=4 4045 B10R1.15 NC[C@@H](O)c1c[n]ccc1 Amb22744742 [1,1,0,0,0,0|2,0,0]=4 4046 B10R1.15 NC[C@@H](O)c1c[n]ccc1 Amb22748405 [1,1,0,0,0,0|2,0,0]=4 4047 B10R1.15 NC[C@@H](O)c1cc[n]cc1 Amb24479579 [1,1,0,0,0,0|2,0,0]=4 4048 B10R1.15 NC[C@@H](O)c1cccc[n]1 Amb25052826 [1,1,0,0,0,0|2,0,0]=4 4049 B10R1.15 NC[C@@H](O)c1ccccc1 Amb24107154 [1,1,0,0,0,0|1,0,0]=3 4050 B10R1.15 NC[C@@H](c1ccccc1)O Amb10070626 [1,1,0,0,0,0|1,0,0]=3 4051 B10R1.15 NC[C@H](F)c1ccccc1 Amb25044881 [1,1,0,0,0,0|1,0,0]=3 4052 B10R1.15 NC[C@H](N)c1c[n]ccc1 Amb24426861 [1,1,0,0,0,0|2,0,0]=4 4053 B10R1.15 NC[C@H](N)c1ccccc1 Amb25757101 [1,1,0,0,0,0|1,0,0]=3 4054 B10R1.15 NC[C@H](O)c1c[n]ccc1 Amb23385336 [1,1,0,0,0,0|2,0,0]=4 4055 B10R1.15 NC[C@H](O)c1c[n]ccc1 Amb25127978 [1,1,0,0,0,0|2,0,0]=4 4056 B10R1.15 NC[C@H](O)c1cccc[n]1 Amb24569794 [1,1,0,0,0,0|2,0,0]=4 4057 B10R1.15 NC[C@H](c1ccccc1)C Amb10070369 [1,1,0,0,0,0|1,0,0]=3 4058 B10R1.15 NNC(O)c1ccccc1 Amb25306494 [1,1,0,0,0,0|2,0,0]=4 4059 B10R1.15 NNC(c1ccccc1)C Amb10610271 [1,1,0,0,0,0|2,0,0]=4 4060 B10R1.15 NOC(c1ccccc1)C Amb17089185 [1,1,0,0,0,0|2,0,0]=4 4061 B10R1.15 N[C@@H](C#N)c1ccccc1 Amb18039831 [1,1,0,0,0,0|1,0,1]=4 4062 B10R1.15 N[C@@H](C#N)c1ccccc1 Amb22746711 [1,1,0,0,0,0|1,0,1]=4 4063 B10R1.15 N[C@@H](CF)c1cc[n]cc1 Amb24403138 [1,1,0,0,0,0|2,0,0]=4 4064 B10R1.15 N[C@@H](CF)c1cccc[n]1 Amb25353862 [1,1,0,0,0,0|2,0,0]=4 4065 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887019 [1,1,0,0,0,0|1,0,0]=3 4066 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887020 [1,1,0,0,0,0|1,0,0]=3 4067 B10R1.15 N[C@@H](CO)c1[n]ccc[n]1 Amb24686593 [1,1,0,0,0,0|2,0,0]=4 4068 B10R1.15 N[C@@H](CO)c1c[n]c[n]c1 Amb24359874 [1,1,0,0,0,0|2,0,0]=4 4069 B10R1.15 N[C@@H](CO)c1c[n]ccc1 Amb25146409 [1,1,0,0,0,0|1,0,0]=3 4070 B10R1.15 N[C@@H](CO)c1cc[n]cc1 Amb25146410 [1,1,0,0,0,0|1,0,0]=3 4071 B10R1.15 N[C@@H](CO)c1ccc[n][n]1 Amb25341315 [1,1,0,0,0,0|2,0,0]=4 4072 B10R1.15 N[C@@H](CO)c1cccc[n]1 Amb22756435 [1,1,0,0,0,0|1,0,0]=3 4073 B10R1.15 N[C@@H](CS)c1ccccc1 Amb25689822 [1,1,0,0,0,0|0,1,0]=3 4074 B10R1.15 N[C@@H](c1ccccc1)C#N Amb17399826 [1,1,0,0,0,0|1,0,1]=4 4075 B10R1.15 N[C@H](CBr)c1ccccc1 Amb24391587 [1,1,0,0,0,0|1,0,0]=3 4076 B10R1.15 N[C@H](CF)c1c[n]ccc1 Amb24509342 [1,1,0,0,0,0|2,0,0]=4 4077 B10R1.15 N[C@H](CF)c1cc[n]cc1 Amb25677477 [1,1,0,0,0,0|2,0,0]=4 4078 B10R1.15 N[C@H](CF)c1cccc[n]1 Amb25840493 [1,1,0,0,0,0|2,0,0]=4 4079 B10R1.15 N[C@H](CO)c1[n]ccc[n]1 Amb24478499 [1,1,0,0,0,0|2,0,0]=4 4080 B10R1.15 N[C@H](CO)c1c[n]c[n]c1 Amb24333346 [1,1,0,0,0,0|2,0,0]=4 4081 B10R1.15 N[C@H](CO)c1c[n]ccc1 Amb24712243 [1,1,0,0,0,0|1,0,0]=3 4082 B10R1.15 N[C@H](CO)c1cc[n]c[n]1 Amb24504962 [1,1,0,0,0,0|2,0,0]=4 4083 B10R1.15 N[C@H](CO)c1cc[n]cc1 Amb24714739 [1,1,0,0,0,0|1,0,0]=3 4084 B10R1.15 N[C@H](CS)c1ccccc1 Amb25111122 [1,1,0,0,0,0|0,1,0]=3 4085 B10R1.15 N\C(=C\O)\c1ccccc1 Amb25675946 [1,1,0,0,0,0|0,0,2]=4 4086 B10R1.15 O/C=C(\O)c1ccccc1 Amb17943089 [1,1,0,0,0,0|0,0,2]=4 4087 B10R1.15 O/N=C(/O)c1ccccc1 Amb17843421 [1,1,0,0,0,0|1,0,1]=4 4088 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [1,1,0,0,0,0|1,0,1]=4 4089 B10R1.15 O=CC(Br)c1ccccc1 Amb18130512 [1,1,0,0,0,0|0,0,2]=4 4090 B10R1.15 O=CC(Cl)c1ccccc1 Amb18644699 [1,1,0,0,0,0|0,0,2]=4 4091 B10R1.15 O=CC(F)c1ccccc1 Amb24117053 [1,1,0,0,0,0|0,0,2]=4 4092 B10R1.15 O=CC(c1ccccc1)O Amb17593446 [1,1,0,0,0,0|0,0,2]=4 4093 B10R1.15 O=C[C@@H](F)c1ccccc1 Amb24564571 [1,1,0,0,0,0|0,0,2]=4 4094 B10R1.15 O=P(CCl)c1ccccc1 Amb25053604 [1,1,0,0,0,0|2,0,0]=4 4095 B10R1.15 O=S(CF)c1ccccc1 Amb22723398 [1,1,0,0,0,0|1,1,0]=4 4096 B10R1.15 OC(CBr)c1c[n]ccc1 Amb24641581 [1,1,0,0,0,0|2,0,0]=4 4097 B10R1.15 OC(CBr)c1cc[n]cc1 Amb24099591 [1,1,0,0,0,0|2,0,0]=4 4098 B10R1.15 OC(CF)c1cccc[n]1 Amb25136249 [1,1,0,0,0,0|2,0,0]=4 4099 B10R1.15 OC(CF)c1ccccc1 Amb22731897 [1,1,0,0,0,0|1,0,0]=3 4100 B10R1.15 OCC(=C)c1ccccn1 Amb10552982 [1,1,0,0,0,0|1,0,1]=4 4101 B10R1.15 OCC(=O)c1cc[n]cc1 Amb18063686 [1,1,0,0,0,0|1,0,1]=4 4102 B10R1.15 OCC(=O)c1ccc[n]c1 Amb18063681 [1,1,0,0,0,0|1,0,1]=4 4103 B10R1.15 OCC(=O)c1cccc[n]1 Amb18063640 [1,1,0,0,0,0|1,0,1]=4 4104 B10R1.15 OCC(F)c1cccc[n]1 Amb24518945 [1,1,0,0,0,0|1,0,0]=3 4105 B10R1.15 OCC(F)c1ccccc1 Amb24105399 [1,1,0,0,0,0|0,0,0]=2 4106 B10R1.15 OCC(O)c1c[n]ccc1 Amb23538717 [1,1,0,0,0,0|1,0,0]=3 4107 B10R1.15 OCC(O)c1cc[n]cc1 Amb23538718 [1,1,0,0,0,0|1,0,0]=3 4108 B10R1.15 OCC(S)c1ccccc1 Amb25333535 [1,1,0,0,0,0|0,0,0]=2 4109 B10R1.15 OC[C@@H](Br)c1ccccc1 Amb25770108 [1,1,0,0,0,0|0,0,0]=2 4110 B10R1.15 OC[C@@H](Cl)c1ccccc1 Amb24417788 [1,1,0,0,0,0|0,0,0]=2 4111 B10R1.15 OC[C@@H](F)c1ccccc1 Amb25320636 [1,1,0,0,0,0|0,0,0]=2 4112 B10R1.15 OC[C@@H](S)c1ccccc1 Amb24504991 [1,1,0,0,0,0|0,0,0]=2 4113 B10R1.15 OC[C@H](O)c1c[n]ccc1 Amb24433399 [1,1,0,0,0,0|1,0,0]=3 4114 B10R1.15 OC[C@H](O)c1cc[n]cc1 Amb25831641 [1,1,0,0,0,0|1,0,0]=3 4115 B10R1.15 ONC(=N)c1ccccc1 Amb17231893 [1,1,0,0,0,0|1,0,1]=4 4116 B10R1.15 ONC(=O)c1ccccc1 Amb1645521 [1,1,0,0,0,0|1,0,1]=4 4117 B10R1.15 ONC(c1ccccc1)C Amb10605006 [1,1,0,0,0,0|1,0,0]=3 4118 B10R1.15 ONC(c1ccccn1)C Amb10605008 [1,1,0,0,0,0|2,0,0]=4 4119 B10R1.15 ONC(c1cccnc1)C Amb10605009 [1,1,0,0,0,0|2,0,0]=4 4120 B10R1.15 ONC(c1ccncc1)C Amb10605014 [1,1,0,0,0,0|2,0,0]=4 4121 B10R1.15 OOC(=O)c1ccccc1 Amb17672281 [1,1,0,0,0,0|1,0,1]=4 4122 B10R1.15 O[C@@H](CBr)c1cc[n]cc1 Amb24479572 [1,1,0,0,0,0|2,0,0]=4 4123 B10R1.15 O[C@@H](CBr)c1ccccc1 Amb19929326 [1,1,0,0,0,0|1,0,0]=3 4124 B10R1.15 O[C@@H](CCl)c1cc[n]cc1 Amb24479576 [1,1,0,0,0,0|2,0,0]=4 4125 B10R1.15 O[C@@H](CF)c1ccccc1 Amb24389146 [1,1,0,0,0,0|1,0,0]=3 4126 B10R1.15 O[C@@H](CI)c1ccccc1 Amb25738089 [1,1,0,0,0,0|1,0,0]=3 4127 B10R1.15 O[C@@H](c1ccccc1)C#C Amb10844978 [1,1,0,0,0,0|1,0,1]=4 4128 B10R1.15 O[C@H](CBr)c1c[n]ccc1 Amb24419839 [1,1,0,0,0,0|2,0,0]=4 4129 B10R1.15 O[C@H](CBr)c1cc[n]cc1 Amb24467759 [1,1,0,0,0,0|2,0,0]=4 4130 B10R1.15 O[C@H](CBr)c1ccccc1 Amb19929329 [1,1,0,0,0,0|1,0,0]=3 4131 B10R1.15 O[C@H](CCl)c1cccc[n]1 Amb24462750 [1,1,0,0,0,0|2,0,0]=4 4132 B10R1.15 O[C@H](CF)c1ccccc1 Amb24437736 [1,1,0,0,0,0|1,0,0]=3 4133 B10R1.15 O\C=C(\Cl)/c1ccccc1 Amb25332181 [1,1,0,0,0,0|0,0,2]=4 4134 B10R1.15 O\N=C(/c1ccccc1)\N Amb2226909 [1,1,0,0,0,0|1,0,1]=4 4135 B10R1.15 O\N=C(\c1ccccc1)/C Amb2387477 [1,1,0,0,0,0|1,0,1]=4 4136 B10R1.15 O\N=C(\c1ccccc1)/Cl Amb10563288 [1,1,0,0,0,0|1,0,1]=4 4137 B10R1.15 O\N=C(\c1ccccc1)/N Amb1149046 [1,1,0,0,0,0|1,0,1]=4 4138 B10R1.15 SCC(=O)c1ccccc1 Amb16192503 [1,1,0,0,0,0|0,1,1]=4 4139 B10R1.15 SCC(c1ccccc1)O Amb10608997 [1,1,0,0,0,0|0,1,0]=3 4140 B10R1.18 BrC(Br)[Hg]c1ccccc1 Amb22345487 [1,1,0,0,0,0|2,0,0]=4 4141 B10R1.18 C=[N+]([O-])Cc1ccccc1 Amb24708106 [1,1,0,0,0,0|1,0,1]=4 4142 B10R1.18 CC(=C)Nc1ccccc1 Amb25269461 [1,1,0,0,0,0|1,0,1]=4 4143 B10R1.18 CC(=C)Oc1cccc[n]1 Amb24101320 [1,1,0,0,0,0|1,0,1]=4 4144 B10R1.18 CC(=N)Nc1ccccc1 Amb1086198 [1,1,0,0,0,0|1,0,1]=4 4145 B10R1.18 CC(=O)N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17607311 [1,1,0,0,0,0|1,0,1]=4 4146 B10R1.18 CC(=O)Oc1cc[n]cc1 Amb22522585 [1,1,0,0,0,0|1,0,1]=4 4147 B10R1.18 CC(=O)Oc1ccccc1 Amb22367025 [1,1,0,0,0,0|0,0,1]=3 4148 B10R1.18 CC(=O)Oc1ccccn1 Amb17619694 [1,1,0,0,0,0|1,0,1]=4 4149 B10R1.18 CC(=O)Sc1ccccc1 Amb10575810 [1,1,0,0,0,0|0,1,1]=4 4150 B10R1.18 CC(=O)[15NH]c1ccccc1 Amb22338649 [1,1,0,0,0,0|1,0,1]=4 4151 B10R1.18 CC(Br)Cc1cc[n]cc1 Amb25208255 [1,1,0,0,0,0|2,0,0]=4 4152 B10R1.18 CC(C)Cc1c[n]ccc1 Amb22043313 [1,1,0,0,0,0|2,0,0]=4 4153 B10R1.18 CC(C)Cc1cc[n]cc1 Amb22353758 [1,1,0,0,0,0|2,0,0]=4 4154 B10R1.18 CC(C)Oc1[n]ccc[n]1 Amb24084462 [1,1,0,0,0,0|2,0,0]=4 4155 B10R1.18 CC(C)Oc1c[n]ccc1 Amb22898896 [1,1,0,0,0,0|1,0,0]=3 4156 B10R1.18 CC(C)Oc1cc[n]cc1 Amb20242496 [1,1,0,0,0,0|1,0,0]=3 4157 B10R1.18 CC(C)Oc1cccc[n]1 Amb22304705 [1,1,0,0,0,0|1,0,0]=3 4158 B10R1.18 CC(C)Sc1cc[n]cc1 Amb24380560 [1,1,0,0,0,0|1,1,0]=4 4159 B10R1.18 CC(C)Sc1cccc[n]1 Amb25130337 [1,1,0,0,0,0|1,1,0]=4 4160 B10R1.18 CC(Cc1ccccc1)N Amb17608372 [1,1,0,0,0,0|1,0,0]=3 4161 B10R1.18 CC(Cc1ccccn1)C Amb15691003 [1,1,0,0,0,0|2,0,0]=4 4162 B10R1.18 CC(Cc1ccccn1)Cl Amb17477796 [1,1,0,0,0,0|2,0,0]=4 4163 B10R1.18 CC(Cc1ccccn1)N Amb1995149 [1,1,0,0,0,0|2,0,0]=4 4164 B10R1.18 CC(Cc1ccccn1)O Amb1995148 [1,1,0,0,0,0|1,0,0]=3 4165 B10R1.18 CC(Cc1cccnc1)Cl Amb17477798 [1,1,0,0,0,0|2,0,0]=4 4166 B10R1.18 CC(Cc1cccnc1)O Amb17477790 [1,1,0,0,0,0|1,0,0]=3 4167 B10R1.18 CC(Cc1ccncc1)Cl Amb17477797 [1,1,0,0,0,0|2,0,0]=4 4168 B10R1.18 CC(Cc1ccncc1)O Amb17477789 [1,1,0,0,0,0|1,0,0]=3 4169 B10R1.18 CC(Cc1cnccn1)O Amb1995175 [1,1,0,0,0,0|2,0,0]=4 4170 B10R1.18 CC(Cl)Cc1ccccc1 Amb18787554 [1,1,0,0,0,0|1,0,0]=3 4171 B10R1.18 CC(Cl)Oc1ccccc1 Amb17689404 [1,1,0,0,0,0|0,0,0]=2 4172 B10R1.18 CC(Cl)Sc1ccccc1 Amb17673697 [1,1,0,0,0,0|0,1,0]=3 4173 B10R1.18 CC(I)Cc1ccccc1 Amb24616287 [1,1,0,0,0,0|1,0,0]=3 4174 B10R1.18 CC(N)=Pc1ccccc1 Amb25351589 [1,1,0,0,0,0|1,0,1]=4 4175 B10R1.18 CC(N)Cc1c[n]ccc1 Amb21972219 [1,1,0,0,0,0|2,0,0]=4 4176 B10R1.18 CC(N)Cc1cc[n]cc1 Amb21972220 [1,1,0,0,0,0|2,0,0]=4 4177 B10R1.18 CC(N)Cc1ccccc1 Amb22346639 [1,1,0,0,0,0|1,0,0]=3 4178 B10R1.18 CC(N)Cc1ccccc1 Amb22352196 [1,1,0,0,0,0|1,0,0]=3 4179 B10R1.18 CC(N)Oc1ccccc1 Amb25830517 [1,1,0,0,0,0|0,0,0]=2 4180 B10R1.18 CC(Nc1ccccn1)C Amb1104052 [1,1,0,0,0,0|2,0,0]=4 4181 B10R1.18 CC(Nc1cccnc1)C Amb16231494 [1,1,0,0,0,0|2,0,0]=4 4182 B10R1.18 CC(Nc1cccnc1)C Amb2382996 [1,1,0,0,0,0|2,0,0]=4 4183 B10R1.18 CC(Nc1ccncc1)C Amb16231495 [1,1,0,0,0,0|2,0,0]=4 4184 B10R1.18 CC(Nc1ccncc1)C Amb2383009 [1,1,0,0,0,0|2,0,0]=4 4185 B10R1.18 CC(O)Nc1cccc[n]1 Amb24478972 [1,1,0,0,0,0|2,0,0]=4 4186 B10R1.18 CC(O)Sc1ccccc1 Amb25045636 [1,1,0,0,0,0|0,1,0]=3 4187 B10R1.18 CC(S)Cc1ccccc1 Amb18177239 [1,1,0,0,0,0|0,1,0]=3 4188 B10R1.18 CN(C)Cc1ccccc1 Amb22359464 [1,1,0,0,0,0|2,0,0]=4 4189 B10R1.18 CN(C)Nc1ccccc1 Amb25810299 [1,1,0,0,0,0|2,0,0]=4 4190 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [1,1,0,0,0,0|1,0,1]=4 4191 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 4192 B10R1.18 C[C@@H](Cc1ccccc1)O Amb10068519 [1,1,0,0,0,0|0,0,0]=2 4193 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb19130510 [1,1,0,0,0,0|1,0,0]=3 4194 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb22745694 [1,1,0,0,0,0|1,0,0]=3 4195 B10R1.18 C[C@@H](O)Cc1c[n]ccc1 Amb22896922 [1,1,0,0,0,0|1,0,0]=3 4196 B10R1.18 C[C@@H](O)Cc1ccccc1 Amb17938083 [1,1,0,0,0,0|0,0,0]=2 4197 B10R1.18 C[C@H](Cc1ccccc1)N Amb17608368 [1,1,0,0,0,0|1,0,0]=3 4198 B10R1.18 C[C@H](N)Cc1cccc[n]1 Amb24451425 [1,1,0,0,0,0|2,0,0]=4 4199 B10R1.18 C[SiH](C)Cc1ccccc1 Amb19893554 [1,1,0,0,0,0|1,1,0]=4 4200 B10R1.18 C[SiH](C)Oc1cccc[n]1 Amb24106737 [1,1,0,0,0,0|1,1,0]=4 4201 B10R1.18 C[Si](C)Cc1ccccc1 Amb24527863 [1,1,0,0,0,0|1,1,0]=4 4202 B10R1.18 C\C(\O)=C/c1ccccc1 Amb24095309 [1,1,0,0,0,0|0,0,2]=4 4203 B10R1.18 ClB(Cl)Cc1ccccc1 Amb25832795 [1,1,0,0,0,0|2,0,0]=4 4204 B10R1.18 ClC(Cl)Cc1ccccc1 Amb25783924 [1,1,0,0,0,0|1,0,0]=3 4205 B10R1.18 ClC(Cl)Sc1ccccc1 Amb24389589 [1,1,0,0,0,0|1,1,0]=4 4206 B10R1.18 ClC(Cl)[SiH2]c1ccccc1 Amb22167700 [1,1,0,0,0,0|1,1,0]=4 4207 B10R1.18 ClP(Cl)Cc1ccccc1 Amb25838123 [1,1,0,0,0,0|2,0,0]=4 4208 B10R1.18 FC(F)Cc1ccccc1 Amb19894546 [1,1,0,0,0,0|1,0,0]=3 4209 B10R1.18 FC(F)Oc1cccc[n]1 Amb22236221 [1,1,0,0,0,0|2,0,0]=4 4210 B10R1.18 FC(Oc1cccnc1)F Amb10610217 [1,1,0,0,0,0|2,0,0]=4 4211 B10R1.18 FC(Oc1ccncc1)F Amb10610214 [1,1,0,0,0,0|2,0,0]=4 4212 B10R1.18 FC(Sc1ccccc1)F Amb17232315 [1,1,0,0,0,0|1,1,0]=4 4213 B10R1.18 N=C(O)Nc1ccccc1 Amb19516159 [1,1,0,0,0,0|1,0,1]=4 4214 B10R1.18 NC(=N)Oc1ccccc1 Amb24432258 [1,1,0,0,0,0|1,0,1]=4 4215 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [1,1,0,0,0,0|0,0,2]=4 4216 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [1,1,0,0,0,0|0,1,1]=4 4217 B10R1.18 NC(O)Cc1ccccc1 Amb25348475 [1,1,0,0,0,0|0,0,0]=2 4218 B10R1.18 NS(=N)Cc1ccccc1 Amb25258845 [1,1,0,0,0,0|2,0,0]=4 4219 B10R1.18 N[C@@H](O)Cc1ccccc1 Amb25790547 [1,1,0,0,0,0|0,0,0]=2 4220 B10R1.18 N[C@H](O)Cc1ccccc1 Amb24444592 [1,1,0,0,0,0|0,0,0]=2 4221 B10R1.18 O=C(Br)Oc1ccccc1 Amb25174288 [1,1,0,0,0,0|0,0,2]=4 4222 B10R1.18 OB(Cc1ccccc1)O Amb10071580 [1,1,0,0,0,0|1,0,0]=3 4223 B10R1.18 OB(O)Cc1c[n]ccc1 Amb24699248 [1,1,0,0,0,0|2,0,0]=4 4224 B10R1.18 OB(O)Cc1cc[n]cc1 Amb24105357 [1,1,0,0,0,0|2,0,0]=4 4225 B10R1.18 OC(=O)C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22353637 [1,1,0,0,0,0|0,0,1]=3 4226 B10R1.18 OC(=O)C[N]1=CC=CC=C1 Amb17836439 [1,1,0,0,0,0|1,0,1]=4 4227 B10R1.18 OC(=O)C[n+]1ccccc1 Amb10552774 [1,1,0,0,0,0|1,0,1]=4 4228 B10R1.18 OC(=O)C[n+]1ccccc1 Amb23468426 [1,1,0,0,0,0|1,0,1]=4 4229 B10R1.18 OC(=O)Cc1cc[nH+]cc1 Amb24113836 [1,1,0,0,0,0|1,0,1]=4 4230 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb10807486 [1,1,0,0,0,0|1,0,1]=4 4231 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb24113838 [1,1,0,0,0,0|1,0,1]=4 4232 B10R1.18 OC(=O)[13CH2]c1ccccc1 Amb22351854 [1,1,0,0,0,0|0,0,1]=3 4233 B10R1.18 OC(=S)Cc1cc[n]cc1 Amb24099577 [1,1,0,0,0,0|1,0,1]=4 4234 B10R1.18 OC(=S)Cc1ccccc1 Amb22262974 [1,1,0,0,0,0|0,0,1]=3 4235 B10R1.18 OC(=S)Nc1ccccc1 Amb24669066 [1,1,0,0,0,0|1,0,1]=4 4236 B10R1.18 OC(F)Cc1ccccc1 Amb25147731 [1,1,0,0,0,0|0,0,0]=2 4237 B10R1.18 OC(O)C[n+]1ccccc1 Amb25149726 [1,1,0,0,0,0|1,0,0]=3 4238 B10R1.18 OC(O)Cc1ccccc1 Amb24639712 [1,1,0,0,0,0|0,0,0]=2 4239 B10R1.18 OP(=O)Cc1cccc[n]1 Amb25787147 [1,1,0,0,0,0|2,0,0]=4 4240 B10R1.18 OP(=O)Cc1ccccc1 Amb24617740 [1,1,0,0,0,0|1,0,0]=3 4241 B10R1.18 OP(=O)Oc1ccccc1 Amb24520486 [1,1,0,0,0,0|1,0,0]=3 4242 B10R1.18 O[13C](=O)Cc1ccccc1 Amb22363120 [1,1,0,0,0,0|0,0,1]=3 4243 B10R1.18 O[13C](=O)[13CH2]c1ccccc1 Amb22351754 [1,1,0,0,0,0|0,0,1]=3 4244 B10R1.18 O[14C](=O)Cc1ccccc1 Amb22337596 [1,1,0,0,0,0|0,0,1]=3 4245 B10R1.18 SC(=O)Cc1ccccc1 Amb10561701 [1,1,0,0,0,0|0,0,2]=4 4246 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20240609 [1,1,0,0,0,0|0,0,2]=4 4247 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20246797 [1,1,0,0,0,0|0,0,2]=4 4248 B10R1.18 [O-][N+](=O)Cc1ccccc1 Amb10606416 [1,1,0,0,0,0|1,0,1]=4 4249 B10R1.18 [O-]\[N+](=C/c1ccccc1)\C Amb2420785 [1,1,0,0,0,0|2,0,0]=4 4250 B10R1.11 CC(CCO)=C1C=CC=C1 Amb25050337 [0,1,0,0,1,0|1,0,0]=3 4251 B10R1.11 CC(CCO)[n]1cccc1 Amb24703202 [0,1,0,0,1,0|2,0,0]=4 4252 B10R1.11 CC(CCO)c1c[s]cc1 Amb25676863 [0,1,0,0,1,0|2,0,0]=4 4253 B10R1.11 CC(CCO)c1ccc[nH]1 Amb24753765 [0,1,0,0,1,0|2,0,0]=4 4254 B10R1.11 CN(CCO)c1c[s]cc1 Amb24481266 [0,1,0,0,1,0|2,0,0]=4 4255 B10R1.11 CN(CCO)c1ccc[s]1 Amb24481267 [0,1,0,0,1,0|2,0,0]=4 4256 B10R1.11 C[C@H](CCO)c1ccco1 Amb25788895 [0,1,0,0,1,0|2,0,0]=4 4257 B10R1.11 NC(CCO)c1c[nH]cc1 Amb18563233 [0,1,0,0,1,0|2,0,0]=4 4258 B10R1.11 NC(CCO)c1ccc[nH]1 Amb24611803 [0,1,0,0,1,0|2,0,0]=4 4259 B10R1.11 NC(CCO)c1ccco1 Amb18120550 [0,1,0,0,1,0|2,0,0]=4 4260 B10R1.11 N[C@@H](CCO)c1ccc[s]1 Amb25835841 [0,1,0,0,1,0|2,0,0]=4 4261 B10R1.11 N[C@H](CCO)c1c[s]cc1 Amb25679671 [0,1,0,0,1,0|2,0,0]=4 4262 B10R1.11 N[C@H](CCO)c1ccc[nH]1 Amb24763735 [0,1,0,0,1,0|2,0,0]=4 4263 B10R1.11 N[C@H](CCO)c1cocc1 Amb25254635 [0,1,0,0,1,0|2,0,0]=4 4264 B10R1.11 OCCC(=O)c1cc[nH]c1 Amb18064961 [0,1,0,0,1,0|2,0,0]=4 4265 B10R1.11 OCCC(=O)c1ccc[nH]1 Amb25780948 [0,1,0,0,1,0|2,0,0]=4 4266 B10R1.11 OCCC(=O)c1ccc[s]1 Amb18563468 [0,1,0,0,1,0|2,0,0]=4 4267 B10R1.11 OCCC(=O)c1ccco1 Amb25234271 [0,1,0,0,1,0|2,0,0]=4 4268 B10R1.11 OCCC(O)c1c[nH]cc1 Amb18563435 [0,1,0,0,1,0|2,0,0]=4 4269 B10R1.11 OCCC(O)c1c[s]cc1 Amb22298358 [0,1,0,0,1,0|2,0,0]=4 4270 B10R1.11 OCCC(O)c1ccc[s]1 Amb18065453 [0,1,0,0,1,0|2,0,0]=4 4271 B10R1.11 OCCC(c1cccs1)C Amb17232175 [0,1,0,0,1,0|2,0,0]=4 4272 B10R1.11 OCCC(c1cccs1)N Amb2408105 [0,1,0,0,1,0|2,0,0]=4 4273 B10R1.11 OCCC(c1cscc1)N Amb2408152 [0,1,0,0,1,0|2,0,0]=4 4274 B10R1.16 C[n]1cc(CCCO)cc1 Amb18223708 [0,1,0,0,1,0|2,0,0]=4 4275 B10R1.16 C[n]1cc(c[n]1)OCCO Amb24464886 [0,1,0,0,1,0|2,0,0]=4 4276 B10R1.16 Cc1c[n](CCCO)cc1 Amb24749638 [0,1,0,0,1,0|2,0,0]=4 4277 B10R1.16 Cc1cc(CCCO)c[s]1 Amb25797741 [0,1,0,0,1,0|2,0,0]=4 4278 B10R1.16 Cc1cc([n]o1)OCCO Amb24587629 [0,1,0,0,1,0|2,0,0]=4 4279 B10R1.16 Cc1ccc(o1)CCCO Amb17477780 [0,1,0,0,1,0|2,0,0]=4 4280 B10R1.16 Cc1ccc(o1)SCCO Amb25078018 [0,1,0,0,1,0|1,1,0]=4 4281 B10R1.16 Cc1ccc(s1)CCCO Amb17605793 [0,1,0,0,1,0|2,0,0]=4 4282 B10R1.16 Nc1c[n](cc1)NCCO Amb25147631 [0,1,0,0,1,0|2,0,0]=4 4283 B10R1.16 OCCCc1cc(Br)c[s]1 Amb23537991 [0,1,0,0,1,0|2,0,0]=4 4284 B10R1.16 OCCCc1ccc(Br)[s]1 Amb25054989 [0,1,0,0,1,0|2,0,0]=4 4285 B10R1.16 OCCCc1ccc(Br)o1 Amb25800149 [0,1,0,0,1,0|2,0,0]=4 4286 B10R1.16 OCCCc1ccc(Cl)[s]1 Amb18804618 [0,1,0,0,1,0|2,0,0]=4 4287 B10R1.16 OCCNc1ccc(Br)[s]1 Amb25041822 [0,1,0,0,1,0|2,0,0]=4 4288 B10R1.16 OCCNc1ccc(Cl)[s]1 Amb24524684 [0,1,0,0,1,0|2,0,0]=4 4289 B10R1.16 OCCO[n]1c[n]c(O)c1 Amb24363569 [0,1,0,0,1,0|2,0,0]=4 4290 B10R1.16 OCCOc1[n]c(Br)c[s]1 Amb25303651 [0,1,0,0,1,0|2,0,0]=4 4291 B10R1.16 OCCOc1[n]c(Cl)c[s]1 Amb24595178 [0,1,0,0,1,0|2,0,0]=4 4292 B10R1.21 BrCCOCc1ccc[s]1 Amb24395674 [0,1,0,0,1,0|2,0,0]=4 4293 B10R1.21 COCCN[n]1cccc1 Amb25705486 [0,1,0,0,1,0|2,0,0]=4 4294 B10R1.21 COCCOc1[n]cc[s]1 Amb24070158 [0,1,0,0,1,0|2,0,0]=4 4295 B10R1.21 ClCCOCc1ccc[s]1 Amb18795876 [0,1,0,0,1,0|2,0,0]=4 4296 B10R1.21 NCCOCc1c[s]cc1 Amb19020781 [0,1,0,0,1,0|2,0,0]=4 4297 B10R1.21 NCCOCc1ccc[s]1 Amb19033621 [0,1,0,0,1,0|2,0,0]=4 4298 B10R1.21 NCCOCc1ccco1 Amb1138811 [0,1,0,0,1,0|2,0,0]=4 4299 B10R1.21 NCCOCc1cocc1 Amb24381340 [0,1,0,0,1,0|2,0,0]=4 4300 B10R1.21 NOCCCc1ccco1 Amb17089544 [0,1,0,0,1,0|2,0,0]=4 4301 B10R1.21 NOCCCc1cccs1 Amb17089545 [0,1,0,0,1,0|2,0,0]=4 4302 B10R1.21 NOCCSc1ccc[s]1 Amb25176001 [0,1,0,0,1,0|1,1,0]=4 4303 B10R1.21 OCCC#Cc1c[s]cc1 Amb25301200 [0,1,0,0,1,0|2,0,0]=4 4304 B10R1.21 OCCC#Cc1ccc[s]1 Amb18179446 [0,1,0,0,1,0|2,0,0]=4 4305 B10R1.21 OCCC#Cc1ccco1 Amb24622475 [0,1,0,0,1,0|2,0,0]=4 4306 B10R1.21 OCCC#Cc1cocc1 Amb25709229 [0,1,0,0,1,0|2,0,0]=4 4307 B10R1.21 OCCCCC=1CC=CC1 Amb25353203 [0,1,0,0,1,0|1,0,1]=4 4308 B10R1.21 OCCCC[n]1cccc1 Amb25369054 [0,1,0,0,1,0|2,0,0]=4 4309 B10R1.21 OCCCCc1c[nH]cc1 Amb18223719 [0,1,0,0,1,0|2,0,0]=4 4310 B10R1.21 OCCCCc1ccco1 Amb17106038 [0,1,0,0,1,0|2,0,0]=4 4311 B10R1.21 OCCCCc1cocc1 Amb24475135 [0,1,0,0,1,0|2,0,0]=4 4312 B10R1.21 OCCCNc1c[s]cc1 Amb25268977 [0,1,0,0,1,0|2,0,0]=4 4313 B10R1.21 OCCCOc1[n]cc[s]1 Amb24480394 [0,1,0,0,1,0|2,0,0]=4 4314 B10R1.21 OCCCOc1c[s]cc1 Amb24511524 [0,1,0,0,1,0|1,0,0]=3 4315 B10R1.21 OCCCOc1ccc[s]1 Amb25226266 [0,1,0,0,1,0|1,0,0]=3 4316 B10R1.21 OCCNCc1c[nH]cc1 Amb18862446 [0,1,0,0,1,0|2,0,0]=4 4317 B10R1.21 OCCNCc1ccc[nH]1 Amb17142860 [0,1,0,0,1,0|2,0,0]=4 4318 B10R1.21 OCCNCc1ccc[s]1 Amb21972158 [0,1,0,0,1,0|2,0,0]=4 4319 B10R1.21 OCCNCc1cocc1 Amb25797936 [0,1,0,0,1,0|2,0,0]=4 4320 B10R1.21 OCCNCc1cscc1 Amb13951827 [0,1,0,0,1,0|2,0,0]=4 4321 B10R1.21 OCCOCc1[nH]cc[n]1 Amb24718033 [0,1,0,0,1,0|2,0,0]=4 4322 B10R1.21 OCCOCc1[n]cc[s]1 Amb24069916 [0,1,0,0,1,0|2,0,0]=4 4323 B10R1.21 OCCOCc1c[s]cc1 Amb24651730 [0,1,0,0,1,0|1,0,0]=3 4324 B10R1.21 OCCOCc1cc[n][nH]1 Amb24354382 [0,1,0,0,1,0|2,0,0]=4 4325 B10R1.21 OCCOCc1ccco1 Amb25853996 [0,1,0,0,1,0|1,0,0]=3 4326 B10R1.21 OCCSCc1cocc1 Amb25308434 [0,1,0,0,1,0|1,1,0]=4 4327 B10R1.21 OCC\C=C\c1ccco1 Amb25060312 [0,1,0,0,1,0|2,0,0]=4 4328 B10R1.21 OCC\N=C\c1ccco1 Amb17593526 [0,1,0,0,1,0|2,0,0]=4 4329 B10R1.21 SCCOCc1ccco1 Amb25144979 [0,1,0,0,1,0|1,1,0]=4 4330 B10R1.27 CC(CN)Oc1ccc[s]1 Amb25286733 [0,1,0,0,1,0|2,0,0]=4 4331 B10R1.27 CC(CO)C[n]1cccc1 Amb25852261 [0,1,0,0,1,0|2,0,0]=4 4332 B10R1.27 CC(CO)Sc1ccc[s]1 Amb25776410 [0,1,0,0,1,0|1,1,0]=4 4333 B10R1.27 C[C@@H](CO)Cc1ccco1 Amb24403930 [0,1,0,0,1,0|2,0,0]=4 4334 B10R1.27 C[C@H](CO)Cc1c[s]cc1 Amb25852894 [0,1,0,0,1,0|2,0,0]=4 4335 B10R1.27 NC(CO)Cc1ccc[nH]1 Amb25293337 [0,1,0,0,1,0|2,0,0]=4 4336 B10R1.27 NC(CO)Cc1cocc1 Amb24627260 [0,1,0,0,1,0|2,0,0]=4 4337 B10R1.27 N[C@@H](CO)Cc1c[s]cc1 Amb24547320 [0,1,0,0,1,0|2,0,0]=4 4338 B10R1.27 N[C@H](CO)Cc1ccc[s]1 Amb25306299 [0,1,0,0,1,0|2,0,0]=4 4339 B10R1.27 OCC(Cc1ccco1)N Amb17062680 [0,1,0,0,1,0|2,0,0]=4 4340 B10R1.27 OCC(Cc1cccs1)N Amb17062681 [0,1,0,0,1,0|2,0,0]=4 4341 B10R1.27 OCC(O)C[n]1cccc1 Amb25066900 [0,1,0,0,1,0|2,0,0]=4 4342 B10R1.27 OCC(O)Cc1ccco1 Amb25308846 [0,1,0,0,1,0|2,0,0]=4 4343 B10R1.29 C[n]1cccc1CCCO Amb24446322 [0,1,0,0,1,0|2,0,0]=4 4344 B10R1.29 Cc1c[s]cc1NCCO Amb24564545 [0,1,0,0,1,0|2,0,0]=4 4345 B10R1.29 Cc1ccoc1OCCC Amb24638261 [0,1,0,0,1,0|2,0,0]=4 4346 B10R1.29 Cc1occc1SCCO Amb25042974 [0,1,0,0,1,0|1,1,0]=4 4347 B10R1.29 OCCCc1[s]ccc1Br Amb24495718 [0,1,0,0,1,0|2,0,0]=4 4348 B10R1.29 OCCCc1c[s]cc1Br Amb24392551 [0,1,0,0,1,0|2,0,0]=4 4349 B10R1.29 OCCCc1cc[s]c1Br Amb25187302 [0,1,0,0,1,0|2,0,0]=4 4350 B10R1.29 OCCCc1cc[s]c1Cl Amb25772720 [0,1,0,0,1,0|2,0,0]=4 4351 B10R1.29 OCCCc1sccc1C Amb17477781 [0,1,0,0,1,0|2,0,0]=4 4352 B10R1.66 CC(CCc1cccs1)O Amb17507262 [0,1,0,0,1,0|2,0,0]=4 4353 B10R1.66 CC(O)CC[n]1cccc1 Amb24368946 [0,1,0,0,1,0|2,0,0]=4 4354 B10R1.66 CC(O)CCc1c[s]cc1 Amb18799744 [0,1,0,0,1,0|2,0,0]=4 4355 B10R1.66 CC(O)CCc1cocc1 Amb25766119 [0,1,0,0,1,0|2,0,0]=4 4356 B10R1.66 CC(O)CN[n]1cccc1 Amb24731421 [0,1,0,0,1,0|2,0,0]=4 4357 B10R1.66 CC(O)CSc1c[s]cc1 Amb25048604 [0,1,0,0,1,0|1,1,0]=4 4358 B10R1.66 CC(O)CSc1ccc[s]1 Amb18180455 [0,1,0,0,1,0|1,1,0]=4 4359 B10R1.66 C[C@@H](O)CN[n]1cccc1 Amb25083744 [0,1,0,0,1,0|2,0,0]=4 4360 B10R1.66 C[C@@H](O)CNc1c[s]cc1 Amb25849372 [0,1,0,0,1,0|2,0,0]=4 4361 B10R1.66 C[C@@H](O)CSc1ccc[s]1 Amb24645865 [0,1,0,0,1,0|1,1,0]=4 4362 B10R1.66 C[C@H](O)CSc1ccc[s]1 Amb24545704 [0,1,0,0,1,0|1,1,0]=4 4363 B10R1.66 OC(=O)COc1cc[s]c1 Amb18126122 [0,1,0,0,1,0|1,0,1]=4 4364 B12R1.18 C=CCOC1=CC=CC=CC1=O Amb25358823 [0,1,0,0,0,1|1,0,1]=4 4365 B12R1.18 CCCOC1=CC=CC=CC1=O Amb24722754 [0,1,0,0,0,1|1,0,0]=3 4366 B12R1.18 O=C1C=CC=CC=C1CCCCl Amb25151144 [0,1,0,0,0,1|2,0,0]=4 4367 B12R1.18 OCCOC1=CC=CC=CC1=O Amb24706831 [0,1,0,0,0,1|0,0,0]=2 4368 B12R1.18 OCCO[C@H]1CC=CC=CC1=O Amb25358903 [0,1,0,0,0,1|0,0,1]=3 4369 B12R1.348 CCCCC=1C=CC(=O)C=CC1 Amb25767136 [0,1,0,0,0,1|2,0,0]=4 4370 B12R1.1 BrCCCOc1ccc(cc1)Cl Amb1154145 [0,2,0,0,0,0|1,0,0]=3 4371 B12R1.1 BrCCCOc1ccc(cc1)N Amb16230364 [0,2,0,0,0,0|1,0,0]=3 4372 B12R1.1 BrCC\C=C\c1ccc(cc1)Br Amb17175754 [0,2,0,0,0,0|2,0,0]=4 4373 B12R1.1 BrCC\C=C\c1ccc(cc1)C Amb17142004 [0,2,0,0,0,0|2,0,0]=4 4374 B12R1.1 BrCC\C=C\c1ccc(cc1)Cl Amb17159818 [0,2,0,0,0,0|2,0,0]=4 4375 B12R1.1 BrCC\C=C\c1ccc(cc1)F Amb17142520 [0,2,0,0,0,0|2,0,0]=4 4376 B12R1.1 C#CCCCc1ccc(O)cc1 Amb25370648 [0,2,0,0,0,0|2,0,0]=4 4377 B12R1.1 C#CCCNc1ccc(Cl)cc1 Amb25137648 [0,2,0,0,0,0|2,0,0]=4 4378 B12R1.1 C#CCCNc1ccc(I)cc1 Amb24483374 [0,2,0,0,0,0|2,0,0]=4 4379 B12R1.1 C#CCCOc1ccc(Br)c[n]1 Amb24426404 [0,2,0,0,0,0|2,0,0]=4 4380 B12R1.1 C#CCCOc1ccc(F)cc1 Amb24354706 [0,2,0,0,0,0|1,0,0]=3 4381 B12R1.1 C#CCCOc1ccc(N)cc1 Amb18290034 [0,2,0,0,0,0|1,0,0]=3 4382 B12R1.1 C#CCCSc1ccc(Cl)cc1 Amb25148456 [0,2,0,0,0,0|1,1,0]=4 4383 B12R1.1 C#CCCSc1ccc(F)cc1 Amb25757679 [0,2,0,0,0,0|1,1,0]=4 4384 B12R1.1 C#CCCSc1ccc(O)cc1 Amb18180838 [0,2,0,0,0,0|1,1,0]=4 4385 B12R1.1 C#CCOCc1ccc(N)cc1 Amb18298742 [0,2,0,0,0,0|1,0,1]=4 4386 B12R1.1 C#CCOCc1ccc(O)cc1 Amb25092905 [0,2,0,0,0,0|1,0,1]=4 4387 B12R1.1 C=CCCCc1ccc(cc1)C Amb13890670 [0,2,0,0,0,0|2,0,0]=4 4388 B12R1.1 C=CCCCc1ccc(cc1)Cl Amb13890658 [0,2,0,0,0,0|2,0,0]=4 4389 B12R1.1 C=CCCCc1ccc(cc1)F Amb13890682 [0,2,0,0,0,0|2,0,0]=4 4390 B12R1.1 C=CCCNc1ccc(Br)cc1 Amb24364913 [0,2,0,0,0,0|2,0,0]=4 4391 B12R1.1 C=CCCNc1ccc(F)cc1 Amb25152653 [0,2,0,0,0,0|2,0,0]=4 4392 B12R1.1 C=CCCNc1ccc(I)cc1 Amb25087539 [0,2,0,0,0,0|2,0,0]=4 4393 B12R1.1 C=CCCNc1ccc(N)cc1 Amb24620212 [0,2,0,0,0,0|2,0,0]=4 4394 B12R1.1 C=CCCNc1ccc(cc1)C Amb10559134 [0,2,0,0,0,0|2,0,0]=4 4395 B12R1.1 C=CCCOc1ccc(N)cc1 Amb24102791 [0,2,0,0,0,0|1,0,0]=3 4396 B12R1.1 CC#CCOc1ccc(Cl)cc1 Amb25249066 [0,2,0,0,0,0|1,0,1]=4 4397 B12R1.1 CC#CCOc1ccc(F)cc1 Amb24484187 [0,2,0,0,0,0|1,0,1]=4 4398 B12R1.1 CC#CCOc1ccc(I)cc1 Amb25050323 [0,2,0,0,0,0|1,0,1]=4 4399 B12R1.1 CC#CCOc1ccc(N)cc1 Amb18988289 [0,2,0,0,0,0|1,0,1]=4 4400 B12R1.1 CC#CCOc1ccc(O)cc1 Amb18798091 [0,2,0,0,0,0|1,0,1]=4 4401 B12R1.1 CC#CCOc1ccc(S)cc1 Amb25154352 [0,2,0,0,0,0|1,0,1]=4 4402 B12R1.1 CCCC#Cc1ccc(Br)cc1 Amb25704153 [0,2,0,0,0,0|2,0,0]=4 4403 B12R1.1 CCCC#Cc1ccc(O)cc1 Amb25282857 [0,2,0,0,0,0|2,0,0]=4 4404 B12R1.1 CCCCCc1ccc(cc1)Br Amb2413171 [0,2,0,0,0,0|2,0,0]=4 4405 B12R1.1 CCCCOc1ccc(Br)c[n]1 Amb20242025 [0,2,0,0,0,0|2,0,0]=4 4406 B12R1.1 CCCCOc1ccc(I)cc1 Amb19929171 [0,2,0,0,0,0|1,0,0]=3 4407 B12R1.1 CCCCOc1ccc(S)cc1 Amb19887938 [0,2,0,0,0,0|1,0,0]=3 4408 B12R1.1 CCCCOc1ccc(cc1)N Amb1127017 [0,2,0,0,0,0|1,0,0]=3 4409 B12R1.1 CCCCSc1ccc(Br)cc1 Amb22227904 [0,2,0,0,0,0|1,1,0]=4 4410 B12R1.1 CCCNCc1ccc(Br)cc1 Amb19890387 [0,2,0,0,0,0|2,0,0]=4 4411 B12R1.1 CCCNCc1ccc(cc1)C Amb1215690 [0,2,0,0,0,0|2,0,0]=4 4412 B12R1.1 CCCNCc1ccc(cc1)Cl Amb10782093 [0,2,0,0,0,0|2,0,0]=4 4413 B12R1.1 CCCNCc1ccc(cc1)O Amb2445168 [0,2,0,0,0,0|2,0,0]=4 4414 B12R1.1 CCCSNc1ccc(N)cc1 Amb25780327 [0,2,0,0,0,0|1,1,0]=4 4415 B12R1.1 CCC\C=C/c1ccc(O)cc1 Amb24706851 [0,2,0,0,0,0|2,0,0]=4 4416 B12R1.1 CCC\C=C\c1ccc(F)cc1 Amb24439442 [0,2,0,0,0,0|2,0,0]=4 4417 B12R1.1 CCC\C=C\c1ccc(O)cc1 Amb24604844 [0,2,0,0,0,0|2,0,0]=4 4418 B12R1.1 CCC\C=C\c1ccc(cc1)Cl Amb10566844 [0,2,0,0,0,0|2,0,0]=4 4419 B12R1.1 CCC\C=N\c1ccc(O)cc1 Amb24736219 [0,2,0,0,0,0|2,0,0]=4 4420 B12R1.1 CCC\N=C\c1ccc(F)cc1 Amb24518468 [0,2,0,0,0,0|2,0,0]=4 4421 B12R1.1 CCC\N=C\c1ccc(cc1)O Amb2445167 [0,2,0,0,0,0|2,0,0]=4 4422 B12R1.1 CCNCCc1ccc(cc1)O Amb15694900 [0,2,0,0,0,0|2,0,0]=4 4423 B12R1.1 CCOCCc1ccc(Br)cc1 Amb23443758 [0,2,0,0,0,0|2,0,0]=4 4424 B12R1.1 CC\C=C\Oc1ccc(N)cc1 Amb25689541 [0,2,0,0,0,0|1,0,1]=4 4425 B12R1.1 CNCCCc1ccc(cc1)Br Amb17104523 [0,2,0,0,0,0|2,0,0]=4 4426 B12R1.1 CNCCCc1ccc(cc1)C Amb17104501 [0,2,0,0,0,0|2,0,0]=4 4427 B12R1.1 CNCCCc1ccc(cc1)Cl Amb17104509 [0,2,0,0,0,0|2,0,0]=4 4428 B12R1.1 CNCCCc1ccc(cc1)F Amb17104503 [0,2,0,0,0,0|2,0,0]=4 4429 B12R1.1 CNCCNc1ccc(Br)cc1 Amb19025288 [0,2,0,0,0,0|2,0,0]=4 4430 B12R1.1 CNCCNc1ccc(Cl)cc1 Amb19025281 [0,2,0,0,0,0|2,0,0]=4 4431 B12R1.1 CNCCNc1ccc(F)cc1 Amb18312613 [0,2,0,0,0,0|2,0,0]=4 4432 B12R1.1 CNCCOc1ccc(O)cc1 Amb19507657 [0,2,0,0,0,0|1,0,0]=3 4433 B12R1.1 CNCCOc1ccc(cc1)Br Amb22166 [0,2,0,0,0,0|1,0,0]=3 4434 B12R1.1 CNCCOc1ccc(cc1)C Amb1670236 [0,2,0,0,0,0|1,0,0]=3 4435 B12R1.1 CNCCOc1ccc(cc1)C Amb2140580 [0,2,0,0,0,0|1,0,0]=3 4436 B12R1.1 CNCCOc1ccc(cc1)F Amb1156338 [0,2,0,0,0,0|1,0,0]=3 4437 B12R1.1 CNCCOc1ccc(cc1)F Amb2094492 [0,2,0,0,0,0|1,0,0]=3 4438 B12R1.1 CNCCOc1ccc(cc1)N Amb17232615 [0,2,0,0,0,0|1,0,0]=3 4439 B12R1.1 CNCCSc1ccc(Cl)cc1 Amb19024601 [0,2,0,0,0,0|1,1,0]=4 4440 B12R1.1 CNCCSc1ccc(cc1)C Amb10608765 [0,2,0,0,0,0|1,1,0]=4 4441 B12R1.1 COCC#Cc1ccc(F)cc1 Amb25830550 [0,2,0,0,0,0|1,0,1]=4 4442 B12R1.1 COCCNc1ccc(F)c[n]1 Amb18306369 [0,2,0,0,0,0|2,0,0]=4 4443 B12R1.1 COCCNc1ccc(cc1)N Amb10610074 [0,2,0,0,0,0|1,0,0]=3 4444 B12R1.1 COCCNc1ccc(cn1)N Amb1116735 [0,2,0,0,0,0|2,0,0]=4 4445 B12R1.1 COCCOc1c[n]c(Cl)c[n]1 Amb24065135 [0,2,0,0,0,0|2,0,0]=4 4446 B12R1.1 COCCOc1c[n]c(N)[n]c1 Amb24085044 [0,2,0,0,0,0|2,0,0]=4 4447 B12R1.1 COCCOc1c[n]c(N)c[n]1 Amb19957730 [0,2,0,0,0,0|2,0,0]=4 4448 B12R1.1 COCCOc1ccc(Br)c[n]1 Amb19349908 [0,2,0,0,0,0|1,0,0]=3 4449 B12R1.1 COCCOc1ccc(F)c[n]1 Amb19959844 [0,2,0,0,0,0|1,0,0]=3 4450 B12R1.1 COCCOc1ccc(cc1)N Amb1995318 [0,2,0,0,0,0|0,0,0]=2 4451 B12R1.1 COCCOc1ccc(cc1)N Amb2189147 [0,2,0,0,0,0|0,0,0]=2 4452 B12R1.1 COCSCc1ccc(cc1)N Amb17498310 [0,2,0,0,0,0|2,0,0]=4 4453 B12R1.1 COC\C=C\c1ccc(O)cc1 Amb25205735 [0,2,0,0,0,0|1,0,1]=4 4454 B12R1.1 CSCCNc1ccc(Br)cc1 Amb25725440 [0,2,0,0,0,0|1,1,0]=4 4455 B12R1.1 CSCCNc1ccc(F)cc1 Amb18312643 [0,2,0,0,0,0|1,1,0]=4 4456 B12R1.1 CSCCNc1ccc(cc1)C Amb17307505 [0,2,0,0,0,0|1,1,0]=4 4457 B12R1.1 CSCCOc1ccc(cc1)N Amb17504112 [0,2,0,0,0,0|0,1,0]=3 4458 B12R1.1 C\C=C\COc1ccc(Cl)cc1 Amb24484186 [0,2,0,0,0,0|1,0,1]=4 4459 B12R1.1 C\C=C\COc1ccc(F)cc1 Amb25667089 [0,2,0,0,0,0|1,0,1]=4 4460 B12R1.1 C\C=C\COc1ccc(I)cc1 Amb25755848 [0,2,0,0,0,0|1,0,1]=4 4461 B12R1.1 C\C=C\COc1ccc(N)cc1 Amb18971519 [0,2,0,0,0,0|1,0,1]=4 4462 B12R1.1 Cc1ccc(C=C=CCO)cc1 Amb25045789 [0,2,0,0,0,0|1,0,1]=4 4463 B12R1.1 Cc1ccc(CNCCC)cc1 Amb19890384 [0,2,0,0,0,0|2,0,0]=4 4464 B12R1.1 Cc1ccc(COCC#C)cc1 Amb25092109 [0,2,0,0,0,0|1,0,1]=4 4465 B12R1.1 Cc1ccc(COCC#N)cc1 Amb25201451 [0,2,0,0,0,0|1,0,1]=4 4466 B12R1.1 Cc1ccc(CSCCCl)cc1 Amb21988400 [0,2,0,0,0,0|1,1,0]=4 4467 B12R1.1 Cc1ccc(c[n]1)OCCC#C Amb25847620 [0,2,0,0,0,0|2,0,0]=4 4468 B12R1.1 Cc1ccc(c[n]1)OCCOC Amb23455914 [0,2,0,0,0,0|1,0,0]=3 4469 B12R1.1 Cc1ccc(cc1)C#CCCCl Amb18796083 [0,2,0,0,0,0|2,0,0]=4 4470 B12R1.1 Cc1ccc(cc1)C#CCCN Amb25722543 [0,2,0,0,0,0|2,0,0]=4 4471 B12R1.1 Cc1ccc(cc1)C#CCCO Amb18792225 [0,2,0,0,0,0|1,0,0]=3 4472 B12R1.1 Cc1ccc(cc1)NCCCCl Amb24443028 [0,2,0,0,0,0|2,0,0]=4 4473 B12R1.1 Cc1ccc(cc1)NCCNC Amb19025280 [0,2,0,0,0,0|2,0,0]=4 4474 B12R1.1 Cc1ccc(cc1)OCC#CC Amb25132393 [0,2,0,0,0,0|1,0,1]=4 4475 B12R1.1 Cc1ccc(cc1)OCN=[N+]=[N-] Amb25159480 [0,2,0,0,0,0|2,0,0]=4 4476 B12R1.1 Cc1ccc(cc1)SCCC#C Amb25378502 [0,2,0,0,0,0|1,1,0]=4 4477 B12R1.1 Cc1ccc(cc1)SCCCN Amb21984206 [0,2,0,0,0,0|1,1,0]=4 4478 B12R1.1 Cc1ccc(cc1)SCCNC Amb19892872 [0,2,0,0,0,0|1,1,0]=4 4479 B12R1.1 Cc1ccc(cc1)S\C=C\CO Amb25740678 [0,2,0,0,0,0|0,1,1]=4 4480 B12R1.1 ClCCCCc1ccc(cc1)Br Amb17160233 [0,2,0,0,0,0|2,0,0]=4 4481 B12R1.1 ClCCCCc1ccc(cc1)C Amb17139047 [0,2,0,0,0,0|2,0,0]=4 4482 B12R1.1 ClCCCCc1ccc(cc1)Cl Amb17139904 [0,2,0,0,0,0|2,0,0]=4 4483 B12R1.1 ClCCCCc1ccc(cc1)F Amb17139159 [0,2,0,0,0,0|2,0,0]=4 4484 B12R1.1 ClCCCOc1ccc(cc1)Br Amb1127124 [0,2,0,0,0,0|1,0,0]=3 4485 B12R1.1 ClCCCOc1ccc(cc1)Cl Amb1138390 [0,2,0,0,0,0|1,0,0]=3 4486 B12R1.1 ClCCCOc1ccc(cc1)F Amb1152973 [0,2,0,0,0,0|1,0,0]=3 4487 B12R1.1 ClCCNCc1ccc(cc1)C Amb17335658 [0,2,0,0,0,0|2,0,0]=4 4488 B12R1.1 ClCCOCc1ccc(cc1)Cl Amb2421038 [0,2,0,0,0,0|1,0,0]=3 4489 B12R1.1 ClCC\C=C\c1ccc(cc1)Br Amb17258088 [0,2,0,0,0,0|2,0,0]=4 4490 B12R1.1 ClCC\C=C\c1ccc(cc1)C Amb17233776 [0,2,0,0,0,0|2,0,0]=4 4491 B12R1.1 ClCC\C=C\c1ccc(cc1)Cl Amb17237225 [0,2,0,0,0,0|2,0,0]=4 4492 B12R1.1 ClCC\C=C\c1ccc(cc1)F Amb17234149 [0,2,0,0,0,0|2,0,0]=4 4493 B12R1.1 ClCNCNc1ccc(cc1)I Amb16224771 [0,2,0,0,0,0|2,0,0]=4 4494 B12R1.1 Clc1ccc(CCC[Mg]Cl)cc1 Amb22897276 [0,2,0,0,0,0|2,0,0]=4 4495 B12R1.1 Clc1ccc(CCC[Zn]Cl)cc1 Amb22897731 [0,2,0,0,0,0|2,0,0]=4 4496 B12R1.1 Clc1ccc(CSCCCl)cc1 Amb22346452 [0,2,0,0,0,0|1,1,0]=4 4497 B12R1.1 Clc1ccc(\C=N\CCCl)cc1 Amb24557149 [0,2,0,0,0,0|2,0,0]=4 4498 B12R1.1 Clc1ccc(cc1)C#CCCCl Amb18322032 [0,2,0,0,0,0|2,0,0]=4 4499 B12R1.1 Clc1ccc(cc1)NCCCCl Amb25780138 [0,2,0,0,0,0|2,0,0]=4 4500 B12R1.1 FCCCNc1ccc(Cl)cc1 Amb24452998 [0,2,0,0,0,0|2,0,0]=4 4501 B12R1.1 FCCCNc1ccc(I)cc1 Amb25705819 [0,2,0,0,0,0|2,0,0]=4 4502 B12R1.1 FCCCOc1ccc(Br)cc1 Amb22008308 [0,2,0,0,0,0|1,0,0]=3 4503 B12R1.1 Fc1ccc(CCCCBr)cc1 Amb20671699 [0,2,0,0,0,0|2,0,0]=4 4504 B12R1.1 Fc1ccc(CSCCCl)cc1 Amb21988508 [0,2,0,0,0,0|1,1,0]=4 4505 B12R1.1 Fc1ccc(cc1)C#CCCCl Amb19057037 [0,2,0,0,0,0|2,0,0]=4 4506 B12R1.1 Fc1ccc(cc1)NCCCF Amb24669915 [0,2,0,0,0,0|2,0,0]=4 4507 B12R1.1 N#CCCCc1ccc(O)cc1 Amb18645494 [0,2,0,0,0,0|2,0,0]=4 4508 B12R1.1 N#CCCCc1ccc(cc1)Br Amb17246438 [0,2,0,0,0,0|2,0,0]=4 4509 B12R1.1 N#CCCCc1ccc(cc1)C Amb17232302 [0,2,0,0,0,0|2,0,0]=4 4510 B12R1.1 N#CCCCc1ccc(cc1)Cl Amb17233649 [0,2,0,0,0,0|2,0,0]=4 4511 B12R1.1 N#CCCCc1ccc(cc1)F Amb17232424 [0,2,0,0,0,0|2,0,0]=4 4512 B12R1.1 N#CCCNc1ccc(cc1)Br Amb1149927 [0,2,0,0,0,0|2,0,0]=4 4513 B12R1.1 N#CCCNc1ccc(cc1)C Amb1643630 [0,2,0,0,0,0|2,0,0]=4 4514 B12R1.1 N#CCCNc1ccc(cc1)Cl Amb1647287 [0,2,0,0,0,0|2,0,0]=4 4515 B12R1.1 N#CCCNc1ccc(cc1)F Amb1103894 [0,2,0,0,0,0|2,0,0]=4 4516 B12R1.1 N#CCCNc1ccc(cc1)O Amb17142901 [0,2,0,0,0,0|2,0,0]=4 4517 B12R1.1 N#CCCOc1ccc(O)cc1 Amb25735175 [0,2,0,0,0,0|1,0,0]=3 4518 B12R1.1 N#CCCSc1ccc(cc1)C Amb1634502 [0,2,0,0,0,0|1,1,0]=4 4519 B12R1.1 N#CCOCc1ccc(Br)cc1 Amb24649568 [0,2,0,0,0,0|1,0,1]=4 4520 B12R1.1 NCCCCc1ccc(Cl)cc1 Amb18015291 [0,2,0,0,0,0|2,0,0]=4 4521 B12R1.1 NCCCCc1ccc(O)cc1 Amb18828233 [0,2,0,0,0,0|2,0,0]=4 4522 B12R1.1 NCCCCc1ccc(O)cc1 Amb24117946 [0,2,0,0,0,0|2,0,0]=4 4523 B12R1.1 NCCCCc1ccc(cc1)Br Amb17195656 [0,2,0,0,0,0|2,0,0]=4 4524 B12R1.1 NCCCNc1ccc(cc1)Br Amb17057730 [0,2,0,0,0,0|2,0,0]=4 4525 B12R1.1 NCCCNc1ccc(cc1)C Amb17057723 [0,2,0,0,0,0|2,0,0]=4 4526 B12R1.1 NCCCNc1ccc(cc1)Cl Amb17057729 [0,2,0,0,0,0|2,0,0]=4 4527 B12R1.1 NCCCNc1ccc(cc1)F Amb17057726 [0,2,0,0,0,0|2,0,0]=4 4528 B12R1.1 NCCCOc1ccc(cc1)C Amb1108458 [0,2,0,0,0,0|1,0,0]=3 4529 B12R1.1 NCCCOc1ccc(cc1)F Amb1108272 [0,2,0,0,0,0|1,0,0]=3 4530 B12R1.1 NCCCSc1ccc(Cl)cc1 Amb21984207 [0,2,0,0,0,0|1,1,0]=4 4531 B12R1.1 NCCCSc1ccc(cc1)F Amb162071 [0,2,0,0,0,0|1,1,0]=4 4532 B12R1.1 NCCCSc1ccc(cc1)F Amb2370740 [0,2,0,0,0,0|1,1,0]=4 4533 B12R1.1 NCCNCc1ccc(Br)cc1 Amb19012729 [0,2,0,0,0,0|2,0,0]=4 4534 B12R1.1 NCCNCc1ccc(cc1)Cl Amb10075508 [0,2,0,0,0,0|2,0,0]=4 4535 B12R1.1 NCCNCc1ccc(cc1)F Amb10075507 [0,2,0,0,0,0|2,0,0]=4 4536 B12R1.1 NCCOCc1ccc(cc1)Br Amb17061822 [0,2,0,0,0,0|1,0,0]=3 4537 B12R1.1 NCCOCc1ccc(cc1)C Amb17061816 [0,2,0,0,0,0|1,0,0]=3 4538 B12R1.1 NCCOCc1ccc(cc1)F Amb17061819 [0,2,0,0,0,0|1,0,0]=3 4539 B12R1.1 NCCSCc1ccc(cc1)Cl Amb1214895 [0,2,0,0,0,0|1,1,0]=4 4540 B12R1.1 NCC\C=C\c1ccc(I)cc1 Amb24493312 [0,2,0,0,0,0|2,0,0]=4 4541 B12R1.1 NCC\C=C\c1ccc(cc1)Br Amb17142136 [0,2,0,0,0,0|2,0,0]=4 4542 B12R1.1 NCC\C=C\c1ccc(cc1)C Amb17138533 [0,2,0,0,0,0|2,0,0]=4 4543 B12R1.1 NCC\C=C\c1ccc(cc1)Cl Amb17139018 [0,2,0,0,0,0|2,0,0]=4 4544 B12R1.1 NCC\C=C\c1ccc(cc1)F Amb17138587 [0,2,0,0,0,0|2,0,0]=4 4545 B12R1.1 NCC\N=C\c1ccc(Cl)cc1 Amb25238653 [0,2,0,0,0,0|2,0,0]=4 4546 B12R1.1 NNCCOc1ccc(cc1)Br Amb17407555 [0,2,0,0,0,0|1,0,0]=3 4547 B12R1.1 NNCCOc1ccc(cc1)C Amb1117290 [0,2,0,0,0,0|1,0,0]=3 4548 B12R1.1 NNCCOc1ccc(cc1)Cl Amb2282443 [0,2,0,0,0,0|1,0,0]=3 4549 B12R1.1 NNCCOc1ccc(cc1)Cl Amb2370789 [0,2,0,0,0,0|1,0,0]=3 4550 B12R1.1 NNCCOc1ccc(cc1)F Amb17400323 [0,2,0,0,0,0|1,0,0]=3 4551 B12R1.1 NOCC#Cc1ccc(F)cc1 Amb24661686 [0,2,0,0,0,0|1,0,1]=4 4552 B12R1.1 NOCCCc1ccc(cc1)Br Amb17089579 [0,2,0,0,0,0|1,0,0]=3 4553 B12R1.1 NOCCCc1ccc(cc1)C Amb17089551 [0,2,0,0,0,0|1,0,0]=3 4554 B12R1.1 NOCCCc1ccc(cc1)Cl Amb17089560 [0,2,0,0,0,0|1,0,0]=3 4555 B12R1.1 NOCCCc1ccc(cc1)F Amb17089553 [0,2,0,0,0,0|1,0,0]=3 4556 B12R1.1 NOCCCc1ccc(cc1)O Amb17089576 [0,2,0,0,0,0|1,0,0]=3 4557 B12R1.1 NOCCOc1ccc(cc1)Br Amb17088299 [0,2,0,0,0,0|0,0,0]=2 4558 B12R1.1 NOCCOc1ccc(cc1)C Amb17088290 [0,2,0,0,0,0|0,0,0]=2 4559 B12R1.1 NOCCOc1ccc(cc1)Cl Amb17088296 [0,2,0,0,0,0|0,0,0]=2 4560 B12R1.1 NOCCOc1ccc(cc1)F Amb17088293 [0,2,0,0,0,0|0,0,0]=2 4561 B12R1.1 Nc1ccc(CCCC#N)cc1 Amb18645390 [0,2,0,0,0,0|2,0,0]=4 4562 B12R1.1 Nc1ccc(CCCCO)cc1 Amb18828232 [0,2,0,0,0,0|1,0,0]=3 4563 B12R1.1 Nc1ccc(cc1)OCCC#N Amb18290036 [0,2,0,0,0,0|1,0,0]=3 4564 B12R1.1 Nc1ccc(cc1)OCCCF Amb22008519 [0,2,0,0,0,0|1,0,0]=3 4565 B12R1.1 Nc1ccc(cc1)OC\C=C\Cl Amb18971517 [0,2,0,0,0,0|1,0,1]=4 4566 B12R1.1 Nc1ccc(cc1)SCCC#N Amb25151005 [0,2,0,0,0,0|1,1,0]=4 4567 B12R1.1 Nc1ccc(cc1)S\C=C\CO Amb24623670 [0,2,0,0,0,0|0,1,1]=4 4568 B12R1.1 O=CCCCc1ccc(cc1)Br Amb17089176 [0,2,0,0,0,0|1,0,1]=4 4569 B12R1.1 O=CCCCc1ccc(cc1)C Amb17089167 [0,2,0,0,0,0|1,0,1]=4 4570 B12R1.1 O=CCCCc1ccc(cc1)Cl Amb17089175 [0,2,0,0,0,0|1,0,1]=4 4571 B12R1.1 O=CCCCc1ccc(cc1)F Amb17089174 [0,2,0,0,0,0|1,0,1]=4 4572 B12R1.1 O=CCCSc1ccc(cc1)Br Amb17082947 [0,2,0,0,0,0|0,1,1]=4 4573 B12R1.1 O=CCCSc1ccc(cc1)C Amb17082944 [0,2,0,0,0,0|0,1,1]=4 4574 B12R1.1 O=CCCSc1ccc(cc1)Cl Amb17082946 [0,2,0,0,0,0|0,1,1]=4 4575 B12R1.1 O=CCCSc1ccc(cc1)F Amb17082945 [0,2,0,0,0,0|0,1,1]=4 4576 B12R1.1 OCC#CCc1ccc(Cl)cc1 Amb24671401 [0,2,0,0,0,0|1,0,1]=4 4577 B12R1.1 OCC=C=Cc1ccc(Cl)cc1 Amb24475143 [0,2,0,0,0,0|1,0,1]=4 4578 B12R1.1 OCCC#Cc1ccc(Br)c[n]1 Amb24517180 [0,2,0,0,0,0|2,0,0]=4 4579 B12R1.1 OCCC#Cc1ccc(Cl)cc1 Amb18796382 [0,2,0,0,0,0|1,0,0]=3 4580 B12R1.1 OCCC#Cc1ccc(F)cc1 Amb18792544 [0,2,0,0,0,0|1,0,0]=3 4581 B12R1.1 OCCC=Cc1ccc(F)cc1 Amb20671698 [0,2,0,0,0,0|1,0,0]=3 4582 B12R1.1 OCCCCc1ccc(cc1)Br Amb17089159 [0,2,0,0,0,0|1,0,0]=3 4583 B12R1.1 OCCCCc1ccc(cc1)C Amb16183285 [0,2,0,0,0,0|1,0,0]=3 4584 B12R1.1 OCCCCc1ccc(cc1)Cl Amb17089158 [0,2,0,0,0,0|1,0,0]=3 4585 B12R1.1 OCCCCc1ccc(cc1)F Amb17089157 [0,2,0,0,0,0|1,0,0]=3 4586 B12R1.1 OCCCNc1ccc(Br)[n]c1 Amb25188079 [0,2,0,0,0,0|2,0,0]=4 4587 B12R1.1 OCCCNc1ccc(F)c[n]1 Amb18306372 [0,2,0,0,0,0|2,0,0]=4 4588 B12R1.1 OCCCNc1ccc(cc1)Br Amb17306798 [0,2,0,0,0,0|1,0,0]=3 4589 B12R1.1 OCCCNc1ccc(cc1)C Amb17306885 [0,2,0,0,0,0|1,0,0]=3 4590 B12R1.1 OCCCNc1ccc(cc1)Cl Amb17307252 [0,2,0,0,0,0|1,0,0]=3 4591 B12R1.1 OCCCNc1ccc(cc1)F Amb17306196 [0,2,0,0,0,0|1,0,0]=3 4592 B12R1.1 OCCCNc1ccc(cc1)I Amb17306250 [0,2,0,0,0,0|1,0,0]=3 4593 B12R1.1 OCCCOc1ccc(cc1)F Amb1109753 [0,2,0,0,0,0|0,0,0]=2 4594 B12R1.1 OCCNCc1ccc(Br)[n]c1 Amb21861807 [0,2,0,0,0,0|2,0,0]=4 4595 B12R1.1 OCCNCc1ccc(Br)c[n]1 Amb24080720 [0,2,0,0,0,0|2,0,0]=4 4596 B12R1.1 OCCNCc1ccc(Cl)[n]c1 Amb21861815 [0,2,0,0,0,0|2,0,0]=4 4597 B12R1.1 OCCNCc1ccc(Cl)[n]c1 Amb21988407 [0,2,0,0,0,0|2,0,0]=4 4598 B12R1.1 OCCOCc1ccc(cc1)Cl Amb2421036 [0,2,0,0,0,0|0,0,0]=2 4599 B12R1.1 OCC\C=C\c1ccc(F)cc1 Amb24763739 [0,2,0,0,0,0|1,0,0]=3 4600 B12R1.1 OCC\N=C\c1ccc(F)cc1 Amb24475878 [0,2,0,0,0,0|1,0,0]=3 4601 B12R1.1 ONCCOc1ccc(cc1)Br Amb17088425 [0,2,0,0,0,0|0,0,0]=2 4602 B12R1.1 ONCCOc1ccc(cc1)C Amb17088416 [0,2,0,0,0,0|0,0,0]=2 4603 B12R1.1 ONCCOc1ccc(cc1)Cl Amb17088422 [0,2,0,0,0,0|0,0,0]=2 4604 B12R1.1 ONCCOc1ccc(cc1)F Amb17088419 [0,2,0,0,0,0|0,0,0]=2 4605 B12R1.1 Oc1ccc(CC\C=N\O)cc1 Amb24598916 [0,2,0,0,0,0|1,0,1]=4 4606 B12R1.1 Oc1ccc(cc1)C#CCCO Amb25271024 [0,2,0,0,0,0|1,0,0]=3 4607 B12R1.1 Oc1ccc(cc1)NCCCF Amb22008518 [0,2,0,0,0,0|2,0,0]=4 4608 B12R1.1 Oc1ccc(cc1)OCCCBr Amb18135328 [0,2,0,0,0,0|1,0,0]=3 4609 B12R1.1 Oc1ccc(cc1)OCCCF Amb22008282 [0,2,0,0,0,0|1,0,0]=3 4610 B12R1.1 SCCCCc1ccc(cc1)Br Amb17411242 [0,2,0,0,0,0|1,1,0]=4 4611 B12R1.1 SCCCCc1ccc(cc1)C Amb17400847 [0,2,0,0,0,0|1,1,0]=4 4612 B12R1.1 SCCCCc1ccc(cc1)Cl Amb17402392 [0,2,0,0,0,0|1,1,0]=4 4613 B12R1.1 SCCCCc1ccc(cc1)F Amb17401040 [0,2,0,0,0,0|1,1,0]=4 4614 B12R1.1 SCCCOc1ccc(cc1)Br Amb17258959 [0,2,0,0,0,0|0,1,0]=3 4615 B12R1.1 SCCCOc1ccc(cc1)C Amb10813402 [0,2,0,0,0,0|0,1,0]=3 4616 B12R1.1 SCCCOc1ccc(cc1)N Amb17504082 [0,2,0,0,0,0|0,1,0]=3 4617 B12R1.1 [C-]#[N+]CCCc1ccc(C)cc1 Amb24610675 [0,2,0,0,0,0|2,0,0]=4 4618 B12R1.1 [C-]#[N+]CCOc1ccc(O)cc1 Amb25178460 [0,2,0,0,0,0|1,0,0]=3 4619 B12R1.1 [C-]#[N+]CCSc1ccc(C)cc1 Amb24686207 [0,2,0,0,0,0|1,1,0]=4 4620 B12R1.16 BrCCC(=O)c1ccc(cc1)Br Amb17437866 [0,2,0,0,0,0|2,0,0]=4 4621 B12R1.16 BrCCC(=O)c1ccc(cc1)F Amb17437867 [0,2,0,0,0,0|2,0,0]=4 4622 B12R1.16 BrCCC(c1ccc(cc1)Br)C Amb17290540 [0,2,0,0,0,0|2,0,0]=4 4623 B12R1.16 BrCCC(c1ccc(cc1)Cl)C Amb17259616 [0,2,0,0,0,0|2,0,0]=4 4624 B12R1.16 BrCCC(c1ccc(cc1)F)C Amb17249285 [0,2,0,0,0,0|2,0,0]=4 4625 B12R1.16 Brc1ccc(cc1)C(Br)CCBr Amb21864681 [0,2,0,0,0,0|2,0,0]=4 4626 B12R1.16 C=C(CCO)c1ccc(Cl)cc1 Amb25760753 [0,2,0,0,0,0|1,0,0]=3 4627 B12R1.16 CC(CCN)c1ccc(Cl)cc1 Amb22034632 [0,2,0,0,0,0|2,0,0]=4 4628 B12R1.16 CC(CCN)c1ccc(N)cc1 Amb25856793 [0,2,0,0,0,0|2,0,0]=4 4629 B12R1.16 CC(CCO)c1ccc(N)cc1 Amb24553218 [0,2,0,0,0,0|1,0,0]=3 4630 B12R1.16 CC(CCS)c1ccc(N)cc1 Amb24442941 [0,2,0,0,0,0|1,1,0]=4 4631 B12R1.16 CCCC(=C)c1ccc(N)cc1 Amb25258551 [0,2,0,0,0,0|2,0,0]=4 4632 B12R1.16 CCCC(=O)c1ccc(cc1)Br Amb2567820 [0,2,0,0,0,0|2,0,0]=4 4633 B12R1.16 CCCC(=O)c1ccc(cc1)Cl Amb1679791 [0,2,0,0,0,0|2,0,0]=4 4634 B12R1.16 CCCC(=O)c1ccc(cc1)O Amb1033062 [0,2,0,0,0,0|2,0,0]=4 4635 B12R1.16 CCCC(Br)c1ccc(Cl)cc1 Amb25281165 [0,2,0,0,0,0|2,0,0]=4 4636 B12R1.16 CCCC(C)c1ccc(N)cc1 Amb18126395 [0,2,0,0,0,0|2,0,0]=4 4637 B12R1.16 CCCC(N)c1ccc(Cl)cc1 Amb20626143 [0,2,0,0,0,0|2,0,0]=4 4638 B12R1.16 CCCC(N)c1ccc(I)cc1 Amb25118824 [0,2,0,0,0,0|2,0,0]=4 4639 B12R1.16 CCCC(N)c1ccc(O)cc1 Amb18939625 [0,2,0,0,0,0|2,0,0]=4 4640 B12R1.16 CCCC(O)c1ccc(N)cc1 Amb24619836 [0,2,0,0,0,0|2,0,0]=4 4641 B12R1.16 CCCC(c1ccc(cc1)Br)Cl Amb17160235 [0,2,0,0,0,0|2,0,0]=4 4642 B12R1.16 CCCC(c1ccc(cc1)C)Cl Amb17139051 [0,2,0,0,0,0|2,0,0]=4 4643 B12R1.16 CCCC(c1ccc(cc1)Cl)Cl Amb17139906 [0,2,0,0,0,0|2,0,0]=4 4644 B12R1.16 CCCC(c1ccc(cc1)F)Cl Amb17139162 [0,2,0,0,0,0|2,0,0]=4 4645 B12R1.16 CCCC(c1ccc(cc1)O)C Amb17594074 [0,2,0,0,0,0|2,0,0]=4 4646 B12R1.16 CCCS(=O)c1ccc(N)cc1 Amb18977331 [0,2,0,0,0,0|1,1,0]=4 4647 B12R1.16 CCC[C@@H](N)c1ccc(Br)cc1 Amb24729386 [0,2,0,0,0,0|2,0,0]=4 4648 B12R1.16 CCC[C@@H](N)c1ccc(Cl)cc1 Amb25043269 [0,2,0,0,0,0|2,0,0]=4 4649 B12R1.16 CCC[C@@H](N)c1ccc(F)cc1 Amb22298535 [0,2,0,0,0,0|2,0,0]=4 4650 B12R1.16 CCC[C@@H](N)c1ccc(F)cc1 Amb22744980 [0,2,0,0,0,0|2,0,0]=4 4651 B12R1.16 CCC[C@@H](N)c1ccc(I)cc1 Amb25195840 [0,2,0,0,0,0|2,0,0]=4 4652 B12R1.16 CCC[C@@H](N)c1ccc(N)cc1 Amb22288661 [0,2,0,0,0,0|2,0,0]=4 4653 B12R1.16 CCC[C@@H](N)c1ccc(N)cc1 Amb25149895 [0,2,0,0,0,0|2,0,0]=4 4654 B12R1.16 CCC[C@@H](N)c1ccc(O)cc1 Amb22288662 [0,2,0,0,0,0|2,0,0]=4 4655 B12R1.16 CCC[C@@H](N)c1ccc(O)cc1 Amb25063010 [0,2,0,0,0,0|2,0,0]=4 4656 B12R1.16 CCC[C@@H](O)c1ccc(Br)cc1 Amb25069849 [0,2,0,0,0,0|2,0,0]=4 4657 B12R1.16 CCC[C@@H](O)c1ccc(F)cc1 Amb24404009 [0,2,0,0,0,0|2,0,0]=4 4658 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb22298578 [0,2,0,0,0,0|2,0,0]=4 4659 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb24700451 [0,2,0,0,0,0|2,0,0]=4 4660 B12R1.16 CCC[C@H](N)c1ccc(I)cc1 Amb25337897 [0,2,0,0,0,0|2,0,0]=4 4661 B12R1.16 CCC[C@H](N)c1ccc(N)cc1 Amb22288706 [0,2,0,0,0,0|2,0,0]=4 4662 B12R1.16 CCC[C@H](N)c1ccc(O)cc1 Amb22288707 [0,2,0,0,0,0|2,0,0]=4 4663 B12R1.16 CCC[C@H](N)c1ccc(S)cc1 Amb24341710 [0,2,0,0,0,0|2,0,0]=4 4664 B12R1.16 CCC[C@H](O)c1ccc(Cl)cc1 Amb24483363 [0,2,0,0,0,0|2,0,0]=4 4665 B12R1.16 CCC[C@H](O)c1ccc(F)cc1 Amb24576719 [0,2,0,0,0,0|2,0,0]=4 4666 B12R1.16 CN(CCBr)c1ccc(F)cc1 Amb24450490 [0,2,0,0,0,0|2,0,0]=4 4667 B12R1.16 CN(CCCl)c1ccc(O)cc1 Amb25321957 [0,2,0,0,0,0|2,0,0]=4 4668 B12R1.16 CN(CCF)c1ccc(N)cc1 Amb25093879 [0,2,0,0,0,0|2,0,0]=4 4669 B12R1.16 CN(CCI)c1ccc(F)cc1 Amb24555424 [0,2,0,0,0,0|2,0,0]=4 4670 B12R1.16 CN(CCN)c1ccc(N)cc1 Amb18251776 [0,2,0,0,0,0|2,0,0]=4 4671 B12R1.16 CN(CCN)c1ccc(O)cc1 Amb18251791 [0,2,0,0,0,0|2,0,0]=4 4672 B12R1.16 CN(CCO)N1C=CC(=S)C=C1 Amb25057822 [0,2,0,0,0,0|2,0,0]=4 4673 B12R1.16 CN(CCO)c1ccc(Cl)c[n]1 Amb19058993 [0,2,0,0,0,0|2,0,0]=4 4674 B12R1.16 CN(CCO)c1ccc(F)c[n]1 Amb18177924 [0,2,0,0,0,0|2,0,0]=4 4675 B12R1.16 CN(CCO)c1ccc(O)cc1 Amb25202702 [0,2,0,0,0,0|1,0,0]=3 4676 B12R1.16 C[C@@H](CCBr)c1ccc(Cl)cc1 Amb24667919 [0,2,0,0,0,0|2,0,0]=4 4677 B12R1.16 C[C@@H](CCO)c1ccc(Cl)cc1 Amb25832765 [0,2,0,0,0,0|1,0,0]=3 4678 B12R1.16 C[C@@H](CCO)c1ccc(F)cc1 Amb25317656 [0,2,0,0,0,0|1,0,0]=3 4679 B12R1.16 C\C(=C\CO)\c1ccc(Br)cc1 Amb24579789 [0,2,0,0,0,0|1,0,1]=4 4680 B12R1.16 C\C(=C\CO)\c1ccc(F)cc1 Amb25848827 [0,2,0,0,0,0|1,0,1]=4 4681 B12R1.16 Cc1ccc([n]c1)C(N)CCO Amb25743140 [0,2,0,0,0,0|2,0,0]=4 4682 B12R1.16 Cc1ccc([n]c1)N(C)CCO Amb18792799 [0,2,0,0,0,0|2,0,0]=4 4683 B12R1.16 Cc1ccc([n]c1)[C@@H](N)CCO Amb25719468 [0,2,0,0,0,0|2,0,0]=4 4684 B12R1.16 Cc1ccc(c[n]1)[C@@H](N)CCO Amb24597642 [0,2,0,0,0,0|2,0,0]=4 4685 B12R1.16 Cc1ccc(c[n]1)[C@H](N)CCO Amb25324270 [0,2,0,0,0,0|2,0,0]=4 4686 B12R1.16 Cc1ccc(cc1)C(=O)CCO Amb18563614 [0,2,0,0,0,0|1,0,0]=3 4687 B12R1.16 Cc1ccc(cc1)C(=O)CNO Amb25140702 [0,2,0,0,0,0|2,0,0]=4 4688 B12R1.16 Cc1ccc(cc1)C(=S)NCO Amb25751184 [0,2,0,0,0,0|2,0,0]=4 4689 B12R1.16 Cc1ccc(cc1)C(Br)CCBr Amb23456168 [0,2,0,0,0,0|2,0,0]=4 4690 B12R1.16 Cc1ccc(cc1)C(Br)CCCl Amb24544004 [0,2,0,0,0,0|2,0,0]=4 4691 B12R1.16 Cc1ccc(cc1)C(Cl)CCO Amb24552889 [0,2,0,0,0,0|1,0,0]=3 4692 B12R1.16 Cc1ccc(cc1)C(N)CCN Amb18646152 [0,2,0,0,0,0|2,0,0]=4 4693 B12R1.16 Cc1ccc(cc1)C(O)CCO Amb18563722 [0,2,0,0,0,0|1,0,0]=3 4694 B12R1.16 Cc1ccc(cc1)C(S)CCN Amb25112044 [0,2,0,0,0,0|2,0,0]=4 4695 B12R1.16 Cc1ccc(cc1)N(C)CCC Amb25154383 [0,2,0,0,0,0|2,0,0]=4 4696 B12R1.16 Cc1ccc(cc1)N(C)CCF Amb25355436 [0,2,0,0,0,0|2,0,0]=4 4697 B12R1.16 Cc1ccc(cc1)N(C)CCS Amb25858637 [0,2,0,0,0,0|1,1,0]=4 4698 B12R1.16 Cc1ccc(cc1)N(N)CCO Amb25755524 [0,2,0,0,0,0|1,0,0]=3 4699 B12R1.16 Cc1ccc(cc1)S(=O)CCN Amb18290917 [0,2,0,0,0,0|1,1,0]=4 4700 B12R1.16 Cc1ccc(cc1)S(=O)CCO Amb24578332 [0,2,0,0,0,0|0,1,0]=3 4701 B12R1.16 Cc1ccc(cc1)[C@@H](C)CCO Amb25058547 [0,2,0,0,0,0|1,0,0]=3 4702 B12R1.16 Cc1ccc(cc1)[C@@H](N)CCC Amb22298580 [0,2,0,0,0,0|2,0,0]=4 4703 B12R1.16 Cc1ccc(cc1)[C@@H](N)CCO Amb19888370 [0,2,0,0,0,0|1,0,0]=3 4704 B12R1.16 Cc1ccc(cc1)[C@@H](N)CCO Amb23399704 [0,2,0,0,0,0|1,0,0]=3 4705 B12R1.16 Cc1ccc(cc1)[C@@H](O)CCC Amb24364768 [0,2,0,0,0,0|2,0,0]=4 4706 B12R1.16 Cc1ccc(cc1)[C@H](C)CCO Amb24671505 [0,2,0,0,0,0|1,0,0]=3 4707 B12R1.16 Cc1ccc(cc1)[C@H](N)CCC Amb22298537 [0,2,0,0,0,0|2,0,0]=4 4708 B12R1.16 Cc1ccc(cc1)[C@H](N)CCO Amb19887704 [0,2,0,0,0,0|1,0,0]=3 4709 B12R1.16 Cc1ccc(cc1)[C@H](O)CCC Amb24709228 [0,2,0,0,0,0|2,0,0]=4 4710 B12R1.16 Cc1ccc(cc1)[C@H](O)CCCl Amb25361013 [0,2,0,0,0,0|2,0,0]=4 4711 B12R1.16 ClC(CCBr)c1ccc(Br)cc1 Amb21864682 [0,2,0,0,0,0|2,0,0]=4 4712 B12R1.16 ClCCC(=O)c1ccc(cc1)F Amb1233062 [0,2,0,0,0,0|2,0,0]=4 4713 B12R1.16 ClCCC(=O)c1ccc(cc1)N Amb17202006 [0,2,0,0,0,0|2,0,0]=4 4714 B12R1.16 ClCCC(c1ccc(cc1)Br)C Amb17259618 [0,2,0,0,0,0|2,0,0]=4 4715 B12R1.16 ClCCC(c1ccc(cc1)Br)O Amb17196599 [0,2,0,0,0,0|2,0,0]=4 4716 B12R1.16 ClCCC(c1ccc(cc1)C)C Amb17233970 [0,2,0,0,0,0|2,0,0]=4 4717 B12R1.16 ClCCC(c1ccc(cc1)C)O Amb17194565 [0,2,0,0,0,0|2,0,0]=4 4718 B12R1.16 ClCCC(c1ccc(cc1)Cl)C Amb17237597 [0,2,0,0,0,0|2,0,0]=4 4719 B12R1.16 ClCCC(c1ccc(cc1)Cl)O Amb17194897 [0,2,0,0,0,0|2,0,0]=4 4720 B12R1.16 ClCCC(c1ccc(cc1)F)C Amb17234366 [0,2,0,0,0,0|2,0,0]=4 4721 B12R1.16 ClCCC(c1ccc(cc1)F)O Amb17194592 [0,2,0,0,0,0|2,0,0]=4 4722 B12R1.16 ClCCN(c1ccc(cc1)Br)C Amb17351918 [0,2,0,0,0,0|2,0,0]=4 4723 B12R1.16 ClCCN(c1ccc(cc1)C)C Amb17335672 [0,2,0,0,0,0|2,0,0]=4 4724 B12R1.16 ClCCN(c1ccc(cc1)Cl)C Amb17338057 [0,2,0,0,0,0|2,0,0]=4 4725 B12R1.16 ClCCN(c1ccc(cc1)F)C Amb17335952 [0,2,0,0,0,0|2,0,0]=4 4726 B12R1.16 Clc1ccc(cc1)C(Br)CCBr Amb22001093 [0,2,0,0,0,0|2,0,0]=4 4727 B12R1.16 Clc1ccc(cc1)C(Br)CCCl Amb25089461 [0,2,0,0,0,0|2,0,0]=4 4728 B12R1.16 Fc1ccc(cc1)C(Br)CCCl Amb24741485 [0,2,0,0,0,0|2,0,0]=4 4729 B12R1.16 ICC[C@@H](c1ccc(cc1)F)O Amb16233257 [0,2,0,0,0,0|2,0,0]=4 4730 B12R1.16 NC(CCO)c1c[n]c(F)cc1 Amb24760895 [0,2,0,0,0,0|2,0,0]=4 4731 B12R1.16 NC(CCO)c1c[n]c(I)cc1 Amb24399872 [0,2,0,0,0,0|2,0,0]=4 4732 B12R1.16 NC(CCO)c1cc[n+]([O-])cc1 Amb25291128 [0,2,0,0,0,0|2,0,0]=4 4733 B12R1.16 NC(CCO)c1ccc(Br)c[n]1 Amb24540520 [0,2,0,0,0,0|2,0,0]=4 4734 B12R1.16 NC(CCO)c1ccc(Cl)cc1 Amb19888463 [0,2,0,0,0,0|1,0,0]=3 4735 B12R1.16 NC(CCO)c1ccc(F)c[n]1 Amb24713297 [0,2,0,0,0,0|2,0,0]=4 4736 B12R1.16 NC(CCO)c1ccc(F)cc1 Amb22490662 [0,2,0,0,0,0|1,0,0]=3 4737 B12R1.16 NC(CCO)c1ccc(I)c[n]1 Amb24375489 [0,2,0,0,0,0|2,0,0]=4 4738 B12R1.16 NC(CCO)c1ccc(O)[n]c1 Amb24561642 [0,2,0,0,0,0|2,0,0]=4 4739 B12R1.16 NC(CCO)c1ccc(O)c[n]1 Amb24668525 [0,2,0,0,0,0|2,0,0]=4 4740 B12R1.16 NCCC(=O)c1ccc(cc1)Br Amb17195655 [0,2,0,0,0,0|2,0,0]=4 4741 B12R1.16 NCCC(=O)c1ccc(cc1)C Amb17194471 [0,2,0,0,0,0|2,0,0]=4 4742 B12R1.16 NCCC(=O)c1ccc(cc1)Cl Amb17194559 [0,2,0,0,0,0|2,0,0]=4 4743 B12R1.16 NCCC(=O)c1ccc(cc1)F Amb17108934 [0,2,0,0,0,0|2,0,0]=4 4744 B12R1.16 NCCC(F)c1ccc(Br)cc1 Amb25255565 [0,2,0,0,0,0|2,0,0]=4 4745 B12R1.16 NCCC(N)c1ccc(Br)cc1 Amb24655128 [0,2,0,0,0,0|2,0,0]=4 4746 B12R1.16 NCCC(N)c1ccc(F)cc1 Amb18646990 [0,2,0,0,0,0|2,0,0]=4 4747 B12R1.16 NCCC(N)c1ccc(I)cc1 Amb25339716 [0,2,0,0,0,0|2,0,0]=4 4748 B12R1.16 NCCC(O)c1ccc(Cl)cc1 Amb21984559 [0,2,0,0,0,0|2,0,0]=4 4749 B12R1.16 NCCC(O)c1ccc(F)cc1 Amb21984558 [0,2,0,0,0,0|2,0,0]=4 4750 B12R1.16 NCCC(c1ccc(cc1)Br)O Amb17079141 [0,2,0,0,0,0|2,0,0]=4 4751 B12R1.16 NCCC(c1ccc(cc1)C)O Amb17079132 [0,2,0,0,0,0|2,0,0]=4 4752 B12R1.16 NCCC(c1ccc(cc1)Cl)O Amb17079140 [0,2,0,0,0,0|2,0,0]=4 4753 B12R1.16 NCCC(c1ccc(cc1)F)O Amb17079139 [0,2,0,0,0,0|2,0,0]=4 4754 B12R1.16 NCCN(c1ccc(cc1)Br)C Amb17059648 [0,2,0,0,0,0|2,0,0]=4 4755 B12R1.16 NCCN(c1ccc(cc1)C)C Amb13893182 [0,2,0,0,0,0|2,0,0]=4 4756 B12R1.16 NCCN(c1ccc(cc1)Cl)C Amb17059647 [0,2,0,0,0,0|2,0,0]=4 4757 B12R1.16 NCCN(c1ccc(cc1)F)C Amb17059644 [0,2,0,0,0,0|2,0,0]=4 4758 B12R1.16 NCCS(=O)c1ccc(Br)cc1 Amb18290919 [0,2,0,0,0,0|1,1,0]=4 4759 B12R1.16 NCCS(=O)c1ccc(Cl)cc1 Amb18974515 [0,2,0,0,0,0|1,1,0]=4 4760 B12R1.16 NCCS(=O)c1ccc(F)cc1 Amb18974517 [0,2,0,0,0,0|1,1,0]=4 4761 B12R1.16 NCCS(=O)c1ccc(I)cc1 Amb25315872 [0,2,0,0,0,0|1,1,0]=4 4762 B12R1.16 NCC[C@@H](N)c1ccc(Br)cc1 Amb24655137 [0,2,0,0,0,0|2,0,0]=4 4763 B12R1.16 NCC[C@@H](N)c1ccc(F)cc1 Amb24549962 [0,2,0,0,0,0|2,0,0]=4 4764 B12R1.16 NCC[C@@H](O)c1ccc(F)cc1 Amb25148762 [0,2,0,0,0,0|2,0,0]=4 4765 B12R1.16 NCC[C@H](N)c1ccc(Br)cc1 Amb24617766 [0,2,0,0,0,0|2,0,0]=4 4766 B12R1.16 NCC[C@H](N)c1ccc(F)cc1 Amb25314561 [0,2,0,0,0,0|2,0,0]=4 4767 B12R1.16 NCC[C@H](O)c1ccc(Cl)cc1 Amb24727053 [0,2,0,0,0,0|2,0,0]=4 4768 B12R1.16 NCC[C@H](O)c1ccc(F)cc1 Amb25148765 [0,2,0,0,0,0|2,0,0]=4 4769 B12R1.16 N[C@@H](CCO)c1c[n]c(Cl)cc1 Amb24361595 [0,2,0,0,0,0|2,0,0]=4 4770 B12R1.16 N[C@@H](CCO)c1c[n]c(F)cc1 Amb24370788 [0,2,0,0,0,0|2,0,0]=4 4771 B12R1.16 N[C@@H](CCO)c1c[n]c(I)cc1 Amb25323952 [0,2,0,0,0,0|2,0,0]=4 4772 B12R1.16 N[C@@H](CCO)c1ccc(Br)c[n]1 Amb24399312 [0,2,0,0,0,0|2,0,0]=4 4773 B12R1.16 N[C@@H](CCO)c1ccc(Cl)c[n]1 Amb25368193 [0,2,0,0,0,0|2,0,0]=4 4774 B12R1.16 N[C@@H](CCO)c1ccc(Cl)cc1 Amb19888405 [0,2,0,0,0,0|1,0,0]=3 4775 B12R1.16 N[C@@H](CCO)c1ccc(Cl)cc1 Amb22747365 [0,2,0,0,0,0|1,0,0]=3 4776 B12R1.16 N[C@@H](CCO)c1ccc(F)c[n]1 Amb24411448 [0,2,0,0,0,0|2,0,0]=4 4777 B12R1.16 N[C@@H](CCO)c1ccc(F)cc1 Amb19888378 [0,2,0,0,0,0|1,0,0]=3 4778 B12R1.16 N[C@@H](CCO)c1ccc(O)[n]c1 Amb24487168 [0,2,0,0,0,0|2,0,0]=4 4779 B12R1.16 N[C@@H](CCO)c1ccc(O)c[n]1 Amb25324318 [0,2,0,0,0,0|2,0,0]=4 4780 B12R1.16 N[C@@H](CCO)c1ccc(O)cc1 Amb24446583 [0,2,0,0,0,0|1,0,0]=3 4781 B12R1.16 N[C@H](CCO)c1c[n]c(Br)cc1 Amb24759936 [0,2,0,0,0,0|2,0,0]=4 4782 B12R1.16 N[C@H](CCO)c1c[n]c(Cl)cc1 Amb25722664 [0,2,0,0,0,0|2,0,0]=4 4783 B12R1.16 N[C@H](CCO)c1c[n]c(F)cc1 Amb24715237 [0,2,0,0,0,0|2,0,0]=4 4784 B12R1.16 N[C@H](CCO)c1c[n]c(I)cc1 Amb25118710 [0,2,0,0,0,0|2,0,0]=4 4785 B12R1.16 N[C@H](CCO)c1ccc(Br)c[n]1 Amb25035262 [0,2,0,0,0,0|2,0,0]=4 4786 B12R1.16 N[C@H](CCO)c1ccc(Br)cc1 Amb19887638 [0,2,0,0,0,0|1,0,0]=3 4787 B12R1.16 N[C@H](CCO)c1ccc(Cl)c[n]1 Amb25859241 [0,2,0,0,0,0|2,0,0]=4 4788 B12R1.16 N[C@H](CCO)c1ccc(Cl)cc1 Amb19887657 [0,2,0,0,0,0|1,0,0]=3 4789 B12R1.16 N[C@H](CCO)c1ccc(F)c[n]1 Amb24587759 [0,2,0,0,0,0|2,0,0]=4 4790 B12R1.16 N[C@H](CCO)c1ccc(F)cc1 Amb19887667 [0,2,0,0,0,0|1,0,0]=3 4791 B12R1.16 N[C@H](CCO)c1ccc(O)cc1 Amb25339383 [0,2,0,0,0,0|1,0,0]=3 4792 B12R1.16 N[C@H](CCO)c1ccc(S)cc1 Amb25824151 [0,2,0,0,0,0|1,0,0]=3 4793 B12R1.16 Nc1ccc([n]c1)[C@H](N)CCO Amb24393367 [0,2,0,0,0,0|2,0,0]=4 4794 B12R1.16 Nc1ccc(c[n]1)[C@@H](N)CCO Amb24657316 [0,2,0,0,0,0|2,0,0]=4 4795 B12R1.16 Nc1ccc(cc1)C(=O)CCN Amb24550545 [0,2,0,0,0,0|2,0,0]=4 4796 B12R1.16 Nc1ccc(cc1)C(N)CCO Amb19887602 [0,2,0,0,0,0|1,0,0]=3 4797 B12R1.16 Nc1ccc(cc1)[C@H](N)CCO Amb19887604 [0,2,0,0,0,0|1,0,0]=3 4798 B12R1.16 O=C(CCCl)c1ccc(I)cc1 Amb24417846 [0,2,0,0,0,0|2,0,0]=4 4799 B12R1.16 O=S(CCCl)c1ccc(F)cc1 Amb24536748 [0,2,0,0,0,0|1,1,0]=4 4800 B12R1.16 OC(CCI)c1ccc(F)cc1 Amb24537939 [0,2,0,0,0,0|2,0,0]=4 4801 B12R1.16 OCCC(=O)c1ccc(Br)cc1 Amb18069914 [0,2,0,0,0,0|1,0,0]=3 4802 B12R1.16 OCCC(=O)c1ccc(Cl)cc1 Amb18564305 [0,2,0,0,0,0|1,0,0]=3 4803 B12R1.16 OCCC(=O)c1ccc(cc1)F Amb1111123 [0,2,0,0,0,0|1,0,0]=3 4804 B12R1.16 OCCC(Cl)c1ccc(Cl)cc1 Amb24752170 [0,2,0,0,0,0|1,0,0]=3 4805 B12R1.16 OCCC(F)c1ccc(F)cc1 Amb25158049 [0,2,0,0,0,0|1,0,0]=3 4806 B12R1.16 OCCC(O)c1ccc(Br)cc1 Amb18070318 [0,2,0,0,0,0|1,0,0]=3 4807 B12R1.16 OCCC(O)c1ccc(Cl)cc1 Amb18066186 [0,2,0,0,0,0|1,0,0]=3 4808 B12R1.16 OCCC(O)c1ccc(F)cc1 Amb18563926 [0,2,0,0,0,0|1,0,0]=3 4809 B12R1.16 OCCC(c1ccc(cc1)Br)C Amb17248426 [0,2,0,0,0,0|1,0,0]=3 4810 B12R1.16 OCCC(c1ccc(cc1)C)C Amb17232490 [0,2,0,0,0,0|1,0,0]=3 4811 B12R1.16 OCCC(c1ccc(cc1)C)N Amb17103955 [0,2,0,0,0,0|1,0,0]=3 4812 B12R1.16 OCCC(c1ccc(cc1)Cl)C Amb17234157 [0,2,0,0,0,0|1,0,0]=3 4813 B12R1.16 OCCC(c1ccc(cc1)Cl)N Amb1993959 [0,2,0,0,0,0|1,0,0]=3 4814 B12R1.16 OCCC(c1ccc(cc1)F)C Amb17232668 [0,2,0,0,0,0|1,0,0]=3 4815 B12R1.16 OCCN(c1ccc(cc1)Br)C Amb17344450 [0,2,0,0,0,0|1,0,0]=3 4816 B12R1.16 OCCN(c1ccc(cc1)C)C Amb17334645 [0,2,0,0,0,0|1,0,0]=3 4817 B12R1.16 OCCN(c1ccc(cc1)Cl)C Amb17335812 [0,2,0,0,0,0|1,0,0]=3 4818 B12R1.16 OCCN(c1ccc(cc1)F)C Amb17334764 [0,2,0,0,0,0|1,0,0]=3 4819 B12R1.16 OCCN(c1ccc(cn1)Br)C Amb17610089 [0,2,0,0,0,0|2,0,0]=4 4820 B12R1.16 OCCN(c1ccc(nc1)Cl)C Amb17562763 [0,2,0,0,0,0|2,0,0]=4 4821 B12R1.16 OCC[C@@H](O)c1ccc(Cl)cc1 Amb24749568 [0,2,0,0,0,0|1,0,0]=3 4822 B12R1.16 OCC[C@@H](O)c1ccc(F)cc1 Amb25070596 [0,2,0,0,0,0|1,0,0]=3 4823 B12R1.16 OCC[C@H](O)c1ccc(Cl)cc1 Amb25129763 [0,2,0,0,0,0|1,0,0]=3 4824 B12R1.16 OCC[C@H](O)c1ccc(F)cc1 Amb24601023 [0,2,0,0,0,0|1,0,0]=3 4825 B12R1.16 OCNC(=S)c1ccc(Cl)cc1 Amb25081413 [0,2,0,0,0,0|2,0,0]=4 4826 B12R1.16 OC\C=C(\F)/c1ccc(Cl)cc1 Amb24569989 [0,2,0,0,0,0|1,0,1]=4 4827 B12R1.16 ONCC(c1ccc(cc1)Br)O Amb17345007 [0,2,0,0,0,0|2,0,0]=4 4828 B12R1.16 ONCC(c1ccc(cc1)C)O Amb17334704 [0,2,0,0,0,0|2,0,0]=4 4829 B12R1.16 ONCC(c1ccc(cc1)Cl)O Amb17335949 [0,2,0,0,0,0|2,0,0]=4 4830 B12R1.16 ONCC(c1ccc(cc1)F)O Amb17334838 [0,2,0,0,0,0|2,0,0]=4 4831 B12R1.16 ONCC(c1ccc(cc1)O)O Amb17334758 [0,2,0,0,0,0|2,0,0]=4 4832 B12R1.16 O[C@@H](CCCl)c1ccc(F)cc1 Amb25073942 [0,2,0,0,0,0|2,0,0]=4 4833 B12R1.16 O[C@H](CCCl)c1ccc(F)cc1 Amb24711502 [0,2,0,0,0,0|2,0,0]=4 4834 B12R1.16 Oc1ccc(cc1)C(=O)CCCl Amb18552996 [0,2,0,0,0,0|2,0,0]=4 4835 B12R1.16 SCCC(=O)c1ccc(cc1)Br Amb17411234 [0,2,0,0,0,0|1,1,0]=4 4836 B12R1.16 SCCC(=O)c1ccc(cc1)C Amb17400836 [0,2,0,0,0,0|1,1,0]=4 4837 B12R1.16 SCCC(=O)c1ccc(cc1)Cl Amb17402391 [0,2,0,0,0,0|1,1,0]=4 4838 B12R1.16 SCCC(=O)c1ccc(cc1)F Amb17401021 [0,2,0,0,0,0|1,1,0]=4 4839 B12R1.21 C=C(Br)COc1ccc(Cl)cc1 Amb25132088 [0,2,0,0,0,0|1,0,1]=4 4840 B12R1.21 C=C(Br)COc1ccc(F)cc1 Amb25078502 [0,2,0,0,0,0|1,0,1]=4 4841 B12R1.21 C=C(Br)COc1ccc(N)cc1 Amb18971535 [0,2,0,0,0,0|1,0,1]=4 4842 B12R1.21 C=C(Cl)COc1ccc(Cl)cc1 Amb24484276 [0,2,0,0,0,0|1,0,1]=4 4843 B12R1.21 C=C(Cl)COc1ccc(F)cc1 Amb25084810 [0,2,0,0,0,0|1,0,1]=4 4844 B12R1.21 C=C(Cl)COc1ccc(N)cc1 Amb18971520 [0,2,0,0,0,0|1,0,1]=4 4845 B12R1.21 C=C(F)COc1ccc(Br)cc1 Amb23570540 [0,2,0,0,0,0|1,0,1]=4 4846 B12R1.21 CC(=C)COc1ccc(Cl)cc1 Amb24367387 [0,2,0,0,0,0|1,0,1]=4 4847 B12R1.21 CC(=C)COc1ccc(cc1)F Amb2444928 [0,2,0,0,0,0|1,0,1]=4 4848 B12R1.21 CC(=C)COc1ccc(cc1)N Amb2081541 [0,2,0,0,0,0|1,0,1]=4 4849 B12R1.21 CC(=O)COc1ccc(O)cc1 Amb18646453 [0,2,0,0,0,0|0,0,2]=4 4850 B12R1.21 CC(=O)COc1ccc(cc1)Br Amb17601394 [0,2,0,0,0,0|0,0,2]=4 4851 B12R1.21 CC(=O)COc1ccc(cc1)Cl Amb1094739 [0,2,0,0,0,0|0,0,2]=4 4852 B12R1.21 CC(=O)COc1ccc(cc1)N Amb17110083 [0,2,0,0,0,0|0,0,2]=4 4853 B12R1.21 CC(Br)CCc1ccc(Br)cc1 Amb25803938 [0,2,0,0,0,0|2,0,0]=4 4854 B12R1.21 CC(Br)CCc1ccc(O)cc1 Amb24532811 [0,2,0,0,0,0|2,0,0]=4 4855 B12R1.21 CC(C)CCc1ccc(S)cc1 Amb19888153 [0,2,0,0,0,0|2,0,0]=4 4856 B12R1.21 CC(C)CNc1ccc(Cl)cc1 Amb20669276 [0,2,0,0,0,0|2,0,0]=4 4857 B12R1.21 CC(C)COc1ccc(Br)[n]c1 Amb25070784 [0,2,0,0,0,0|2,0,0]=4 4858 B12R1.21 CC(C)COc1ccc(Cl)cc1 Amb25667205 [0,2,0,0,0,0|1,0,0]=3 4859 B12R1.21 CC(C)COc1ccc(F)[n]c1 Amb24395753 [0,2,0,0,0,0|2,0,0]=4 4860 B12R1.21 CC(C)COc1ccc(I)cc1 Amb22266147 [0,2,0,0,0,0|1,0,0]=3 4861 B12R1.21 CC(C)COc1ccc(N)cc1 Amb24273093 [0,2,0,0,0,0|1,0,0]=3 4862 B12R1.21 CC(C)CSc1ccc(Cl)cc1 Amb25133783 [0,2,0,0,0,0|1,1,0]=4 4863 B12R1.21 CC(C)CSc1ccc(F)cc1 Amb24760114 [0,2,0,0,0,0|1,1,0]=4 4864 B12R1.21 CC(C)CSc1ccc(O)cc1 Amb18321683 [0,2,0,0,0,0|1,1,0]=4 4865 B12R1.21 CC(C)CSc1ccc(S)cc1 Amb24709264 [0,2,0,0,0,0|1,1,0]=4 4866 B12R1.21 CC(CCc1ccc(cc1)Br)C Amb2226924 [0,2,0,0,0,0|2,0,0]=4 4867 B12R1.21 CC(CCc1ccc(cc1)Cl)O Amb17507284 [0,2,0,0,0,0|1,0,0]=3 4868 B12R1.21 CC(CCc1ccc(cc1)F)O Amb17507285 [0,2,0,0,0,0|1,0,0]=3 4869 B12R1.21 CC(CCc1ccc(cc1)O)O Amb1110722 [0,2,0,0,0,0|1,0,0]=3 4870 B12R1.21 CC(CNc1ccc(cc1)Br)O Amb17142609 [0,2,0,0,0,0|1,0,0]=3 4871 B12R1.21 CC(CNc1ccc(cc1)C)O Amb17138594 [0,2,0,0,0,0|1,0,0]=3 4872 B12R1.21 CC(CNc1ccc(cc1)Cl)O Amb17139127 [0,2,0,0,0,0|1,0,0]=3 4873 B12R1.21 CC(CNc1ccc(cc1)F)O Amb17138651 [0,2,0,0,0,0|1,0,0]=3 4874 B12R1.21 CC(COc1ccc(cc1)Cl)N Amb17224217 [0,2,0,0,0,0|1,0,0]=3 4875 B12R1.21 CC(COc1ccc(cc1)F)N Amb10609780 [0,2,0,0,0,0|1,0,0]=3 4876 B12R1.21 CC(COc1ccc(cc1)F)N Amb1140862 [0,2,0,0,0,0|1,0,0]=3 4877 B12R1.21 CC(COc1ccc(cc1)N)C Amb1124176 [0,2,0,0,0,0|1,0,0]=3 4878 B12R1.21 CC(Cl)CCc1ccc(Br)cc1 Amb25796648 [0,2,0,0,0,0|2,0,0]=4 4879 B12R1.21 CC(Cl)CCc1ccc(Cl)cc1 Amb24488696 [0,2,0,0,0,0|2,0,0]=4 4880 B12R1.21 CC(Cl)CCc1ccc(F)cc1 Amb19076402 [0,2,0,0,0,0|2,0,0]=4 4881 B12R1.21 CC(Cl)CCc1ccc(O)cc1 Amb25715798 [0,2,0,0,0,0|2,0,0]=4 4882 B12R1.21 CC(Cl)CNc1ccc(Cl)cc1 Amb24497324 [0,2,0,0,0,0|2,0,0]=4 4883 B12R1.21 CC(Cl)COc1ccc(O)cc1 Amb25780632 [0,2,0,0,0,0|1,0,0]=3 4884 B12R1.21 CC(Cl)CSc1ccc(F)cc1 Amb25103667 [0,2,0,0,0,0|1,1,0]=4 4885 B12R1.21 CC(F)CCc1ccc(N)cc1 Amb24511306 [0,2,0,0,0,0|2,0,0]=4 4886 B12R1.21 CC(F)COc1ccc(Br)cc1 Amb24079074 [0,2,0,0,0,0|1,0,0]=3 4887 B12R1.21 CC(F)COc1ccc(N)cc1 Amb25247403 [0,2,0,0,0,0|1,0,0]=3 4888 B12R1.21 CC(F)CSc1ccc(N)cc1 Amb24654129 [0,2,0,0,0,0|1,1,0]=4 4889 B12R1.21 CC(N)CCc1ccc(Br)cc1 Amb17991263 [0,2,0,0,0,0|2,0,0]=4 4890 B12R1.21 CC(N)CCc1ccc(Cl)cc1 Amb22461482 [0,2,0,0,0,0|2,0,0]=4 4891 B12R1.21 CC(N)CNc1ccc(F)cc1 Amb25237265 [0,2,0,0,0,0|2,0,0]=4 4892 B12R1.21 CC(N)COc1ccc(Cl)[n]c1 Amb24532541 [0,2,0,0,0,0|2,0,0]=4 4893 B12R1.21 CC(N)COc1ccc(F)[n]c1 Amb25737952 [0,2,0,0,0,0|2,0,0]=4 4894 B12R1.21 CC(N)COc1ccc(I)cc1 Amb25249613 [0,2,0,0,0,0|1,0,0]=3 4895 B12R1.21 CC(N)COc1ccc(O)cc1 Amb22446609 [0,2,0,0,0,0|1,0,0]=3 4896 B12R1.21 CC(N)CSc1ccc(Br)cc1 Amb18576934 [0,2,0,0,0,0|1,1,0]=4 4897 B12R1.21 CC(N)CSc1ccc(Cl)cc1 Amb18066330 [0,2,0,0,0,0|1,1,0]=4 4898 B12R1.21 CC(N)CSc1ccc(Cl)cc1 Amb21988434 [0,2,0,0,0,0|1,1,0]=4 4899 B12R1.21 CC(N)CSc1ccc(F)cc1 Amb18564329 [0,2,0,0,0,0|1,1,0]=4 4900 B12R1.21 CC(N)CSc1ccc(O)cc1 Amb25350095 [0,2,0,0,0,0|1,1,0]=4 4901 B12R1.21 CC(O)C#Cc1ccc(O)cc1 Amb24497071 [0,2,0,0,0,0|1,0,1]=4 4902 B12R1.21 CC(O)CCN1C=CC(=O)C=C1 Amb18788585 [0,2,0,0,0,0|2,0,0]=4 4903 B12R1.21 CC(O)CCc1ccc(Br)cc1 Amb24056590 [0,2,0,0,0,0|1,0,0]=3 4904 B12R1.21 CC(O)CNc1ccc(Br)[n]c1 Amb25078767 [0,2,0,0,0,0|2,0,0]=4 4905 B12R1.21 CC(O)CNc1ccc(F)c[n]1 Amb18291208 [0,2,0,0,0,0|2,0,0]=4 4906 B12R1.21 CC(O)COc1ccc(Br)[n]c1 Amb25816228 [0,2,0,0,0,0|1,0,0]=3 4907 B12R1.21 CC(O)COc1ccc(Cl)[n]c1 Amb25292022 [0,2,0,0,0,0|1,0,0]=3 4908 B12R1.21 CC(O)COc1ccc(Cl)cc1 Amb24064341 [0,2,0,0,0,0|0,0,0]=2 4909 B12R1.21 CC(O)COc1ccc(F)[n]c1 Amb25260687 [0,2,0,0,0,0|1,0,0]=3 4910 B12R1.21 CC(O)COc1ccc(F)cc1 Amb18806455 [0,2,0,0,0,0|0,0,0]=2 4911 B12R1.21 CC(O)COc1ccc(I)cc1 Amb25115077 [0,2,0,0,0,0|0,0,0]=2 4912 B12R1.21 CC(O)COc1ccc(N)cc1 Amb18290039 [0,2,0,0,0,0|0,0,0]=2 4913 B12R1.21 CC(O)CSc1ccc(Br)c[n]1 Amb25751413 [0,2,0,0,0,0|1,1,0]=4 4914 B12R1.21 CC(O)CSc1ccc(Cl)c[n]1 Amb25700678 [0,2,0,0,0,0|1,1,0]=4 4915 B12R1.21 CC(O)CSc1ccc(F)cc1 Amb19058402 [0,2,0,0,0,0|0,1,0]=3 4916 B12R1.21 CC(O)CSc1ccc(N)[n]c1 Amb18289455 [0,2,0,0,0,0|1,1,0]=4 4917 B12R1.21 CC(O)CSc1ccc(N)c[n]1 Amb18969624 [0,2,0,0,0,0|1,1,0]=4 4918 B12R1.21 CC(O)CSc1ccc(N)cc1 Amb18969621 [0,2,0,0,0,0|0,1,0]=3 4919 B12R1.21 CC(O)CSc1ccc(O)cc1 Amb19057513 [0,2,0,0,0,0|0,1,0]=3 4920 B12R1.21 CC(O)\C=C\c1ccc(I)cc1 Amb24493262 [0,2,0,0,0,0|1,0,1]=4 4921 B12R1.21 CS(=O)COc1ccc(Br)cc1 Amb25692440 [0,2,0,0,0,0|1,0,1]=4 4922 B12R1.21 C[C@@H](COc1ccc(cc1)Br)N Amb17248852 [0,2,0,0,0,0|1,0,0]=3 4923 B12R1.21 C[C@@H](COc1ccc(cc1)C)N Amb17232559 [0,2,0,0,0,0|1,0,0]=3 4924 B12R1.21 C[C@@H](COc1ccc(cc1)Cl)N Amb17234272 [0,2,0,0,0,0|1,0,0]=3 4925 B12R1.21 C[C@@H](COc1ccc(cc1)F)N Amb17232708 [0,2,0,0,0,0|1,0,0]=3 4926 B12R1.21 C[C@@H](N)COc1ccc(Br)cc1 Amb18036080 [0,2,0,0,0,0|1,0,0]=3 4927 B12R1.21 C[C@@H](N)COc1ccc(Cl)cc1 Amb18538520 [0,2,0,0,0,0|1,0,0]=3 4928 B12R1.21 C[C@@H](N)CSc1ccc(Cl)cc1 Amb25073658 [0,2,0,0,0,0|1,1,0]=4 4929 B12R1.21 C[C@@H](N)CSc1ccc(F)cc1 Amb25715002 [0,2,0,0,0,0|1,1,0]=4 4930 B12R1.21 C[C@@H](O)CCc1ccc(O)cc1 Amb23604212 [0,2,0,0,0,0|1,0,0]=3 4931 B12R1.21 C[C@@H](O)CNc1ccc(Cl)c[n]1 Amb25742048 [0,2,0,0,0,0|2,0,0]=4 4932 B12R1.21 C[C@@H](O)CNc1ccc(F)c[n]1 Amb25160337 [0,2,0,0,0,0|2,0,0]=4 4933 B12R1.21 C[C@@H](O)CNc1ccc(F)cc1 Amb25719811 [0,2,0,0,0,0|1,0,0]=3 4934 B12R1.21 C[C@@H](O)COc1ccc(F)cc1 Amb22351329 [0,2,0,0,0,0|0,0,0]=2 4935 B12R1.21 C[C@@H](O)COc1ccc(I)cc1 Amb25373827 [0,2,0,0,0,0|0,0,0]=2 4936 B12R1.21 C[C@@H](O)CSc1ccc(Cl)c[n]1 Amb25722457 [0,2,0,0,0,0|1,1,0]=4 4937 B12R1.21 C[C@@H](O)CSc1ccc(Cl)cc1 Amb25179956 [0,2,0,0,0,0|0,1,0]=3 4938 B12R1.21 C[C@@H](O)CSc1ccc(F)cc1 Amb25073680 [0,2,0,0,0,0|0,1,0]=3 4939 B12R1.21 C[C@@H](O)\C=C\c1ccc(Cl)cc1 Amb24497692 [0,2,0,0,0,0|1,0,1]=4 4940 B12R1.21 C[C@H](N)CCc1ccc(Cl)cc1 Amb24702508 [0,2,0,0,0,0|2,0,0]=4 4941 B12R1.21 C[C@H](N)CCc1ccc(F)cc1 Amb24624091 [0,2,0,0,0,0|2,0,0]=4 4942 B12R1.21 C[C@H](N)COc1ccc(F)[n]c1 Amb24355939 [0,2,0,0,0,0|2,0,0]=4 4943 B12R1.21 C[C@H](O)CNc1ccc(Br)cc1 Amb25719810 [0,2,0,0,0,0|1,0,0]=3 4944 B12R1.21 C[C@H](O)COc1ccc(F)cc1 Amb22351296 [0,2,0,0,0,0|0,0,0]=2 4945 B12R1.21 C[C@H](O)COc1ccc(I)cc1 Amb25724275 [0,2,0,0,0,0|0,0,0]=2 4946 B12R1.21 C[C@H](O)CSc1ccc(Br)cc1 Amb24636648 [0,2,0,0,0,0|0,1,0]=3 4947 B12R1.21 C[C@H](O)CSc1ccc(Cl)c[n]1 Amb25246297 [0,2,0,0,0,0|1,1,0]=4 4948 B12R1.21 C[C@H](O)CSc1ccc(F)cc1 Amb24379354 [0,2,0,0,0,0|0,1,0]=3 4949 B12R1.21 C[C@H](O)\C=C\c1ccc(Cl)cc1 Amb25051261 [0,2,0,0,0,0|1,0,1]=4 4950 B12R1.21 C[C@H](O)\C=C\c1ccc(F)cc1 Amb25052234 [0,2,0,0,0,0|1,0,1]=4 4951 B12R1.21 Cc1ccc(CCC(C)Cl)cc1 Amb19074261 [0,2,0,0,0,0|2,0,0]=4 4952 B12R1.21 Cc1ccc(CCC(C)O)cc1 Amb18800837 [0,2,0,0,0,0|1,0,0]=3 4953 B12R1.21 Cc1ccc(NC[C@@H](C)O)[n]c1 Amb24408026 [0,2,0,0,0,0|2,0,0]=4 4954 B12R1.21 Cc1ccc(NC[C@H](C)O)[n]c1 Amb25297162 [0,2,0,0,0,0|2,0,0]=4 4955 B12R1.21 Cc1ccc([n]c1)OCC(O)=O Amb24359369 [0,2,0,0,0,0|1,0,1]=4 4956 B12R1.21 Cc1ccc(\C=C\C(C)O)cc1 Amb24707156 [0,2,0,0,0,0|1,0,1]=4 4957 B12R1.21 Cc1ccc(\C=C\[C@@H](C)O)cc1 Amb25119983 [0,2,0,0,0,0|1,0,1]=4 4958 B12R1.21 Cc1ccc(c[n]1)OCC(F)F Amb25160278 [0,2,0,0,0,0|2,0,0]=4 4959 B12R1.21 Cc1ccc(c[n]1)OCC(O)=O Amb18991754 [0,2,0,0,0,0|1,0,1]=4 4960 B12R1.21 Cc1ccc(cc1)NCC(C)N Amb22410806 [0,2,0,0,0,0|2,0,0]=4 4961 B12R1.21 Cc1ccc(cc1)NCC(C)S Amb24365983 [0,2,0,0,0,0|1,1,0]=4 4962 B12R1.21 Cc1ccc(cc1)NC[C@@H](C)O Amb24626471 [0,2,0,0,0,0|1,0,0]=3 4963 B12R1.21 Cc1ccc(cc1)OCC(C)C Amb25118479 [0,2,0,0,0,0|1,0,0]=3 4964 B12R1.21 Cc1ccc(cc1)OCC(C)O Amb18182640 [0,2,0,0,0,0|0,0,0]=2 4965 B12R1.21 Cc1ccc(cc1)OCC(O)O Amb24588428 [0,2,0,0,0,0|0,0,0]=2 4966 B12R1.21 Cc1ccc(cc1)OC[C@@H](C)N Amb18538493 [0,2,0,0,0,0|1,0,0]=3 4967 B12R1.21 Cc1ccc(cc1)SCC(C)N Amb18564186 [0,2,0,0,0,0|1,1,0]=4 4968 B12R1.21 Cc1ccc(cc1)SCC(C)N Amb21988435 [0,2,0,0,0,0|1,1,0]=4 4969 B12R1.21 Cc1ccc(cc1)SCC(C)O Amb19054498 [0,2,0,0,0,0|0,1,0]=3 4970 B12R1.21 Cc1ccc(cc1)SCC(F)F Amb25270900 [0,2,0,0,0,0|1,1,0]=4 4971 B12R1.21 ClC(=O)COc1ccc(cc1)Br Amb16186415 [0,2,0,0,0,0|0,0,2]=4 4972 B12R1.21 ClC(=O)COc1ccc(cc1)C Amb10880011 [0,2,0,0,0,0|0,0,2]=4 4973 B12R1.21 Clc1ccc(cc1)SCC(Cl)Cl Amb24632965 [0,2,0,0,0,0|1,1,0]=4 4974 B12R1.21 FC(CNc1ccc(cc1)C)F Amb16229928 [0,2,0,0,0,0|2,0,0]=4 4975 B12R1.21 FC(F)CNc1ccc(Cl)cc1 Amb18320422 [0,2,0,0,0,0|2,0,0]=4 4976 B12R1.21 FC(F)COc1ccc(Br)cc1 Amb22008305 [0,2,0,0,0,0|1,0,0]=3 4977 B12R1.21 FC(F)COc1ccc(I)cc1 Amb24056924 [0,2,0,0,0,0|1,0,0]=3 4978 B12R1.21 Fc1ccc(cc1)NCC(F)F Amb18795535 [0,2,0,0,0,0|2,0,0]=4 4979 B12R1.21 N=C(COc1ccc(cc1)F)[NH3+] Amb2434228 [0,2,0,0,0,0|1,0,1]=4 4980 B12R1.21 NC(=N)COc1ccc(F)cc1 Amb19894602 [0,2,0,0,0,0|1,0,1]=4 4981 B12R1.21 NC(=O)COc1ccc(cc1)F Amb2456996 [0,2,0,0,0,0|0,0,2]=4 4982 B12R1.21 NC(=O)COc1ccc(cc1)I Amb173371 [0,2,0,0,0,0|0,0,2]=4 4983 B12R1.21 NC(=S)COc1ccc(cc1)F Amb1106123 [0,2,0,0,0,0|0,1,1]=4 4984 B12R1.21 Nc1ccc([n]c1)OCC(F)F Amb22280516 [0,2,0,0,0,0|2,0,0]=4 4985 B12R1.21 Nc1ccc(cc1)NCC(O)=O Amb18296058 [0,2,0,0,0,0|1,0,1]=4 4986 B12R1.21 Nc1ccc(cc1)NCS(O)=O Amb25732370 [0,2,0,0,0,0|2,0,0]=4 4987 B12R1.21 Nc1ccc(cc1)OCC(F)F Amb22280478 [0,2,0,0,0,0|1,0,0]=3 4988 B12R1.21 Nc1ccc(cc1)OCC(N)=S Amb25821999 [0,2,0,0,0,0|0,1,1]=4 4989 B12R1.21 Nc1ccc(cc1)OCC(O)=O Amb22751390 [0,2,0,0,0,0|0,0,1]=3 4990 B12R1.21 Nc1ccc(cc1)SCC(F)F Amb19060393 [0,2,0,0,0,0|1,1,0]=4 4991 B12R1.21 OB(O)CCc1ccc(Cl)cc1 Amb25667152 [0,2,0,0,0,0|2,0,0]=4 4992 B12R1.21 OB(O)CCc1ccc(F)cc1 Amb25149900 [0,2,0,0,0,0|2,0,0]=4 4993 B12R1.21 OC(=O)CCc1ccc(cc1)Br Amb1220330 [0,2,0,0,0,0|1,0,1]=4 4994 B12R1.21 OC(=O)CCc1ccc(cc1)C Amb1225383 [0,2,0,0,0,0|1,0,1]=4 4995 B12R1.21 OC(=O)CCc1ccc(cc1)Cl Amb1093991 [0,2,0,0,0,0|1,0,1]=4 4996 B12R1.21 OC(=O)CCc1ccc(cc1)F Amb1214879 [0,2,0,0,0,0|1,0,1]=4 4997 B12R1.21 OC(=O)CNc1ccc(cc1)Br Amb1981434 [0,2,0,0,0,0|1,0,1]=4 4998 B12R1.21 OC(=O)CNc1ccc(cc1)C Amb1106469 [0,2,0,0,0,0|1,0,1]=4 4999 B12R1.21 OC(=O)CNc1ccc(cc1)Cl Amb1486152 [0,2,0,0,0,0|1,0,1]=4 5000 B12R1.21 OC(=O)CNc1ccc(cc1)O Amb1950558 [0,2,0,0,0,0|1,0,1]=4 5001 B12R1.21 OC(=O)CON1C=CC(=O)C=C1 Amb18647100 [0,2,0,0,0,0|1,0,1]=4 5002 B12R1.21 OC(=O)COc1ccc(F)c[n]1 Amb24748685 [0,2,0,0,0,0|1,0,1]=4 5003 B12R1.21 OC(=O)COc1ccc(cc1)Cl Amb1830178 [0,2,0,0,0,0|0,0,1]=3 5004 B12R1.21 OC(=O)COc1ccc(cc1)F Amb1210357 [0,2,0,0,0,0|0,0,1]=3 5005 B12R1.21 OC(=O)COc1ccc(cc1)I Amb1152251 [0,2,0,0,0,0|0,0,1]=3 5006 B12R1.21 OC(=O)COc1ccc(cc1)N Amb1034889 [0,2,0,0,0,0|0,0,1]=3 5007 B12R1.21 OC(=O)CSc1ccc(S)cc1 Amb24341890 [0,2,0,0,0,0|0,1,1]=4 5008 B12R1.21 OC(=O)CSc1ccc(cc1)Br Amb1208368 [0,2,0,0,0,0|0,1,1]=4 5009 B12R1.21 OC(=O)CSc1ccc(cc1)C Amb1197696 [0,2,0,0,0,0|0,1,1]=4 5010 B12R1.21 OC(=O)CSc1ccc(cc1)F Amb1209262 [0,2,0,0,0,0|0,1,1]=4 5011 B12R1.21 Oc1ccc(CCC(F)F)cc1 Amb25247374 [0,2,0,0,0,0|2,0,0]=4 5012 B12R1.21 Oc1ccc(cc1)NCC(F)F Amb22008480 [0,2,0,0,0,0|2,0,0]=4 5013 B12R1.21 Oc1ccc(cc1)OCC(=O)Cl Amb24467045 [0,2,0,0,0,0|0,0,2]=4 5014 B12R1.21 Oc1ccc(cc1)OCC(F)F Amb18795190 [0,2,0,0,0,0|1,0,0]=3 5015 B12R1.21 Oc1ccc(cc1)OCC(O)O Amb24466979 [0,2,0,0,0,0|0,0,0]=2 5016 B12R1.21 Oc1ccc(cc1)SCC(F)F Amb18324326 [0,2,0,0,0,0|1,1,0]=4 5017 B12R1.21 Oc1ccc(cc1)SCC(O)=O Amb18291566 [0,2,0,0,0,0|0,1,1]=4 5018 B12R1.49 BrCC(Oc1ccc(cc1)Br)C Amb17291822 [0,2,0,0,0,0|1,0,0]=3 5019 B12R1.49 BrCC(Oc1ccc(cc1)C)C Amb17248433 [0,2,0,0,0,0|1,0,0]=3 5020 B12R1.49 BrCC(Oc1ccc(cc1)Cl)C Amb17261131 [0,2,0,0,0,0|1,0,0]=3 5021 B12R1.49 BrCC(Oc1ccc(cc1)F)C Amb17250551 [0,2,0,0,0,0|1,0,0]=3 5022 B12R1.49 C=C(CCl)Oc1ccc(Cl)cc1 Amb24441008 [0,2,0,0,0,0|1,0,1]=4 5023 B12R1.49 CC(C#C)Oc1ccc(N)cc1 Amb24379533 [0,2,0,0,0,0|1,0,1]=4 5024 B12R1.49 CC(C#N)Oc1ccc(N)cc1 Amb18283545 [0,2,0,0,0,0|1,0,1]=4 5025 B12R1.49 CC(C#N)Oc1ccc(O)cc1 Amb18798180 [0,2,0,0,0,0|1,0,1]=4 5026 B12R1.49 CC(C=C)Oc1ccc(Cl)cc1 Amb24484184 [0,2,0,0,0,0|1,0,1]=4 5027 B12R1.49 CC(C=C)Oc1ccc(I)cc1 Amb25137309 [0,2,0,0,0,0|1,0,1]=4 5028 B12R1.49 CC(C=C)Oc1ccc(N)cc1 Amb18990276 [0,2,0,0,0,0|1,0,1]=4 5029 B12R1.49 CC(C=C)Oc1ccc(O)cc1 Amb18798279 [0,2,0,0,0,0|1,0,1]=4 5030 B12R1.49 CC(CC)Oc1ccc(N)[n]c1 Amb18969750 [0,2,0,0,0,0|2,0,0]=4 5031 B12R1.49 CC(CN)Cc1ccc(Br)cc1 Amb18992228 [0,2,0,0,0,0|2,0,0]=4 5032 B12R1.49 CC(CN)Cc1ccc(I)cc1 Amb25054279 [0,2,0,0,0,0|2,0,0]=4 5033 B12R1.49 CC(CN)Cc1ccc(O)cc1 Amb25738797 [0,2,0,0,0,0|2,0,0]=4 5034 B12R1.49 CC(CN)Nc1ccc(Cl)cc1 Amb18909433 [0,2,0,0,0,0|2,0,0]=4 5035 B12R1.49 CC(CN)Nc1ccc(F)cc1 Amb18908738 [0,2,0,0,0,0|2,0,0]=4 5036 B12R1.49 CC(CN)Oc1ccc(I)cc1 Amb25035111 [0,2,0,0,0,0|1,0,0]=3 5037 B12R1.49 CC(CN)Oc1ccc(O)cc1 Amb24664519 [0,2,0,0,0,0|1,0,0]=3 5038 B12R1.49 CC(CN)Sc1ccc(Br)cc1 Amb18992812 [0,2,0,0,0,0|1,1,0]=4 5039 B12R1.49 CC(CN)Sc1ccc(Br)cc1 Amb19350751 [0,2,0,0,0,0|1,1,0]=4 5040 B12R1.49 CC(CN)Sc1ccc(F)cc1 Amb18992823 [0,2,0,0,0,0|1,1,0]=4 5041 B12R1.49 CC(CN)Sc1ccc(N)cc1 Amb18909305 [0,2,0,0,0,0|1,1,0]=4 5042 B12R1.49 CC(CN)Sc1ccc(O)cc1 Amb18909348 [0,2,0,0,0,0|1,1,0]=4 5043 B12R1.49 CC(CO)Cc1ccc(Br)c[n]1 Amb24688461 [0,2,0,0,0,0|2,0,0]=4 5044 B12R1.49 CC(CO)Cc1ccc(Cl)[n]c1 Amb24353075 [0,2,0,0,0,0|2,0,0]=4 5045 B12R1.49 CC(CO)Cc1ccc(I)cc1 Amb25711706 [0,2,0,0,0,0|1,0,0]=3 5046 B12R1.49 CC(CO)Nc1ccc(Br)cc1 Amb18290179 [0,2,0,0,0,0|1,0,0]=3 5047 B12R1.49 CC(CO)Nc1ccc(Cl)cc1 Amb18290161 [0,2,0,0,0,0|1,0,0]=3 5048 B12R1.49 CC(CO)Nc1ccc(F)c[n]1 Amb18291209 [0,2,0,0,0,0|2,0,0]=4 5049 B12R1.49 CC(CO)Nc1ccc(F)cc1 Amb18290165 [0,2,0,0,0,0|1,0,0]=3 5050 B12R1.49 CC(CO)Nc1ccc(I)cc1 Amb24493605 [0,2,0,0,0,0|1,0,0]=3 5051 B12R1.49 CC(CO)Oc1ccc(I)cc1 Amb24379893 [0,2,0,0,0,0|0,0,0]=2 5052 B12R1.49 CC(CO)Sc1ccc(Br)cc1 Amb23449854 [0,2,0,0,0,0|0,1,0]=3 5053 B12R1.49 CC(CO)Sc1ccc(N)[n]c1 Amb25705394 [0,2,0,0,0,0|1,1,0]=4 5054 B12R1.49 CC(Cc1ccc(Br)cc1)CBr Amb25366059 [0,2,0,0,0,0|2,0,0]=4 5055 B12R1.49 CC(Cc1ccc(F)cc1)CBr Amb25115291 [0,2,0,0,0,0|2,0,0]=4 5056 B12R1.49 CC(Cc1ccc(O)cc1)CO Amb25770294 [0,2,0,0,0,0|1,0,0]=3 5057 B12R1.49 CCC(=O)Oc1ccc(I)cc1 Amb24430745 [0,2,0,0,0,0|1,0,1]=4 5058 B12R1.49 CCC(=O)Oc1ccc(N)cc1 Amb18646257 [0,2,0,0,0,0|1,0,1]=4 5059 B12R1.49 CCC(=O)Oc1ccc(O)cc1 Amb18646456 [0,2,0,0,0,0|1,0,1]=4 5060 B12R1.49 CCC(Br)Cc1ccc(Br)cc1 Amb18049412 [0,2,0,0,0,0|2,0,0]=4 5061 B12R1.49 CCC(C)Cc1ccc(N)cc1 Amb25798952 [0,2,0,0,0,0|2,0,0]=4 5062 B12R1.49 CCC(C)Oc1ccc(F)cc1 Amb24568831 [0,2,0,0,0,0|1,0,0]=3 5063 B12R1.49 CCC(C)Sc1ccc(Cl)cc1 Amb25284129 [0,2,0,0,0,0|1,1,0]=4 5064 B12R1.49 CCC(C)Sc1ccc(O)cc1 Amb18321724 [0,2,0,0,0,0|1,1,0]=4 5065 B12R1.49 CCC(Cc1ccc(cc1)Br)Cl Amb17477596 [0,2,0,0,0,0|2,0,0]=4 5066 B12R1.49 CCC(Cc1ccc(cc1)Br)O Amb17477579 [0,2,0,0,0,0|2,0,0]=4 5067 B12R1.49 CCC(Cc1ccc(cc1)C)Cl Amb17477426 [0,2,0,0,0,0|2,0,0]=4 5068 B12R1.49 CCC(Cc1ccc(cc1)C)O Amb17138583 [0,2,0,0,0,0|2,0,0]=4 5069 B12R1.49 CCC(Cc1ccc(cc1)Cl)Cl Amb17477604 [0,2,0,0,0,0|2,0,0]=4 5070 B12R1.49 CCC(Cc1ccc(cc1)Cl)O Amb17139103 [0,2,0,0,0,0|2,0,0]=4 5071 B12R1.49 CCC(Cc1ccc(cc1)F)Cl Amb17477606 [0,2,0,0,0,0|2,0,0]=4 5072 B12R1.49 CCC(Cc1ccc(cc1)F)O Amb17138637 [0,2,0,0,0,0|2,0,0]=4 5073 B12R1.49 CCC(Cl)Cc1ccc(I)cc1 Amb25157799 [0,2,0,0,0,0|2,0,0]=4 5074 B12R1.49 CCC(N)Cc1ccc(Cl)cc1 Amb19374189 [0,2,0,0,0,0|2,0,0]=4 5075 B12R1.49 CCC(N)Cc1ccc(I)cc1 Amb24711014 [0,2,0,0,0,0|2,0,0]=4 5076 B12R1.49 CCC(N)Cc1ccc(N)cc1 Amb24738382 [0,2,0,0,0,0|2,0,0]=4 5077 B12R1.49 CCC(O)Nc1ccc(N)cc1 Amb25774074 [0,2,0,0,0,0|2,0,0]=4 5078 B12R1.49 CCC(Oc1ccc(cc1)N)C Amb2189169 [0,2,0,0,0,0|1,0,0]=3 5079 B12R1.49 CCC(Oc1ccc(cn1)N)C Amb17093693 [0,2,0,0,0,0|2,0,0]=4 5080 B12R1.49 CC[C@@H](C)Oc1ccc(N)cc1 Amb24103201 [0,2,0,0,0,0|1,0,0]=3 5081 B12R1.49 CC[C@@H](N)Cc1ccc(Cl)cc1 Amb24357569 [0,2,0,0,0,0|2,0,0]=4 5082 B12R1.49 CC[C@H](N)Cc1ccc(Cl)cc1 Amb25313710 [0,2,0,0,0,0|2,0,0]=4 5083 B12R1.49 C[C@@H](CN)Oc1ccc(Cl)cc1 Amb24701895 [0,2,0,0,0,0|1,0,0]=3 5084 B12R1.49 C[C@@H](CO)Cc1ccc(Cl)cc1 Amb25847856 [0,2,0,0,0,0|1,0,0]=3 5085 B12R1.49 C[C@@H](CO)Nc1ccc(Br)c[n]1 Amb25369644 [0,2,0,0,0,0|2,0,0]=4 5086 B12R1.49 C[C@@H](CO)Nc1ccc(Cl)c[n]1 Amb24723455 [0,2,0,0,0,0|2,0,0]=4 5087 B12R1.49 C[C@@H](CO)Oc1ccc(Cl)cc1 Amb25179930 [0,2,0,0,0,0|0,0,0]=2 5088 B12R1.49 C[C@@H](CO)Oc1ccc(F)cc1 Amb24497746 [0,2,0,0,0,0|0,0,0]=2 5089 B12R1.49 C[C@@H](Cc1ccc(O)cc1)CO Amb24647774 [0,2,0,0,0,0|1,0,0]=3 5090 B12R1.49 C[C@H](CN)Oc1ccc(Cl)cc1 Amb25697013 [0,2,0,0,0,0|1,0,0]=3 5091 B12R1.49 C[C@H](CO)Cc1ccc(F)cc1 Amb24387764 [0,2,0,0,0,0|1,0,0]=3 5092 B12R1.49 C[C@H](CO)Oc1ccc(Cl)cc1 Amb25831906 [0,2,0,0,0,0|0,0,0]=2 5093 B12R1.49 C[C@H](Cc1ccc(O)cc1)CO Amb25371827 [0,2,0,0,0,0|1,0,0]=3 5094 B12R1.49 C\C(\CO)=C\c1ccc(N)cc1 Amb24536329 [0,2,0,0,0,0|1,0,1]=4 5095 B12R1.49 Cc1ccc(CC(=O)CO)cc1 Amb18563613 [0,2,0,0,0,0|1,0,1]=4 5096 B12R1.49 Cc1ccc(CC(Br)CC)cc1 Amb24399086 [0,2,0,0,0,0|2,0,0]=4 5097 B12R1.49 Cc1ccc(CC(C)CBr)cc1 Amb25152481 [0,2,0,0,0,0|2,0,0]=4 5098 B12R1.49 Cc1ccc(CC(C)CC)cc1 Amb25241788 [0,2,0,0,0,0|2,0,0]=4 5099 B12R1.49 Cc1ccc(CC(C)CCl)cc1 Amb24390124 [0,2,0,0,0,0|2,0,0]=4 5100 B12R1.49 Cc1ccc(CC(C)CO)cc1 Amb24354502 [0,2,0,0,0,0|1,0,0]=3 5101 B12R1.49 Cc1ccc(CC(Cl)CCl)cc1 Amb24459787 [0,2,0,0,0,0|2,0,0]=4 5102 B12R1.49 Cc1ccc(CC(Cl)CN)cc1 Amb24443143 [0,2,0,0,0,0|2,0,0]=4 5103 B12R1.49 Cc1ccc(CC(N)CF)cc1 Amb24564243 [0,2,0,0,0,0|2,0,0]=4 5104 B12R1.49 Cc1ccc(C[C@@H](C)CO)cc1 Amb25687834 [0,2,0,0,0,0|1,0,0]=3 5105 B12R1.49 Cc1ccc(C[C@H](C)CO)cc1 Amb25221031 [0,2,0,0,0,0|1,0,0]=3 5106 B12R1.49 Cc1ccc(C[C@H](N)CO)cc1 Amb25257357 [0,2,0,0,0,0|1,0,0]=3 5107 B12R1.49 Cc1ccc(N[C@@H](C)CO)[n]c1 Amb25821290 [0,2,0,0,0,0|2,0,0]=4 5108 B12R1.49 Cc1ccc(\C=C(\C)/CO)cc1 Amb24649471 [0,2,0,0,0,0|1,0,1]=4 5109 B12R1.49 Cc1ccc(c[n]1)OC(C)CN Amb18992841 [0,2,0,0,0,0|2,0,0]=4 5110 B12R1.49 Cc1ccc(cc1)NC(C)CN Amb18646166 [0,2,0,0,0,0|2,0,0]=4 5111 B12R1.49 Cc1ccc(cc1)NC(C)CO Amb18971798 [0,2,0,0,0,0|1,0,0]=3 5112 B12R1.49 Cc1ccc(cc1)N[C@@H](C)CC Amb24635875 [0,2,0,0,0,0|2,0,0]=4 5113 B12R1.49 Cc1ccc(cc1)OC(=O)CN Amb19115308 [0,2,0,0,0,0|1,0,1]=4 5114 B12R1.49 Cc1ccc(cc1)OC(=O)CO Amb25829911 [0,2,0,0,0,0|0,0,1]=3 5115 B12R1.49 Cc1ccc(cc1)OC(C)C=C Amb24484185 [0,2,0,0,0,0|1,0,1]=4 5116 B12R1.49 Cc1ccc(cc1)SC(C)CO Amb24387756 [0,2,0,0,0,0|0,1,0]=3 5117 B12R1.49 Cc1ccc(cc1)SC(O)CC Amb22228345 [0,2,0,0,0,0|1,1,0]=4 5118 B12R1.49 Cc1ccc(cc1)S[C@@H](C)CO Amb24733445 [0,2,0,0,0,0|0,1,0]=3 5119 B12R1.49 Cc1ccc(cc1)S[C@H](C)CO Amb24719675 [0,2,0,0,0,0|0,1,0]=3 5120 B12R1.49 ClCC(Oc1ccc(cc1)Br)C Amb17261134 [0,2,0,0,0,0|1,0,0]=3 5121 B12R1.49 ClCC(Oc1ccc(cc1)C)C Amb17234170 [0,2,0,0,0,0|1,0,0]=3 5122 B12R1.49 ClCC(Oc1ccc(cc1)Cl)C Amb17238291 [0,2,0,0,0,0|1,0,0]=3 5123 B12R1.49 ClCC(Oc1ccc(cc1)F)C Amb17234615 [0,2,0,0,0,0|1,0,0]=3 5124 B12R1.49 NC(CF)Cc1ccc(Cl)cc1 Amb24080995 [0,2,0,0,0,0|2,0,0]=4 5125 B12R1.49 NC(CO)CC=1C=CC(=O)NC1 Amb24413449 [0,2,0,0,0,0|2,0,0]=4 5126 B12R1.49 NC(CO)Cc1ccc(Br)[n]c1 Amb25200151 [0,2,0,0,0,0|2,0,0]=4 5127 B12R1.49 NC(CO)Cc1ccc(I)cc1 Amb25140389 [0,2,0,0,0,0|1,0,0]=3 5128 B12R1.49 NC(Cc1ccc(O)cc1)CF Amb25276877 [0,2,0,0,0,0|2,0,0]=4 5129 B12R1.49 NCC(=O)Oc1ccc(cc1)Br Amb17344448 [0,2,0,0,0,0|1,0,1]=4 5130 B12R1.49 NCC(=O)Oc1ccc(cc1)C Amb17334636 [0,2,0,0,0,0|1,0,1]=4 5131 B12R1.49 NCC(=O)Oc1ccc(cc1)Cl Amb17335805 [0,2,0,0,0,0|1,0,1]=4 5132 B12R1.49 NCC(=O)Oc1ccc(cc1)F Amb17334754 [0,2,0,0,0,0|1,0,1]=4 5133 B12R1.49 NCC(Cc1ccc(cc1)Br)O Amb17248849 [0,2,0,0,0,0|2,0,0]=4 5134 B12R1.49 NCC(Cc1ccc(cc1)C)O Amb17232550 [0,2,0,0,0,0|2,0,0]=4 5135 B12R1.49 NCC(Cc1ccc(cc1)Cl)O Amb17234269 [0,2,0,0,0,0|2,0,0]=4 5136 B12R1.49 NCC(Cc1ccc(cc1)F)O Amb17232703 [0,2,0,0,0,0|2,0,0]=4 5137 B12R1.49 NCC(N)Cc1ccc(Br)cc1 Amb25280308 [0,2,0,0,0,0|2,0,0]=4 5138 B12R1.49 NCC(N)Cc1ccc(Cl)cc1 Amb18649050 [0,2,0,0,0,0|2,0,0]=4 5139 B12R1.49 NCC(N)Cc1ccc(F)cc1 Amb25245193 [0,2,0,0,0,0|2,0,0]=4 5140 B12R1.49 NCC(Nc1ccc(cc1)Br)C Amb17226676 [0,2,0,0,0,0|2,0,0]=4 5141 B12R1.49 NCC(Oc1ccc(cc1)F)C Amb2089060 [0,2,0,0,0,0|1,0,0]=3 5142 B12R1.49 NCC(Sc1ccc(cc1)C)C Amb17485974 [0,2,0,0,0,0|1,1,0]=4 5143 B12R1.49 NCC(Sc1ccc(cc1)Cl)C Amb17485977 [0,2,0,0,0,0|1,1,0]=4 5144 B12R1.49 NC[C@H](N)Cc1ccc(F)cc1 Amb25686081 [0,2,0,0,0,0|2,0,0]=4 5145 B12R1.49 N[C@@H](CO)Cc1ccc(Cl)cc1 Amb22225388 [0,2,0,0,0,0|1,0,0]=3 5146 B12R1.49 N[C@@H](CO)Cc1ccc(Cl)cc1 Amb22747948 [0,2,0,0,0,0|1,0,0]=3 5147 B12R1.49 N[C@@H](CO)Cc1ccc(F)cc1 Amb22746377 [0,2,0,0,0,0|1,0,0]=3 5148 B12R1.49 N[C@@H](CO)Cc1ccc(I)cc1 Amb20242327 [0,2,0,0,0,0|1,0,0]=3 5149 B12R1.49 N[C@H](CO)Cc1ccc(Br)cc1 Amb24453435 [0,2,0,0,0,0|1,0,0]=3 5150 B12R1.49 N[C@H](CO)Cc1ccc(Cl)cc1 Amb19943950 [0,2,0,0,0,0|1,0,0]=3 5151 B12R1.49 N[C@H](CO)Cc1ccc(Cl)cc1 Amb22233150 [0,2,0,0,0,0|1,0,0]=3 5152 B12R1.49 N[C@H](CO)Cc1ccc(F)cc1 Amb22233151 [0,2,0,0,0,0|1,0,0]=3 5153 B12R1.49 N[C@H](CO)Cc1ccc(I)cc1 Amb25200273 [0,2,0,0,0,0|1,0,0]=3 5154 B12R1.49 Nc1ccc(C[C@H](N)CO)cc1 Amb22233152 [0,2,0,0,0,0|1,0,0]=3 5155 B12R1.49 Nc1ccc(cc1)OC(=O)CO Amb24730945 [0,2,0,0,0,0|0,0,1]=3 5156 B12R1.49 O=C(CBr)Oc1ccc(Br)cc1 Amb25246512 [0,2,0,0,0,0|1,0,1]=4 5157 B12R1.49 O=C(CCl)Oc1ccc(Br)cc1 Amb22411419 [0,2,0,0,0,0|1,0,1]=4 5158 B12R1.49 O=C(CCl)Oc1ccc(F)cc1 Amb25295534 [0,2,0,0,0,0|1,0,1]=4 5159 B12R1.49 OC(CF)Sc1ccc(F)cc1 Amb24090066 [0,2,0,0,0,0|1,1,0]=4 5160 B12R1.49 OC(Cc1ccc(F)cc1)CCl Amb24410753 [0,2,0,0,0,0|2,0,0]=4 5161 B12R1.49 OCC(=O)Cc1ccc(Br)cc1 Amb18069830 [0,2,0,0,0,0|1,0,1]=4 5162 B12R1.49 OCC(=O)Cc1ccc(Cl)cc1 Amb18564300 [0,2,0,0,0,0|1,0,1]=4 5163 B12R1.49 OCC(=O)Cc1ccc(F)cc1 Amb18805789 [0,2,0,0,0,0|1,0,1]=4 5164 B12R1.49 OCC(=O)Nc1ccc(cc1)Br Amb1111396 [0,2,0,0,0,0|1,0,1]=4 5165 B12R1.49 OCC(=O)Nc1ccc(cc1)C Amb1109727 [0,2,0,0,0,0|1,0,1]=4 5166 B12R1.49 OCC(=O)Nc1ccc(cc1)Cl Amb1111272 [0,2,0,0,0,0|1,0,1]=4 5167 B12R1.49 OCC(=O)Nc1ccc(cc1)F Amb1110979 [0,2,0,0,0,0|1,0,1]=4 5168 B12R1.49 OCC(=O)Nc1ccc(cc1)I Amb1110138 [0,2,0,0,0,0|1,0,1]=4 5169 B12R1.49 OCC(Cc1ccc(cc1)Br)N Amb17062713 [0,2,0,0,0,0|1,0,0]=3 5170 B12R1.49 OCC(Cc1ccc(cc1)C)N Amb17062687 [0,2,0,0,0,0|1,0,0]=3 5171 B12R1.49 OCC(Cc1ccc(cc1)F)N Amb17062689 [0,2,0,0,0,0|1,0,0]=3 5172 B12R1.49 OCC(Cc1ccc(cc1)O)N Amb17062710 [0,2,0,0,0,0|1,0,0]=3 5173 B12R1.49 OCC(F)Cc1ccc(Cl)cc1 Amb25741479 [0,2,0,0,0,0|1,0,0]=3 5174 B12R1.49 OCC(O)Cc1ccc(Cl)c[n]1 Amb24475111 [0,2,0,0,0,0|2,0,0]=4 5175 B12R1.49 OCC(Oc1ccc(cc1)Br)C Amb17249278 [0,2,0,0,0,0|0,0,0]=2 5176 B12R1.49 OCC(Oc1ccc(cc1)C)C Amb17232602 [0,2,0,0,0,0|0,0,0]=2 5177 B12R1.49 OCC(Oc1ccc(cc1)Cl)C Amb17234358 [0,2,0,0,0,0|0,0,0]=2 5178 B12R1.49 OCC(Oc1ccc(cc1)F)C Amb17232741 [0,2,0,0,0,0|0,0,0]=2 5179 B12R1.49 OC[C@H](Cc1ccc(cc1)O)N Amb1157858 [0,2,0,0,0,0|1,0,0]=3 5180 B12R1.49 OC[C@H](F)Cc1ccc(F)cc1 Amb24749775 [0,2,0,0,0,0|1,0,0]=3 5181 B12R1.49 Oc1ccc(CC(O)CO)cc1 Amb25092907 [0,2,0,0,0,0|1,0,0]=3 5182 B12R1.49 Oc1ccc(C[C@H](O)CO)cc1 Amb24497177 [0,2,0,0,0,0|1,0,0]=3 5183 B12R1.49 Oc1ccc(cc1)OC(=O)CCl Amb22232555 [0,2,0,0,0,0|1,0,1]=4 5184 B12R1.69 BrCCOc1ccc(Br)cc1Br Amb22728681 [0,2,0,0,0,0|1,0,0]=3 5185 B12R1.69 BrCCOc1ccc(cc1Br)Cl Amb1154146 [0,2,0,0,0,0|1,0,0]=3 5186 B12R1.69 BrCCOc1ccc(cc1Cl)C Amb10608618 [0,2,0,0,0,0|1,0,0]=3 5187 B12R1.69 BrCCOc1ccc(cc1Cl)Cl Amb1152303 [0,2,0,0,0,0|1,0,0]=3 5188 B12R1.69 BrCCOc1ccc(cc1Cl)F Amb17263583 [0,2,0,0,0,0|1,0,0]=3 5189 B12R1.69 Brc1ccc(CCCBr)c(I)c1 Amb25248923 [0,2,0,0,0,0|2,0,0]=4 5190 B12R1.69 C#CCOc1ccc(Br)cc1Br Amb25357835 [0,2,0,0,0,0|1,0,1]=4 5191 B12R1.69 C#CCOc1ccc(Cl)cc1F Amb25757750 [0,2,0,0,0,0|1,0,1]=4 5192 B12R1.69 C#CCOc1ccc(Cl)cc1N Amb18809679 [0,2,0,0,0,0|1,0,1]=4 5193 B12R1.69 C#CCOc1ccc(F)cc1Cl Amb19075141 [0,2,0,0,0,0|1,0,1]=4 5194 B12R1.69 C#CCOc1ccc(F)cc1F Amb18788731 [0,2,0,0,0,0|1,0,1]=4 5195 B12R1.69 C#CCOc1ccc(F)cc1N Amb18286191 [0,2,0,0,0,0|1,0,1]=4 5196 B12R1.69 C#CCOc1ccc(F)cc1N Amb19375014 [0,2,0,0,0,0|1,0,1]=4 5197 B12R1.69 C#CCOc1ccc(N)cc1Cl Amb18809680 [0,2,0,0,0,0|1,0,1]=4 5198 B12R1.69 C#CCOc1ccc(N)cc1F Amb18961872 [0,2,0,0,0,0|1,0,1]=4 5199 B12R1.69 C=CCOc1ccc(Br)cc1N Amb20207047 [0,2,0,0,0,0|1,0,1]=4 5200 B12R1.69 C=CCOc1ccc(Cl)cc1F Amb24460659 [0,2,0,0,0,0|1,0,1]=4 5201 B12R1.69 C=CCOc1ccc(N)cc1F Amb18991653 [0,2,0,0,0,0|1,0,1]=4 5202 B12R1.69 C=CCOc1ccc(N)cc1N Amb20207201 [0,2,0,0,0,0|1,0,1]=4 5203 B12R1.69 C=CCOc1ccc(cc1Br)Cl Amb17259614 [0,2,0,0,0,0|1,0,1]=4 5204 B12R1.69 C=CCOc1ccc(cc1Cl)N Amb17139077 [0,2,0,0,0,0|1,0,1]=4 5205 B12R1.69 C=CCOc1ccc(cc1N)C Amb17138556 [0,2,0,0,0,0|1,0,1]=4 5206 B12R1.69 C=CCOc1ccc(cc1N)F Amb17232632 [0,2,0,0,0,0|1,0,1]=4 5207 B12R1.69 CC1=CC(=O)C(=CN1)OCCC Amb19120152 [0,2,0,0,0,0|2,0,0]=4 5208 B12R1.69 CC1=CC(=O)C(=CO1)OCCO Amb24408111 [0,2,0,0,0,0|1,0,0]=3 5209 B12R1.69 CC1=CC(=O)C(CCCO)=CO1 Amb25347586 [0,2,0,0,0,0|2,0,0]=4 5210 B12R1.69 CC1=CC(=O)N(CCCO)C=C1 Amb18041291 [0,2,0,0,0,0|2,0,0]=4 5211 B12R1.69 CC=1C=CN(OCCC)C(=S)C1 Amb25725167 [0,2,0,0,0,0|2,0,0]=4 5212 B12R1.69 CCCCc1ccc(Br)cc1N Amb25688839 [0,2,0,0,0,0|2,0,0]=4 5213 B12R1.69 CCCCc1ccc(Cl)cc1N Amb25212906 [0,2,0,0,0,0|2,0,0]=4 5214 B12R1.69 CCCCc1ccc(F)cc1N Amb25697644 [0,2,0,0,0,0|2,0,0]=4 5215 B12R1.69 CCCCc1ccc(N)cc1Br Amb25766211 [0,2,0,0,0,0|2,0,0]=4 5216 B12R1.69 CCCCc1ccc(N)cc1Cl Amb25858096 [0,2,0,0,0,0|2,0,0]=4 5217 B12R1.69 CCCCc1ccc(N)cc1I Amb25265964 [0,2,0,0,0,0|2,0,0]=4 5218 B12R1.69 CCCNc1ccc(N)cc1Br Amb18293593 [0,2,0,0,0,0|2,0,0]=4 5219 B12R1.69 CCCNc1ccc(N)cc1N Amb19962414 [0,2,0,0,0,0|2,0,0]=4 5220 B12R1.69 CCCOc1[n]cc(Br)cc1Br Amb24317465 [0,2,0,0,0,0|2,0,0]=4 5221 B12R1.69 CCCOc1[n]cc(Br)cc1Cl Amb22235757 [0,2,0,0,0,0|2,0,0]=4 5222 B12R1.69 CCCOc1[n]cc(Br)cc1N Amb18973562 [0,2,0,0,0,0|2,0,0]=4 5223 B12R1.69 CCCOc1[n]cc(Cl)cc1Br Amb24734218 [0,2,0,0,0,0|2,0,0]=4 5224 B12R1.69 CCCOc1[n]cc(Cl)cc1Cl Amb25229280 [0,2,0,0,0,0|2,0,0]=4 5225 B12R1.69 CCCOc1[n]cc(Cl)cc1N Amb24379735 [0,2,0,0,0,0|2,0,0]=4 5226 B12R1.69 CCCOc1ccc(Br)cc1S Amb25342159 [0,2,0,0,0,0|1,0,0]=3 5227 B12R1.69 CCCOc1ccc(C)cc1C Amb24484228 [0,2,0,0,0,0|1,0,0]=3 5228 B12R1.69 CCCOc1ccc(F)cc1Cl Amb25822065 [0,2,0,0,0,0|1,0,0]=3 5229 B12R1.69 CCCOc1ccc(F)cc1S Amb24640815 [0,2,0,0,0,0|1,0,0]=3 5230 B12R1.69 CCCOc1ccc(I)[n]c1Br Amb25365289 [0,2,0,0,0,0|2,0,0]=4 5231 B12R1.69 CCCOc1ccc(I)[n]c1Cl Amb24087515 [0,2,0,0,0,0|2,0,0]=4 5232 B12R1.69 CCCOc1ccc(I)cc1Br Amb25847171 [0,2,0,0,0,0|1,0,0]=3 5233 B12R1.69 CCCOc1ccc(I)cc1N Amb18057209 [0,2,0,0,0,0|1,0,0]=3 5234 B12R1.69 CCCOc1ccc(N)cc1Br Amb18293616 [0,2,0,0,0,0|1,0,0]=3 5235 B12R1.69 CCCOc1ccc(N)cc1O Amb24373151 [0,2,0,0,0,0|1,0,0]=3 5236 B12R1.69 CCCOc1ccc(N)cc1S Amb25324650 [0,2,0,0,0,0|1,0,0]=3 5237 B12R1.69 CCCOc1ccc(S)cc1Cl Amb25669642 [0,2,0,0,0,0|1,0,0]=3 5238 B12R1.69 CCCOc1ccc(S)cc1F Amb25359884 [0,2,0,0,0,0|1,0,0]=3 5239 B12R1.69 CCCOc1ccc(cc1Br)Cl Amb17261136 [0,2,0,0,0,0|1,0,0]=3 5240 B12R1.69 CCCOc1ccc(cc1Cl)N Amb1141135 [0,2,0,0,0,0|1,0,0]=3 5241 B12R1.69 CCCOc1ccc(cc1Cl)O Amb17202481 [0,2,0,0,0,0|1,0,0]=3 5242 B12R1.69 CCCOc1ccc(cc1F)Br Amb10607074 [0,2,0,0,0,0|1,0,0]=3 5243 B12R1.69 CCCSc1ccc(C)cc1C Amb25072296 [0,2,0,0,0,0|1,1,0]=4 5244 B12R1.69 CCCSc1ccc(Cl)cc1O Amb18054146 [0,2,0,0,0,0|1,1,0]=4 5245 B12R1.69 CCCSc1ccc(I)cc1N Amb25150127 [0,2,0,0,0,0|1,1,0]=4 5246 B12R1.69 CCCSc1ccc(N)cc1Br Amb24488693 [0,2,0,0,0,0|1,1,0]=4 5247 B12R1.69 COCOc1ccc(Br)cc1Cl Amb25677213 [0,2,0,0,0,0|2,0,0]=4 5248 B12R1.69 COCOc1ccc(Br)cc1F Amb22034392 [0,2,0,0,0,0|2,0,0]=4 5249 B12R1.69 COCOc1ccc(Br)cc1I Amb25110432 [0,2,0,0,0,0|2,0,0]=4 5250 B12R1.69 COCOc1ccc(Br)cc1S Amb24714977 [0,2,0,0,0,0|2,0,0]=4 5251 B12R1.69 COCOc1ccc(Cl)cc1Cl Amb24439524 [0,2,0,0,0,0|2,0,0]=4 5252 B12R1.69 COCOc1ccc(Cl)cc1F Amb25753343 [0,2,0,0,0,0|2,0,0]=4 5253 B12R1.69 COCOc1ccc(Cl)cc1N Amb24470925 [0,2,0,0,0,0|2,0,0]=4 5254 B12R1.69 COCOc1ccc(F)cc1F Amb22546899 [0,2,0,0,0,0|2,0,0]=4 5255 B12R1.69 COCOc1ccc(N)cc1F Amb24409739 [0,2,0,0,0,0|2,0,0]=4 5256 B12R1.69 COCOc1ccc(O)cc1Cl Amb25723799 [0,2,0,0,0,0|2,0,0]=4 5257 B12R1.69 CSCOc1ccc(Br)cc1Br Amb25094118 [0,2,0,0,0,0|2,0,0]=4 5258 B12R1.69 CSCOc1ccc(Br)cc1F Amb24575854 [0,2,0,0,0,0|2,0,0]=4 5259 B12R1.69 CSCOc1ccc(Cl)cc1Br Amb25734919 [0,2,0,0,0,0|2,0,0]=4 5260 B12R1.69 CSCOc1ccc(F)cc1Br Amb25370342 [0,2,0,0,0,0|2,0,0]=4 5261 B12R1.69 CSCOc1ccc(F)cc1Cl Amb24516568 [0,2,0,0,0,0|2,0,0]=4 5262 B12R1.69 CSCOc1ccc(F)cc1F Amb24570203 [0,2,0,0,0,0|2,0,0]=4 5263 B12R1.69 Cc1[n]c(N)ccc1OCCC Amb25314101 [0,2,0,0,0,0|2,0,0]=4 5264 B12R1.69 Cc1c[n]c(OCCC)c(Cl)c1 Amb24681602 [0,2,0,0,0,0|2,0,0]=4 5265 B12R1.69 Cc1c[n]c(OCCC)c(N)c1 Amb23003212 [0,2,0,0,0,0|2,0,0]=4 5266 B12R1.69 Cc1c[n]c(OCCN)c(C)c1 Amb25211435 [0,2,0,0,0,0|2,0,0]=4 5267 B12R1.69 Cc1c[n]c(OCCO)c(N)c1 Amb24668278 [0,2,0,0,0,0|1,0,0]=3 5268 B12R1.69 Cc1c[n]c(SCCO)c(C)c1 Amb24590353 [0,2,0,0,0,0|1,1,0]=4 5269 B12R1.69 Cc1cc(Br)c(cc1)NCCF Amb25710867 [0,2,0,0,0,0|2,0,0]=4 5270 B12R1.69 Cc1cc(Br)c(cc1)OCCS Amb25344721 [0,2,0,0,0,0|0,1,0]=3 5271 B12R1.69 Cc1cc(Br)c[n]c1NCCO Amb21958721 [0,2,0,0,0,0|2,0,0]=4 5272 B12R1.69 Cc1cc(Br)c[n]c1OCCC Amb19959834 [0,2,0,0,0,0|2,0,0]=4 5273 B12R1.69 Cc1cc(Br)ccc1C#CCO Amb22228979 [0,2,0,0,0,0|1,0,1]=4 5274 B12R1.69 Cc1cc(Br)ccc1CCCC Amb24341759 [0,2,0,0,0,0|2,0,0]=4 5275 B12R1.69 Cc1cc(Br)ccc1CCCO Amb23537809 [0,2,0,0,0,0|1,0,0]=3 5276 B12R1.69 Cc1cc(Br)ccc1OCC#C Amb25134248 [0,2,0,0,0,0|1,0,1]=4 5277 B12R1.69 Cc1cc(Br)ccc1OCCC Amb25323749 [0,2,0,0,0,0|1,0,0]=3 5278 B12R1.69 Cc1cc(Br)ccc1OCCCl Amb24483456 [0,2,0,0,0,0|1,0,0]=3 5279 B12R1.69 Cc1cc(Br)ccc1OCCF Amb24487619 [0,2,0,0,0,0|1,0,0]=3 5280 B12R1.69 Cc1cc(Br)ccc1OCCO Amb24483359 [0,2,0,0,0,0|0,0,0]=2 5281 B12R1.69 Cc1cc(Br)ccc1OCCS Amb24487553 [0,2,0,0,0,0|0,1,0]=3 5282 B12R1.69 Cc1cc(Br)ccc1OCOC Amb24485679 [0,2,0,0,0,0|2,0,0]=4 5283 B12R1.69 Cc1cc(Br)ccc1\C=C\CO Amb25160043 [0,2,0,0,0,0|1,0,1]=4 5284 B12R1.69 Cc1cc(C)c(CCCS)cc1 Amb24497542 [0,2,0,0,0,0|1,1,0]=4 5285 B12R1.69 Cc1cc(C)c(cc1)OCC#C Amb18800359 [0,2,0,0,0,0|1,0,1]=4 5286 B12R1.69 Cc1cc(C)c(cc1)OCC=C Amb22266021 [0,2,0,0,0,0|1,0,1]=4 5287 B12R1.69 Cc1cc(C)c(cc1)SCCS Amb25730666 [0,2,0,0,0,0|0,2,0]=4 5288 B12R1.69 Cc1cc(Cl)c(cc1)NCCF Amb24425918 [0,2,0,0,0,0|2,0,0]=4 5289 B12R1.69 Cc1cc(Cl)c(cc1)NCCN Amb18909434 [0,2,0,0,0,0|2,0,0]=4 5290 B12R1.69 Cc1cc(Cl)c(cc1)OCCN Amb18994687 [0,2,0,0,0,0|1,0,0]=3 5291 B12R1.69 Cc1cc(Cl)c(cc1)OCCO Amb19070653 [0,2,0,0,0,0|0,0,0]=2 5292 B12R1.69 Cc1cc(Cl)c(cc1)OCCS Amb24354256 [0,2,0,0,0,0|0,1,0]=3 5293 B12R1.69 Cc1cc(Cl)ccc1C#CCO Amb25267599 [0,2,0,0,0,0|1,0,1]=4 5294 B12R1.69 Cc1cc(Cl)ccc1NCCF Amb25210402 [0,2,0,0,0,0|2,0,0]=4 5295 B12R1.69 Cc1cc(Cl)ccc1OCC#C Amb18186753 [0,2,0,0,0,0|1,0,1]=4 5296 B12R1.69 Cc1cc(Cl)ccc1OCC=O Amb19075146 [0,2,0,0,0,0|0,0,2]=4 5297 B12R1.69 Cc1cc(Cl)ccc1OCCC Amb24706356 [0,2,0,0,0,0|1,0,0]=3 5298 B12R1.69 Cc1cc(Cl)ccc1OCCF Amb25219644 [0,2,0,0,0,0|1,0,0]=3 5299 B12R1.69 Cc1cc(Cl)ccc1\C=C\CO Amb25324808 [0,2,0,0,0,0|1,0,1]=4 5300 B12R1.69 Cc1cc(F)c(cc1)NCCF Amb25337401 [0,2,0,0,0,0|2,0,0]=4 5301 B12R1.69 Cc1cc(F)c(cc1)NCCN Amb18908740 [0,2,0,0,0,0|2,0,0]=4 5302 B12R1.69 Cc1cc(F)ccc1C#CCO Amb18792546 [0,2,0,0,0,0|1,0,1]=4 5303 B12R1.69 Cc1cc(F)ccc1CCCCl Amb25840107 [0,2,0,0,0,0|2,0,0]=4 5304 B12R1.69 Cc1cc(F)ccc1CCCN Amb18295693 [0,2,0,0,0,0|2,0,0]=4 5305 B12R1.69 Cc1cc(F)ccc1CCCO Amb25148633 [0,2,0,0,0,0|1,0,0]=3 5306 B12R1.69 Cc1cc(F)ccc1NCCF Amb25685410 [0,2,0,0,0,0|2,0,0]=4 5307 B12R1.69 Cc1cc(F)ccc1NCCN Amb18992220 [0,2,0,0,0,0|2,0,0]=4 5308 B12R1.69 Cc1cc(F)ccc1OCC#C Amb25035208 [0,2,0,0,0,0|1,0,1]=4 5309 B12R1.69 Cc1cc(F)ccc1OCC#N Amb25152357 [0,2,0,0,0,0|1,0,1]=4 5310 B12R1.69 Cc1cc(F)ccc1OCCBr Amb25346591 [0,2,0,0,0,0|1,0,0]=3 5311 B12R1.69 Cc1cc(F)ccc1OCCC Amb25332766 [0,2,0,0,0,0|1,0,0]=3 5312 B12R1.69 Cc1cc(F)ccc1OCCCl Amb25051615 [0,2,0,0,0,0|1,0,0]=3 5313 B12R1.69 Cc1cc(F)ccc1OCCO Amb24581854 [0,2,0,0,0,0|0,0,0]=2 5314 B12R1.69 Cc1cc(F)ccc1OCOC Amb25333800 [0,2,0,0,0,0|2,0,0]=4 5315 B12R1.69 Cc1cc(F)ccc1\C=C\CO Amb23442796 [0,2,0,0,0,0|1,0,1]=4 5316 B12R1.69 Cc1cc(I)c(cc1)OCCF Amb25160462 [0,2,0,0,0,0|1,0,0]=3 5317 B12R1.69 Cc1cc(I)c(cc1)OCCO Amb25358459 [0,2,0,0,0,0|0,0,0]=2 5318 B12R1.69 Cc1cc(I)ccc1NCCN Amb25820325 [0,2,0,0,0,0|2,0,0]=4 5319 B12R1.69 Cc1cc(I)ccc1NCCO Amb25160361 [0,2,0,0,0,0|1,0,0]=3 5320 B12R1.69 Cc1cc(I)ccc1OCCCl Amb24559327 [0,2,0,0,0,0|1,0,0]=3 5321 B12R1.69 Cc1cc(N)c(cc1)NCCN Amb18298682 [0,2,0,0,0,0|2,0,0]=4 5322 B12R1.69 Cc1cc(N)c(cc1)SCCN Amb18291316 [0,2,0,0,0,0|1,1,0]=4 5323 B12R1.69 Cc1cc(N)c[n]c1OCCC Amb18991478 [0,2,0,0,0,0|2,0,0]=4 5324 B12R1.69 Cc1cc(N)c[n]c1OCCO Amb18298667 [0,2,0,0,0,0|1,0,0]=3 5325 B12R1.69 Cc1cc(N)c[n]c1SCCO Amb18298672 [0,2,0,0,0,0|1,1,0]=4 5326 B12R1.69 Cc1cc(N)ccc1CCCCl Amb24695776 [0,2,0,0,0,0|2,0,0]=4 5327 B12R1.69 Cc1cc(N)ccc1NCCN Amb18991506 [0,2,0,0,0,0|2,0,0]=4 5328 B12R1.69 Cc1cc(N)ccc1OCCC Amb21954722 [0,2,0,0,0,0|1,0,0]=3 5329 B12R1.69 Cc1cc(N)ccc1OCCF Amb25678791 [0,2,0,0,0,0|1,0,0]=3 5330 B12R1.69 Cc1cc(N)ccc1SCCN Amb18975710 [0,2,0,0,0,0|1,1,0]=4 5331 B12R1.69 Cc1cc(O)c(COCO)cc1 Amb24065149 [0,2,0,0,0,0|2,0,0]=4 5332 B12R1.69 Cc1cc(O)c(\C=C/CO)cc1 Amb25373419 [0,2,0,0,0,0|1,0,1]=4 5333 B12R1.69 Cc1cc(O)c(cc1)SCCO Amb24497015 [0,2,0,0,0,0|0,1,0]=3 5334 B12R1.69 Cc1cc(O)ccc1CCCBr Amb24559420 [0,2,0,0,0,0|2,0,0]=4 5335 B12R1.69 Cc1cc(O)ccc1CCCC Amb24722982 [0,2,0,0,0,0|2,0,0]=4 5336 B12R1.69 Cc1cc(O)ccc1CCCN Amb18554106 [0,2,0,0,0,0|2,0,0]=4 5337 B12R1.69 Cc1cc(S)ccc1CCCCl Amb24541029 [0,2,0,0,0,0|2,0,0]=4 5338 B12R1.69 Cc1ccc(C#CCO)c(C)c1 Amb18792230 [0,2,0,0,0,0|1,0,1]=4 5339 B12R1.69 Cc1ccc(CCCBr)c(Cl)c1 Amb25798590 [0,2,0,0,0,0|2,0,0]=4 5340 B12R1.69 Cc1ccc(CCCBr)c(N)c1 Amb24743622 [0,2,0,0,0,0|2,0,0]=4 5341 B12R1.69 Cc1ccc(CCCBr)c(O)c1 Amb25194824 [0,2,0,0,0,0|2,0,0]=4 5342 B12R1.69 Cc1ccc(CCCC)c(N)c1 Amb24524870 [0,2,0,0,0,0|2,0,0]=4 5343 B12R1.69 Cc1ccc(CCCC)c(O)c1 Amb24557617 [0,2,0,0,0,0|2,0,0]=4 5344 B12R1.69 Cc1ccc(CCCCl)c(N)c1 Amb24638069 [0,2,0,0,0,0|2,0,0]=4 5345 B12R1.69 Cc1ccc(CCCN)c(Cl)c1 Amb25159902 [0,2,0,0,0,0|2,0,0]=4 5346 B12R1.69 Cc1ccc(CCCN)c(F)c1 Amb25677595 [0,2,0,0,0,0|2,0,0]=4 5347 B12R1.69 Cc1ccc(CCCN)c(O)c1 Amb25776876 [0,2,0,0,0,0|2,0,0]=4 5348 B12R1.69 Cc1ccc(CCCO)c(Br)c1 Amb23537990 [0,2,0,0,0,0|1,0,0]=3 5349 B12R1.69 Cc1ccc(CCCO)c(Cl)c1 Amb25820255 [0,2,0,0,0,0|1,0,0]=3 5350 B12R1.69 Cc1ccc(CCCO)c(F)c1 Amb25135641 [0,2,0,0,0,0|1,0,0]=3 5351 B12R1.69 Cc1ccc(CCCO)c(N)c1 Amb22233216 [0,2,0,0,0,0|1,0,0]=3 5352 B12R1.69 Cc1ccc(NCCC)c(S)c1 Amb24355891 [0,2,0,0,0,0|2,0,0]=4 5353 B12R1.69 Cc1ccc(OCC#C)c(Cl)c1 Amb18805199 [0,2,0,0,0,0|1,0,1]=4 5354 B12R1.69 Cc1ccc(OCC#C)c(N)c1 Amb18286187 [0,2,0,0,0,0|1,0,1]=4 5355 B12R1.69 Cc1ccc(OCC#N)c(Cl)c1 Amb18805466 [0,2,0,0,0,0|1,0,1]=4 5356 B12R1.69 Cc1ccc(OCC#N)c(I)c1 Amb25797087 [0,2,0,0,0,0|1,0,1]=4 5357 B12R1.69 Cc1ccc(OCC#N)c(N)c1 Amb18282436 [0,2,0,0,0,0|1,0,1]=4 5358 B12R1.69 Cc1ccc(OCC=C)c(Cl)c1 Amb24416521 [0,2,0,0,0,0|1,0,1]=4 5359 B12R1.69 Cc1ccc(OCC=C)c(I)c1 Amb24570191 [0,2,0,0,0,0|1,0,1]=4 5360 B12R1.69 Cc1ccc(OCC=O)c(Cl)c1 Amb19069174 [0,2,0,0,0,0|0,0,2]=4 5361 B12R1.69 Cc1ccc(OCCBr)c(C)[n]1 Amb24638382 [0,2,0,0,0,0|2,0,0]=4 5362 B12R1.69 Cc1ccc(OCCC)c(Br)[n]1 Amb25120593 [0,2,0,0,0,0|2,0,0]=4 5363 B12R1.69 Cc1ccc(OCCC)c(Cl)[n]1 Amb25356928 [0,2,0,0,0,0|2,0,0]=4 5364 B12R1.69 Cc1ccc(OCCC)c(N)[n]1 Amb18986272 [0,2,0,0,0,0|2,0,0]=4 5365 B12R1.69 Cc1ccc(OCCC)c(S)c1 Amb24688543 [0,2,0,0,0,0|1,0,0]=3 5366 B12R1.69 Cc1ccc(OCCF)c(Cl)[n]1 Amb24370508 [0,2,0,0,0,0|2,0,0]=4 5367 B12R1.69 Cc1ccc(OCCN)c(I)[n]1 Amb25675702 [0,2,0,0,0,0|2,0,0]=4 5368 B12R1.69 Cc1ccc(OCCO)c(Br)[n]1 Amb22585592 [0,2,0,0,0,0|1,0,0]=3 5369 B12R1.69 Cc1ccc(OCCO)c(Cl)[n]1 Amb24421579 [0,2,0,0,0,0|1,0,0]=3 5370 B12R1.69 Cc1ccc(OCCO)c(I)[n]1 Amb25801033 [0,2,0,0,0,0|1,0,0]=3 5371 B12R1.69 Cc1ccc(OCCO)c(N)[n]1 Amb18295556 [0,2,0,0,0,0|1,0,0]=3 5372 B12R1.69 Cc1ccc(OCOC)c(Br)c1 Amb20241784 [0,2,0,0,0,0|2,0,0]=4 5373 B12R1.69 Cc1ccc(OCOC)c(S)c1 Amb25255588 [0,2,0,0,0,0|2,0,0]=4 5374 B12R1.69 Cc1ccc(SCCC)c(O)c1 Amb18554610 [0,2,0,0,0,0|1,1,0]=4 5375 B12R1.69 ClCCCc1ccc(Br)cc1Br Amb24756782 [0,2,0,0,0,0|2,0,0]=4 5376 B12R1.69 ClCCCc1ccc(cc1Cl)Cl Amb17477748 [0,2,0,0,0,0|2,0,0]=4 5377 B12R1.69 ClCCNc1ccc(cc1Br)C Amb17351915 [0,2,0,0,0,0|2,0,0]=4 5378 B12R1.69 ClCCNc1ccc(cc1C)Br Amb17351916 [0,2,0,0,0,0|2,0,0]=4 5379 B12R1.69 ClCCNc1ccc(cc1C)C Amb17335661 [0,2,0,0,0,0|2,0,0]=4 5380 B12R1.69 ClCCNc1ccc(cc1C)Cl Amb17338053 [0,2,0,0,0,0|2,0,0]=4 5381 B12R1.69 ClCCNc1ccc(cc1Cl)Cl Amb17343163 [0,2,0,0,0,0|2,0,0]=4 5382 B12R1.69 ClCCOc1ccc(Br)cc1Br Amb25788260 [0,2,0,0,0,0|1,0,0]=3 5383 B12R1.69 ClCCOc1ccc(cc1Cl)F Amb17240164 [0,2,0,0,0,0|1,0,0]=3 5384 B12R1.69 Clc1cc(Cl)c(CCCBr)cc1 Amb24064155 [0,2,0,0,0,0|2,0,0]=4 5385 B12R1.69 Clc1cc(I)ccc1CCCBr Amb25247642 [0,2,0,0,0,0|2,0,0]=4 5386 B12R1.69 Clc1ccc(OCCI)c(Br)c1 Amb24427248 [0,2,0,0,0,0|1,0,0]=3 5387 B12R1.69 FCCNc1ccc(Cl)cc1Br Amb25284979 [0,2,0,0,0,0|2,0,0]=4 5388 B12R1.69 FCCNc1ccc(I)cc1Cl Amb25341860 [0,2,0,0,0,0|2,0,0]=4 5389 B12R1.69 FCCOc1ccc(Br)cc1Br Amb24593741 [0,2,0,0,0,0|1,0,0]=3 5390 B12R1.69 FCCOc1ccc(Br)cc1Cl Amb22470092 [0,2,0,0,0,0|1,0,0]=3 5391 B12R1.69 FCCOc1ccc(Cl)cc1Cl Amb24495908 [0,2,0,0,0,0|1,0,0]=3 5392 B12R1.69 FCCSc1ccc(F)cc1F Amb24497848 [0,2,0,0,0,0|1,1,0]=4 5393 B12R1.69 Fc1cc(Br)c(CCCBr)cc1 Amb24448383 [0,2,0,0,0,0|2,0,0]=4 5394 B12R1.69 Fc1cc(Br)ccc1CCCBr Amb20075851 [0,2,0,0,0,0|2,0,0]=4 5395 B12R1.69 Fc1cc(Br)ccc1CCCCl Amb25770333 [0,2,0,0,0,0|2,0,0]=4 5396 B12R1.69 Fc1cc(Br)ccc1NCCF Amb24535413 [0,2,0,0,0,0|2,0,0]=4 5397 B12R1.69 Fc1cc(Br)ccc1OCCF Amb24440151 [0,2,0,0,0,0|1,0,0]=3 5398 B12R1.69 Fc1cc(Cl)c(c[n]1)OCCF Amb24343805 [0,2,0,0,0,0|2,0,0]=4 5399 B12R1.69 Fc1cc(Cl)ccc1OCCCl Amb25231116 [0,2,0,0,0,0|1,0,0]=3 5400 B12R1.69 Fc1cc(Cl)ccc1OCCF Amb24493304 [0,2,0,0,0,0|1,0,0]=3 5401 B12R1.69 Fc1cc(Cl)ccc1OCCS Amb25789820 [0,2,0,0,0,0|0,1,0]=3 5402 B12R1.69 Fc1cc(F)c(CCCCl)cc1 Amb19073200 [0,2,0,0,0,0|2,0,0]=4 5403 B12R1.69 Fc1cc(F)c(CCCS)cc1 Amb25159701 [0,2,0,0,0,0|1,1,0]=4 5404 B12R1.69 Fc1cc(F)c(cc1)SCCS Amb24487519 [0,2,0,0,0,0|0,2,0]=4 5405 B12R1.69 Fc1cc(I)ccc1CCCBr Amb25209319 [0,2,0,0,0,0|2,0,0]=4 5406 B12R1.69 Fc1cc(S)ccc1CCCCl Amb25278657 [0,2,0,0,0,0|2,0,0]=4 5407 B12R1.69 Fc1ccc(CCCBr)c(S)c1 Amb25254870 [0,2,0,0,0,0|2,0,0]=4 5408 B12R1.69 Fc1ccc(NCCF)c(Br)c1 Amb24434276 [0,2,0,0,0,0|2,0,0]=4 5409 B12R1.69 Fc1ccc(NCCF)c(Cl)c1 Amb25124418 [0,2,0,0,0,0|2,0,0]=4 5410 B12R1.69 NCCCc1ccc(Cl)cc1F Amb23315399 [0,2,0,0,0,0|2,0,0]=4 5411 B12R1.69 NCCCc1ccc(Cl)cc1O Amb25084560 [0,2,0,0,0,0|2,0,0]=4 5412 B12R1.69 NCCCc1ccc(F)cc1O Amb25757889 [0,2,0,0,0,0|2,0,0]=4 5413 B12R1.69 NCCCc1ccc(O)cc1Cl Amb18556149 [0,2,0,0,0,0|2,0,0]=4 5414 B12R1.69 NCCCc1ccc(O)cc1O Amb18054814 [0,2,0,0,0,0|2,0,0]=4 5415 B12R1.69 NCCCc1ccc(cc1Br)C Amb17204537 [0,2,0,0,0,0|2,0,0]=4 5416 B12R1.69 NCCCc1ccc(cc1C)Br Amb17204538 [0,2,0,0,0,0|2,0,0]=4 5417 B12R1.69 NCCCc1ccc(cc1C)C Amb1215673 [0,2,0,0,0,0|2,0,0]=4 5418 B12R1.69 NCCCc1ccc(cc1C)Cl Amb17204337 [0,2,0,0,0,0|2,0,0]=4 5419 B12R1.69 NCCCc1ccc(cc1F)F Amb17204313 [0,2,0,0,0,0|2,0,0]=4 5420 B12R1.69 NCCNc1ccc(Br)cc1Cl Amb25062245 [0,2,0,0,0,0|2,0,0]=4 5421 B12R1.69 NCCNc1ccc(Cl)cc1F Amb18909785 [0,2,0,0,0,0|2,0,0]=4 5422 B12R1.69 NCCNc1ccc(F)cc1Cl Amb18909783 [0,2,0,0,0,0|2,0,0]=4 5423 B12R1.69 NCCNc1ccc(I)cc1Cl Amb25109686 [0,2,0,0,0,0|2,0,0]=4 5424 B12R1.69 NCCNc1ccc(cc1Br)C Amb17091075 [0,2,0,0,0,0|2,0,0]=4 5425 B12R1.69 NCCNc1ccc(cc1C)Br Amb17091076 [0,2,0,0,0,0|2,0,0]=4 5426 B12R1.69 NCCNc1ccc(cc1C)C Amb17057764 [0,2,0,0,0,0|2,0,0]=4 5427 B12R1.69 NCCNc1ccc(cc1C)Cl Amb17091059 [0,2,0,0,0,0|2,0,0]=4 5428 B12R1.69 NCCNc1ccc(cc1Cl)Cl Amb17091081 [0,2,0,0,0,0|2,0,0]=4 5429 B12R1.69 NCCNc1ccc(cc1F)F Amb17057761 [0,2,0,0,0,0|2,0,0]=4 5430 B12R1.69 NCCOc1[n]cc(Br)cc1Cl Amb25064902 [0,2,0,0,0,0|2,0,0]=4 5431 B12R1.69 NCCOc1[n]cc(Cl)cc1Br Amb24406156 [0,2,0,0,0,0|2,0,0]=4 5432 B12R1.69 NCCOc1[n]cc(Cl)cc1Cl Amb18296484 [0,2,0,0,0,0|2,0,0]=4 5433 B12R1.69 NCCOc1[n]cc(Cl)cc1Cl Amb20631072 [0,2,0,0,0,0|2,0,0]=4 5434 B12R1.69 NCCOc1[n]cc(F)cc1F Amb25717110 [0,2,0,0,0,0|2,0,0]=4 5435 B12R1.69 NCCOc1ccc(Br)[n]c1Br Amb24712539 [0,2,0,0,0,0|2,0,0]=4 5436 B12R1.69 NCCOc1ccc(Cl)cc1F Amb25192665 [0,2,0,0,0,0|1,0,0]=3 5437 B12R1.69 NCCOc1ccc(F)cc1F Amb19426831 [0,2,0,0,0,0|1,0,0]=3 5438 B12R1.69 NCCOc1ccc(cc1Br)Br Amb17381668 [0,2,0,0,0,0|1,0,0]=3 5439 B12R1.69 NCCOc1ccc(cc1C)C Amb1072012 [0,2,0,0,0,0|1,0,0]=3 5440 B12R1.69 NCCOc1ccc(cc1C)C Amb1215328 [0,2,0,0,0,0|1,0,0]=3 5441 B12R1.69 NCCOc1ccc(cc1Cl)F Amb2150774 [0,2,0,0,0,0|1,0,0]=3 5442 B12R1.69 NCCOc1ccc(cc1F)F Amb1139149 [0,2,0,0,0,0|1,0,0]=3 5443 B12R1.69 NCCSc1ccc(Cl)cc1Cl Amb21861547 [0,2,0,0,0,0|1,1,0]=4 5444 B12R1.69 NCCSc1ccc(cc1C)F Amb17083029 [0,2,0,0,0,0|1,1,0]=4 5445 B12R1.69 Nc1cc(Br)c(CCCBr)cc1 Amb25243524 [0,2,0,0,0,0|2,0,0]=4 5446 B12R1.69 Nc1cc(Br)c(cc1)NCCF Amb24391810 [0,2,0,0,0,0|2,0,0]=4 5447 B12R1.69 Nc1cc(Br)c(cc1)NCCO Amb18293614 [0,2,0,0,0,0|1,0,0]=3 5448 B12R1.69 Nc1cc(Br)c(cc1)OCCO Amb18981633 [0,2,0,0,0,0|0,0,0]=2 5449 B12R1.69 Nc1cc(Br)c(cc1)SCCO Amb18293602 [0,2,0,0,0,0|0,1,0]=3 5450 B12R1.69 Nc1cc(Br)c[n]c1OCCO Amb18973561 [0,2,0,0,0,0|1,0,0]=3 5451 B12R1.69 Nc1cc(Br)c[n]c1SCCO Amb18973564 [0,2,0,0,0,0|1,1,0]=4 5452 B12R1.69 Nc1cc(Br)ccc1CCCN Amb24452129 [0,2,0,0,0,0|2,0,0]=4 5453 B12R1.69 Nc1cc(Br)ccc1NCCN Amb18999459 [0,2,0,0,0,0|2,0,0]=4 5454 B12R1.69 Nc1cc(Br)ccc1OCCBr Amb22263521 [0,2,0,0,0,0|1,0,0]=3 5455 B12R1.69 Nc1cc(Br)ccc1OCCF Amb24758558 [0,2,0,0,0,0|1,0,0]=3 5456 B12R1.69 Nc1cc(Br)ccc1SCCN Amb18291323 [0,2,0,0,0,0|1,1,0]=4 5457 B12R1.69 Nc1cc(Cl)c(NCCO)[n]c1 Amb25816494 [0,2,0,0,0,0|2,0,0]=4 5458 B12R1.69 Nc1cc(Cl)c([n]c1)OCCO Amb25121631 [0,2,0,0,0,0|1,0,0]=3 5459 B12R1.69 Nc1cc(Cl)c([n]c1)SCCO Amb25121632 [0,2,0,0,0,0|1,1,0]=4 5460 B12R1.69 Nc1cc(Cl)c(cc1)NCCF Amb24712144 [0,2,0,0,0,0|2,0,0]=4 5461 B12R1.69 Nc1cc(Cl)c[n]c1SCCO Amb24370294 [0,2,0,0,0,0|1,1,0]=4 5462 B12R1.69 Nc1cc(Cl)ccc1C#CCO Amb25824714 [0,2,0,0,0,0|1,0,1]=4 5463 B12R1.69 Nc1cc(Cl)ccc1CCCCl Amb24574272 [0,2,0,0,0,0|2,0,0]=4 5464 B12R1.69 Nc1cc(Cl)ccc1NCCF Amb24443635 [0,2,0,0,0,0|2,0,0]=4 5465 B12R1.69 Nc1cc(Cl)ccc1NCCN Amb18298634 [0,2,0,0,0,0|2,0,0]=4 5466 B12R1.69 Nc1cc(Cl)ccc1OCCF Amb24487547 [0,2,0,0,0,0|1,0,0]=3 5467 B12R1.69 Nc1cc(Cl)ccc1SCCF Amb25069132 [0,2,0,0,0,0|1,1,0]=4 5468 B12R1.69 Nc1cc(Cl)ccc1SCCN Amb18291311 [0,2,0,0,0,0|1,1,0]=4 5469 B12R1.69 Nc1cc(F)c(cc1)OCCF Amb25771296 [0,2,0,0,0,0|1,0,0]=3 5470 B12R1.69 Nc1cc(F)c[n]c1SCCO Amb25229318 [0,2,0,0,0,0|1,1,0]=4 5471 B12R1.69 Nc1cc(F)ccc1NCCF Amb25669799 [0,2,0,0,0,0|2,0,0]=4 5472 B12R1.69 Nc1cc(F)ccc1NCCN Amb18991501 [0,2,0,0,0,0|2,0,0]=4 5473 B12R1.69 Nc1cc(F)ccc1OCC#N Amb18285720 [0,2,0,0,0,0|1,0,1]=4 5474 B12R1.69 Nc1cc(F)ccc1OCCF Amb24437013 [0,2,0,0,0,0|1,0,0]=3 5475 B12R1.69 Nc1cc(F)ccc1SCCN Amb18291317 [0,2,0,0,0,0|1,1,0]=4 5476 B12R1.69 Nc1cc(I)c(cc1)NCCF Amb25125089 [0,2,0,0,0,0|2,0,0]=4 5477 B12R1.69 Nc1cc(I)c(cc1)OCCO Amb25035161 [0,2,0,0,0,0|0,0,0]=2 5478 B12R1.69 Nc1cc(I)c(cc1)SCCO Amb25150124 [0,2,0,0,0,0|0,1,0]=3 5479 B12R1.69 Nc1cc(I)ccc1CCCCl Amb25312276 [0,2,0,0,0,0|2,0,0]=4 5480 B12R1.69 Nc1cc(I)ccc1NCCF Amb25036430 [0,2,0,0,0,0|2,0,0]=4 5481 B12R1.69 Nc1cc(I)ccc1NCCO Amb25150077 [0,2,0,0,0,0|1,0,0]=3 5482 B12R1.69 Nc1cc(I)ccc1OCCO Amb25150025 [0,2,0,0,0,0|0,0,0]=2 5483 B12R1.69 Nc1cc(N)c(CCCCl)cc1 Amb24537154 [0,2,0,0,0,0|2,0,0]=4 5484 B12R1.69 Nc1cc(N)c(cc1)OCCO Amb22734340 [0,2,0,0,0,0|0,0,0]=2 5485 B12R1.69 Nc1cc(N)c(cc1)SCCO Amb24542857 [0,2,0,0,0,0|0,1,0]=3 5486 B12R1.69 Nc1cc(O)c(cc1)OCCO Amb25289025 [0,2,0,0,0,0|0,0,0]=2 5487 B12R1.69 Nc1cc(S)ccc1CCCBr Amb24695628 [0,2,0,0,0,0|2,0,0]=4 5488 B12R1.69 Nc1cc(S)ccc1CCCCl Amb24628043 [0,2,0,0,0,0|2,0,0]=4 5489 B12R1.69 Nc1ccc(CCCBr)c(O)c1 Amb24759204 [0,2,0,0,0,0|2,0,0]=4 5490 B12R1.69 Nc1ccc(CCCCl)c(O)c1 Amb25208686 [0,2,0,0,0,0|2,0,0]=4 5491 B12R1.69 Nc1ccc(NCCN)c(Br)c1 Amb18991524 [0,2,0,0,0,0|2,0,0]=4 5492 B12R1.69 Nc1ccc(NCCN)c(Cl)c1 Amb18298651 [0,2,0,0,0,0|2,0,0]=4 5493 B12R1.69 Nc1ccc(NCCN)c(F)c1 Amb18991505 [0,2,0,0,0,0|2,0,0]=4 5494 B12R1.69 Nc1ccc(SCCN)c(Cl)c1 Amb18975709 [0,2,0,0,0,0|1,1,0]=4 5495 B12R1.69 Nc1ccc(SCCN)c(F)c1 Amb18975707 [0,2,0,0,0,0|1,1,0]=4 5496 B12R1.69 O=CCOc1ccc(Br)cc1Br Amb24438161 [0,2,0,0,0,0|0,0,2]=4 5497 B12R1.69 O=CCOc1ccc(Br)cc1F Amb25710965 [0,2,0,0,0,0|0,0,2]=4 5498 B12R1.69 O=CCOc1ccc(F)cc1Cl Amb18330025 [0,2,0,0,0,0|0,0,2]=4 5499 B12R1.69 O=CCOc1ccc(F)cc1F Amb18807299 [0,2,0,0,0,0|0,0,2]=4 5500 B12R1.69 O=CCOc1ccc(cc1Br)C Amb17099967 [0,2,0,0,0,0|0,0,2]=4 5501 B12R1.69 O=CCOc1ccc(cc1Br)Cl Amb17099945 [0,2,0,0,0,0|0,0,2]=4 5502 B12R1.69 O=CCOc1ccc(cc1Br)F Amb17099943 [0,2,0,0,0,0|0,0,2]=4 5503 B12R1.69 O=CCOc1ccc(cc1C)Br Amb17099968 [0,2,0,0,0,0|0,0,2]=4 5504 B12R1.69 O=CCOc1ccc(cc1Cl)Br Amb17099944 [0,2,0,0,0,0|0,0,2]=4 5505 B12R1.69 OCC#Cc1ccc(cc1F)Cl Amb2423467 [0,2,0,0,0,0|1,0,1]=4 5506 B12R1.69 OCCCN1C=CC(=O)C=C1Cl Amb25043292 [0,2,0,0,0,0|2,0,0]=4 5507 B12R1.69 OCCCc1ccc(Br)cc1F Amb20171344 [0,2,0,0,0,0|1,0,0]=3 5508 B12R1.69 OCCCc1ccc(Cl)cc1F Amb25720643 [0,2,0,0,0,0|1,0,0]=3 5509 B12R1.69 OCCCc1ccc(F)cc1Br Amb24090111 [0,2,0,0,0,0|1,0,0]=3 5510 B12R1.69 OCCCc1ccc(F)cc1Cl Amb19072148 [0,2,0,0,0,0|1,0,0]=3 5511 B12R1.69 OCCCc1ccc(O)cc1O Amb18646882 [0,2,0,0,0,0|1,0,0]=3 5512 B12R1.69 OCCCc1ccc(cc1C)C Amb17400157 [0,2,0,0,0,0|1,0,0]=3 5513 B12R1.69 OCCCc1ccc(cc1Cl)Cl Amb17402981 [0,2,0,0,0,0|1,0,0]=3 5514 B12R1.69 OCCCc1ccc(cc1F)F Amb17605787 [0,2,0,0,0,0|1,0,0]=3 5515 B12R1.69 OCCNc1[n]cc(Br)cc1Br Amb24680585 [0,2,0,0,0,0|2,0,0]=4 5516 B12R1.69 OCCNc1[n]cc(Cl)cc1Br Amb24359358 [0,2,0,0,0,0|2,0,0]=4 5517 B12R1.69 OCCNc1[n]cc(Cl)cc1F Amb19959550 [0,2,0,0,0,0|2,0,0]=4 5518 B12R1.69 OCCNc1ccc(Br)cc1Br Amb24744028 [0,2,0,0,0,0|1,0,0]=3 5519 B12R1.69 OCCNc1ccc(Cl)cc1F Amb18987263 [0,2,0,0,0,0|1,0,0]=3 5520 B12R1.69 OCCNc1ccc(Cl)cc1I Amb25115225 [0,2,0,0,0,0|1,0,0]=3 5521 B12R1.69 OCCNc1ccc(I)cc1Br Amb25340858 [0,2,0,0,0,0|1,0,0]=3 5522 B12R1.69 OCCNc1ccc(I)cc1Cl Amb25697771 [0,2,0,0,0,0|1,0,0]=3 5523 B12R1.69 OCCNc1ccc(cc1C)Cl Amb17305825 [0,2,0,0,0,0|1,0,0]=3 5524 B12R1.69 OCCNc1ncc(cc1Br)N Amb17213688 [0,2,0,0,0,0|2,0,0]=4 5525 B12R1.69 OCCNc1ncc(cc1C)N Amb17210900 [0,2,0,0,0,0|2,0,0]=4 5526 B12R1.69 OCCNc1ncc(cc1N)Br Amb17209005 [0,2,0,0,0,0|2,0,0]=4 5527 B12R1.69 OCCNc1ncc(cc1N)C Amb17209059 [0,2,0,0,0,0|2,0,0]=4 5528 B12R1.69 OCCNc1ncc(cc1N)Cl Amb17208938 [0,2,0,0,0,0|2,0,0]=4 5529 B12R1.69 OCCOc1[n]cc(I)cc1Br Amb25785075 [0,2,0,0,0,0|1,0,0]=3 5530 B12R1.69 OCCOc1ccc(Br)[n]c1Cl Amb24493295 [0,2,0,0,0,0|1,0,0]=3 5531 B12R1.69 OCCOc1ccc(Br)cc1Br Amb19339973 [0,2,0,0,0,0|0,0,0]=2 5532 B12R1.69 OCCOc1ccc(I)cc1I Amb25036249 [0,2,0,0,0,0|0,0,0]=2 5533 B12R1.69 OCCOc1ccc(O)cc1O Amb25674471 [0,2,0,0,0,0|0,0,0]=2 5534 B12R1.69 OCCOc1ccc(cc1Cl)Cl Amb1050772 [0,2,0,0,0,0|0,0,0]=2 5535 B12R1.69 OCCOc1ccc(cc1Cl)F Amb17105030 [0,2,0,0,0,0|0,0,0]=2 5536 B12R1.69 OCCSc1[n]cc(Br)cc1Br Amb24645556 [0,2,0,0,0,0|1,1,0]=4 5537 B12R1.69 OCCSc1[n]cc(Br)cc1Cl Amb24407077 [0,2,0,0,0,0|1,1,0]=4 5538 B12R1.69 OCCSc1[n]cc(Cl)cc1Br Amb24556174 [0,2,0,0,0,0|1,1,0]=4 5539 B12R1.69 OCCSc1[n]cc(Cl)cc1F Amb25041989 [0,2,0,0,0,0|1,1,0]=4 5540 B12R1.69 OCCSc1[n]cc(F)cc1F Amb25035058 [0,2,0,0,0,0|1,1,0]=4 5541 B12R1.69 OC\C=C\c1ccc(Br)cc1Cl Amb25826292 [0,2,0,0,0,0|1,0,1]=4 5542 B12R1.69 OC\C=C\c1ccc(Cl)cc1Br Amb24465297 [0,2,0,0,0,0|1,0,1]=4 5543 B12R1.69 OC\C=C\c1ccc(Cl)cc1Cl Amb22499014 [0,2,0,0,0,0|1,0,1]=4 5544 B12R1.69 OC\C=C\c1ccc(Cl)cc1F Amb25697673 [0,2,0,0,0,0|1,0,1]=4 5545 B12R1.69 OC\C=C\c1ccc(F)cc1F Amb23442759 [0,2,0,0,0,0|1,0,1]=4 5546 B12R1.69 Oc1cc(Br)c[n]c1OCCO Amb21959464 [0,2,0,0,0,0|1,0,0]=3 5547 B12R1.69 Oc1cc(Cl)c[n]c1OCCO Amb21961116 [0,2,0,0,0,0|1,0,0]=3 5548 B12R1.69 Oc1cc(Cl)ccc1CCCBr Amb24743949 [0,2,0,0,0,0|2,0,0]=4 5549 B12R1.69 Oc1cc(F)ccc1CCCO Amb25106077 [0,2,0,0,0,0|1,0,0]=3 5550 B12R1.69 Oc1cc(F)ccc1OCCO Amb25838740 [0,2,0,0,0,0|0,0,0]=2 5551 B12R1.69 Oc1ccc(CCCBr)c(I)c1 Amb24527855 [0,2,0,0,0,0|2,0,0]=4 5552 B12R1.69 Oc1ccc(CCCBr)c(S)c1 Amb25351802 [0,2,0,0,0,0|2,0,0]=4 5553 B12R1.69 Oc1ccc(CCCCl)c(S)c1 Amb25253243 [0,2,0,0,0,0|2,0,0]=4 5554 B12R1.69 Oc1ccc(CCCO)c(Cl)c1 Amb25690683 [0,2,0,0,0,0|1,0,0]=3 5555 B12R1.69 Oc1ccc(CCCO)c(F)c1 Amb25281830 [0,2,0,0,0,0|1,0,0]=3 5556 B12R1.69 SCCOc1ccc(Br)cc1Br Amb25034566 [0,2,0,0,0,0|0,1,0]=3 5557 B12R1.69 SCCOc1ccc(Br)cc1Cl Amb25120727 [0,2,0,0,0,0|0,1,0]=3 5558 B12R1.69 SCCOc1ccc(cc1C)C Amb17233944 [0,2,0,0,0,0|0,1,0]=3 5559 B12R1.69 SCCOc1ccc(cc1C)Cl Amb17237590 [0,2,0,0,0,0|0,1,0]=3 5560 B12R1.69 SCCOc1ccc(cc1Cl)F Amb17239148 [0,2,0,0,0,0|0,1,0]=3 5561 B12R1.69 SCCOc1ccc(cc1F)F Amb17234881 [0,2,0,0,0,0|0,1,0]=3 5562 B12R1.69 SCCSc1ccc(Cl)cc1Cl Amb25696682 [0,2,0,0,0,0|0,2,0]=4 5563 B12R1.69 Sc1ccc(CCCBr)c(I)c1 Amb24696766 [0,2,0,0,0,0|2,0,0]=4 5564 B12R1.71 BrCCCc1ccc(cc1)CC Amb17104557 [0,2,0,0,0,0|2,0,0]=4 5565 B12R1.71 BrCCCc1ccc(cc1)OC Amb17104559 [0,2,0,0,0,0|2,0,0]=4 5566 B12R1.71 BrCCOc1ccc(cc1)C#N Amb1107353 [0,2,0,0,0,0|1,0,0]=3 5567 B12R1.71 BrCCOc1ccc(cc1)CC Amb1353197 [0,2,0,0,0,0|1,0,0]=3 5568 B12R1.71 BrCCOc1ccc(cc1)OC Amb1151010 [0,2,0,0,0,0|1,0,0]=3 5569 B12R1.71 BrCc1ccc(CCCBr)cc1 Amb23590681 [0,2,0,0,0,0|2,0,0]=4 5570 B12R1.71 C#CCOc1ccc(CCl)cc1 Amb25053883 [0,2,0,0,0,0|1,0,1]=4 5571 B12R1.71 C#CCOc1ccc(CN)cc1 Amb18969701 [0,2,0,0,0,0|1,0,1]=4 5572 B12R1.71 C#Cc1ccc(cc1)OCCCl Amb25794485 [0,2,0,0,0,0|1,0,0]=3 5573 B12R1.71 C=CCOc1ccc(cc1)C=O Amb1240568 [0,2,0,0,0,0|1,0,1]=4 5574 B12R1.71 C=CCOc1ccc(cc1)[Zn]Br Amb22897943 [0,2,0,0,0,0|1,0,1]=4 5575 B12R1.71 C=Cc1ccc(CCCBr)cc1 Amb22831998 [0,2,0,0,0,0|2,0,0]=4 5576 B12R1.71 CCCCc1ccc(CBr)cc1 Amb24065906 [0,2,0,0,0,0|2,0,0]=4 5577 B12R1.71 CCCCc1ccc(NN)cc1 Amb17949643 [0,2,0,0,0,0|2,0,0]=4 5578 B12R1.71 CCCCc1ccc(cc1)NC Amb20623748 [0,2,0,0,0,0|2,0,0]=4 5579 B12R1.71 CCCCc1ccc(cc1)NN Amb2234491 [0,2,0,0,0,0|2,0,0]=4 5580 B12R1.71 CCCCc1ccc(cc1)NO Amb24091344 [0,2,0,0,0,0|2,0,0]=4 5581 B12R1.71 CCCCc1ccc(cc1)[Mg]Br Amb22000527 [0,2,0,0,0,0|2,0,0]=4 5582 B12R1.71 CCCCc1ccc(cc1)[Zn]Br Amb22898139 [0,2,0,0,0,0|2,0,0]=4 5583 B12R1.71 CCCNc1ccc(C=O)cc1 Amb25055167 [0,2,0,0,0,0|2,0,0]=4 5584 B12R1.71 CCCNc1ccc(CN)cc1 Amb18800849 [0,2,0,0,0,0|2,0,0]=4 5585 B12R1.71 CCCNc1ccc(CO)cc1 Amb25734032 [0,2,0,0,0,0|2,0,0]=4 5586 B12R1.71 CCCNc1ccc(cc1)N=O Amb25096367 [0,2,0,0,0,0|2,0,0]=4 5587 B12R1.71 CCCOc1c[n]c(CCl)cc1 Amb24065127 [0,2,0,0,0,0|2,0,0]=4 5588 B12R1.71 CCCOc1c[n]c(cc1)C#N Amb25667480 [0,2,0,0,0,0|2,0,0]=4 5589 B12R1.71 CCCOc1ccc(CO)c[n]1 Amb18788576 [0,2,0,0,0,0|2,0,0]=4 5590 B12R1.71 CCCOc1ccc(c[n]1)C#C Amb25260764 [0,2,0,0,0,0|2,0,0]=4 5591 B12R1.71 CCCOc1ccc(cc1)C=O Amb1073495 [0,2,0,0,0,0|1,0,0]=3 5592 B12R1.71 CCCOc1ccc(cc1)CN Amb1136393 [0,2,0,0,0,0|1,0,0]=3 5593 B12R1.71 CCCOc1ccc(cc1)NC Amb19032018 [0,2,0,0,0,0|1,0,0]=3 5594 B12R1.71 CCCOc1ccc(cc1)NN Amb17232617 [0,2,0,0,0,0|1,0,0]=3 5595 B12R1.71 CCCOc1ccc(cc1)[Zn]Br Amb22897867 [0,2,0,0,0,0|1,0,0]=3 5596 B12R1.71 CCCSc1ccc(cc1)NC Amb18554168 [0,2,0,0,0,0|1,1,0]=4 5597 B12R1.71 CCCSc1ccc(cc1)[Zn]Br Amb22897972 [0,2,0,0,0,0|1,1,0]=4 5598 B12R1.71 CCc1ccc(\C=C\CO)cc1 Amb23442835 [0,2,0,0,0,0|1,0,1]=4 5599 B12R1.71 CCc1ccc(cc1)C#CCO Amb18792228 [0,2,0,0,0,0|1,0,1]=4 5600 B12R1.71 CCc1ccc(cc1)NCCF Amb24539836 [0,2,0,0,0,0|2,0,0]=4 5601 B12R1.71 CCc1ccc(cc1)OCC#C Amb18800356 [0,2,0,0,0,0|1,0,1]=4 5602 B12R1.71 CNc1ccc(cc1)OCC#C Amb18972060 [0,2,0,0,0,0|1,0,1]=4 5603 B12R1.71 CNc1ccc(cc1)OCC#N Amb18975190 [0,2,0,0,0,0|1,0,1]=4 5604 B12R1.71 CNc1ccc(cc1)OCC=C Amb19009330 [0,2,0,0,0,0|1,0,1]=4 5605 B12R1.71 CNc1ccc(cc1)OCCF Amb24487620 [0,2,0,0,0,0|1,0,0]=3 5606 B12R1.71 CNc1ccc(cc1)OCCN Amb23400492 [0,2,0,0,0,0|1,0,0]=3 5607 B12R1.71 CNc1ccc(cc1)OCCO Amb19008490 [0,2,0,0,0,0|0,0,0]=2 5608 B12R1.71 COCOc1ccc(C=O)cc1 Amb24103003 [0,2,0,0,0,0|2,0,0]=4 5609 B12R1.71 COCOc1ccc(cc1)C#C Amb22387889 [0,2,0,0,0,0|2,0,0]=4 5610 B12R1.71 COc1c[n]c(cc1)NCCO Amb24497791 [0,2,0,0,0,0|2,0,0]=4 5611 B12R1.71 COc1ccc(\C=N\CO)cc1 Amb25057794 [0,2,0,0,0,0|2,0,0]=4 5612 B12R1.71 COc1ccc(cc1)NCCF Amb24410912 [0,2,0,0,0,0|2,0,0]=4 5613 B12R1.71 COc1ccc(cc1)OCC#C Amb18800611 [0,2,0,0,0,0|1,0,1]=4 5614 B12R1.71 COc1ccc(cc1)SCCN Amb22051707 [0,2,0,0,0,0|1,1,0]=4 5615 B12R1.71 CSc1ccc(CCCN)cc1 Amb18055313 [0,2,0,0,0,0|2,0,0]=4 5616 B12R1.71 CSc1ccc(CCCO)cc1 Amb18863034 [0,2,0,0,0,0|1,0,0]=3 5617 B12R1.71 CSc1ccc(\C=C\CO)cc1 Amb25682133 [0,2,0,0,0,0|1,0,1]=4 5618 B12R1.71 CSc1ccc(cc1)C#CCO Amb25228424 [0,2,0,0,0,0|1,0,1]=4 5619 B12R1.71 CSc1ccc(cc1)NCCN Amb18243831 [0,2,0,0,0,0|2,0,0]=4 5620 B12R1.71 CSc1ccc(cc1)OCC#C Amb24638488 [0,2,0,0,0,0|1,0,1]=4 5621 B12R1.71 CSc1ccc(cc1)OCC#N Amb22523395 [0,2,0,0,0,0|1,0,1]=4 5622 B12R1.71 CSc1ccc(cc1)OCCCl Amb19148893 [0,2,0,0,0,0|1,0,0]=3 5623 B12R1.71 CSc1ccc(cc1)OCCF Amb22482423 [0,2,0,0,0,0|1,0,0]=3 5624 B12R1.71 ClCCCc1ccc(cc1)CC Amb17104530 [0,2,0,0,0,0|2,0,0]=4 5625 B12R1.71 ClCCNc1ccc(cc1)C#N Amb17335462 [0,2,0,0,0,0|2,0,0]=4 5626 B12R1.71 ClCCNc1ccc(cc1)CC Amb17335668 [0,2,0,0,0,0|2,0,0]=4 5627 B12R1.71 ClCCNc1ccc(cc1)OC Amb17335808 [0,2,0,0,0,0|2,0,0]=4 5628 B12R1.71 ClCCOc1ccc(cc1)OC Amb2446473 [0,2,0,0,0,0|1,0,0]=3 5629 B12R1.71 FCCOc1ccc(CBr)cc1 Amb23580154 [0,2,0,0,0,0|1,0,0]=3 5630 B12R1.71 N#Cc1ccc(CCCBr)cc1 Amb25851402 [0,2,0,0,0,0|2,0,0]=4 5631 B12R1.71 N#Cc1ccc(\C=C\CO)cc1 Amb25787543 [0,2,0,0,0,0|1,0,1]=4 5632 B12R1.71 N#Cc1ccc(c[n]1)SCCO Amb24421951 [0,2,0,0,0,0|1,1,0]=4 5633 B12R1.71 N#Cc1ccc(cc1)OCC=O Amb18800495 [0,2,0,0,0,0|0,0,2]=4 5634 B12R1.71 N#Cc1ccc(cc1)OCCF Amb23579957 [0,2,0,0,0,0|1,0,0]=3 5635 B12R1.71 N#Cc1ccc(cc1)SCCF Amb24473476 [0,2,0,0,0,0|1,1,0]=4 5636 B12R1.71 NCCCc1ccc(cc1)C#N Amb25708502 [0,2,0,0,0,0|2,0,0]=4 5637 B12R1.71 NCCCc1ccc(cc1)CO Amb17477572 [0,2,0,0,0,0|2,0,0]=4 5638 B12R1.71 NCCCc1ccc(cc1)OC Amb1092530 [0,2,0,0,0,0|2,0,0]=4 5639 B12R1.71 NCCCc1ccc(cc1)OC Amb13949143 [0,2,0,0,0,0|2,0,0]=4 5640 B12R1.71 NCCNc1ccc(CO)cc1 Amb25719187 [0,2,0,0,0,0|2,0,0]=4 5641 B12R1.71 NCCNc1ccc(cc1)CC Amb17057758 [0,2,0,0,0,0|2,0,0]=4 5642 B12R1.71 NCCNc1ccc(cc1)OC Amb10604015 [0,2,0,0,0,0|2,0,0]=4 5643 B12R1.71 NCCOc1ccc(c[n]1)C#N Amb18988873 [0,2,0,0,0,0|2,0,0]=4 5644 B12R1.71 NCCOc1ccc(cc1)C#N Amb17562028 [0,2,0,0,0,0|1,0,0]=3 5645 B12R1.71 NCCOc1ccc(cc1)C#N Amb19374943 [0,2,0,0,0,0|1,0,0]=3 5646 B12R1.71 NCCOc1ccc(cc1)CC Amb1138492 [0,2,0,0,0,0|1,0,0]=3 5647 B12R1.71 NCCOc1ccc(cc1)OC Amb1063468 [0,2,0,0,0,0|1,0,0]=3 5648 B12R1.71 NCCOc1ccc(cc1)SC Amb10243213 [0,2,0,0,0,0|1,0,0]=3 5649 B12R1.71 NCCSc1ccc(cc1)C#N Amb18909077 [0,2,0,0,0,0|1,1,0]=4 5650 B12R1.71 NCCSc1ccc(cc1)CC Amb17083025 [0,2,0,0,0,0|1,1,0]=4 5651 B12R1.71 NCc1c[n]c(cc1)NCCO Amb19025110 [0,2,0,0,0,0|2,0,0]=4 5652 B12R1.71 NCc1ccc(CCCN)cc1 Amb22395124 [0,2,0,0,0,0|2,0,0]=4 5653 B12R1.71 NCc1ccc(CCCO)cc1 Amb23441994 [0,2,0,0,0,0|1,0,0]=3 5654 B12R1.71 NCc1ccc(c[n]1)NCCO Amb24634838 [0,2,0,0,0,0|2,0,0]=4 5655 B12R1.71 NCc1ccc(cc1)OCC#N Amb19373065 [0,2,0,0,0,0|1,0,1]=4 5656 B12R1.71 NCc1ccc(cc1)OCCBr Amb24094298 [0,2,0,0,0,0|1,0,0]=3 5657 B12R1.71 NCc1ccc(cc1)OCCF Amb23580153 [0,2,0,0,0,0|1,0,0]=3 5658 B12R1.71 NNc1ccc(cc1)OCCBr Amb20620464 [0,2,0,0,0,0|1,0,0]=3 5659 B12R1.71 O=Cc1ccc(cc1)NCCF Amb25178323 [0,2,0,0,0,0|2,0,0]=4 5660 B12R1.71 O=Cc1ccc(cc1)OCC#C Amb1880437 [0,2,0,0,0,0|1,0,1]=4 5661 B12R1.71 O=Cc1ccc(cc1)OCC#N Amb1214880 [0,2,0,0,0,0|1,0,1]=4 5662 B12R1.71 O=Cc1ccc(cc1)OCCF Amb23579953 [0,2,0,0,0,0|1,0,0]=3 5663 B12R1.71 OCC#Cc1ccc(CO)cc1 Amb18792413 [0,2,0,0,0,0|1,0,1]=4 5664 B12R1.71 OCCCc1ccc(C=O)cc1 Amb18646079 [0,2,0,0,0,0|1,0,0]=3 5665 B12R1.71 OCCCc1ccc(cc1)C#N Amb13883607 [0,2,0,0,0,0|1,0,0]=3 5666 B12R1.71 OCCCc1ccc(cc1)CC Amb17089498 [0,2,0,0,0,0|1,0,0]=3 5667 B12R1.71 OCCNc1ccc(C=O)c[n]1 Amb24083497 [0,2,0,0,0,0|2,0,0]=4 5668 B12R1.71 OCCOc1ccc(cc1)CN Amb13951489 [0,2,0,0,0,0|0,0,0]=2 5669 B12R1.71 OCCOc1ccc(cc1)OC Amb2209351 [0,2,0,0,0,0|0,0,0]=2 5670 B12R1.71 OCc1ccc(cc1)NCCCl Amb25257978 [0,2,0,0,0,0|2,0,0]=4 5671 B12R1.71 OCc1ccc(cc1)OCC=C Amb1111157 [0,2,0,0,0,0|1,0,1]=4 5672 B12R1.71 OCc1ccc(cc1)OCCCl Amb24094315 [0,2,0,0,0,0|1,0,0]=3 5673 B12R1.71 OCc1ccc(cc1)OCCF Amb23580002 [0,2,0,0,0,0|1,0,0]=3 5674 B12R1.71 SCCCc1ccc(cc1)CC Amb17400844 [0,2,0,0,0,0|1,1,0]=4 5675 B12R1.71 SCCCc1ccc(cc1)OC Amb17400951 [0,2,0,0,0,0|1,1,0]=4 5676 B12R1.71 SCCOc1ccc(cc1)CC Amb17233943 [0,2,0,0,0,0|0,1,0]=3 5677 B12R1.385 BrCCCc1cc(Br)c(Br)cc1 Amb24579120 [0,2,0,0,0,0|2,0,0]=4 5678 B12R1.385 BrCCOc1ccc(c(c1)Cl)Cl Amb17274514 [0,2,0,0,0,0|1,0,0]=3 5679 B12R1.385 Brc1ccc(CCCBr)cc1I Amb24651202 [0,2,0,0,0,0|2,0,0]=4 5680 B12R1.385 C#CCOc1cc(Cl)c(Cl)cc1 Amb18333165 [0,2,0,0,0,0|1,0,1]=4 5681 B12R1.385 C#CCOc1cc(F)c(F)cc1 Amb18788730 [0,2,0,0,0,0|1,0,1]=4 5682 B12R1.385 C#CCOc1ccc(Cl)c(F)c1 Amb25077358 [0,2,0,0,0,0|1,0,1]=4 5683 B12R1.385 C#CCOc1ccc(F)c(Cl)c1 Amb24359417 [0,2,0,0,0,0|1,0,1]=4 5684 B12R1.385 C#CCOc1ccc(I)c(Cl)c1 Amb24569807 [0,2,0,0,0,0|1,0,1]=4 5685 B12R1.385 C#CCOc1ccc(N)c(Cl)c1 Amb18809681 [0,2,0,0,0,0|1,0,1]=4 5686 B12R1.385 C#CCOc1ccc(N)c(F)c1 Amb18286189 [0,2,0,0,0,0|1,0,1]=4 5687 B12R1.385 C=CCOc1cc(Cl)c(Cl)cc1 Amb24361907 [0,2,0,0,0,0|1,0,1]=4 5688 B12R1.385 C=CCOc1cc(F)c(F)cc1 Amb24082974 [0,2,0,0,0,0|1,0,1]=4 5689 B12R1.385 C=CCOc1cc(N)c(N)cc1 Amb24377079 [0,2,0,0,0,0|1,0,1]=4 5690 B12R1.385 C=CCOc1ccc(Br)c(N)c1 Amb23555853 [0,2,0,0,0,0|1,0,1]=4 5691 B12R1.385 C=CCOc1ccc(Cl)c(F)c1 Amb25783253 [0,2,0,0,0,0|1,0,1]=4 5692 B12R1.385 C=CCOc1ccc(F)c(Br)c1 Amb25328171 [0,2,0,0,0,0|1,0,1]=4 5693 B12R1.385 C=CCOc1ccc(F)c(Cl)c1 Amb24543710 [0,2,0,0,0,0|1,0,1]=4 5694 B12R1.385 C=CCOc1ccc(N)c(Cl)c1 Amb18991661 [0,2,0,0,0,0|1,0,1]=4 5695 B12R1.385 C=CCOc1ccc(N)c(F)c1 Amb18991658 [0,2,0,0,0,0|1,0,1]=4 5696 B12R1.385 C=CCOc1ccc(O)c(N)c1 Amb25055173 [0,2,0,0,0,0|1,0,1]=4 5697 B12R1.385 C=CCOc1ccc(c(c1)C)N Amb17138560 [0,2,0,0,0,0|1,0,1]=4 5698 B12R1.385 C=CCOc1ccc(c(c1)N)C Amb17138559 [0,2,0,0,0,0|1,0,1]=4 5699 B12R1.385 C=CCOc1ccc(c(c1)N)Cl Amb17139076 [0,2,0,0,0,0|1,0,1]=4 5700 B12R1.385 CC1=CN(CCCO)C=CC1=O Amb25129952 [0,2,0,0,0,0|2,0,0]=4 5701 B12R1.385 CCCCc1cc(Br)c(Br)cc1 Amb19944055 [0,2,0,0,0,0|2,0,0]=4 5702 B12R1.385 CCCCc1cc(N)c(N)cc1 Amb18646137 [0,2,0,0,0,0|2,0,0]=4 5703 B12R1.385 CCCCc1cc(N)c(N)cc1 Amb20247546 [0,2,0,0,0,0|2,0,0]=4 5704 B12R1.385 CCCCc1cc(O)c(O)cc1 Amb22167996 [0,2,0,0,0,0|2,0,0]=4 5705 B12R1.385 CCCCc1ccc(Cl)c(Br)c1 Amb19944056 [0,2,0,0,0,0|2,0,0]=4 5706 B12R1.385 CCCCc1ccc(I)c(Br)c1 Amb19944054 [0,2,0,0,0,0|2,0,0]=4 5707 B12R1.385 CCCCc1ccc(N)c(Br)c1 Amb19944049 [0,2,0,0,0,0|2,0,0]=4 5708 B12R1.385 CCCCc1ccc(N)c(Br)c1 Amb23517949 [0,2,0,0,0,0|2,0,0]=4 5709 B12R1.385 CCCCc1ccc(N)c(F)c1 Amb25351578 [0,2,0,0,0,0|2,0,0]=4 5710 B12R1.385 CCCCc1ccc(N)c(S)c1 Amb18939301 [0,2,0,0,0,0|2,0,0]=4 5711 B12R1.385 CCCCc1ccc(O)c(Br)c1 Amb20620414 [0,2,0,0,0,0|2,0,0]=4 5712 B12R1.385 CCCCc1ccc(O)c(F)c1 Amb24091337 [0,2,0,0,0,0|2,0,0]=4 5713 B12R1.385 CCCCc1ccc(O)c(N)c1 Amb24331679 [0,2,0,0,0,0|2,0,0]=4 5714 B12R1.385 CCCNc1cc(Br)c(Cl)cc1 Amb24487633 [0,2,0,0,0,0|2,0,0]=4 5715 B12R1.385 CCCNc1cc(Br)c(I)cc1 Amb24493642 [0,2,0,0,0,0|2,0,0]=4 5716 B12R1.385 CCCNc1ccc(c(c1)Br)C Amb17142401 [0,2,0,0,0,0|2,0,0]=4 5717 B12R1.385 CCCOc1c[n]c(Cl)c(F)c1 Amb25140972 [0,2,0,0,0,0|2,0,0]=4 5718 B12R1.385 CCCOc1cc(Br)c(N)cc1 Amb23556483 [0,2,0,0,0,0|1,0,0]=3 5719 B12R1.385 CCCOc1cc(Cl)c(Cl)cc1 Amb24450826 [0,2,0,0,0,0|1,0,0]=3 5720 B12R1.385 CCCOc1cc(Cl)c(N)cc1 Amb18986395 [0,2,0,0,0,0|1,0,0]=3 5721 B12R1.385 CCCOc1cc(Cl)c(O)cc1 Amb18556110 [0,2,0,0,0,0|1,0,0]=3 5722 B12R1.385 CCCOc1cc(F)c(Br)cc1 Amb22490083 [0,2,0,0,0,0|1,0,0]=3 5723 B12R1.385 CCCOc1cc(F)c(F)cc1 Amb25816178 [0,2,0,0,0,0|1,0,0]=3 5724 B12R1.385 CCCOc1cc(F)c(N)cc1 Amb18980926 [0,2,0,0,0,0|1,0,0]=3 5725 B12R1.385 CCCOc1cc(N)c(Br)c[n]1 Amb24320371 [0,2,0,0,0,0|2,0,0]=4 5726 B12R1.385 CCCOc1cc(N)c(Br)cc1 Amb23555865 [0,2,0,0,0,0|1,0,0]=3 5727 B12R1.385 CCCOc1cc(N)c(I)cc1 Amb23505543 [0,2,0,0,0,0|1,0,0]=3 5728 B12R1.385 CCCOc1cc(N)c(O)cc1 Amb18056091 [0,2,0,0,0,0|1,0,0]=3 5729 B12R1.385 CCCOc1cc(N)c(S)cc1 Amb18939266 [0,2,0,0,0,0|1,0,0]=3 5730 B12R1.385 CCCOc1cc(O)c(O)cc1 Amb18055901 [0,2,0,0,0,0|1,0,0]=3 5731 B12R1.385 CCCOc1cc(S)c(N)cc1 Amb18939289 [0,2,0,0,0,0|1,0,0]=3 5732 B12R1.385 CCCOc1ccc(N)c(N)[n]1 Amb25694490 [0,2,0,0,0,0|2,0,0]=4 5733 B12R1.385 CCCOc1ccc(c(c1)C)N Amb1134107 [0,2,0,0,0,0|1,0,0]=3 5734 B12R1.385 CCCOc1ccc(c(c1)N)C Amb17138590 [0,2,0,0,0,0|1,0,0]=3 5735 B12R1.385 CCCOc1ccc(c(c1)N)Cl Amb17139123 [0,2,0,0,0,0|1,0,0]=3 5736 B12R1.385 CCCSc1cc(Cl)c(F)cc1 Amb25795992 [0,2,0,0,0,0|1,1,0]=4 5737 B12R1.385 CCCSc1cc(Cl)c(N)cc1 Amb24537858 [0,2,0,0,0,0|1,1,0]=4 5738 B12R1.385 CCCSc1cc(Cl)c(O)cc1 Amb24497361 [0,2,0,0,0,0|1,1,0]=4 5739 B12R1.385 CCCSc1cc(N)c(N)cc1 Amb18648679 [0,2,0,0,0,0|1,1,0]=4 5740 B12R1.385 CN1C=CC(=CC1=O)NCCO Amb25031204 [0,2,0,0,0,0|2,0,0]=4 5741 B12R1.385 CN1C=CC(=CC1=O)SCCO Amb25031196 [0,2,0,0,0,0|1,1,0]=4 5742 B12R1.385 COCOc1ccc(Cl)c(Cl)c1 Amb25072018 [0,2,0,0,0,0|2,0,0]=4 5743 B12R1.385 COCOc1ccc(F)c(Br)c1 Amb24392676 [0,2,0,0,0,0|2,0,0]=4 5744 B12R1.385 COCOc1ccc(F)c(Cl)c1 Amb25078774 [0,2,0,0,0,0|2,0,0]=4 5745 B12R1.385 COCOc1ccc(F)c(F)c1 Amb22641749 [0,2,0,0,0,0|2,0,0]=4 5746 B12R1.385 COCOc1ccc(O)c(Cl)c1 Amb25315981 [0,2,0,0,0,0|2,0,0]=4 5747 B12R1.385 CSCOc1cc(N)c(N)cc1 Amb25751531 [0,2,0,0,0,0|2,0,0]=4 5748 B12R1.385 CSCOc1ccc(Cl)c(F)c1 Amb25830423 [0,2,0,0,0,0|2,0,0]=4 5749 B12R1.385 CSCOc1ccc(F)c(Br)c1 Amb25162717 [0,2,0,0,0,0|2,0,0]=4 5750 B12R1.385 CSCOc1ccc(I)c(Br)c1 Amb25067041 [0,2,0,0,0,0|2,0,0]=4 5751 B12R1.385 Cc1[n][n]c(cc1C)OCCO Amb25160461 [0,2,0,0,0,0|2,0,0]=4 5752 B12R1.385 Cc1[n]c(ccc1Br)OCCC Amb19959831 [0,2,0,0,0,0|2,0,0]=4 5753 B12R1.385 Cc1[n]c(ccc1Br)OCCO Amb24746555 [0,2,0,0,0,0|1,0,0]=3 5754 B12R1.385 Cc1[n]c(ccc1Br)SCCO Amb24453711 [0,2,0,0,0,0|1,1,0]=4 5755 B12R1.385 Cc1[n]c(ccc1N)OCCO Amb25793927 [0,2,0,0,0,0|1,0,0]=3 5756 B12R1.385 Cc1[n]cc(CCCO)cc1O Amb18646741 [0,2,0,0,0,0|2,0,0]=4 5757 B12R1.385 Cc1cc(CCCBr)ccc1C Amb24488677 [0,2,0,0,0,0|2,0,0]=4 5758 B12R1.385 Cc1cc(CCCBr)ccc1O Amb24527963 [0,2,0,0,0,0|2,0,0]=4 5759 B12R1.385 Cc1cc(CCCC)ccc1O Amb24403254 [0,2,0,0,0,0|2,0,0]=4 5760 B12R1.385 Cc1cc(CCCCl)ccc1Br Amb24566578 [0,2,0,0,0,0|2,0,0]=4 5761 B12R1.385 Cc1cc(CCCCl)ccc1C Amb18325208 [0,2,0,0,0,0|2,0,0]=4 5762 B12R1.385 Cc1cc(CCCCl)ccc1F Amb25841123 [0,2,0,0,0,0|2,0,0]=4 5763 B12R1.385 Cc1cc(CCCCl)ccc1I Amb24605295 [0,2,0,0,0,0|2,0,0]=4 5764 B12R1.385 Cc1cc(CCCCl)ccc1O Amb24637062 [0,2,0,0,0,0|2,0,0]=4 5765 B12R1.385 Cc1cc(CCCCl)ccc1S Amb25217669 [0,2,0,0,0,0|2,0,0]=4 5766 B12R1.385 Cc1cc(CCCN)ccc1Cl Amb18554358 [0,2,0,0,0,0|2,0,0]=4 5767 B12R1.385 Cc1cc(CCCO)c[n]c1C Amb25770809 [0,2,0,0,0,0|2,0,0]=4 5768 B12R1.385 Cc1cc(CCCO)ccc1Cl Amb24465130 [0,2,0,0,0,0|1,0,0]=3 5769 B12R1.385 Cc1cc(CCCO)ccc1F Amb18862775 [0,2,0,0,0,0|1,0,0]=3 5770 B12R1.385 Cc1cc(CCCO)ccc1O Amb24624666 [0,2,0,0,0,0|1,0,0]=3 5771 B12R1.385 Cc1cc(CCCS)ccc1C Amb25198296 [0,2,0,0,0,0|1,1,0]=4 5772 B12R1.385 Cc1cc(NCCO)[n]cc1Br Amb21958720 [0,2,0,0,0,0|2,0,0]=4 5773 B12R1.385 Cc1cc(NCCO)ncc1N Amb17213742 [0,2,0,0,0,0|2,0,0]=4 5774 B12R1.385 Cc1cc([n]cc1Br)OCCC Amb24525541 [0,2,0,0,0,0|2,0,0]=4 5775 B12R1.385 Cc1cc([n]cc1Br)OCCO Amb25779768 [0,2,0,0,0,0|1,0,0]=3 5776 B12R1.385 Cc1cc([n]cc1N)OCCO Amb24668511 [0,2,0,0,0,0|1,0,0]=3 5777 B12R1.385 Cc1cc(\C=C\CO)ccc1Br Amb25133361 [0,2,0,0,0,0|1,0,1]=4 5778 B12R1.385 Cc1cc(ccc1Br)OCC#C Amb25847165 [0,2,0,0,0,0|1,0,1]=4 5779 B12R1.385 Cc1cc(ccc1Br)OCCBr Amb24749067 [0,2,0,0,0,0|1,0,0]=3 5780 B12R1.385 Cc1cc(ccc1Br)OCCC Amb22001434 [0,2,0,0,0,0|1,0,0]=3 5781 B12R1.385 Cc1cc(ccc1Br)OCCF Amb25136415 [0,2,0,0,0,0|1,0,0]=3 5782 B12R1.385 Cc1cc(ccc1Br)OCCO Amb24493152 [0,2,0,0,0,0|0,0,0]=2 5783 B12R1.385 Cc1cc(ccc1Br)OCCS Amb25058697 [0,2,0,0,0,0|0,1,0]=3 5784 B12R1.385 Cc1cc(ccc1Br)OCOC Amb24493202 [0,2,0,0,0,0|2,0,0]=4 5785 B12R1.385 Cc1cc(ccc1Br)SCCN Amb24354309 [0,2,0,0,0,0|1,1,0]=4 5786 B12R1.385 Cc1cc(ccc1C)C#CCO Amb18792229 [0,2,0,0,0,0|1,0,1]=4 5787 B12R1.385 Cc1cc(ccc1C)OCC#C Amb18183414 [0,2,0,0,0,0|1,0,1]=4 5788 B12R1.385 Cc1cc(ccc1C)SCCF Amb25160818 [0,2,0,0,0,0|1,1,0]=4 5789 B12R1.385 Cc1cc(ccc1C)SCCS Amb24532624 [0,2,0,0,0,0|0,2,0]=4 5790 B12R1.385 Cc1cc(ccc1Cl)C#CCO Amb25715888 [0,2,0,0,0,0|1,0,1]=4 5791 B12R1.385 Cc1cc(ccc1Cl)OCC#C Amb18186754 [0,2,0,0,0,0|1,0,1]=4 5792 B12R1.385 Cc1cc(ccc1Cl)OCC=C Amb25283208 [0,2,0,0,0,0|1,0,1]=4 5793 B12R1.385 Cc1cc(ccc1Cl)OCOC Amb25697480 [0,2,0,0,0,0|2,0,0]=4 5794 B12R1.385 Cc1cc(ccc1F)C#CCO Amb18792547 [0,2,0,0,0,0|1,0,1]=4 5795 B12R1.385 Cc1cc(ccc1F)NCCC Amb18792942 [0,2,0,0,0,0|2,0,0]=4 5796 B12R1.385 Cc1cc(ccc1F)NCCF Amb25738928 [0,2,0,0,0,0|2,0,0]=4 5797 B12R1.385 Cc1cc(ccc1F)NCCN Amb18299162 [0,2,0,0,0,0|2,0,0]=4 5798 B12R1.385 Cc1cc(ccc1F)NCCO Amb18301456 [0,2,0,0,0,0|1,0,0]=3 5799 B12R1.385 Cc1cc(ccc1F)OCC#N Amb25266473 [0,2,0,0,0,0|1,0,1]=4 5800 B12R1.385 Cc1cc(ccc1F)OCC=C Amb24591308 [0,2,0,0,0,0|1,0,1]=4 5801 B12R1.385 Cc1cc(ccc1F)OCCF Amb24683532 [0,2,0,0,0,0|1,0,0]=3 5802 B12R1.385 Cc1cc(ccc1F)OCCN Amb18893580 [0,2,0,0,0,0|1,0,0]=3 5803 B12R1.385 Cc1cc(ccc1F)OCCS Amb25722565 [0,2,0,0,0,0|0,1,0]=3 5804 B12R1.385 Cc1cc(ccc1I)OCC#C Amb25160178 [0,2,0,0,0,0|1,0,1]=4 5805 B12R1.385 Cc1cc(ccc1N)NCCF Amb24375199 [0,2,0,0,0,0|2,0,0]=4 5806 B12R1.385 Cc1cc(ccc1N)NCCN Amb18298683 [0,2,0,0,0,0|2,0,0]=4 5807 B12R1.385 Cc1cc(ccc1N)OCC#C Amb18961931 [0,2,0,0,0,0|1,0,1]=4 5808 B12R1.385 Cc1cc(ccc1N)OCCF Amb23579996 [0,2,0,0,0,0|1,0,0]=3 5809 B12R1.385 Cc1cc(ccc1N)OCCN Amb18908681 [0,2,0,0,0,0|1,0,0]=3 5810 B12R1.385 Cc1cc(ccc1N)OCOC Amb25342621 [0,2,0,0,0,0|2,0,0]=4 5811 B12R1.385 Cc1cc(ccc1N)SCCF Amb25827423 [0,2,0,0,0,0|1,1,0]=4 5812 B12R1.385 Cc1cc(ccc1N)SCCN Amb24627532 [0,2,0,0,0,0|1,1,0]=4 5813 B12R1.385 Cc1cc(ccc1O)OCCC Amb18055364 [0,2,0,0,0,0|1,0,0]=3 5814 B12R1.385 Cc1ccc(CCCBr)cc1Br Amb24339560 [0,2,0,0,0,0|2,0,0]=4 5815 B12R1.385 Cc1ccc(CCCBr)cc1Cl Amb25130714 [0,2,0,0,0,0|2,0,0]=4 5816 B12R1.385 Cc1ccc(CCCBr)cc1I Amb25207303 [0,2,0,0,0,0|2,0,0]=4 5817 B12R1.385 Cc1ccc(CCCC)cc1N Amb24071080 [0,2,0,0,0,0|2,0,0]=4 5818 B12R1.385 Cc1ccc(CCCCl)cc1Cl Amb24720204 [0,2,0,0,0,0|2,0,0]=4 5819 B12R1.385 Cc1ccc(CCCCl)cc1F Amb25152290 [0,2,0,0,0,0|2,0,0]=4 5820 B12R1.385 Cc1ccc(CCCN)cc1F Amb22395115 [0,2,0,0,0,0|2,0,0]=4 5821 B12R1.385 Cc1ccc(CCCN)cc1N Amb25269801 [0,2,0,0,0,0|2,0,0]=4 5822 B12R1.385 Cc1ccc(CCCN)cc1O Amb25159897 [0,2,0,0,0,0|2,0,0]=4 5823 B12R1.385 Cc1ccc(CCCO)cc1Br Amb24664258 [0,2,0,0,0,0|1,0,0]=3 5824 B12R1.385 Cc1ccc(CCCO)cc1F Amb25265576 [0,2,0,0,0,0|1,0,0]=3 5825 B12R1.385 Cc1ccc(\C=C\CO)cc1Br Amb25331292 [0,2,0,0,0,0|1,0,1]=4 5826 B12R1.385 Cc1ccc(c[n+]1[O-])OCCC Amb25806351 [0,2,0,0,0,0|2,0,0]=4 5827 B12R1.385 Cc1ccc(cc1Br)NCCF Amb25859409 [0,2,0,0,0,0|2,0,0]=4 5828 B12R1.385 Cc1ccc(cc1Br)OCC#C Amb24706691 [0,2,0,0,0,0|1,0,1]=4 5829 B12R1.385 Cc1ccc(cc1Br)OCC=C Amb22896490 [0,2,0,0,0,0|1,0,1]=4 5830 B12R1.385 Cc1ccc(cc1Br)OCCF Amb25279224 [0,2,0,0,0,0|1,0,0]=3 5831 B12R1.385 Cc1ccc(cc1Br)OCCO Amb24738236 [0,2,0,0,0,0|0,0,0]=2 5832 B12R1.385 Cc1ccc(cc1Br)OCCS Amb24615125 [0,2,0,0,0,0|0,1,0]=3 5833 B12R1.385 Cc1ccc(cc1Br)OCOC Amb25272851 [0,2,0,0,0,0|2,0,0]=4 5834 B12R1.385 Cc1ccc(cc1Cl)C#CCO Amb25251769 [0,2,0,0,0,0|1,0,1]=4 5835 B12R1.385 Cc1ccc(cc1Cl)OCCN Amb23441775 [0,2,0,0,0,0|1,0,0]=3 5836 B12R1.385 Cc1ccc(cc1Cl)OCOC Amb25266302 [0,2,0,0,0,0|2,0,0]=4 5837 B12R1.385 Cc1ccc(cc1F)NCCF Amb25082185 [0,2,0,0,0,0|2,0,0]=4 5838 B12R1.385 Cc1ccc(cc1F)NCCN Amb18251976 [0,2,0,0,0,0|2,0,0]=4 5839 B12R1.385 Cc1ccc(cc1F)OCC#C Amb25060549 [0,2,0,0,0,0|1,0,1]=4 5840 B12R1.385 Cc1ccc(cc1F)OCC#N Amb25720857 [0,2,0,0,0,0|1,0,1]=4 5841 B12R1.385 Cc1ccc(cc1F)OCC=C Amb25816239 [0,2,0,0,0,0|1,0,1]=4 5842 B12R1.385 Cc1ccc(cc1F)OCCBr Amb24358276 [0,2,0,0,0,0|1,0,0]=3 5843 B12R1.385 Cc1ccc(cc1F)OCCN Amb24341985 [0,2,0,0,0,0|1,0,0]=3 5844 B12R1.385 Cc1ccc(cc1F)OCCO Amb25156896 [0,2,0,0,0,0|0,0,0]=2 5845 B12R1.385 Cc1ccc(cc1I)NCCF Amb24531465 [0,2,0,0,0,0|2,0,0]=4 5846 B12R1.385 Cc1ccc(cc1I)NCCN Amb25757086 [0,2,0,0,0,0|2,0,0]=4 5847 B12R1.385 Cc1ccc(cc1N)NCCC Amb18302069 [0,2,0,0,0,0|2,0,0]=4 5848 B12R1.385 Cc1ccc(cc1N)NCCF Amb25669796 [0,2,0,0,0,0|2,0,0]=4 5849 B12R1.385 Cc1ccc(cc1N)NCCN Amb18999842 [0,2,0,0,0,0|2,0,0]=4 5850 B12R1.385 Cc1ccc(cc1N)NCCO Amb18999456 [0,2,0,0,0,0|1,0,0]=3 5851 B12R1.385 Cc1ccc(cc1N)OCC#N Amb24068377 [0,2,0,0,0,0|1,0,1]=4 5852 B12R1.385 Cc1ccc(cc1N)OCCF Amb25188189 [0,2,0,0,0,0|1,0,0]=3 5853 B12R1.385 Cc1ccc(cc1N)OCCO Amb25805340 [0,2,0,0,0,0|0,0,0]=2 5854 B12R1.385 Cc1ccc(cc1N)SCCC Amb18791356 [0,2,0,0,0,0|1,1,0]=4 5855 B12R1.385 Cc1ccc(cc1N)SCCO Amb18302073 [0,2,0,0,0,0|0,1,0]=3 5856 B12R1.385 Cc1ccc(cc1O)NCCN Amb25755404 [0,2,0,0,0,0|2,0,0]=4 5857 B12R1.385 Cc1ccc(cc1O)OCCC Amb23568451 [0,2,0,0,0,0|1,0,0]=3 5858 B12R1.385 Cc1nc(NCCO)ccc1N Amb17213811 [0,2,0,0,0,0|2,0,0]=4 5859 B12R1.385 ClCCCc1ccc(Br)c(I)c1 Amb24651203 [0,2,0,0,0,0|2,0,0]=4 5860 B12R1.385 ClCCCc1ccc(c(c1)Cl)Cl Amb17477749 [0,2,0,0,0,0|2,0,0]=4 5861 B12R1.385 ClCCCc1ccc(c(c1)N)Cl Amb17477718 [0,2,0,0,0,0|2,0,0]=4 5862 B12R1.385 ClCCCc1ccc(c(c1)N)O Amb17477706 [0,2,0,0,0,0|2,0,0]=4 5863 B12R1.385 ClCCNc1ccc(c(c1)Br)C Amb17351914 [0,2,0,0,0,0|2,0,0]=4 5864 B12R1.385 ClCCNc1ccc(c(c1)C)Br Amb17351917 [0,2,0,0,0,0|2,0,0]=4 5865 B12R1.385 ClCCNc1ccc(c(c1)C)C Amb17335663 [0,2,0,0,0,0|2,0,0]=4 5866 B12R1.385 ClCCNc1ccc(c(c1)Cl)C Amb17338054 [0,2,0,0,0,0|2,0,0]=4 5867 B12R1.385 ClCCNc1ccc(c(c1)Cl)Cl Amb17343162 [0,2,0,0,0,0|2,0,0]=4 5868 B12R1.385 ClCCNc1ccc(c(c1)Cl)F Amb17338959 [0,2,0,0,0,0|2,0,0]=4 5869 B12R1.385 ClCCOc1ccc(c(c1)Cl)Cl Amb17247124 [0,2,0,0,0,0|1,0,0]=3 5870 B12R1.385 Clc1cc(CCCCl)ccc1I Amb24591038 [0,2,0,0,0,0|2,0,0]=4 5871 B12R1.385 Clc1cc(ccc1Br)OCCBr Amb24339406 [0,2,0,0,0,0|1,0,0]=3 5872 B12R1.385 Clc1cc(ccc1Br)OCCCl Amb24741085 [0,2,0,0,0,0|1,0,0]=3 5873 B12R1.385 Clc1ccc(CCCBr)cc1I Amb25376283 [0,2,0,0,0,0|2,0,0]=4 5874 B12R1.385 FCCNc1cc(Br)c(Cl)cc1 Amb25297749 [0,2,0,0,0,0|2,0,0]=4 5875 B12R1.385 FCCNc1cc(F)c(F)cc1 Amb25726274 [0,2,0,0,0,0|2,0,0]=4 5876 B12R1.385 FCCOc1cc(Br)c(I)cc1 Amb24498037 [0,2,0,0,0,0|1,0,0]=3 5877 B12R1.385 FCCOc1cc(Cl)c(Br)cc1 Amb24339421 [0,2,0,0,0,0|1,0,0]=3 5878 B12R1.385 Fc1cc(CCCBr)ccc1Cl Amb25046816 [0,2,0,0,0,0|2,0,0]=4 5879 B12R1.385 Fc1cc(CCCCl)ccc1Br Amb25351929 [0,2,0,0,0,0|2,0,0]=4 5880 B12R1.385 Fc1cc(CCCCl)ccc1Cl Amb24468477 [0,2,0,0,0,0|2,0,0]=4 5881 B12R1.385 Fc1cc(CCCCl)ccc1I Amb24598653 [0,2,0,0,0,0|2,0,0]=4 5882 B12R1.385 Fc1cc(ccc1Br)NCCF Amb25086182 [0,2,0,0,0,0|2,0,0]=4 5883 B12R1.385 Fc1cc(ccc1Cl)OCCBr Amb25244280 [0,2,0,0,0,0|1,0,0]=3 5884 B12R1.385 Fc1cc(ccc1Cl)OCCCl Amb25820212 [0,2,0,0,0,0|1,0,0]=3 5885 B12R1.385 Fc1cc(ccc1F)SCCS Amb25285175 [0,2,0,0,0,0|0,2,0]=4 5886 B12R1.385 Fc1ccc(CCCBr)cc1Br Amb25699797 [0,2,0,0,0,0|2,0,0]=4 5887 B12R1.385 Fc1ccc(CCCBr)cc1Cl Amb24638891 [0,2,0,0,0,0|2,0,0]=4 5888 B12R1.385 Fc1ccc(CCCBr)cc1S Amb25209552 [0,2,0,0,0,0|2,0,0]=4 5889 B12R1.385 Fc1ccc(CCCCl)cc1Br Amb24389703 [0,2,0,0,0,0|2,0,0]=4 5890 B12R1.385 Fc1ccc(CCCCl)cc1S Amb24640781 [0,2,0,0,0,0|2,0,0]=4 5891 B12R1.385 Fc1ccc(cc1Br)OCCCl Amb25104456 [0,2,0,0,0,0|1,0,0]=3 5892 B12R1.385 Fc1ccc(cc1Cl)NCCF Amb25156652 [0,2,0,0,0,0|2,0,0]=4 5893 B12R1.385 Fc1ccc(cc1Cl)OCCCl Amb24361601 [0,2,0,0,0,0|1,0,0]=3 5894 B12R1.385 Fc1ccc(cc1Cl)OCCF Amb24495913 [0,2,0,0,0,0|1,0,0]=3 5895 B12R1.385 Fc1ccc(cc1Cl)OCCS Amb25234561 [0,2,0,0,0,0|0,1,0]=3 5896 B12R1.385 Fc1ccc(cc1Cl)SCCF Amb24497847 [0,2,0,0,0,0|1,1,0]=4 5897 B12R1.385 N#CCOc1ccc(Br)c(Cl)c1 Amb24339420 [0,2,0,0,0,0|1,0,1]=4 5898 B12R1.385 N#CCOc1ccc(Br)c(F)c1 Amb24700032 [0,2,0,0,0,0|1,0,1]=4 5899 B12R1.385 N#CCOc1ccc(F)c(Cl)c1 Amb23116906 [0,2,0,0,0,0|1,0,1]=4 5900 B12R1.385 N#CCOc1ccc(I)c(Br)c1 Amb25145081 [0,2,0,0,0,0|1,0,1]=4 5901 B12R1.385 NC1=CN(CCCO)C=CC1=O Amb25141259 [0,2,0,0,0,0|2,0,0]=4 5902 B12R1.385 NCCCc1cc(O)c(O)cc1 Amb18827195 [0,2,0,0,0,0|2,0,0]=4 5903 B12R1.385 NCCCc1cc(O)c(O)cc1 Amb19516002 [0,2,0,0,0,0|2,0,0]=4 5904 B12R1.385 NCCCc1ccc(Br)c(Cl)c1 Amb25127779 [0,2,0,0,0,0|2,0,0]=4 5905 B12R1.385 NCCCc1ccc(Cl)c(Br)c1 Amb25331909 [0,2,0,0,0,0|2,0,0]=4 5906 B12R1.385 NCCCc1ccc(Cl)c(F)c1 Amb18821280 [0,2,0,0,0,0|2,0,0]=4 5907 B12R1.385 NCCCc1ccc(O)c(Br)c1 Amb24483621 [0,2,0,0,0,0|2,0,0]=4 5908 B12R1.385 NCCCc1ccc(c(c1)Br)C Amb17204536 [0,2,0,0,0,0|2,0,0]=4 5909 B12R1.385 NCCCc1ccc(c(c1)C)Br Amb17204539 [0,2,0,0,0,0|2,0,0]=4 5910 B12R1.385 NCCCc1ccc(c(c1)C)F Amb17232643 [0,2,0,0,0,0|2,0,0]=4 5911 B12R1.385 NCCCc1ccc(c(c1)Cl)C Amb17204338 [0,2,0,0,0,0|2,0,0]=4 5912 B12R1.385 NCCCc1ccc(c(c1)Cl)F Amb17204345 [0,2,0,0,0,0|2,0,0]=4 5913 B12R1.385 NCCCc1ccc(c(c1)Cl)O Amb17509068 [0,2,0,0,0,0|2,0,0]=4 5914 B12R1.385 NCCCc1ccc(c(c1)F)F Amb17204314 [0,2,0,0,0,0|2,0,0]=4 5915 B12R1.385 NCCCc1ccc(c(c1)N)Cl Amb17477697 [0,2,0,0,0,0|2,0,0]=4 5916 B12R1.385 NCCCc1ccc(c(c1)N)O Amb17477692 [0,2,0,0,0,0|2,0,0]=4 5917 B12R1.385 NCCNc1cc(Br)c(Cl)cc1 Amb24414229 [0,2,0,0,0,0|2,0,0]=4 5918 B12R1.385 NCCNc1cc(Br)c(F)cc1 Amb25327051 [0,2,0,0,0,0|2,0,0]=4 5919 B12R1.385 NCCNc1cc(Cl)c(Br)cc1 Amb24416528 [0,2,0,0,0,0|2,0,0]=4 5920 B12R1.385 NCCNc1cc(Cl)c(O)cc1 Amb25094658 [0,2,0,0,0,0|2,0,0]=4 5921 B12R1.385 NCCNc1cc(F)c(Cl)cc1 Amb18909784 [0,2,0,0,0,0|2,0,0]=4 5922 B12R1.385 NCCNc1cc(F)c(O)cc1 Amb25793339 [0,2,0,0,0,0|2,0,0]=4 5923 B12R1.385 NCCNc1cc(I)c(Br)cc1 Amb24408786 [0,2,0,0,0,0|2,0,0]=4 5924 B12R1.385 NCCNc1cc(N)c(N)cc1 Amb24543629 [0,2,0,0,0,0|2,0,0]=4 5925 B12R1.385 NCCNc1ccc(c(c1)Br)C Amb17091063 [0,2,0,0,0,0|2,0,0]=4 5926 B12R1.385 NCCNc1ccc(c(c1)C)Br Amb17091077 [0,2,0,0,0,0|2,0,0]=4 5927 B12R1.385 NCCNc1ccc(c(c1)C)C Amb17091052 [0,2,0,0,0,0|2,0,0]=4 5928 B12R1.385 NCCNc1ccc(c(c1)Cl)C Amb17091060 [0,2,0,0,0,0|2,0,0]=4 5929 B12R1.385 NCCNc1ccc(c(c1)Cl)Cl Amb17091080 [0,2,0,0,0,0|2,0,0]=4 5930 B12R1.385 NCCNc1ccc(c(c1)Cl)F Amb17057760 [0,2,0,0,0,0|2,0,0]=4 5931 B12R1.385 NCCNc1ccc(c(c1)F)F Amb17057762 [0,2,0,0,0,0|2,0,0]=4 5932 B12R1.385 NCCOc1cc(Br)c(Cl)cc1 Amb25251177 [0,2,0,0,0,0|1,0,0]=3 5933 B12R1.385 NCCOc1cc(Br)c(F)cc1 Amb24385803 [0,2,0,0,0,0|1,0,0]=3 5934 B12R1.385 NCCOc1cc(Cl)c(Cl)cc1 Amb21959595 [0,2,0,0,0,0|1,0,0]=3 5935 B12R1.385 NCCOc1cc(F)c(Cl)cc1 Amb25327059 [0,2,0,0,0,0|1,0,0]=3 5936 B12R1.385 NCCOc1cc(F)c(F)cc1 Amb19345444 [0,2,0,0,0,0|1,0,0]=3 5937 B12R1.385 NCCOc1cc(O)c(Cl)cc1 Amb25101621 [0,2,0,0,0,0|1,0,0]=3 5938 B12R1.385 NCCOc1ccc(c(c1)C)Cl Amb1090468 [0,2,0,0,0,0|1,0,0]=3 5939 B12R1.385 NCCOc1ccc(c(c1)Cl)F Amb2198114 [0,2,0,0,0,0|1,0,0]=3 5940 B12R1.385 NCCSc1ccc(c(c1)C)C Amb1105388 [0,2,0,0,0,0|1,1,0]=4 5941 B12R1.385 NCCSc1ccc(c(c1)C)Cl Amb17083044 [0,2,0,0,0,0|1,1,0]=4 5942 B12R1.385 NCCSc1ccc(c(c1)C)F Amb17083028 [0,2,0,0,0,0|1,1,0]=4 5943 B12R1.385 NCCSc1ccc(c(c1)Cl)Cl Amb17083030 [0,2,0,0,0,0|1,1,0]=4 5944 B12R1.385 Nc1cc(CCCBr)ccc1N Amb24537158 [0,2,0,0,0,0|2,0,0]=4 5945 B12R1.385 Nc1cc(CCCBr)ccc1O Amb25208684 [0,2,0,0,0,0|2,0,0]=4 5946 B12R1.385 Nc1cc(CCCCl)ccc1S Amb24707954 [0,2,0,0,0,0|2,0,0]=4 5947 B12R1.385 Nc1cc(ccc1Cl)OCCCl Amb25803611 [0,2,0,0,0,0|1,0,0]=3 5948 B12R1.385 Nc1cc(ccc1F)OCCCl Amb24693887 [0,2,0,0,0,0|1,0,0]=3 5949 B12R1.385 Nc1cc(ccc1N)NCCO Amb24468320 [0,2,0,0,0,0|1,0,0]=3 5950 B12R1.385 Nc1ccc(CCCBr)cc1F Amb24549379 [0,2,0,0,0,0|2,0,0]=4 5951 B12R1.385 Nc1ccc(CCCBr)cc1S Amb25217656 [0,2,0,0,0,0|2,0,0]=4 5952 B12R1.385 Nc1ccc(CCCCl)cc1Cl Amb24697078 [0,2,0,0,0,0|2,0,0]=4 5953 B12R1.385 Nc1ccc(CCCCl)cc1S Amb25275606 [0,2,0,0,0,0|2,0,0]=4 5954 B12R1.385 Nc1ccc([n]c1N)OCCO Amb25378486 [0,2,0,0,0,0|1,0,0]=3 5955 B12R1.385 Nc1ccc(cc1Cl)OCC#N Amb18284742 [0,2,0,0,0,0|1,0,1]=4 5956 B12R1.385 Nc1ccc(cc1Cl)OCCO Amb18295590 [0,2,0,0,0,0|0,0,0]=2 5957 B12R1.385 Nc1ccc(cc1Cl)SCCF Amb25075487 [0,2,0,0,0,0|1,1,0]=4 5958 B12R1.385 Nc1ccc(cc1Cl)SCCN Amb25303044 [0,2,0,0,0,0|1,1,0]=4 5959 B12R1.385 Nc1ccc(cc1F)OCC#N Amb18283491 [0,2,0,0,0,0|1,0,1]=4 5960 B12R1.385 Nc1ccc(cc1F)OCCF Amb25338875 [0,2,0,0,0,0|1,0,0]=3 5961 B12R1.385 Nc1ccc(cc1F)OCCO Amb18980930 [0,2,0,0,0,0|0,0,0]=2 5962 B12R1.385 Nc1ccc(cc1F)SCCN Amb24356894 [0,2,0,0,0,0|1,1,0]=4 5963 B12R1.385 O=CCOc1cc(F)c(F)cc1 Amb18807300 [0,2,0,0,0,0|0,0,2]=4 5964 B12R1.385 O=CCOc1ccc(Br)c(Cl)c1 Amb25138911 [0,2,0,0,0,0|0,0,2]=4 5965 B12R1.385 O=CCOc1ccc(Br)c(F)c1 Amb24429474 [0,2,0,0,0,0|0,0,2]=4 5966 B12R1.385 O=CCOc1ccc(F)c(Br)c1 Amb25314122 [0,2,0,0,0,0|0,0,2]=4 5967 B12R1.385 O=CCOc1ccc(F)c(Cl)c1 Amb18330026 [0,2,0,0,0,0|0,0,2]=4 5968 B12R1.385 O=CCOc1ccc(c(c1)C)Br Amb17099969 [0,2,0,0,0,0|0,0,2]=4 5969 B12R1.385 OCC#Cc1cc(Cl)c(F)cc1 Amb25308121 [0,2,0,0,0,0|1,0,1]=4 5970 B12R1.385 OCC#Cc1cc(F)c(Cl)cc1 Amb25728405 [0,2,0,0,0,0|1,0,1]=4 5971 B12R1.385 OCC=Cc1cc(Cl)c(Cl)cc1 Amb22488010 [0,2,0,0,0,0|1,0,1]=4 5972 B12R1.385 OCCCc1cc(F)c(F)cc1 Amb18224422 [0,2,0,0,0,0|1,0,0]=3 5973 B12R1.385 OCCCc1ccc(Cl)c(Br)c1 Amb23560508 [0,2,0,0,0,0|1,0,0]=3 5974 B12R1.385 OCCCc1ccc(F)c(Cl)c1 Amb18863384 [0,2,0,0,0,0|1,0,0]=3 5975 B12R1.385 OCCCc1ccc(c(c1)C)C Amb17605788 [0,2,0,0,0,0|1,0,0]=3 5976 B12R1.385 OCCCc1ccc(c(c1)Cl)Cl Amb17402982 [0,2,0,0,0,0|1,0,0]=3 5977 B12R1.385 OCCCc1ccc(c(c1)N)Cl Amb17477707 [0,2,0,0,0,0|1,0,0]=3 5978 B12R1.385 OCCCc1ccc(c(c1)N)O Amb17477699 [0,2,0,0,0,0|1,0,0]=3 5979 B12R1.385 OCCNc1cc(Br)c(I)cc1 Amb25310897 [0,2,0,0,0,0|1,0,0]=3 5980 B12R1.385 OCCNc1cc(F)c(Cl)cc1 Amb18294793 [0,2,0,0,0,0|1,0,0]=3 5981 B12R1.385 OCCNc1ccc(c(c1)Br)C Amb17307023 [0,2,0,0,0,0|1,0,0]=3 5982 B12R1.385 OCCNc1ccc(c(c1)Cl)F Amb17305858 [0,2,0,0,0,0|1,0,0]=3 5983 B12R1.385 OCCOC=1C=CN(O)C(=O)C1 Amb24749808 [0,2,0,0,0,0|1,0,0]=3 5984 B12R1.385 OCCOc1cc(Br)c(I)cc1 Amb25079767 [0,2,0,0,0,0|0,0,0]=2 5985 B12R1.385 OCCOc1cc(F)c(Cl)cc1 Amb24447177 [0,2,0,0,0,0|0,0,0]=2 5986 B12R1.385 OCCOc1cc(O)c(O)cc1 Amb22802397 [0,2,0,0,0,0|0,0,0]=2 5987 B12R1.385 OCCOc1ccc(c(c1)C)Cl Amb2209357 [0,2,0,0,0,0|0,0,0]=2 5988 B12R1.385 OCCOc1ccc(c(c1)Cl)Cl Amb17105031 [0,2,0,0,0,0|0,0,0]=2 5989 B12R1.385 OCCSc1cc(Cl)c(F)cc1 Amb24497956 [0,2,0,0,0,0|0,1,0]=3 5990 B12R1.385 OC\C=C/c1cc(O)c(O)cc1 Amb25271016 [0,2,0,0,0,0|1,0,1]=4 5991 B12R1.385 OC\C=C\C1=CC(=O)C(=O)C=C1 Amb24631190 [0,2,0,0,0,0|1,0,1]=4 5992 B12R1.385 OC\C=C\c1cc(Cl)c(Cl)cc1 Amb23442815 [0,2,0,0,0,0|1,0,1]=4 5993 B12R1.385 OC\C=C\c1cc(F)c(F)cc1 Amb23555608 [0,2,0,0,0,0|1,0,1]=4 5994 B12R1.385 OC\C=C\c1cc(O)c(O)cc1 Amb22583876 [0,2,0,0,0,0|1,0,1]=4 5995 B12R1.385 OC\C=C\c1ccc(Br)c(F)c1 Amb24438785 [0,2,0,0,0,0|1,0,1]=4 5996 B12R1.385 OC\C=C\c1ccc(Cl)c(Br)c1 Amb24452954 [0,2,0,0,0,0|1,0,1]=4 5997 B12R1.385 OC\C=C\c1ccc(Cl)c(F)c1 Amb25710181 [0,2,0,0,0,0|1,0,1]=4 5998 B12R1.385 Oc1cc(CCCBr)ccc1F Amb24640779 [0,2,0,0,0,0|2,0,0]=4 5999 B12R1.385 Oc1cc(CCCBr)ccc1O Amb25323902 [0,2,0,0,0,0|2,0,0]=4 6000 B12R1.385 Oc1cc(CCCCl)ccc1F Amb25209551 [0,2,0,0,0,0|2,0,0]=4 6001 B12R1.385 Oc1cc(CCCCl)ccc1I Amb24527864 [0,2,0,0,0,0|2,0,0]=4 6002 B12R1.385 Oc1ccc(CCCBr)cc1I Amb24598660 [0,2,0,0,0,0|2,0,0]=4 6003 B12R1.385 Oc1ccc(CCCBr)cc1S Amb25351801 [0,2,0,0,0,0|2,0,0]=4 6004 B12R1.385 Oc1ccc(CCCCl)cc1Cl Amb24638403 [0,2,0,0,0,0|2,0,0]=4 6005 B12R1.385 Oc1ccc(CCCO)cc1F Amb24378042 [0,2,0,0,0,0|1,0,0]=3 6006 B12R1.385 Oc1ccc(\C=C\CO)cc1Cl Amb18649022 [0,2,0,0,0,0|1,0,1]=4 6007 B12R1.385 Oc1ccc(\C=C\CO)cc1F Amb25274595 [0,2,0,0,0,0|1,0,1]=4 6008 B12R1.385 Oc1ccc(cc1Cl)OCCO Amb18650034 [0,2,0,0,0,0|0,0,0]=2 6009 B12R1.385 SCCOc1ccc(c(c1)C)Cl Amb17237591 [0,2,0,0,0,0|0,1,0]=3 6010 B12R1.385 SCCOc1ccc(c(c1)Cl)Cl Amb17245968 [0,2,0,0,0,0|0,1,0]=3 6011 B12R1.385 SCCOc1ccc(c(c1)F)F Amb17234882 [0,2,0,0,0,0|0,1,0]=3 6012 B12R1.385 SCCSc1cc(Cl)c(Cl)cc1 Amb24577231 [0,2,0,0,0,0|0,2,0]=4 6013 B12R1.385 Sc1cc(CCCCl)ccc1Cl Amb24610892 [0,2,0,0,0,0|2,0,0]=4 6014 B12R1.385 Sc1cc(CCCCl)ccc1S Amb25223374 [0,2,0,0,0,0|2,0,0]=4 6015 B12R1.385 Sc1ccc(CCCCl)cc1Cl Amb24591066 [0,2,0,0,0,0|2,0,0]=4 6016 B12R1.2259 OCCCC1(O)C=CC(=O)C=C1 Amb25768457 [0,2,0,0,0,0|1,0,1]=4 6017 B12R1.3 C#CC(CCO)c1ccccc1 Amb25369422 [0,2,0,0,0,0|1,0,0]=3 6018 B12R1.3 C=C\C(=C\CO)\c1ccccc1 Amb24619165 [0,2,0,0,0,0|1,0,1]=4 6019 B12R1.3 CCCC(=[N+]=[N-])c1ccccc1 Amb24095317 [0,2,0,0,0,0|2,0,0]=4 6020 B12R1.3 CCCC(CN)c1ccccc1 Amb22052580 [0,2,0,0,0,0|2,0,0]=4 6021 B12R1.3 CCCC(c1ccccc1)C=O Amb17594046 [0,2,0,0,0,0|2,0,0]=4 6022 B12R1.3 CCCC(c1ccccc1)CBr Amb17247626 [0,2,0,0,0,0|2,0,0]=4 6023 B12R1.3 CCCC(c1ccccc1)CCl Amb17233968 [0,2,0,0,0,0|2,0,0]=4 6024 B12R1.3 CCCC(c1ccccc1)CO Amb17232487 [0,2,0,0,0,0|2,0,0]=4 6025 B12R1.3 CCCC(c1ccccc1)NO Amb10605018 [0,2,0,0,0,0|2,0,0]=4 6026 B12R1.3 CCN(CCO)c1c[n]ccc1 Amb24098213 [0,2,0,0,0,0|2,0,0]=4 6027 B12R1.3 CCN(CCO)c1cc[n]cc1 Amb18792801 [0,2,0,0,0,0|2,0,0]=4 6028 B12R1.3 CC\C(=C\CO)\c1ccccc1 Amb25816528 [0,2,0,0,0,0|1,0,1]=4 6029 B12R1.3 CNC(CCO)c1ccccc1 Amb18563697 [0,2,0,0,0,0|1,0,0]=3 6030 B12R1.3 C\C=C(\CCN)/c1ccccc1 Amb25349495 [0,2,0,0,0,0|2,0,0]=4 6031 B12R1.3 C\C=C(\CCO)/c1ccccc1 Amb25256435 [0,2,0,0,0,0|1,0,0]=3 6032 B12R1.3 N#CC(CCCl)c1ccccc1 Amb18648314 [0,2,0,0,0,0|2,0,0]=4 6033 B12R1.3 N#CN(CCF)c1ccccc1 Amb25795104 [0,2,0,0,0,0|2,0,0]=4 6034 B12R1.3 N#CN(CCO)c1ccccc1 Amb24349826 [0,2,0,0,0,0|1,0,0]=3 6035 B12R1.3 NCCC(c1ccccc1)CN Amb1111605 [0,2,0,0,0,0|2,0,0]=4 6036 B12R1.3 NCCC(c1ccccc1)OC Amb17334641 [0,2,0,0,0,0|2,0,0]=4 6037 B12R1.3 NCCN(c1ccccc1)CC Amb1136918 [0,2,0,0,0,0|2,0,0]=4 6038 B12R1.3 NCC\C(=N\N)\c1ccccc1 Amb24427544 [0,2,0,0,0,0|2,0,0]=4 6039 B12R1.3 OCCC(c1ccccc1)C#N Amb17334526 [0,2,0,0,0,0|1,0,0]=3 6040 B12R1.3 OCCC(c1ccccc1)CC Amb17232488 [0,2,0,0,0,0|1,0,0]=3 6041 B12R1.3 OCCC(c1ccccn1)C#N Amb17334562 [0,2,0,0,0,0|2,0,0]=4 6042 B12R1.3 OCCC(c1cccnc1)C#N Amb17334563 [0,2,0,0,0,0|2,0,0]=4 6043 B12R1.3 OCCC(c1cccnc1)CN Amb17232607 [0,2,0,0,0,0|2,0,0]=4 6044 B12R1.3 OCCC(c1ccncc1)C#N Amb17334564 [0,2,0,0,0,0|2,0,0]=4 6045 B12R1.3 OCCN(c1ccccc1)CC Amb1208392 [0,2,0,0,0,0|1,0,0]=3 6046 B12R1.3 OCC\C(=N\O)\c1ccccc1 Amb24497634 [0,2,0,0,0,0|1,0,0]=3 6047 B12R1.3 OC\C=C(\CF)/c1ccccc1 Amb25769424 [0,2,0,0,0,0|1,0,1]=4 6048 B12R1.3 SCCN(c1ccccc1)CC Amb13881733 [0,2,0,0,0,0|1,1,0]=4 6049 B12R1.3 [C-]#[N+]C(CCO)c1ccccc1 Amb24431832 [0,2,0,0,0,0|1,0,0]=3 6050 B12R1.17 BrCCC(=O)c1cccc(c1)Br Amb17437897 [0,2,0,0,0,0|2,0,0]=4 6051 B12R1.17 C=C(CCO)c1cc(F)ccc1 Amb25098576 [0,2,0,0,0,0|1,0,0]=3 6052 B12R1.17 CC(CCBr)c1cccc(Cl)c1 Amb25751472 [0,2,0,0,0,0|2,0,0]=4 6053 B12R1.17 CCCC(=O)c1cc(I)ccc1 Amb24424807 [0,2,0,0,0,0|2,0,0]=4 6054 B12R1.17 CCCC(=O)c1cc(N)ccc1 Amb22730482 [0,2,0,0,0,0|2,0,0]=4 6055 B12R1.17 CCCC(=O)c1cc(O)ccc1 Amb24736503 [0,2,0,0,0,0|2,0,0]=4 6056 B12R1.17 CCCC(=O)c1cccc(c1)Br Amb17193987 [0,2,0,0,0,0|2,0,0]=4 6057 B12R1.17 CCCC(=O)c1cccc(c1)Cl Amb17198744 [0,2,0,0,0,0|2,0,0]=4 6058 B12R1.17 CCCC(=O)c1cccc(c1)F Amb17232581 [0,2,0,0,0,0|2,0,0]=4 6059 B12R1.17 CCCC(C)c1cccc(Br)c1 Amb25281341 [0,2,0,0,0,0|2,0,0]=4 6060 B12R1.17 CCCC(N)c1cc(O)ccc1 Amb24379131 [0,2,0,0,0,0|2,0,0]=4 6061 B12R1.17 CCCC(O)c1cc(I)ccc1 Amb25310854 [0,2,0,0,0,0|2,0,0]=4 6062 B12R1.17 CCCC(O)c1cc(N)ccc1 Amb25087129 [0,2,0,0,0,0|2,0,0]=4 6063 B12R1.17 CCCC(O)c1cc(O)ccc1 Amb24706852 [0,2,0,0,0,0|2,0,0]=4 6064 B12R1.17 CCCC(c1cccc(c1)Br)O Amb17248424 [0,2,0,0,0,0|2,0,0]=4 6065 B12R1.17 CCCC(c1cccc(c1)C)N Amb17232449 [0,2,0,0,0,0|2,0,0]=4 6066 B12R1.17 CCCC(c1cccc(c1)C)O Amb17232484 [0,2,0,0,0,0|2,0,0]=4 6067 B12R1.17 CCCC(c1cccc(c1)Cl)N Amb17234050 [0,2,0,0,0,0|2,0,0]=4 6068 B12R1.17 CCCC(c1cccc(c1)Cl)O Amb17234155 [0,2,0,0,0,0|2,0,0]=4 6069 B12R1.17 CCCC(c1cccc(c1)F)N Amb17232649 [0,2,0,0,0,0|2,0,0]=4 6070 B12R1.17 CCCC(c1cccc(c1)F)O Amb17232673 [0,2,0,0,0,0|2,0,0]=4 6071 B12R1.17 CCCN(C)c1cccc(Br)c1 Amb25154384 [0,2,0,0,0,0|2,0,0]=4 6072 B12R1.17 CCCN(C)c1cccc(F)c1 Amb25285140 [0,2,0,0,0,0|2,0,0]=4 6073 B12R1.17 CCCN(C)c1cccc(O)c1 Amb18646357 [0,2,0,0,0,0|2,0,0]=4 6074 B12R1.17 CCC[C@@H](N)c1cc(Br)ccc1 Amb25301508 [0,2,0,0,0,0|2,0,0]=4 6075 B12R1.17 CCC[C@@H](N)c1cc(Cl)ccc1 Amb24426769 [0,2,0,0,0,0|2,0,0]=4 6076 B12R1.17 CCC[C@@H](N)c1cc(F)ccc1 Amb25709212 [0,2,0,0,0,0|2,0,0]=4 6077 B12R1.17 CCC[C@@H](N)c1cc(O)ccc1 Amb25328595 [0,2,0,0,0,0|2,0,0]=4 6078 B12R1.17 CCC[C@@H](O)c1cc(Cl)ccc1 Amb25069848 [0,2,0,0,0,0|2,0,0]=4 6079 B12R1.17 CCC[C@H](N)c1cc(Br)ccc1 Amb24400381 [0,2,0,0,0,0|2,0,0]=4 6080 B12R1.17 CCC[C@H](O)c1cc(Br)ccc1 Amb25762439 [0,2,0,0,0,0|2,0,0]=4 6081 B12R1.17 CN(CCBr)c1cccc(Cl)c1 Amb25854316 [0,2,0,0,0,0|2,0,0]=4 6082 B12R1.17 CN(CCBr)c1cccc(F)c1 Amb22886711 [0,2,0,0,0,0|2,0,0]=4 6083 B12R1.17 CN(CCI)c1cccc(Br)c1 Amb25680335 [0,2,0,0,0,0|2,0,0]=4 6084 B12R1.17 CN(CCI)c1cccc(F)c1 Amb24732661 [0,2,0,0,0,0|2,0,0]=4 6085 B12R1.17 CN(CCI)c1cccc(O)c1 Amb24397741 [0,2,0,0,0,0|2,0,0]=4 6086 B12R1.17 CN(CCN)c1cc(Br)ccc1 Amb24525334 [0,2,0,0,0,0|2,0,0]=4 6087 B12R1.17 CN(CCN)c1cc(O)ccc1 Amb25804629 [0,2,0,0,0,0|2,0,0]=4 6088 B12R1.17 CN(CCO)c1c[n]cc(Br)c1 Amb23744740 [0,2,0,0,0,0|2,0,0]=4 6089 B12R1.17 CN(CCO)c1c[n]cc(N)c1 Amb25139848 [0,2,0,0,0,0|2,0,0]=4 6090 B12R1.17 CN(CCO)c1cc(Br)cc[n]1 Amb18160449 [0,2,0,0,0,0|2,0,0]=4 6091 B12R1.17 CN(CCO)c1cc(N)cc[n]1 Amb18981476 [0,2,0,0,0,0|2,0,0]=4 6092 B12R1.17 CN(CCO)c1cc[n]c(N)c1 Amb24644882 [0,2,0,0,0,0|2,0,0]=4 6093 B12R1.17 CN(CCO)c1cccc(Br)[n]1 Amb24683325 [0,2,0,0,0,0|2,0,0]=4 6094 B12R1.17 CN(CCO)c1cccc(Cl)[n]1 Amb21957698 [0,2,0,0,0,0|2,0,0]=4 6095 B12R1.17 CN(CCO)c1cccc(F)[n]1 Amb18789196 [0,2,0,0,0,0|2,0,0]=4 6096 B12R1.17 CN(CCO)c1cccc(N)[n]1 Amb25711550 [0,2,0,0,0,0|2,0,0]=4 6097 B12R1.17 C\C(=C\CO)\c1cccc(Br)c1 Amb25260939 [0,2,0,0,0,0|1,0,1]=4 6098 B12R1.17 Cc1cc([n]cc1)[C@@H](N)CCO Amb25667121 [0,2,0,0,0,0|2,0,0]=4 6099 B12R1.17 Cc1cc(c[n]c1)[C@H](N)CCO Amb24761431 [0,2,0,0,0,0|2,0,0]=4 6100 B12R1.17 Cc1cc(cc[n]1)C(N)CCO Amb25727723 [0,2,0,0,0,0|2,0,0]=4 6101 B12R1.17 Cc1cc(cc[n]1)N(C)CCO Amb25065009 [0,2,0,0,0,0|2,0,0]=4 6102 B12R1.17 Cc1cc(cc[n]1)[C@H](N)CCO Amb24419434 [0,2,0,0,0,0|2,0,0]=4 6103 B12R1.17 Cc1cc(ccc1)C(=C)CCO Amb25056805 [0,2,0,0,0,0|1,0,0]=3 6104 B12R1.17 Cc1cc(ccc1)C(=O)CCN Amb24700399 [0,2,0,0,0,0|2,0,0]=4 6105 B12R1.17 Cc1cc(ccc1)C(=O)CCO Amb25735228 [0,2,0,0,0,0|1,0,0]=3 6106 B12R1.17 Cc1cc(ccc1)C(Cl)CCO Amb24355343 [0,2,0,0,0,0|1,0,0]=3 6107 B12R1.17 Cc1cc(ccc1)C(F)CCN Amb25043004 [0,2,0,0,0,0|2,0,0]=4 6108 B12R1.17 Cc1cc(ccc1)C(O)CCCl Amb25725000 [0,2,0,0,0,0|2,0,0]=4 6109 B12R1.17 Cc1cc(ccc1)S(=O)CCCl Amb24428231 [0,2,0,0,0,0|1,1,0]=4 6110 B12R1.17 Cc1cc(ccc1)S(=O)CCN Amb18974528 [0,2,0,0,0,0|1,1,0]=4 6111 B12R1.17 Cc1cc(ccc1)[C@@H](N)CCO Amb19888371 [0,2,0,0,0,0|1,0,0]=3 6112 B12R1.17 Cc1cc(ccc1)[C@H](N)CCN Amb24612216 [0,2,0,0,0,0|2,0,0]=4 6113 B12R1.17 Cc1cc(ccc1)[C@H](N)CCO Amb19887706 [0,2,0,0,0,0|1,0,0]=3 6114 B12R1.17 Cc1cc[n]c(c1)N(C)CCO Amb18798583 [0,2,0,0,0,0|2,0,0]=4 6115 B12R1.17 Cc1cccc([n]1)C(N)CCO Amb24697663 [0,2,0,0,0,0|2,0,0]=4 6116 B12R1.17 Cc1cccc([n]1)N(C)CCO Amb18792800 [0,2,0,0,0,0|2,0,0]=4 6117 B12R1.17 Cc1cccc([n]1)[C@@H](N)CCO Amb24644867 [0,2,0,0,0,0|2,0,0]=4 6118 B12R1.17 Cc1cccc([n]1)[C@H](N)CCO Amb24487360 [0,2,0,0,0,0|2,0,0]=4 6119 B12R1.17 Cc1cccc(c1)N(C)CCF Amb25057274 [0,2,0,0,0,0|2,0,0]=4 6120 B12R1.17 Cc1cccc(c1)N(C)CCI Amb25802690 [0,2,0,0,0,0|2,0,0]=4 6121 B12R1.17 Cc1cccc(c1)[C@@H](C)CCO Amb25155793 [0,2,0,0,0,0|1,0,0]=3 6122 B12R1.17 Cc1cccc(c1)[C@@H](N)CCC Amb22746897 [0,2,0,0,0,0|2,0,0]=4 6123 B12R1.17 Cc1cccc(c1)[C@H](N)CCC Amb22298528 [0,2,0,0,0,0|2,0,0]=4 6124 B12R1.17 Cc1cccc(c1)[C@H](N)CCC Amb25328596 [0,2,0,0,0,0|2,0,0]=4 6125 B12R1.17 Cc1cccc(c1)\C(\C)=C/CO Amb25852937 [0,2,0,0,0,0|1,0,1]=4 6126 B12R1.17 ClCCC(=O)c1cccc(c1)Br Amb17351482 [0,2,0,0,0,0|2,0,0]=4 6127 B12R1.17 ClCCN(c1cccc(c1)Br)C Amb17351920 [0,2,0,0,0,0|2,0,0]=4 6128 B12R1.17 ClCCN(c1cccc(c1)C)C Amb17335671 [0,2,0,0,0,0|2,0,0]=4 6129 B12R1.17 ClCCN(c1cccc(c1)Cl)C Amb17338056 [0,2,0,0,0,0|2,0,0]=4 6130 B12R1.17 ClCCN(c1cccc(c1)F)C Amb17335953 [0,2,0,0,0,0|2,0,0]=4 6131 B12R1.17 NC(CCO)c1cc(Br)[n]cc1 Amb25805294 [0,2,0,0,0,0|2,0,0]=4 6132 B12R1.17 NC(CCO)c1cc(Br)cc[n]1 Amb24637813 [0,2,0,0,0,0|2,0,0]=4 6133 B12R1.17 NC(CCO)c1cc(Br)ccc1 Amb18990231 [0,2,0,0,0,0|1,0,0]=3 6134 B12R1.17 NC(CCO)c1cc(Cl)[n]cc1 Amb22296964 [0,2,0,0,0,0|2,0,0]=4 6135 B12R1.17 NC(CCO)c1cc(F)[n]cc1 Amb25324412 [0,2,0,0,0,0|2,0,0]=4 6136 B12R1.17 NC(CCO)c1cc(O)ccc1 Amb19887678 [0,2,0,0,0,0|1,0,0]=3 6137 B12R1.17 NC(CCO)c1cc(S)ccc1 Amb24655390 [0,2,0,0,0,0|1,0,0]=3 6138 B12R1.17 NCCC(=O)c1cc(Br)ccc1 Amb18121501 [0,2,0,0,0,0|2,0,0]=4 6139 B12R1.17 NCCC(O)c1cc(Br)ccc1 Amb18121493 [0,2,0,0,0,0|2,0,0]=4 6140 B12R1.17 NCCC(O)c1cc(I)ccc1 Amb24493265 [0,2,0,0,0,0|2,0,0]=4 6141 B12R1.17 NCCC(O)c1cc(O)ccc1 Amb18251885 [0,2,0,0,0,0|2,0,0]=4 6142 B12R1.17 NCCC(c1cccc(c1)C)C Amb17232450 [0,2,0,0,0,0|2,0,0]=4 6143 B12R1.17 NCCC(c1cccc(c1)C)O Amb17232540 [0,2,0,0,0,0|2,0,0]=4 6144 B12R1.17 NCCC(c1cccc(c1)Cl)C Amb17234051 [0,2,0,0,0,0|2,0,0]=4 6145 B12R1.17 NCCC(c1cccc(c1)Cl)O Amb17234260 [0,2,0,0,0,0|2,0,0]=4 6146 B12R1.17 NCCC(c1cccc(c1)F)C Amb17232650 [0,2,0,0,0,0|2,0,0]=4 6147 B12R1.17 NCCC(c1cccc(c1)F)O Amb17232697 [0,2,0,0,0,0|2,0,0]=4 6148 B12R1.17 NCCN(c1cccc(c1)Br)C Amb17059773 [0,2,0,0,0,0|2,0,0]=4 6149 B12R1.17 NCCN(c1cccc(c1)C)C Amb17059641 [0,2,0,0,0,0|2,0,0]=4 6150 B12R1.17 NCCN(c1cccc(c1)Cl)C Amb17059646 [0,2,0,0,0,0|2,0,0]=4 6151 B12R1.17 NCCN(c1cccc(c1)F)C Amb17059643 [0,2,0,0,0,0|2,0,0]=4 6152 B12R1.17 NCCS(=O)c1cc(Br)ccc1 Amb18301434 [0,2,0,0,0,0|1,1,0]=4 6153 B12R1.17 NCCS(=O)c1cc(Cl)ccc1 Amb18299921 [0,2,0,0,0,0|1,1,0]=4 6154 B12R1.17 NCCS(=O)c1cc(F)ccc1 Amb24487393 [0,2,0,0,0,0|1,1,0]=4 6155 B12R1.17 NCC[C@@H](N)c1cccc(Br)c1 Amb25314552 [0,2,0,0,0,0|2,0,0]=4 6156 B12R1.17 NCC[C@@H](N)c1cccc(Cl)c1 Amb25850090 [0,2,0,0,0,0|2,0,0]=4 6157 B12R1.17 NCC[C@@H](N)c1cccc(F)c1 Amb24610239 [0,2,0,0,0,0|2,0,0]=4 6158 B12R1.17 NCC[C@@H](O)c1cc(Cl)ccc1 Amb25105024 [0,2,0,0,0,0|2,0,0]=4 6159 B12R1.17 NCC[C@H](N)c1cccc(F)c1 Amb25230671 [0,2,0,0,0,0|2,0,0]=4 6160 B12R1.17 N[C@@H](CCO)c1c[n]cc(F)c1 Amb25048026 [0,2,0,0,0,0|2,0,0]=4 6161 B12R1.17 N[C@@H](CCO)c1cc(Br)[n]cc1 Amb24341990 [0,2,0,0,0,0|2,0,0]=4 6162 B12R1.17 N[C@@H](CCO)c1cc(Cl)ccc1 Amb19888404 [0,2,0,0,0,0|1,0,0]=3 6163 B12R1.17 N[C@@H](CCO)c1cc(F)ccc1 Amb19888379 [0,2,0,0,0,0|1,0,0]=3 6164 B12R1.17 N[C@@H](CCO)c1cc(O)[n]cc1 Amb24715791 [0,2,0,0,0,0|2,0,0]=4 6165 B12R1.17 N[C@@H](CCO)c1cc(O)c[n]c1 Amb25709599 [0,2,0,0,0,0|2,0,0]=4 6166 B12R1.17 N[C@@H](CCO)c1cc(O)ccc1 Amb19888375 [0,2,0,0,0,0|1,0,0]=3 6167 B12R1.17 N[C@@H](CCO)c1cc(O)ccc1 Amb19929578 [0,2,0,0,0,0|1,0,0]=3 6168 B12R1.17 N[C@@H](CCO)c1cc(S)ccc1 Amb24745621 [0,2,0,0,0,0|1,0,0]=3 6169 B12R1.17 N[C@@H](CCO)c1cccc(Br)[n]1 Amb25055651 [0,2,0,0,0,0|2,0,0]=4 6170 B12R1.17 N[C@@H](CCO)c1cccc(Cl)[n]1 Amb24460351 [0,2,0,0,0,0|2,0,0]=4 6171 B12R1.17 N[C@@H](CCO)c1cccc(O)[n]1 Amb24618184 [0,2,0,0,0,0|2,0,0]=4 6172 B12R1.17 N[C@H](CCO)c1c[n]cc(Br)c1 Amb25758880 [0,2,0,0,0,0|2,0,0]=4 6173 B12R1.17 N[C@H](CCO)c1cc(Br)ccc1 Amb19887619 [0,2,0,0,0,0|1,0,0]=3 6174 B12R1.17 N[C@H](CCO)c1cc(Br)ccc1 Amb19943918 [0,2,0,0,0,0|1,0,0]=3 6175 B12R1.17 N[C@H](CCO)c1cc(Cl)[n]cc1 Amb24488508 [0,2,0,0,0,0|2,0,0]=4 6176 B12R1.17 N[C@H](CCO)c1cc(Cl)ccc1 Amb19887652 [0,2,0,0,0,0|1,0,0]=3 6177 B12R1.17 N[C@H](CCO)c1cc(F)ccc1 Amb19887668 [0,2,0,0,0,0|1,0,0]=3 6178 B12R1.17 N[C@H](CCO)c1cc(F)ccc1 Amb19888995 [0,2,0,0,0,0|1,0,0]=3 6179 B12R1.17 N[C@H](CCO)c1cc(O)[n]cc1 Amb24433305 [0,2,0,0,0,0|2,0,0]=4 6180 B12R1.17 N[C@H](CCO)c1cc(O)c[n]c1 Amb25758090 [0,2,0,0,0,0|2,0,0]=4 6181 B12R1.17 N[C@H](CCO)c1cc(O)cc[n]1 Amb25119351 [0,2,0,0,0,0|2,0,0]=4 6182 B12R1.17 N[C@H](CCO)c1cc(O)ccc1 Amb19887679 [0,2,0,0,0,0|1,0,0]=3 6183 B12R1.17 N[C@H](CCO)c1cccc(Br)[n]1 Amb24483637 [0,2,0,0,0,0|2,0,0]=4 6184 B12R1.17 N[C@H](CCO)c1cccc(F)[n]1 Amb24341639 [0,2,0,0,0,0|2,0,0]=4 6185 B12R1.17 Nc1c[n]cc(c1)C(N)CCO Amb25152307 [0,2,0,0,0,0|2,0,0]=4 6186 B12R1.17 Nc1cc(cc[n]1)[C@@H](N)CCO Amb24655927 [0,2,0,0,0,0|2,0,0]=4 6187 B12R1.17 Nc1cc(cc[n]1)[C@H](N)CCO Amb24487135 [0,2,0,0,0,0|2,0,0]=4 6188 B12R1.17 Nc1cc[n]c(c1)[C@@H](N)CCO Amb24674058 [0,2,0,0,0,0|2,0,0]=4 6189 B12R1.17 Nc1cccc(c1)C(N)CCO Amb19929590 [0,2,0,0,0,0|1,0,0]=3 6190 B12R1.17 Nc1cccc(c1)C(N)CCO Amb22235814 [0,2,0,0,0,0|1,0,0]=3 6191 B12R1.17 Nc1cccc(c1)[C@H](N)CCO Amb19887593 [0,2,0,0,0,0|1,0,0]=3 6192 B12R1.17 O=C(CCBr)c1cccc(Cl)c1 Amb24483618 [0,2,0,0,0,0|2,0,0]=4 6193 B12R1.17 O=C(CCBr)c1cccc(F)c1 Amb25669661 [0,2,0,0,0,0|2,0,0]=4 6194 B12R1.17 O=C(CCBr)c1cccc(S)c1 Amb25312667 [0,2,0,0,0,0|2,0,0]=4 6195 B12R1.17 O=C(CCCl)c1cc(Cl)ccc1 Amb25742498 [0,2,0,0,0,0|2,0,0]=4 6196 B12R1.17 O=S(CCF)c1cc(F)ccc1 Amb24602311 [0,2,0,0,0,0|1,1,0]=4 6197 B12R1.17 OCCC(=O)c1cc(Cl)[n]cc1 Amb25156807 [0,2,0,0,0,0|2,0,0]=4 6198 B12R1.17 OCCC(Cl)c1cc(F)ccc1 Amb24444966 [0,2,0,0,0,0|1,0,0]=3 6199 B12R1.17 OCCC(O)c1cc[n]c(Cl)c1 Amb22298355 [0,2,0,0,0,0|2,0,0]=4 6200 B12R1.17 OCCC(O)c1cccc(Br)c1 Amb24513513 [0,2,0,0,0,0|1,0,0]=3 6201 B12R1.17 OCCC(O)c1cccc(F)c1 Amb24406026 [0,2,0,0,0,0|1,0,0]=3 6202 B12R1.17 OCCC(c1cccc(c1)C)C Amb17232501 [0,2,0,0,0,0|1,0,0]=3 6203 B12R1.17 OCCC(c1cccc(c1)C)N Amb17103954 [0,2,0,0,0,0|1,0,0]=3 6204 B12R1.17 OCCC(c1cccc(c1)Cl)C Amb17234166 [0,2,0,0,0,0|1,0,0]=3 6205 B12R1.17 OCCC(c1cccc(c1)Cl)N Amb2417047 [0,2,0,0,0,0|1,0,0]=3 6206 B12R1.17 OCCC(c1cccc(c1)F)C Amb17232674 [0,2,0,0,0,0|1,0,0]=3 6207 B12R1.17 OCCN(c1cccc(c1)Br)C Amb17344452 [0,2,0,0,0,0|1,0,0]=3 6208 B12R1.17 OCCN(c1cccc(c1)C)C Amb17334644 [0,2,0,0,0,0|1,0,0]=3 6209 B12R1.17 OCCN(c1cccc(c1)Cl)C Amb17335811 [0,2,0,0,0,0|1,0,0]=3 6210 B12R1.17 OCCN(c1cccc(c1)F)C Amb17334765 [0,2,0,0,0,0|1,0,0]=3 6211 B12R1.17 OCCS(=O)c1cc(F)ccc1 Amb24354278 [0,2,0,0,0,0|0,1,0]=3 6212 B12R1.17 OCC[C@@H](O)c1cccc(Cl)c1 Amb25049479 [0,2,0,0,0,0|1,0,0]=3 6213 B12R1.17 OCC[C@@H](O)c1cccc(F)c1 Amb24405405 [0,2,0,0,0,0|1,0,0]=3 6214 B12R1.17 OCNC(=O)c1cccc(Cl)c1 Amb24666791 [0,2,0,0,0,0|2,0,0]=4 6215 B12R1.17 ONCC(c1cccc(c1)Br)O Amb17345006 [0,2,0,0,0,0|2,0,0]=4 6216 B12R1.17 ONCC(c1cccc(c1)C)O Amb17334703 [0,2,0,0,0,0|2,0,0]=4 6217 B12R1.17 ONCC(c1cccc(c1)Cl)O Amb17335948 [0,2,0,0,0,0|2,0,0]=4 6218 B12R1.17 ONCC(c1cccc(c1)O)O Amb17334759 [0,2,0,0,0,0|2,0,0]=4 6219 B12R1.17 O[C@@H](CCCl)c1cc(Cl)ccc1 Amb24655785 [0,2,0,0,0,0|2,0,0]=4 6220 B12R1.17 Oc1cccc(c1)C(O)CCO Amb24430894 [0,2,0,0,0,0|1,0,0]=3 6221 B12R1.17 Oc1cccc(c1)[C@@H](O)CCO Amb24686857 [0,2,0,0,0,0|1,0,0]=3 6222 B12R1.17 Oc1cccc(c1)[C@H](O)CCO Amb25797566 [0,2,0,0,0,0|1,0,0]=3 6223 B12R1.30 BrCCCC(=O)c1ccccc1 Amb17247624 [0,2,0,0,0,0|2,0,0]=4 6224 B12R1.30 BrCC\C=C(\c1ccccc1)/C Amb17246875 [0,2,0,0,0,0|2,0,0]=4 6225 B12R1.30 C#CCCC(Cl)c1ccccc1 Amb25756186 [0,2,0,0,0,0|2,0,0]=4 6226 B12R1.30 C#CCCC(O)c1ccccc1 Amb18800360 [0,2,0,0,0,0|2,0,0]=4 6227 B12R1.30 C#CCOC(=O)c1ccccc1 Amb22001698 [0,2,0,0,0,0|1,0,1]=4 6228 B12R1.30 C=CCCC(N)c1ccccc1 Amb18126305 [0,2,0,0,0,0|2,0,0]=4 6229 B12R1.30 C=CCCN(c1ccccc1)C Amb10559130 [0,2,0,0,0,0|2,0,0]=4 6230 B12R1.30 CC(=C=CCO)c1ccccc1 Amb25855530 [0,2,0,0,0,0|1,0,1]=4 6231 B12R1.30 CC(C#CCO)c1ccccc1 Amb24457769 [0,2,0,0,0,0|1,0,1]=4 6232 B12R1.30 CC(CCC=C)c1ccccc1 Amb24062989 [0,2,0,0,0,0|2,0,0]=4 6233 B12R1.30 CC(CCCN)c1ccccc1 Amb18563593 [0,2,0,0,0,0|2,0,0]=4 6234 B12R1.30 CC(OCCO)c1ccccc1 Amb24103429 [0,2,0,0,0,0|0,0,0]=2 6235 B12R1.30 CCC/N=C(\C)c1ccccc1 Amb17779516 [0,2,0,0,0,0|2,0,0]=4 6236 B12R1.30 CCCCN(c1ccccc1)N Amb17226670 [0,2,0,0,0,0|2,0,0]=4 6237 B12R1.30 CCCNC(=N)c1ccccc1 Amb23447119 [0,2,0,0,0,0|2,0,0]=4 6238 B12R1.30 CCCNC(=S)c1ccccc1 Amb25827093 [0,2,0,0,0,0|2,0,0]=4 6239 B12R1.30 CCCNC(c1ccccc1)C Amb1833463 [0,2,0,0,0,0|2,0,0]=4 6240 B12R1.30 CCCOC(=O)c1cccnc1 Amb1958081 [0,2,0,0,0,0|2,0,0]=4 6241 B12R1.30 CCC\N=C(\Cl)/c1ccccc1 Amb25142394 [0,2,0,0,0,0|2,0,0]=4 6242 B12R1.30 CCNCC(N)c1ccccc1 Amb19009737 [0,2,0,0,0,0|2,0,0]=4 6243 B12R1.30 CCNCC(O)c1ccccc1 Amb22491734 [0,2,0,0,0,0|2,0,0]=4 6244 B12R1.30 CCNCC(c1ccccc1)C Amb2119469 [0,2,0,0,0,0|2,0,0]=4 6245 B12R1.30 CCOC[C@H](c1ccccc1)N Amb17061646 [0,2,0,0,0,0|2,0,0]=4 6246 B12R1.30 CN(OCC=C)c1ccccc1 Amb22366090 [0,2,0,0,0,0|1,0,1]=4 6247 B12R1.30 CN(c1ccccc1)CCC#C Amb10559135 [0,2,0,0,0,0|2,0,0]=4 6248 B12R1.30 CNCCC(=O)c1ccccc1 Amb11032366 [0,2,0,0,0,0|2,0,0]=4 6249 B12R1.30 CNCC[C@@H](O)c1ccccc1 Amb20240620 [0,2,0,0,0,0|2,0,0]=4 6250 B12R1.30 CNCC[C@@H](O)c1ccccc1 Amb22747753 [0,2,0,0,0,0|2,0,0]=4 6251 B12R1.30 COCCC(=O)c1ccccc1 Amb10602329 [0,2,0,0,0,0|1,0,0]=3 6252 B12R1.30 COCCC(O)c1ccccc1 Amb18788453 [0,2,0,0,0,0|1,0,0]=3 6253 B12R1.30 C[C@@H](OCC=O)c1ccccc1 Amb22896802 [0,2,0,0,0,0|0,0,2]=4 6254 B12R1.30 C[C@H]([NH2+]CCCl)c1ccccc1 Amb17773001 [0,2,0,0,0,0|2,0,0]=4 6255 B12R1.30 C\C(=C\CCCl)\c1ccccc1 Amb24394711 [0,2,0,0,0,0|2,0,0]=4 6256 B12R1.30 ClCCCC(=O)c1ccccc1 Amb1229841 [0,2,0,0,0,0|2,0,0]=4 6257 B12R1.30 ClCCCC(c1ccccc1)O Amb17194564 [0,2,0,0,0,0|2,0,0]=4 6258 B12R1.30 ClCCCN(c1ccccc1)C Amb17335669 [0,2,0,0,0,0|2,0,0]=4 6259 B12R1.30 ClCCNC(=O)c1ccccc1 Amb2414312 [0,2,0,0,0,0|2,0,0]=4 6260 B12R1.30 ClCCNC(c1ccccc1)C Amb10069614 [0,2,0,0,0,0|2,0,0]=4 6261 B12R1.30 ClCCNC(c1ccccc1)C Amb17335659 [0,2,0,0,0,0|2,0,0]=4 6262 B12R1.30 ClCC\C=C(\c1ccccc1)/C Amb17233775 [0,2,0,0,0,0|2,0,0]=4 6263 B12R1.30 Cl\C(=N/CCCl)\c1ccccc1 Amb25758706 [0,2,0,0,0,0|2,0,0]=4 6264 B12R1.30 ICCOC(=O)c1ccccc1 Amb16233230 [0,2,0,0,0,0|1,0,0]=3 6265 B12R1.30 N#CCCC(=O)c1ccccc1 Amb1672449 [0,2,0,0,0,0|2,0,0]=4 6266 B12R1.30 N#CCCC(Cl)c1ccccc1 Amb18648313 [0,2,0,0,0,0|2,0,0]=4 6267 B12R1.30 N#CCCS(=O)c1ccccc1 Amb18648265 [0,2,0,0,0,0|1,1,0]=4 6268 B12R1.30 N#CCC[C@H](O)c1ccccc1 Amb24466214 [0,2,0,0,0,0|2,0,0]=4 6269 B12R1.30 N=C(NCCF)c1ccccc1 Amb25351227 [0,2,0,0,0,0|2,0,0]=4 6270 B12R1.30 N=C(OCCO)c1ccccc1 Amb22465986 [0,2,0,0,0,0|0,0,0]=2 6271 B12R1.30 NC(\C=C\CO)c1ccccc1 Amb25312103 [0,2,0,0,0,0|1,0,1]=4 6272 B12R1.30 NCCCC(=O)c1ccccc1 Amb18623671 [0,2,0,0,0,0|2,0,0]=4 6273 B12R1.30 NCCCC(O)c1ccccc1 Amb21984517 [0,2,0,0,0,0|2,0,0]=4 6274 B12R1.30 NCCCC(c1ccccc1)O Amb17079154 [0,2,0,0,0,0|2,0,0]=4 6275 B12R1.30 NCCNC(c1ccccc1)C Amb17091024 [0,2,0,0,0,0|2,0,0]=4 6276 B12R1.30 NCCOC(=O)c1ccccc1 Amb10807731 [0,2,0,0,0,0|1,0,0]=3 6277 B12R1.30 NCCSC(=O)c1ccccc1 Amb21618899 [0,2,0,0,0,0|1,1,0]=4 6278 B12R1.30 NCCSC(c1ccccc1)C Amb17500453 [0,2,0,0,0,0|1,1,0]=4 6279 B12R1.30 NCC\C=C(\c1ccccc1)/C Amb17232384 [0,2,0,0,0,0|2,0,0]=4 6280 B12R1.30 NOCCN(c1ccccc1)C Amb17104857 [0,2,0,0,0,0|1,0,0]=3 6281 B12R1.30 N[C@@H](CCCO)c1ccccc1 Amb23440411 [0,2,0,0,0,0|1,0,0]=3 6282 B12R1.30 O=C(NCCF)c1ccccc1 Amb25139529 [0,2,0,0,0,0|2,0,0]=4 6283 B12R1.30 O=C(NCCI)c1ccccc1 Amb22753771 [0,2,0,0,0,0|2,0,0]=4 6284 B12R1.30 O=C(OCC=O)c1ccccc1 Amb18645965 [0,2,0,0,0,0|0,0,2]=4 6285 B12R1.30 OC(c1ccccc1)CCC#N Amb17232364 [0,2,0,0,0,0|2,0,0]=4 6286 B12R1.30 OCC#CC(=O)c1ccccc1 Amb22495841 [0,2,0,0,0,0|1,0,1]=4 6287 B12R1.30 OCC#CS(=O)c1ccccc1 Amb24431904 [0,2,0,0,0,0|0,1,1]=4 6288 B12R1.30 OCC#C[C@H](O)c1ccccc1 Amb24588419 [0,2,0,0,0,0|1,0,1]=4 6289 B12R1.30 OCCCC(=O)c1ccccc1 Amb17334609 [0,2,0,0,0,0|1,0,0]=3 6290 B12R1.30 OCCCC(=O)c1cccnc1 Amb17615812 [0,2,0,0,0,0|2,0,0]=4 6291 B12R1.30 OCCCC(c1ccccc1)O Amb17334675 [0,2,0,0,0,0|1,0,0]=3 6292 B12R1.30 OCCCC(c1cccnc1)O Amb17619700 [0,2,0,0,0,0|2,0,0]=4 6293 B12R1.30 OCCNC(=O)c1ccccn1 Amb1951218 [0,2,0,0,0,0|2,0,0]=4 6294 B12R1.30 OCCNC(=S)c1c[n]ccc1 Amb24407503 [0,2,0,0,0,0|2,0,0]=4 6295 B12R1.30 OCCNC(c1ccccc1)C Amb2092663 [0,2,0,0,0,0|1,0,0]=3 6296 B12R1.30 OCCOC(=N)c1ccccn1 Amb10553000 [0,2,0,0,0,0|1,0,0]=3 6297 B12R1.30 OCCOC(=O)c1ccccc1 Amb1110468 [0,2,0,0,0,0|0,0,0]=2 6298 B12R1.30 OCC\C=C(\Cl)/c1ccccc1 Amb25204635 [0,2,0,0,0,0|1,0,0]=3 6299 B12R1.30 OCNNC(=O)c1ccccc1 Amb24608056 [0,2,0,0,0,0|2,0,0]=4 6300 B12R1.30 OC\C=C\C(=O)c1ccccc1 Amb24706829 [0,2,0,0,0,0|1,0,1]=4 6301 B12R1.30 OC\C=C\C(O)c1ccccc1 Amb25071691 [0,2,0,0,0,0|1,0,1]=4 6302 B12R1.30 OC\C=C\[C@@H](O)c1ccccc1 Amb25285682 [0,2,0,0,0,0|1,0,1]=4 6303 B12R1.30 O\N=C/CC(=O)c1ccccc1 Amb25833653 [0,2,0,0,0,0|1,0,1]=4 6304 B12R1.30 O\N=C\CC(O)c1ccccc1 Amb25156836 [0,2,0,0,0,0|1,0,1]=4 6305 B12R1.30 [C-]#[N+]CCC(F)c1ccccc1 Amb25217234 [0,2,0,0,0,0|2,0,0]=4 6306 B12R1.34 BrCC(Br)C(Br)c1ccccc1 Amb25114235 [0,2,0,0,0,0|2,0,0]=4 6307 B12R1.34 C=C(C(O)CO)c1ccccc1 Amb25333663 [0,2,0,0,0,0|1,0,0]=3 6308 B12R1.34 C=C(CO)C(=O)c1ccccc1 Amb24645413 [0,2,0,0,0,0|1,0,1]=4 6309 B12R1.34 C=C(CO)C(O)c1ccccc1 Amb24671500 [0,2,0,0,0,0|1,0,1]=4 6310 B12R1.34 C=C(CO)S(=O)c1ccccc1 Amb24497581 [0,2,0,0,0,0|0,1,1]=4 6311 B12R1.34 CC(C(Br)CC)c1ccccc1 Amb25805104 [0,2,0,0,0,0|2,0,0]=4 6312 B12R1.34 CC(C(C)CN)c1ccccc1 Amb18829124 [0,2,0,0,0,0|2,0,0]=4 6313 B12R1.34 CC(C(F)CO)c1ccccc1 Amb25316277 [0,2,0,0,0,0|1,0,0]=3 6314 B12R1.34 CC(C(N)CC)c1ccccc1 Amb18829127 [0,2,0,0,0,0|2,0,0]=4 6315 B12R1.34 CC(C(N)CC)c1ccccc1 Amb20623710 [0,2,0,0,0,0|2,0,0]=4 6316 B12R1.34 CC(C(N)CN)c1ccccc1 Amb18972125 [0,2,0,0,0,0|2,0,0]=4 6317 B12R1.34 CC(C(N)CO)c1ccccc1 Amb18975503 [0,2,0,0,0,0|1,0,0]=3 6318 B12R1.34 CC(C(N)CO)c1ccccc1 Amb19349648 [0,2,0,0,0,0|1,0,0]=3 6319 B12R1.34 CC(CC)C(Br)c1ccccc1 Amb24618999 [0,2,0,0,0,0|2,0,0]=4 6320 B12R1.34 CC(CC)C(Cl)c1ccccc1 Amb19057046 [0,2,0,0,0,0|2,0,0]=4 6321 B12R1.34 CC(CC)C(O)c1ccccc1 Amb18792585 [0,2,0,0,0,0|2,0,0]=4 6322 B12R1.34 CC(CC)[C@@H](N)c1ccccc1 Amb23438852 [0,2,0,0,0,0|2,0,0]=4 6323 B12R1.34 CC(CC)[C@@H](O)c1ccccc1 Amb25158043 [0,2,0,0,0,0|2,0,0]=4 6324 B12R1.34 CC(CN)C(=O)c1ccccc1 Amb18829249 [0,2,0,0,0,0|2,0,0]=4 6325 B12R1.34 CC(CN)C(O)c1ccccc1 Amb18646366 [0,2,0,0,0,0|2,0,0]=4 6326 B12R1.34 CC(CN)S(=O)c1ccccc1 Amb24469474 [0,2,0,0,0,0|1,1,0]=4 6327 B12R1.34 CC(CO)C(N)c1ccccc1 Amb18646383 [0,2,0,0,0,0|1,0,0]=3 6328 B12R1.34 CC(CO)C(O)c1c[n]ccc1 Amb25036612 [0,2,0,0,0,0|2,0,0]=4 6329 B12R1.34 CC(CO)C(O)c1cc[n]cc1 Amb24412972 [0,2,0,0,0,0|2,0,0]=4 6330 B12R1.34 CC(CO)C(O)c1ccccc1 Amb25220934 [0,2,0,0,0,0|1,0,0]=3 6331 B12R1.34 CC(CO)N(C)c1cc[n]cc1 Amb25781190 [0,2,0,0,0,0|2,0,0]=4 6332 B12R1.34 CC(CO)N(C)c1cccc[n]1 Amb25071051 [0,2,0,0,0,0|2,0,0]=4 6333 B12R1.34 CC(CO)[C@@H](O)c1ccccc1 Amb25832639 [0,2,0,0,0,0|1,0,0]=3 6334 B12R1.34 CC(NO)C(=O)c1ccccc1 Amb25130640 [0,2,0,0,0,0|2,0,0]=4 6335 B12R1.34 CCC(C(=O)c1ccccc1)N Amb17138555 [0,2,0,0,0,0|2,0,0]=4 6336 B12R1.34 CCC(C)C(=C)c1ccccc1 Amb24598173 [0,2,0,0,0,0|2,0,0]=4 6337 B12R1.34 CCC(C)N(C)c1ccccc1 Amb24525678 [0,2,0,0,0,0|2,0,0]=4 6338 B12R1.34 CCC(Cl)C(=O)c1ccccc1 Amb19074252 [0,2,0,0,0,0|2,0,0]=4 6339 B12R1.34 CCC(Cl)C(Cl)c1ccccc1 Amb25039087 [0,2,0,0,0,0|2,0,0]=4 6340 B12R1.34 CCC(F)C(O)c1ccccc1 Amb25158096 [0,2,0,0,0,0|2,0,0]=4 6341 B12R1.34 CCC(I)C(=O)c1ccccc1 Amb20621476 [0,2,0,0,0,0|2,0,0]=4 6342 B12R1.34 CCC(N)C(=O)c1ccccc1 Amb22549075 [0,2,0,0,0,0|2,0,0]=4 6343 B12R1.34 CCC(N)C(N)c1ccccc1 Amb25765179 [0,2,0,0,0,0|2,0,0]=4 6344 B12R1.34 CCC(N)C(O)c1ccccc1 Amb19373101 [0,2,0,0,0,0|2,0,0]=4 6345 B12R1.34 CCC(O)C(=O)c1ccccc1 Amb18800792 [0,2,0,0,0,0|2,0,0]=4 6346 B12R1.34 CC[C@@H](C)C(=O)c1ccccc1 Amb24724257 [0,2,0,0,0,0|2,0,0]=4 6347 B12R1.34 CC[C@@H](N)C(=O)c1ccccc1 Amb24595929 [0,2,0,0,0,0|2,0,0]=4 6348 B12R1.34 CC[C@@H](N)[C@@H](N)c1ccccc1 Amb25151083 [0,2,0,0,0,0|2,0,0]=4 6349 B12R1.34 CC[C@@H](N)[C@H](O)c1ccccc1 Amb25793544 [0,2,0,0,0,0|2,0,0]=4 6350 B12R1.34 CC[C@@H](O)C(=O)c1ccccc1 Amb24691713 [0,2,0,0,0,0|2,0,0]=4 6351 B12R1.34 CC[C@@H](O)[C@@H](N)c1ccccc1 Amb25760697 [0,2,0,0,0,0|2,0,0]=4 6352 B12R1.34 CC[C@@H](O)[C@H](N)c1ccccc1 Amb25301206 [0,2,0,0,0,0|2,0,0]=4 6353 B12R1.34 CC[C@H](C)C(=O)c1ccccc1 Amb24378367 [0,2,0,0,0,0|2,0,0]=4 6354 B12R1.34 CC[C@H](N)C(=O)c1ccccc1 Amb25302294 [0,2,0,0,0,0|2,0,0]=4 6355 B12R1.34 CC[C@H](N)[C@@H](O)c1ccccc1 Amb24677748 [0,2,0,0,0,0|2,0,0]=4 6356 B12R1.34 CC[C@H](O)C(=O)c1ccccc1 Amb25799278 [0,2,0,0,0,0|2,0,0]=4 6357 B12R1.34 CC[C@H](O)[C@@H](O)c1ccccc1 Amb25280169 [0,2,0,0,0,0|2,0,0]=4 6358 B12R1.34 C[C@@H](CN)[C@@H](N)c1ccccc1 Amb25738664 [0,2,0,0,0,0|2,0,0]=4 6359 B12R1.34 C[C@@H](CN)[C@@H](O)c1ccccc1 Amb24711275 [0,2,0,0,0,0|2,0,0]=4 6360 B12R1.34 C[C@@H](CO)C(O)c1ccccc1 Amb25769383 [0,2,0,0,0,0|1,0,0]=3 6361 B12R1.34 C[C@@H](CO)N(C)c1cccc[n]1 Amb25742051 [0,2,0,0,0,0|2,0,0]=4 6362 B12R1.34 C[C@@H](CO)S(=O)c1ccccc1 Amb24733124 [0,2,0,0,0,0|0,1,0]=3 6363 B12R1.34 C[C@@H](CO)[C@@H](N)c1ccccc1 Amb25152441 [0,2,0,0,0,0|1,0,0]=3 6364 B12R1.34 C[C@@H](CO)[C@@H](O)c1ccccc1 Amb24497744 [0,2,0,0,0,0|1,0,0]=3 6365 B12R1.34 C[C@@H](CO)[C@H](N)c1ccccc1 Amb25320937 [0,2,0,0,0,0|1,0,0]=3 6366 B12R1.34 C[C@@H](CO)[C@H](O)c1c[n]ccc1 Amb24407542 [0,2,0,0,0,0|2,0,0]=4 6367 B12R1.34 C[C@@H](CO)[C@H](O)c1ccccc1 Amb24412993 [0,2,0,0,0,0|1,0,0]=3 6368 B12R1.34 C[C@@H]([C@@H](F)CO)c1ccccc1 Amb24362837 [0,2,0,0,0,0|1,0,0]=3 6369 B12R1.34 C[C@@H]([C@@H](O)CF)c1ccccc1 Amb24372036 [0,2,0,0,0,0|2,0,0]=4 6370 B12R1.34 C[C@@H]([C@@H](O)CO)c1ccccc1 Amb24662545 [0,2,0,0,0,0|1,0,0]=3 6371 B12R1.34 C[C@@H]([C@H](O)CC)c1ccccc1 Amb25317557 [0,2,0,0,0,0|2,0,0]=4 6372 B12R1.34 C[C@H](CC)C(O)c1ccccc1 Amb24735208 [0,2,0,0,0,0|2,0,0]=4 6373 B12R1.34 C[C@H](CC)[C@@H](O)c1ccccc1 Amb25047673 [0,2,0,0,0,0|2,0,0]=4 6374 B12R1.34 C[C@H](CN)[C@@H](N)c1ccccc1 Amb25669594 [0,2,0,0,0,0|2,0,0]=4 6375 B12R1.34 C[C@H](CN)[C@@H](O)c1ccccc1 Amb24710137 [0,2,0,0,0,0|2,0,0]=4 6376 B12R1.34 C[C@H](CO)C(=O)c1ccccc1 Amb25139941 [0,2,0,0,0,0|1,0,0]=3 6377 B12R1.34 C[C@H](CO)N(C)c1cccc[n]1 Amb25160368 [0,2,0,0,0,0|2,0,0]=4 6378 B12R1.34 C[C@H](CO)[C@@H](N)c1ccccc1 Amb24373854 [0,2,0,0,0,0|1,0,0]=3 6379 B12R1.34 C[C@H](CO)[C@@H](O)c1c[n]ccc1 Amb24675561 [0,2,0,0,0,0|2,0,0]=4 6380 B12R1.34 C[C@H](CO)[C@@H](O)c1ccccc1 Amb25687837 [0,2,0,0,0,0|1,0,0]=3 6381 B12R1.34 C[C@H](CO)[C@H](O)c1c[n]ccc1 Amb25221434 [0,2,0,0,0,0|2,0,0]=4 6382 B12R1.34 C[C@H](CO)[C@H](O)c1ccccc1 Amb24448086 [0,2,0,0,0,0|1,0,0]=3 6383 B12R1.34 C[C@H](NO)[C@H](O)c1ccccc1 Amb24475112 [0,2,0,0,0,0|2,0,0]=4 6384 B12R1.34 C[C@H]([C@H](N)CC)c1ccccc1 Amb25800098 [0,2,0,0,0,0|2,0,0]=4 6385 B12R1.34 C[C@H]([C@H](N)CO)c1ccccc1 Amb24427355 [0,2,0,0,0,0|1,0,0]=3 6386 B12R1.34 C[C@H]([C@H](O)CO)c1ccccc1 Amb24735213 [0,2,0,0,0,0|1,0,0]=3 6387 B12R1.34 C\C(=C(\F)/CO)\c1ccccc1 Amb24412960 [0,2,0,0,0,0|1,0,1]=4 6388 B12R1.34 C\C(\CO)=C(\O)/c1ccccc1 Amb24520521 [0,2,0,0,0,0|1,0,1]=4 6389 B12R1.34 ClCC(C(=O)c1ccccc1)Br Amb17351480 [0,2,0,0,0,0|2,0,0]=4 6390 B12R1.34 ClCC(C(=O)c1ccccc1)Cl Amb17337895 [0,2,0,0,0,0|2,0,0]=4 6391 B12R1.34 NC(C(O)CO)c1ccccc1 Amb18646773 [0,2,0,0,0,0|1,0,0]=3 6392 B12R1.34 NC(CF)C(O)c1ccccc1 Amb25101573 [0,2,0,0,0,0|2,0,0]=4 6393 B12R1.34 NC(CN)C(O)c1ccccc1 Amb25150994 [0,2,0,0,0,0|2,0,0]=4 6394 B12R1.34 NC(CO)C(=O)c1ccccc1 Amb24711479 [0,2,0,0,0,0|1,0,0]=3 6395 B12R1.34 NC(CO)C(Cl)c1ccccc1 Amb25159303 [0,2,0,0,0,0|1,0,0]=3 6396 B12R1.34 NC(CO)C(F)c1ccccc1 Amb25299166 [0,2,0,0,0,0|1,0,0]=3 6397 B12R1.34 NC(CO)C(O)c1c[n]ccc1 Amb18826621 [0,2,0,0,0,0|2,0,0]=4 6398 B12R1.34 NC(CO)C(O)c1cccc[n]1 Amb25736521 [0,2,0,0,0,0|2,0,0]=4 6399 B12R1.34 NC(CO)[C@H](O)c1ccccc1 Amb25247266 [0,2,0,0,0,0|1,0,0]=3 6400 B12R1.34 NCC(Br)C(=O)c1ccccc1 Amb25188302 [0,2,0,0,0,0|2,0,0]=4 6401 B12R1.34 NCC(C(=O)c1ccccc1)N Amb10843426 [0,2,0,0,0,0|2,0,0]=4 6402 B12R1.34 NCC(C(c1ccccc1)C)O Amb17232553 [0,2,0,0,0,0|2,0,0]=4 6403 B12R1.34 NCC(F)C(F)c1ccccc1 Amb25851560 [0,2,0,0,0,0|2,0,0]=4 6404 B12R1.34 NCC(N(c1ccccc1)C)C Amb1128364 [0,2,0,0,0,0|2,0,0]=4 6405 B12R1.34 NCC(N(c1ccccc1)C)C Amb13949221 [0,2,0,0,0,0|2,0,0]=4 6406 B12R1.34 NCC(O)C(O)c1ccccc1 Amb19148004 [0,2,0,0,0,0|2,0,0]=4 6407 B12R1.34 NC[C@@H](O)[C@H](O)c1ccccc1 Amb24401596 [0,2,0,0,0,0|2,0,0]=4 6408 B12R1.34 NC[C@H](O)[C@@H](F)c1ccccc1 Amb24678302 [0,2,0,0,0,0|2,0,0]=4 6409 B12R1.34 NC[C@H](O)[C@@H](O)c1ccccc1 Amb24461599 [0,2,0,0,0,0|2,0,0]=4 6410 B12R1.34 NC[C@H](O)[C@H](O)c1ccccc1 Amb24695219 [0,2,0,0,0,0|2,0,0]=4 6411 B12R1.34 N[C@@H](CO)C(O)c1ccccc1 Amb24739572 [0,2,0,0,0,0|1,0,0]=3 6412 B12R1.34 N[C@@H](CO)[C@H](O)c1ccccc1 Amb24487235 [0,2,0,0,0,0|1,0,0]=3 6413 B12R1.34 N[C@H](CO)[C@@H](O)c1ccccc1 Amb25789451 [0,2,0,0,0,0|1,0,0]=3 6414 B12R1.34 N[C@H]([C@H](N)CO)c1ccccc1 Amb24558772 [0,2,0,0,0,0|1,0,0]=3 6415 B12R1.34 O=C(C(Br)CBr)c1ccccc1 Amb25087312 [0,2,0,0,0,0|2,0,0]=4 6416 B12R1.34 OC(CCl)C(Cl)c1ccccc1 Amb25803612 [0,2,0,0,0,0|2,0,0]=4 6417 B12R1.34 OC(CO)C(F)c1ccccc1 Amb25792385 [0,2,0,0,0,0|1,0,0]=3 6418 B12R1.34 OCC(=O)C(O)c1ccccc1 Amb24364158 [0,2,0,0,0,0|1,0,1]=4 6419 B12R1.34 OCC(=O)[C@@H](O)c1ccccc1 Amb24357245 [0,2,0,0,0,0|1,0,1]=4 6420 B12R1.34 OCC(C(c1ccccc1)O)Br Amb17596330 [0,2,0,0,0,0|1,0,0]=3 6421 B12R1.34 OCC(C(c1ccccc1)O)Cl Amb17594842 [0,2,0,0,0,0|1,0,0]=3 6422 B12R1.34 OCC(Cl)C(=O)c1ccccc1 Amb24104261 [0,2,0,0,0,0|1,0,0]=3 6423 B12R1.34 OCC(Cl)C(Cl)c1ccccc1 Amb25759065 [0,2,0,0,0,0|1,0,0]=3 6424 B12R1.34 OCC(F)C(=O)c1ccccc1 Amb24084171 [0,2,0,0,0,0|1,0,0]=3 6425 B12R1.34 OCC(O)C(O)c1cccc[n]1 Amb24550636 [0,2,0,0,0,0|2,0,0]=4 6426 B12R1.34 OC[C@@H](O)C(O)c1ccccc1 Amb25332503 [0,2,0,0,0,0|1,0,0]=3 6427 B12R1.34 OC[C@@H](O)[C@@H](O)c1cccc[n]1 Amb25200149 [0,2,0,0,0,0|2,0,0]=4 6428 B12R1.34 OC[C@@H](O)[C@H](O)c1cccc[n]1 Amb24641998 [0,2,0,0,0,0|2,0,0]=4 6429 B12R1.34 OC[C@@H](O)[C@H](O)c1ccccc1 Amb24496901 [0,2,0,0,0,0|1,0,0]=3 6430 B12R1.34 OC[C@H](Cl)[C@H](Cl)c1ccccc1 Amb25678650 [0,2,0,0,0,0|1,0,0]=3 6431 B12R1.34 OC[C@H](O)C(=O)c1ccccc1 Amb25086748 [0,2,0,0,0,0|1,0,0]=3 6432 B12R1.34 OC[C@H](O)[C@@H](O)c1ccccc1 Amb25816355 [0,2,0,0,0,0|1,0,0]=3 6433 B12R1.34 OC[C@H](O)[C@H](O)c1ccccc1 Amb24735337 [0,2,0,0,0,0|1,0,0]=3 6434 B12R1.34 O[C@@H](CCl)C(=O)c1ccccc1 Amb24365917 [0,2,0,0,0,0|2,0,0]=4 6435 B12R1.34 O[C@@H](CO)[C@@H](F)c1ccccc1 Amb25206688 [0,2,0,0,0,0|1,0,0]=3 6436 B12R1.34 O[C@@H](CO)[C@H](F)c1ccccc1 Amb25157359 [0,2,0,0,0,0|1,0,0]=3 6437 B12R1.34 O[C@@H]([C@@H](Cl)CO)c1ccccc1 Amb25321935 [0,2,0,0,0,0|1,0,0]=3 6438 B12R1.39 BrCCS(=O)(=O)c1ccccc1 Amb17106167 [0,2,0,0,0,0|1,1,0]=4 6439 B12R1.39 CC(C)(CCBr)c1ccccc1 Amb25726868 [0,2,0,0,0,0|2,0,0]=4 6440 B12R1.39 CC(C)(CCN)c1ccccc1 Amb22755963 [0,2,0,0,0,0|2,0,0]=4 6441 B12R1.39 CC(C)(CCO)c1ccccc1 Amb23440831 [0,2,0,0,0,0|1,0,0]=3 6442 B12R1.39 CC(N)(CCO)c1c[n]ccc1 Amb25686451 [0,2,0,0,0,0|2,0,0]=4 6443 B12R1.39 CC(N)(CCO)c1cc[n]cc1 Amb25732906 [0,2,0,0,0,0|2,0,0]=4 6444 B12R1.39 CC(N)(CCO)c1cccc[n]1 Amb24468790 [0,2,0,0,0,0|2,0,0]=4 6445 B12R1.39 CC(N)(CCO)c1ccccc1 Amb18862633 [0,2,0,0,0,0|1,0,0]=3 6446 B12R1.39 CC(O)(CCCl)c1ccccc1 Amb25114796 [0,2,0,0,0,0|2,0,0]=4 6447 B12R1.39 CC(O)(CCO)c1ccccc1 Amb25716950 [0,2,0,0,0,0|1,0,0]=3 6448 B12R1.39 CC(S)(CCO)c1ccccc1 Amb24630816 [0,2,0,0,0,0|1,0,0]=3 6449 B12R1.39 CCCC(F)(F)c1ccccc1 Amb19894549 [0,2,0,0,0,0|2,0,0]=4 6450 B12R1.39 CCCS(=O)(=O)c1ccccc1 Amb24485446 [0,2,0,0,0,0|1,1,0]=4 6451 B12R1.39 C[C@@](N)(CCO)c1c[n]ccc1 Amb25709797 [0,2,0,0,0,0|2,0,0]=4 6452 B12R1.39 C[C@@](N)(CCO)c1cc[n]cc1 Amb25776127 [0,2,0,0,0,0|2,0,0]=4 6453 B12R1.39 C[C@@](N)(CCO)c1cccc[n]1 Amb25704179 [0,2,0,0,0,0|2,0,0]=4 6454 B12R1.39 C[C@@](N)(CCO)c1ccccc1 Amb25097043 [0,2,0,0,0,0|1,0,0]=3 6455 B12R1.39 C[C@@](O)(CCCl)c1ccccc1 Amb25361033 [0,2,0,0,0,0|2,0,0]=4 6456 B12R1.39 C[C@](N)(CCO)c1cccc[n]1 Amb24341958 [0,2,0,0,0,0|2,0,0]=4 6457 B12R1.39 C[C@](O)(CCCl)c1ccccc1 Amb25667166 [0,2,0,0,0,0|2,0,0]=4 6458 B12R1.39 C[C@](S)(CCO)c1ccccc1 Amb25120134 [0,2,0,0,0,0|1,0,0]=3 6459 B12R1.39 C[Si](C)(CCCl)c1ccccc1 Amb25765655 [0,2,0,0,0,0|2,0,0]=4 6460 B12R1.39 C[Si](C)(CCO)c1ccccc1 Amb25788909 [0,2,0,0,0,0|1,0,0]=3 6461 B12R1.39 ClCCS(=O)(=O)c1ccccc1 Amb1034876 [0,2,0,0,0,0|1,1,0]=4 6462 B12R1.39 NC(O)(CCO)c1ccccc1 Amb24431011 [0,2,0,0,0,0|1,0,0]=3 6463 B12R1.39 NCCC(c1ccccc1)(O)C Amb17594116 [0,2,0,0,0,0|2,0,0]=4 6464 B12R1.39 NCC[S+](=O)(c1ccccc1)[O-] Amb10230992 [0,2,0,0,0,0|1,1,0]=4 6465 B12R1.39 N[C@](O)(CCO)c1ccccc1 Amb25356322 [0,2,0,0,0,0|1,0,0]=3 6466 B12R1.39 O=S(=O)(CCF)c1ccccc1 Amb24734666 [0,2,0,0,0,0|1,1,0]=4 6467 B12R1.39 OCCP(O)(=O)c1ccccc1 Amb25706050 [0,2,0,0,0,0|1,0,0]=3 6468 B12R1.107 C=C(CC(O)=O)c1ccccc1 Amb18645643 [0,2,0,0,0,0|1,0,1]=4 6469 B12R1.107 CC(C)C[C@@H](Cl)c1ccccc1 Amb25667428 [0,2,0,0,0,0|2,0,0]=4 6470 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb22288660 [0,2,0,0,0,0|2,0,0]=4 6471 B12R1.107 CC(C)C[C@@H](O)c1ccccc1 Amb25816173 [0,2,0,0,0,0|2,0,0]=4 6472 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb22288705 [0,2,0,0,0,0|2,0,0]=4 6473 B12R1.107 CC(C)C[C@H](O)c1ccccc1 Amb24344678 [0,2,0,0,0,0|2,0,0]=4 6474 B12R1.107 CC(CB(O)O)c1ccccc1 Amb24725059 [0,2,0,0,0,0|2,0,0]=4 6475 B12R1.107 CC(CC(C)Br)c1ccccc1 Amb25273655 [0,2,0,0,0,0|2,0,0]=4 6476 B12R1.107 CC(CC(C)O)c1c[n]ccc1 Amb25278209 [0,2,0,0,0,0|2,0,0]=4 6477 B12R1.107 CC(CC(N)N)c1ccccc1 Amb24670721 [0,2,0,0,0,0|2,0,0]=4 6478 B12R1.107 CC(CC(O)O)c1ccccc1 Amb25092014 [0,2,0,0,0,0|1,0,0]=3 6479 B12R1.107 CC(CN(c1ccccc1)C)C Amb17232437 [0,2,0,0,0,0|2,0,0]=4 6480 B12R1.107 CC(CN(c1ccccc1)C)N Amb10610213 [0,2,0,0,0,0|2,0,0]=4 6481 B12R1.107 CC(CN(c1ccccc1)C)N Amb1137929 [0,2,0,0,0,0|2,0,0]=4 6482 B12R1.107 CC(CN(c1ccccc1)C)O Amb17138595 [0,2,0,0,0,0|1,0,0]=3 6483 B12R1.107 CC(CN(c1ccccc1)N)C Amb17226667 [0,2,0,0,0,0|2,0,0]=4 6484 B12R1.107 CC(CS(O)=O)c1ccccc1 Amb24557264 [0,2,0,0,0,0|2,0,0]=4 6485 B12R1.107 CC(Cl)CN(C)c1ccccc1 Amb24711498 [0,2,0,0,0,0|2,0,0]=4 6486 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb20668879 [0,2,0,0,0,0|2,0,0]=4 6487 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb22059727 [0,2,0,0,0,0|2,0,0]=4 6488 B12R1.107 CC(N)CC(O)c1ccccc1 Amb18646365 [0,2,0,0,0,0|2,0,0]=4 6489 B12R1.107 CC(N)C[C@@H](O)c1ccccc1 Amb25719473 [0,2,0,0,0,0|2,0,0]=4 6490 B12R1.107 CC(O)CC(=C)c1ccc[n]c1 Amb25706101 [0,2,0,0,0,0|2,0,0]=4 6491 B12R1.107 CC(O)CC(=O)c1ccc[n]c1 Amb25060077 [0,2,0,0,0,0|2,0,0]=4 6492 B12R1.107 CC(O)CC(N)c1cc[n]cc1 Amb25124085 [0,2,0,0,0,0|2,0,0]=4 6493 B12R1.107 CC(O)CC(N)c1ccc[n]c1 Amb25362253 [0,2,0,0,0,0|2,0,0]=4 6494 B12R1.107 CC(O)CC(N)c1ccccc1 Amb18646382 [0,2,0,0,0,0|1,0,0]=3 6495 B12R1.107 CC(O)CC(P)c1ccccc1 Amb25157842 [0,2,0,0,0,0|1,0,0]=3 6496 B12R1.107 CC(O)CC(S)c1ccccc1 Amb24525704 [0,2,0,0,0,0|1,0,0]=3 6497 B12R1.107 CC(O)CN(C)c1cc[n]cc1 Amb18798599 [0,2,0,0,0,0|2,0,0]=4 6498 B12R1.107 CC(O)CN(C)c1cccc[n]1 Amb18798612 [0,2,0,0,0,0|2,0,0]=4 6499 B12R1.107 CC(O)CS(=O)c1ccccc1 Amb25042910 [0,2,0,0,0,0|0,1,0]=3 6500 B12R1.107 CC(O)C[C@H](O)c1ccccc1 Amb24355251 [0,2,0,0,0,0|1,0,0]=3 6501 B12R1.107 CC(c1ccccc1)CC(=O)O Amb1207393 [0,2,0,0,0,0|1,0,1]=4 6502 B12R1.107 CN(CC(Cl)Cl)c1ccccc1 Amb24351871 [0,2,0,0,0,0|2,0,0]=4 6503 B12R1.107 CN(CC(F)F)c1ccccc1 Amb25079937 [0,2,0,0,0,0|2,0,0]=4 6504 B12R1.107 CN(c1ccccc1)CC(=O)O Amb10610413 [0,2,0,0,0,0|1,0,1]=4 6505 B12R1.107 CP(CC(O)=O)c1ccccc1 Amb25108110 [0,2,0,0,0,0|1,0,1]=4 6506 B12R1.107 C[C@@H](N)CN(C)c1ccccc1 Amb25058714 [0,2,0,0,0,0|2,0,0]=4 6507 B12R1.107 C[C@@H](N)CS(=O)c1ccccc1 Amb24381565 [0,2,0,0,0,0|1,1,0]=4 6508 B12R1.107 C[C@@H](N)C[C@@H]([O-])c1ccccc1 Amb25825094 [0,2,0,0,0,0|2,0,0]=4 6509 B12R1.107 C[C@@H](O)CN(C)c1cc[n]cc1 Amb25065978 [0,2,0,0,0,0|2,0,0]=4 6510 B12R1.107 C[C@@H](O)CN(C)c1ccccc1 Amb24663849 [0,2,0,0,0,0|1,0,0]=3 6511 B12R1.107 C[C@@H](O)CS(=O)c1ccccc1 Amb25788068 [0,2,0,0,0,0|0,1,0]=3 6512 B12R1.107 C[C@@H](O)C[C@@H](N)c1ccccc1 Amb24634311 [0,2,0,0,0,0|1,0,0]=3 6513 B12R1.107 C[C@@H](O)C[C@H](N)c1ccccc1 Amb24711221 [0,2,0,0,0,0|1,0,0]=3 6514 B12R1.107 C[C@@H](c1ccccc1)CC(=O)O Amb10844340 [0,2,0,0,0,0|1,0,1]=4 6515 B12R1.107 C[C@H](C[C@H](C)O)c1ccccc1 Amb25741359 [0,2,0,0,0,0|1,0,0]=3 6516 B12R1.107 C[C@H](Cl)C[C@@H](Cl)c1ccccc1 Amb25119306 [0,2,0,0,0,0|2,0,0]=4 6517 B12R1.107 C[C@H](N)C[C@@H](O)c1ccccc1 Amb25362221 [0,2,0,0,0,0|2,0,0]=4 6518 B12R1.107 C[C@H](N)C[C@H]([O-])c1ccccc1 Amb25180739 [0,2,0,0,0,0|2,0,0]=4 6519 B12R1.107 C[C@H](O)CC(=C)c1ccccc1 Amb25741335 [0,2,0,0,0,0|1,0,0]=3 6520 B12R1.107 C[C@H](O)CC(N)c1ccccc1 Amb24608910 [0,2,0,0,0,0|1,0,0]=3 6521 B12R1.107 C[C@H](O)CC(O)c1ccccc1 Amb25846972 [0,2,0,0,0,0|1,0,0]=3 6522 B12R1.107 C[C@H](O)CN(C)c1cccc[n]1 Amb25182856 [0,2,0,0,0,0|2,0,0]=4 6523 B12R1.107 C[C@H](O)CS(=O)c1ccccc1 Amb24364273 [0,2,0,0,0,0|0,1,0]=3 6524 B12R1.107 C[C@H](O)C[C@@H](N)c1ccccc1 Amb25152440 [0,2,0,0,0,0|1,0,0]=3 6525 B12R1.107 C[C@H](O)C[C@@H](O)c1ccccc1 Amb24431811 [0,2,0,0,0,0|1,0,0]=3 6526 B12R1.107 C[C@H](O)C[C@H](S)c1ccccc1 Amb24398074 [0,2,0,0,0,0|1,0,0]=3 6527 B12R1.107 C[C@H](c1ccccc1)CC(=O)O Amb10844379 [0,2,0,0,0,0|1,0,1]=4 6528 B12R1.107 C\C(=C\C(C)O)\c1ccccc1 Amb25823380 [0,2,0,0,0,0|1,0,1]=4 6529 B12R1.107 NC(CB(O)O)c1ccccc1 Amb24658322 [0,2,0,0,0,0|2,0,0]=4 6530 B12R1.107 NC(CC(Cl)Cl)c1ccccc1 Amb25324519 [0,2,0,0,0,0|2,0,0]=4 6531 B12R1.107 NC(CC(F)F)c1ccccc1 Amb18802187 [0,2,0,0,0,0|2,0,0]=4 6532 B12R1.107 NC(c1ccccc1)CC(=O)O Amb1048120 [0,2,0,0,0,0|1,0,1]=4 6533 B12R1.107 NC(c1ccccc1)CC(C)C Amb1107536 [0,2,0,0,0,0|2,0,0]=4 6534 B12R1.107 NN(CC(O)=O)c1ccccc1 Amb22757137 [0,2,0,0,0,0|1,0,1]=4 6535 B12R1.107 O=C(c1ccccc1)CC(=O)O Amb10576353 [0,2,0,0,0,0|1,0,1]=4 6536 B12R1.107 OC(=O)CC(Cl)c1ccccc1 Amb18120400 [0,2,0,0,0,0|1,0,1]=4 6537 B12R1.107 OC(=O)CC(F)c1ccccc1 Amb24554792 [0,2,0,0,0,0|1,0,1]=4 6538 B12R1.107 OC(=O)CC(S)c1ccccc1 Amb18303085 [0,2,0,0,0,0|1,0,1]=4 6539 B12R1.107 OC(=O)CS(=O)c1ccccc1 Amb18290924 [0,2,0,0,0,0|0,1,1]=4 6540 B12R1.107 OC(CC(F)F)c1ccccc1 Amb24433354 [0,2,0,0,0,0|2,0,0]=4 6541 B12R1.107 OC(c1ccccc1)CC(C)C Amb1110402 [0,2,0,0,0,0|2,0,0]=4 6542 B12R1.107 OC(c1ccccc1)CC(O)C Amb1110547 [0,2,0,0,0,0|1,0,0]=3 6543 B12R1.308 CC(CCN)c1ccccc1O Amb24643805 [0,2,0,0,0,0|2,0,0]=4 6544 B12R1.308 CCCC(=N)c1ccccc1O Amb24721703 [0,2,0,0,0,0|2,0,0]=4 6545 B12R1.308 CCCC(=O)c1ccccc1Br Amb17343723 [0,2,0,0,0,0|2,0,0]=4 6546 B12R1.308 CCCC(=O)c1ccccc1C Amb17198733 [0,2,0,0,0,0|2,0,0]=4 6547 B12R1.308 CCCC(=O)c1ccccc1Cl Amb17198743 [0,2,0,0,0,0|2,0,0]=4 6548 B12R1.308 CCCC(=O)c1ccccc1F Amb17198734 [0,2,0,0,0,0|2,0,0]=4 6549 B12R1.308 CCCC(=O)c1ccccc1I Amb24397248 [0,2,0,0,0,0|2,0,0]=4 6550 B12R1.308 CCCC(=O)c1ccccc1N Amb18645869 [0,2,0,0,0,0|2,0,0]=4 6551 B12R1.308 CCCC(C)c1ccccc1N Amb24729496 [0,2,0,0,0,0|2,0,0]=4 6552 B12R1.308 CCCC(Cl)c1ccccc1F Amb25127215 [0,2,0,0,0,0|2,0,0]=4 6553 B12R1.308 CCCC(N)c1ccccc1N Amb25119381 [0,2,0,0,0,0|2,0,0]=4 6554 B12R1.308 CCCC(N)c1ccccc1S Amb24488673 [0,2,0,0,0,0|2,0,0]=4 6555 B12R1.308 CCCC(O)c1ccccc1I Amb24623046 [0,2,0,0,0,0|2,0,0]=4 6556 B12R1.308 CCCC(O)c1ccccc1N Amb24473035 [0,2,0,0,0,0|2,0,0]=4 6557 B12R1.308 CCCC(O)c1ccccc1O Amb18646532 [0,2,0,0,0,0|2,0,0]=4 6558 B12R1.308 CCCC(c1ccccc1C)N Amb17232446 [0,2,0,0,0,0|2,0,0]=4 6559 B12R1.308 CCCC(c1ccccc1C)O Amb17232483 [0,2,0,0,0,0|2,0,0]=4 6560 B12R1.308 CCCC(c1ccccc1Cl)N Amb17234047 [0,2,0,0,0,0|2,0,0]=4 6561 B12R1.308 CCCC(c1ccccc1Cl)O Amb17234154 [0,2,0,0,0,0|2,0,0]=4 6562 B12R1.308 CCCC(c1ccccc1F)N Amb17232645 [0,2,0,0,0,0|2,0,0]=4 6563 B12R1.308 CCCC(c1ccccc1F)O Amb17232666 [0,2,0,0,0,0|2,0,0]=4 6564 B12R1.308 CCCN(C)c1ccccc1Br Amb25306279 [0,2,0,0,0,0|2,0,0]=4 6565 B12R1.308 CCCN(C)c1ccccc1F Amb25345830 [0,2,0,0,0,0|2,0,0]=4 6566 B12R1.308 CCCS(=O)c1ccccc1N Amb18291960 [0,2,0,0,0,0|1,1,0]=4 6567 B12R1.308 CCCS(=O)c1ccccc1O Amb25143473 [0,2,0,0,0,0|1,1,0]=4 6568 B12R1.308 CCC[C@@H](N)c1ccccc1I Amb24443865 [0,2,0,0,0,0|2,0,0]=4 6569 B12R1.308 CCC[C@@H](O)c1ccccc1Br Amb24705993 [0,2,0,0,0,0|2,0,0]=4 6570 B12R1.308 CCC[C@@H](O)c1ccccc1Cl Amb25043992 [0,2,0,0,0,0|2,0,0]=4 6571 B12R1.308 CCC[C@H](N)c1ccccc1Br Amb25096337 [0,2,0,0,0,0|2,0,0]=4 6572 B12R1.308 CCC[C@H](N)c1ccccc1N Amb25088274 [0,2,0,0,0,0|2,0,0]=4 6573 B12R1.308 CN(CCBr)c1ccccc1F Amb24454501 [0,2,0,0,0,0|2,0,0]=4 6574 B12R1.308 CN(CCI)c1ccccc1F Amb25344514 [0,2,0,0,0,0|2,0,0]=4 6575 B12R1.308 CN(CCO)c1[n]cccc1Br Amb25215188 [0,2,0,0,0,0|2,0,0]=4 6576 B12R1.308 CN(CCO)c1[n]cccc1Cl Amb19076386 [0,2,0,0,0,0|2,0,0]=4 6577 B12R1.308 CN(CCO)c1[n]cccc1F Amb18801751 [0,2,0,0,0,0|2,0,0]=4 6578 B12R1.308 CN(CCO)c1ccccc1I Amb25307387 [0,2,0,0,0,0|1,0,0]=3 6579 B12R1.308 CN(CCS)c1ccccc1F Amb24577221 [0,2,0,0,0,0|1,1,0]=4 6580 B12R1.308 C[C@H](CCO)c1ccccc1O Amb24686462 [0,2,0,0,0,0|1,0,0]=3 6581 B12R1.308 C\C(=C/CO)\c1ccccc1Br Amb24438353 [0,2,0,0,0,0|1,0,1]=4 6582 B12R1.308 C\C(=C\CO)\c1ccccc1Br Amb24623710 [0,2,0,0,0,0|1,0,1]=4 6583 B12R1.308 C\C(=C\CO)\c1ccccc1Cl Amb25209579 [0,2,0,0,0,0|1,0,1]=4 6584 B12R1.308 C\C(=C\CO)\c1ccccc1F Amb24420735 [0,2,0,0,0,0|1,0,1]=4 6585 B12R1.308 C\C(=C\CO)\c1ccccc1O Amb18646033 [0,2,0,0,0,0|1,0,1]=4 6586 B12R1.308 Cc1[n]cccc1C(O)CCO Amb25669426 [0,2,0,0,0,0|2,0,0]=4 6587 B12R1.308 Cc1[n]cccc1[C@@H](N)CCO Amb24657174 [0,2,0,0,0,0|2,0,0]=4 6588 B12R1.308 Cc1[n]cccc1[C@H](N)CCO Amb25294664 [0,2,0,0,0,0|2,0,0]=4 6589 B12R1.308 Cc1c[n]ccc1[C@@H](N)CCO Amb24488509 [0,2,0,0,0,0|2,0,0]=4 6590 B12R1.308 Cc1cc[n]cc1[C@@H](N)CCO Amb25324426 [0,2,0,0,0,0|2,0,0]=4 6591 B12R1.308 Cc1cc[n]cc1[C@H](N)CCO Amb25131710 [0,2,0,0,0,0|2,0,0]=4 6592 B12R1.308 Cc1ccc[n]c1C(N)CCO Amb24488620 [0,2,0,0,0,0|2,0,0]=4 6593 B12R1.308 Cc1ccc[n]c1N(C)CCO Amb18801092 [0,2,0,0,0,0|2,0,0]=4 6594 B12R1.308 Cc1ccc[n]c1[C@@H](N)CCO Amb25127456 [0,2,0,0,0,0|2,0,0]=4 6595 B12R1.308 Cc1ccc[n]c1[C@H](N)CCO Amb24487361 [0,2,0,0,0,0|2,0,0]=4 6596 B12R1.308 Cc1ccccc1C(=O)CCN Amb25062867 [0,2,0,0,0,0|2,0,0]=4 6597 B12R1.308 Cc1ccccc1C(Cl)CCC Amb25157873 [0,2,0,0,0,0|2,0,0]=4 6598 B12R1.308 Cc1ccccc1C(Cl)CCO Amb24692648 [0,2,0,0,0,0|1,0,0]=3 6599 B12R1.308 Cc1ccccc1C(N)CCCl Amb24739582 [0,2,0,0,0,0|2,0,0]=4 6600 B12R1.308 Cc1ccccc1N(C)CCBr Amb24418265 [0,2,0,0,0,0|2,0,0]=4 6601 B12R1.308 Cc1ccccc1S(=O)CCN Amb18974524 [0,2,0,0,0,0|1,1,0]=4 6602 B12R1.308 Cc1ccccc1[C@@H](N)CCC Amb22298562 [0,2,0,0,0,0|2,0,0]=4 6603 B12R1.308 Cc1ccccc1[C@@H](N)CCN Amb24567843 [0,2,0,0,0,0|2,0,0]=4 6604 B12R1.308 Cc1ccccc1[C@@H](N)CCO Amb24393358 [0,2,0,0,0,0|1,0,0]=3 6605 B12R1.308 Cc1ccccc1[C@H](N)CCC Amb22298519 [0,2,0,0,0,0|2,0,0]=4 6606 B12R1.308 Cc1ccccc1[C@H](N)CCN Amb24580760 [0,2,0,0,0,0|2,0,0]=4 6607 B12R1.308 ClCCN(c1ccccc1Br)C Amb17351919 [0,2,0,0,0,0|2,0,0]=4 6608 B12R1.308 ClCCN(c1ccccc1C)C Amb17335670 [0,2,0,0,0,0|2,0,0]=4 6609 B12R1.308 ClCCN(c1ccccc1Cl)C Amb17338055 [0,2,0,0,0,0|2,0,0]=4 6610 B12R1.308 ClCCN(c1ccccc1F)C Amb17335951 [0,2,0,0,0,0|2,0,0]=4 6611 B12R1.308 FCCC(=O)c1ccccc1Br Amb16231892 [0,2,0,0,0,0|2,0,0]=4 6612 B12R1.308 NC(CCCl)c1ccccc1Cl Amb25667414 [0,2,0,0,0,0|2,0,0]=4 6613 B12R1.308 NC(CCO)c1[n]cccc1Br Amb25244942 [0,2,0,0,0,0|2,0,0]=4 6614 B12R1.308 NC(CCO)c1[n]cccc1Cl Amb24745647 [0,2,0,0,0,0|2,0,0]=4 6615 B12R1.308 NC(CCO)c1cc[n]cc1Br Amb25212924 [0,2,0,0,0,0|2,0,0]=4 6616 B12R1.308 NC(CCO)c1cc[n]cc1Cl Amb24655939 [0,2,0,0,0,0|2,0,0]=4 6617 B12R1.308 NC(CCO)c1ccc[n]c1Br Amb24461552 [0,2,0,0,0,0|2,0,0]=4 6618 B12R1.308 NC(CCO)c1ccc[n]c1Cl Amb22296967 [0,2,0,0,0,0|2,0,0]=4 6619 B12R1.308 NC(CCO)c1ccc[n]c1O Amb25152302 [0,2,0,0,0,0|2,0,0]=4 6620 B12R1.308 NC(CCO)c1ccc[n]c1S Amb25324363 [0,2,0,0,0,0|2,0,0]=4 6621 B12R1.308 NC(CCO)c1ccccc1Br Amb18297962 [0,2,0,0,0,0|1,0,0]=3 6622 B12R1.308 NC(CCO)c1ccccc1Cl Amb19888406 [0,2,0,0,0,0|1,0,0]=3 6623 B12R1.308 NC(CCO)c1ccccc1I Amb25729935 [0,2,0,0,0,0|1,0,0]=3 6624 B12R1.308 NC(CCO)c1ccccc1O Amb24487329 [0,2,0,0,0,0|1,0,0]=3 6625 B12R1.308 NC(CCO)c1ccccc1S Amb24488674 [0,2,0,0,0,0|1,0,0]=3 6626 B12R1.308 NCCC(=O)c1ccccc1Cl Amb25709180 [0,2,0,0,0,0|2,0,0]=4 6627 B12R1.308 NCCC(=O)c1ccccc1O Amb24346596 [0,2,0,0,0,0|2,0,0]=4 6628 B12R1.308 NCCC(F)c1ccccc1Cl Amb25083769 [0,2,0,0,0,0|2,0,0]=4 6629 B12R1.308 NCCC(F)c1ccccc1O Amb24742701 [0,2,0,0,0,0|2,0,0]=4 6630 B12R1.308 NCCC(N)c1ccccc1Br Amb25339731 [0,2,0,0,0,0|2,0,0]=4 6631 B12R1.308 NCCC(O)c1ccccc1Br Amb18747006 [0,2,0,0,0,0|2,0,0]=4 6632 B12R1.308 NCCC(O)c1ccccc1O Amb24718394 [0,2,0,0,0,0|2,0,0]=4 6633 B12R1.308 NCCC(c1ccccc1C)C Amb17232447 [0,2,0,0,0,0|2,0,0]=4 6634 B12R1.308 NCCC(c1ccccc1C)O Amb17232539 [0,2,0,0,0,0|2,0,0]=4 6635 B12R1.308 NCCC(c1ccccc1Cl)C Amb17234048 [0,2,0,0,0,0|2,0,0]=4 6636 B12R1.308 NCCC(c1ccccc1Cl)O Amb17234259 [0,2,0,0,0,0|2,0,0]=4 6637 B12R1.308 NCCC(c1ccccc1F)C Amb17232646 [0,2,0,0,0,0|2,0,0]=4 6638 B12R1.308 NCCC(c1ccccc1F)O Amb17232696 [0,2,0,0,0,0|2,0,0]=4 6639 B12R1.308 NCCN(c1ccccc1Br)C Amb17059772 [0,2,0,0,0,0|2,0,0]=4 6640 B12R1.308 NCCN(c1ccccc1C)C Amb17059640 [0,2,0,0,0,0|2,0,0]=4 6641 B12R1.308 NCCN(c1ccccc1Cl)C Amb17059645 [0,2,0,0,0,0|2,0,0]=4 6642 B12R1.308 NCCN(c1ccccc1F)C Amb17059642 [0,2,0,0,0,0|2,0,0]=4 6643 B12R1.308 NCCS(=O)c1ccccc1Br Amb18290922 [0,2,0,0,0,0|1,1,0]=4 6644 B12R1.308 NCCS(=O)c1ccccc1Cl Amb18290916 [0,2,0,0,0,0|1,1,0]=4 6645 B12R1.308 NCCS(=O)c1ccccc1F Amb18974522 [0,2,0,0,0,0|1,1,0]=4 6646 B12R1.308 NCCS(=O)c1ccccc1F Amb19373859 [0,2,0,0,0,0|1,1,0]=4 6647 B12R1.308 NCC[C@@H](N)c1ccccc1Br Amb24580692 [0,2,0,0,0,0|2,0,0]=4 6648 B12R1.308 NCC[C@@H](N)c1ccccc1F Amb24744679 [0,2,0,0,0,0|2,0,0]=4 6649 B12R1.308 NCC[C@@H](N)c1ccccc1O Amb24568021 [0,2,0,0,0,0|2,0,0]=4 6650 B12R1.308 NCC[C@H](N)c1ccccc1F Amb25339749 [0,2,0,0,0,0|2,0,0]=4 6651 B12R1.308 N[C@@H](CCO)c1[n]cccc1F Amb25698321 [0,2,0,0,0,0|2,0,0]=4 6652 B12R1.308 N[C@@H](CCO)c1c[n]ccc1Cl Amb25148599 [0,2,0,0,0,0|2,0,0]=4 6653 B12R1.308 N[C@@H](CCO)c1cc[n]cc1F Amb24423142 [0,2,0,0,0,0|2,0,0]=4 6654 B12R1.308 N[C@@H](CCO)c1ccc[n]c1F Amb25821978 [0,2,0,0,0,0|2,0,0]=4 6655 B12R1.308 N[C@@H](CCO)c1ccccc1Br Amb25140602 [0,2,0,0,0,0|1,0,0]=3 6656 B12R1.308 N[C@@H](CCO)c1ccccc1Cl Amb19888408 [0,2,0,0,0,0|1,0,0]=3 6657 B12R1.308 N[C@@H](CCO)c1ccccc1S Amb25791527 [0,2,0,0,0,0|1,0,0]=3 6658 B12R1.308 N[C@H](CCO)c1[n]cccc1Cl Amb25808103 [0,2,0,0,0,0|2,0,0]=4 6659 B12R1.308 N[C@H](CCO)c1[n]cccc1O Amb24487359 [0,2,0,0,0,0|2,0,0]=4 6660 B12R1.308 N[C@H](CCO)c1c[n]ccc1Br Amb25259097 [0,2,0,0,0,0|2,0,0]=4 6661 B12R1.308 N[C@H](CCO)c1c[n]ccc1Cl Amb25149887 [0,2,0,0,0,0|2,0,0]=4 6662 B12R1.308 N[C@H](CCO)c1cc[n]cc1Br Amb24696421 [0,2,0,0,0,0|2,0,0]=4 6663 B12R1.308 N[C@H](CCO)c1cc[n]cc1F Amb25761821 [0,2,0,0,0,0|2,0,0]=4 6664 B12R1.308 N[C@H](CCO)c1ccc[n]c1O Amb25751304 [0,2,0,0,0,0|2,0,0]=4 6665 B12R1.308 N[C@H](CCO)c1ccc[n]c1S Amb24488523 [0,2,0,0,0,0|2,0,0]=4 6666 B12R1.308 N[C@H](CCO)c1ccccc1Br Amb25301240 [0,2,0,0,0,0|1,0,0]=3 6667 B12R1.308 N[C@H](CCO)c1ccccc1Cl Amb19887650 [0,2,0,0,0,0|1,0,0]=3 6668 B12R1.308 N[C@H](CCO)c1ccccc1S Amb25694372 [0,2,0,0,0,0|1,0,0]=3 6669 B12R1.308 Nc1[n]cccc1[C@H](N)CCO Amb24699148 [0,2,0,0,0,0|2,0,0]=4 6670 B12R1.308 Nc1c[n]ccc1[C@H](N)CCO Amb24746611 [0,2,0,0,0,0|2,0,0]=4 6671 B12R1.308 Nc1cc[n]cc1[C@@H](N)CCO Amb25111522 [0,2,0,0,0,0|2,0,0]=4 6672 B12R1.308 Nc1ccc[n]c1[C@@H](N)CCO Amb25809412 [0,2,0,0,0,0|2,0,0]=4 6673 B12R1.308 Nc1ccccc1C(=O)CCN Amb21855941 [0,2,0,0,0,0|2,0,0]=4 6674 B12R1.308 Nc1ccccc1C(=O)CCN Amb22350218 [0,2,0,0,0,0|2,0,0]=4 6675 B12R1.308 Nc1ccccc1C(N)CCO Amb22235813 [0,2,0,0,0,0|1,0,0]=3 6676 B12R1.308 Nc1ccccc1S(=O)CCF Amb25337402 [0,2,0,0,0,0|1,1,0]=4 6677 B12R1.308 Nc1ccccc1S(=O)CCO Amb25299207 [0,2,0,0,0,0|0,1,0]=3 6678 B12R1.308 Nc1ccccc1[C@H](N)CCO Amb19887576 [0,2,0,0,0,0|1,0,0]=3 6679 B12R1.308 O=C(CCBr)c1ccccc1Br Amb24695292 [0,2,0,0,0,0|2,0,0]=4 6680 B12R1.308 O=C(CCBr)c1ccccc1I Amb24696334 [0,2,0,0,0,0|2,0,0]=4 6681 B12R1.308 O=C(CCCl)c1ccccc1Br Amb25377082 [0,2,0,0,0,0|2,0,0]=4 6682 B12R1.308 O=C(CCCl)c1ccccc1Cl Amb22229247 [0,2,0,0,0,0|2,0,0]=4 6683 B12R1.308 O=C(CCCl)c1ccccc1I Amb25796603 [0,2,0,0,0,0|2,0,0]=4 6684 B12R1.308 O=S(CCF)c1ccccc1F Amb25374903 [0,2,0,0,0,0|1,1,0]=4 6685 B12R1.308 OC(CCCl)c1ccccc1Cl Amb25159575 [0,2,0,0,0,0|2,0,0]=4 6686 B12R1.308 OCCC(=O)c1ccccc1F Amb25159895 [0,2,0,0,0,0|1,0,0]=3 6687 B12R1.308 OCCC(O)c1[n]cccc1Cl Amb25157617 [0,2,0,0,0,0|2,0,0]=4 6688 B12R1.308 OCCC(O)c1c[n]ccc1Br Amb24458860 [0,2,0,0,0,0|2,0,0]=4 6689 B12R1.308 OCCC(O)c1ccc[n]c1Cl Amb22298357 [0,2,0,0,0,0|2,0,0]=4 6690 B12R1.308 OCCC(O)c1ccccc1Br Amb24668754 [0,2,0,0,0,0|1,0,0]=3 6691 B12R1.308 OCCC(O)c1ccccc1Cl Amb25275717 [0,2,0,0,0,0|1,0,0]=3 6692 B12R1.308 OCCC(O)c1ccccc1F Amb24649873 [0,2,0,0,0,0|1,0,0]=3 6693 B12R1.308 OCCC(c1ccccc1C)C Amb17232499 [0,2,0,0,0,0|1,0,0]=3 6694 B12R1.308 OCCC(c1ccccc1C)N Amb17103953 [0,2,0,0,0,0|1,0,0]=3 6695 B12R1.308 OCCC(c1ccccc1Cl)C Amb17234164 [0,2,0,0,0,0|1,0,0]=3 6696 B12R1.308 OCCC(c1ccccc1Cl)N Amb1993960 [0,2,0,0,0,0|1,0,0]=3 6697 B12R1.308 OCCC(c1ccccc1F)C Amb17232671 [0,2,0,0,0,0|1,0,0]=3 6698 B12R1.308 OCCC(c1ccccc1F)N Amb2408130 [0,2,0,0,0,0|1,0,0]=3 6699 B12R1.308 OCCN(c1ccccc1Br)C Amb17344451 [0,2,0,0,0,0|1,0,0]=3 6700 B12R1.308 OCCN(c1ccccc1C)C Amb17334643 [0,2,0,0,0,0|1,0,0]=3 6701 B12R1.308 OCCN(c1ccccc1Cl)C Amb17335810 [0,2,0,0,0,0|1,0,0]=3 6702 B12R1.308 OCCN(c1ccccc1F)C Amb17334763 [0,2,0,0,0,0|1,0,0]=3 6703 B12R1.308 OCC[C@@H](O)c1ccccc1F Amb25308216 [0,2,0,0,0,0|1,0,0]=3 6704 B12R1.308 OCC[C@H](O)c1ccccc1Br Amb24385097 [0,2,0,0,0,0|1,0,0]=3 6705 B12R1.308 OCC[C@H](O)c1ccccc1Cl Amb24748463 [0,2,0,0,0,0|1,0,0]=3 6706 B12R1.308 OCC[C@H](O)c1ccccc1F Amb25353877 [0,2,0,0,0,0|1,0,0]=3 6707 B12R1.308 ONCC(c1ccccc1C)O Amb17334702 [0,2,0,0,0,0|2,0,0]=4 6708 B12R1.308 ONCC(c1ccccc1Cl)O Amb17335947 [0,2,0,0,0,0|2,0,0]=4 6709 B12R1.308 ONCC(c1ccccc1F)O Amb17334837 [0,2,0,0,0,0|2,0,0]=4 6710 B12R1.308 Oc1ccccc1\C(\Cl)=C/CO Amb24655131 [0,2,0,0,0,0|1,0,1]=4 6711 B12R1.25 C#CCOc1cccc(Br)c1Br Amb25353856 [0,2,0,0,0,0|1,0,1]=4 6712 B12R1.25 C#CCOc1cccc(Cl)c1Cl Amb18333167 [0,2,0,0,0,0|1,0,1]=4 6713 B12R1.25 C#CCOc1cccc(F)c1F Amb18788734 [0,2,0,0,0,0|1,0,1]=4 6714 B12R1.25 C#CCOc1cccc(N)c1N Amb24060474 [0,2,0,0,0,0|1,0,1]=4 6715 B12R1.25 C#CCOc1cccc(O)c1N Amb25792635 [0,2,0,0,0,0|1,0,1]=4 6716 B12R1.25 C=CCOc1cccc(Br)c1F Amb22896683 [0,2,0,0,0,0|1,0,1]=4 6717 B12R1.25 C=CCOc1cccc(F)c1I Amb25669714 [0,2,0,0,0,0|1,0,1]=4 6718 B12R1.25 C=CCOc1cccc(N)c1Br Amb24531422 [0,2,0,0,0,0|1,0,1]=4 6719 B12R1.25 C=CCOc1cccc(N)c1Cl Amb25821654 [0,2,0,0,0,0|1,0,1]=4 6720 B12R1.25 C=CCOc1cccc(O)c1O Amb18646459 [0,2,0,0,0,0|1,0,1]=4 6721 B12R1.25 CC1=CC=CN(CCCO)C1=O Amb18041290 [0,2,0,0,0,0|2,0,0]=4 6722 B12R1.25 CCCCc1cccc(Cl)c1O Amb24584452 [0,2,0,0,0,0|2,0,0]=4 6723 B12R1.25 CCCCc1cccc(F)c1N Amb25842564 [0,2,0,0,0,0|2,0,0]=4 6724 B12R1.25 CCCCc1cccc(N)c1Cl Amb22229240 [0,2,0,0,0,0|2,0,0]=4 6725 B12R1.25 CCCNc1cccc(Cl)c1N Amb24377739 [0,2,0,0,0,0|2,0,0]=4 6726 B12R1.25 CCCNc1cccc(F)c1F Amb18793935 [0,2,0,0,0,0|2,0,0]=4 6727 B12R1.25 CCCNc1cccc(F)c1N Amb18968033 [0,2,0,0,0,0|2,0,0]=4 6728 B12R1.25 CCCOC1=CC=CN(C)C1=O Amb19125994 [0,2,0,0,0,0|2,0,0]=4 6729 B12R1.25 CCCOc1[n]ccc(Br)c1Cl Amb24586060 [0,2,0,0,0,0|2,0,0]=4 6730 B12R1.25 CCCOc1[n]ccc(Cl)c1Cl Amb24563139 [0,2,0,0,0,0|2,0,0]=4 6731 B12R1.25 CCCOc1[n]ccc(N)c1Br Amb23455165 [0,2,0,0,0,0|2,0,0]=4 6732 B12R1.25 CCCOc1cc[n]c(Cl)c1F Amb25153967 [0,2,0,0,0,0|2,0,0]=4 6733 B12R1.25 CCCOc1cc[n]c(Cl)c1N Amb25337787 [0,2,0,0,0,0|2,0,0]=4 6734 B12R1.25 CCCOc1cccc(Br)c1F Amb24563134 [0,2,0,0,0,0|1,0,0]=3 6735 B12R1.25 CCCOc1cccc(Br)c1N Amb24406179 [0,2,0,0,0,0|1,0,0]=3 6736 B12R1.25 CCCOc1cccc(C)c1C Amb25051268 [0,2,0,0,0,0|1,0,0]=3 6737 B12R1.25 CCCOc1cccc(F)c1I Amb25057474 [0,2,0,0,0,0|1,0,0]=3 6738 B12R1.25 CCCOc1cccc(F)c1N Amb18288907 [0,2,0,0,0,0|1,0,0]=3 6739 B12R1.25 CCCOc1cccc(N)c1Br Amb25781135 [0,2,0,0,0,0|1,0,0]=3 6740 B12R1.25 CCCOc1cccc(N)c1Cl Amb24381575 [0,2,0,0,0,0|1,0,0]=3 6741 B12R1.25 CCCOc1cccc(O)c1O Amb25092908 [0,2,0,0,0,0|1,0,0]=3 6742 B12R1.25 CCCOc1cccc(S)c1N Amb18271336 [0,2,0,0,0,0|1,0,0]=3 6743 B12R1.25 CCCOc1cccc(c1F)F Amb10839414 [0,2,0,0,0,0|1,0,0]=3 6744 B12R1.25 CCCSc1cccc(Cl)c1N Amb24680543 [0,2,0,0,0,0|1,1,0]=4 6745 B12R1.25 CCCSc1cccc(F)c1N Amb18968084 [0,2,0,0,0,0|1,1,0]=4 6746 B12R1.25 COCOc1cccc(Br)c1Cl Amb25188277 [0,2,0,0,0,0|2,0,0]=4 6747 B12R1.25 COCOc1cccc(Br)c1F Amb24618552 [0,2,0,0,0,0|2,0,0]=4 6748 B12R1.25 COCOc1cccc(Cl)c1Cl Amb24594072 [0,2,0,0,0,0|2,0,0]=4 6749 B12R1.25 COCOc1cccc(F)c1Br Amb24623278 [0,2,0,0,0,0|2,0,0]=4 6750 B12R1.25 COCOc1cccc(F)c1Cl Amb22546881 [0,2,0,0,0,0|2,0,0]=4 6751 B12R1.25 COCOc1cccc(F)c1F Amb22641752 [0,2,0,0,0,0|2,0,0]=4 6752 B12R1.25 CSCOc1cccc(F)c1I Amb24737042 [0,2,0,0,0,0|2,0,0]=4 6753 B12R1.25 Cc1[n]ccc(SCCO)c1Cl Amb25795628 [0,2,0,0,0,0|1,1,0]=4 6754 B12R1.25 Cc1c(Br)[n]ccc1OCCC Amb25834115 [0,2,0,0,0,0|2,0,0]=4 6755 B12R1.25 Cc1c(Br)[n]ccc1OCCO Amb24497837 [0,2,0,0,0,0|1,0,0]=3 6756 B12R1.25 Cc1c(Br)cccc1CCCCl Amb24579173 [0,2,0,0,0,0|2,0,0]=4 6757 B12R1.25 Cc1c(Br)cccc1NCCC Amb24420962 [0,2,0,0,0,0|2,0,0]=4 6758 B12R1.25 Cc1c(CCCN)cccc1C Amb17204309 [0,2,0,0,0,0|2,0,0]=4 6759 B12R1.25 Cc1c(CCCN)cccc1Cl Amb17204335 [0,2,0,0,0,0|2,0,0]=4 6760 B12R1.25 Cc1c(Cl)cccc1CCCO Amb23537657 [0,2,0,0,0,0|1,0,0]=3 6761 B12R1.25 Cc1c(F)cccc1CCCN Amb23442800 [0,2,0,0,0,0|2,0,0]=4 6762 B12R1.25 Cc1c(F)cccc1CCCO Amb23590885 [0,2,0,0,0,0|1,0,0]=3 6763 B12R1.25 Cc1c(F)cccc1NCCC Amb18798862 [0,2,0,0,0,0|2,0,0]=4 6764 B12R1.25 Cc1c(F)cccc1\C=C\CO Amb23442807 [0,2,0,0,0,0|1,0,1]=4 6765 B12R1.25 Cc1c(N)cccc1NCCC Amb18303020 [0,2,0,0,0,0|2,0,0]=4 6766 B12R1.25 Cc1c(N)cccc1NCCF Amb25799841 [0,2,0,0,0,0|2,0,0]=4 6767 B12R1.25 Cc1c(N)cccc1NCCO Amb19002458 [0,2,0,0,0,0|1,0,0]=3 6768 B12R1.25 Cc1c(N)cccc1OCC#C Amb18286186 [0,2,0,0,0,0|1,0,1]=4 6769 B12R1.25 Cc1c(N)cccc1OCC=C Amb18991655 [0,2,0,0,0,0|1,0,1]=4 6770 B12R1.25 Cc1c(N)cccc1OCCF Amb25238113 [0,2,0,0,0,0|1,0,0]=3 6771 B12R1.25 Cc1c(N)cccc1SCCC Amb18791357 [0,2,0,0,0,0|1,1,0]=4 6772 B12R1.25 Cc1c(N)cccc1SCCO Amb19002507 [0,2,0,0,0,0|0,1,0]=3 6773 B12R1.25 Cc1c(NCCCl)cccc1C Amb17335666 [0,2,0,0,0,0|2,0,0]=4 6774 B12R1.25 Cc1c(NCCN)cccc1C Amb17091054 [0,2,0,0,0,0|2,0,0]=4 6775 B12R1.25 Cc1c(NCCN)cccc1Cl Amb17091057 [0,2,0,0,0,0|2,0,0]=4 6776 B12R1.25 Cc1c(O)cccc1OCOC Amb24485681 [0,2,0,0,0,0|2,0,0]=4 6777 B12R1.25 Cc1c(OCCN)cccc1C Amb1138513 [0,2,0,0,0,0|1,0,0]=3 6778 B12R1.25 Cc1c(OCCN)cccc1C Amb2091065 [0,2,0,0,0,0|1,0,0]=3 6779 B12R1.25 Cc1c(OCCS)cccc1C Amb17233945 [0,2,0,0,0,0|0,1,0]=3 6780 B12R1.25 Cc1c(cccc1Br)NCCN Amb24654407 [0,2,0,0,0,0|2,0,0]=4 6781 B12R1.25 Cc1c(cccc1Br)NCCO Amb25144864 [0,2,0,0,0,0|1,0,0]=3 6782 B12R1.25 Cc1c(cccc1Br)OCCN Amb24395348 [0,2,0,0,0,0|1,0,0]=3 6783 B12R1.25 Cc1c(cccc1Cl)NCCF Amb25744159 [0,2,0,0,0,0|2,0,0]=4 6784 B12R1.25 Cc1c(cccc1Cl)OCCN Amb24454848 [0,2,0,0,0,0|1,0,0]=3 6785 B12R1.25 Cc1c(cccc1F)NCCN Amb18251978 [0,2,0,0,0,0|2,0,0]=4 6786 B12R1.25 Cc1c(cccc1F)NCCO Amb18980394 [0,2,0,0,0,0|1,0,0]=3 6787 B12R1.25 Cc1c(cccc1I)NCCF Amb25124421 [0,2,0,0,0,0|2,0,0]=4 6788 B12R1.25 Cc1c(cccc1N)NCCN Amb19002501 [0,2,0,0,0,0|2,0,0]=4 6789 B12R1.25 Cc1cc[n]c(NCCO)c1Cl Amb25160117 [0,2,0,0,0,0|2,0,0]=4 6790 B12R1.25 Cc1cc[n]c(OCCC)c1N Amb24488646 [0,2,0,0,0,0|2,0,0]=4 6791 B12R1.25 Cc1cc[n]c(OCCO)c1N Amb24414249 [0,2,0,0,0,0|1,0,0]=3 6792 B12R1.25 Cc1cc[n]c(SCCO)c1N Amb25705549 [0,2,0,0,0,0|1,1,0]=4 6793 B12R1.25 Cc1cccc(C#CCO)c1C Amb18797805 [0,2,0,0,0,0|1,0,1]=4 6794 B12R1.25 Cc1cccc(CCCBr)c1Br Amb25248971 [0,2,0,0,0,0|2,0,0]=4 6795 B12R1.25 Cc1cccc(CCCBr)c1O Amb25269813 [0,2,0,0,0,0|2,0,0]=4 6796 B12R1.25 Cc1cccc(CCCBr)c1S Amb25195138 [0,2,0,0,0,0|2,0,0]=4 6797 B12R1.25 Cc1cccc(CCCC)c1N Amb24104100 [0,2,0,0,0,0|2,0,0]=4 6798 B12R1.25 Cc1cccc(CCCC)c1O Amb25669631 [0,2,0,0,0,0|2,0,0]=4 6799 B12R1.25 Cc1cccc(CCCCl)c1Cl Amb24656579 [0,2,0,0,0,0|2,0,0]=4 6800 B12R1.25 Cc1cccc(CCCCl)c1O Amb25139391 [0,2,0,0,0,0|2,0,0]=4 6801 B12R1.25 Cc1cccc(CCCN)c1Cl Amb25677548 [0,2,0,0,0,0|2,0,0]=4 6802 B12R1.25 Cc1cccc(CCCN)c1F Amb25135172 [0,2,0,0,0,0|2,0,0]=4 6803 B12R1.25 Cc1cccc(CCCO)c1Br Amb25159971 [0,2,0,0,0,0|1,0,0]=3 6804 B12R1.25 Cc1cccc(CCCO)c1C Amb23537989 [0,2,0,0,0,0|1,0,0]=3 6805 B12R1.25 Cc1cccc(CCCO)c1O Amb24671286 [0,2,0,0,0,0|1,0,0]=3 6806 B12R1.25 Cc1cccc(NCCC)c1Cl Amb25816695 [0,2,0,0,0,0|2,0,0]=4 6807 B12R1.25 Cc1cccc(NCCF)c1Br Amb25108876 [0,2,0,0,0,0|2,0,0]=4 6808 B12R1.25 Cc1cccc(NCCN)c1F Amb25684079 [0,2,0,0,0,0|2,0,0]=4 6809 B12R1.25 Cc1cccc(NCCO)c1Br Amb25046066 [0,2,0,0,0,0|1,0,0]=3 6810 B12R1.25 Cc1cccc(NCCO)c1Cl Amb24652065 [0,2,0,0,0,0|1,0,0]=3 6811 B12R1.25 Cc1cccc(OCC#C)c1C Amb18800358 [0,2,0,0,0,0|1,0,1]=4 6812 B12R1.25 Cc1cccc(OCC#C)c1Cl Amb25160234 [0,2,0,0,0,0|1,0,1]=4 6813 B12R1.25 Cc1cccc(OCC#C)c1F Amb25816986 [0,2,0,0,0,0|1,0,1]=4 6814 B12R1.25 Cc1cccc(OCC#C)c1N Amb18961932 [0,2,0,0,0,0|1,0,1]=4 6815 B12R1.25 Cc1cccc(OCC=C)c1C Amb24342097 [0,2,0,0,0,0|1,0,1]=4 6816 B12R1.25 Cc1cccc(OCC=C)c1Cl Amb24458366 [0,2,0,0,0,0|1,0,1]=4 6817 B12R1.25 Cc1cccc(OCC=C)c1N Amb18991656 [0,2,0,0,0,0|1,0,1]=4 6818 B12R1.25 Cc1cccc(OCCBr)c1F Amb25068549 [0,2,0,0,0,0|1,0,0]=3 6819 B12R1.25 Cc1cccc(OCCF)c1N Amb24487580 [0,2,0,0,0,0|1,0,0]=3 6820 B12R1.25 Cc1cccc(OCCN)c1Cl Amb24447813 [0,2,0,0,0,0|1,0,0]=3 6821 B12R1.25 Cc1cccc(OCCS)c1F Amb25766773 [0,2,0,0,0,0|0,1,0]=3 6822 B12R1.25 Cc1cccc(OCOC)c1N Amb24485680 [0,2,0,0,0,0|2,0,0]=4 6823 B12R1.25 Cc1cccc(OCSC)c1F Amb25162718 [0,2,0,0,0,0|2,0,0]=4 6824 B12R1.25 Cc1cccc(SCCN)c1N Amb25133561 [0,2,0,0,0,0|1,1,0]=4 6825 B12R1.25 Cc1cccc(\C=C/CO)c1O Amb24497313 [0,2,0,0,0,0|1,0,1]=4 6826 B12R1.25 Cc1cccc(\C=C\CO)c1C Amb25139939 [0,2,0,0,0,0|1,0,1]=4 6827 B12R1.25 Cc1cccc(\C=C\CO)c1F Amb24473288 [0,2,0,0,0,0|1,0,1]=4 6828 B12R1.25 Cc1ccnc(c1N)NCCO Amb17213619 [0,2,0,0,0,0|2,0,0]=4 6829 B12R1.25 ClCCCc1cccc(Cl)c1Cl Amb24367464 [0,2,0,0,0,0|2,0,0]=4 6830 B12R1.25 ClCCCc1cccc(I)c1Br Amb25208583 [0,2,0,0,0,0|2,0,0]=4 6831 B12R1.25 ClCCCc1cccc(I)c1I Amb25249930 [0,2,0,0,0,0|2,0,0]=4 6832 B12R1.25 ClCCNc1cccc(c1C)Cl Amb17338051 [0,2,0,0,0,0|2,0,0]=4 6833 B12R1.25 ClCCNc1cccc(c1Cl)Cl Amb17343166 [0,2,0,0,0,0|2,0,0]=4 6834 B12R1.25 Clc1c(I)cccc1CCCBr Amb24656429 [0,2,0,0,0,0|2,0,0]=4 6835 B12R1.25 Clc1c(OCC[NH3+])cccc1Cl Amb2444251 [0,2,0,0,0,0|1,0,0]=3 6836 B12R1.25 Clc1cccc(CCCBr)c1Cl Amb24730274 [0,2,0,0,0,0|2,0,0]=4 6837 B12R1.25 FCCNc1cccc(Cl)c1Cl Amb25108906 [0,2,0,0,0,0|2,0,0]=4 6838 B12R1.25 Fc1c(Cl)cccc1NCCF Amb24693402 [0,2,0,0,0,0|2,0,0]=4 6839 B12R1.25 Fc1cccc(CCCBr)c1Br Amb25039114 [0,2,0,0,0,0|2,0,0]=4 6840 B12R1.25 Fc1cccc(CCCBr)c1F Amb22001598 [0,2,0,0,0,0|2,0,0]=4 6841 B12R1.25 Fc1cccc(CCCCl)c1Br Amb24566065 [0,2,0,0,0,0|2,0,0]=4 6842 B12R1.25 Fc1cccc(CCCCl)c1F Amb19073202 [0,2,0,0,0,0|2,0,0]=4 6843 B12R1.25 Fc1cccc(CCCCl)c1S Amb24712667 [0,2,0,0,0,0|2,0,0]=4 6844 B12R1.25 Fc1cccc(OCCCl)c1F Amb19041934 [0,2,0,0,0,0|1,0,0]=3 6845 B12R1.25 Fc1cccc(OCCS)c1F Amb25806509 [0,2,0,0,0,0|0,1,0]=3 6846 B12R1.25 N#CCOc1cccc(Cl)c1F Amb24557696 [0,2,0,0,0,0|1,0,1]=4 6847 B12R1.25 N#CCOc1cccc(F)c1F Amb18177891 [0,2,0,0,0,0|1,0,1]=4 6848 B12R1.25 N#CCOc1cccc(F)c1I Amb25115772 [0,2,0,0,0,0|1,0,1]=4 6849 B12R1.25 NC1=CC=CN(CCCO)C1=O Amb18295572 [0,2,0,0,0,0|2,0,0]=4 6850 B12R1.25 NC=1C(=O)NC=NC1OCCO Amb25675875 [0,2,0,0,0,0|2,0,0]=4 6851 B12R1.25 NCCCc1cccc(Br)c1O Amb25738591 [0,2,0,0,0,0|2,0,0]=4 6852 B12R1.25 NCCCc1cccc(Cl)c1Br Amb25320523 [0,2,0,0,0,0|2,0,0]=4 6853 B12R1.25 NCCCc1cccc(F)c1Br Amb25683566 [0,2,0,0,0,0|2,0,0]=4 6854 B12R1.25 NCCCc1cccc(O)c1O Amb24426748 [0,2,0,0,0,0|2,0,0]=4 6855 B12R1.25 NCCCc1cccc(c1Cl)Cl Amb17204407 [0,2,0,0,0,0|2,0,0]=4 6856 B12R1.25 NCCNc1cccc(Cl)c1F Amb18909782 [0,2,0,0,0,0|2,0,0]=4 6857 B12R1.25 NCCNc1cccc(F)c1F Amb18908891 [0,2,0,0,0,0|2,0,0]=4 6858 B12R1.25 NCCNc1cccc(F)c1I Amb25723571 [0,2,0,0,0,0|2,0,0]=4 6859 B12R1.25 NCCNc1cccc(c1Cl)Cl Amb17091084 [0,2,0,0,0,0|2,0,0]=4 6860 B12R1.25 NCCOc1cccc(Br)c1F Amb25841484 [0,2,0,0,0,0|1,0,0]=3 6861 B12R1.25 NCCOc1cccc(Cl)c1Br Amb24686813 [0,2,0,0,0,0|1,0,0]=3 6862 B12R1.25 NCCOc1cccc(Cl)c1F Amb25330890 [0,2,0,0,0,0|1,0,0]=3 6863 B12R1.25 NCCOc1cccc(F)c1F Amb19002179 [0,2,0,0,0,0|1,0,0]=3 6864 B12R1.25 NCCOc1cccc(c1Cl)Cl Amb10609908 [0,2,0,0,0,0|1,0,0]=3 6865 B12R1.25 Nc1c(Br)cccc1NCCN Amb25071760 [0,2,0,0,0,0|2,0,0]=4 6866 B12R1.25 Nc1c(CCCBr)cccc1Br Amb25270390 [0,2,0,0,0,0|2,0,0]=4 6867 B12R1.25 Nc1c(Cl)cccc1CCCBr Amb25208690 [0,2,0,0,0,0|2,0,0]=4 6868 B12R1.25 Nc1c(Cl)cccc1NCCN Amb24671070 [0,2,0,0,0,0|2,0,0]=4 6869 B12R1.25 Nc1c(F)cccc1NCCN Amb18991513 [0,2,0,0,0,0|2,0,0]=4 6870 B12R1.25 Nc1c(F)cccc1OCCN Amb24685005 [0,2,0,0,0,0|1,0,0]=3 6871 B12R1.25 Nc1c(O)cccc1CCCCl Amb25208685 [0,2,0,0,0,0|2,0,0]=4 6872 B12R1.25 Nc1c(O)cccc1OCC#N Amb25838848 [0,2,0,0,0,0|1,0,1]=4 6873 B12R1.25 Nc1c([n]c[n]c1Cl)OCCO Amb19002063 [0,2,0,0,0,0|2,0,0]=4 6874 B12R1.25 Nc1c(cccc1Br)NCCF Amb24359399 [0,2,0,0,0,0|2,0,0]=4 6875 B12R1.25 Nc1c(cccc1Cl)NCCF Amb25669798 [0,2,0,0,0,0|2,0,0]=4 6876 B12R1.25 Nc1c(cccc1Cl)OCCO Amb25800609 [0,2,0,0,0,0|0,0,0]=2 6877 B12R1.25 Nc1c(cccc1F)NCCO Amb18968044 [0,2,0,0,0,0|1,0,0]=3 6878 B12R1.25 Nc1c(cccc1F)OCCO Amb18968080 [0,2,0,0,0,0|0,0,0]=2 6879 B12R1.25 Nc1c(cccc1F)SCCO Amb18288911 [0,2,0,0,0,0|0,1,0]=3 6880 B12R1.25 Nc1c(cccc1O)OCCO Amb24621417 [0,2,0,0,0,0|0,0,0]=2 6881 B12R1.25 Nc1cc[n]c(NCCO)c1N Amb24374592 [0,2,0,0,0,0|2,0,0]=4 6882 B12R1.25 Nc1cccc(CCCBr)c1Cl Amb24574270 [0,2,0,0,0,0|2,0,0]=4 6883 B12R1.25 Nc1cccc(CCCBr)c1O Amb25195517 [0,2,0,0,0,0|2,0,0]=4 6884 B12R1.25 Nc1cccc(CCCCl)c1N Amb24695907 [0,2,0,0,0,0|2,0,0]=4 6885 B12R1.25 Nc1cccc(CCCCl)c1O Amb25253604 [0,2,0,0,0,0|2,0,0]=4 6886 B12R1.25 O=CCOc1cccc(Cl)c1F Amb25849144 [0,2,0,0,0,0|0,0,2]=4 6887 B12R1.25 O=CCOc1cccc(F)c1F Amb18789654 [0,2,0,0,0,0|0,0,2]=4 6888 B12R1.25 OCC#Cc1cccc(Cl)c1F Amb25306469 [0,2,0,0,0,0|1,0,1]=4 6889 B12R1.25 OCC#Cc1cccc(F)c1F Amb25148503 [0,2,0,0,0,0|1,0,1]=4 6890 B12R1.25 OCCCN1C=CC=C(Br)C1=O Amb18543189 [0,2,0,0,0,0|2,0,0]=4 6891 B12R1.25 OCCCc1cccc(Cl)c1F Amb24402092 [0,2,0,0,0,0|1,0,0]=3 6892 B12R1.25 OCCCc1cccc(F)c1Br Amb25834826 [0,2,0,0,0,0|1,0,0]=3 6893 B12R1.25 OCCCc1cccc(F)c1Cl Amb25136399 [0,2,0,0,0,0|1,0,0]=3 6894 B12R1.25 OCCCc1cccc(F)c1F Amb18802844 [0,2,0,0,0,0|1,0,0]=3 6895 B12R1.25 OCCCc1cccc(O)c1O Amb25063876 [0,2,0,0,0,0|1,0,0]=3 6896 B12R1.25 OCCCc1cccc(c1Cl)Cl Amb17605780 [0,2,0,0,0,0|1,0,0]=3 6897 B12R1.25 OCCNc1cccc(Br)c1Cl Amb25787091 [0,2,0,0,0,0|1,0,0]=3 6898 B12R1.25 OCCNc1cccc(Cl)c1Br Amb24271233 [0,2,0,0,0,0|1,0,0]=3 6899 B12R1.25 OCCNc1cccc(F)c1Cl Amb25675434 [0,2,0,0,0,0|1,0,0]=3 6900 B12R1.25 OCCNc1cccc(F)c1F Amb18972086 [0,2,0,0,0,0|1,0,0]=3 6901 B12R1.25 OCCNc1cccc(F)c1I Amb24365727 [0,2,0,0,0,0|1,0,0]=3 6902 B12R1.25 OCCOC=1N=CNC(=O)C1Br Amb24621394 [0,2,0,0,0,0|2,0,0]=4 6903 B12R1.25 OCCOC=1N=CNC(=O)C1Cl Amb25319060 [0,2,0,0,0,0|2,0,0]=4 6904 B12R1.25 OCCOc1cccc(Cl)c1F Amb25154046 [0,2,0,0,0,0|0,0,0]=2 6905 B12R1.25 OCCOc1cccc(F)c1F Amb18790271 [0,2,0,0,0,0|0,0,0]=2 6906 B12R1.25 OCCOc1cccc(O)c1O Amb25142616 [0,2,0,0,0,0|0,0,0]=2 6907 B12R1.25 OC\C=C\c1cccc(Cl)c1Cl Amb23555632 [0,2,0,0,0,0|1,0,1]=4 6908 B12R1.25 OC\C=C\c1cccc(Cl)c1F Amb24581201 [0,2,0,0,0,0|1,0,1]=4 6909 B12R1.25 OC\C=C\c1cccc(F)c1F Amb24593079 [0,2,0,0,0,0|1,0,1]=4 6910 B12R1.25 Oc1c(Br)cccc1CCCCl Amb25364541 [0,2,0,0,0,0|2,0,0]=4 6911 B12R1.25 Oc1c(Cl)cccc1CCCBr Amb24759296 [0,2,0,0,0,0|2,0,0]=4 6912 B12R1.25 Oc1c(Cl)cccc1CCCO Amb25098650 [0,2,0,0,0,0|1,0,0]=3 6913 B12R1.25 Oc1c(F)cccc1CCCO Amb24551042 [0,2,0,0,0,0|1,0,0]=3 6914 B12R1.25 Oc1c(I)cccc1CCCBr Amb24527854 [0,2,0,0,0,0|2,0,0]=4 6915 B12R1.25 Oc1c(S)cccc1CCCBr Amb24696726 [0,2,0,0,0,0|2,0,0]=4 6916 B12R1.25 Oc1c(S)cccc1CCCCl Amb24628082 [0,2,0,0,0,0|2,0,0]=4 6917 B12R1.25 Oc1cccc(CCCBr)c1Br Amb25325193 [0,2,0,0,0,0|2,0,0]=4 6918 B12R1.25 Oc1cccc(CCCBr)c1F Amb24679117 [0,2,0,0,0,0|2,0,0]=4 6919 B12R1.25 Oc1cccc(CCCBr)c1I Amb24527846 [0,2,0,0,0,0|2,0,0]=4 6920 B12R1.25 Oc1cccc(CCCCl)c1Br Amb24638371 [0,2,0,0,0,0|2,0,0]=4 6921 B12R1.25 Oc1cccc(\C=C\CO)c1Cl Amb24456130 [0,2,0,0,0,0|1,0,1]=4 6922 B12R1.25 SCCOc1cccc(c1Cl)Cl Amb17245966 [0,2,0,0,0,0|0,1,0]=3 6923 B12R1.25 Sc1c(I)cccc1CCCBr Amb24758199 [0,2,0,0,0,0|2,0,0]=4 6924 B12R1.25 Sc1cccc(CCCBr)c1S Amb25351784 [0,2,0,0,0,0|2,0,0]=4 6925 B12R1.121 C#CCOc1ccccc1CN Amb19514977 [0,2,0,0,0,0|1,0,1]=4 6926 B12R1.121 C#Cc1c[n]ccc1CCCO Amb24702653 [0,2,0,0,0,0|2,0,0]=4 6927 B12R1.121 C#Cc1ccccc1OCCO Amb25092012 [0,2,0,0,0,0|0,0,0]=2 6928 B12R1.121 C=CCOc1ccccc1C=O Amb1211891 [0,2,0,0,0,0|1,0,1]=4 6929 B12R1.121 C=CCOc1ccccc1CO Amb1110020 [0,2,0,0,0,0|1,0,1]=4 6930 B12R1.121 C=CCOc1ccccc1NN Amb25694443 [0,2,0,0,0,0|1,0,1]=4 6931 B12R1.121 C=CCOc1ccccc1[Zn]Br Amb22897941 [0,2,0,0,0,0|1,0,1]=4 6932 B12R1.121 C=Cc1ccccc1C#CCO Amb25236524 [0,2,0,0,0,0|1,0,1]=4 6933 B12R1.121 CCCNc1ccccc1CCl Amb24630890 [0,2,0,0,0,0|2,0,0]=4 6934 B12R1.121 CCCNc1ccccc1CN Amb18800850 [0,2,0,0,0,0|2,0,0]=4 6935 B12R1.121 CCCOc1cc[n]cc1C#N Amb24581068 [0,2,0,0,0,0|2,0,0]=4 6936 B12R1.121 CCCOc1ccc[n]c1NC Amb24740317 [0,2,0,0,0,0|2,0,0]=4 6937 B12R1.121 CCCOc1ccc[n]c1NO Amb24460596 [0,2,0,0,0,0|2,0,0]=4 6938 B12R1.121 CCCOc1ccccc1C=O Amb1033069 [0,2,0,0,0,0|1,0,0]=3 6939 B12R1.121 CCCOc1ccccc1CN Amb1141875 [0,2,0,0,0,0|1,0,0]=3 6940 B12R1.121 CCCOc1ccccc1NC Amb18316381 [0,2,0,0,0,0|1,0,0]=3 6941 B12R1.121 CCCOc1ccccc1NN Amb25751634 [0,2,0,0,0,0|1,0,0]=3 6942 B12R1.121 CCCOc1ccccc1[Zn]Br Amb22897953 [0,2,0,0,0,0|1,0,0]=3 6943 B12R1.121 CCCOc1cccnc1NN Amb17207295 [0,2,0,0,0,0|2,0,0]=4 6944 B12R1.121 CCCOc1ncccc1C=O Amb10807469 [0,2,0,0,0,0|2,0,0]=4 6945 B12R1.121 CCCSc1ccccc1C=O Amb18648423 [0,2,0,0,0,0|1,1,0]=4 6946 B12R1.121 CCCSc1ccccc1[Zn]Br Amb22897954 [0,2,0,0,0,0|1,1,0]=4 6947 B12R1.121 CCc1ccccc1C#CCO Amb24449940 [0,2,0,0,0,0|1,0,1]=4 6948 B12R1.121 CCc1ccccc1NCCN Amb24513622 [0,2,0,0,0,0|2,0,0]=4 6949 B12R1.121 CCc1ccccc1OCC#C Amb18183416 [0,2,0,0,0,0|1,0,1]=4 6950 B12R1.121 CNc1ccccc1OCC#C Amb25106445 [0,2,0,0,0,0|1,0,1]=4 6951 B12R1.121 COCOc1ccccc1C#C Amb22284521 [0,2,0,0,0,0|2,0,0]=4 6952 B12R1.121 COCOc1ccccc1C#N Amb24101329 [0,2,0,0,0,0|2,0,0]=4 6953 B12R1.121 COCOc1ccccc1C=O Amb17594124 [0,2,0,0,0,0|2,0,0]=4 6954 B12R1.121 COCOc1ccccc1CO Amb24104564 [0,2,0,0,0,0|2,0,0]=4 6955 B12R1.121 COc1ccc[n]c1NCCO Amb25046084 [0,2,0,0,0,0|2,0,0]=4 6956 B12R1.121 COc1ccccc1C#CCO Amb18180050 [0,2,0,0,0,0|1,0,1]=4 6957 B12R1.121 COc1ccccc1NCCF Amb25855105 [0,2,0,0,0,0|2,0,0]=4 6958 B12R1.121 COc1ccccc1OCC#C Amb18183490 [0,2,0,0,0,0|1,0,1]=4 6959 B12R1.121 COc1ccccc1OCCN Amb20241252 [0,2,0,0,0,0|1,0,0]=3 6960 B12R1.121 COc1ccccc1SCCN Amb19024665 [0,2,0,0,0,0|1,1,0]=4 6961 B12R1.121 CSc1[n]cccc1OCCO Amb24105861 [0,2,0,0,0,0|1,0,0]=3 6962 B12R1.121 CSc1ccccc1C#CCO Amb25037042 [0,2,0,0,0,0|1,0,1]=4 6963 B12R1.121 CSc1ccccc1NCCF Amb24467958 [0,2,0,0,0,0|2,0,0]=4 6964 B12R1.121 CSc1ccccc1OCC#N Amb22523372 [0,2,0,0,0,0|1,0,1]=4 6965 B12R1.121 CSc1ccccc1OCCN Amb22523348 [0,2,0,0,0,0|1,0,0]=3 6966 B12R1.121 ClCCCc1ccccc1OC Amb17104531 [0,2,0,0,0,0|2,0,0]=4 6967 B12R1.121 ClCCNc1ccccc1C#N Amb17335460 [0,2,0,0,0,0|2,0,0]=4 6968 B12R1.121 ClCCNc1ccccc1CC Amb17335667 [0,2,0,0,0,0|2,0,0]=4 6969 B12R1.121 ClCCNc1ccccc1OC Amb17335806 [0,2,0,0,0,0|2,0,0]=4 6970 B12R1.121 N#CCOc1ccccc1OC Amb2504984 [0,2,0,0,0,0|1,0,1]=4 6971 B12R1.121 N#Cc1[n]cc[n]c1OCCO Amb18798386 [0,2,0,0,0,0|2,0,0]=4 6972 B12R1.121 N#Cc1[n]cccc1OCCF Amb24343804 [0,2,0,0,0,0|2,0,0]=4 6973 B12R1.121 N#Cc1[n]cccc1SCCO Amb25042308 [0,2,0,0,0,0|1,1,0]=4 6974 B12R1.121 N#Cc1c[n]c[n]c1OCCO Amb24475218 [0,2,0,0,0,0|2,0,0]=4 6975 B12R1.121 N#Cc1c[n]ccc1CCCO Amb25088271 [0,2,0,0,0,0|2,0,0]=4 6976 B12R1.121 N#Cc1c[n]ccc1NCCO Amb25059127 [0,2,0,0,0,0|2,0,0]=4 6977 B12R1.121 N#Cc1c[n]ccc1OCCO Amb24568499 [0,2,0,0,0,0|1,0,0]=3 6978 B12R1.121 N#Cc1c[n]ccc1SCCO Amb25683201 [0,2,0,0,0,0|1,1,0]=4 6979 B12R1.121 N#Cc1cc[n]cc1NCCO Amb25772070 [0,2,0,0,0,0|2,0,0]=4 6980 B12R1.121 N#Cc1cc[n]cc1SCCO Amb18648381 [0,2,0,0,0,0|1,1,0]=4 6981 B12R1.121 N#Cc1ccccc1NCCF Amb25305472 [0,2,0,0,0,0|2,0,0]=4 6982 B12R1.121 N#Cc1ccccc1OCC=O Amb18800497 [0,2,0,0,0,0|0,0,2]=4 6983 B12R1.121 N#Cc1ccccc1SCCF Amb24430499 [0,2,0,0,0,0|1,1,0]=4 6984 B12R1.121 N#Cc1ccccc1\C=C\CO Amb18645181 [0,2,0,0,0,0|1,0,1]=4 6985 B12R1.121 NCCCc1ccccc1C#N Amb18251586 [0,2,0,0,0,0|2,0,0]=4 6986 B12R1.121 NCCNc1ccccc1C#N Amb17933166 [0,2,0,0,0,0|2,0,0]=4 6987 B12R1.121 NCCNc1ccccc1C#N Amb18289758 [0,2,0,0,0,0|2,0,0]=4 6988 B12R1.121 NCCNc1ccccc1OC Amb17057753 [0,2,0,0,0,0|2,0,0]=4 6989 B12R1.121 NCCOc1[n]cccc1C#N Amb18296486 [0,2,0,0,0,0|2,0,0]=4 6990 B12R1.121 NCCOc1c[n]ccc1C#N Amb24638541 [0,2,0,0,0,0|2,0,0]=4 6991 B12R1.121 NCCOc1cc[n]cc1C#N Amb25267127 [0,2,0,0,0,0|2,0,0]=4 6992 B12R1.121 NCCOc1ccc[n]c1C#N Amb25736318 [0,2,0,0,0,0|2,0,0]=4 6993 B12R1.121 NCCOc1ccccc1C#N Amb17740016 [0,2,0,0,0,0|1,0,0]=3 6994 B12R1.121 NCCOc1ccccc1OC Amb1210085 [0,2,0,0,0,0|1,0,0]=3 6995 B12R1.121 NCCSc1ccccc1C#N Amb18909080 [0,2,0,0,0,0|1,1,0]=4 6996 B12R1.121 NCc1ccc[n]c1NCCO Amb19025092 [0,2,0,0,0,0|2,0,0]=4 6997 B12R1.121 NCc1ccccc1CCCBr Amb24099890 [0,2,0,0,0,0|2,0,0]=4 6998 B12R1.121 NCc1ccccc1NCCF Amb24594115 [0,2,0,0,0,0|2,0,0]=4 6999 B12R1.121 NCc1ccccc1\C=C\CO Amb24575002 [0,2,0,0,0,0|1,0,1]=4 7000 B12R1.121 O=Cc1ccccc1NCCF Amb24708154 [0,2,0,0,0,0|2,0,0]=4 7001 B12R1.121 OCC#Cc1ccccc1C=O Amb24100546 [0,2,0,0,0,0|1,0,1]=4 7002 B12R1.121 OCC#Cc1ccccc1CO Amb18792412 [0,2,0,0,0,0|1,0,1]=4 7003 B12R1.121 OCCOc1ccccc1OC Amb2209353 [0,2,0,0,0,0|0,0,0]=2 7004 B12R1.121 OC\C=C\c1ccccc1C=O Amb24629278 [0,2,0,0,0,0|1,0,1]=4 7005 B12R1.121 OC\C=C\c1ccccc1OC Amb1110152 [0,2,0,0,0,0|1,0,1]=4 7006 B12R1.121 OCc1ccc[n]c1NCCO Amb18106094 [0,2,0,0,0,0|2,0,0]=4 7007 B12R1.121 OCc1ccccc1NCCO Amb25042975 [0,2,0,0,0,0|1,0,0]=3 7008 B12R1.121 SCCCc1ccccc1OC Amb17400949 [0,2,0,0,0,0|1,1,0]=4 7009 B12R1.121 SCCOc1ccccc1CC Amb17233941 [0,2,0,0,0,0|0,1,0]=3 7010 B12R1.121 SCCOc1ccccc1OC Amb17234095 [0,2,0,0,0,0|0,1,0]=3 7011 B12R1.125 C=C(Br)COc1ccccc1F Amb24484229 [0,2,0,0,0,0|1,0,1]=4 7012 B12R1.125 C=C(Br)COc1ccccc1N Amb18971551 [0,2,0,0,0,0|1,0,1]=4 7013 B12R1.125 C=C(Br)COc1ccccc1O Amb25837219 [0,2,0,0,0,0|1,0,1]=4 7014 B12R1.125 C=C(Cl)COc1ccccc1Cl Amb25724454 [0,2,0,0,0,0|1,0,1]=4 7015 B12R1.125 C=C(Cl)COc1ccccc1N Amb18290043 [0,2,0,0,0,0|1,0,1]=4 7016 B12R1.125 C=C(F)COc1ccccc1Br Amb23570547 [0,2,0,0,0,0|1,0,1]=4 7017 B12R1.125 CC(=C)COc1ccccc1Cl Amb25831212 [0,2,0,0,0,0|1,0,1]=4 7018 B12R1.125 CC(=C)COc1ccccc1F Amb25069154 [0,2,0,0,0,0|1,0,1]=4 7019 B12R1.125 CC(=C)COc1ccccc1I Amb24730906 [0,2,0,0,0,0|1,0,1]=4 7020 B12R1.125 CC(=C)COc1ccccc1N Amb2081551 [0,2,0,0,0,0|1,0,1]=4 7021 B12R1.125 CC(=O)COc1ccccc1Br Amb17226707 [0,2,0,0,0,0|0,0,2]=4 7022 B12R1.125 CC(=O)COc1ccccc1Cl Amb19075143 [0,2,0,0,0,0|0,0,2]=4 7023 B12R1.125 CC(=O)COc1ccccc1I Amb25692816 [0,2,0,0,0,0|0,0,2]=4 7024 B12R1.125 CC(=O)COc1ccccc1N Amb17110085 [0,2,0,0,0,0|0,0,2]=4 7025 B12R1.125 CC(=O)COc1ccccc1O Amb18646466 [0,2,0,0,0,0|0,0,2]=4 7026 B12R1.125 CC(Br)CCc1ccccc1Br Amb24488694 [0,2,0,0,0,0|2,0,0]=4 7027 B12R1.125 CC(C)CNc1ccccc1O Amb25739989 [0,2,0,0,0,0|2,0,0]=4 7028 B12R1.125 CC(C)COC1=CC=CNC1=O Amb18034646 [0,2,0,0,0,0|2,0,0]=4 7029 B12R1.125 CC(C)COc1[n]cccc1Cl Amb25667675 [0,2,0,0,0,0|2,0,0]=4 7030 B12R1.125 CC(C)COc1c[n]ccc1N Amb25188159 [0,2,0,0,0,0|2,0,0]=4 7031 B12R1.125 CC(C)COc1ccc[n]c1Cl Amb25751253 [0,2,0,0,0,0|2,0,0]=4 7032 B12R1.125 CC(C)COc1ccc[n]c1F Amb24657959 [0,2,0,0,0,0|2,0,0]=4 7033 B12R1.125 CC(C)COc1cccc[n+]1[O-] Amb25832556 [0,2,0,0,0,0|2,0,0]=4 7034 B12R1.125 CC(C)COc1ccccc1Cl Amb24632680 [0,2,0,0,0,0|1,0,0]=3 7035 B12R1.125 CC(C)COc1ccccc1F Amb25078524 [0,2,0,0,0,0|1,0,0]=3 7036 B12R1.125 CC(C)COc1ccccc1I Amb25148597 [0,2,0,0,0,0|1,0,0]=3 7037 B12R1.125 CC(C)COc1ccccc1S Amb25844615 [0,2,0,0,0,0|1,0,0]=3 7038 B12R1.125 CC(C)CSc1ccccc1Br Amb24728137 [0,2,0,0,0,0|1,1,0]=4 7039 B12R1.125 CC(C)CSc1ccccc1O Amb18318224 [0,2,0,0,0,0|1,1,0]=4 7040 B12R1.125 CC(C)CSc1ccccc1S Amb25359793 [0,2,0,0,0,0|1,1,0]=4 7041 B12R1.125 CC(CCc1ccccc1N)C Amb13951566 [0,2,0,0,0,0|2,0,0]=4 7042 B12R1.125 CC(CCc1ccccc1O)N Amb17507315 [0,2,0,0,0,0|2,0,0]=4 7043 B12R1.125 CC(CCc1ccccc1O)O Amb17507249 [0,2,0,0,0,0|1,0,0]=3 7044 B12R1.125 CC(CNc1ccccc1Br)O Amb17142610 [0,2,0,0,0,0|1,0,0]=3 7045 B12R1.125 CC(CNc1ccccc1C)O Amb17138592 [0,2,0,0,0,0|1,0,0]=3 7046 B12R1.125 CC(CNc1ccccc1Cl)O Amb17139125 [0,2,0,0,0,0|1,0,0]=3 7047 B12R1.125 CC(CNc1ccccc1F)O Amb17138650 [0,2,0,0,0,0|1,0,0]=3 7048 B12R1.125 CC(COc1ccccc1Br)N Amb17062516 [0,2,0,0,0,0|1,0,0]=3 7049 B12R1.125 CC(COc1ccccc1C)N Amb1124829 [0,2,0,0,0,0|1,0,0]=3 7050 B12R1.125 CC(COc1ccccc1F)N Amb1134402 [0,2,0,0,0,0|1,0,0]=3 7051 B12R1.125 CC(COc1ccccc1N)C Amb1137660 [0,2,0,0,0,0|1,0,0]=3 7052 B12R1.125 CC(COc1ccccc1N)C Amb2140563 [0,2,0,0,0,0|1,0,0]=3 7053 B12R1.125 CC(COc1ccccc1O)C Amb1016836 [0,2,0,0,0,0|1,0,0]=3 7054 B12R1.125 CC(Cl)CCc1ccccc1Br Amb24488697 [0,2,0,0,0,0|2,0,0]=4 7055 B12R1.125 CC(Cl)CCc1ccccc1F Amb19076400 [0,2,0,0,0,0|2,0,0]=4 7056 B12R1.125 CC(Cl)COc1ccccc1Cl Amb25785226 [0,2,0,0,0,0|1,0,0]=3 7057 B12R1.125 CC(Cl)COc1ccccc1F Amb24355402 [0,2,0,0,0,0|1,0,0]=3 7058 B12R1.125 CC(F)CCc1ccccc1N Amb25212968 [0,2,0,0,0,0|2,0,0]=4 7059 B12R1.125 CC(F)COc1ccccc1N Amb25208077 [0,2,0,0,0,0|1,0,0]=3 7060 B12R1.125 CC(F)CSc1ccccc1Br Amb24564104 [0,2,0,0,0,0|1,1,0]=4 7061 B12R1.125 CC(N)CCc1ccccc1N Amb18646140 [0,2,0,0,0,0|2,0,0]=4 7062 B12R1.125 CC(N)COc1ccccc1I Amb25095421 [0,2,0,0,0,0|1,0,0]=3 7063 B12R1.125 CC(N)CSc1ccccc1Cl Amb25696792 [0,2,0,0,0,0|1,1,0]=4 7064 B12R1.125 CC(N)CSc1ccccc1F Amb24597976 [0,2,0,0,0,0|1,1,0]=4 7065 B12R1.125 CC(N)CSc1ccccc1N Amb18648678 [0,2,0,0,0,0|1,1,0]=4 7066 B12R1.125 CC(N)CSc1ccccc1O Amb25816545 [0,2,0,0,0,0|1,1,0]=4 7067 B12R1.125 CC(O)CCN1C=CC=CC1=O Amb18805593 [0,2,0,0,0,0|2,0,0]=4 7068 B12R1.125 CC(O)CCc1cc[n]cc1Cl Amb25053788 [0,2,0,0,0,0|2,0,0]=4 7069 B12R1.125 CC(O)CCc1ccc[n]c1N Amb25726251 [0,2,0,0,0,0|2,0,0]=4 7070 B12R1.125 CC(O)CCc1ccccc1Br Amb25763352 [0,2,0,0,0,0|1,0,0]=3 7071 B12R1.125 CC(O)CCc1ccccc1Cl Amb19075162 [0,2,0,0,0,0|1,0,0]=3 7072 B12R1.125 CC(O)CCc1ccccc1F Amb18805845 [0,2,0,0,0,0|1,0,0]=3 7073 B12R1.125 CC(O)CCc1ccccc1N Amb24485690 [0,2,0,0,0,0|1,0,0]=3 7074 B12R1.125 CC(O)CNc1[n]cccc1Br Amb18292050 [0,2,0,0,0,0|2,0,0]=4 7075 B12R1.125 CC(O)CNc1[n]cccc1F Amb18300637 [0,2,0,0,0,0|2,0,0]=4 7076 B12R1.125 CC(O)CNc1cc[n]cc1Cl Amb24373611 [0,2,0,0,0,0|2,0,0]=4 7077 B12R1.125 CC(O)CNc1ccccc1O Amb18646739 [0,2,0,0,0,0|1,0,0]=3 7078 B12R1.125 CC(O)COc1ccc[n]c1N Amb25854752 [0,2,0,0,0,0|1,0,0]=3 7079 B12R1.125 CC(O)COc1cccc[n+]1[O-] Amb25097547 [0,2,0,0,0,0|1,0,0]=3 7080 B12R1.125 CC(O)COc1ccccc1Cl Amb25337460 [0,2,0,0,0,0|0,0,0]=2 7081 B12R1.125 CC(O)COc1ccccc1F Amb18806458 [0,2,0,0,0,0|0,0,0]=2 7082 B12R1.125 CC(O)COc1ccccc1N Amb18971553 [0,2,0,0,0,0|0,0,0]=2 7083 B12R1.125 CC(O)COc1ccccc1O Amb18646901 [0,2,0,0,0,0|0,0,0]=2 7084 B12R1.125 CC(O)CSc1[n]cccc1Br Amb25100776 [0,2,0,0,0,0|1,1,0]=4 7085 B12R1.125 CC(O)CSc1[n]cccc1Cl Amb24415071 [0,2,0,0,0,0|1,1,0]=4 7086 B12R1.125 CC(O)CSc1[n]cccc1N Amb18969623 [0,2,0,0,0,0|1,1,0]=4 7087 B12R1.125 CC(O)CSc1[n]cccc1O Amb18649167 [0,2,0,0,0,0|1,1,0]=4 7088 B12R1.125 CC(O)CSc1cc[n]cc1N Amb18969622 [0,2,0,0,0,0|1,1,0]=4 7089 B12R1.125 CC(O)CSc1cccc[n+]1[O-] Amb24718225 [0,2,0,0,0,0|1,1,0]=4 7090 B12R1.125 CC(O)CSc1ccccc1F Amb19058401 [0,2,0,0,0,0|0,1,0]=3 7091 B12R1.125 CC(O)CSc1ccccc1N Amb18969617 [0,2,0,0,0,0|0,1,0]=3 7092 B12R1.125 CC(O)CSc1ccccc1O Amb19045466 [0,2,0,0,0,0|0,1,0]=3 7093 B12R1.125 CC(O)\C=C\c1ccccc1Br Amb25086864 [0,2,0,0,0,0|1,0,1]=4 7094 B12R1.125 C[C@@H](COc1ccccc1Br)N Amb17248850 [0,2,0,0,0,0|1,0,0]=3 7095 B12R1.125 C[C@@H](COc1ccccc1C)N Amb17232557 [0,2,0,0,0,0|1,0,0]=3 7096 B12R1.125 C[C@@H](COc1ccccc1Cl)N Amb17234270 [0,2,0,0,0,0|1,0,0]=3 7097 B12R1.125 C[C@@H](COc1ccccc1F)N Amb17232706 [0,2,0,0,0,0|1,0,0]=3 7098 B12R1.125 C[C@@H](N)CCc1ccccc1Cl Amb24117939 [0,2,0,0,0,0|2,0,0]=4 7099 B12R1.125 C[C@@H](N)COc1ccccc1Br Amb18036081 [0,2,0,0,0,0|1,0,0]=3 7100 B12R1.125 C[C@@H](N)COc1ccccc1Cl Amb18538518 [0,2,0,0,0,0|1,0,0]=3 7101 B12R1.125 C[C@@H](N)COc1ccccc1F Amb18538499 [0,2,0,0,0,0|1,0,0]=3 7102 B12R1.125 C[C@@H](O)CNc1cc[n]cc1Br Amb25065990 [0,2,0,0,0,0|2,0,0]=4 7103 B12R1.125 C[C@@H](O)COc1ccccc1O Amb24689528 [0,2,0,0,0,0|0,0,0]=2 7104 B12R1.125 C[C@@H](O)CSc1ccccc1Br Amb24725913 [0,2,0,0,0,0|0,1,0]=3 7105 B12R1.125 C[C@@H](O)CSc1ccccc1Cl Amb25831408 [0,2,0,0,0,0|0,1,0]=3 7106 B12R1.125 C[C@H](N)CCc1ccccc1Cl Amb24470862 [0,2,0,0,0,0|2,0,0]=4 7107 B12R1.125 C[C@H](N)CCc1ccccc1O Amb25149919 [0,2,0,0,0,0|2,0,0]=4 7108 B12R1.125 C[C@H](N)CSc1ccccc1Br Amb24608778 [0,2,0,0,0,0|1,1,0]=4 7109 B12R1.125 C[C@H](N)CSc1ccccc1Cl Amb25825016 [0,2,0,0,0,0|1,1,0]=4 7110 B12R1.125 C[C@H](O)CNc1[n]cccc1Br Amb25160146 [0,2,0,0,0,0|2,0,0]=4 7111 B12R1.125 C[C@H](O)CNc1[n]cccc1Cl Amb24351996 [0,2,0,0,0,0|2,0,0]=4 7112 B12R1.125 C[C@H](O)CNc1cc[n]cc1Cl Amb25717399 [0,2,0,0,0,0|2,0,0]=4 7113 B12R1.125 C[C@H](O)COc1ccccc1F Amb25784865 [0,2,0,0,0,0|0,0,0]=2 7114 B12R1.125 C[C@H](O)CSc1ccccc1Br Amb24497740 [0,2,0,0,0,0|0,1,0]=3 7115 B12R1.125 C[C@H](O)CSc1ccccc1F Amb25073686 [0,2,0,0,0,0|0,1,0]=3 7116 B12R1.125 Cc1[n]cccc1OCC(C)C Amb25154513 [0,2,0,0,0,0|2,0,0]=4 7117 B12R1.125 Cc1[n]cccc1OCC(F)F Amb24723480 [0,2,0,0,0,0|2,0,0]=4 7118 B12R1.125 Cc1[n]cccc1OCC(O)=O Amb24729073 [0,2,0,0,0,0|1,0,1]=4 7119 B12R1.125 Cc1[n]cccc1OC[C@@H](C)O Amb24411996 [0,2,0,0,0,0|1,0,0]=3 7120 B12R1.125 Cc1c[n]ccc1NC[C@@H](C)O Amb25188212 [0,2,0,0,0,0|2,0,0]=4 7121 B12R1.125 Cc1c[n]ccc1NC[C@H](C)O Amb25115834 [0,2,0,0,0,0|2,0,0]=4 7122 B12R1.125 Cc1c[n]ccc1OCC(O)=O Amb25705533 [0,2,0,0,0,0|1,0,1]=4 7123 B12R1.125 Cc1ccc[n]c1NCC(C)O Amb18296068 [0,2,0,0,0,0|2,0,0]=4 7124 B12R1.125 Cc1ccc[n]c1OCC(O)=O Amb25154207 [0,2,0,0,0,0|1,0,1]=4 7125 B12R1.125 Cc1ccc[n]c1SCC(C)O Amb25037300 [0,2,0,0,0,0|1,1,0]=4 7126 B12R1.125 Cc1ccccc1C#C[C@H](C)O Amb25077975 [0,2,0,0,0,0|1,0,1]=4 7127 B12R1.125 Cc1ccccc1CCC(C)Cl Amb19074258 [0,2,0,0,0,0|2,0,0]=4 7128 B12R1.125 Cc1ccccc1CCC(C)O Amb18800836 [0,2,0,0,0,0|1,0,0]=3 7129 B12R1.125 Cc1ccccc1NCC(F)F Amb18793934 [0,2,0,0,0,0|2,0,0]=4 7130 B12R1.125 Cc1ccccc1NC[C@H](C)O Amb25096984 [0,2,0,0,0,0|1,0,0]=3 7131 B12R1.125 Cc1ccccc1OCC(=C)Br Amb24484140 [0,2,0,0,0,0|1,0,1]=4 7132 B12R1.125 Cc1ccccc1OCC(=C)Cl Amb25751372 [0,2,0,0,0,0|1,0,1]=4 7133 B12R1.125 Cc1ccccc1OCC(C)C Amb24590121 [0,2,0,0,0,0|1,0,0]=3 7134 B12R1.125 Cc1ccccc1OCC(C)Cl Amb25189523 [0,2,0,0,0,0|1,0,0]=3 7135 B12R1.125 Cc1ccccc1OCC(C)O Amb18182639 [0,2,0,0,0,0|0,0,0]=2 7136 B12R1.125 Cc1ccccc1OCC(F)F Amb24386309 [0,2,0,0,0,0|1,0,0]=3 7137 B12R1.125 Cc1ccccc1OCC(O)O Amb24420845 [0,2,0,0,0,0|0,0,0]=2 7138 B12R1.125 Cc1ccccc1OC[C@@H](C)N Amb18538491 [0,2,0,0,0,0|1,0,0]=3 7139 B12R1.125 Cc1ccccc1OC[C@H](C)O Amb25068670 [0,2,0,0,0,0|0,0,0]=2 7140 B12R1.125 Cc1ccccc1SCC(C)C Amb25730826 [0,2,0,0,0,0|1,1,0]=4 7141 B12R1.125 Cc1ccccc1SCC(C)O Amb19054504 [0,2,0,0,0,0|0,1,0]=3 7142 B12R1.125 ClC(=O)COc1ccccc1Br Amb16230053 [0,2,0,0,0,0|0,0,2]=4 7143 B12R1.125 ClC(=O)COc1ccccc1C Amb10880009 [0,2,0,0,0,0|0,0,2]=4 7144 B12R1.125 ClC(=O)COc1ccccc1Cl Amb16230049 [0,2,0,0,0,0|0,0,2]=4 7145 B12R1.125 ClC(=O)COc1ccccc1F Amb10880012 [0,2,0,0,0,0|0,0,2]=4 7146 B12R1.125 ClC(Cl)COc1ccccc1I Amb24351985 [0,2,0,0,0,0|1,0,0]=3 7147 B12R1.125 FC(CSc1ccccc1Br)F Amb10976061 [0,2,0,0,0,0|1,1,0]=4 7148 B12R1.125 FC(F)CNc1ccccc1Cl Amb18320405 [0,2,0,0,0,0|2,0,0]=4 7149 B12R1.125 FC(F)CNc1ccccc1I Amb24693475 [0,2,0,0,0,0|2,0,0]=4 7150 B12R1.125 FC(F)COc1ccccc1Br Amb22008304 [0,2,0,0,0,0|1,0,0]=3 7151 B12R1.125 FC(F)COc1ccccc1I Amb24056920 [0,2,0,0,0,0|1,0,0]=3 7152 B12R1.125 Fc1[n]cccc1OCC(F)F Amb24657960 [0,2,0,0,0,0|2,0,0]=4 7153 B12R1.125 Fc1ccccc1NCC(F)F Amb18795536 [0,2,0,0,0,0|2,0,0]=4 7154 B12R1.125 Fc1ccccc1SCC(F)F Amb25763543 [0,2,0,0,0,0|1,1,0]=4 7155 B12R1.125 NC(=N)COc1ccccc1C Amb10610301 [0,2,0,0,0,0|1,0,1]=4 7156 B12R1.125 NC(=N)COc1ccccc1O Amb25326714 [0,2,0,0,0,0|1,0,1]=4 7157 B12R1.125 NC(=O)COc1ccccc1Br Amb1174441 [0,2,0,0,0,0|0,0,2]=4 7158 B12R1.125 NC(=O)COc1ccccc1I Amb15712041 [0,2,0,0,0,0|0,0,2]=4 7159 B12R1.125 NC(=S)COc1ccccc1O Amb24663202 [0,2,0,0,0,0|0,1,1]=4 7160 B12R1.125 Nc1[n]cccc1OCC(F)F Amb18795193 [0,2,0,0,0,0|2,0,0]=4 7161 B12R1.125 Nc1[n]cccc1OCC(O)=O Amb18290784 [0,2,0,0,0,0|1,0,1]=4 7162 B12R1.125 Nc1ccc[n]c1OCC(F)F Amb22059739 [0,2,0,0,0,0|2,0,0]=4 7163 B12R1.125 Nc1ccccc1CCC(O)=O Amb24118035 [0,2,0,0,0,0|1,0,1]=4 7164 B12R1.125 Nc1ccccc1NCC(O)=O Amb18296519 [0,2,0,0,0,0|1,0,1]=4 7165 B12R1.125 Nc1ccccc1OCC(N)=S Amb25329428 [0,2,0,0,0,0|0,1,1]=4 7166 B12R1.125 Nc1ccccc1OCC([O-])=O Amb21972214 [0,2,0,0,0,0|0,0,2]=4 7167 B12R1.125 OC(=O)CCc1ccccc1Cl Amb1209214 [0,2,0,0,0,0|1,0,1]=4 7168 B12R1.125 OC(=O)CCc1ccccc1I Amb10071543 [0,2,0,0,0,0|1,0,1]=4 7169 B12R1.125 OC(=O)CCc1ccccc1N Amb17477727 [0,2,0,0,0,0|1,0,1]=4 7170 B12R1.125 OC(=O)CCc1ccccc1O Amb1211927 [0,2,0,0,0,0|1,0,1]=4 7171 B12R1.125 OC(=O)CCc1ccccc1S Amb18648646 [0,2,0,0,0,0|1,0,1]=4 7172 B12R1.125 OC(=O)CNc1ccccc1C Amb1258286 [0,2,0,0,0,0|1,0,1]=4 7173 B12R1.125 OC(=O)CNc1ccccc1S Amb25124141 [0,2,0,0,0,0|1,0,1]=4 7174 B12R1.125 OC(=O)COc1[n]cccc1Cl Amb18649694 [0,2,0,0,0,0|1,0,1]=4 7175 B12R1.125 OC(=O)COc1ccccc1C Amb1215022 [0,2,0,0,0,0|0,0,1]=3 7176 B12R1.125 OC(=O)COc1ccccc1O Amb1030005 [0,2,0,0,0,0|0,0,1]=3 7177 B12R1.125 OC(=O)CSc1ccccc1Br Amb1113386 [0,2,0,0,0,0|0,1,1]=4 7178 B12R1.125 OC(=O)CSc1ccccc1C Amb1205492 [0,2,0,0,0,0|0,1,1]=4 7179 B12R1.125 OC(=O)CSc1ccccc1Cl Amb1105912 [0,2,0,0,0,0|0,1,1]=4 7180 B12R1.125 OC(=O)CSc1ccccc1F Amb1105913 [0,2,0,0,0,0|0,1,1]=4 7181 B12R1.125 Oc1ccccc1OCC(F)F Amb18795191 [0,2,0,0,0,0|1,0,0]=3 7182 B12R1.125 Oc1ccccc1SCC(F)F Amb18317372 [0,2,0,0,0,0|1,1,0]=4 7183 B12R1.125 Oc1ccccc1SCC(O)=O Amb18294823 [0,2,0,0,0,0|0,1,1]=4 7184 B12R1.125 [O-]C(=O)COc1ccccc1O Amb10789357 [0,2,0,0,0,0|0,0,2]=4 7185 B12R1.267 BrCC\C=C\c1ccccc1C Amb17246876 [0,2,0,0,0,0|2,0,0]=4 7186 B12R1.267 BrCC\C=C\c1ccccc1Cl Amb17258089 [0,2,0,0,0,0|2,0,0]=4 7187 B12R1.267 BrCC\C=C\c1ccccc1F Amb17248420 [0,2,0,0,0,0|2,0,0]=4 7188 B12R1.267 C#CCCNc1ccccc1Cl Amb25118560 [0,2,0,0,0,0|2,0,0]=4 7189 B12R1.267 C#CCCNc1ccccc1F Amb25047099 [0,2,0,0,0,0|2,0,0]=4 7190 B12R1.267 C#CCCOc1[n]cccc1Br Amb24497675 [0,2,0,0,0,0|2,0,0]=4 7191 B12R1.267 C#CCCOc1[n]cccc1N Amb25825804 [0,2,0,0,0,0|2,0,0]=4 7192 B12R1.267 C#CCCOc1cc[n]cc1Br Amb25328085 [0,2,0,0,0,0|2,0,0]=4 7193 B12R1.267 C#CCCOc1ccc[n]c1Cl Amb24485501 [0,2,0,0,0,0|2,0,0]=4 7194 B12R1.267 C#CCCOc1ccc[n]c1N Amb24483335 [0,2,0,0,0,0|2,0,0]=4 7195 B12R1.267 C#CCCOc1ccccc1Cl Amb25748470 [0,2,0,0,0,0|1,0,0]=3 7196 B12R1.267 C#CCCOc1ccccc1F Amb24732557 [0,2,0,0,0,0|1,0,0]=3 7197 B12R1.267 C#CCCOc1ccccc1N Amb18290041 [0,2,0,0,0,0|1,0,0]=3 7198 B12R1.267 C#CCCSc1ccccc1Br Amb25727396 [0,2,0,0,0,0|1,1,0]=4 7199 B12R1.267 C#CCCSc1ccccc1Cl Amb25727168 [0,2,0,0,0,0|1,1,0]=4 7200 B12R1.267 C#CCCSc1ccccc1F Amb25225107 [0,2,0,0,0,0|1,1,0]=4 7201 B12R1.267 C#CCCSc1ccccc1O Amb18790975 [0,2,0,0,0,0|1,1,0]=4 7202 B12R1.267 C#CCOCc1ccccc1Br Amb25107682 [0,2,0,0,0,0|1,0,1]=4 7203 B12R1.267 C=CCCCc1ccccc1C Amb13890662 [0,2,0,0,0,0|2,0,0]=4 7204 B12R1.267 C=CCCNc1ccccc1Cl Amb25373616 [0,2,0,0,0,0|2,0,0]=4 7205 B12R1.267 C=CCCNc1ccccc1I Amb24364914 [0,2,0,0,0,0|2,0,0]=4 7206 B12R1.267 C=CCCOc1ccc[n]c1Br Amb20241441 [0,2,0,0,0,0|2,0,0]=4 7207 B12R1.267 C=CCCOc1ccccc1Br Amb22232193 [0,2,0,0,0,0|1,0,0]=3 7208 B12R1.267 C=CCOCc1ccccc1Br Amb22360706 [0,2,0,0,0,0|1,0,1]=4 7209 B12R1.267 C=CCOCc1ccccc1F Amb22227646 [0,2,0,0,0,0|1,0,1]=4 7210 B12R1.267 C=CCOCc1ccccc1N Amb22503744 [0,2,0,0,0,0|1,0,1]=4 7211 B12R1.267 CC#CCOc1ccccc1I Amb24370471 [0,2,0,0,0,0|1,0,1]=4 7212 B12R1.267 CC#CCOc1ccccc1N Amb18988290 [0,2,0,0,0,0|1,0,1]=4 7213 B12R1.267 CC#CCOc1ccccc1O Amb18798092 [0,2,0,0,0,0|1,0,1]=4 7214 B12R1.267 CCCC#Cc1ccccc1Br Amb25676440 [0,2,0,0,0,0|2,0,0]=4 7215 B12R1.267 CCCC#Cc1ccccc1N Amb25238355 [0,2,0,0,0,0|2,0,0]=4 7216 B12R1.267 CCCCNc1ccccc1O Amb18646353 [0,2,0,0,0,0|2,0,0]=4 7217 B12R1.267 CCCCNc1ccccc1S Amb25805362 [0,2,0,0,0,0|2,0,0]=4 7218 B12R1.267 CCCCOC1=CC=CNC1=O Amb18034630 [0,2,0,0,0,0|2,0,0]=4 7219 B12R1.267 CCCCOc1[n]cccc1Cl Amb24308905 [0,2,0,0,0,0|2,0,0]=4 7220 B12R1.267 CCCCOc1ccc[n]c1Br Amb20242847 [0,2,0,0,0,0|2,0,0]=4 7221 B12R1.267 CCCCOc1ccc[n]c1Cl Amb20242808 [0,2,0,0,0,0|2,0,0]=4 7222 B12R1.267 CCCCOc1ccccc1N Amb1033054 [0,2,0,0,0,0|1,0,0]=3 7223 B12R1.267 CCCNCc1ccccc1Br Amb19892805 [0,2,0,0,0,0|2,0,0]=4 7224 B12R1.267 CCCNCc1ccccc1O Amb20673481 [0,2,0,0,0,0|2,0,0]=4 7225 B12R1.267 CCCSCc1ccccc1Br Amb22228182 [0,2,0,0,0,0|1,1,0]=4 7226 B12R1.267 CCC\C=C/c1ccccc1O Amb24662307 [0,2,0,0,0,0|2,0,0]=4 7227 B12R1.267 CCC\C=C\c1ccccc1O Amb24707025 [0,2,0,0,0,0|2,0,0]=4 7228 B12R1.267 CCC\C=N\c1ccccc1N Amb24485477 [0,2,0,0,0,0|2,0,0]=4 7229 B12R1.267 CCC\N=C\c1ccccc1O Amb24408352 [0,2,0,0,0,0|2,0,0]=4 7230 B12R1.267 CNCCCc1ccccc1Br Amb17605546 [0,2,0,0,0,0|2,0,0]=4 7231 B12R1.267 CNCCCc1ccccc1C Amb17104499 [0,2,0,0,0,0|2,0,0]=4 7232 B12R1.267 CNCCCc1ccccc1Cl Amb17104507 [0,2,0,0,0,0|2,0,0]=4 7233 B12R1.267 CNCCCc1ccccc1F Amb17104502 [0,2,0,0,0,0|2,0,0]=4 7234 B12R1.267 CNCCNc1ccccc1Br Amb18312614 [0,2,0,0,0,0|2,0,0]=4 7235 B12R1.267 CNCCNc1ccccc1C Amb15772130 [0,2,0,0,0,0|2,0,0]=4 7236 B12R1.267 CNCCNc1ccccc1Cl Amb19025278 [0,2,0,0,0,0|2,0,0]=4 7237 B12R1.267 CNCCNc1ccccc1F Amb19025282 [0,2,0,0,0,0|2,0,0]=4 7238 B12R1.267 CNCCOc1ccccc1C Amb1222745 [0,2,0,0,0,0|1,0,0]=3 7239 B12R1.267 CNCCOc1ccccc1C Amb2140560 [0,2,0,0,0,0|1,0,0]=3 7240 B12R1.267 CNCCOc1ccccc1Cl Amb1669286 [0,2,0,0,0,0|1,0,0]=3 7241 B12R1.267 CNCCOc1ccccc1F Amb1669285 [0,2,0,0,0,0|1,0,0]=3 7242 B12R1.267 CNCCOc1ccccc1F Amb2132299 [0,2,0,0,0,0|1,0,0]=3 7243 B12R1.267 CNCCOc1ccccc1N Amb17232613 [0,2,0,0,0,0|1,0,0]=3 7244 B12R1.267 COCC#Cc1ccccc1Cl Amb25693189 [0,2,0,0,0,0|1,0,1]=4 7245 B12R1.267 COCCNc1[n]cccc1F Amb18314046 [0,2,0,0,0,0|2,0,0]=4 7246 B12R1.267 COCCNc1c[n]ccc1N Amb25059984 [0,2,0,0,0,0|2,0,0]=4 7247 B12R1.267 COCCNc1ccc[n]c1Br Amb25738806 [0,2,0,0,0,0|2,0,0]=4 7248 B12R1.267 COCCNc1ccc[n]c1N Amb24649774 [0,2,0,0,0,0|2,0,0]=4 7249 B12R1.267 COCCOc1[n]cccc1Br Amb19448504 [0,2,0,0,0,0|1,0,0]=3 7250 B12R1.267 COCCOc1ccccc1N Amb22492333 [0,2,0,0,0,0|0,0,0]=2 7251 B12R1.267 COCOCc1ccccc1Br Amb21964629 [0,2,0,0,0,0|2,0,0]=4 7252 B12R1.267 CSCCNc1ccccc1Cl Amb24451973 [0,2,0,0,0,0|1,1,0]=4 7253 B12R1.267 CSCCNc1ccccc1F Amb19025512 [0,2,0,0,0,0|1,1,0]=4 7254 B12R1.267 C\C=C\COc1ccccc1F Amb24388004 [0,2,0,0,0,0|1,0,1]=4 7255 B12R1.267 C\C=C\COc1ccccc1I Amb25841807 [0,2,0,0,0,0|1,0,1]=4 7256 B12R1.267 C\C=C\COc1ccccc1N Amb18290042 [0,2,0,0,0,0|1,0,1]=4 7257 B12R1.267 Cc1[n]cccc1OCCC#C Amb25307450 [0,2,0,0,0,0|2,0,0]=4 7258 B12R1.267 Cc1c[n]ccc1C#CCCO Amb24441297 [0,2,0,0,0,0|2,0,0]=4 7259 B12R1.267 Cc1cc[n]cc1C#CCCO Amb24735671 [0,2,0,0,0,0|2,0,0]=4 7260 B12R1.267 Cc1cc[n]cc1NCCOC Amb24452333 [0,2,0,0,0,0|2,0,0]=4 7261 B12R1.267 Cc1ccc[n]c1NCCCO Amb18801091 [0,2,0,0,0,0|2,0,0]=4 7262 B12R1.267 Cc1ccc[n]c1NCCOC Amb18801090 [0,2,0,0,0,0|2,0,0]=4 7263 B12R1.267 Cc1ccccc1C#CCCCl Amb18796084 [0,2,0,0,0,0|2,0,0]=4 7264 B12R1.267 Cc1ccccc1C#CCCN Amb25153987 [0,2,0,0,0,0|2,0,0]=4 7265 B12R1.267 Cc1ccccc1C#CCCO Amb18792226 [0,2,0,0,0,0|1,0,0]=3 7266 B12R1.267 Cc1ccccc1CCCC#N Amb24502058 [0,2,0,0,0,0|2,0,0]=4 7267 B12R1.267 Cc1ccccc1CCCCN Amb17991254 [0,2,0,0,0,0|2,0,0]=4 7268 B12R1.267 Cc1ccccc1CCCCS Amb18564154 [0,2,0,0,0,0|1,1,0]=4 7269 B12R1.267 Cc1ccccc1COCC#C Amb24493349 [0,2,0,0,0,0|1,0,1]=4 7270 B12R1.267 Cc1ccccc1C\C=C\CO Amb24592563 [0,2,0,0,0,0|1,0,1]=4 7271 B12R1.267 Cc1ccccc1NCCC#C Amb24444032 [0,2,0,0,0,0|2,0,0]=4 7272 B12R1.267 Cc1ccccc1NCCC=C Amb25073730 [0,2,0,0,0,0|2,0,0]=4 7273 B12R1.267 Cc1ccccc1NCCN=C Amb24406582 [0,2,0,0,0,0|2,0,0]=4 7274 B12R1.267 Cc1ccccc1NCCNC Amb21959972 [0,2,0,0,0,0|2,0,0]=4 7275 B12R1.267 Cc1ccccc1NCCSC Amb19025516 [0,2,0,0,0,0|1,1,0]=4 7276 B12R1.267 Cc1ccccc1OCC#CC Amb25081759 [0,2,0,0,0,0|1,0,1]=4 7277 B12R1.267 Cc1ccccc1SCCC#C Amb25849161 [0,2,0,0,0,0|1,1,0]=4 7278 B12R1.267 Cc1ccccc1SCCC#N Amb17740947 [0,2,0,0,0,0|1,1,0]=4 7279 B12R1.267 Cc1ccccc1S\C=C\CO Amb24412213 [0,2,0,0,0,0|0,1,1]=4 7280 B12R1.267 Cc1ccccc1\C=N\CCO Amb24675358 [0,2,0,0,0,0|1,0,0]=3 7281 B12R1.267 ClCCCOc1ccccc1C Amb1141955 [0,2,0,0,0,0|1,0,0]=3 7282 B12R1.267 ClCCCOc1ccccc1Cl Amb1135755 [0,2,0,0,0,0|1,0,0]=3 7283 B12R1.267 ClCCCOc1ccccc1F Amb1131839 [0,2,0,0,0,0|1,0,0]=3 7284 B12R1.267 ClCC\C=C\c1ccccc1C Amb17233777 [0,2,0,0,0,0|2,0,0]=4 7285 B12R1.267 ClCC\C=C\c1ccccc1Cl Amb17237226 [0,2,0,0,0,0|2,0,0]=4 7286 B12R1.267 ClCC\C=C\c1ccccc1F Amb17234150 [0,2,0,0,0,0|2,0,0]=4 7287 B12R1.267 Cl\C=C\COc1ccccc1I Amb24410456 [0,2,0,0,0,0|1,0,1]=4 7288 B12R1.267 Clc1ccccc1C#CCCCl Amb18322039 [0,2,0,0,0,0|2,0,0]=4 7289 B12R1.267 FCCCNc1ccccc1Cl Amb24426496 [0,2,0,0,0,0|2,0,0]=4 7290 B12R1.267 FCCCNc1ccccc1I Amb25847224 [0,2,0,0,0,0|2,0,0]=4 7291 B12R1.267 FCCCOc1ccccc1Br Amb22008306 [0,2,0,0,0,0|1,0,0]=3 7292 B12R1.267 Fc1ccccc1C#CCCCl Amb19074251 [0,2,0,0,0,0|2,0,0]=4 7293 B12R1.267 Fc1ccccc1CCCCS Amb18066143 [0,2,0,0,0,0|1,1,0]=4 7294 B12R1.267 Fc1ccccc1NCCCF Amb24460043 [0,2,0,0,0,0|2,0,0]=4 7295 B12R1.267 N#CCCCc1ccccc1Br Amb25732390 [0,2,0,0,0,0|2,0,0]=4 7296 B12R1.267 N#CCCCc1ccccc1O Amb24679850 [0,2,0,0,0,0|2,0,0]=4 7297 B12R1.267 N#CCCNc1ccccc1F Amb1103848 [0,2,0,0,0,0|2,0,0]=4 7298 B12R1.267 N#CCCOc1ccccc1C Amb1635755 [0,2,0,0,0,0|1,0,0]=3 7299 B12R1.267 N#CCCOc1ccccc1F Amb1148995 [0,2,0,0,0,0|1,0,0]=3 7300 B12R1.267 N#CCCOc1ccccc1O Amb25735836 [0,2,0,0,0,0|1,0,0]=3 7301 B12R1.267 N#CCCSc1ccccc1O Amb25093813 [0,2,0,0,0,0|1,1,0]=4 7302 B12R1.267 N#CCOCc1ccccc1Br Amb25088050 [0,2,0,0,0,0|1,0,1]=4 7303 B12R1.267 NCCC#Cc1ccccc1Cl Amb24439812 [0,2,0,0,0,0|2,0,0]=4 7304 B12R1.267 NCCCCc1ccccc1Br Amb18069064 [0,2,0,0,0,0|2,0,0]=4 7305 B12R1.267 NCCCCc1ccccc1Cl Amb22904185 [0,2,0,0,0,0|2,0,0]=4 7306 B12R1.267 NCCCCc1ccccc1F Amb18524598 [0,2,0,0,0,0|2,0,0]=4 7307 B12R1.267 NCCCCc1ccccc1O Amb18828230 [0,2,0,0,0,0|2,0,0]=4 7308 B12R1.267 NCCCNc1ccccc1C Amb17057721 [0,2,0,0,0,0|2,0,0]=4 7309 B12R1.267 NCCCNc1ccccc1Cl Amb17057727 [0,2,0,0,0,0|2,0,0]=4 7310 B12R1.267 NCCCNc1ccccc1F Amb17057724 [0,2,0,0,0,0|2,0,0]=4 7311 B12R1.267 NCCCNc1ccccc1O Amb25214340 [0,2,0,0,0,0|2,0,0]=4 7312 B12R1.267 NCCCOc1ccccc1C Amb1136099 [0,2,0,0,0,0|1,0,0]=3 7313 B12R1.267 NCCCOc1ccccc1F Amb1107911 [0,2,0,0,0,0|1,0,0]=3 7314 B12R1.267 NCCCOc1ccccc1F Amb1221365 [0,2,0,0,0,0|1,0,0]=3 7315 B12R1.267 NCCNCc1ccccc1Br Amb18306264 [0,2,0,0,0,0|2,0,0]=4 7316 B12R1.267 NCCNCc1ccccc1Cl Amb10075510 [0,2,0,0,0,0|2,0,0]=4 7317 B12R1.267 NCCNCc1ccccc1F Amb10075506 [0,2,0,0,0,0|2,0,0]=4 7318 B12R1.267 NCCNCc1ccccc1O Amb19005483 [0,2,0,0,0,0|2,0,0]=4 7319 B12R1.267 NCCOCc1ccccc1Br Amb19020774 [0,2,0,0,0,0|1,0,0]=3 7320 B12R1.267 NCCOCc1ccccc1C Amb17061814 [0,2,0,0,0,0|1,0,0]=3 7321 B12R1.267 NCCOCc1ccccc1F Amb17061817 [0,2,0,0,0,0|1,0,0]=3 7322 B12R1.267 NCC\C=C\c1ccccc1Br Amb25129350 [0,2,0,0,0,0|2,0,0]=4 7323 B12R1.267 NCC\C=C\c1ccccc1C Amb17232386 [0,2,0,0,0,0|2,0,0]=4 7324 B12R1.267 NCC\C=C\c1ccccc1Cl Amb17233874 [0,2,0,0,0,0|2,0,0]=4 7325 B12R1.267 NCC\C=C\c1ccccc1F Amb17232531 [0,2,0,0,0,0|2,0,0]=4 7326 B12R1.267 NCC\N=C\c1ccccc1[O-] Amb24585164 [0,2,0,0,0,0|2,0,0]=4 7327 B12R1.267 NNCCOc1ccccc1Br Amb17407554 [0,2,0,0,0,0|1,0,0]=3 7328 B12R1.267 NNCCOc1ccccc1C Amb2282444 [0,2,0,0,0,0|1,0,0]=3 7329 B12R1.267 NNCCOc1ccccc1C Amb2370790 [0,2,0,0,0,0|1,0,0]=3 7330 B12R1.267 NNCCOc1ccccc1Cl Amb1114795 [0,2,0,0,0,0|1,0,0]=3 7331 B12R1.267 NNCCOc1ccccc1F Amb17400321 [0,2,0,0,0,0|1,0,0]=3 7332 B12R1.267 NOCC#Cc1ccccc1F Amb25773644 [0,2,0,0,0,0|1,0,1]=4 7333 B12R1.267 NOCCCc1ccccc1C Amb17089549 [0,2,0,0,0,0|1,0,0]=3 7334 B12R1.267 NOCCCc1ccccc1Cl Amb17089558 [0,2,0,0,0,0|1,0,0]=3 7335 B12R1.267 NOCCCc1ccccc1F Amb17089552 [0,2,0,0,0,0|1,0,0]=3 7336 B12R1.267 NOCCOc1ccccc1Br Amb17088297 [0,2,0,0,0,0|0,0,0]=2 7337 B12R1.267 NOCCOc1ccccc1C Amb17088288 [0,2,0,0,0,0|0,0,0]=2 7338 B12R1.267 NOCCOc1ccccc1Cl Amb17088294 [0,2,0,0,0,0|0,0,0]=2 7339 B12R1.267 NOCCOc1ccccc1F Amb17088291 [0,2,0,0,0,0|0,0,0]=2 7340 B12R1.267 Nc1cc[n]cc1NCCCO Amb25330082 [0,2,0,0,0,0|2,0,0]=4 7341 B12R1.267 Nc1ccccc1CCCC#N Amb25253484 [0,2,0,0,0,0|2,0,0]=4 7342 B12R1.267 Nc1ccccc1NCCCN Amb24367240 [0,2,0,0,0,0|2,0,0]=4 7343 B12R1.267 Nc1ccccc1OCCC#N Amb18971549 [0,2,0,0,0,0|1,0,0]=3 7344 B12R1.267 Nc1ccccc1OCCCF Amb23539407 [0,2,0,0,0,0|1,0,0]=3 7345 B12R1.267 Nc1ccccc1OC\C=C\Br Amb24749836 [0,2,0,0,0,0|1,0,1]=4 7346 B12R1.267 Nc1ccccc1OC\C=C\Cl Amb18971536 [0,2,0,0,0,0|1,0,1]=4 7347 B12R1.267 Nc1ccccc1\C=C\CCN Amb25805143 [0,2,0,0,0,0|2,0,0]=4 7348 B12R1.267 Nc1ccccc1\C=C\CCO Amb24623669 [0,2,0,0,0,0|1,0,0]=3 7349 B12R1.267 Nc1ncccc1OCCCO Amb17206812 [0,2,0,0,0,0|1,0,0]=3 7350 B12R1.267 O=CCCOc1ccccc1Br Amb17099971 [0,2,0,0,0,0|0,0,1]=3 7351 B12R1.267 OCCC#Cc1cc[n]cc1F Amb25118228 [0,2,0,0,0,0|2,0,0]=4 7352 B12R1.267 OCCC#Cc1ccccc1Cl Amb18796383 [0,2,0,0,0,0|1,0,0]=3 7353 B12R1.267 OCCC#Cc1ccccc1F Amb18800777 [0,2,0,0,0,0|1,0,0]=3 7354 B12R1.267 OCCCNc1[n]cccc1Br Amb19015766 [0,2,0,0,0,0|2,0,0]=4 7355 B12R1.267 OCCCNc1[n]cccc1F Amb19029642 [0,2,0,0,0,0|2,0,0]=4 7356 B12R1.267 OCCCNc1cc[n]cc1Br Amb25314096 [0,2,0,0,0,0|2,0,0]=4 7357 B12R1.267 OCCCNc1cccc[n+]1O Amb17308217 [0,2,0,0,0,0|2,0,0]=4 7358 B12R1.267 OCCCNc1ccccc1Br Amb17306220 [0,2,0,0,0,0|1,0,0]=3 7359 B12R1.267 OCCCNc1ccccc1C Amb17306598 [0,2,0,0,0,0|1,0,0]=3 7360 B12R1.267 OCCCNc1ccccc1Cl Amb17306039 [0,2,0,0,0,0|1,0,0]=3 7361 B12R1.267 OCCCNc1ccccc1F Amb17306155 [0,2,0,0,0,0|1,0,0]=3 7362 B12R1.267 OCCNCc1ccc[n]c1Cl Amb24048984 [0,2,0,0,0,0|2,0,0]=4 7363 B12R1.267 OCCNCc1ccccc1Cl Amb13949019 [0,2,0,0,0,0|1,0,0]=3 7364 B12R1.267 OCCNCc1ccccc1I Amb21861540 [0,2,0,0,0,0|1,0,0]=3 7365 B12R1.267 OCC\C=C\c1ccccc1Cl Amb25670027 [0,2,0,0,0,0|1,0,0]=3 7366 B12R1.267 OCC\C=C\c1ccccc1F Amb25221113 [0,2,0,0,0,0|1,0,0]=3 7367 B12R1.267 OCC\N=C\c1ccccc1F Amb25769365 [0,2,0,0,0,0|1,0,0]=3 7368 B12R1.267 ONCCOc1ccccc1Br Amb17088423 [0,2,0,0,0,0|0,0,0]=2 7369 B12R1.267 ONCCOc1ccccc1C Amb17088414 [0,2,0,0,0,0|0,0,0]=2 7370 B12R1.267 ONCCOc1ccccc1Cl Amb17088420 [0,2,0,0,0,0|0,0,0]=2 7371 B12R1.267 ONCCOc1ccccc1F Amb17088417 [0,2,0,0,0,0|0,0,0]=2 7372 B12R1.267 Oc1ccccc1OCCCF Amb23449023 [0,2,0,0,0,0|1,0,0]=3 7373 B12R1.267 Oc1ccccc1\C=N\CCO Amb24633463 [0,2,0,0,0,0|1,0,0]=3 7374 B12R1.267 SCCCCc1ccccc1Br Amb18576923 [0,2,0,0,0,0|1,1,0]=4 7375 B12R1.267 SCCCCc1ccccc1Cl Amb18066299 [0,2,0,0,0,0|1,1,0]=4 7376 B12R1.267 SCCCOc1ccccc1Br Amb17258957 [0,2,0,0,0,0|0,1,0]=3 7377 B12R1.267 SCCCOc1ccccc1C Amb17233940 [0,2,0,0,0,0|0,1,0]=3 7378 B12R1.267 SCCCOc1ccccc1Cl Amb17237588 [0,2,0,0,0,0|0,1,0]=3 7379 B12R1.267 SCCCOc1ccccc1F Amb17234296 [0,2,0,0,0,0|0,1,0]=3 7380 B12R1.267 [C-]#[N+]CCCc1ccccc1Br Amb25364511 [0,2,0,0,0,0|2,0,0]=4 7381 B12R1.267 [C-]#[N+]CCCc1ccccc1F Amb24754342 [0,2,0,0,0,0|2,0,0]=4 7382 B12R1.267 [C-]#[N+]CCCc1ccccc1O Amb25202328 [0,2,0,0,0,0|2,0,0]=4 7383 B12R1.267 [C-]#[N+]CCOc1ccccc1Br Amb25196036 [0,2,0,0,0,0|1,0,0]=3 7384 B12R1.267 [C-]#[N+]CCSc1ccccc1Br Amb25762926 [0,2,0,0,0,0|1,1,0]=4 7385 B12R1.267 [C-]#[N+]CCSc1ccccc1C Amb25697577 [0,2,0,0,0,0|1,1,0]=4 7386 B12R1.267 [O-][n+]1ccccc1NCCCO Amb25751367 [0,2,0,0,0,0|2,0,0]=4 7387 B12R1.371 BrCC(Oc1ccccc1Br)C Amb17291820 [0,2,0,0,0,0|1,0,0]=3 7388 B12R1.371 BrCC(Oc1ccccc1C)C Amb17248431 [0,2,0,0,0,0|1,0,0]=3 7389 B12R1.371 BrCC(Oc1ccccc1Cl)C Amb17261129 [0,2,0,0,0,0|1,0,0]=3 7390 B12R1.371 BrCC(Oc1ccccc1F)C Amb17250549 [0,2,0,0,0,0|1,0,0]=3 7391 B12R1.371 CC(C#C)Oc1ccccc1N Amb25724852 [0,2,0,0,0,0|1,0,1]=4 7392 B12R1.371 CC(C#C)Oc1ccccc1O Amb24466963 [0,2,0,0,0,0|1,0,1]=4 7393 B12R1.371 CC(C#N)Oc1ccccc1F Amb18800884 [0,2,0,0,0,0|1,0,1]=4 7394 B12R1.371 CC(C#N)Oc1ccccc1N Amb18283546 [0,2,0,0,0,0|1,0,1]=4 7395 B12R1.371 CC(C#N)Oc1ccccc1O Amb18798181 [0,2,0,0,0,0|1,0,1]=4 7396 B12R1.371 CC(C=C)Oc1ccccc1N Amb24100513 [0,2,0,0,0,0|1,0,1]=4 7397 B12R1.371 CC(C=C)Oc1ccccc1O Amb18798280 [0,2,0,0,0,0|1,0,1]=4 7398 B12R1.371 CC(C=O)Oc1ccccc1Cl Amb25224007 [0,2,0,0,0,0|0,0,2]=4 7399 B12R1.371 CC(CCl)Oc1ccccc1O Amb24096843 [0,2,0,0,0,0|1,0,0]=3 7400 B12R1.371 CC(CN)Cc1ccccc1Br Amb18992226 [0,2,0,0,0,0|2,0,0]=4 7401 B12R1.371 CC(CN)Nc1ccccc1Cl Amb18909432 [0,2,0,0,0,0|2,0,0]=4 7402 B12R1.371 CC(CN)Nc1ccccc1F Amb18908737 [0,2,0,0,0,0|2,0,0]=4 7403 B12R1.371 CC(CN)Nc1ccccc1I Amb24551694 [0,2,0,0,0,0|2,0,0]=4 7404 B12R1.371 CC(CN)Oc1ccccc1Cl Amb19148877 [0,2,0,0,0,0|1,0,0]=3 7405 B12R1.371 CC(CN)Oc1ccccc1F Amb18299438 [0,2,0,0,0,0|1,0,0]=3 7406 B12R1.371 CC(CN)Sc1ccccc1Br Amb18992815 [0,2,0,0,0,0|1,1,0]=4 7407 B12R1.371 CC(CN)Sc1ccccc1Cl Amb18992821 [0,2,0,0,0,0|1,1,0]=4 7408 B12R1.371 CC(CN)Sc1ccccc1F Amb18992820 [0,2,0,0,0,0|1,1,0]=4 7409 B12R1.371 CC(CN)Sc1ccccc1N Amb18909296 [0,2,0,0,0,0|1,1,0]=4 7410 B12R1.371 CC(CN)Sc1ccccc1O Amb18909347 [0,2,0,0,0,0|1,1,0]=4 7411 B12R1.371 CC(CO)Cc1cc[n]cc1F Amb25367851 [0,2,0,0,0,0|2,0,0]=4 7412 B12R1.371 CC(CO)Cc1ccccc1Br Amb25208316 [0,2,0,0,0,0|1,0,0]=3 7413 B12R1.371 CC(CO)Cc1ccccc1Cl Amb25039912 [0,2,0,0,0,0|1,0,0]=3 7414 B12R1.371 CC(CO)Nc1[n]cccc1Br Amb18977528 [0,2,0,0,0,0|2,0,0]=4 7415 B12R1.371 CC(CO)Nc1[n]cccc1F Amb18300638 [0,2,0,0,0,0|2,0,0]=4 7416 B12R1.371 CC(CO)Nc1[n]cccc1I Amb25681220 [0,2,0,0,0,0|2,0,0]=4 7417 B12R1.371 CC(CO)Nc1c[n]ccc1N Amb24752776 [0,2,0,0,0,0|2,0,0]=4 7418 B12R1.371 CC(CO)Nc1cc[n]cc1F Amb24747865 [0,2,0,0,0,0|2,0,0]=4 7419 B12R1.371 CC(CO)Nc1ccc[n]c1N Amb25803740 [0,2,0,0,0,0|2,0,0]=4 7420 B12R1.371 CC(CO)Nc1ccccc1Br Amb18290138 [0,2,0,0,0,0|1,0,0]=3 7421 B12R1.371 CC(CO)Nc1ccccc1Cl Amb18971813 [0,2,0,0,0,0|1,0,0]=3 7422 B12R1.371 CC(CO)Nc1ccccc1F Amb18971852 [0,2,0,0,0,0|1,0,0]=3 7423 B12R1.371 CC(CO)Oc1ccccc1I Amb25828459 [0,2,0,0,0,0|0,0,0]=2 7424 B12R1.371 CC(CO)Oc1ccccc1O Amb24559693 [0,2,0,0,0,0|0,0,0]=2 7425 B12R1.371 CC(CO)Sc1[n]cccc1Br Amb25804892 [0,2,0,0,0,0|1,1,0]=4 7426 B12R1.371 CC(CO)Sc1[n]cccc1N Amb24439608 [0,2,0,0,0,0|1,1,0]=4 7427 B12R1.371 CC(CO)Sc1cc[n]cc1Br Amb24745188 [0,2,0,0,0,0|1,1,0]=4 7428 B12R1.371 CC(CO)Sc1cccc[n+]1[O-] Amb25154653 [0,2,0,0,0,0|1,1,0]=4 7429 B12R1.371 CC(CO)Sc1ccccc1F Amb25330415 [0,2,0,0,0,0|0,1,0]=3 7430 B12R1.371 CC(CO)Sc1ccccc1N Amb25266122 [0,2,0,0,0,0|0,1,0]=3 7431 B12R1.371 CC(Cc1ccc[n]c1N)CO Amb25302419 [0,2,0,0,0,0|2,0,0]=4 7432 B12R1.371 CC(Cc1ccccc1Br)CBr Amb25040689 [0,2,0,0,0,0|2,0,0]=4 7433 B12R1.371 CC(Cc1ccccc1F)CBr Amb25741700 [0,2,0,0,0,0|2,0,0]=4 7434 B12R1.371 CC(Cc1ccccc1F)CCl Amb25349982 [0,2,0,0,0,0|2,0,0]=4 7435 B12R1.371 CCC(=O)Oc1ccccc1F Amb25039137 [0,2,0,0,0,0|1,0,1]=4 7436 B12R1.371 CCC(=O)Oc1ccccc1N Amb24743412 [0,2,0,0,0,0|1,0,1]=4 7437 B12R1.371 CCC(=O)Oc1ccccc1O Amb22167293 [0,2,0,0,0,0|1,0,1]=4 7438 B12R1.371 CCC(Br)Cc1ccccc1Cl Amb24675424 [0,2,0,0,0,0|2,0,0]=4 7439 B12R1.371 CCC(C)Cc1ccccc1N Amb25034567 [0,2,0,0,0,0|2,0,0]=4 7440 B12R1.371 CCC(C)Oc1[n]cccc1Br Amb22044256 [0,2,0,0,0,0|2,0,0]=4 7441 B12R1.371 CCC(C)Oc1cc[n]cc1N Amb18289484 [0,2,0,0,0,0|2,0,0]=4 7442 B12R1.371 CCC(C)Oc1ccc[n]c1Br Amb25111806 [0,2,0,0,0,0|2,0,0]=4 7443 B12R1.371 CCC(C)Oc1ccccc1I Amb24531541 [0,2,0,0,0,0|1,0,0]=3 7444 B12R1.371 CCC(C)Sc1ccccc1O Amb19045078 [0,2,0,0,0,0|1,1,0]=4 7445 B12R1.371 CCC(Cc1ccccc1C)Cl Amb17477425 [0,2,0,0,0,0|2,0,0]=4 7446 B12R1.371 CCC(Cc1ccccc1C)O Amb17138581 [0,2,0,0,0,0|2,0,0]=4 7447 B12R1.371 CCC(Cc1ccccc1Cl)Cl Amb17477603 [0,2,0,0,0,0|2,0,0]=4 7448 B12R1.371 CCC(Cc1ccccc1Cl)O Amb17139101 [0,2,0,0,0,0|2,0,0]=4 7449 B12R1.371 CCC(Cc1ccccc1F)O Amb17138635 [0,2,0,0,0,0|2,0,0]=4 7450 B12R1.371 CCC(Cl)Cc1ccccc1F Amb19046368 [0,2,0,0,0,0|2,0,0]=4 7451 B12R1.371 CCC(N)Cc1ccccc1Br Amb20627508 [0,2,0,0,0,0|2,0,0]=4 7452 B12R1.371 CCC(O)Cc1ccccc1Br Amb24465632 [0,2,0,0,0,0|2,0,0]=4 7453 B12R1.371 CCC(O)Cc1ccccc1N Amb25335274 [0,2,0,0,0,0|2,0,0]=4 7454 B12R1.371 CCC(Oc1ncccc1N)C Amb17093706 [0,2,0,0,0,0|2,0,0]=4 7455 B12R1.371 COC(C)Oc1ccccc1O Amb25334885 [0,2,0,0,0,0|2,0,0]=4 7456 B12R1.371 C[C@@H](CO)Nc1[n]cccc1Cl Amb24408027 [0,2,0,0,0,0|2,0,0]=4 7457 B12R1.371 C[C@@H](CO)Nc1[n]cccc1F Amb25256998 [0,2,0,0,0,0|2,0,0]=4 7458 B12R1.371 C[C@@H](CO)Oc1ccccc1Cl Amb24407533 [0,2,0,0,0,0|0,0,0]=2 7459 B12R1.371 C[C@@H](CO)Oc1ccccc1I Amb22746638 [0,2,0,0,0,0|0,0,0]=2 7460 B12R1.371 C[C@@H](Cc1ccccc1O)CO Amb24633514 [0,2,0,0,0,0|1,0,0]=3 7461 B12R1.371 C[C@H](CO)Cc1ccccc1Cl Amb25157925 [0,2,0,0,0,0|1,0,0]=3 7462 B12R1.371 C[C@H](CO)Cc1ccccc1F Amb25837933 [0,2,0,0,0,0|1,0,0]=3 7463 B12R1.371 C[C@H](CO)Oc1ccccc1I Amb25150105 [0,2,0,0,0,0|0,0,0]=2 7464 B12R1.371 C[C@H](Cc1ccccc1O)CO Amb25094364 [0,2,0,0,0,0|1,0,0]=3 7465 B12R1.371 C\C(\CO)=C/c1ccccc1O Amb25838654 [0,2,0,0,0,0|1,0,1]=4 7466 B12R1.371 C\C(\CO)=C\c1ccccc1Br Amb25335085 [0,2,0,0,0,0|1,0,1]=4 7467 B12R1.371 C\C(\CO)=C\c1ccccc1Cl Amb24557711 [0,2,0,0,0,0|1,0,1]=4 7468 B12R1.371 C\C(\CO)=C\c1ccccc1F Amb24700903 [0,2,0,0,0,0|1,0,1]=4 7469 B12R1.371 C\C(\CO)=C\c1ccccc1O Amb18646032 [0,2,0,0,0,0|1,0,1]=4 7470 B12R1.371 Cc1[n]cccc1OC(C)CN Amb25034818 [0,2,0,0,0,0|2,0,0]=4 7471 B12R1.371 Cc1c[n]ccc1CC(N)CO Amb24549921 [0,2,0,0,0,0|2,0,0]=4 7472 B12R1.371 Cc1c[n]ccc1NC(C)CO Amb24487182 [0,2,0,0,0,0|2,0,0]=4 7473 B12R1.371 Cc1ccc[n]c1CC(N)CO Amb25751493 [0,2,0,0,0,0|2,0,0]=4 7474 B12R1.371 Cc1ccc[n]c1NC(C)CO Amb18296069 [0,2,0,0,0,0|2,0,0]=4 7475 B12R1.371 Cc1ccccc1CC(=O)CO Amb18563611 [0,2,0,0,0,0|1,0,1]=4 7476 B12R1.371 Cc1ccccc1CC(C)CBr Amb25733982 [0,2,0,0,0,0|2,0,0]=4 7477 B12R1.371 Cc1ccccc1CC(C)CO Amb25152371 [0,2,0,0,0,0|1,0,0]=3 7478 B12R1.371 Cc1ccccc1CC(F)CN Amb24745160 [0,2,0,0,0,0|2,0,0]=4 7479 B12R1.371 Cc1ccccc1CC(O)CCl Amb25258048 [0,2,0,0,0,0|2,0,0]=4 7480 B12R1.371 Cc1ccccc1CC(O)CO Amb24615514 [0,2,0,0,0,0|1,0,0]=3 7481 B12R1.371 Cc1ccccc1C[C@@H](N)CC Amb24410901 [0,2,0,0,0,0|2,0,0]=4 7482 B12R1.371 Cc1ccccc1C[C@H](O)CC Amb25157887 [0,2,0,0,0,0|2,0,0]=4 7483 B12R1.371 Cc1ccccc1NC(C)CN Amb18251701 [0,2,0,0,0,0|2,0,0]=4 7484 B12R1.371 Cc1ccccc1NC(C)CO Amb18971809 [0,2,0,0,0,0|1,0,0]=3 7485 B12R1.371 Cc1ccccc1OC(=O)CN Amb19115306 [0,2,0,0,0,0|1,0,1]=4 7486 B12R1.371 Cc1ccccc1OC(Cl)CCl Amb25141618 [0,2,0,0,0,0|1,0,0]=3 7487 B12R1.371 Cc1ccccc1SC(=C)CO Amb25271481 [0,2,0,0,0,0|0,1,1]=4 7488 B12R1.371 Cc1ccccc1SC(C)CN Amb18299446 [0,2,0,0,0,0|1,1,0]=4 7489 B12R1.371 Cc1ccccc1SC(O)CC Amb22228394 [0,2,0,0,0,0|1,1,0]=4 7490 B12R1.371 Cc1ccccc1\C=C(\F)/CO Amb24407513 [0,2,0,0,0,0|1,0,1]=4 7491 B12R1.371 ClCC(=O)Oc1ccccc1O Amb17594841 [0,2,0,0,0,0|1,0,1]=4 7492 B12R1.371 ClCC(Oc1ccccc1Br)C Amb17261132 [0,2,0,0,0,0|1,0,0]=3 7493 B12R1.371 ClCC(Oc1ccccc1C)C Amb17234168 [0,2,0,0,0,0|1,0,0]=3 7494 B12R1.371 ClCC(Oc1ccccc1Cl)C Amb17238289 [0,2,0,0,0,0|1,0,0]=3 7495 B12R1.371 ClCC(Oc1ccccc1F)C Amb17234613 [0,2,0,0,0,0|1,0,0]=3 7496 B12R1.371 N=C1C=CC=CN1CC(O)CO Amb24475826 [0,2,0,0,0,0|2,0,0]=4 7497 B12R1.371 NC(CF)Cc1ccccc1Cl Amb24596044 [0,2,0,0,0,0|2,0,0]=4 7498 B12R1.371 NC(CO)Cc1[n]cccc1Br Amb24581707 [0,2,0,0,0,0|2,0,0]=4 7499 B12R1.371 NC(CO)Cc1cc[n]cc1Br Amb24542635 [0,2,0,0,0,0|2,0,0]=4 7500 B12R1.371 NC(CO)Cc1cc[n]cc1Cl Amb25669679 [0,2,0,0,0,0|2,0,0]=4 7501 B12R1.371 NC(CO)Cc1cc[n]cc1F Amb25261338 [0,2,0,0,0,0|2,0,0]=4 7502 B12R1.371 NC(CO)Cc1ccc[n]c1Cl Amb25241685 [0,2,0,0,0,0|2,0,0]=4 7503 B12R1.371 NC(CO)Cc1ccccc1Br Amb18747032 [0,2,0,0,0,0|1,0,0]=3 7504 B12R1.371 NC(CO)Cc1ccccc1I Amb25200271 [0,2,0,0,0,0|1,0,0]=3 7505 B12R1.371 NC(Cc1ccccc1F)CF Amb25255727 [0,2,0,0,0,0|2,0,0]=4 7506 B12R1.371 NC(Cc1ccccc1O)CO Amb18827210 [0,2,0,0,0,0|1,0,0]=3 7507 B12R1.371 NCC(=O)Oc1ccccc1Br Amb17344446 [0,2,0,0,0,0|1,0,1]=4 7508 B12R1.371 NCC(=O)Oc1ccccc1C Amb17334634 [0,2,0,0,0,0|1,0,1]=4 7509 B12R1.371 NCC(=O)Oc1ccccc1Cl Amb17335803 [0,2,0,0,0,0|1,0,1]=4 7510 B12R1.371 NCC(=O)Oc1ccccc1F Amb17334752 [0,2,0,0,0,0|1,0,1]=4 7511 B12R1.371 NCC(Cc1ccccc1C)O Amb17232545 [0,2,0,0,0,0|2,0,0]=4 7512 B12R1.371 NCC(Cc1ccccc1Cl)O Amb17234263 [0,2,0,0,0,0|2,0,0]=4 7513 B12R1.371 NCC(Cc1ccccc1F)O Amb17232700 [0,2,0,0,0,0|2,0,0]=4 7514 B12R1.371 NCC(O)Cc1ccccc1Br Amb18069447 [0,2,0,0,0,0|2,0,0]=4 7515 B12R1.371 N[C@@H](CO)Cc1ccccc1Cl Amb25106847 [0,2,0,0,0,0|1,0,0]=3 7516 B12R1.371 N[C@@H](CO)Cc1ccccc1F Amb25331070 [0,2,0,0,0,0|1,0,0]=3 7517 B12R1.371 N[C@H](CO)Cc1ccccc1Br Amb24424605 [0,2,0,0,0,0|1,0,0]=3 7518 B12R1.371 N[C@H](CO)Cc1ccccc1Cl Amb22233157 [0,2,0,0,0,0|1,0,0]=3 7519 B12R1.371 N[C@H](CO)Cc1ccccc1F Amb25308478 [0,2,0,0,0,0|1,0,0]=3 7520 B12R1.371 Nc1c[n]ccc1CC(N)CO Amb25287483 [0,2,0,0,0,0|2,0,0]=4 7521 B12R1.371 Nc1ccccc1CC(N)CO Amb25712145 [0,2,0,0,0,0|1,0,0]=3 7522 B12R1.371 Nc1ccccc1C[C@H](N)CO Amb22233158 [0,2,0,0,0,0|1,0,0]=3 7523 B12R1.371 O=C(CCl)Oc1ccccc1Cl Amb24121334 [0,2,0,0,0,0|1,0,1]=4 7524 B12R1.371 O=C(CCl)Oc1ccccc1F Amb23442007 [0,2,0,0,0,0|1,0,1]=4 7525 B12R1.371 OC(Cc1ccccc1F)CCl Amb24355863 [0,2,0,0,0,0|2,0,0]=4 7526 B12R1.371 OCC(=O)Cc1ccccc1Cl Amb18564303 [0,2,0,0,0,0|1,0,1]=4 7527 B12R1.371 OCC(=O)Cc1ccccc1F Amb18805788 [0,2,0,0,0,0|1,0,1]=4 7528 B12R1.371 OCC(=O)Nc1ccccc1Br Amb1109988 [0,2,0,0,0,0|1,0,1]=4 7529 B12R1.371 OCC(=O)Nc1ccccc1C Amb1110662 [0,2,0,0,0,0|1,0,1]=4 7530 B12R1.371 OCC(=O)Nc1ccccc1Cl Amb1111147 [0,2,0,0,0,0|1,0,1]=4 7531 B12R1.371 OCC(=O)Nc1ccccc1F Amb1109775 [0,2,0,0,0,0|1,0,1]=4 7532 B12R1.371 OCC(=O)Oc1ccccc1Cl Amb25072212 [0,2,0,0,0,0|0,0,1]=3 7533 B12R1.371 OCC(=O)Oc1ccccc1F Amb25122488 [0,2,0,0,0,0|0,0,1]=3 7534 B12R1.371 OCC(=O)Oc1ccccc1I Amb25056604 [0,2,0,0,0,0|0,0,1]=3 7535 B12R1.371 OCC(Cc1ccccc1C)N Amb17062685 [0,2,0,0,0,0|1,0,0]=3 7536 B12R1.371 OCC(Cc1ccccc1Cl)N Amb17062694 [0,2,0,0,0,0|1,0,0]=3 7537 B12R1.371 OCC(Cc1ccccc1F)N Amb17062688 [0,2,0,0,0,0|1,0,0]=3 7538 B12R1.371 OCC(O)CN1C=CC=CC1=O Amb25817247 [0,2,0,0,0,0|2,0,0]=4 7539 B12R1.371 OCC(Oc1ccccc1Br)C Amb17249276 [0,2,0,0,0,0|0,0,0]=2 7540 B12R1.371 OCC(Oc1ccccc1C)C Amb17232600 [0,2,0,0,0,0|0,0,0]=2 7541 B12R1.371 OCC(Oc1ccccc1Cl)C Amb17234356 [0,2,0,0,0,0|0,0,0]=2 7542 B12R1.371 OCC(Oc1ccccc1F)C Amb17232739 [0,2,0,0,0,0|0,0,0]=2 7543 B12R1.371 Oc1ccccc1OC(=O)NO Amb24631630 [0,2,0,0,0,0|1,0,1]=4 7544 B12R1.374 BrCCCc1cc(Br)ccc1Br Amb24537172 [0,2,0,0,0,0|2,0,0]=4 7545 B12R1.374 BrCCOc1cc(Br)ccc1Br Amb10068285 [0,2,0,0,0,0|1,0,0]=3 7546 B12R1.374 C#CCOc1cc(Br)ccc1Cl Amb25698581 [0,2,0,0,0,0|1,0,1]=4 7547 B12R1.374 C#CCOc1cc(Cl)ccc1Cl Amb18333170 [0,2,0,0,0,0|1,0,1]=4 7548 B12R1.374 C#CCOc1cc(Cl)ccc1N Amb18809682 [0,2,0,0,0,0|1,0,1]=4 7549 B12R1.374 C#CCOc1cc(Cl)ccc1O Amb25729107 [0,2,0,0,0,0|1,0,1]=4 7550 B12R1.374 C#CCOc1cc(F)ccc1Br Amb25796459 [0,2,0,0,0,0|1,0,1]=4 7551 B12R1.374 C#CCOc1cc(F)ccc1F Amb21963613 [0,2,0,0,0,0|1,0,1]=4 7552 B12R1.374 C#CCOc1cc(F)ccc1N Amb18286184 [0,2,0,0,0,0|1,0,1]=4 7553 B12R1.374 C#CCOc1cc(F)ccc1N Amb19353352 [0,2,0,0,0,0|1,0,1]=4 7554 B12R1.374 C#CCOc1cc(N)ccc1Cl Amb22170470 [0,2,0,0,0,0|1,0,1]=4 7555 B12R1.374 C=CCOC1=CC(=O)C=CC1=O Amb25373844 [0,2,0,0,0,0|1,0,1]=4 7556 B12R1.374 C=CCOc1cc(Br)ccc1Cl Amb25282047 [0,2,0,0,0,0|1,0,1]=4 7557 B12R1.374 C=CCOc1cc(Cl)ccc1F Amb24343683 [0,2,0,0,0,0|1,0,1]=4 7558 B12R1.374 C=CCOc1cc(Cl)ccc1N Amb18991663 [0,2,0,0,0,0|1,0,1]=4 7559 B12R1.374 C=CCOc1cc(F)ccc1Br Amb24605603 [0,2,0,0,0,0|1,0,1]=4 7560 B12R1.374 C=CCOc1cc(F)ccc1Cl Amb25377701 [0,2,0,0,0,0|1,0,1]=4 7561 B12R1.374 C=CCOc1cc(F)ccc1N Amb18298740 [0,2,0,0,0,0|1,0,1]=4 7562 B12R1.374 C=CCOc1cc(N)ccc1Br Amb24525540 [0,2,0,0,0,0|1,0,1]=4 7563 B12R1.374 C=CCOc1cc(N)ccc1Cl Amb23454613 [0,2,0,0,0,0|1,0,1]=4 7564 B12R1.374 C=CCOc1cc(O)ccc1Cl Amb18649015 [0,2,0,0,0,0|1,0,1]=4 7565 B12R1.374 C=CCOc1cc(O)ccc1F Amb24537787 [0,2,0,0,0,0|1,0,1]=4 7566 B12R1.374 CC1=CN(CCCO)C(=O)C=C1 Amb18041286 [0,2,0,0,0,0|2,0,0]=4 7567 B12R1.374 CCCCC1=CC(=O)C=CC1=O Amb24065452 [0,2,0,0,0,0|2,0,0]=4 7568 B12R1.374 CCCCc1cc(Cl)ccc1N Amb25691483 [0,2,0,0,0,0|2,0,0]=4 7569 B12R1.374 CCCCc1cc(Cl)ccc1O Amb25273097 [0,2,0,0,0,0|2,0,0]=4 7570 B12R1.374 CCCCc1cc(N)ccc1Cl Amb25843846 [0,2,0,0,0,0|2,0,0]=4 7571 B12R1.374 CCCCc1cc(O)ccc1O Amb24330377 [0,2,0,0,0,0|2,0,0]=4 7572 B12R1.374 CCCNc1cc(Br)ccc1I Amb25670015 [0,2,0,0,0,0|2,0,0]=4 7573 B12R1.374 CCCNc1cc(Br)ccc1N Amb25738246 [0,2,0,0,0,0|2,0,0]=4 7574 B12R1.374 CCCNc1cc(Cl)ccc1Br Amb25675324 [0,2,0,0,0,0|2,0,0]=4 7575 B12R1.374 CCCNc1cc(F)ccc1N Amb18989853 [0,2,0,0,0,0|2,0,0]=4 7576 B12R1.374 CCCOc1[n]c(Cl)ccc1N Amb24436278 [0,2,0,0,0,0|2,0,0]=4 7577 B12R1.374 CCCOc1cc(Br)ccc1Cl Amb25342832 [0,2,0,0,0,0|1,0,0]=3 7578 B12R1.374 CCCOc1cc(Br)ccc1F Amb24483694 [0,2,0,0,0,0|1,0,0]=3 7579 B12R1.374 CCCOc1cc(Br)ccc1N Amb24727840 [0,2,0,0,0,0|1,0,0]=3 7580 B12R1.374 CCCOc1cc(Cl)c[n]c1Br Amb25343501 [0,2,0,0,0,0|2,0,0]=4 7581 B12R1.374 CCCOc1cc(Cl)ccc1Br Amb25291702 [0,2,0,0,0,0|1,0,0]=3 7582 B12R1.374 CCCOc1cc(Cl)ccc1N Amb18296228 [0,2,0,0,0,0|1,0,0]=3 7583 B12R1.374 CCCOc1cc(Cl)ccc1O Amb25282670 [0,2,0,0,0,0|1,0,0]=3 7584 B12R1.374 CCCOc1cc(F)ccc1F Amb25681585 [0,2,0,0,0,0|1,0,0]=3 7585 B12R1.374 CCCOc1cc(F)ccc1N Amb1132322 [0,2,0,0,0,0|1,0,0]=3 7586 B12R1.374 CCCOc1cc(N)ccc1Cl Amb18649207 [0,2,0,0,0,0|1,0,0]=3 7587 B12R1.374 CCCOc1cc(N)ccc1O Amb25059149 [0,2,0,0,0,0|1,0,0]=3 7588 B12R1.374 CCCOc1cc(O)ccc1N Amb24461245 [0,2,0,0,0,0|1,0,0]=3 7589 B12R1.374 CCCOc1cc(S)ccc1F Amb25692041 [0,2,0,0,0,0|1,0,0]=3 7590 B12R1.374 CCCOc1cc(S)ccc1N Amb25714978 [0,2,0,0,0,0|1,0,0]=3 7591 B12R1.374 CCCSc1cc(Cl)ccc1N Amb25720780 [0,2,0,0,0,0|1,1,0]=4 7592 B12R1.374 CCCSc1cc(F)ccc1N Amb18297864 [0,2,0,0,0,0|1,1,0]=4 7593 B12R1.374 CCCSc1cc(N)ccc1Cl Amb25208915 [0,2,0,0,0,0|1,1,0]=4 7594 B12R1.374 CCCSc1cc(N)ccc1N Amb25124116 [0,2,0,0,0,0|1,1,0]=4 7595 B12R1.374 CCCSc1cc(O)ccc1Cl Amb24689472 [0,2,0,0,0,0|1,1,0]=4 7596 B12R1.374 COCOc1cc(F)ccc1Br Amb21856392 [0,2,0,0,0,0|2,0,0]=4 7597 B12R1.374 COCOc1cc(F)ccc1F Amb10607090 [0,2,0,0,0,0|2,0,0]=4 7598 B12R1.374 COCOc1cc(F)ccc1N Amb25315523 [0,2,0,0,0,0|2,0,0]=4 7599 B12R1.374 COCOc1cc(N)ccc1Cl Amb25140296 [0,2,0,0,0,0|2,0,0]=4 7600 B12R1.374 CSCOc1cc(Br)ccc1Cl Amb24614971 [0,2,0,0,0,0|2,0,0]=4 7601 B12R1.374 CSCOc1cc(Cl)ccc1Cl Amb24370702 [0,2,0,0,0,0|2,0,0]=4 7602 B12R1.374 CSCOc1cc(Cl)ccc1F Amb24516453 [0,2,0,0,0,0|2,0,0]=4 7603 B12R1.374 CSCOc1cc(F)ccc1Br Amb25298156 [0,2,0,0,0,0|2,0,0]=4 7604 B12R1.374 CSCOc1cc(F)ccc1F Amb24516454 [0,2,0,0,0,0|2,0,0]=4 7605 B12R1.374 Cc1[n]cc(Br)c([n]1)OCCO Amb25360085 [0,2,0,0,0,0|2,0,0]=4 7606 B12R1.374 Cc1c[n]c(Cl)[n]c1OCCO Amb25131928 [0,2,0,0,0,0|2,0,0]=4 7607 B12R1.374 Cc1c[n]c(Cl)cc1OCCC Amb24655422 [0,2,0,0,0,0|2,0,0]=4 7608 B12R1.374 Cc1c[n]c(Cl)cc1SCCO Amb25068179 [0,2,0,0,0,0|1,1,0]=4 7609 B12R1.374 Cc1cc(C#CCO)c(C)cc1 Amb18792227 [0,2,0,0,0,0|1,0,1]=4 7610 B12R1.374 Cc1cc(C#CCO)c(F)cc1 Amb18792543 [0,2,0,0,0,0|1,0,1]=4 7611 B12R1.374 Cc1cc(C#CCO)c(O)cc1 Amb24497073 [0,2,0,0,0,0|1,0,1]=4 7612 B12R1.374 Cc1cc(CCCBr)c(C)cc1 Amb24593678 [0,2,0,0,0,0|2,0,0]=4 7613 B12R1.374 Cc1cc(CCCBr)c(O)cc1 Amb24558916 [0,2,0,0,0,0|2,0,0]=4 7614 B12R1.374 Cc1cc(CCCCl)c(C)cc1 Amb18325129 [0,2,0,0,0,0|2,0,0]=4 7615 B12R1.374 Cc1cc(CCCCl)c(F)cc1 Amb25250611 [0,2,0,0,0,0|2,0,0]=4 7616 B12R1.374 Cc1cc(CCCCl)c(I)cc1 Amb25230131 [0,2,0,0,0,0|2,0,0]=4 7617 B12R1.374 Cc1cc(CCCN)c(Cl)cc1 Amb18909370 [0,2,0,0,0,0|2,0,0]=4 7618 B12R1.374 Cc1cc(CCCN)c(O)cc1 Amb18552860 [0,2,0,0,0,0|2,0,0]=4 7619 B12R1.374 Cc1cc(CCCO)c(Cl)cc1 Amb25074743 [0,2,0,0,0,0|1,0,0]=3 7620 B12R1.374 Cc1cc(CCCO)c(F)cc1 Amb25148634 [0,2,0,0,0,0|1,0,0]=3 7621 B12R1.374 Cc1cc(CCCO)c(N)[n]c1 Amb24679609 [0,2,0,0,0,0|2,0,0]=4 7622 B12R1.374 Cc1cc(NCCF)c(Br)cc1 Amb24736608 [0,2,0,0,0,0|2,0,0]=4 7623 B12R1.374 Cc1cc(NCCF)c(C)cc1 Amb24667607 [0,2,0,0,0,0|2,0,0]=4 7624 B12R1.374 Cc1cc(NCCN)c(Br)cc1 Amb25281394 [0,2,0,0,0,0|2,0,0]=4 7625 B12R1.374 Cc1cc(NCCN)c(F)cc1 Amb18299160 [0,2,0,0,0,0|2,0,0]=4 7626 B12R1.374 Cc1cc(NCCO)c(Cl)cc1 Amb24420961 [0,2,0,0,0,0|1,0,0]=3 7627 B12R1.374 Cc1cc(OCC#C)c(C)cc1 Amb18183413 [0,2,0,0,0,0|1,0,1]=4 7628 B12R1.374 Cc1cc(OCC#C)c(Cl)cc1 Amb18809452 [0,2,0,0,0,0|1,0,1]=4 7629 B12R1.374 Cc1cc(OCC#C)c(I)cc1 Amb24421542 [0,2,0,0,0,0|1,0,1]=4 7630 B12R1.374 Cc1cc(OCC#C)c(N)cc1 Amb18286185 [0,2,0,0,0,0|1,0,1]=4 7631 B12R1.374 Cc1cc(OCC#C)c(O)cc1 Amb24408295 [0,2,0,0,0,0|1,0,1]=4 7632 B12R1.374 Cc1cc(OCC#N)c(F)cc1 Amb25088280 [0,2,0,0,0,0|1,0,1]=4 7633 B12R1.374 Cc1cc(OCC=C)c(F)cc1 Amb24572950 [0,2,0,0,0,0|1,0,1]=4 7634 B12R1.374 Cc1cc(OCC=C)c(I)cc1 Amb25318288 [0,2,0,0,0,0|1,0,1]=4 7635 B12R1.374 Cc1cc(OCC=C)c(cc1)N Amb17138557 [0,2,0,0,0,0|1,0,1]=4 7636 B12R1.374 Cc1cc(OCC=O)c(Cl)cc1 Amb19075149 [0,2,0,0,0,0|0,0,2]=4 7637 B12R1.374 Cc1cc(OCCF)c(C)cc1 Amb25238490 [0,2,0,0,0,0|1,0,0]=3 7638 B12R1.374 Cc1cc(OCCF)c(Cl)cc1 Amb25316429 [0,2,0,0,0,0|1,0,0]=3 7639 B12R1.374 Cc1cc(OCCF)c(I)cc1 Amb25807182 [0,2,0,0,0,0|1,0,0]=3 7640 B12R1.374 Cc1cc(OCCN)c(Cl)cc1 Amb21959599 [0,2,0,0,0,0|1,0,0]=3 7641 B12R1.374 Cc1cc(OCCO)c(F)cc1 Amb25225003 [0,2,0,0,0,0|0,0,0]=2 7642 B12R1.374 Cc1cc(OCCO)c(I)cc1 Amb25297123 [0,2,0,0,0,0|0,0,0]=2 7643 B12R1.374 Cc1cc(OCCS)c(F)cc1 Amb25058337 [0,2,0,0,0,0|0,1,0]=3 7644 B12R1.374 Cc1cc(OCCS)c(cc1)Cl Amb17237592 [0,2,0,0,0,0|0,1,0]=3 7645 B12R1.374 Cc1cc(OCSC)c(C)cc1 Amb25180345 [0,2,0,0,0,0|2,0,0]=4 7646 B12R1.374 Cc1ccc(Br)c(c1)NCCC Amb25797222 [0,2,0,0,0,0|2,0,0]=4 7647 B12R1.374 Cc1ccc(Br)cc1CCCS Amb25036393 [0,2,0,0,0,0|1,1,0]=4 7648 B12R1.374 Cc1ccc(Br)cc1OCC#C Amb24116405 [0,2,0,0,0,0|1,0,1]=4 7649 B12R1.374 Cc1ccc(Br)cc1OCC#N Amb24116406 [0,2,0,0,0,0|1,0,1]=4 7650 B12R1.374 Cc1ccc(Br)cc1OCC=C Amb24116404 [0,2,0,0,0,0|1,0,1]=4 7651 B12R1.374 Cc1ccc(Br)cc1OCCBr Amb24116416 [0,2,0,0,0,0|1,0,0]=3 7652 B12R1.374 Cc1ccc(Br)cc1OCCC Amb24116403 [0,2,0,0,0,0|1,0,0]=3 7653 B12R1.374 Cc1ccc(Br)cc1OCCCl Amb25330077 [0,2,0,0,0,0|1,0,0]=3 7654 B12R1.374 Cc1ccc(Br)cc1OCCN Amb24116411 [0,2,0,0,0,0|1,0,0]=3 7655 B12R1.374 Cc1ccc(Br)cc1OCCO Amb24116409 [0,2,0,0,0,0|0,0,0]=2 7656 B12R1.374 Cc1ccc(Br)cc1OCCS Amb24472577 [0,2,0,0,0,0|0,1,0]=3 7657 B12R1.374 Cc1ccc(Cl)c(CCCCl)c1 Amb25242993 [0,2,0,0,0,0|2,0,0]=4 7658 B12R1.374 Cc1ccc(Cl)c(NCCO)[n]1 Amb25853279 [0,2,0,0,0,0|2,0,0]=4 7659 B12R1.374 Cc1ccc(Cl)c(c1)OCOC Amb24439786 [0,2,0,0,0,0|2,0,0]=4 7660 B12R1.374 Cc1ccc(Cl)c(c1)OCSC Amb24614148 [0,2,0,0,0,0|2,0,0]=4 7661 B12R1.374 Cc1ccc(Cl)cc1CCCBr Amb24615762 [0,2,0,0,0,0|2,0,0]=4 7662 B12R1.374 Cc1ccc(Cl)cc1CCCO Amb25829954 [0,2,0,0,0,0|1,0,0]=3 7663 B12R1.374 Cc1ccc(Cl)cc1NCCF Amb25702797 [0,2,0,0,0,0|2,0,0]=4 7664 B12R1.374 Cc1ccc(Cl)cc1OCC#C Amb25669515 [0,2,0,0,0,0|1,0,1]=4 7665 B12R1.374 Cc1ccc(Cl)cc1OCC=C Amb25742598 [0,2,0,0,0,0|1,0,1]=4 7666 B12R1.374 Cc1ccc(Cl)cc1OCC=O Amb25139225 [0,2,0,0,0,0|0,0,2]=4 7667 B12R1.374 Cc1ccc(Cl)cc1OCCN Amb18649214 [0,2,0,0,0,0|1,0,0]=3 7668 B12R1.374 Cc1ccc(Cl)cc1\C=C\CO Amb25721181 [0,2,0,0,0,0|1,0,1]=4 7669 B12R1.374 Cc1ccc(F)c(c1)NCCF Amb24739348 [0,2,0,0,0,0|2,0,0]=4 7670 B12R1.374 Cc1ccc(F)c(c1)OCCC Amb21856655 [0,2,0,0,0,0|1,0,0]=3 7671 B12R1.374 Cc1ccc(F)c(c1)OCOC Amb24485677 [0,2,0,0,0,0|2,0,0]=4 7672 B12R1.374 Cc1ccc(F)c(c1)OCSC Amb25144436 [0,2,0,0,0,0|2,0,0]=4 7673 B12R1.374 Cc1ccc(F)cc1C#CCO Amb18792545 [0,2,0,0,0,0|1,0,1]=4 7674 B12R1.374 Cc1ccc(F)cc1NCCN Amb18992218 [0,2,0,0,0,0|2,0,0]=4 7675 B12R1.374 Cc1ccc(F)cc1OCC#N Amb24497565 [0,2,0,0,0,0|1,0,1]=4 7676 B12R1.374 Cc1ccc(F)cc1OCC=C Amb24352587 [0,2,0,0,0,0|1,0,1]=4 7677 B12R1.374 Cc1ccc(F)cc1OCCBr Amb25109433 [0,2,0,0,0,0|1,0,0]=3 7678 B12R1.374 Cc1ccc(F)cc1OCCC Amb25215912 [0,2,0,0,0,0|1,0,0]=3 7679 B12R1.374 Cc1ccc(F)cc1OCCCl Amb24590550 [0,2,0,0,0,0|1,0,0]=3 7680 B12R1.374 Cc1ccc(F)cc1OCCF Amb24394687 [0,2,0,0,0,0|1,0,0]=3 7681 B12R1.374 Cc1ccc(F)cc1OCCN Amb24682325 [0,2,0,0,0,0|1,0,0]=3 7682 B12R1.374 Cc1ccc(F)cc1\C=C\CO Amb25364684 [0,2,0,0,0,0|1,0,1]=4 7683 B12R1.374 Cc1ccc(I)c(c1)OCOC Amb25686772 [0,2,0,0,0,0|2,0,0]=4 7684 B12R1.374 Cc1ccc(I)cc1NCCF Amb24739352 [0,2,0,0,0,0|2,0,0]=4 7685 B12R1.374 Cc1ccc(I)cc1NCCN Amb25359504 [0,2,0,0,0,0|2,0,0]=4 7686 B12R1.374 Cc1ccc(I)cc1NCCO Amb24390698 [0,2,0,0,0,0|1,0,0]=3 7687 B12R1.374 Cc1ccc(I)cc1OCC#N Amb25160239 [0,2,0,0,0,0|1,0,1]=4 7688 B12R1.374 Cc1ccc(I)cc1OCSC Amb24612916 [0,2,0,0,0,0|2,0,0]=4 7689 B12R1.374 Cc1ccc(N)c(CCCC)c1 Amb24365184 [0,2,0,0,0,0|2,0,0]=4 7690 B12R1.374 Cc1ccc(N)c([n]1)SCCO Amb24759879 [0,2,0,0,0,0|1,1,0]=4 7691 B12R1.374 Cc1ccc(N)c(c1)NCCC Amb23114177 [0,2,0,0,0,0|2,0,0]=4 7692 B12R1.374 Cc1ccc(N)c(c1)OCCC Amb21954488 [0,2,0,0,0,0|1,0,0]=3 7693 B12R1.374 Cc1ccc(N)c(c1)OCOC Amb25667223 [0,2,0,0,0,0|2,0,0]=4 7694 B12R1.374 Cc1ccc(N)c(c1)SCCC Amb24427487 [0,2,0,0,0,0|1,1,0]=4 7695 B12R1.374 Cc1ccc(N)cc1CCCCl Amb25376376 [0,2,0,0,0,0|2,0,0]=4 7696 B12R1.374 Cc1ccc(N)cc1NCCC Amb18299607 [0,2,0,0,0,0|2,0,0]=4 7697 B12R1.374 Cc1ccc(N)cc1NCCN Amb18299627 [0,2,0,0,0,0|2,0,0]=4 7698 B12R1.374 Cc1ccc(N)cc1NCCO Amb18993356 [0,2,0,0,0,0|1,0,0]=3 7699 B12R1.374 Cc1ccc(N)cc1OCC#C Amb18961933 [0,2,0,0,0,0|1,0,1]=4 7700 B12R1.374 Cc1ccc(N)cc1OCCF Amb25063471 [0,2,0,0,0,0|1,0,0]=3 7701 B12R1.374 Cc1ccc(N)cc1SCCC Amb18805443 [0,2,0,0,0,0|1,1,0]=4 7702 B12R1.374 Cc1ccc(N)cc1SCCN Amb25834786 [0,2,0,0,0,0|1,1,0]=4 7703 B12R1.374 Cc1ccc(N)cc1SCCO Amb18993401 [0,2,0,0,0,0|0,1,0]=3 7704 B12R1.374 Cc1ccc(O)c(CCCO)c1 Amb18646539 [0,2,0,0,0,0|1,0,0]=3 7705 B12R1.374 Cc1ccc(O)c([n]1)SCCO Amb18649166 [0,2,0,0,0,0|1,1,0]=4 7706 B12R1.374 Cc1ccc(O)c(\C=C\CO)c1 Amb18646066 [0,2,0,0,0,0|1,0,1]=4 7707 B12R1.374 Cc1ccc(O)cc1CCCC Amb24527628 [0,2,0,0,0,0|2,0,0]=4 7708 B12R1.374 Cc1ccc(O)cc1CCCN Amb25777725 [0,2,0,0,0,0|2,0,0]=4 7709 B12R1.374 Cc1ccc(O)cc1NCCC Amb24405966 [0,2,0,0,0,0|2,0,0]=4 7710 B12R1.374 Cc1ccc(O)cc1OCCN Amb24754289 [0,2,0,0,0,0|1,0,0]=3 7711 B12R1.374 Cc1ccc(O)cc1OCOC Amb25717711 [0,2,0,0,0,0|2,0,0]=4 7712 B12R1.374 Cc1ccc(S)cc1CCCCl Amb24610834 [0,2,0,0,0,0|2,0,0]=4 7713 B12R1.374 Cc1ccc(c(n1)NCCO)N Amb17209129 [0,2,0,0,0,0|2,0,0]=4 7714 B12R1.374 Cc1ccc(cc1CCCN)C Amb17204307 [0,2,0,0,0,0|2,0,0]=4 7715 B12R1.374 Cc1ccc(cc1CCCN)Cl Amb17204336 [0,2,0,0,0,0|2,0,0]=4 7716 B12R1.374 Cc1ccc(cc1CCCO)C Amb17400156 [0,2,0,0,0,0|1,0,0]=3 7717 B12R1.374 Cc1ccc(cc1NCCCl)C Amb17335662 [0,2,0,0,0,0|2,0,0]=4 7718 B12R1.374 Cc1ccc(cc1NCCN)C Amb17091051 [0,2,0,0,0,0|2,0,0]=4 7719 B12R1.374 Cc1ccc(cc1NCCN)Cl Amb17091058 [0,2,0,0,0,0|2,0,0]=4 7720 B12R1.374 Cc1ccc(cc1OCC=C)N Amb17138558 [0,2,0,0,0,0|1,0,1]=4 7721 B12R1.374 Cc1ccc(cc1OCCBr)C Amb1105545 [0,2,0,0,0,0|1,0,0]=3 7722 B12R1.374 Cc1ccc(cc1OCCN)C Amb1101722 [0,2,0,0,0,0|1,0,0]=3 7723 B12R1.374 ClCCNc1cc(Cl)ccc1C Amb17338052 [0,2,0,0,0,0|2,0,0]=4 7724 B12R1.374 ClCCNc1cc(Cl)ccc1Cl Amb17343164 [0,2,0,0,0,0|2,0,0]=4 7725 B12R1.374 Clc1cc(SCCI)c(Cl)cc1 Amb24418749 [0,2,0,0,0,0|1,1,0]=4 7726 B12R1.374 Clc1ccc(Br)c(CCCCl)c1 Amb25714131 [0,2,0,0,0,0|2,0,0]=4 7727 B12R1.374 Clc1ccc(Br)cc1OCCCl Amb25034588 [0,2,0,0,0,0|1,0,0]=3 7728 B12R1.374 Clc1ccc(cc1OCCBr)Cl Amb1106064 [0,2,0,0,0,0|1,0,0]=3 7729 B12R1.374 FCCNc1cc(Br)ccc1Br Amb25690163 [0,2,0,0,0,0|2,0,0]=4 7730 B12R1.374 FCCNc1cc(Cl)ccc1Cl Amb25776303 [0,2,0,0,0,0|2,0,0]=4 7731 B12R1.374 FCCNc1cc(F)ccc1F Amb25067555 [0,2,0,0,0,0|2,0,0]=4 7732 B12R1.374 FCCOc1cc(Br)ccc1Cl Amb24434277 [0,2,0,0,0,0|1,0,0]=3 7733 B12R1.374 FCCOc1cc(Cl)c[n]c1Br Amb24457440 [0,2,0,0,0,0|2,0,0]=4 7734 B12R1.374 FCCSc1cc(F)ccc1F Amb25048210 [0,2,0,0,0,0|1,1,0]=4 7735 B12R1.374 Fc1cc(CCCBr)c(F)cc1 Amb24439123 [0,2,0,0,0,0|2,0,0]=4 7736 B12R1.374 Fc1cc(CCCCl)c(Br)cc1 Amb24341770 [0,2,0,0,0,0|2,0,0]=4 7737 B12R1.374 Fc1cc(CCCCl)c(F)cc1 Amb19073201 [0,2,0,0,0,0|2,0,0]=4 7738 B12R1.374 Fc1cc(OCCBr)c(F)cc1 Amb24483410 [0,2,0,0,0,0|1,0,0]=3 7739 B12R1.374 Fc1cc(OCCCl)c(Br)cc1 Amb25687989 [0,2,0,0,0,0|1,0,0]=3 7740 B12R1.374 Fc1cc(OCCCl)c(F)cc1 Amb25374341 [0,2,0,0,0,0|1,0,0]=3 7741 B12R1.374 Fc1ccc(Br)cc1CCCBr Amb25204237 [0,2,0,0,0,0|2,0,0]=4 7742 B12R1.374 Fc1ccc(Br)cc1CCCS Amb25778866 [0,2,0,0,0,0|1,1,0]=4 7743 B12R1.374 Fc1ccc(Br)cc1NCCF Amb24488700 [0,2,0,0,0,0|2,0,0]=4 7744 B12R1.374 Fc1ccc(Cl)c(CCCCl)c1 Amb25796501 [0,2,0,0,0,0|2,0,0]=4 7745 B12R1.374 Fc1ccc(Cl)c(c1)NCCF Amb25817155 [0,2,0,0,0,0|2,0,0]=4 7746 B12R1.374 Fc1ccc(Cl)cc1CCCBr Amb24441885 [0,2,0,0,0,0|2,0,0]=4 7747 B12R1.374 Fc1ccc(Cl)cc1SCCF Amb24497846 [0,2,0,0,0,0|1,1,0]=4 7748 B12R1.374 Fc1ccc(I)cc1CCCBr Amb24571927 [0,2,0,0,0,0|2,0,0]=4 7749 B12R1.374 N#CCOc1cc(Br)ccc1F Amb24578846 [0,2,0,0,0,0|1,0,1]=4 7750 B12R1.374 N#CCOc1cc(F)ccc1Br Amb19892313 [0,2,0,0,0,0|1,0,1]=4 7751 B12R1.374 N#CCOc1cc(F)ccc1F Amb19887434 [0,2,0,0,0,0|1,0,1]=4 7752 B12R1.374 N#CCOc1cc(I)ccc1I Amb25802798 [0,2,0,0,0,0|1,0,1]=4 7753 B12R1.374 NC1=CN(CCCO)C(=O)C=C1 Amb18535272 [0,2,0,0,0,0|2,0,0]=4 7754 B12R1.374 NCCCc1cc(Br)ccc1Br Amb25309336 [0,2,0,0,0,0|2,0,0]=4 7755 B12R1.374 NCCCc1cc(Br)ccc1Cl Amb25036212 [0,2,0,0,0,0|2,0,0]=4 7756 B12R1.374 NCCCc1cc(Cl)ccc1Br Amb25150112 [0,2,0,0,0,0|2,0,0]=4 7757 B12R1.374 NCCCc1cc(Cl)ccc1Cl Amb17204405 [0,2,0,0,0,0|2,0,0]=4 7758 B12R1.374 NCCCc1cc(Cl)ccc1F Amb18863289 [0,2,0,0,0,0|2,0,0]=4 7759 B12R1.374 NCCCc1cc(Cl)ccc1O Amb18909512 [0,2,0,0,0,0|2,0,0]=4 7760 B12R1.374 NCCCc1cc(F)ccc1Cl Amb18821281 [0,2,0,0,0,0|2,0,0]=4 7761 B12R1.374 NCCCc1cc(F)ccc1F Amb18980797 [0,2,0,0,0,0|2,0,0]=4 7762 B12R1.374 NCCCc1cc(F)ccc1O Amb18556316 [0,2,0,0,0,0|2,0,0]=4 7763 B12R1.374 NCCCc1cc(I)ccc1F Amb24627911 [0,2,0,0,0,0|2,0,0]=4 7764 B12R1.374 NCCCc1cc(I)ccc1O Amb25063089 [0,2,0,0,0,0|2,0,0]=4 7765 B12R1.374 NCCCc1cc(O)ccc1Br Amb24537692 [0,2,0,0,0,0|2,0,0]=4 7766 B12R1.374 NCCCc1cc(O)ccc1Cl Amb25682654 [0,2,0,0,0,0|2,0,0]=4 7767 B12R1.374 NCCNc1cc(Br)ccc1Br Amb25302841 [0,2,0,0,0,0|2,0,0]=4 7768 B12R1.374 NCCNc1cc(Br)ccc1F Amb24732633 [0,2,0,0,0,0|2,0,0]=4 7769 B12R1.374 NCCNc1cc(Br)ccc1I Amb25086988 [0,2,0,0,0,0|2,0,0]=4 7770 B12R1.374 NCCNc1cc(Cl)ccc1Br Amb25268806 [0,2,0,0,0,0|2,0,0]=4 7771 B12R1.374 NCCNc1cc(Cl)ccc1Cl Amb17091082 [0,2,0,0,0,0|2,0,0]=4 7772 B12R1.374 NCCNc1cc(Cl)ccc1F Amb18243910 [0,2,0,0,0,0|2,0,0]=4 7773 B12R1.374 NCCNc1cc(F)ccc1Cl Amb24380239 [0,2,0,0,0,0|2,0,0]=4 7774 B12R1.374 NCCNc1cc(F)ccc1F Amb18997936 [0,2,0,0,0,0|2,0,0]=4 7775 B12R1.374 NCCOc1cc(Cl)ccc1Cl Amb21927638 [0,2,0,0,0,0|1,0,0]=3 7776 B12R1.374 NCCOc1cc(Cl)ccc1Cl Amb2446347 [0,2,0,0,0,0|1,0,0]=3 7777 B12R1.374 NCCOc1cc(Cl)ccc1F Amb18243938 [0,2,0,0,0,0|1,0,0]=3 7778 B12R1.374 NCCOc1cc(F)ccc1Br Amb25106321 [0,2,0,0,0,0|1,0,0]=3 7779 B12R1.374 NCCOc1cc(F)ccc1F Amb18243555 [0,2,0,0,0,0|1,0,0]=3 7780 B12R1.374 NCCOc1cc(O)ccc1Cl Amb25111598 [0,2,0,0,0,0|1,0,0]=3 7781 B12R1.374 NNCOc1cc(Cl)ccc1Cl Amb21837660 [0,2,0,0,0,0|2,0,0]=4 7782 B12R1.374 Nc1[n]cc(Br)c([n]1)OCCO Amb25207480 [0,2,0,0,0,0|2,0,0]=4 7783 B12R1.374 Nc1[n]cc(Cl)cc1CCCO Amb25370190 [0,2,0,0,0,0|2,0,0]=4 7784 B12R1.374 Nc1[n]cc(Cl)cc1OCCO Amb24470139 [0,2,0,0,0,0|1,0,0]=3 7785 B12R1.374 Nc1c[n]c(Cl)[n]c1OCCO Amb24459525 [0,2,0,0,0,0|2,0,0]=4 7786 B12R1.374 Nc1cc(CCCBr)c(N)cc1 Amb24665868 [0,2,0,0,0,0|2,0,0]=4 7787 B12R1.374 Nc1cc(CCCCl)c(N)cc1 Amb25239005 [0,2,0,0,0,0|2,0,0]=4 7788 B12R1.374 Nc1cc(OCC#N)c(Br)cc1 Amb24713025 [0,2,0,0,0,0|1,0,1]=4 7789 B12R1.374 Nc1cc(OCC#N)c(Cl)cc1 Amb25667265 [0,2,0,0,0,0|1,0,1]=4 7790 B12R1.374 Nc1cc(OCCF)c(Cl)cc1 Amb25844731 [0,2,0,0,0,0|1,0,0]=3 7791 B12R1.374 Nc1cc(OCCO)c(Br)c[n]1 Amb25310212 [0,2,0,0,0,0|1,0,0]=3 7792 B12R1.374 Nc1cc(OCCO)c(Br)cc1 Amb25726570 [0,2,0,0,0,0|0,0,0]=2 7793 B12R1.374 Nc1cc(OCCO)c(Cl)cc1 Amb25779670 [0,2,0,0,0,0|0,0,0]=2 7794 B12R1.374 Nc1cc(OCCO)c(N)cc1 Amb24070056 [0,2,0,0,0,0|0,0,0]=2 7795 B12R1.374 Nc1cc(SCCF)c(Cl)cc1 Amb25857315 [0,2,0,0,0,0|1,1,0]=4 7796 B12R1.374 Nc1cc(SCCO)c(Br)c[n]1 Amb25182616 [0,2,0,0,0,0|1,1,0]=4 7797 B12R1.374 Nc1cc(\C=C\CO)c(N)cc1 Amb25366505 [0,2,0,0,0,0|1,0,1]=4 7798 B12R1.374 Nc1ccc(Br)c(CCCBr)c1 Amb24541058 [0,2,0,0,0,0|2,0,0]=4 7799 B12R1.374 Nc1ccc(Cl)c(c1)OCCN Amb24574085 [0,2,0,0,0,0|1,0,0]=3 7800 B12R1.374 Nc1ccc(Cl)cc1CCCCl Amb25779328 [0,2,0,0,0,0|2,0,0]=4 7801 B12R1.374 Nc1ccc(Cl)cc1CCCN Amb25177280 [0,2,0,0,0,0|2,0,0]=4 7802 B12R1.374 Nc1ccc(Cl)cc1NCCF Amb25137457 [0,2,0,0,0,0|2,0,0]=4 7803 B12R1.374 Nc1ccc(Cl)cc1NCCN Amb25843427 [0,2,0,0,0,0|2,0,0]=4 7804 B12R1.374 Nc1ccc(Cl)cc1NCCO Amb18649473 [0,2,0,0,0,0|1,0,0]=3 7805 B12R1.374 Nc1ccc(Cl)cc1OCC#N Amb18285099 [0,2,0,0,0,0|1,0,1]=4 7806 B12R1.374 Nc1ccc(Cl)cc1OCCF Amb24579905 [0,2,0,0,0,0|1,0,0]=3 7807 B12R1.374 Nc1ccc(Cl)cc1OCCO Amb18990920 [0,2,0,0,0,0|0,0,0]=2 7808 B12R1.374 Nc1ccc(Cl)cc1SCCN Amb24641295 [0,2,0,0,0,0|1,1,0]=4 7809 B12R1.374 Nc1ccc(Cl)cc1SCCO Amb24358543 [0,2,0,0,0,0|0,1,0]=3 7810 B12R1.374 Nc1ccc(F)cc1NCCN Amb18991517 [0,2,0,0,0,0|2,0,0]=4 7811 B12R1.374 Nc1ccc(F)cc1NCCO Amb18989891 [0,2,0,0,0,0|1,0,0]=3 7812 B12R1.374 Nc1ccc(F)cc1SCCN Amb25732834 [0,2,0,0,0,0|1,1,0]=4 7813 B12R1.374 Nc1ccc(F)cc1SCCO Amb18989905 [0,2,0,0,0,0|0,1,0]=3 7814 B12R1.374 Nc1ccc(O)c(CCCN)c1 Amb25212967 [0,2,0,0,0,0|2,0,0]=4 7815 B12R1.374 Nc1ccc(O)c(c1)OCCO Amb24760908 [0,2,0,0,0,0|0,0,0]=2 7816 B12R1.374 Nc1ccc(O)cc1CCCN Amb24094576 [0,2,0,0,0,0|2,0,0]=4 7817 B12R1.374 Nc1ncc(cc1CCCO)F Amb13889726 [0,2,0,0,0,0|2,0,0]=4 7818 B12R1.374 Nc1ncc(cc1CCCO)I Amb13890001 [0,2,0,0,0,0|2,0,0]=4 7819 B12R1.374 O=CCOc1cc(Br)ccc1F Amb24361042 [0,2,0,0,0,0|0,0,2]=4 7820 B12R1.374 OCC#Cc1cc(Br)ccc1F Amb25846440 [0,2,0,0,0,0|1,0,1]=4 7821 B12R1.374 OCC#Cc1cc(Cl)ccc1F Amb24386907 [0,2,0,0,0,0|1,0,1]=4 7822 B12R1.374 OCC=Cc1cc(F)ccc1F Amb24082691 [0,2,0,0,0,0|1,0,1]=4 7823 B12R1.374 OCCCN1C=C(Br)C=CC1=O Amb18041268 [0,2,0,0,0,0|2,0,0]=4 7824 B12R1.374 OCCCN1C=C(Cl)C=CC1=O Amb18041266 [0,2,0,0,0,0|2,0,0]=4 7825 B12R1.374 OCCCN1C=C(F)C=CC1=O Amb18040863 [0,2,0,0,0,0|2,0,0]=4 7826 B12R1.374 OCCCc1cc(Br)ccc1F Amb25669437 [0,2,0,0,0,0|1,0,0]=3 7827 B12R1.374 OCCCc1cc(Cl)ccc1F Amb18863273 [0,2,0,0,0,0|1,0,0]=3 7828 B12R1.374 OCCCc1cc(F)ccc1Cl Amb25271650 [0,2,0,0,0,0|1,0,0]=3 7829 B12R1.374 OCCCc1cc(F)ccc1F Amb17605791 [0,2,0,0,0,0|1,0,0]=3 7830 B12R1.374 OCCCc1cc(F)cnc1Cl Amb13889729 [0,2,0,0,0,0|2,0,0]=4 7831 B12R1.374 OCCNc1cc(Br)c[n]c1Br Amb25246406 [0,2,0,0,0,0|2,0,0]=4 7832 B12R1.374 OCCNc1cc(Br)ccc1Br Amb25149787 [0,2,0,0,0,0|1,0,0]=3 7833 B12R1.374 OCCNc1cc(Br)ccc1I Amb24386418 [0,2,0,0,0,0|1,0,0]=3 7834 B12R1.374 OCCNc1cc(Cl)ccc1Br Amb25284978 [0,2,0,0,0,0|1,0,0]=3 7835 B12R1.374 OCCNc1cc(F)ccc1Cl Amb24559136 [0,2,0,0,0,0|1,0,0]=3 7836 B12R1.374 OCCNc1cc(I)ccc1Br Amb25765613 [0,2,0,0,0,0|1,0,0]=3 7837 B12R1.374 OCCOc1[n]c(Cl)[n]cc1Br Amb24680721 [0,2,0,0,0,0|2,0,0]=4 7838 B12R1.374 OCCOc1[n]c(Cl)[n]cc1Cl Amb25718856 [0,2,0,0,0,0|2,0,0]=4 7839 B12R1.374 OCCOc1cc(Br)ccc1Br Amb23412184 [0,2,0,0,0,0|0,0,0]=2 7840 B12R1.374 OCCOc1cc(Br)ccc1F Amb24271232 [0,2,0,0,0,0|0,0,0]=2 7841 B12R1.374 OCCOc1cc(Cl)c[n]c1Br Amb25042604 [0,2,0,0,0,0|1,0,0]=3 7842 B12R1.374 OCCOc1cc(F)ccc1Cl Amb25118879 [0,2,0,0,0,0|0,0,0]=2 7843 B12R1.374 OCCOc1cc(F)ccc1F Amb25039649 [0,2,0,0,0,0|0,0,0]=2 7844 B12R1.374 OCCSC1=CC(=O)C=CC1=O Amb24525023 [0,2,0,0,0,0|0,1,0]=3 7845 B12R1.374 OCCSc1cc(Cl)ccc1Cl Amb1110887 [0,2,0,0,0,0|0,1,0]=3 7846 B12R1.374 OCCSc1cc(O)ccc1O Amb25729106 [0,2,0,0,0,0|0,1,0]=3 7847 B12R1.374 OC\C=C\c1cc(Br)ccc1Cl Amb24461355 [0,2,0,0,0,0|1,0,1]=4 7848 B12R1.374 OC\C=C\c1cc(Br)ccc1F Amb25742275 [0,2,0,0,0,0|1,0,1]=4 7849 B12R1.374 OC\C=C\c1cc(Cl)ccc1Cl Amb23442825 [0,2,0,0,0,0|1,0,1]=4 7850 B12R1.374 OC\C=C\c1cc(F)ccc1F Amb24404057 [0,2,0,0,0,0|1,0,1]=4 7851 B12R1.374 Oc1cc(CCCBr)c(Cl)cc1 Amb24569466 [0,2,0,0,0,0|2,0,0]=4 7852 B12R1.374 Oc1ccc(Cl)c(CCCCl)c1 Amb25208780 [0,2,0,0,0,0|2,0,0]=4 7853 B12R1.374 Oc1ccc(Cl)cc1CCCO Amb25762478 [0,2,0,0,0,0|1,0,0]=3 7854 B12R1.374 Oc1ccc(Cl)cc1\C=C\CO Amb18649021 [0,2,0,0,0,0|1,0,1]=4 7855 B12R1.374 Oc1ccc(F)c(CCCO)c1 Amb24588858 [0,2,0,0,0,0|1,0,0]=3 7856 B12R1.374 Oc1ccc(F)cc1CCCO Amb24377655 [0,2,0,0,0,0|1,0,0]=3 7857 B12R1.374 Oc1ccc(I)cc1CCCCl Amb25209323 [0,2,0,0,0,0|2,0,0]=4 7858 B12R1.374 Oc1ncc(cc1CCCO)F Amb13889728 [0,2,0,0,0,0|2,0,0]=4 7859 B12R1.374 SCCOc1cc(Cl)ccc1Cl Amb17245965 [0,2,0,0,0,0|0,1,0]=3 7860 B12R1.374 SCCSc1cc(Cl)ccc1Cl Amb25107258 [0,2,0,0,0,0|0,2,0]=4 7861 B12R1.1631 BrCCCc1c(F)cccc1Cl Amb17104568 [0,2,0,0,0,0|2,0,0]=4 7862 B12R1.1631 BrCCOc1c(C)cccc1C Amb1648711 [0,2,0,0,0,0|1,0,0]=3 7863 B12R1.1631 BrCCOc1c(C)cccc1Cl Amb10608622 [0,2,0,0,0,0|1,0,0]=3 7864 B12R1.1631 BrCCOc1c(Cl)cccc1Cl Amb1152417 [0,2,0,0,0,0|1,0,0]=3 7865 B12R1.1631 C#CCOc1c(F)cccc1Cl Amb25196711 [0,2,0,0,0,0|1,0,1]=4 7866 B12R1.1631 C#CCOc1c(N)cccc1F Amb25081313 [0,2,0,0,0,0|1,0,1]=4 7867 B12R1.1631 C=CCOc1c(Cl)cccc1Cl Amb25075776 [0,2,0,0,0,0|1,0,1]=4 7868 B12R1.1631 C=CCOc1c(F)cccc1Br Amb22896475 [0,2,0,0,0,0|1,0,1]=4 7869 B12R1.1631 C=CCOc1c(F)cccc1Cl Amb24525648 [0,2,0,0,0,0|1,0,1]=4 7870 B12R1.1631 C=CCOc1c(F)cccc1F Amb22641482 [0,2,0,0,0,0|1,0,1]=4 7871 B12R1.1631 C=CCOc1c(N)cccc1Cl Amb25052568 [0,2,0,0,0,0|1,0,1]=4 7872 B12R1.1631 CC1=CC=CC(=O)N1CCCO Amb18041293 [0,2,0,0,0,0|2,0,0]=4 7873 B12R1.1631 CC=1OC=CC(=O)C1OCCC Amb18035383 [0,2,0,0,0,0|2,0,0]=4 7874 B12R1.1631 CCCCc1c(N)cccc1Cl Amb25365047 [0,2,0,0,0,0|2,0,0]=4 7875 B12R1.1631 CCCNc1c(Cl)cccc1Cl Amb17306283 [0,2,0,0,0,0|2,0,0]=4 7876 B12R1.1631 CCCNc1c(N)cccc1F Amb22289420 [0,2,0,0,0,0|2,0,0]=4 7877 B12R1.1631 CCCOc1c(F)cccc1Br Amb22896472 [0,2,0,0,0,0|1,0,0]=3 7878 B12R1.1631 CCCOc1c(F)cccc1Cl Amb25080640 [0,2,0,0,0,0|1,0,0]=3 7879 B12R1.1631 CCCOc1c(F)cccc1F Amb25670749 [0,2,0,0,0,0|1,0,0]=3 7880 B12R1.1631 CCCOc1c(N)cccc1Br Amb25258745 [0,2,0,0,0,0|1,0,0]=3 7881 B12R1.1631 CCCOc1c(N)cccc1F Amb25678737 [0,2,0,0,0,0|1,0,0]=3 7882 B12R1.1631 CCCOc1c(O)cccc1Br Amb22896497 [0,2,0,0,0,0|1,0,0]=3 7883 B12R1.1631 CCCOc1c(O)ccnc1C Amb17219248 [0,2,0,0,0,0|2,0,0]=4 7884 B12R1.1631 COCOc1c(Br)cccc1Br Amb25280184 [0,2,0,0,0,0|2,0,0]=4 7885 B12R1.1631 COCOc1c(Cl)cccc1Cl Amb24732716 [0,2,0,0,0,0|2,0,0]=4 7886 B12R1.1631 COCOc1c(F)cccc1F Amb25669754 [0,2,0,0,0,0|2,0,0]=4 7887 B12R1.1631 COCOc1c(F)cccc1S Amb25154131 [0,2,0,0,0,0|2,0,0]=4 7888 B12R1.1631 COCOc1c(O)cccc1Br Amb25825957 [0,2,0,0,0,0|2,0,0]=4 7889 B12R1.1631 CSCOc1c(F)cccc1Cl Amb25138004 [0,2,0,0,0,0|2,0,0]=4 7890 B12R1.1631 Cc1cc[n]c(C)c1OCCN Amb25268707 [0,2,0,0,0,0|2,0,0]=4 7891 B12R1.1631 Cc1cc[n]c(Cl)c1OCCC Amb25795972 [0,2,0,0,0,0|2,0,0]=4 7892 B12R1.1631 Cc1cc[n]c(Cl)c1OCCF Amb25717403 [0,2,0,0,0,0|2,0,0]=4 7893 B12R1.1631 Cc1cc[n]c(Cl)c1OCCN Amb24741930 [0,2,0,0,0,0|2,0,0]=4 7894 B12R1.1631 Cc1cc[n]c(N)c1CCCO Amb25099845 [0,2,0,0,0,0|2,0,0]=4 7895 B12R1.1631 Cc1cccc(Br)c1OCC=C Amb25084424 [0,2,0,0,0,0|1,0,1]=4 7896 B12R1.1631 Cc1cccc(C)c1CCCN Amb18251668 [0,2,0,0,0,0|2,0,0]=4 7897 B12R1.1631 Cc1cccc(C)c1NCCF Amb24418635 [0,2,0,0,0,0|2,0,0]=4 7898 B12R1.1631 Cc1cccc(C)c1OCC#C Amb17872264 [0,2,0,0,0,0|1,0,1]=4 7899 B12R1.1631 Cc1cccc(Cl)c1CCCCl Amb25234260 [0,2,0,0,0,0|2,0,0]=4 7900 B12R1.1631 Cc1cccc(Cl)c1CCCO Amb25791304 [0,2,0,0,0,0|1,0,0]=3 7901 B12R1.1631 Cc1cccc(Cl)c1NCCO Amb25148802 [0,2,0,0,0,0|1,0,0]=3 7902 B12R1.1631 Cc1cccc(F)c1CCCBr Amb24637088 [0,2,0,0,0,0|2,0,0]=4 7903 B12R1.1631 Cc1cccc(F)c1NCCF Amb25111768 [0,2,0,0,0,0|2,0,0]=4 7904 B12R1.1631 Cc1cccc(F)c1OCCN Amb24367943 [0,2,0,0,0,0|1,0,0]=3 7905 B12R1.1631 Cc1cccc(I)c1CCCCl Amb24561233 [0,2,0,0,0,0|2,0,0]=4 7906 B12R1.1631 Cc1cccc(N)c1CCCBr Amb25223463 [0,2,0,0,0,0|2,0,0]=4 7907 B12R1.1631 Cc1cccc(N)c1CCCCl Amb25253324 [0,2,0,0,0,0|2,0,0]=4 7908 B12R1.1631 Cc1cccc(N)c1NCCC Amb24678901 [0,2,0,0,0,0|2,0,0]=4 7909 B12R1.1631 Cc1cccc(N)c1OCC#C Amb24423002 [0,2,0,0,0,0|1,0,1]=4 7910 B12R1.1631 Cc1cccc(N)c1OCCF Amb24455449 [0,2,0,0,0,0|1,0,0]=3 7911 B12R1.1631 Cc1cccc(N)c1OCCO Amb25324902 [0,2,0,0,0,0|0,0,0]=2 7912 B12R1.1631 Cc1cccc(N)c1OCOC Amb24684659 [0,2,0,0,0,0|2,0,0]=4 7913 B12R1.1631 Cc1cccc(N)c1SCCC Amb25667455 [0,2,0,0,0,0|1,1,0]=4 7914 B12R1.1631 ClCCCc1c(Br)cccc1Br Amb25208586 [0,2,0,0,0,0|2,0,0]=4 7915 B12R1.1631 ClCCCc1c(Cl)cccc1Cl Amb24341769 [0,2,0,0,0,0|2,0,0]=4 7916 B12R1.1631 ClCCCc1c(F)cccc1Cl Amb17104540 [0,2,0,0,0,0|2,0,0]=4 7917 B12R1.1631 ClCCNc1c(C)cccc1C Amb17335665 [0,2,0,0,0,0|2,0,0]=4 7918 B12R1.1631 ClCCOc1c(Cl)cccc1Cl Amb1152442 [0,2,0,0,0,0|1,0,0]=3 7919 B12R1.1631 Clc1cccc(Cl)c1CCCBr Amb24456278 [0,2,0,0,0,0|2,0,0]=4 7920 B12R1.1631 Clc1cccc(I)c1CCCBr Amb24695695 [0,2,0,0,0,0|2,0,0]=4 7921 B12R1.1631 Clc1cccc(I)c1CCCCl Amb25195180 [0,2,0,0,0,0|2,0,0]=4 7922 B12R1.1631 FCCNc1c(Cl)cccc1Cl Amb25707140 [0,2,0,0,0,0|2,0,0]=4 7923 B12R1.1631 FCCOc1c(Br)cccc1Br Amb24457439 [0,2,0,0,0,0|1,0,0]=3 7924 B12R1.1631 FCCSc1c(Cl)cccc1Cl Amb25079852 [0,2,0,0,0,0|1,1,0]=4 7925 B12R1.1631 Fc1cccc(Br)c1CCCBr Amb25312282 [0,2,0,0,0,0|2,0,0]=4 7926 B12R1.1631 Fc1cccc(Br)c1OCCBr Amb22896607 [0,2,0,0,0,0|1,0,0]=3 7927 B12R1.1631 Fc1cccc(Cl)c1NCCF Amb25113742 [0,2,0,0,0,0|2,0,0]=4 7928 B12R1.1631 Fc1cccc(Cl)c1OCCS Amb24471068 [0,2,0,0,0,0|0,1,0]=3 7929 B12R1.1631 Fc1cccc(F)c1CCCBr Amb25152621 [0,2,0,0,0,0|2,0,0]=4 7930 B12R1.1631 Fc1cccc(F)c1CCCCl Amb25189588 [0,2,0,0,0,0|2,0,0]=4 7931 B12R1.1631 Fc1cccc(F)c1OCCS Amb24412506 [0,2,0,0,0,0|0,1,0]=3 7932 B12R1.1631 N#CCOc1c(F)cccc1Cl Amb25281422 [0,2,0,0,0,0|1,0,1]=4 7933 B12R1.1631 N#CCOc1c(F)cccc1F Amb19887435 [0,2,0,0,0,0|1,0,1]=4 7934 B12R1.1631 NCCCc1c(Cl)cccc1Br Amb24447135 [0,2,0,0,0,0|2,0,0]=4 7935 B12R1.1631 NCCCc1c(F)cccc1Cl Amb22548235 [0,2,0,0,0,0|2,0,0]=4 7936 B12R1.1631 NCCCc1c(F)cccc1F Amb18981388 [0,2,0,0,0,0|2,0,0]=4 7937 B12R1.1631 NCCCc1c(O)cccc1F Amb25149830 [0,2,0,0,0,0|2,0,0]=4 7938 B12R1.1631 NCCNc1c(Br)cccc1Br Amb25823941 [0,2,0,0,0,0|2,0,0]=4 7939 B12R1.1631 NCCNc1c(C)cccc1C Amb17091053 [0,2,0,0,0,0|2,0,0]=4 7940 B12R1.1631 NCCNc1c(Cl)cccc1Cl Amb18130950 [0,2,0,0,0,0|2,0,0]=4 7941 B12R1.1631 NCCNc1c(F)cccc1Br Amb24669803 [0,2,0,0,0,0|2,0,0]=4 7942 B12R1.1631 NCCNc1c(F)cccc1F Amb17091087 [0,2,0,0,0,0|2,0,0]=4 7943 B12R1.1631 NCCOc1c(Br)[n]ccc1Cl Amb24615868 [0,2,0,0,0,0|2,0,0]=4 7944 B12R1.1631 NCCOc1c(Br)c[n]cc1Br Amb25365395 [0,2,0,0,0,0|2,0,0]=4 7945 B12R1.1631 NCCOc1c(Cl)[n]ccc1Cl Amb24628209 [0,2,0,0,0,0|2,0,0]=4 7946 B12R1.1631 NCCOc1c(F)cccc1F Amb22396841 [0,2,0,0,0,0|1,0,0]=3 7947 B12R1.1631 NCCOc1c(I)[n]ccc1Cl Amb25239477 [0,2,0,0,0,0|2,0,0]=4 7948 B12R1.1631 NCCSc1c(Cl)cccc1Cl Amb25296115 [0,2,0,0,0,0|1,1,0]=4 7949 B12R1.1631 Nc1c[n]cc(Cl)c1SCCO Amb25128664 [0,2,0,0,0,0|1,1,0]=4 7950 B12R1.1631 Nc1cccc(Br)c1CCCCl Amb24626552 [0,2,0,0,0,0|2,0,0]=4 7951 B12R1.1631 Nc1cccc(Cl)c1CCCBr Amb24727766 [0,2,0,0,0,0|2,0,0]=4 7952 B12R1.1631 Nc1cccc(Cl)c1NCCF Amb25094961 [0,2,0,0,0,0|2,0,0]=4 7953 B12R1.1631 Nc1cccc(Cl)c1NCCN Amb18991499 [0,2,0,0,0,0|2,0,0]=4 7954 B12R1.1631 Nc1cccc(Cl)c1OCCF Amb25108017 [0,2,0,0,0,0|1,0,0]=3 7955 B12R1.1631 Nc1cccc(Cl)c1SCCN Amb18975708 [0,2,0,0,0,0|1,1,0]=4 7956 B12R1.1631 Nc1cccc(F)c1NCCN Amb25089972 [0,2,0,0,0,0|2,0,0]=4 7957 B12R1.1631 Nc1cccc(F)c1OCCO Amb24729037 [0,2,0,0,0,0|0,0,0]=2 7958 B12R1.1631 Nc1cccc(N)c1CCCBr Amb25312577 [0,2,0,0,0,0|2,0,0]=4 7959 B12R1.1631 Nc1cccc(N)c1NCCO Amb25758923 [0,2,0,0,0,0|1,0,0]=3 7960 B12R1.1631 O=CCOc1c(Br)cccc1Br Amb25282461 [0,2,0,0,0,0|0,0,2]=4 7961 B12R1.1631 OCC#Cc1c(F)cccc1Cl Amb24493479 [0,2,0,0,0,0|1,0,1]=4 7962 B12R1.1631 OCC#Cc1c(F)cccc1F Amb24483483 [0,2,0,0,0,0|1,0,1]=4 7963 B12R1.1631 OCCCN1C(=O)C=CC=C1Br Amb18040866 [0,2,0,0,0,0|2,0,0]=4 7964 B12R1.1631 OCCCN1C(=O)C=CC=C1Cl Amb25042512 [0,2,0,0,0,0|2,0,0]=4 7965 B12R1.1631 OCCCc1c(Br)c[n]cc1Br Amb25786116 [0,2,0,0,0,0|2,0,0]=4 7966 B12R1.1631 OCCCc1c(Cl)cccc1Br Amb25829173 [0,2,0,0,0,0|1,0,0]=3 7967 B12R1.1631 OCCCc1c(Cl)cccc1Cl Amb24356168 [0,2,0,0,0,0|1,0,0]=3 7968 B12R1.1631 OCCCc1c(F)cccc1Cl Amb17089506 [0,2,0,0,0,0|1,0,0]=3 7969 B12R1.1631 OCCCc1c(F)cccc1F Amb24447301 [0,2,0,0,0,0|1,0,0]=3 7970 B12R1.1631 OCCNc1c(Br)cccc1Br Amb24375032 [0,2,0,0,0,0|1,0,0]=3 7971 B12R1.1631 OCCNc1c(C)cccc1C Amb17306428 [0,2,0,0,0,0|1,0,0]=3 7972 B12R1.1631 OCCNc1c(Cl)cccc1Cl Amb17306298 [0,2,0,0,0,0|1,0,0]=3 7973 B12R1.1631 OCCNc1c(F)cccc1Br Amb24375111 [0,2,0,0,0,0|1,0,0]=3 7974 B12R1.1631 OCCSc1c(Br)c[n]cc1Br Amb25852513 [0,2,0,0,0,0|1,1,0]=4 7975 B12R1.1631 OCNCc1c(Cl)cccc1Cl Amb24567203 [0,2,0,0,0,0|2,0,0]=4 7976 B12R1.1631 OC\C=C\c1c(F)cccc1F Amb23442862 [0,2,0,0,0,0|1,0,1]=4 7977 B12R1.1631 Oc1cccc(Br)c1CCCBr Amb25377434 [0,2,0,0,0,0|2,0,0]=4 7978 B12R1.1631 Oc1cccc(Br)c1CCCCl Amb24638372 [0,2,0,0,0,0|2,0,0]=4 7979 B12R1.1631 Oc1cccc(Cl)c1CCCO Amb24416761 [0,2,0,0,0,0|1,0,0]=3 7980 B12R1.1631 Oc1cccc(I)c1CCCBr Amb24758191 [0,2,0,0,0,0|2,0,0]=4 7981 B12R1.1631 Oc1cccc(O)c1CCCBr Amb24639237 [0,2,0,0,0,0|2,0,0]=4 7982 B12R1.1631 Oc1cccc(O)c1CCCCl Amb25218074 [0,2,0,0,0,0|2,0,0]=4 7983 B12R1.1631 SCCCc1c(F)cccc1Cl Amb17402978 [0,2,0,0,0,0|1,1,0]=4 7984 B12R1.1631 Sc1cccc(Br)c1CCCBr Amb25217975 [0,2,0,0,0,0|2,0,0]=4 7985 B12R1.1631 Sc1cccc(I)c1CCCCl Amb24628126 [0,2,0,0,0,0|2,0,0]=4 7986 B12R1.28 BrCCCOc1cccc(c1)C Amb1675755 [0,2,0,0,0,0|1,0,0]=3 7987 B12R1.28 BrCC\C=C\c1cccc(c1)C Amb17246877 [0,2,0,0,0,0|2,0,0]=4 7988 B12R1.28 BrCC\C=C\c1cccc(c1)Cl Amb17258090 [0,2,0,0,0,0|2,0,0]=4 7989 B12R1.28 BrCC\C=C\c1cccc(c1)F Amb17248421 [0,2,0,0,0,0|2,0,0]=4 7990 B12R1.28 C#CCCNc1cccc(F)c1 Amb25800317 [0,2,0,0,0,0|2,0,0]=4 7991 B12R1.28 C#CCCOc1c[n]cc(Br)c1 Amb24716639 [0,2,0,0,0,0|2,0,0]=4 7992 B12R1.28 C#CCCOc1c[n]cc(Cl)c1 Amb25051508 [0,2,0,0,0,0|2,0,0]=4 7993 B12R1.28 C#CCCOc1c[n]cc(N)c1 Amb24497674 [0,2,0,0,0,0|2,0,0]=4 7994 B12R1.28 C#CCCOc1cc(N)cc[n]1 Amb25823795 [0,2,0,0,0,0|2,0,0]=4 7995 B12R1.28 C#CCCOc1cc[n]c(F)c1 Amb24371122 [0,2,0,0,0,0|2,0,0]=4 7996 B12R1.28 C#CCCOc1cc[n]c(N)c1 Amb25779088 [0,2,0,0,0,0|2,0,0]=4 7997 B12R1.28 C#CCCOc1cccc(Br)[n]1 Amb25739564 [0,2,0,0,0,0|2,0,0]=4 7998 B12R1.28 C#CCCOc1cccc(Cl)[n]1 Amb24497618 [0,2,0,0,0,0|2,0,0]=4 7999 B12R1.28 C#CCCOc1cccc(F)[n]1 Amb25381336 [0,2,0,0,0,0|2,0,0]=4 8000 B12R1.28 C#CCCOc1cccc(F)c1 Amb24706220 [0,2,0,0,0,0|1,0,0]=3 8001 B12R1.28 C#CCCOc1cccc(I)c1 Amb24646963 [0,2,0,0,0,0|1,0,0]=3 8002 B12R1.28 C#CCCOc1cccc(N)[n]1 Amb24392059 [0,2,0,0,0,0|2,0,0]=4 8003 B12R1.28 C#CCCOc1cccc(N)c1 Amb18971498 [0,2,0,0,0,0|1,0,0]=3 8004 B12R1.28 C#CCCSc1cccc(F)c1 Amb24487394 [0,2,0,0,0,0|1,1,0]=4 8005 B12R1.28 C#CCCSc1cccc(N)c1 Amb24418218 [0,2,0,0,0,0|1,1,0]=4 8006 B12R1.28 C#CCOCc1cccc(Br)c1 Amb23512551 [0,2,0,0,0,0|1,0,1]=4 8007 B12R1.28 C#CCOCc1cccc(N)c1 Amb24116425 [0,2,0,0,0,0|1,0,1]=4 8008 B12R1.28 C=CCCCc1cccc(c1)C Amb13890666 [0,2,0,0,0,0|2,0,0]=4 8009 B12R1.28 C=CCCCc1cccc(c1)Cl Amb13890654 [0,2,0,0,0,0|2,0,0]=4 8010 B12R1.28 C=CCCCc1cccc(c1)F Amb13890678 [0,2,0,0,0,0|2,0,0]=4 8011 B12R1.28 C=CCCNc1cccc(F)c1 Amb24072145 [0,2,0,0,0,0|2,0,0]=4 8012 B12R1.28 C=CCCOc1cc(Br)cc[n]1 Amb24065855 [0,2,0,0,0,0|2,0,0]=4 8013 B12R1.28 C=CCCOc1cccc(I)c1 Amb22503741 [0,2,0,0,0,0|1,0,0]=3 8014 B12R1.28 C=CCCOc1cccc(N)c1 Amb24271220 [0,2,0,0,0,0|1,0,0]=3 8015 B12R1.28 C=CCOCc1cccc(I)c1 Amb22503743 [0,2,0,0,0,0|1,0,1]=4 8016 B12R1.28 CC#CCOc1cc(N)ccc1 Amb18988288 [0,2,0,0,0,0|1,0,1]=4 8017 B12R1.28 CC#CCOc1cc(O)ccc1 Amb18798093 [0,2,0,0,0,0|1,0,1]=4 8018 B12R1.28 CCCC#Cc1cc(Br)ccc1 Amb25721063 [0,2,0,0,0,0|2,0,0]=4 8019 B12R1.28 CCCC#Cc1cc(F)ccc1 Amb25221923 [0,2,0,0,0,0|2,0,0]=4 8020 B12R1.28 CCCC#Cc1cc(I)ccc1 Amb24604509 [0,2,0,0,0,0|2,0,0]=4 8021 B12R1.28 CCCC#Cc1cc(O)ccc1 Amb24568856 [0,2,0,0,0,0|2,0,0]=4 8022 B12R1.28 CCCCCc1cccc(F)c1 Amb22235097 [0,2,0,0,0,0|2,0,0]=4 8023 B12R1.28 CCCCNc1cccc(I)c1 Amb19232035 [0,2,0,0,0,0|2,0,0]=4 8024 B12R1.28 CCCCOc1cc(Br)cc[n]1 Amb22276477 [0,2,0,0,0,0|2,0,0]=4 8025 B12R1.28 CCCCOc1cc(Cl)cc[n]1 Amb22276195 [0,2,0,0,0,0|2,0,0]=4 8026 B12R1.28 CCCCOc1cc(N)cc[n]1 Amb18798584 [0,2,0,0,0,0|2,0,0]=4 8027 B12R1.28 CCCCOc1cccc(Br)[n]1 Amb19959446 [0,2,0,0,0,0|2,0,0]=4 8028 B12R1.28 CCCCOc1cccc([NH3+])c1 Amb22483190 [0,2,0,0,0,0|1,0,0]=3 8029 B12R1.28 CCCCOc1cccc(c1)N Amb1132055 [0,2,0,0,0,0|1,0,0]=3 8030 B12R1.28 CCCCOc1cccc(c1)N Amb2140562 [0,2,0,0,0,0|1,0,0]=3 8031 B12R1.28 CCCNCc1cccc(F)c1 Amb20673497 [0,2,0,0,0,0|2,0,0]=4 8032 B12R1.28 CCCNCc1cccc(O)c1 Amb20673478 [0,2,0,0,0,0|2,0,0]=4 8033 B12R1.28 CCCNCc1cccc(c1)Br Amb1922696 [0,2,0,0,0,0|2,0,0]=4 8034 B12R1.28 CCCNCc1cccc(c1)Cl Amb1923473 [0,2,0,0,0,0|2,0,0]=4 8035 B12R1.28 CCC\N=C\c1cc(O)ccc1 Amb25249271 [0,2,0,0,0,0|2,0,0]=4 8036 B12R1.28 CCNCCc1cccc(N)c1 Amb18550383 [0,2,0,0,0,0|2,0,0]=4 8037 B12R1.28 CCNCCc1cccc(c1)Br Amb17407066 [0,2,0,0,0,0|2,0,0]=4 8038 B12R1.28 CCNCCc1cccc(c1)C Amb17193871 [0,2,0,0,0,0|2,0,0]=4 8039 B12R1.28 CCOCOc1cc(N)ccc1 Amb24085370 [0,2,0,0,0,0|1,0,0]=3 8040 B12R1.28 CNCCCc1cccc(c1)Br Amb17104522 [0,2,0,0,0,0|2,0,0]=4 8041 B12R1.28 CNCCCc1cccc(c1)C Amb17104500 [0,2,0,0,0,0|2,0,0]=4 8042 B12R1.28 CNCCCc1cccc(c1)Cl Amb17104508 [0,2,0,0,0,0|2,0,0]=4 8043 B12R1.28 CNCCCc1cccc(c1)F Amb17605539 [0,2,0,0,0,0|2,0,0]=4 8044 B12R1.28 CNCCNc1cc(Br)ccc1 Amb19025286 [0,2,0,0,0,0|2,0,0]=4 8045 B12R1.28 CNCCNc1cc(Cl)ccc1 Amb19025283 [0,2,0,0,0,0|2,0,0]=4 8046 B12R1.28 CNCCNc1cc(F)ccc1 Amb19025285 [0,2,0,0,0,0|2,0,0]=4 8047 B12R1.28 CNCCOc1c[n]cc(N)c1 Amb24062309 [0,2,0,0,0,0|2,0,0]=4 8048 B12R1.28 CNCCOc1cc(Cl)cc[n]1 Amb22236271 [0,2,0,0,0,0|2,0,0]=4 8049 B12R1.28 CNCCOc1cccc(c1)C Amb1670237 [0,2,0,0,0,0|1,0,0]=3 8050 B12R1.28 CNCCOc1cccc(c1)C Amb2140579 [0,2,0,0,0,0|1,0,0]=3 8051 B12R1.28 CNCCOc1cccc(c1)Cl Amb1106194 [0,2,0,0,0,0|1,0,0]=3 8052 B12R1.28 CNCCOc1cccc(c1)F Amb2132298 [0,2,0,0,0,0|1,0,0]=3 8053 B12R1.28 CNCCOc1cccc(c1)N Amb17232614 [0,2,0,0,0,0|1,0,0]=3 8054 B12R1.28 COCC#Cc1cc(Cl)ccc1 Amb24436599 [0,2,0,0,0,0|1,0,1]=4 8055 B12R1.28 COCC#Cc1cc(I)ccc1 Amb24368630 [0,2,0,0,0,0|1,0,1]=4 8056 B12R1.28 COCC#Cc1cc(O)ccc1 Amb25156562 [0,2,0,0,0,0|1,0,1]=4 8057 B12R1.28 COCCNc1c[n]cc(N)c1 Amb23454675 [0,2,0,0,0,0|2,0,0]=4 8058 B12R1.28 COCCNc1cc(Br)cc[n]1 Amb24450746 [0,2,0,0,0,0|2,0,0]=4 8059 B12R1.28 COCCNc1cc(N)ccn1 Amb17334706 [0,2,0,0,0,0|2,0,0]=4 8060 B12R1.28 COCCNc1cccc(Cl)[n]1 Amb21958803 [0,2,0,0,0,0|2,0,0]=4 8061 B12R1.28 COCCNc1cccc(F)[n]1 Amb19011120 [0,2,0,0,0,0|2,0,0]=4 8062 B12R1.28 COCCNc1cccc(N)[n]1 Amb24581106 [0,2,0,0,0,0|2,0,0]=4 8063 B12R1.28 COCCOC1=CC(=O)NN=C1 Amb22276588 [0,2,0,0,0,0|2,0,0]=4 8064 B12R1.28 COCCOc1[n]c(N)cc[n]1 Amb23437549 [0,2,0,0,0,0|2,0,0]=4 8065 B12R1.28 COCCOc1cc(Br)c[n]c1 Amb22276360 [0,2,0,0,0,0|1,0,0]=3 8066 B12R1.28 COCCOc1cc(Br)cc[n]1 Amb22276471 [0,2,0,0,0,0|1,0,0]=3 8067 B12R1.28 COCCOc1cc(Cl)[n][n]c1 Amb22276559 [0,2,0,0,0,0|2,0,0]=4 8068 B12R1.28 COCCOc1cc(Cl)cc[n]1 Amb22276482 [0,2,0,0,0,0|1,0,0]=3 8069 B12R1.28 COCCOc1cccc(c1)N Amb1995345 [0,2,0,0,0,0|0,0,0]=2 8070 B12R1.28 COCCOc1cccc(c1)N Amb2189171 [0,2,0,0,0,0|0,0,0]=2 8071 B12R1.28 COC\C=C\c1cccc(Br)c1 Amb25245073 [0,2,0,0,0,0|1,0,1]=4 8072 B12R1.28 CSCCNc1cccc(F)c1 Amb19025515 [0,2,0,0,0,0|1,1,0]=4 8073 B12R1.28 CSCCNc1cccc(I)c1 Amb25232446 [0,2,0,0,0,0|1,1,0]=4 8074 B12R1.28 CSCCNc1cccc(c1)C Amb17307508 [0,2,0,0,0,0|1,1,0]=4 8075 B12R1.28 CSCCOc1cccc(c1)N Amb17504021 [0,2,0,0,0,0|0,1,0]=3 8076 B12R1.28 C\C=C\COc1cccc(N)c1 Amb18971501 [0,2,0,0,0,0|1,0,1]=4 8077 B12R1.28 Cc1c[n]cc(c1)NCCOC Amb24451954 [0,2,0,0,0,0|2,0,0]=4 8078 B12R1.28 Cc1cc(CCCCS)ccc1 Amb18564155 [0,2,0,0,0,0|1,1,0]=4 8079 B12R1.28 Cc1cc(NCCCO)[n]cc1 Amb18798582 [0,2,0,0,0,0|2,0,0]=4 8080 B12R1.28 Cc1cc(\C=C\CCO)ccc1 Amb25333403 [0,2,0,0,0,0|1,0,0]=3 8081 B12R1.28 Cc1cc(\C=N\CCO)ccc1 Amb25144474 [0,2,0,0,0,0|1,0,0]=3 8082 B12R1.28 Cc1cc(cc[n]1)C#CCCO Amb24601417 [0,2,0,0,0,0|2,0,0]=4 8083 B12R1.28 Cc1cc(cc[n]1)NCCCO Amb24406842 [0,2,0,0,0,0|2,0,0]=4 8084 B12R1.28 Cc1cc(cc[n]1)NCCOC Amb24590544 [0,2,0,0,0,0|2,0,0]=4 8085 B12R1.28 Cc1cc(cc[n]1)OCCC#C Amb25160414 [0,2,0,0,0,0|2,0,0]=4 8086 B12R1.28 Cc1cc(ccc1)C#CCCCl Amb18796082 [0,2,0,0,0,0|2,0,0]=4 8087 B12R1.28 Cc1cc(ccc1)C#CCCN Amb25766570 [0,2,0,0,0,0|2,0,0]=4 8088 B12R1.28 Cc1cc(ccc1)C#CCCO Amb18792224 [0,2,0,0,0,0|1,0,0]=3 8089 B12R1.28 Cc1cc(ccc1)C#CCOC Amb25125980 [0,2,0,0,0,0|1,0,1]=4 8090 B12R1.28 Cc1cc(ccc1)NCCCF Amb25809142 [0,2,0,0,0,0|2,0,0]=4 8091 B12R1.28 Cc1cc(ccc1)OCCC#C Amb24732559 [0,2,0,0,0,0|1,0,0]=3 8092 B12R1.28 Cc1cc(ccc1)SCCC#C Amb25148457 [0,2,0,0,0,0|1,1,0]=4 8093 B12R1.28 Cc1cc(ccc1)SCCC#N Amb18790888 [0,2,0,0,0,0|1,1,0]=4 8094 B12R1.28 Cc1cc(ccc1)SCCCCl Amb18317179 [0,2,0,0,0,0|1,1,0]=4 8095 B12R1.28 Cc1cc[n]c(c1)NCCOC Amb18798581 [0,2,0,0,0,0|2,0,0]=4 8096 B12R1.28 Cc1cccc(CCCCO)[n]1 Amb23441243 [0,2,0,0,0,0|2,0,0]=4 8097 B12R1.28 Cc1cccc(CNCCC)c1 Amb20673492 [0,2,0,0,0,0|2,0,0]=4 8098 B12R1.28 Cc1cccc(NCCCO)[n]1 Amb19009921 [0,2,0,0,0,0|2,0,0]=4 8099 B12R1.28 Cc1cccc(NCCOC)[n]1 Amb19005113 [0,2,0,0,0,0|2,0,0]=4 8100 B12R1.28 Cc1cccc([n]1)OCCCO Amb22900068 [0,2,0,0,0,0|1,0,0]=3 8101 B12R1.28 Cc1cccc(c1)NCCNC Amb19025279 [0,2,0,0,0,0|2,0,0]=4 8102 B12R1.28 ClCCCOc1cccc(c1)Br Amb1128139 [0,2,0,0,0,0|1,0,0]=3 8103 B12R1.28 ClCCCOc1cccc(c1)C Amb1138744 [0,2,0,0,0,0|1,0,0]=3 8104 B12R1.28 ClCCCOc1cccc(c1)Cl Amb1126449 [0,2,0,0,0,0|1,0,0]=3 8105 B12R1.28 ClCCCOc1cccc(c1)F Amb1129297 [0,2,0,0,0,0|1,0,0]=3 8106 B12R1.28 ClCC\C=C\c1cccc(c1)C Amb17233778 [0,2,0,0,0,0|2,0,0]=4 8107 B12R1.28 ClCC\C=C\c1cccc(c1)Cl Amb17237227 [0,2,0,0,0,0|2,0,0]=4 8108 B12R1.28 ClCC\C=C\c1cccc(c1)F Amb17234151 [0,2,0,0,0,0|2,0,0]=4 8109 B12R1.28 Cl\C=C\COc1cccc(I)c1 Amb24467213 [0,2,0,0,0,0|1,0,1]=4 8110 B12R1.28 Clc1cc(ccc1)C#CCCCl Amb19088531 [0,2,0,0,0,0|2,0,0]=4 8111 B12R1.28 Clc1cccc(c1)OC\C=C\Cl Amb25125538 [0,2,0,0,0,0|1,0,1]=4 8112 B12R1.28 FCCCNc1cccc(Br)c1 Amb25679781 [0,2,0,0,0,0|2,0,0]=4 8113 B12R1.28 FCCCNc1cccc(Cl)c1 Amb24350967 [0,2,0,0,0,0|2,0,0]=4 8114 B12R1.28 FCCCOc1cccc(Br)c1 Amb22008307 [0,2,0,0,0,0|1,0,0]=3 8115 B12R1.28 Fc1cc(CCCCS)ccc1 Amb18564294 [0,2,0,0,0,0|1,1,0]=4 8116 B12R1.28 Fc1cc(ccc1)C#CCCCl Amb18321955 [0,2,0,0,0,0|2,0,0]=4 8117 B12R1.28 Fc1cccc(c1)NCCCF Amb24452997 [0,2,0,0,0,0|2,0,0]=4 8118 B12R1.28 N#CCCNc1cccc(c1)C Amb1647378 [0,2,0,0,0,0|2,0,0]=4 8119 B12R1.28 N#CCCNc1cccc(c1)Cl Amb1647289 [0,2,0,0,0,0|2,0,0]=4 8120 B12R1.28 N#CCCNc1cccc(c1)O Amb17142902 [0,2,0,0,0,0|2,0,0]=4 8121 B12R1.28 N#CCCOc1c[n]cc(Br)c1 Amb25363676 [0,2,0,0,0,0|2,0,0]=4 8122 B12R1.28 N#CCCOc1cccc(c1)O Amb10564583 [0,2,0,0,0,0|1,0,0]=3 8123 B12R1.28 N#CCCSc1cccc(Cl)c1 Amb18325237 [0,2,0,0,0,0|1,1,0]=4 8124 B12R1.28 N#CCOCc1cccc(Br)c1 Amb25211535 [0,2,0,0,0,0|1,0,1]=4 8125 B12R1.28 NCCC#Cc1cc(Cl)ccc1 Amb25083732 [0,2,0,0,0,0|2,0,0]=4 8126 B12R1.28 NCCCCc1cccc(Br)c1 Amb18549204 [0,2,0,0,0,0|2,0,0]=4 8127 B12R1.28 NCCCCc1cccc(F)c1 Amb18563815 [0,2,0,0,0,0|2,0,0]=4 8128 B12R1.28 NCCCNc1cccc(c1)C Amb17057722 [0,2,0,0,0,0|2,0,0]=4 8129 B12R1.28 NCCCNc1cccc(c1)Cl Amb17057728 [0,2,0,0,0,0|2,0,0]=4 8130 B12R1.28 NCCCNc1cccc(c1)F Amb17057725 [0,2,0,0,0,0|2,0,0]=4 8131 B12R1.28 NCCCOc1cc(Br)cc[n]1 Amb22276283 [0,2,0,0,0,0|2,0,0]=4 8132 B12R1.28 NCCCOc1cc(Cl)cc[n]1 Amb22276287 [0,2,0,0,0,0|2,0,0]=4 8133 B12R1.28 NCCCOc1cccc(c1)C Amb1108604 [0,2,0,0,0,0|1,0,0]=3 8134 B12R1.28 NCCCOc1cccc(c1)C Amb1221739 [0,2,0,0,0,0|1,0,0]=3 8135 B12R1.28 NCCCOc1cccc(c1)F Amb1140971 [0,2,0,0,0,0|1,0,0]=3 8136 B12R1.28 NCCCSc1cccc(c1)C Amb17083071 [0,2,0,0,0,0|1,1,0]=4 8137 B12R1.28 NCCCSc1cccc(c1)Cl Amb17083080 [0,2,0,0,0,0|1,1,0]=4 8138 B12R1.28 NCCNCc1cccc(Br)c1 Amb19005476 [0,2,0,0,0,0|2,0,0]=4 8139 B12R1.28 NCCNCc1cccc(O)c1 Amb19005503 [0,2,0,0,0,0|2,0,0]=4 8140 B12R1.28 NCCNCc1cccc(c1)C Amb10075511 [0,2,0,0,0,0|2,0,0]=4 8141 B12R1.28 NCCNCc1cccc(c1)Cl Amb10075509 [0,2,0,0,0,0|2,0,0]=4 8142 B12R1.28 NCCNCc1cccc(c1)F Amb10075489 [0,2,0,0,0,0|2,0,0]=4 8143 B12R1.28 NCCOCc1cccc(c1)Br Amb17061821 [0,2,0,0,0,0|1,0,0]=3 8144 B12R1.28 NCCOCc1cccc(c1)C Amb17061815 [0,2,0,0,0,0|1,0,0]=3 8145 B12R1.28 NCCOCc1cccc(c1)Cl Amb17061820 [0,2,0,0,0,0|1,0,0]=3 8146 B12R1.28 NCCOCc1cccc(c1)F Amb17061818 [0,2,0,0,0,0|1,0,0]=3 8147 B12R1.28 NCC\C=C\c1cc(I)ccc1 Amb24560016 [0,2,0,0,0,0|2,0,0]=4 8148 B12R1.28 NCC\C=C\c1cc(O)ccc1 Amb24519589 [0,2,0,0,0,0|2,0,0]=4 8149 B12R1.28 NCC\C=C\c1cccc(c1)C Amb17232387 [0,2,0,0,0,0|2,0,0]=4 8150 B12R1.28 NCC\C=C\c1cccc(c1)Cl Amb17233875 [0,2,0,0,0,0|2,0,0]=4 8151 B12R1.28 NCC\C=C\c1cccc(c1)F Amb17232532 [0,2,0,0,0,0|2,0,0]=4 8152 B12R1.28 NNCCOc1cccc(c1)Br Amb1116522 [0,2,0,0,0,0|1,0,0]=3 8153 B12R1.28 NNCCOc1cccc(c1)C Amb17400212 [0,2,0,0,0,0|1,0,0]=3 8154 B12R1.28 NNCCOc1cccc(c1)Cl Amb17401092 [0,2,0,0,0,0|1,0,0]=3 8155 B12R1.28 NNCCOc1cccc(c1)F Amb17400322 [0,2,0,0,0,0|1,0,0]=3 8156 B12R1.28 NOCC#Cc1cc(F)ccc1 Amb24689943 [0,2,0,0,0,0|1,0,1]=4 8157 B12R1.28 NOCCCc1cccc(c1)Br Amb17089578 [0,2,0,0,0,0|1,0,0]=3 8158 B12R1.28 NOCCCc1cccc(c1)C Amb17089550 [0,2,0,0,0,0|1,0,0]=3 8159 B12R1.28 NOCCCc1cccc(c1)Cl Amb17089559 [0,2,0,0,0,0|1,0,0]=3 8160 B12R1.28 NOCCCc1cccc(c1)O Amb17089577 [0,2,0,0,0,0|1,0,0]=3 8161 B12R1.28 NOCCOc1cccc(c1)Br Amb17088298 [0,2,0,0,0,0|0,0,0]=2 8162 B12R1.28 NOCCOc1cccc(c1)C Amb17088289 [0,2,0,0,0,0|0,0,0]=2 8163 B12R1.28 NOCCOc1cccc(c1)Cl Amb17088295 [0,2,0,0,0,0|0,0,0]=2 8164 B12R1.28 NOCCOc1cccc(c1)F Amb17088292 [0,2,0,0,0,0|0,0,0]=2 8165 B12R1.28 Nc1cc(CCCC#N)ccc1 Amb24681109 [0,2,0,0,0,0|2,0,0]=4 8166 B12R1.28 Nc1cc(CSCCO)cc[n]1 Amb18311356 [0,2,0,0,0,0|1,1,0]=4 8167 B12R1.28 Nc1cc(NCCCO)[n]cc1 Amb18798796 [0,2,0,0,0,0|2,0,0]=4 8168 B12R1.28 Nc1cc(cc[n]1)NCCCO Amb24685867 [0,2,0,0,0,0|2,0,0]=4 8169 B12R1.28 Nc1cc(ccc1)C#CCCO Amb24423816 [0,2,0,0,0,0|1,0,0]=3 8170 B12R1.28 Nc1cc(ccc1)NCCCF Amb25132504 [0,2,0,0,0,0|2,0,0]=4 8171 B12R1.28 Nc1cc(ccc1)OCCC#N Amb18971514 [0,2,0,0,0,0|1,0,0]=3 8172 B12R1.28 Nc1cc(ccc1)OCCCCl Amb22831609 [0,2,0,0,0,0|1,0,0]=3 8173 B12R1.28 Nc1cc(ccc1)OCCCF Amb23539406 [0,2,0,0,0,0|1,0,0]=3 8174 B12R1.28 Nc1cc(ccc1)OC\C=C\Cl Amb18971499 [0,2,0,0,0,0|1,0,1]=4 8175 B12R1.28 Nc1cc(ccc1)SCCC#N Amb25707773 [0,2,0,0,0,0|1,1,0]=4 8176 B12R1.28 Nc1cccc(NCCCO)[n]1 Amb25133228 [0,2,0,0,0,0|2,0,0]=4 8177 B12R1.28 O=CCCCc1cccc(Br)c1 Amb18048776 [0,2,0,0,0,0|1,0,1]=4 8178 B12R1.28 O=CCCSc1cccc(c1)C Amb17082972 [0,2,0,0,0,0|0,1,1]=4 8179 B12R1.28 O=CCCSc1cccc(c1)Cl Amb17082982 [0,2,0,0,0,0|0,1,1]=4 8180 B12R1.28 OCCC#Cc1cc(Cl)ccc1 Amb18809453 [0,2,0,0,0,0|1,0,0]=3 8181 B12R1.28 OCCC#Cc1cc(F)c[n]c1 Amb18792621 [0,2,0,0,0,0|2,0,0]=4 8182 B12R1.28 OCCC#Cc1cc(F)ccc1 Amb18792548 [0,2,0,0,0,0|1,0,0]=3 8183 B12R1.28 OCCCCc1cccc(Br)c1 Amb20668830 [0,2,0,0,0,0|1,0,0]=3 8184 B12R1.28 OCCCNC1=CC=CC(=O)N1 Amb24487347 [0,2,0,0,0,0|2,0,0]=4 8185 B12R1.28 OCCCNc1c[n]cc(Br)c1 Amb24410008 [0,2,0,0,0,0|2,0,0]=4 8186 B12R1.28 OCCCNc1cccc(Cl)[n]1 Amb21958816 [0,2,0,0,0,0|2,0,0]=4 8187 B12R1.28 OCCCNc1cccc(F)[n]1 Amb19011128 [0,2,0,0,0,0|2,0,0]=4 8188 B12R1.28 OCCCNc1cccc(I)c1 Amb25091300 [0,2,0,0,0,0|1,0,0]=3 8189 B12R1.28 OCCCNc1cccc(c1)Br Amb17306225 [0,2,0,0,0,0|1,0,0]=3 8190 B12R1.28 OCCCNc1cccc(c1)C Amb17306565 [0,2,0,0,0,0|1,0,0]=3 8191 B12R1.28 OCCCNc1cccc(c1)Cl Amb17307144 [0,2,0,0,0,0|1,0,0]=3 8192 B12R1.28 OCCCNc1cccc(c1)F Amb17306246 [0,2,0,0,0,0|1,0,0]=3 8193 B12R1.28 OCCNCc1cc[n]c(Br)c1 Amb21861822 [0,2,0,0,0,0|2,0,0]=4 8194 B12R1.28 OCCNCc1cccc(Cl)c1 Amb22284257 [0,2,0,0,0,0|1,0,0]=3 8195 B12R1.28 OCCNCc1cccc(F)c1 Amb24271193 [0,2,0,0,0,0|1,0,0]=3 8196 B12R1.28 OCCOCc1cccc(c1)Cl Amb2438435 [0,2,0,0,0,0|0,0,0]=2 8197 B12R1.28 OCC\C=C\c1cc(Cl)ccc1 Amb25357329 [0,2,0,0,0,0|1,0,0]=3 8198 B12R1.28 OCC\C=C\c1cc(F)ccc1 Amb25157956 [0,2,0,0,0,0|1,0,0]=3 8199 B12R1.28 OCC\N=C\c1cc(Cl)ccc1 Amb25069558 [0,2,0,0,0,0|1,0,0]=3 8200 B12R1.28 OC\C=C\Cc1cc(Cl)ccc1 Amb25725507 [0,2,0,0,0,0|1,0,1]=4 8201 B12R1.28 ONCCOc1cccc(c1)Br Amb17088424 [0,2,0,0,0,0|0,0,0]=2 8202 B12R1.28 ONCCOc1cccc(c1)C Amb17088415 [0,2,0,0,0,0|0,0,0]=2 8203 B12R1.28 ONCCOc1cccc(c1)Cl Amb17088421 [0,2,0,0,0,0|0,0,0]=2 8204 B12R1.28 ONCCOc1cccc(c1)F Amb17088418 [0,2,0,0,0,0|0,0,0]=2 8205 B12R1.28 Oc1cccc(c1)\C=N\CCO Amb24628979 [0,2,0,0,0,0|1,0,0]=3 8206 B12R1.28 SCCCCc1cccc(Br)c1 Amb18072286 [0,2,0,0,0,0|1,1,0]=4 8207 B12R1.28 SCCCCc1cccc(Cl)c1 Amb18565790 [0,2,0,0,0,0|1,1,0]=4 8208 B12R1.28 SCCCOc1cccc(c1)Br Amb17258958 [0,2,0,0,0,0|0,1,0]=3 8209 B12R1.28 SCCCOc1cccc(c1)Cl Amb17237589 [0,2,0,0,0,0|0,1,0]=3 8210 B12R1.28 SCCCOc1cccc(c1)F Amb17234297 [0,2,0,0,0,0|0,1,0]=3 8211 B12R1.28 [C-]#[N+]CCOc1cccc(C)c1 Amb25249438 [0,2,0,0,0,0|1,0,0]=3 8212 B12R1.28 [C-]#[N+]CCOc1cccc(O)c1 Amb25178461 [0,2,0,0,0,0|1,0,0]=3 8213 B12R1.50 BrCC(Oc1cccc(c1)Br)C Amb17291821 [0,2,0,0,0,0|1,0,0]=3 8214 B12R1.50 BrCC(Oc1cccc(c1)C)C Amb17248432 [0,2,0,0,0,0|1,0,0]=3 8215 B12R1.50 BrCC(Oc1cccc(c1)Cl)C Amb17261130 [0,2,0,0,0,0|1,0,0]=3 8216 B12R1.50 BrCC(Oc1cccc(c1)F)C Amb17250550 [0,2,0,0,0,0|1,0,0]=3 8217 B12R1.50 CC(C#N)Oc1cccc(Cl)c1 Amb18809670 [0,2,0,0,0,0|1,0,1]=4 8218 B12R1.50 CC(C#N)Oc1cccc(F)c1 Amb18183521 [0,2,0,0,0,0|1,0,1]=4 8219 B12R1.50 CC(C#N)Oc1cccc(N)c1 Amb18283543 [0,2,0,0,0,0|1,0,1]=4 8220 B12R1.50 CC(C#N)Oc1cccc(O)c1 Amb18798182 [0,2,0,0,0,0|1,0,1]=4 8221 B12R1.50 CC(C=C)Oc1cccc(Br)c1 Amb25212875 [0,2,0,0,0,0|1,0,1]=4 8222 B12R1.50 CC(C=C)Oc1cccc(N)c1 Amb18990275 [0,2,0,0,0,0|1,0,1]=4 8223 B12R1.50 CC(C=C)Oc1cccc(O)c1 Amb18798281 [0,2,0,0,0,0|1,0,1]=4 8224 B12R1.50 CC(C=O)Oc1cccc(Cl)c1 Amb19045647 [0,2,0,0,0,0|0,0,2]=4 8225 B12R1.50 CC(CC)Oc1c[n]cc(Br)c1 Amb24487183 [0,2,0,0,0,0|2,0,0]=4 8226 B12R1.50 CC(CC)Oc1cc[n]c(Cl)c1 Amb25703370 [0,2,0,0,0,0|2,0,0]=4 8227 B12R1.50 CC(CC)Oc1cc[n]c(F)c1 Amb24670770 [0,2,0,0,0,0|2,0,0]=4 8228 B12R1.50 CC(CC)Oc1cc[n]c(N)c1 Amb25327099 [0,2,0,0,0,0|2,0,0]=4 8229 B12R1.50 CC(CCl)Cc1cc(Br)ccc1 Amb24728303 [0,2,0,0,0,0|2,0,0]=4 8230 B12R1.50 CC(CN)Cc1cc(Br)ccc1 Amb18992227 [0,2,0,0,0,0|2,0,0]=4 8231 B12R1.50 CC(CN)Cc1cc(F)ccc1 Amb18299465 [0,2,0,0,0,0|2,0,0]=4 8232 B12R1.50 CC(CN)Cc1cc(O)ccc1 Amb24537853 [0,2,0,0,0,0|2,0,0]=4 8233 B12R1.50 CC(CN)Nc1cccc(F)c1 Amb18908739 [0,2,0,0,0,0|2,0,0]=4 8234 B12R1.50 CC(CN)Oc1c[n]cc(Cl)c1 Amb24419587 [0,2,0,0,0,0|2,0,0]=4 8235 B12R1.50 CC(CN)Oc1c[n]cc(F)c1 Amb25155974 [0,2,0,0,0,0|2,0,0]=4 8236 B12R1.50 CC(CN)Oc1cccc(Cl)c1 Amb18299442 [0,2,0,0,0,0|1,0,0]=3 8237 B12R1.50 CC(CN)Oc1cccc(Cl)c1 Amb19148897 [0,2,0,0,0,0|1,0,0]=3 8238 B12R1.50 CC(CN)Oc1cccc(F)c1 Amb18299439 [0,2,0,0,0,0|1,0,0]=3 8239 B12R1.50 CC(CN)Sc1cccc(Br)c1 Amb18301433 [0,2,0,0,0,0|1,1,0]=4 8240 B12R1.50 CC(CN)Sc1cccc(Cl)c1 Amb18299920 [0,2,0,0,0,0|1,1,0]=4 8241 B12R1.50 CC(CO)Cc1cc(Br)c[n]c1 Amb25803193 [0,2,0,0,0,0|2,0,0]=4 8242 B12R1.50 CC(CO)Cc1cc(Br)ccc1 Amb25729945 [0,2,0,0,0,0|1,0,0]=3 8243 B12R1.50 CC(CO)Cc1cc(Cl)ccc1 Amb25212222 [0,2,0,0,0,0|1,0,0]=3 8244 B12R1.50 CC(CO)Cc1cc(F)c[n]c1 Amb24654523 [0,2,0,0,0,0|2,0,0]=4 8245 B12R1.50 CC(CO)Cc1cc(F)ccc1 Amb25228330 [0,2,0,0,0,0|1,0,0]=3 8246 B12R1.50 CC(CO)Nc1c[n]cc(N)c1 Amb24531592 [0,2,0,0,0,0|2,0,0]=4 8247 B12R1.50 CC(CO)Nc1cc(Br)cc[n]1 Amb24705364 [0,2,0,0,0,0|2,0,0]=4 8248 B12R1.50 CC(CO)Nc1cc(N)cc[n]1 Amb18293573 [0,2,0,0,0,0|2,0,0]=4 8249 B12R1.50 CC(CO)Nc1cc[n]c(F)c1 Amb24419333 [0,2,0,0,0,0|2,0,0]=4 8250 B12R1.50 CC(CO)Nc1cccc(Br)[n]1 Amb24483480 [0,2,0,0,0,0|2,0,0]=4 8251 B12R1.50 CC(CO)Nc1cccc(Br)c1 Amb18290175 [0,2,0,0,0,0|1,0,0]=3 8252 B12R1.50 CC(CO)Nc1cccc(Cl)[n]1 Amb24682006 [0,2,0,0,0,0|2,0,0]=4 8253 B12R1.50 CC(CO)Nc1cccc(Cl)c1 Amb18290158 [0,2,0,0,0,0|1,0,0]=3 8254 B12R1.50 CC(CO)Nc1cccc(F)[n]1 Amb18290678 [0,2,0,0,0,0|2,0,0]=4 8255 B12R1.50 CC(CO)Nc1cccc(F)c1 Amb18971844 [0,2,0,0,0,0|1,0,0]=3 8256 B12R1.50 CC(CO)Oc1cc(Cl)[n]c[n]1 Amb25820286 [0,2,0,0,0,0|2,0,0]=4 8257 B12R1.50 CC(CO)Oc1cc(O)ccc1 Amb25320205 [0,2,0,0,0,0|0,0,0]=2 8258 B12R1.50 CC(CO)Oc1cccc(N)c1 Amb25849749 [0,2,0,0,0,0|0,0,0]=2 8259 B12R1.50 CC(CO)Sc1cc(O)ccc1 Amb25130867 [0,2,0,0,0,0|0,1,0]=3 8260 B12R1.50 CC(CO)Sc1cc[n]c(F)c1 Amb24637560 [0,2,0,0,0,0|1,1,0]=4 8261 B12R1.50 CC(CO)Sc1cccc(Br)c1 Amb24361119 [0,2,0,0,0,0|0,1,0]=3 8262 B12R1.50 CC(CO)Sc1cccc(F)[n]1 Amb25247749 [0,2,0,0,0,0|1,1,0]=4 8263 B12R1.50 CC(CO)Sc1cccc(F)c1 Amb25792582 [0,2,0,0,0,0|0,1,0]=3 8264 B12R1.50 CC(CO)Sc1cccc(N)[n]1 Amb25758425 [0,2,0,0,0,0|1,1,0]=4 8265 B12R1.50 CC(CO)Sc1cccc(N)c1 Amb24697150 [0,2,0,0,0,0|0,1,0]=3 8266 B12R1.50 CC(Cc1cc(O)ccc1)CO Amb24579423 [0,2,0,0,0,0|1,0,0]=3 8267 B12R1.50 CC(Cc1cccc(F)c1)NO Amb25056304 [0,2,0,0,0,0|2,0,0]=4 8268 B12R1.50 CC(Cc1cccc(O)c1)CBr Amb24444691 [0,2,0,0,0,0|2,0,0]=4 8269 B12R1.50 CC(Cc1cccc(O)c1)CCl Amb24537852 [0,2,0,0,0,0|2,0,0]=4 8270 B12R1.50 CCC(=O)Oc1cccc(Br)c1 Amb25219957 [0,2,0,0,0,0|1,0,1]=4 8271 B12R1.50 CCC(=O)Oc1cccc(Cl)c1 Amb25800916 [0,2,0,0,0,0|1,0,1]=4 8272 B12R1.50 CCC(=O)Oc1cccc(F)c1 Amb25153440 [0,2,0,0,0,0|1,0,1]=4 8273 B12R1.50 CCC(=O)Oc1cccc(I)c1 Amb25220812 [0,2,0,0,0,0|1,0,1]=4 8274 B12R1.50 CCC(=O)Oc1cccc(O)c1 Amb22167292 [0,2,0,0,0,0|1,0,1]=4 8275 B12R1.50 CCC(Br)Cc1cc(Br)ccc1 Amb18049408 [0,2,0,0,0,0|2,0,0]=4 8276 B12R1.50 CCC(Br)Cc1cc(F)ccc1 Amb25039883 [0,2,0,0,0,0|2,0,0]=4 8277 B12R1.50 CCC(C)Oc1cc(Br)cc[n]1 Amb22276480 [0,2,0,0,0,0|2,0,0]=4 8278 B12R1.50 CCC(C)Oc1cc(Cl)cc[n]1 Amb22276244 [0,2,0,0,0,0|2,0,0]=4 8279 B12R1.50 CCC(C)Oc1cc(N)cc[n]1 Amb18293585 [0,2,0,0,0,0|2,0,0]=4 8280 B12R1.50 CCC(C)Oc1cccc(Br)[n]1 Amb25775646 [0,2,0,0,0,0|2,0,0]=4 8281 B12R1.50 CCC(C)Oc1cccc(Cl)[n]1 Amb24380292 [0,2,0,0,0,0|2,0,0]=4 8282 B12R1.50 CCC(C)Oc1cccc(F)[n]1 Amb18177898 [0,2,0,0,0,0|2,0,0]=4 8283 B12R1.50 CCC(C)Oc1cccc(I)c1 Amb24422625 [0,2,0,0,0,0|1,0,0]=3 8284 B12R1.50 CCC(C)Sc1cccc(Br)c1 Amb25706089 [0,2,0,0,0,0|1,1,0]=4 8285 B12R1.50 CCC(C)Sc1cccc(N)c1 Amb18289356 [0,2,0,0,0,0|1,1,0]=4 8286 B12R1.50 CCC(C)Sc1cccc(O)c1 Amb25136875 [0,2,0,0,0,0|1,1,0]=4 8287 B12R1.50 CCC(Cc1cccc(c1)Br)Cl Amb17477597 [0,2,0,0,0,0|2,0,0]=4 8288 B12R1.50 CCC(Cc1cccc(c1)Br)O Amb17477580 [0,2,0,0,0,0|2,0,0]=4 8289 B12R1.50 CCC(Cc1cccc(c1)C)Cl Amb17477424 [0,2,0,0,0,0|2,0,0]=4 8290 B12R1.50 CCC(Cc1cccc(c1)C)O Amb17138582 [0,2,0,0,0,0|2,0,0]=4 8291 B12R1.50 CCC(Cc1cccc(c1)Cl)Cl Amb17477605 [0,2,0,0,0,0|2,0,0]=4 8292 B12R1.50 CCC(Cc1cccc(c1)Cl)O Amb17139102 [0,2,0,0,0,0|2,0,0]=4 8293 B12R1.50 CCC(Cc1cccc(c1)F)O Amb17138636 [0,2,0,0,0,0|2,0,0]=4 8294 B12R1.50 CCC(Cl)Cc1cc(F)ccc1 Amb19046367 [0,2,0,0,0,0|2,0,0]=4 8295 B12R1.50 CCC(N)Cc1cc(I)ccc1 Amb25800100 [0,2,0,0,0,0|2,0,0]=4 8296 B12R1.50 CCC(Oc1cccc(c1)N)C Amb2189170 [0,2,0,0,0,0|1,0,0]=3 8297 B12R1.50 CC[C@@H](N)Cc1cc(F)ccc1 Amb24535474 [0,2,0,0,0,0|2,0,0]=4 8298 B12R1.50 CC[C@H](C)Oc1cccc(O)c1 Amb24497029 [0,2,0,0,0,0|1,0,0]=3 8299 B12R1.50 CC[C@H](N)Cc1cc(Cl)ccc1 Amb24668259 [0,2,0,0,0,0|2,0,0]=4 8300 B12R1.50 C[C@@H](CO)Nc1cc(Br)cc[n]1 Amb25160518 [0,2,0,0,0,0|2,0,0]=4 8301 B12R1.50 C[C@@H](CO)Nc1cccc(Cl)[n]1 Amb24476491 [0,2,0,0,0,0|2,0,0]=4 8302 B12R1.50 C[C@@H](CO)Nc1cccc(Cl)c1 Amb22831872 [0,2,0,0,0,0|1,0,0]=3 8303 B12R1.50 C[C@@H](CO)Nc1cccc(F)[n]1 Amb25160519 [0,2,0,0,0,0|2,0,0]=4 8304 B12R1.50 C[C@@H](CO)Oc1cc(Cl)[n]c[n]1 Amb25706102 [0,2,0,0,0,0|2,0,0]=4 8305 B12R1.50 C[C@@H](CO)Oc1cccc(Cl)c1 Amb24618891 [0,2,0,0,0,0|0,0,0]=2 8306 B12R1.50 C[C@H](CO)Oc1cccc(Cl)c1 Amb24414999 [0,2,0,0,0,0|0,0,0]=2 8307 B12R1.50 C\C(\CO)=C\c1cc(O)ccc1 Amb25369722 [0,2,0,0,0,0|1,0,1]=4 8308 B12R1.50 Cc1cc(CC(=O)CO)ccc1 Amb18563612 [0,2,0,0,0,0|1,0,1]=4 8309 B12R1.50 Cc1cc(CC(N)CF)ccc1 Amb24708150 [0,2,0,0,0,0|2,0,0]=4 8310 B12R1.50 Cc1cc(CC(N)CO)c[n]c1 Amb25374367 [0,2,0,0,0,0|2,0,0]=4 8311 B12R1.50 Cc1cc(CC(O)CCl)ccc1 Amb24711431 [0,2,0,0,0,0|2,0,0]=4 8312 B12R1.50 Cc1cc(CC(O)CO)ccc1 Amb24397224 [0,2,0,0,0,0|1,0,0]=3 8313 B12R1.50 Cc1cc(C[C@@H](N)CO)ccc1 Amb24362986 [0,2,0,0,0,0|1,0,0]=3 8314 B12R1.50 Cc1cc(C[C@@H](O)CCl)ccc1 Amb24652370 [0,2,0,0,0,0|2,0,0]=4 8315 B12R1.50 Cc1cc(cc[n]1)SC(C)CO Amb25373441 [0,2,0,0,0,0|1,1,0]=4 8316 B12R1.50 Cc1cc(ccc1)OC(=O)CC Amb25198730 [0,2,0,0,0,0|1,0,1]=4 8317 B12R1.50 Cc1cc(ccc1)OC(=O)CN Amb19115307 [0,2,0,0,0,0|1,0,1]=4 8318 B12R1.50 Cc1cc(ccc1)OC(=O)CO Amb25160233 [0,2,0,0,0,0|0,0,1]=3 8319 B12R1.50 Cc1cc[n]c(c1)NC(C)CO Amb18293563 [0,2,0,0,0,0|2,0,0]=4 8320 B12R1.50 Cc1cccc(CC(Br)CC)c1 Amb24483315 [0,2,0,0,0,0|2,0,0]=4 8321 B12R1.50 Cc1cccc(CC(C)CO)c1 Amb24341616 [0,2,0,0,0,0|1,0,0]=3 8322 B12R1.50 Cc1cccc(CC(N)CO)[n]1 Amb25737795 [0,2,0,0,0,0|2,0,0]=4 8323 B12R1.50 Cc1cccc(NC(C)CO)[n]1 Amb18972552 [0,2,0,0,0,0|2,0,0]=4 8324 B12R1.50 Cc1cccc([n]1)SC(C)CO Amb24703024 [0,2,0,0,0,0|1,1,0]=4 8325 B12R1.50 Cc1cccc(c1)NC(C)CN Amb18251702 [0,2,0,0,0,0|2,0,0]=4 8326 B12R1.50 Cc1cccc(c1)NC(C)CO Amb18971818 [0,2,0,0,0,0|1,0,0]=3 8327 B12R1.50 Cc1cccc(c1)OC(C)C=C Amb24484277 [0,2,0,0,0,0|1,0,1]=4 8328 B12R1.50 Cc1cccc(c1)OC(C)C=O Amb25780101 [0,2,0,0,0,0|0,0,2]=4 8329 B12R1.50 Cc1cccc(c1)OC(C)CC Amb24484235 [0,2,0,0,0,0|1,0,0]=3 8330 B12R1.50 Cc1cccc(c1)SC(C)CN Amb18992832 [0,2,0,0,0,0|1,1,0]=4 8331 B12R1.50 Cc1cccc(c1)SC(C)CO Amb25792350 [0,2,0,0,0,0|0,1,0]=3 8332 B12R1.50 Cc1cccc(c1)SC(O)CC Amb22228367 [0,2,0,0,0,0|1,1,0]=4 8333 B12R1.50 ClCC(Oc1cccc(c1)Br)C Amb17261133 [0,2,0,0,0,0|1,0,0]=3 8334 B12R1.50 ClCC(Oc1cccc(c1)C)C Amb17234169 [0,2,0,0,0,0|1,0,0]=3 8335 B12R1.50 ClCC(Oc1cccc(c1)Cl)C Amb17238290 [0,2,0,0,0,0|1,0,0]=3 8336 B12R1.50 ClCC(Oc1cccc(c1)F)C Amb17234614 [0,2,0,0,0,0|1,0,0]=3 8337 B12R1.50 NC(CO)CC1=CC=CC(=O)N1 Amb25853681 [0,2,0,0,0,0|2,0,0]=4 8338 B12R1.50 NC(CO)Cc1cc(Br)[n]cc1 Amb25241686 [0,2,0,0,0,0|2,0,0]=4 8339 B12R1.50 NC(CO)Cc1cc(F)ccc1 Amb22751648 [0,2,0,0,0,0|1,0,0]=3 8340 B12R1.50 NC(CO)Cc1cc(I)ccc1 Amb24694473 [0,2,0,0,0,0|1,0,0]=3 8341 B12R1.50 NC(Cc1cc(F)ccc1)CF Amb25267761 [0,2,0,0,0,0|2,0,0]=4 8342 B12R1.50 NCC(=O)Oc1cccc(c1)Br Amb17344447 [0,2,0,0,0,0|1,0,1]=4 8343 B12R1.50 NCC(=O)Oc1cccc(c1)C Amb17334635 [0,2,0,0,0,0|1,0,1]=4 8344 B12R1.50 NCC(=O)Oc1cccc(c1)Cl Amb17335804 [0,2,0,0,0,0|1,0,1]=4 8345 B12R1.50 NCC(=O)Oc1cccc(c1)F Amb17334753 [0,2,0,0,0,0|1,0,1]=4 8346 B12R1.50 NCC(Cc1cccc(c1)Br)O Amb17248846 [0,2,0,0,0,0|2,0,0]=4 8347 B12R1.50 NCC(Cc1cccc(c1)C)O Amb17232548 [0,2,0,0,0,0|2,0,0]=4 8348 B12R1.50 NCC(Cc1cccc(c1)Cl)O Amb17234266 [0,2,0,0,0,0|2,0,0]=4 8349 B12R1.50 NCC(F)Cc1cc(Cl)ccc1 Amb25078215 [0,2,0,0,0,0|2,0,0]=4 8350 B12R1.50 NCC(F)Cc1cc(F)ccc1 Amb25667301 [0,2,0,0,0,0|2,0,0]=4 8351 B12R1.50 NCC(N)Cc1cccc(O)c1 Amb25097207 [0,2,0,0,0,0|2,0,0]=4 8352 B12R1.50 NCC(Nc1cccc(c1)Cl)C Amb17226673 [0,2,0,0,0,0|2,0,0]=4 8353 B12R1.50 NCC(O)Cc1cc(F)ccc1 Amb18563898 [0,2,0,0,0,0|2,0,0]=4 8354 B12R1.50 N[C@@H](Cc1cc(O)ccc1)CO Amb22233156 [0,2,0,0,0,0|1,0,0]=3 8355 B12R1.50 N[C@H](CO)Cc1cc(Cl)ccc1 Amb22233154 [0,2,0,0,0,0|1,0,0]=3 8356 B12R1.50 Nc1cc(ccc1)OC(=O)CN Amb25291404 [0,2,0,0,0,0|1,0,1]=4 8357 B12R1.50 Nc1cccc(CC(N)CN)c1 Amb24559863 [0,2,0,0,0,0|2,0,0]=4 8358 B12R1.50 Nc1cccc(C[C@H](N)CO)c1 Amb22233155 [0,2,0,0,0,0|1,0,0]=3 8359 B12R1.50 OC(CCl)Sc1cc(Cl)ccc1 Amb24065279 [0,2,0,0,0,0|1,1,0]=4 8360 B12R1.50 OC(Cc1cc(Cl)ccc1)CCl Amb25780609 [0,2,0,0,0,0|2,0,0]=4 8361 B12R1.50 OC(Cc1cccc(F)c1)CCl Amb25266882 [0,2,0,0,0,0|2,0,0]=4 8362 B12R1.50 OCC(=O)Cc1cc(Br)ccc1 Amb18572003 [0,2,0,0,0,0|1,0,1]=4 8363 B12R1.50 OCC(=O)Cc1cc(Cl)ccc1 Amb18564304 [0,2,0,0,0,0|1,0,1]=4 8364 B12R1.50 OCC(=O)Cc1cc(F)ccc1 Amb25232023 [0,2,0,0,0,0|1,0,1]=4 8365 B12R1.50 OCC(=O)Nc1cccc(c1)Cl Amb1110353 [0,2,0,0,0,0|1,0,1]=4 8366 B12R1.50 OCC(=O)Nc1cccc(c1)F Amb1110282 [0,2,0,0,0,0|1,0,1]=4 8367 B12R1.50 OCC(=O)Oc1cccc(Cl)c1 Amb25043439 [0,2,0,0,0,0|0,0,1]=3 8368 B12R1.50 OCC(Cc1cccc(c1)Br)N Amb17062712 [0,2,0,0,0,0|1,0,0]=3 8369 B12R1.50 OCC(Cc1cccc(c1)C)N Amb17062686 [0,2,0,0,0,0|1,0,0]=3 8370 B12R1.50 OCC(Cc1cccc(c1)Cl)N Amb17062695 [0,2,0,0,0,0|1,0,0]=3 8371 B12R1.50 OCC(Cc1cccc(c1)O)N Amb17062711 [0,2,0,0,0,0|1,0,0]=3 8372 B12R1.50 OCC(O)C[n+]1cc(Br)ccc1 Amb21994488 [0,2,0,0,0,0|2,0,0]=4 8373 B12R1.50 OCC(O)Cc1cccc(Cl)c1 Amb25281635 [0,2,0,0,0,0|1,0,0]=3 8374 B12R1.50 OCC(Oc1cccc(c1)Br)C Amb17249277 [0,2,0,0,0,0|0,0,0]=2 8375 B12R1.50 OCC(Oc1cccc(c1)C)C Amb17232601 [0,2,0,0,0,0|0,0,0]=2 8376 B12R1.50 OCC(Oc1cccc(c1)Cl)C Amb17234357 [0,2,0,0,0,0|0,0,0]=2 8377 B12R1.50 OCC(Oc1cccc(c1)F)C Amb17232740 [0,2,0,0,0,0|0,0,0]=2 8378 B12R1.50 OCC(S)Cc1cc(F)ccc1 Amb25177551 [0,2,0,0,0,0|1,0,0]=3 8379 B12R1.50 Oc1cc(ccc1)OC(=O)CCl Amb18649457 [0,2,0,0,0,0|1,0,1]=4 8380 B12R1.50 Oc1cccc(CC(O)CO)c1 Amb24497069 [0,2,0,0,0,0|1,0,0]=3 8381 B12R1.100 BrCCOc1cc(C)cc(c1)C Amb1153291 [0,2,0,0,0,0|1,0,0]=3 8382 B12R1.100 C#CCOc1cc(Cl)cc(Cl)c1 Amb19090783 [0,2,0,0,0,0|1,0,1]=4 8383 B12R1.100 C#CCOc1cc(F)cc(F)c1 Amb18182666 [0,2,0,0,0,0|1,0,1]=4 8384 B12R1.100 C#CCOc1cc(N)cc(Br)c1 Amb24364545 [0,2,0,0,0,0|1,0,1]=4 8385 B12R1.100 C=CCOc1cc(Cl)cc(Cl)c1 Amb25762862 [0,2,0,0,0,0|1,0,1]=4 8386 B12R1.100 C=CCOc1cc(F)cc(F)c1 Amb25279969 [0,2,0,0,0,0|1,0,1]=4 8387 B12R1.100 C=CCOc1cc(F)cc(I)c1 Amb24645081 [0,2,0,0,0,0|1,0,1]=4 8388 B12R1.100 CC1=CC(=CC(=O)O1)OCCN Amb22642627 [0,2,0,0,0,0|2,0,0]=4 8389 B12R1.100 CCCCc1cc(Br)cc(Br)c1 Amb19944051 [0,2,0,0,0,0|2,0,0]=4 8390 B12R1.100 CCCCc1cc(C)cc(C)c1 Amb20621114 [0,2,0,0,0,0|2,0,0]=4 8391 B12R1.100 CCCCc1cc(F)cc(F)c1 Amb20620632 [0,2,0,0,0,0|2,0,0]=4 8392 B12R1.100 CCCCc1cc(O)cc(O)c1 Amb24331632 [0,2,0,0,0,0|2,0,0]=4 8393 B12R1.100 CCCNc1cc(F)cc(N)c1 Amb18289354 [0,2,0,0,0,0|2,0,0]=4 8394 B12R1.100 CCCOc1cc(C)[n]c(C)c1 Amb25222170 [0,2,0,0,0,0|2,0,0]=4 8395 B12R1.100 CCCOc1cc(C)cc(c1)Br Amb17506057 [0,2,0,0,0,0|1,0,0]=3 8396 B12R1.100 CCCOc1cc(Cl)cc(Cl)c1 Amb21964743 [0,2,0,0,0,0|1,0,0]=3 8397 B12R1.100 CCCOc1cc(N)[n]c(N)c1 Amb24739594 [0,2,0,0,0,0|2,0,0]=4 8398 B12R1.100 CCCOc1cc(N)cc(Cl)[n]1 Amb22276219 [0,2,0,0,0,0|2,0,0]=4 8399 B12R1.100 CCCOc1cc(N)cc(N)c1 Amb24405495 [0,2,0,0,0,0|1,0,0]=3 8400 B12R1.100 CCCOc1cc(S)cc(N)c1 Amb25830785 [0,2,0,0,0,0|1,0,0]=3 8401 B12R1.100 CCCSc1cc(F)cc(N)c1 Amb18969323 [0,2,0,0,0,0|1,1,0]=4 8402 B12R1.100 COCOc1cc(C)cc(C)c1 Amb24485678 [0,2,0,0,0,0|2,0,0]=4 8403 B12R1.100 COCOc1cc(Cl)cc(Cl)c1 Amb25669755 [0,2,0,0,0,0|2,0,0]=4 8404 B12R1.100 CSCOc1cc(Cl)cc(Cl)c1 Amb24456411 [0,2,0,0,0,0|2,0,0]=4 8405 B12R1.100 Cc1[n]c(Cl)cc([n]1)OCCO Amb18330039 [0,2,0,0,0,0|2,0,0]=4 8406 B12R1.100 Cc1cc(Br)cc(c1)NCCN Amb25068548 [0,2,0,0,0,0|2,0,0]=4 8407 B12R1.100 Cc1cc(Br)cc(c1)NCCO Amb24653429 [0,2,0,0,0,0|1,0,0]=3 8408 B12R1.100 Cc1cc(Br)cc(c1)OCCN Amb23590664 [0,2,0,0,0,0|1,0,0]=3 8409 B12R1.100 Cc1cc(CCCBr)cc(F)c1 Amb24453699 [0,2,0,0,0,0|2,0,0]=4 8410 B12R1.100 Cc1cc(CCCBr)cc(I)c1 Amb24605669 [0,2,0,0,0,0|2,0,0]=4 8411 B12R1.100 Cc1cc(CCCCl)cc(C)c1 Amb19068163 [0,2,0,0,0,0|2,0,0]=4 8412 B12R1.100 Cc1cc(CCCCl)cc(O)c1 Amb25217661 [0,2,0,0,0,0|2,0,0]=4 8413 B12R1.100 Cc1cc(CCCN)cc(Br)c1 Amb25851408 [0,2,0,0,0,0|2,0,0]=4 8414 B12R1.100 Cc1cc(CCCN)cc(Cl)c1 Amb25282299 [0,2,0,0,0,0|2,0,0]=4 8415 B12R1.100 Cc1cc(CCCO)cc(C)c1 Amb18798360 [0,2,0,0,0,0|1,0,0]=3 8416 B12R1.100 Cc1cc(Cl)cc(c1)OCCC Amb25265303 [0,2,0,0,0,0|1,0,0]=3 8417 B12R1.100 Cc1cc(Cl)cc(c1)OCCN Amb24410300 [0,2,0,0,0,0|1,0,0]=3 8418 B12R1.100 Cc1cc(F)cc(c1)NCCN Amb25034985 [0,2,0,0,0,0|2,0,0]=4 8419 B12R1.100 Cc1cc(I)cc(c1)NCCO Amb25160175 [0,2,0,0,0,0|1,0,0]=3 8420 B12R1.100 Cc1cc(N)cc(CCCC)c1 Amb24457282 [0,2,0,0,0,0|2,0,0]=4 8421 B12R1.100 Cc1cc(N)cc(c1)NCCN Amb25098174 [0,2,0,0,0,0|2,0,0]=4 8422 B12R1.100 Cc1cc(N)cc(c1)OCCC Amb25345513 [0,2,0,0,0,0|1,0,0]=3 8423 B12R1.100 Cc1cc(O)cc(CCCC)c1 Amb25102928 [0,2,0,0,0,0|2,0,0]=4 8424 B12R1.100 Cc1cc(O)cc(c1)OCCC Amb25109724 [0,2,0,0,0,0|1,0,0]=3 8425 B12R1.100 Cc1cc(O)cc(c1)OCOC Amb25039254 [0,2,0,0,0,0|2,0,0]=4 8426 B12R1.100 Cc1cc([n]c(Cl)[n]1)OCCO Amb18330038 [0,2,0,0,0,0|2,0,0]=4 8427 B12R1.100 Cc1cc(\C=C\CO)cc(C)c1 Amb23555572 [0,2,0,0,0,0|1,0,1]=4 8428 B12R1.100 Cc1cc(cc(C)[n]1)NCCO Amb24493543 [0,2,0,0,0,0|2,0,0]=4 8429 B12R1.100 Cc1cc(cc(C)[n]1)OCCN Amb24354724 [0,2,0,0,0,0|2,0,0]=4 8430 B12R1.100 Cc1cc(cc(C)[n]1)OCCO Amb25323364 [0,2,0,0,0,0|1,0,0]=3 8431 B12R1.100 Cc1cc(cc(C)[n]1)SCCO Amb25857668 [0,2,0,0,0,0|1,1,0]=4 8432 B12R1.100 Cc1cc(cc(C)c1)C#CCO Amb18792231 [0,2,0,0,0,0|1,0,1]=4 8433 B12R1.100 Cc1cc(cc(C)c1)OCC#C Amb18183415 [0,2,0,0,0,0|1,0,1]=4 8434 B12R1.100 Cc1cc(cc(C)c1)OCC=C Amb25667217 [0,2,0,0,0,0|1,0,1]=4 8435 B12R1.100 Cc1cc(cc(C)c1)OCNN Amb25174182 [0,2,0,0,0,0|2,0,0]=4 8436 B12R1.100 Cc1cc(cc(C)c1)SCCN Amb18909241 [0,2,0,0,0,0|1,1,0]=4 8437 B12R1.100 Cc1cc(cc(Cl)c1)OCC=C Amb25790276 [0,2,0,0,0,0|1,0,1]=4 8438 B12R1.100 Cc1cc(cc(F)c1)C#CCO Amb25825086 [0,2,0,0,0,0|1,0,1]=4 8439 B12R1.100 Cc1cc(cc(N)c1)NCCO Amb24431310 [0,2,0,0,0,0|1,0,0]=3 8440 B12R1.100 Cc1cc(cc(N)c1)SCCO Amb24462266 [0,2,0,0,0,0|0,1,0]=3 8441 B12R1.100 Cc1cc(cc(O)c1)OCC=C Amb24408439 [0,2,0,0,0,0|1,0,1]=4 8442 B12R1.100 Cc1cc(cc(O)c1)OCCCl Amb25233023 [0,2,0,0,0,0|1,0,0]=3 8443 B12R1.100 ClCCCc1cc(Cl)cc(Cl)c1 Amb24656658 [0,2,0,0,0,0|2,0,0]=4 8444 B12R1.100 ClCCNc1cc(C)cc(c1)C Amb17335664 [0,2,0,0,0,0|2,0,0]=4 8445 B12R1.100 ClCCNc1cc(Cl)cc(c1)Cl Amb17343165 [0,2,0,0,0,0|2,0,0]=4 8446 B12R1.100 ClCCOc1cc(Br)cc(Br)c1 Amb24493398 [0,2,0,0,0,0|1,0,0]=3 8447 B12R1.100 Clc1cc(Br)cc(CCCBr)c1 Amb24424487 [0,2,0,0,0,0|2,0,0]=4 8448 B12R1.100 Clc1cc(I)cc(CCCCl)c1 Amb24596614 [0,2,0,0,0,0|2,0,0]=4 8449 B12R1.100 Clc1cc(cc(Cl)c1)SCCBr Amb25834988 [0,2,0,0,0,0|1,1,0]=4 8450 B12R1.100 Fc1cc(Br)cc(CCCBr)c1 Amb25804673 [0,2,0,0,0,0|2,0,0]=4 8451 B12R1.100 Fc1cc(Br)cc(c1)OCCBr Amb24465729 [0,2,0,0,0,0|1,0,0]=3 8452 B12R1.100 Fc1cc(Br)cc(c1)OCCCl Amb24474593 [0,2,0,0,0,0|1,0,0]=3 8453 B12R1.100 Fc1cc(CCCBr)cc(F)c1 Amb25034793 [0,2,0,0,0,0|2,0,0]=4 8454 B12R1.100 Fc1cc(CCCBr)cc(I)c1 Amb24640773 [0,2,0,0,0,0|2,0,0]=4 8455 B12R1.100 Fc1cc(CCCCl)cc(F)c1 Amb25152291 [0,2,0,0,0,0|2,0,0]=4 8456 B12R1.100 Fc1cc(CCCCl)cc(I)c1 Amb24640774 [0,2,0,0,0,0|2,0,0]=4 8457 B12R1.100 Fc1cc(Cl)cc(c1)NCCF Amb25720516 [0,2,0,0,0,0|2,0,0]=4 8458 B12R1.100 Fc1cc(cc(F)c1)OCCCl Amb19061624 [0,2,0,0,0,0|1,0,0]=3 8459 B12R1.100 Fc1cc(cc(F)c1)OCCS Amb25345868 [0,2,0,0,0,0|0,1,0]=3 8460 B12R1.100 N#CCOc1cc(F)cc(F)c1 Amb18801188 [0,2,0,0,0,0|1,0,1]=4 8461 B12R1.100 N#CCOc1cc(O)cc(O)c1 Amb24068366 [0,2,0,0,0,0|1,0,1]=4 8462 B12R1.100 NCCCc1cc(Br)cc(Br)c1 Amb24420259 [0,2,0,0,0,0|2,0,0]=4 8463 B12R1.100 NCCCc1cc(C)cc(c1)C Amb17204308 [0,2,0,0,0,0|2,0,0]=4 8464 B12R1.100 NCCCc1cc(Cl)cc(c1)Cl Amb17204406 [0,2,0,0,0,0|2,0,0]=4 8465 B12R1.100 NCCCc1cc(F)cc(Br)c1 Amb25795729 [0,2,0,0,0,0|2,0,0]=4 8466 B12R1.100 NCCCc1cc(F)cc(Cl)c1 Amb25709208 [0,2,0,0,0,0|2,0,0]=4 8467 B12R1.100 NCCCc1cc(F)cc(F)c1 Amb18126758 [0,2,0,0,0,0|2,0,0]=4 8468 B12R1.100 NCCCc1cc(O)cc(Br)c1 Amb25045372 [0,2,0,0,0,0|2,0,0]=4 8469 B12R1.100 NCCCc1cc(O)cc(Cl)c1 Amb25710883 [0,2,0,0,0,0|2,0,0]=4 8470 B12R1.100 NCCCc1cc(O)cc(O)c1 Amb25113881 [0,2,0,0,0,0|2,0,0]=4 8471 B12R1.100 NCCNc1cc(Br)cc(Cl)c1 Amb24502463 [0,2,0,0,0,0|2,0,0]=4 8472 B12R1.100 NCCNc1cc(C)cc(c1)C Amb17057763 [0,2,0,0,0,0|2,0,0]=4 8473 B12R1.100 NCCNc1cc(Cl)cc(F)c1 Amb25817322 [0,2,0,0,0,0|2,0,0]=4 8474 B12R1.100 NCCNc1cc(Cl)cc(c1)Cl Amb17091083 [0,2,0,0,0,0|2,0,0]=4 8475 B12R1.100 NCCNc1cc(F)cc(F)c1 Amb18299159 [0,2,0,0,0,0|2,0,0]=4 8476 B12R1.100 NCCOc1cc(Br)cc(Cl)c1 Amb25034906 [0,2,0,0,0,0|1,0,0]=3 8477 B12R1.100 NCCOc1cc(Br)cc(F)c1 Amb24389824 [0,2,0,0,0,0|1,0,0]=3 8478 B12R1.100 NCCOc1cc(C)cc(c1)C Amb1065358 [0,2,0,0,0,0|1,0,0]=3 8479 B12R1.100 NCCOc1cc(F)cc(F)c1 Amb18997300 [0,2,0,0,0,0|1,0,0]=3 8480 B12R1.100 Nc1[n]c(Br)cc([n]1)OCCO Amb25288502 [0,2,0,0,0,0|2,0,0]=4 8481 B12R1.100 Nc1[n]c(Cl)cc([n]1)OCCO Amb24714460 [0,2,0,0,0,0|2,0,0]=4 8482 B12R1.100 Nc1cc(Br)[n]c([n]1)OCCO Amb25120422 [0,2,0,0,0,0|2,0,0]=4 8483 B12R1.100 Nc1cc(F)cc(c1)NCCN Amb18991515 [0,2,0,0,0,0|2,0,0]=4 8484 B12R1.100 Nc1cc(F)cc(c1)NCCO Amb18969362 [0,2,0,0,0,0|1,0,0]=3 8485 B12R1.100 Nc1cc(F)cc(c1)OCCO Amb25703510 [0,2,0,0,0,0|0,0,0]=2 8486 B12R1.100 Nc1cc(F)cc(c1)SCCO Amb18289367 [0,2,0,0,0,0|0,1,0]=3 8487 B12R1.100 Nc1cc(O)cc(c1)OCCO Amb24451135 [0,2,0,0,0,0|0,0,0]=2 8488 B12R1.100 Nc1cc(cc(Br)c1)OCC#N Amb25798663 [0,2,0,0,0,0|1,0,1]=4 8489 B12R1.100 Nc1cc(cc(N)c1)OCC#N Amb25046905 [0,2,0,0,0,0|1,0,1]=4 8490 B12R1.100 Nc1cc(cc(N)c1)OCCO Amb24367238 [0,2,0,0,0,0|0,0,0]=2 8491 B12R1.100 O=CCOc1cc(F)cc(Br)c1 Amb25827273 [0,2,0,0,0,0|0,0,2]=4 8492 B12R1.100 O=CCOc1cc(F)cc(F)c1 Amb18802837 [0,2,0,0,0,0|0,0,2]=4 8493 B12R1.100 OC=1C=C(CCCO)NC(=O)C1 Amb25714614 [0,2,0,0,0,0|2,0,0]=4 8494 B12R1.100 OCCCc1cc(C)nc(c1)C Amb10573709 [0,2,0,0,0,0|2,0,0]=4 8495 B12R1.100 OCCCc1cc(Cl)cc(Br)c1 Amb25150113 [0,2,0,0,0,0|1,0,0]=3 8496 B12R1.100 OCCCc1cc(Cl)cc(c1)Cl Amb17605792 [0,2,0,0,0,0|1,0,0]=3 8497 B12R1.100 OCCCc1cc(F)cc(Br)c1 Amb24453157 [0,2,0,0,0,0|1,0,0]=3 8498 B12R1.100 OCCCc1cc(F)cc(Cl)c1 Amb24673776 [0,2,0,0,0,0|1,0,0]=3 8499 B12R1.100 OCCCc1cc(F)cc(F)c1 Amb24094063 [0,2,0,0,0,0|1,0,0]=3 8500 B12R1.100 OCCCc1cc(O)cc(O)c1 Amb24674121 [0,2,0,0,0,0|1,0,0]=3 8501 B12R1.100 OCCNc1cc(C)[nH]c(=O)c1 Amb2549073 [0,2,0,0,0,0|2,0,0]=4 8502 B12R1.100 OCCNc1cc(Cl)cc(F)c1 Amb25710763 [0,2,0,0,0,0|1,0,0]=3 8503 B12R1.100 OCCOc1cc(Br)cc(F)c1 Amb25344156 [0,2,0,0,0,0|0,0,0]=2 8504 B12R1.100 OCCOc1cc(C)cc(c1)C Amb2209348 [0,2,0,0,0,0|0,0,0]=2 8505 B12R1.100 OCCOc1cc(Cl)[n]c(Cl)[n]1 Amb25798085 [0,2,0,0,0,0|2,0,0]=4 8506 B12R1.100 OCCOc1cc(F)cc(F)c1 Amb18803893 [0,2,0,0,0,0|0,0,0]=2 8507 B12R1.100 OCCOc1cc(I)cc(F)c1 Amb24498015 [0,2,0,0,0,0|0,0,0]=2 8508 B12R1.100 OCCSc1cc(Br)cc(Cl)c1 Amb25680612 [0,2,0,0,0,0|0,1,0]=3 8509 B12R1.100 OC\C=C\c1cc(F)cc(Cl)c1 Amb24446625 [0,2,0,0,0,0|1,0,1]=4 8510 B12R1.100 OC\C=C\c1cc(F)cc(F)c1 Amb19889731 [0,2,0,0,0,0|1,0,1]=4 8511 B12R1.100 Oc1cc(CCCBr)cc(I)c1 Amb24605307 [0,2,0,0,0,0|2,0,0]=4 8512 B12R1.100 Oc1cc(CCCCl)cc(I)c1 Amb24713686 [0,2,0,0,0,0|2,0,0]=4 8513 B12R1.100 Oc1cc(CCCCl)cc(S)c1 Amb24541060 [0,2,0,0,0,0|2,0,0]=4 8514 B12R1.100 Oc1cc(Cl)cc(CCCCl)c1 Amb25195602 [0,2,0,0,0,0|2,0,0]=4 8515 B12R1.100 Oc1cc(\C=C\CO)cc(F)c1 Amb24673086 [0,2,0,0,0,0|1,0,1]=4 8516 B12R1.100 SCCOc1cc(Cl)cc(c1)Cl Amb17245967 [0,2,0,0,0,0|0,1,0]=3 8517 B12R1.100 SCCSc1cc(Cl)cc(Cl)c1 Amb24357102 [0,2,0,0,0,0|0,2,0]=4 8518 B12R1.100 Sc1cc(CCCBr)cc(I)c1 Amb24696764 [0,2,0,0,0,0|2,0,0]=4 8519 B12R1.226 C=C(Br)COc1cccc(I)c1 Amb24456153 [0,2,0,0,0,0|1,0,1]=4 8520 B12R1.226 C=C(Br)COc1cccc(N)c1 Amb18971516 [0,2,0,0,0,0|1,0,1]=4 8521 B12R1.226 C=C(Cl)COc1cc(Cl)ccc1 Amb24484274 [0,2,0,0,0,0|1,0,1]=4 8522 B12R1.226 C=C(Cl)COc1cccc(F)c1 Amb25340679 [0,2,0,0,0,0|1,0,1]=4 8523 B12R1.226 C=C(Cl)COc1cccc(N)c1 Amb18290028 [0,2,0,0,0,0|1,0,1]=4 8524 B12R1.226 C=C(F)COc1cccc(Br)c1 Amb23570548 [0,2,0,0,0,0|1,0,1]=4 8525 B12R1.226 CC(=C)COc1cccc(Cl)c1 Amb24409848 [0,2,0,0,0,0|1,0,1]=4 8526 B12R1.226 CC(=C)COc1cccc(I)c1 Amb24582646 [0,2,0,0,0,0|1,0,1]=4 8527 B12R1.226 CC(=C)COc1cccc(c1)N Amb2081546 [0,2,0,0,0,0|1,0,1]=4 8528 B12R1.226 CC(=O)COc1cccc(Cl)c1 Amb19075144 [0,2,0,0,0,0|0,0,2]=4 8529 B12R1.226 CC(=O)COc1cccc(O)c1 Amb25053053 [0,2,0,0,0,0|0,0,2]=4 8530 B12R1.226 CC(=O)COc1cccc(c1)Br Amb17226706 [0,2,0,0,0,0|0,0,2]=4 8531 B12R1.226 CC(=O)COc1cccc(c1)N Amb17110084 [0,2,0,0,0,0|0,0,2]=4 8532 B12R1.226 CC(Br)CCc1cc(Br)ccc1 Amb24488695 [0,2,0,0,0,0|2,0,0]=4 8533 B12R1.226 CC(Br)CCc1cccc(F)c1 Amb24366969 [0,2,0,0,0,0|2,0,0]=4 8534 B12R1.226 CC(Br)CCc1cccc(O)c1 Amb25765194 [0,2,0,0,0,0|2,0,0]=4 8535 B12R1.226 CC(C)COC=1C=CNC(=O)C1 Amb25092840 [0,2,0,0,0,0|2,0,0]=4 8536 B12R1.226 CC(C)COc1c[n]cc(N)c1 Amb24454303 [0,2,0,0,0,0|2,0,0]=4 8537 B12R1.226 CC(C)COc1c[n]cc(O)c1 Amb23455725 [0,2,0,0,0,0|2,0,0]=4 8538 B12R1.226 CC(C)COc1cc(Br)cc[n]1 Amb22276479 [0,2,0,0,0,0|2,0,0]=4 8539 B12R1.226 CC(C)COc1cc(Cl)cc[n]1 Amb22276513 [0,2,0,0,0,0|2,0,0]=4 8540 B12R1.226 CC(C)COc1cc(N)cc[n]1 Amb18981536 [0,2,0,0,0,0|2,0,0]=4 8541 B12R1.226 CC(C)COc1cccc(Cl)[n]1 Amb22432527 [0,2,0,0,0,0|2,0,0]=4 8542 B12R1.226 CC(C)COc1cccc(Cl)c1 Amb24484227 [0,2,0,0,0,0|1,0,0]=3 8543 B12R1.226 CC(C)COc1cccc(F)[n]1 Amb18788981 [0,2,0,0,0,0|2,0,0]=4 8544 B12R1.226 CC(C)COc1cccc(S)c1 Amb25808776 [0,2,0,0,0,0|1,0,0]=3 8545 B12R1.226 CC(C)CSc1cccc(Br)c1 Amb22227900 [0,2,0,0,0,0|1,1,0]=4 8546 B12R1.226 CC(C)CSc1cccc(Cl)c1 Amb25206523 [0,2,0,0,0,0|1,1,0]=4 8547 B12R1.226 CC(C)CSc1cccc(N)c1 Amb18289365 [0,2,0,0,0,0|1,1,0]=4 8548 B12R1.226 CC(C)CSc1cccc(O)c1 Amb25207683 [0,2,0,0,0,0|1,1,0]=4 8549 B12R1.226 CC(CCc1cccc(c1)C)O Amb17507253 [0,2,0,0,0,0|1,0,0]=3 8550 B12R1.226 CC(CNc1cccc(c1)Br)O Amb17142611 [0,2,0,0,0,0|1,0,0]=3 8551 B12R1.226 CC(CNc1cccc(c1)C)O Amb17138593 [0,2,0,0,0,0|1,0,0]=3 8552 B12R1.226 CC(CNc1cccc(c1)Cl)O Amb17139126 [0,2,0,0,0,0|1,0,0]=3 8553 B12R1.226 CC(CNc1cccc(c1)F)O Amb17138652 [0,2,0,0,0,0|1,0,0]=3 8554 B12R1.226 CC(COc1cccc(c1)Br)N Amb17062517 [0,2,0,0,0,0|1,0,0]=3 8555 B12R1.226 CC(COc1cccc(c1)C)N Amb1127701 [0,2,0,0,0,0|1,0,0]=3 8556 B12R1.226 CC(COc1cccc(c1)F)N Amb1142128 [0,2,0,0,0,0|1,0,0]=3 8557 B12R1.226 CC(COc1cccc(c1)N)C Amb1133931 [0,2,0,0,0,0|1,0,0]=3 8558 B12R1.226 CC(COc1cccc(c1)N)C Amb2140554 [0,2,0,0,0,0|1,0,0]=3 8559 B12R1.226 CC(Cl)CCc1cccc(F)c1 Amb19076401 [0,2,0,0,0,0|2,0,0]=4 8560 B12R1.226 CC(F)CCc1cccc(N)c1 Amb24610510 [0,2,0,0,0,0|2,0,0]=4 8561 B12R1.226 CC(F)CSc1cccc(N)c1 Amb25223187 [0,2,0,0,0,0|1,1,0]=4 8562 B12R1.226 CC(F)CSc1cccc(O)c1 Amb24694587 [0,2,0,0,0,0|1,1,0]=4 8563 B12R1.226 CC(N)CCc1cc(N)ccc1 Amb24424070 [0,2,0,0,0,0|2,0,0]=4 8564 B12R1.226 CC(N)CCc1cccc(I)c1 Amb25281897 [0,2,0,0,0,0|2,0,0]=4 8565 B12R1.226 CC(N)CCc1cccc(O)c1 Amb18828241 [0,2,0,0,0,0|2,0,0]=4 8566 B12R1.226 CC(N)CNc1cccc(Br)c1 Amb25674799 [0,2,0,0,0,0|2,0,0]=4 8567 B12R1.226 CC(N)COc1c[n]cc(Cl)c1 Amb24711203 [0,2,0,0,0,0|2,0,0]=4 8568 B12R1.226 CC(N)COc1c[n]cc(F)c1 Amb24739938 [0,2,0,0,0,0|2,0,0]=4 8569 B12R1.226 CC(N)COc1cccc(Cl)[n]1 Amb25856966 [0,2,0,0,0,0|2,0,0]=4 8570 B12R1.226 CC(N)COc1cccc(Cl)c1 Amb22642660 [0,2,0,0,0,0|1,0,0]=3 8571 B12R1.226 CC(N)COc1cccc(I)c1 Amb24441736 [0,2,0,0,0,0|1,0,0]=3 8572 B12R1.226 CC(N)CSc1cccc(Cl)c1 Amb18066336 [0,2,0,0,0,0|1,1,0]=4 8573 B12R1.226 CC(N)CSc1cccc(O)c1 Amb25179966 [0,2,0,0,0,0|1,1,0]=4 8574 B12R1.226 CC(O)CCc1cc(O)ccc1 Amb25251886 [0,2,0,0,0,0|1,0,0]=3 8575 B12R1.226 CC(O)CCc1cccc(Cl)c1 Amb19075161 [0,2,0,0,0,0|1,0,0]=3 8576 B12R1.226 CC(O)CCc1cccc(F)c1 Amb18805846 [0,2,0,0,0,0|1,0,0]=3 8577 B12R1.226 CC(O)CNc1cc(Br)cc[n]1 Amb25043498 [0,2,0,0,0,0|2,0,0]=4 8578 B12R1.226 CC(O)CNc1cc(F)cc[n]1 Amb24465837 [0,2,0,0,0,0|2,0,0]=4 8579 B12R1.226 CC(O)CNc1cc(N)cc[n]1 Amb18293572 [0,2,0,0,0,0|2,0,0]=4 8580 B12R1.226 CC(O)CNc1cccc(Br)[n]1 Amb24643479 [0,2,0,0,0,0|2,0,0]=4 8581 B12R1.226 CC(O)CNc1cccc(Cl)[n]1 Amb24401999 [0,2,0,0,0,0|2,0,0]=4 8582 B12R1.226 CC(O)CNc1cccc(F)[n]1 Amb18290677 [0,2,0,0,0,0|2,0,0]=4 8583 B12R1.226 CC(O)CNc1cccc(I)c1 Amb24463052 [0,2,0,0,0,0|1,0,0]=3 8584 B12R1.226 CC(O)COc1c[n]cc(Br)c1 Amb24368963 [0,2,0,0,0,0|1,0,0]=3 8585 B12R1.226 CC(O)COc1c[n]cc(F)c1 Amb25109424 [0,2,0,0,0,0|1,0,0]=3 8586 B12R1.226 CC(O)COc1cccc(F)c1 Amb18806456 [0,2,0,0,0,0|0,0,0]=2 8587 B12R1.226 CC(O)COc1cccc(I)c1 Amb24535405 [0,2,0,0,0,0|0,0,0]=2 8588 B12R1.226 CC(O)COc1cccc(N)c1 Amb18290032 [0,2,0,0,0,0|0,0,0]=2 8589 B12R1.226 CC(O)CSc1cc(O)ccc1 Amb24356234 [0,2,0,0,0,0|0,1,0]=3 8590 B12R1.226 CC(O)CSc1cccc(F)c1 Amb25698440 [0,2,0,0,0,0|0,1,0]=3 8591 B12R1.226 CC(O)\C=C\c1cc(O)ccc1 Amb25065736 [0,2,0,0,0,0|1,0,1]=4 8592 B12R1.226 CC(O)\C=C\c1cccc(Br)c1 Amb25098989 [0,2,0,0,0,0|1,0,1]=4 8593 B12R1.226 CC(O)\C=C\c1cccc(Cl)c1 Amb24590748 [0,2,0,0,0,0|1,0,1]=4 8594 B12R1.226 CC(O)\C=C\c1cccc(F)c1 Amb25730368 [0,2,0,0,0,0|1,0,1]=4 8595 B12R1.226 C[C@@H](COc1cccc(c1)Br)N Amb17248851 [0,2,0,0,0,0|1,0,0]=3 8596 B12R1.226 C[C@@H](COc1cccc(c1)C)N Amb17232558 [0,2,0,0,0,0|1,0,0]=3 8597 B12R1.226 C[C@@H](COc1cccc(c1)Cl)N Amb17234271 [0,2,0,0,0,0|1,0,0]=3 8598 B12R1.226 C[C@@H](COc1cccc(c1)F)N Amb17232707 [0,2,0,0,0,0|1,0,0]=3 8599 B12R1.226 C[C@@H](N)COc1cccc(Br)c1 Amb18036076 [0,2,0,0,0,0|1,0,0]=3 8600 B12R1.226 C[C@@H](N)COc1cccc(Cl)c1 Amb18538519 [0,2,0,0,0,0|1,0,0]=3 8601 B12R1.226 C[C@@H](N)COc1cccc(F)c1 Amb18538500 [0,2,0,0,0,0|1,0,0]=3 8602 B12R1.226 C[C@@H](N)CSc1cccc(Cl)c1 Amb25132468 [0,2,0,0,0,0|1,1,0]=4 8603 B12R1.226 C[C@@H](N)CSc1cccc(F)c1 Amb24354913 [0,2,0,0,0,0|1,1,0]=4 8604 B12R1.226 C[C@@H](O)CNc1cc[n]c(Cl)c1 Amb25711976 [0,2,0,0,0,0|2,0,0]=4 8605 B12R1.226 C[C@@H](O)CNc1cccc(Cl)[n]1 Amb25036595 [0,2,0,0,0,0|2,0,0]=4 8606 B12R1.226 C[C@@H](O)COc1c[n]cc(Cl)c1 Amb24704043 [0,2,0,0,0,0|1,0,0]=3 8607 B12R1.226 C[C@H](N)CCc1cccc(Br)c1 Amb24683805 [0,2,0,0,0,0|2,0,0]=4 8608 B12R1.226 C[C@H](O)CNc1cc(Br)cc[n]1 Amb25712641 [0,2,0,0,0,0|2,0,0]=4 8609 B12R1.226 C[C@H](O)CNc1cccc(Br)c1 Amb25373826 [0,2,0,0,0,0|1,0,0]=3 8610 B12R1.226 C[C@H](O)CNc1cccc(F)[n]1 Amb24388271 [0,2,0,0,0,0|2,0,0]=4 8611 B12R1.226 C[C@H](O)CNc1cccc(F)c1 Amb24708973 [0,2,0,0,0,0|1,0,0]=3 8612 B12R1.226 C[C@H](O)CNc1cccc(I)c1 Amb25717242 [0,2,0,0,0,0|1,0,0]=3 8613 B12R1.226 C[C@H](O)COc1c[n]cc(Br)c1 Amb25345851 [0,2,0,0,0,0|1,0,0]=3 8614 B12R1.226 C[C@H](O)COc1cccc(Cl)c1 Amb25037433 [0,2,0,0,0,0|0,0,0]=2 8615 B12R1.226 C[C@H](O)COc1cccc(F)c1 Amb24637453 [0,2,0,0,0,0|0,0,0]=2 8616 B12R1.226 Cc1cc(CCB(O)O)ccc1 Amb25790748 [0,2,0,0,0,0|2,0,0]=4 8617 B12R1.226 Cc1cc([n]cc1)OCC(O)=O Amb25154209 [0,2,0,0,0,0|1,0,1]=4 8618 B12R1.226 Cc1cc(cc[n]1)NC[C@@H](C)O Amb25296997 [0,2,0,0,0,0|2,0,0]=4 8619 B12R1.226 Cc1cc(cc[n]1)OCC(F)F Amb24372641 [0,2,0,0,0,0|2,0,0]=4 8620 B12R1.226 Cc1cc(cc[n]1)OCC(O)=O Amb24450470 [0,2,0,0,0,0|1,0,1]=4 8621 B12R1.226 Cc1cc(ccc1)NCC(F)F Amb18180317 [0,2,0,0,0,0|2,0,0]=4 8622 B12R1.226 Cc1cc(ccc1)OCC(=C)Br Amb25840777 [0,2,0,0,0,0|1,0,1]=4 8623 B12R1.226 Cc1cc(ccc1)OCC(=C)Cl Amb25281377 [0,2,0,0,0,0|1,0,1]=4 8624 B12R1.226 Cc1cc(ccc1)OCC(F)F Amb25077448 [0,2,0,0,0,0|1,0,0]=3 8625 B12R1.226 Cc1cc(ccc1)OCC(O)O Amb24618797 [0,2,0,0,0,0|0,0,0]=2 8626 B12R1.226 Cc1cc(ccc1)SCC(F)F Amb25160449 [0,2,0,0,0,0|1,1,0]=4 8627 B12R1.226 Cc1cc[n]c(c1)NCC(C)O Amb18293562 [0,2,0,0,0,0|2,0,0]=4 8628 B12R1.226 Cc1cc[n]c(c1)NC[C@@H](C)O Amb25160112 [0,2,0,0,0,0|2,0,0]=4 8629 B12R1.226 Cc1cccc(CCC(C)Br)c1 Amb25723537 [0,2,0,0,0,0|2,0,0]=4 8630 B12R1.226 Cc1cccc(CCC(C)Cl)c1 Amb18321700 [0,2,0,0,0,0|2,0,0]=4 8631 B12R1.226 Cc1cccc(CC[C@H](C)N)c1 Amb24682488 [0,2,0,0,0,0|2,0,0]=4 8632 B12R1.226 Cc1cccc(NCC(C)O)[n]1 Amb18972551 [0,2,0,0,0,0|2,0,0]=4 8633 B12R1.226 Cc1cccc(NC[C@H](C)O)[n]1 Amb24720567 [0,2,0,0,0,0|2,0,0]=4 8634 B12R1.226 Cc1cccc([n]1)OCC(C)O Amb22900273 [0,2,0,0,0,0|1,0,0]=3 8635 B12R1.226 Cc1cccc([n]1)OCC(F)F Amb25206554 [0,2,0,0,0,0|2,0,0]=4 8636 B12R1.226 Cc1cccc([n]1)OCC(O)=O Amb24389213 [0,2,0,0,0,0|1,0,1]=4 8637 B12R1.226 Cc1cccc(c1)C#CC(C)O Amb25303891 [0,2,0,0,0,0|1,0,1]=4 8638 B12R1.226 Cc1cccc(c1)C#C[C@H](C)O Amb24592401 [0,2,0,0,0,0|1,0,1]=4 8639 B12R1.226 Cc1cccc(c1)OCC(C)C Amb25375594 [0,2,0,0,0,0|1,0,0]=3 8640 B12R1.226 Cc1cccc(c1)OCC(C)Cl Amb24429171 [0,2,0,0,0,0|1,0,0]=3 8641 B12R1.226 Cc1cccc(c1)OCC(C)O Amb18182641 [0,2,0,0,0,0|0,0,0]=2 8642 B12R1.226 Cc1cccc(c1)OC[C@@H](C)N Amb18538492 [0,2,0,0,0,0|1,0,0]=3 8643 B12R1.226 Cc1cccc(c1)OC[C@@H](C)O Amb25123169 [0,2,0,0,0,0|0,0,0]=2 8644 B12R1.226 Cc1cccc(c1)OC[C@H](C)O Amb25270564 [0,2,0,0,0,0|0,0,0]=2 8645 B12R1.226 Cc1cccc(c1)SCC(C)N Amb18564187 [0,2,0,0,0,0|1,1,0]=4 8646 B12R1.226 Cc1cccc(c1)SCC(C)O Amb18318405 [0,2,0,0,0,0|0,1,0]=3 8647 B12R1.226 Cc1cccc(c1)SC[C@H](C)N Amb25112431 [0,2,0,0,0,0|1,1,0]=4 8648 B12R1.226 Cc1cccc(c1)\C=C\C(C)O Amb25683937 [0,2,0,0,0,0|1,0,1]=4 8649 B12R1.226 Cc1cccc(c1)\C=C\[C@@H](C)O Amb24404792 [0,2,0,0,0,0|1,0,1]=4 8650 B12R1.226 Cc1cccc(c1)\C=C\[C@H](C)O Amb25725509 [0,2,0,0,0,0|1,0,1]=4 8651 B12R1.226 ClC(=O)COc1cccc(c1)Br Amb16230149 [0,2,0,0,0,0|0,0,2]=4 8652 B12R1.226 ClC(=O)COc1cccc(c1)C Amb10880010 [0,2,0,0,0,0|0,0,2]=4 8653 B12R1.226 ClC(Cl)COc1cccc(I)c1 Amb24612554 [0,2,0,0,0,0|1,0,0]=3 8654 B12R1.226 FC(F)CNc1cccc(Br)c1 Amb25770279 [0,2,0,0,0,0|2,0,0]=4 8655 B12R1.226 FC(F)CNc1cccc(Cl)c1 Amb18320416 [0,2,0,0,0,0|2,0,0]=4 8656 B12R1.226 FC(F)CNc1cccc(I)c1 Amb24650609 [0,2,0,0,0,0|2,0,0]=4 8657 B12R1.226 FC(F)COc1c[n]cc(Br)c1 Amb25237251 [0,2,0,0,0,0|2,0,0]=4 8658 B12R1.226 FC(F)COc1cc[n]c(Cl)c1 Amb25041409 [0,2,0,0,0,0|2,0,0]=4 8659 B12R1.226 FC(F)COc1cccc(Br)c1 Amb19148821 [0,2,0,0,0,0|1,0,0]=3 8660 B12R1.226 FC(F)COc1cccc(Cl)[n]1 Amb25156660 [0,2,0,0,0,0|2,0,0]=4 8661 B12R1.226 FC(F)COc1cccc(I)c1 Amb24056922 [0,2,0,0,0,0|1,0,0]=3 8662 B12R1.226 FC(F)CSc1cccc(Br)c1 Amb22227888 [0,2,0,0,0,0|1,1,0]=4 8663 B12R1.226 FC(F)CSc1cccc(Cl)c1 Amb25295654 [0,2,0,0,0,0|1,1,0]=4 8664 B12R1.226 Fc1cccc(c1)NCC(F)F Amb18795534 [0,2,0,0,0,0|2,0,0]=4 8665 B12R1.226 NC(=O)COc1cccc(c1)Br Amb192032 [0,2,0,0,0,0|0,0,2]=4 8666 B12R1.226 NC(=O)COc1cccc(c1)I Amb181273 [0,2,0,0,0,0|0,0,2]=4 8667 B12R1.226 NC(=O)COc1cccc(c1)N Amb1112358 [0,2,0,0,0,0|0,0,2]=4 8668 B12R1.226 NC(=S)COc1cccc(c1)[*] Amb22043508 [0,2,0,0,0,0|0,1,1]=4 8669 B12R1.226 Nc1cc(CCC(F)F)ccc1 Amb25253012 [0,2,0,0,0,0|2,0,0]=4 8670 B12R1.226 Nc1cc([n]cc1)OCC(F)F Amb25054272 [0,2,0,0,0,0|2,0,0]=4 8671 B12R1.226 Nc1cc(ccc1)NCC(F)F Amb25216863 [0,2,0,0,0,0|2,0,0]=4 8672 B12R1.226 Nc1cc(ccc1)NCC(O)=O Amb18987711 [0,2,0,0,0,0|1,0,1]=4 8673 B12R1.226 Nc1cc(ccc1)SCC(O)=O Amb25700944 [0,2,0,0,0,0|0,1,1]=4 8674 B12R1.226 Nc1cccc([n]1)OCC(F)F Amb22157309 [0,2,0,0,0,0|2,0,0]=4 8675 B12R1.226 Nc1cccc(c1)OCC(N)=S Amb24439144 [0,2,0,0,0,0|0,1,1]=4 8676 B12R1.226 OB(O)CCc1cccc(F)c1 Amb24392487 [0,2,0,0,0,0|2,0,0]=4 8677 B12R1.226 OC(=O)CCc1cccc(c1)Br Amb1209216 [0,2,0,0,0,0|1,0,1]=4 8678 B12R1.226 OC(=O)CCc1cccc(c1)C Amb1106242 [0,2,0,0,0,0|1,0,1]=4 8679 B12R1.226 OC(=O)CCc1cccc(c1)Cl Amb1672952 [0,2,0,0,0,0|1,0,1]=4 8680 B12R1.226 OC(=O)CCc1cccc(c1)F Amb1091868 [0,2,0,0,0,0|1,0,1]=4 8681 B12R1.226 OC(=O)CCc1cccc(c1)I Amb16232982 [0,2,0,0,0,0|1,0,1]=4 8682 B12R1.226 OC(=O)CNc1cccc(F)c1 Amb19341704 [0,2,0,0,0,0|1,0,1]=4 8683 B12R1.226 OC(=O)CNc1cccc(c1)Cl Amb10609174 [0,2,0,0,0,0|1,0,1]=4 8684 B12R1.226 OC(=O)COc1c[n]cc(Br)c1 Amb24271218 [0,2,0,0,0,0|1,0,1]=4 8685 B12R1.226 OC(=O)COc1c[n]cc(F)c1 Amb25760871 [0,2,0,0,0,0|1,0,1]=4 8686 B12R1.226 OC(=O)COc1cc(Br)cc[n]1 Amb18660970 [0,2,0,0,0,0|1,0,1]=4 8687 B12R1.226 OC(=O)COc1cc[n]c(Br)c1 Amb18660965 [0,2,0,0,0,0|1,0,1]=4 8688 B12R1.226 OC(=O)COc1cc[n]c(Cl)c1 Amb25792389 [0,2,0,0,0,0|1,0,1]=4 8689 B12R1.226 OC(=O)COc1cccc(c1)Cl Amb1211231 [0,2,0,0,0,0|0,0,1]=3 8690 B12R1.226 OC(=O)COc1cccc(c1)F Amb1102803 [0,2,0,0,0,0|0,0,1]=3 8691 B12R1.226 OC(=O)CSc1cccc(F)c1 Amb19887452 [0,2,0,0,0,0|0,1,1]=4 8692 B12R1.226 OC(=O)CSc1cccc(c1)Br Amb2372547 [0,2,0,0,0,0|0,1,1]=4 8693 B12R1.226 Oc1cc(ccc1)OCC(F)F Amb18795192 [0,2,0,0,0,0|1,0,0]=3 8694 B12R1.226 Oc1cc(ccc1)SCC(F)F Amb24362099 [0,2,0,0,0,0|1,1,0]=4 8695 B12R1.382 BrCCCc1cccc(c1)OC Amb17104558 [0,2,0,0,0,0|2,0,0]=4 8696 B12R1.382 BrCCOc1cccc(c1)CC Amb1657338 [0,2,0,0,0,0|1,0,0]=3 8697 B12R1.382 C#CCOc1cc(CN)ccc1 Amb18969289 [0,2,0,0,0,0|1,0,1]=4 8698 B12R1.382 C#Cc1cc(c[n]c1)OCCN Amb24445474 [0,2,0,0,0,0|2,0,0]=4 8699 B12R1.382 C#Cc1cc(ccc1)NCCN Amb18251584 [0,2,0,0,0,0|2,0,0]=4 8700 B12R1.382 C#Cc1cccc(CCCO)c1 Amb24388502 [0,2,0,0,0,0|1,0,0]=3 8701 B12R1.382 C=CCOc1cc(ccc1)[Zn]Br Amb22897942 [0,2,0,0,0,0|1,0,1]=4 8702 B12R1.382 C=CCOc1cccc(c1)C=O Amb1227717 [0,2,0,0,0,0|1,0,1]=4 8703 B12R1.382 C=CCOc1cccc(c1)CN Amb16233827 [0,2,0,0,0,0|1,0,1]=4 8704 B12R1.382 CCCCc1cc(CN)ccc1 Amb22755129 [0,2,0,0,0,0|2,0,0]=4 8705 B12R1.382 CCCCc1cc(ccc1)C#N Amb19893374 [0,2,0,0,0,0|2,0,0]=4 8706 B12R1.382 CCCOc1c[n]cc(c1)NC Amb25126362 [0,2,0,0,0,0|2,0,0]=4 8707 B12R1.382 CCCOc1cc(C#C)[n]cc1 Amb24524938 [0,2,0,0,0,0|2,0,0]=4 8708 B12R1.382 CCCOc1cc(C#N)[n]cc1 Amb18788123 [0,2,0,0,0,0|2,0,0]=4 8709 B12R1.382 CCCOc1cc(NC)[n]cc1 Amb24342138 [0,2,0,0,0,0|2,0,0]=4 8710 B12R1.382 CCCOc1cc(NN)[n]cc1 Amb24699743 [0,2,0,0,0,0|2,0,0]=4 8711 B12R1.382 CCCOc1cc(ccc1)NC Amb19037542 [0,2,0,0,0,0|1,0,0]=3 8712 B12R1.382 CCCOc1cc(ccc1)[Zn]Br Amb22897961 [0,2,0,0,0,0|1,0,0]=3 8713 B12R1.382 CCCOc1cccc(C#C)[n]1 Amb24717122 [0,2,0,0,0,0|2,0,0]=4 8714 B12R1.382 CCCOc1cccc(NN)[n]1 Amb25770916 [0,2,0,0,0,0|2,0,0]=4 8715 B12R1.382 CCCOc1cccc(c1)CN Amb10201546 [0,2,0,0,0,0|1,0,0]=3 8716 B12R1.382 CCCOc1cccc(c1)CN Amb1135599 [0,2,0,0,0,0|1,0,0]=3 8717 B12R1.382 CCCOc1cccc(c1)NN Amb17232618 [0,2,0,0,0,0|1,0,0]=3 8718 B12R1.382 CCCSc1cc(ccc1)[Zn]Br Amb22897962 [0,2,0,0,0,0|1,1,0]=4 8719 B12R1.382 CCc1cc(ccc1)OCC#C Amb18800357 [0,2,0,0,0,0|1,0,1]=4 8720 B12R1.382 CCc1cc(ccc1)OCC=C Amb22266027 [0,2,0,0,0,0|1,0,1]=4 8721 B12R1.382 CCc1cccc(c1)C#CCO Amb25096891 [0,2,0,0,0,0|1,0,1]=4 8722 B12R1.382 CNc1c[n]cc(c1)NCCO Amb25090709 [0,2,0,0,0,0|2,0,0]=4 8723 B12R1.382 CNc1cc(c[n]c1)OCCO Amb24419132 [0,2,0,0,0,0|1,0,0]=3 8724 B12R1.382 CNc1cc(cc[n]1)NCCO Amb25118036 [0,2,0,0,0,0|2,0,0]=4 8725 B12R1.382 CNc1cc(cc[n]1)SCCO Amb24342139 [0,2,0,0,0,0|1,1,0]=4 8726 B12R1.382 CNc1cc(ccc1)OCC#N Amb18303216 [0,2,0,0,0,0|1,0,1]=4 8727 B12R1.382 CNc1cc(ccc1)OCC=C Amb23539741 [0,2,0,0,0,0|1,0,1]=4 8728 B12R1.382 COCOc1cc(C=O)ccc1 Amb22228997 [0,2,0,0,0,0|2,0,0]=4 8729 B12R1.382 COCOc1cc(ccc1)C#N Amb24485634 [0,2,0,0,0,0|2,0,0]=4 8730 B12R1.382 COc1cc(NCCO)[n]cc1 Amb24651088 [0,2,0,0,0,0|2,0,0]=4 8731 B12R1.382 COc1cc(ccc1)NCCF Amb24435276 [0,2,0,0,0,0|2,0,0]=4 8732 B12R1.382 COc1cc(ccc1)NCCS Amb25667359 [0,2,0,0,0,0|1,1,0]=4 8733 B12R1.382 COc1cccc(CCCN)c1 Amb19429208 [0,2,0,0,0,0|2,0,0]=4 8734 B12R1.382 COc1cccc(\C=C\CO)c1 Amb23442965 [0,2,0,0,0,0|1,0,1]=4 8735 B12R1.382 COc1cccc(c1)C#CCO Amb18180049 [0,2,0,0,0,0|1,0,1]=4 8736 B12R1.382 COc1cccc(c1)OCC#C Amb18800612 [0,2,0,0,0,0|1,0,1]=4 8737 B12R1.382 CSCOc1cc(ccc1)C#N Amb25286292 [0,2,0,0,0,0|2,0,0]=4 8738 B12R1.382 ClCCCc1cccc(c1)OC Amb17104532 [0,2,0,0,0,0|2,0,0]=4 8739 B12R1.382 ClCCNc1cccc(c1)C#N Amb17335461 [0,2,0,0,0,0|2,0,0]=4 8740 B12R1.382 ClCCNc1cccc(c1)OC Amb17335807 [0,2,0,0,0,0|2,0,0]=4 8741 B12R1.382 FCCOc1cc(CBr)ccc1 Amb23580156 [0,2,0,0,0,0|1,0,0]=3 8742 B12R1.382 N#Cc1c[n][n]c(c1)OCCO Amb24573416 [0,2,0,0,0,0|2,0,0]=4 8743 B12R1.382 N#Cc1cc(CCCO)cc[n]1 Amb25798409 [0,2,0,0,0,0|2,0,0]=4 8744 B12R1.382 N#Cc1cc([n]c[n]1)OCCO Amb25131600 [0,2,0,0,0,0|2,0,0]=4 8745 B12R1.382 N#Cc1cc(cc[n]1)NCCO Amb19000091 [0,2,0,0,0,0|2,0,0]=4 8746 B12R1.382 N#Cc1cc(cc[n]1)OCCO Amb18788264 [0,2,0,0,0,0|1,0,0]=3 8747 B12R1.382 N#Cc1cc(cc[n]1)SCCO Amb18791122 [0,2,0,0,0,0|1,1,0]=4 8748 B12R1.382 N#Cc1cc(ccc1)OCC=O Amb18800496 [0,2,0,0,0,0|0,0,2]=4 8749 B12R1.382 N#Cc1cc(ccc1)OCCF Amb23580158 [0,2,0,0,0,0|1,0,0]=3 8750 B12R1.382 N#Cc1cc[n]c([n]1)OCCO Amb25700218 [0,2,0,0,0,0|2,0,0]=4 8751 B12R1.382 N#Cc1cccc(CCCBr)c1 Amb25675608 [0,2,0,0,0,0|2,0,0]=4 8752 B12R1.382 N#Cc1cccc(CCCCl)c1 Amb25270450 [0,2,0,0,0,0|2,0,0]=4 8753 B12R1.382 N#Cc1cccc(\C=C\CO)c1 Amb18645175 [0,2,0,0,0,0|1,0,1]=4 8754 B12R1.382 NCCCc1cc(ccc1)C#N Amb25217817 [0,2,0,0,0,0|2,0,0]=4 8755 B12R1.382 NCCCc1cccc(c1)OC Amb1092531 [0,2,0,0,0,0|2,0,0]=4 8756 B12R1.382 NCCNc1cc(ccc1)C#N Amb18992217 [0,2,0,0,0,0|2,0,0]=4 8757 B12R1.382 NCCNc1cccc(c1)OC Amb17057754 [0,2,0,0,0,0|2,0,0]=4 8758 B12R1.382 NCCOc1cc(C#N)[n]cc1 Amb19000153 [0,2,0,0,0,0|2,0,0]=4 8759 B12R1.382 NCCOc1cc(CO)ccc1 Amb18182646 [0,2,0,0,0,0|1,0,0]=3 8760 B12R1.382 NCCOc1cc(cc[n]1)C#N Amb18296481 [0,2,0,0,0,0|2,0,0]=4 8761 B12R1.382 NCCOc1cccc(C#N)[n]1 Amb25358970 [0,2,0,0,0,0|2,0,0]=4 8762 B12R1.382 NCCOc1cccc(c1)C#N Amb17562051 [0,2,0,0,0,0|1,0,0]=3 8763 B12R1.382 NCCOc1cccc(c1)OC Amb1135524 [0,2,0,0,0,0|1,0,0]=3 8764 B12R1.382 NCc1cc(NCCO)[n]cc1 Amb19025121 [0,2,0,0,0,0|2,0,0]=4 8765 B12R1.382 NCc1cc(cc[n]1)NCCO Amb19034627 [0,2,0,0,0,0|2,0,0]=4 8766 B12R1.382 NCc1cc(ccc1)OCC#N Amb19373866 [0,2,0,0,0,0|1,0,1]=4 8767 B12R1.382 NCc1cc(ccc1)OCCF Amb23580157 [0,2,0,0,0,0|1,0,0]=3 8768 B12R1.382 NNc1[n]c(cc[n]1)OCCO Amb25678960 [0,2,0,0,0,0|2,0,0]=4 8769 B12R1.382 NNc1cc(cc[n]1)OCCO Amb24376376 [0,2,0,0,0,0|1,0,0]=3 8770 B12R1.382 NNc1cccc(NCCO)[n]1 Amb25694991 [0,2,0,0,0,0|2,0,0]=4 8771 B12R1.382 NNc1cccc([n]1)OCCO Amb24616697 [0,2,0,0,0,0|1,0,0]=3 8772 B12R1.382 NNc1cccc([n]1)SCCO Amb25823752 [0,2,0,0,0,0|1,1,0]=4 8773 B12R1.382 O=Cc1cc(ccc1)OCCF Amb23579958 [0,2,0,0,0,0|1,0,0]=3 8774 B12R1.382 OCC#Cc1cc(CO)ccc1 Amb18792414 [0,2,0,0,0,0|1,0,1]=4 8775 B12R1.382 OCCCc1cccc(c1)C#N Amb17605790 [0,2,0,0,0,0|1,0,0]=3 8776 B12R1.382 OCCCc1cccc(c1)OC Amb13883640 [0,2,0,0,0,0|1,0,0]=3 8777 B12R1.382 OCCOc1cccc(c1)OC Amb2209352 [0,2,0,0,0,0|0,0,0]=2 8778 B12R1.382 OCc1cc(ccc1)OCCF Amb23580003 [0,2,0,0,0,0|1,0,0]=3 8779 B12R1.382 SCCCc1cccc(c1)OC Amb17400950 [0,2,0,0,0,0|1,1,0]=4 8780 B12R1.382 SCCOc1cccc(c1)CC Amb17233942 [0,2,0,0,0,0|0,1,0]=3 8781 B12R1.8 BrCCCNCc1ccccc1 Amb18134994 [0,2,0,0,0,0|2,0,0]=4 8782 B12R1.8 Br[Zn]CCCOc1ccccc1 Amb22000474 [0,2,0,0,0,0|1,0,0]=3 8783 B12R1.8 C#CCNOCc1ccccc1 Amb25282219 [0,2,0,0,0,0|1,0,1]=4 8784 B12R1.8 C#CCONCc1ccccc1 Amb24444637 [0,2,0,0,0,0|1,0,1]=4 8785 B12R1.8 C=CCCCCc1ccccc1 Amb19930233 [0,2,0,0,0,0|2,0,0]=4 8786 B12R1.8 C=CCNCCc1ccccc1 Amb2119614 [0,2,0,0,0,0|2,0,0]=4 8787 B12R1.8 C=CCONCc1ccccc1 Amb24725564 [0,2,0,0,0,0|1,0,1]=4 8788 B12R1.8 CC#CCCOc1c[n]ccc1 Amb25266861 [0,2,0,0,0,0|2,0,0]=4 8789 B12R1.8 CCCCCOc1ccccc1 Amb1106330 [0,2,0,0,0,0|1,0,0]=3 8790 B12R1.8 CCCC\C=C/c1ccccc1 Amb22546625 [0,2,0,0,0,0|2,0,0]=4 8791 B12R1.8 CCCC\N=C\c1ccccc1 Amb20248424 [0,2,0,0,0,0|2,0,0]=4 8792 B12R1.8 CCCNCCc1ccccc1 Amb2119486 [0,2,0,0,0,0|2,0,0]=4 8793 B12R1.8 CCCN\C=C\c1ccccc1 Amb24565827 [0,2,0,0,0,0|2,0,0]=4 8794 B12R1.8 CCCONCc1ccccc1 Amb25031180 [0,2,0,0,0,0|1,0,0]=3 8795 B12R1.8 CCCO\N=C\c1c[n]ccc1 Amb24068837 [0,2,0,0,0,0|2,0,0]=4 8796 B12R1.8 CCC\C=C/Cc1ccccc1 Amb22546636 [0,2,0,0,0,0|2,0,0]=4 8797 B12R1.8 CCC\C=N\Cc1ccccc1 Amb10562392 [0,2,0,0,0,0|2,0,0]=4 8798 B12R1.8 CCNCC#Cc1ccccc1 Amb18800149 [0,2,0,0,0,0|2,0,0]=4 8799 B12R1.8 CCNCCCc1ccccc1 Amb2094490 [0,2,0,0,0,0|2,0,0]=4 8800 B12R1.8 CCNCCNc1ccccc1 Amb18792597 [0,2,0,0,0,0|2,0,0]=4 8801 B12R1.8 CCNCCOc1ccccc1 Amb2099717 [0,2,0,0,0,0|1,0,0]=3 8802 B12R1.8 CCNCCSc1ccccc1 Amb10608724 [0,2,0,0,0,0|1,1,0]=4 8803 B12R1.8 CCOCC#Cc1ccccc1 Amb24663302 [0,2,0,0,0,0|1,0,1]=4 8804 B12R1.8 CCOCCCc1ccccc1 Amb24063530 [0,2,0,0,0,0|1,0,0]=3 8805 B12R1.8 CCSCC#Cc1ccccc1 Amb25822151 [0,2,0,0,0,0|2,0,0]=4 8806 B12R1.8 CCSCCNc1ccccc1 Amb17307513 [0,2,0,0,0,0|1,1,0]=4 8807 B12R1.8 CC\C=N\OCc1ccccc1 Amb24395281 [0,2,0,0,0,0|1,0,1]=4 8808 B12R1.8 CNCCC#Cc1ccccc1 Amb19025186 [0,2,0,0,0,0|2,0,0]=4 8809 B12R1.8 CNCCCCc1ccccc1 Amb10068774 [0,2,0,0,0,0|2,0,0]=4 8810 B12R1.8 CNCCCNc1ccccc1 Amb13951704 [0,2,0,0,0,0|2,0,0]=4 8811 B12R1.8 CNCCCSc1ccccc1 Amb10608730 [0,2,0,0,0,0|1,1,0]=4 8812 B12R1.8 CNCCCSc1ccccc1 Amb22588097 [0,2,0,0,0,0|1,1,0]=4 8813 B12R1.8 CNCCOCc1ccccc1 Amb20668782 [0,2,0,0,0,0|1,0,0]=3 8814 B12R1.8 CNCCSCc1ccccc1 Amb18809641 [0,2,0,0,0,0|1,1,0]=4 8815 B12R1.8 COCCCNc1ccccc1 Amb17232551 [0,2,0,0,0,0|1,0,0]=3 8816 B12R1.8 COCCCOc1ccccc1 Amb23450364 [0,2,0,0,0,0|0,0,0]=2 8817 B12R1.8 COCCNCc1ccccn1 Amb1663439 [0,2,0,0,0,0|2,0,0]=4 8818 B12R1.8 COCCNCc1ccccn1 Amb17622505 [0,2,0,0,0,0|2,0,0]=4 8819 B12R1.8 CONCC#Cc1ccccc1 Amb25139183 [0,2,0,0,0,0|1,0,1]=4 8820 B12R1.8 CSCCNCc1ccccc1 Amb18187025 [0,2,0,0,0,0|1,1,0]=4 8821 B12R1.8 ClCC#CCNc1ccccc1 Amb24652633 [0,2,0,0,0,0|2,0,0]=4 8822 B12R1.8 ClCCCCCc1ccccc1 Amb10808064 [0,2,0,0,0,0|2,0,0]=4 8823 B12R1.8 ClCCCNCc1ccccc1 Amb10766327 [0,2,0,0,0,0|2,0,0]=4 8824 B12R1.8 ClCCO\N=C/c1cc[n]cc1 Amb22364487 [0,2,0,0,0,0|2,0,0]=4 8825 B12R1.8 ClCOCC#Cc1ccccc1 Amb25363282 [0,2,0,0,0,0|1,0,1]=4 8826 B12R1.8 Cl[Zn]CCCCc1ccccc1 Amb22897864 [0,2,0,0,0,0|2,0,0]=4 8827 B12R1.8 Cl\C=C/COCc1ccccc1 Amb24711309 [0,2,0,0,0,0|1,0,1]=4 8828 B12R1.8 FCCCSCc1ccccc1 Amb22008717 [0,2,0,0,0,0|1,1,0]=4 8829 B12R1.8 N#CCCCOc1cccc[n]1 Amb19374567 [0,2,0,0,0,0|2,0,0]=4 8830 B12R1.8 N#CCCNNc1ccccc1 Amb17594020 [0,2,0,0,0,0|2,0,0]=4 8831 B12R1.8 N#CCC\C=C\c1ccccc1 Amb18644947 [0,2,0,0,0,0|2,0,0]=4 8832 B12R1.8 NCCCC#Cc1ccccc1 Amb25803470 [0,2,0,0,0,0|2,0,0]=4 8833 B12R1.8 NCCCCCc1ccccc1 Amb18034503 [0,2,0,0,0,0|2,0,0]=4 8834 B12R1.8 NCCCNCc1ccccc1 Amb17720405 [0,2,0,0,0,0|2,0,0]=4 8835 B12R1.8 NCCCOCc1ccccc1 Amb1217769 [0,2,0,0,0,0|1,0,0]=3 8836 B12R1.8 NCCC\C=C\c1ccccc1 Amb18563531 [0,2,0,0,0,0|2,0,0]=4 8837 B12R1.8 NCCNCCc1ccccc1 Amb1086596 [0,2,0,0,0,0|2,0,0]=4 8838 B12R1.8 NCCNCCc1ccccc1 Amb22283881 [0,2,0,0,0,0|2,0,0]=4 8839 B12R1.8 NCCOCCc1ccccc1 Amb19374389 [0,2,0,0,0,0|1,0,0]=3 8840 B12R1.8 NC\C=C\CNc1ccccc1 Amb25046454 [0,2,0,0,0,0|2,0,0]=4 8841 B12R1.8 NNCCCOc1ccccc1 Amb19373220 [0,2,0,0,0,0|1,0,0]=3 8842 B12R1.8 NOCCOCc1ccccc1 Amb22896393 [0,2,0,0,0,0|0,0,0]=2 8843 B12R1.8 NOCC\C=C\c1ccccc1 Amb18563583 [0,2,0,0,0,0|1,0,0]=3 8844 B12R1.8 O=C=NCCOc1ccccc1 Amb13783673 [0,2,0,0,0,0|0,0,1]=3 8845 B12R1.8 O=CCCCCc1ccccc1 Amb18798121 [0,2,0,0,0,0|1,0,1]=4 8846 B12R1.8 O=CCCCOc1ccccc1 Amb18798283 [0,2,0,0,0,0|0,0,1]=3 8847 B12R1.8 O=CCOCCc1ccccc1 Amb18800786 [0,2,0,0,0,0|0,0,2]=4 8848 B12R1.8 O=CNCOCc1ccccc1 Amb24552397 [0,2,0,0,0,0|0,0,2]=4 8849 B12R1.8 O=COCCCc1ccccc1 Amb22229401 [0,2,0,0,0,0|1,0,0]=3 8850 B12R1.8 OCC#CC#Cc1ccccc1 Amb25714420 [0,2,0,0,0,0|1,0,1]=4 8851 B12R1.8 OCC#CCNc1ccccc1 Amb25758889 [0,2,0,0,0,0|1,0,0]=3 8852 B12R1.8 OCCC#CCc1cc[n]cc1 Amb25287671 [0,2,0,0,0,0|2,0,0]=4 8853 B12R1.8 OCCCC#Cc1cc[n]cc1 Amb24364350 [0,2,0,0,0,0|2,0,0]=4 8854 B12R1.8 OCCCC#Cc1ccccc1 Amb22730795 [0,2,0,0,0,0|1,0,0]=3 8855 B12R1.8 OCCCCCc1cccc[n]1 Amb23441163 [0,2,0,0,0,0|2,0,0]=4 8856 B12R1.8 OCCCNCc1cc[n]cc1 Amb22588118 [0,2,0,0,0,0|2,0,0]=4 8857 B12R1.8 OCCCNCc1ccccc1 Amb2221510 [0,2,0,0,0,0|1,0,0]=3 8858 B12R1.8 OCCCNCc1cccnc1 Amb2114454 [0,2,0,0,0,0|2,0,0]=4 8859 B12R1.8 OCCNCCc1cc[n]cc1 Amb22282674 [0,2,0,0,0,0|2,0,0]=4 8860 B12R1.8 OCCNCCc1cc[n]cc1 Amb22282814 [0,2,0,0,0,0|2,0,0]=4 8861 B12R1.8 OCCNCCc1ccccc1 Amb2119205 [0,2,0,0,0,0|1,0,0]=3 8862 B12R1.8 OCCNCCc1ccncc1 Amb1028249 [0,2,0,0,0,0|2,0,0]=4 8863 B12R1.8 OCCN\C=C\c1ccccc1 Amb25087866 [0,2,0,0,0,0|1,0,0]=3 8864 B12R1.8 OCCN\C=N\c1cccc[n]1 Amb25696101 [0,2,0,0,0,0|2,0,0]=4 8865 B12R1.8 OCCSCCc1ccccn1 Amb10608714 [0,2,0,0,0,0|1,1,0]=4 8866 B12R1.8 OCCSCCc1ccncc1 Amb15695449 [0,2,0,0,0,0|1,1,0]=4 8867 B12R1.8 OCC\C=N\Nc1ccccc1 Amb25846258 [0,2,0,0,0,0|1,0,0]=3 8868 B12R1.8 OCOCOCc1ccccc1 Amb25803238 [0,2,0,0,0,0|0,0,0]=2 8869 B12R1.8 OC\C=C\C#Cc1ccccc1 Amb17593957 [0,2,0,0,0,0|1,0,1]=4 8870 B12R1.8 OC\C=C\C=Cc1ccccc1 Amb24700798 [0,2,0,0,0,0|1,0,1]=4 8871 B12R1.8 O\C=C\NCCc1ccccc1 Amb24721604 [0,2,0,0,0,0|1,0,1]=4 8872 B12R1.8 S=C=NCCOc1ccccc1 Amb17233560 [0,2,0,0,0,0|0,1,0]=3 8873 B12R1.8 S=C=NCCSc1ccccc1 Amb2371165 [0,2,0,0,0,0|0,2,0]=4 8874 B12R1.8 SCCCNCc1ccccc1 Amb25751336 [0,2,0,0,0,0|1,1,0]=4 8875 B12R1.8 [N-]=[N+]=NCCCc1ccccc1 Amb10572439 [0,2,0,0,0,0|2,0,0]=4 8876 B12R1.27 C#CC(=O)COc1ccccc1 Amb24483847 [0,2,0,0,0,0|0,0,2]=4 8877 B12R1.27 C#CC(Cl)CCc1ccccc1 Amb25775006 [0,2,0,0,0,0|2,0,0]=4 8878 B12R1.27 C#CC(N)CCc1ccccc1 Amb25150966 [0,2,0,0,0,0|2,0,0]=4 8879 B12R1.27 C#CC(N)CSc1ccccc1 Amb24731339 [0,2,0,0,0,0|1,1,0]=4 8880 B12R1.27 C#CC(O)C#Cc1ccccc1 Amb24544056 [0,2,0,0,0,0|1,0,1]=4 8881 B12R1.27 C#CC(O)CCc1ccccc1 Amb25024201 [0,2,0,0,0,0|1,0,0]=3 8882 B12R1.27 C#CC(O)COc1ccccc1 Amb25686511 [0,2,0,0,0,0|0,0,0]=2 8883 B12R1.27 C#C[C@@H](O)COc1ccccc1 Amb25205027 [0,2,0,0,0,0|0,0,0]=2 8884 B12R1.27 C#C[C@@H](O)\C=C\c1ccccc1 Amb24592205 [0,2,0,0,0,0|1,0,1]=4 8885 B12R1.27 C#C[C@H](O)CCc1ccccc1 Amb25266374 [0,2,0,0,0,0|1,0,0]=3 8886 B12R1.27 C=C(CO)C#Cc1ccccc1 Amb24497788 [0,2,0,0,0,0|1,0,1]=4 8887 B12R1.27 C=C(CO)CNc1ccccc1 Amb24537817 [0,2,0,0,0,0|1,0,0]=3 8888 B12R1.27 C=C(COc1ccccc1)C#N Amb25739080 [0,2,0,0,0,0|1,0,1]=4 8889 B12R1.27 C=CC(O)CSc1ccccc1 Amb24273355 [0,2,0,0,0,0|0,1,0]=3 8890 B12R1.27 C=C[C@@H](O)C#Cc1ccccc1 Amb25817128 [0,2,0,0,0,0|1,0,1]=4 8891 B12R1.27 CC(C#C)OCc1ccccc1 Amb25208112 [0,2,0,0,0,0|1,0,1]=4 8892 B12R1.27 CC(C#N)OCc1ccccc1 Amb18797967 [0,2,0,0,0,0|1,0,1]=4 8893 B12R1.27 CC(C=O)OCc1ccccc1 Amb18646071 [0,2,0,0,0,0|0,0,2]=4 8894 B12R1.27 CC(C=O)ONc1ccccc1 Amb25239411 [0,2,0,0,0,0|0,0,2]=4 8895 B12R1.27 CC(CCc1ccccc1)NN Amb22445317 [0,2,0,0,0,0|2,0,0]=4 8896 B12R1.27 CC(CCl)CNc1ccccc1 Amb22756334 [0,2,0,0,0,0|2,0,0]=4 8897 B12R1.27 CC(CCl)OCc1ccccc1 Amb25257973 [0,2,0,0,0,0|1,0,0]=3 8898 B12R1.27 CC(CF)NCc1ccccc1 Amb24536598 [0,2,0,0,0,0|2,0,0]=4 8899 B12R1.27 CC(CN)CNc1ccccc1 Amb19027860 [0,2,0,0,0,0|2,0,0]=4 8900 B12R1.27 CC(CN)NCc1ccccc1 Amb18646179 [0,2,0,0,0,0|2,0,0]=4 8901 B12R1.27 CC(CN)OCc1ccccc1 Amb18312421 [0,2,0,0,0,0|1,0,0]=3 8902 B12R1.27 CC(CNc1ccccc1)C=C Amb25080486 [0,2,0,0,0,0|2,0,0]=4 8903 B12R1.27 CC(CNc1ccccc1)NN Amb18646401 [0,2,0,0,0,0|2,0,0]=4 8904 B12R1.27 CC(CO)C#Cc1ccccc1 Amb25071626 [0,2,0,0,0,0|1,0,0]=3 8905 B12R1.27 CC(CO)CNc1cc[n]cc1 Amb24364366 [0,2,0,0,0,0|2,0,0]=4 8906 B12R1.27 CC(CO)OCc1ccccc1 Amb25667474 [0,2,0,0,0,0|0,0,0]=2 8907 B12R1.27 CC(CO)\C=C\c1ccccc1 Amb25378732 [0,2,0,0,0,0|1,0,0]=3 8908 B12R1.27 CC(CO)\C=N\c1ccccc1 Amb20248421 [0,2,0,0,0,0|1,0,0]=3 8909 B12R1.27 CC(CO)\N=C\c1ccccc1 Amb25680631 [0,2,0,0,0,0|1,0,0]=3 8910 B12R1.27 CC(COc1ccccc1)NN Amb18563755 [0,2,0,0,0,0|1,0,0]=3 8911 B12R1.27 CCC(=C)CNc1ccccc1 Amb25093473 [0,2,0,0,0,0|2,0,0]=4 8912 B12R1.27 CCC(=O)O[Hg]c1ccccc1 Amb22359615 [0,2,0,0,0,0|1,0,1]=4 8913 B12R1.27 CCC(CCc1ccccc1)O Amb17138574 [0,2,0,0,0,0|1,0,0]=3 8914 B12R1.27 CCC(CNc1ccccc1)O Amb13952005 [0,2,0,0,0,0|1,0,0]=3 8915 B12R1.27 CCC(CSc1ccccc1)N Amb17485970 [0,2,0,0,0,0|1,1,0]=4 8916 B12R1.27 CCC(Cl)\C=C\c1ccccc1 Amb25210818 [0,2,0,0,0,0|2,0,0]=4 8917 B12R1.27 CCC(N)CNc1ccccc1 Amb19009674 [0,2,0,0,0,0|2,0,0]=4 8918 B12R1.27 CCC(N)COc1cccc[n]1 Amb22522748 [0,2,0,0,0,0|2,0,0]=4 8919 B12R1.27 CCC(N)COc1ccccc1 Amb19029691 [0,2,0,0,0,0|1,0,0]=3 8920 B12R1.27 CCC(O)CNc1cccc[n]1 Amb25350283 [0,2,0,0,0,0|2,0,0]=4 8921 B12R1.27 CCC(O)OCc1ccccc1 Amb25793622 [0,2,0,0,0,0|1,0,0]=3 8922 B12R1.27 CCC(O)\C=C\c1ccccc1 Amb22546605 [0,2,0,0,0,0|1,0,1]=4 8923 B12R1.27 CCC(O)\C=N\c1ccccc1 Amb25333476 [0,2,0,0,0,0|1,0,1]=4 8924 B12R1.27 CC[C@@H](O)C#Cc1ccccc1 Amb24525022 [0,2,0,0,0,0|1,0,1]=4 8925 B12R1.27 CC[C@@H](O)\C=C\c1ccccc1 Amb25320497 [0,2,0,0,0,0|1,0,1]=4 8926 B12R1.27 CC[C@H](C)CNc1ccccc1 Amb25843960 [0,2,0,0,0,0|2,0,0]=4 8927 B12R1.27 CC[C@H](O)CNc1cc[n]cc1 Amb24372478 [0,2,0,0,0,0|2,0,0]=4 8928 B12R1.27 CC[C@H](O)CNc1cccc[n]1 Amb24364763 [0,2,0,0,0,0|2,0,0]=4 8929 B12R1.27 CNC(=N)COc1ccccc1 Amb25336063 [0,2,0,0,0,0|1,0,1]=4 8930 B12R1.27 CNC(C)CNc1ccccc1 Amb18312626 [0,2,0,0,0,0|2,0,0]=4 8931 B12R1.27 CNC(CCc1ccccc1)C Amb1138722 [0,2,0,0,0,0|2,0,0]=4 8932 B12R1.27 COC(=N)CNc1ccccc1 Amb24597022 [0,2,0,0,0,0|1,0,1]=4 8933 B12R1.27 COC(=N)COc1ccccc1 Amb18798404 [0,2,0,0,0,0|0,0,1]=3 8934 B12R1.27 COC(=O)COc1cccc[n]1 Amb24095859 [0,2,0,0,0,0|1,0,1]=4 8935 B12R1.27 COC(C)CNc1c[n]ccc1 Amb25359695 [0,2,0,0,0,0|2,0,0]=4 8936 B12R1.27 COC(C)CNc1cccc[n]1 Amb25689750 [0,2,0,0,0,0|2,0,0]=4 8937 B12R1.27 COC(C)CNc1ccccc1 Amb19025483 [0,2,0,0,0,0|1,0,0]=3 8938 B12R1.27 CSC(C)CNc1ccccc1 Amb18312645 [0,2,0,0,0,0|1,1,0]=4 8939 B12R1.27 C[C@@H](C=O)ONc1ccccc1 Amb25701904 [0,2,0,0,0,0|0,0,2]=4 8940 B12R1.27 C[C@@H](CCl)OCc1ccccc1 Amb25320908 [0,2,0,0,0,0|1,0,0]=3 8941 B12R1.27 C[C@@H](CN)NCc1ccccc1 Amb24396541 [0,2,0,0,0,0|2,0,0]=4 8942 B12R1.27 C[C@@H](CO)NCc1ccccc1 Amb19301927 [0,2,0,0,0,0|1,0,0]=3 8943 B12R1.27 C[C@@H](CO)\C=C\c1ccccc1 Amb25127764 [0,2,0,0,0,0|1,0,0]=3 8944 B12R1.27 C[C@H](C=O)OCc1ccccc1 Amb25326165 [0,2,0,0,0,0|0,0,2]=4 8945 B12R1.27 C[C@H](CO)NCc1ccccc1 Amb19375302 [0,2,0,0,0,0|1,0,0]=3 8946 B12R1.27 C[C@H](CO)OCc1ccccc1 Amb25694316 [0,2,0,0,0,0|0,0,0]=2 8947 B12R1.27 C[C@H](CO)ONc1ccccc1 Amb24625280 [0,2,0,0,0,0|0,0,0]=2 8948 B12R1.27 C[C@H](CO)\N=C\c1ccccc1 Amb25048456 [0,2,0,0,0,0|1,0,0]=3 8949 B12R1.27 C\C(\CCc1ccccc1)=N\O Amb24638706 [0,2,0,0,0,0|1,0,1]=4 8950 B12R1.27 C\C(\CO)=N\Nc1ccccc1 Amb24619168 [0,2,0,0,0,0|1,0,1]=4 8951 B12R1.27 C\C(\COc1ccccc1)=C\Cl Amb25241242 [0,2,0,0,0,0|1,0,1]=4 8952 B12R1.27 ClCC(=O)CCc1ccccc1 Amb17139043 [0,2,0,0,0,0|2,0,0]=4 8953 B12R1.27 ClCC(=O)COc1ccccc1 Amb17139095 [0,2,0,0,0,0|1,0,0]=3 8954 B12R1.27 ClCC(CNc1ccccc1)O Amb10565986 [0,2,0,0,0,0|1,0,0]=3 8955 B12R1.27 ClCC(Cl)OCc1ccccc1 Amb25139547 [0,2,0,0,0,0|1,0,0]=3 8956 B12R1.27 ClCC(Cl)\C=C\c1ccccc1 Amb25124868 [0,2,0,0,0,0|2,0,0]=4 8957 B12R1.27 N#CC(Cl)CCc1ccccc1 Amb18791084 [0,2,0,0,0,0|2,0,0]=4 8958 B12R1.27 N#CC(Cl)CNc1ccccc1 Amb18648453 [0,2,0,0,0,0|2,0,0]=4 8959 B12R1.27 N#CC(Cl)CSc1ccccc1 Amb18130442 [0,2,0,0,0,0|1,1,0]=4 8960 B12R1.27 N#CC(O)CCc1cccc[n]1 Amb25284586 [0,2,0,0,0,0|2,0,0]=4 8961 B12R1.27 N#CC(O)CCc1ccccc1 Amb18177732 [0,2,0,0,0,0|1,0,0]=3 8962 B12R1.27 N#CC(O)CNc1cccc[n]1 Amb25035185 [0,2,0,0,0,0|2,0,0]=4 8963 B12R1.27 N#CC(O)CSc1ccccc1 Amb25051459 [0,2,0,0,0,0|0,1,0]=3 8964 B12R1.27 N#C[C@@H](O)CCc1ccccc1 Amb25073440 [0,2,0,0,0,0|1,0,0]=3 8965 B12R1.27 N#C[C@@H](O)COc1ccccc1 Amb24474239 [0,2,0,0,0,0|0,0,0]=2 8966 B12R1.27 N#C[C@@H](O)\C=C\c1ccccc1 Amb24581221 [0,2,0,0,0,0|1,0,1]=4 8967 B12R1.27 N#C[C@H](O)CCc1ccccc1 Amb24344695 [0,2,0,0,0,0|1,0,0]=3 8968 B12R1.27 N#C[C@H](O)\C=C\c1ccccc1 Amb25371981 [0,2,0,0,0,0|1,0,1]=4 8969 B12R1.27 NC(C#N)COc1ccccc1 Amb17076555 [0,2,0,0,0,0|1,0,0]=3 8970 B12R1.27 NC(CCc1ccccc1)C#N Amb18999188 [0,2,0,0,0,0|2,0,0]=4 8971 B12R1.27 NC(CO)C#Cc1ccccc1 Amb25667614 [0,2,0,0,0,0|1,0,0]=3 8972 B12R1.27 NC(CO)CCc1c[n]ccc1 Amb18563730 [0,2,0,0,0,0|2,0,0]=4 8973 B12R1.27 NC(CO)CCc1cc[n]cc1 Amb18563732 [0,2,0,0,0,0|2,0,0]=4 8974 B12R1.27 NC(CO)CCc1cccc[n]1 Amb18563729 [0,2,0,0,0,0|2,0,0]=4 8975 B12R1.27 NC(CO)CNc1cc[n]cc1 Amb24570958 [0,2,0,0,0,0|2,0,0]=4 8976 B12R1.27 NC(CO)CNc1ccccc1 Amb25674165 [0,2,0,0,0,0|1,0,0]=3 8977 B12R1.27 NC(CO)COc1ccccc1 Amb18563798 [0,2,0,0,0,0|0,0,0]=2 8978 B12R1.27 NC(CO)\C=C\c1ccccc1 Amb25201509 [0,2,0,0,0,0|1,0,0]=3 8979 B12R1.27 NC(COc1ccccc1)=NN Amb18788366 [0,2,0,0,0,0|1,0,1]=4 8980 B12R1.27 NC(CSc1ccccc1)C#N Amb18984305 [0,2,0,0,0,0|1,1,0]=4 8981 B12R1.27 NCC(=O)CCc1ccccc1 Amb18563587 [0,2,0,0,0,0|2,0,0]=4 8982 B12R1.27 NCC(=O)OCc1ccccc1 Amb1207685 [0,2,0,0,0,0|1,0,1]=4 8983 B12R1.27 NCC(=O)OCc1ccccc1 Amb1808695 [0,2,0,0,0,0|1,0,1]=4 8984 B12R1.27 NCC(=O)OCc1ccccc1 Amb2228429 [0,2,0,0,0,0|1,0,1]=4 8985 B12R1.27 NCC(CNc1ccccc1)O Amb17138613 [0,2,0,0,0,0|1,0,0]=3 8986 B12R1.27 NCC(COc1ccccc1)O Amb1139174 [0,2,0,0,0,0|0,0,0]=2 8987 B12R1.27 NCC(F)C#Cc1ccccc1 Amb24470253 [0,2,0,0,0,0|2,0,0]=4 8988 B12R1.27 NCC(N)\C=C\c1ccccc1 Amb24678472 [0,2,0,0,0,0|2,0,0]=4 8989 B12R1.27 NCC(O)C#Cc1ccccc1 Amb24677996 [0,2,0,0,0,0|1,0,1]=4 8990 B12R1.27 NCC(O)CNc1cc[n]cc1 Amb24752893 [0,2,0,0,0,0|2,0,0]=4 8991 B12R1.27 NCC(O)\C=C\c1ccccc1 Amb18126377 [0,2,0,0,0,0|1,0,1]=4 8992 B12R1.27 NC[C@@H](O)COc1ccccc1 Amb22747719 [0,2,0,0,0,0|0,0,0]=2 8993 B12R1.27 N[C@@H](CO)\C=C\c1ccccc1 Amb24565958 [0,2,0,0,0,0|1,0,0]=3 8994 B12R1.27 N\C(\CCc1ccccc1)=N\O Amb22053006 [0,2,0,0,0,0|1,0,1]=4 8995 B12R1.27 N\C(\CNc1ccccc1)=N\O Amb24614329 [0,2,0,0,0,0|1,0,1]=4 8996 B12R1.27 O=C(CBr)CCc1ccccc1 Amb20171375 [0,2,0,0,0,0|2,0,0]=4 8997 B12R1.27 O=C(CBr)COc1ccccc1 Amb20668077 [0,2,0,0,0,0|1,0,0]=3 8998 B12R1.27 O=C(CI)OCc1ccccc1 Amb25144488 [0,2,0,0,0,0|1,0,1]=4 8999 B12R1.27 O=CC(CSc1ccccc1)C Amb17594629 [0,2,0,0,0,0|0,1,1]=4 9000 B12R1.27 O=C[C@@H](OCc1ccccc1)C Amb17609288 [0,2,0,0,0,0|0,0,2]=4 9001 B12R1.27 OC(C=O)C#Cc1ccccc1 Amb25375035 [0,2,0,0,0,0|1,0,1]=4 9002 B12R1.27 OC(CF)C#Cc1ccccc1 Amb25157858 [0,2,0,0,0,0|1,0,1]=4 9003 B12R1.27 OC(CF)\C=C\c1ccccc1 Amb25284420 [0,2,0,0,0,0|1,0,1]=4 9004 B12R1.27 OCC(=O)C#Cc1ccccc1 Amb25094460 [0,2,0,0,0,0|1,0,1]=4 9005 B12R1.27 OCC(=O)CCc1cc[n]cc1 Amb18563675 [0,2,0,0,0,0|2,0,0]=4 9006 B12R1.27 OCC(=O)CCc1ccc[n]c1 Amb18563674 [0,2,0,0,0,0|2,0,0]=4 9007 B12R1.27 OCC(=O)CCc1cccc[n]1 Amb18563673 [0,2,0,0,0,0|2,0,0]=4 9008 B12R1.27 OCC(=O)CCc1ccccc1 Amb18563609 [0,2,0,0,0,0|1,0,0]=3 9009 B12R1.27 OCC(=O)COc1ccccc1 Amb18563713 [0,2,0,0,0,0|0,0,0]=2 9010 B12R1.27 OCC(=O)NCc1ccccc1 Amb1111331 [0,2,0,0,0,0|1,0,1]=4 9011 B12R1.27 OCC(=O)\C=C\c1ccccc1 Amb25142729 [0,2,0,0,0,0|1,0,1]=4 9012 B12R1.27 OCC(CNc1ccccc1)O Amb17307124 [0,2,0,0,0,0|1,0,0]=3 9013 B12R1.27 OCC(COc1ccccc1)C Amb17232599 [0,2,0,0,0,0|0,0,0]=2 9014 B12R1.27 OCC(CSc1ccccc1)Cl Amb10553704 [0,2,0,0,0,0|0,1,0]=3 9015 B12R1.27 OCC(Cl)\C=C\c1ccccc1 Amb24711501 [0,2,0,0,0,0|1,0,0]=3 9016 B12R1.27 OCC(F)C#Cc1ccccc1 Amb25157406 [0,2,0,0,0,0|1,0,0]=3 9017 B12R1.27 OCC(O)CSc1cccc[n]1 Amb21978181 [0,2,0,0,0,0|1,1,0]=4 9018 B12R1.27 OCC(O)\C=C\c1ccccc1 Amb24496400 [0,2,0,0,0,0|1,0,0]=3 9019 B12R1.27 OC[C@@H](COc1ccccc1)O Amb10982588 [0,2,0,0,0,0|0,0,0]=2 9020 B12R1.27 OC[C@@H](O)CNc1ccccc1 Amb18792912 [0,2,0,0,0,0|1,0,0]=3 9021 B12R1.27 OC[C@@H](O)\C=C\c1ccccc1 Amb24371109 [0,2,0,0,0,0|1,0,0]=3 9022 B12R1.27 OC[C@@H](OCc1ccccc1)C Amb17609287 [0,2,0,0,0,0|0,0,0]=2 9023 B12R1.27 OC\C(=C/Cc1ccccc1)\C Amb17594048 [0,2,0,0,0,0|1,0,1]=4 9024 B12R1.27 OC\C(\F)=C\Cc1ccccc1 Amb24661184 [0,2,0,0,0,0|1,0,1]=4 9025 B12R1.27 ONC(=O)OCc1ccccc1 Amb2445312 [0,2,0,0,0,0|1,0,1]=4 9026 B12R1.27 O[C@@H](CCl)C#Cc1ccccc1 Amb24429084 [0,2,0,0,0,0|1,0,1]=4 9027 B12R1.27 O[C@@H](CF)C#Cc1ccccc1 Amb24370047 [0,2,0,0,0,0|1,0,1]=4 9028 B12R1.27 O[C@H](CCl)C#Cc1ccccc1 Amb25216902 [0,2,0,0,0,0|1,0,1]=4 9029 B12R1.27 O[C@H](CCl)CNc1ccccc1 Amb24426200 [0,2,0,0,0,0|1,0,0]=3 9030 B12R1.27 O[C@H](CCl)\C=C\c1ccccc1 Amb24565740 [0,2,0,0,0,0|1,0,1]=4 9031 B12R1.27 O[C@H](CF)C#Cc1ccccc1 Amb25769474 [0,2,0,0,0,0|1,0,1]=4 9032 B12R1.27 O[C@H](CF)\C=C\c1ccccc1 Amb24497699 [0,2,0,0,0,0|1,0,1]=4 9033 B12R1.27 O\N=C(\CCc1ccccc1)/N Amb1115853 [0,2,0,0,0,0|1,0,1]=4 9034 B12R1.27 O\N=C(\COc1ccccc1)/N Amb1154723 [0,2,0,0,0,0|0,0,1]=3 9035 B12R1.32 BrCCC(=O)Nc1ccccc1 Amb16191990 [0,2,0,0,0,0|2,0,0]=4 9036 B12R1.32 BrCCC(Br)Cc1ccccc1 Amb23456171 [0,2,0,0,0,0|2,0,0]=4 9037 B12R1.32 C#CCC(N)Cc1ccccc1 Amb18296094 [0,2,0,0,0,0|2,0,0]=4 9038 B12R1.32 C#CCC(O)Cc1ccccc1 Amb18800362 [0,2,0,0,0,0|2,0,0]=4 9039 B12R1.32 C#CC[C@@H](O)Cc1ccccc1 Amb24497745 [0,2,0,0,0,0|2,0,0]=4 9040 B12R1.32 C=CCC(N)Cc1ccccc1 Amb19015820 [0,2,0,0,0,0|2,0,0]=4 9041 B12R1.32 CC#C[C@@H](C)Oc1ccccc1 Amb24068913 [0,2,0,0,0,0|1,0,1]=4 9042 B12R1.32 CC(CC#N)Sc1ccccc1 Amb18795942 [0,2,0,0,0,0|1,1,0]=4 9043 B12R1.32 CC(CCO)Nc1c[n]ccc1 Amb25153319 [0,2,0,0,0,0|2,0,0]=4 9044 B12R1.32 CC(CNN)Nc1ccccc1 Amb18646400 [0,2,0,0,0,0|2,0,0]=4 9045 B12R1.32 CC(CNN)Oc1ccccc1 Amb18563756 [0,2,0,0,0,0|1,0,0]=3 9046 B12R1.32 CC(Nc1ccccc1)CC#N Amb17138511 [0,2,0,0,0,0|2,0,0]=4 9047 B12R1.32 CC(Oc1ccccc1)CC#N Amb17232369 [0,2,0,0,0,0|1,0,0]=3 9048 B12R1.32 CCCC(=N)Nc1ccccc1 Amb24096810 [0,2,0,0,0,0|2,0,0]=4 9049 B12R1.32 CCCC(C)Cc1ccccc1 Amb22224920 [0,2,0,0,0,0|2,0,0]=4 9050 B12R1.32 CCCC(Cc1ccccc1)[NH3+] Amb10560244 [0,2,0,0,0,0|2,0,0]=4 9051 B12R1.32 CCCC(N)Cc1ccccc1 Amb18180073 [0,2,0,0,0,0|2,0,0]=4 9052 B12R1.32 CCC\C(\I)=C/c1ccccc1 Amb22546627 [0,2,0,0,0,0|2,0,0]=4 9053 B12R1.32 CCNC(C)Cc1ccccc1 Amb18552940 [0,2,0,0,0,0|2,0,0]=4 9054 B12R1.32 CCNC(C)Cc1ccccc1 Amb22055190 [0,2,0,0,0,0|2,0,0]=4 9055 B12R1.32 CCSC(C)Nc1ccccc1 Amb24585828 [0,2,0,0,0,0|2,0,0]=4 9056 B12R1.32 CN(CCBr)Cc1ccccc1 Amb24357900 [0,2,0,0,0,0|2,0,0]=4 9057 B12R1.32 CN(CCCl)Cc1ccccc1 Amb19895292 [0,2,0,0,0,0|2,0,0]=4 9058 B12R1.32 CN(CCF)Cc1ccccc1 Amb25318241 [0,2,0,0,0,0|2,0,0]=4 9059 B12R1.32 CN(CCI)Cc1ccccc1 Amb25235494 [0,2,0,0,0,0|2,0,0]=4 9060 B12R1.32 CNCC(C)Oc1ccccc1 Amb19025044 [0,2,0,0,0,0|1,0,0]=3 9061 B12R1.32 CNCC(Cc1ccccc1)O Amb17193901 [0,2,0,0,0,0|2,0,0]=4 9062 B12R1.32 CNCC(N)Cc1ccccc1 Amb19009730 [0,2,0,0,0,0|2,0,0]=4 9063 B12R1.32 COCC(C)Nc1c[n]ccc1 Amb19024143 [0,2,0,0,0,0|2,0,0]=4 9064 B12R1.32 COCC(C)Nc1ccccc1 Amb19024307 [0,2,0,0,0,0|1,0,0]=3 9065 B12R1.32 COCC(N)Cc1ccccc1 Amb20623561 [0,2,0,0,0,0|1,0,0]=3 9066 B12R1.32 COC[C@@H](C)Nc1cc[n]cc1 Amb25220804 [0,2,0,0,0,0|2,0,0]=4 9067 B12R1.32 CONC(=O)Oc1ccccc1 Amb16969957 [0,2,0,0,0,0|1,0,1]=4 9068 B12R1.32 CSCC(C)Nc1ccccc1 Amb25674366 [0,2,0,0,0,0|1,1,0]=4 9069 B12R1.32 C[C@@H](CC#N)Nc1ccccc1 Amb25301483 [0,2,0,0,0,0|2,0,0]=4 9070 B12R1.32 C[C@@H](CCO)Nc1cccc[n]1 Amb24722354 [0,2,0,0,0,0|2,0,0]=4 9071 B12R1.32 C[C@@H](CCO)Nc1ccccc1 Amb25124401 [0,2,0,0,0,0|1,0,0]=3 9072 B12R1.32 C[C@H](CC#N)Nc1ccccc1 Amb24459585 [0,2,0,0,0,0|2,0,0]=4 9073 B12R1.32 C[C@H](CCO)Nc1cc[n]cc1 Amb24722224 [0,2,0,0,0,0|2,0,0]=4 9074 B12R1.32 C[C@H](CCO)Nc1cccc[n]1 Amb25160516 [0,2,0,0,0,0|2,0,0]=4 9075 B12R1.32 C[C@H](CCO)Nc1ccccc1 Amb25324766 [0,2,0,0,0,0|1,0,0]=3 9076 B12R1.32 C\C(\CCBr)=C/c1ccccc1 Amb18063581 [0,2,0,0,0,0|2,0,0]=4 9077 B12R1.32 C\C(\CCN)=C/c1ccccc1 Amb18063553 [0,2,0,0,0,0|2,0,0]=4 9078 B12R1.32 C\C(\CCO)=C\c1ccccc1 Amb24576953 [0,2,0,0,0,0|1,0,0]=3 9079 B12R1.32 ClCCC(=O)Oc1ccccc1 Amb16230794 [0,2,0,0,0,0|1,0,0]=3 9080 B12R1.32 N#CCC(=O)Oc1ccccc1 Amb18645449 [0,2,0,0,0,0|1,0,1]=4 9081 B12R1.32 N#CCC(Cl)Sc1ccccc1 Amb24373160 [0,2,0,0,0,0|1,1,0]=4 9082 B12R1.32 N#CCC(F)Cc1ccccc1 Amb25079148 [0,2,0,0,0,0|2,0,0]=4 9083 B12R1.32 N#CC[C@H](O)Cc1ccccc1 Amb24386953 [0,2,0,0,0,0|2,0,0]=4 9084 B12R1.32 NCCC(=O)Nc1ccccc1 Amb1125528 [0,2,0,0,0,0|2,0,0]=4 9085 B12R1.32 NCCC(=O)Nc1ccccc1 Amb15740909 [0,2,0,0,0,0|2,0,0]=4 9086 B12R1.32 NCCC(=O)Oc1ccccc1 Amb17334633 [0,2,0,0,0,0|1,0,0]=3 9087 B12R1.32 NCCC(Cc1ccccc1)C Amb17232439 [0,2,0,0,0,0|2,0,0]=4 9088 B12R1.32 NCCC(Cc1ccccc1)O Amb17232552 [0,2,0,0,0,0|2,0,0]=4 9089 B12R1.32 NCCC(Oc1ccccc1)C Amb17232556 [0,2,0,0,0,0|1,0,0]=3 9090 B12R1.32 NCCS(=O)Cc1ccccc1 Amb18306046 [0,2,0,0,0,0|1,1,0]=4 9091 B12R1.32 NN(CCO)Cc1ccccc1 Amb18646608 [0,2,0,0,0,0|1,0,0]=3 9092 B12R1.32 NOCC(=O)Nc1ccccc1 Amb24596278 [0,2,0,0,0,0|1,0,1]=4 9093 B12R1.32 NOCC(=O)Oc1ccccc1 Amb24096859 [0,2,0,0,0,0|0,0,1]=3 9094 B12R1.32 N[C@@H](CC#N)Cc1ccccc1 Amb24483888 [0,2,0,0,0,0|2,0,0]=4 9095 B12R1.32 O=C(CCF)Nc1ccccc1 Amb25276540 [0,2,0,0,0,0|2,0,0]=4 9096 B12R1.32 O=C(CCI)Nc1ccccc1 Amb23447340 [0,2,0,0,0,0|2,0,0]=4 9097 B12R1.32 OC(CCCl)Nc1ccccc1 Amb24635759 [0,2,0,0,0,0|2,0,0]=4 9098 B12R1.32 OC(Cc1ccccc1)CC#N Amb17232368 [0,2,0,0,0,0|2,0,0]=4 9099 B12R1.32 OCCC(Cc1ccccc1)C Amb17232486 [0,2,0,0,0,0|1,0,0]=3 9100 B12R1.32 OCCC(O)Cc1ccccc1 Amb22491209 [0,2,0,0,0,0|1,0,0]=3 9101 B12R1.32 OCCC(O)Nc1ccccc1 Amb25060097 [0,2,0,0,0,0|1,0,0]=3 9102 B12R1.32 OCCC(Oc1ccccc1)C Amb17232598 [0,2,0,0,0,0|0,0,0]=2 9103 B12R1.32 OCCN(O)Cc1ccccc1 Amb25284514 [0,2,0,0,0,0|1,0,0]=3 9104 B12R1.32 OCNC(=O)Oc1ccccc1 Amb10552983 [0,2,0,0,0,0|0,0,1]=3 9105 B12R1.32 ONCC(=O)Nc1ccccc1 Amb24495972 [0,2,0,0,0,0|1,0,1]=4 9106 B12R1.32 O\N=C\C(O)Cc1ccccc1 Amb25136306 [0,2,0,0,0,0|1,0,1]=4 9107 B12R1.32 SCCC(=O)Nc1ccccc1 Amb17305724 [0,2,0,0,0,0|1,1,0]=4 9108 B12R1.32 SCCN(Cc1ccccc1)C Amb13881720 [0,2,0,0,0,0|1,1,0]=4 9109 B12R1.32 [BH3]N(CCC)Cc1ccccc1 Amb24678772 [0,2,0,0,0,0|2,0,0]=4 9110 B12R1.252 C=C(Br)COCc1ccccc1 Amb25305709 [0,2,0,0,0,0|1,0,1]=4 9111 B12R1.252 CC(=C)CCNc1ccccc1 Amb25771824 [0,2,0,0,0,0|2,0,0]=4 9112 B12R1.252 CC(Br)CCSc1ccccc1 Amb20623511 [0,2,0,0,0,0|1,1,0]=4 9113 B12R1.252 CC(C)CCCc1ccccc1 Amb24063684 [0,2,0,0,0,0|2,0,0]=4 9114 B12R1.252 CC(C)CCOc1ccccc1 Amb23450363 [0,2,0,0,0,0|1,0,0]=3 9115 B12R1.252 CC(C)CNCc1ccccc1 Amb22586944 [0,2,0,0,0,0|2,0,0]=4 9116 B12R1.252 CC(C)NOCc1ccccc1 Amb24407142 [0,2,0,0,0,0|2,0,0]=4 9117 B12R1.252 CC(CCCc1ccccc1)Cl Amb17477428 [0,2,0,0,0,0|2,0,0]=4 9118 B12R1.252 CC(CCCc1ccccc1)O Amb17138575 [0,2,0,0,0,0|1,0,0]=3 9119 B12R1.252 CC(CCSc1ccccc1)N Amb13881552 [0,2,0,0,0,0|1,1,0]=4 9120 B12R1.252 CC(COCc1ccccc1)N Amb1124568 [0,2,0,0,0,0|1,0,0]=3 9121 B12R1.252 CC(Cl)COCc1ccccc1 Amb25059141 [0,2,0,0,0,0|1,0,0]=3 9122 B12R1.252 CC(F)CCCc1ccccc1 Amb22229780 [0,2,0,0,0,0|2,0,0]=4 9123 B12R1.252 CC(F)CNCc1ccccc1 Amb25795376 [0,2,0,0,0,0|2,0,0]=4 9124 B12R1.252 CC(I)CCCc1ccccc1 Amb22274883 [0,2,0,0,0,0|2,0,0]=4 9125 B12R1.252 CC(N)CC#Cc1ccccc1 Amb25081198 [0,2,0,0,0,0|2,0,0]=4 9126 B12R1.252 CC(N)CCNc1ccccc1 Amb19009675 [0,2,0,0,0,0|2,0,0]=4 9127 B12R1.252 CC(N)CNCc1ccccc1 Amb18305296 [0,2,0,0,0,0|2,0,0]=4 9128 B12R1.252 CC(NCCc1ccccc1)C Amb2111109 [0,2,0,0,0,0|2,0,0]=4 9129 B12R1.252 CC(O)C#COc1ccccc1 Amb25357442 [0,2,0,0,0,0|0,0,1]=3 9130 B12R1.252 CC(O)C=C=Cc1ccccc1 Amb24431362 [0,2,0,0,0,0|1,0,1]=4 9131 B12R1.252 CC(O)CC#Cc1c[n]ccc1 Amb24464546 [0,2,0,0,0,0|2,0,0]=4 9132 B12R1.252 CC(O)CCCc1c[n]ccc1 Amb22292250 [0,2,0,0,0,0|2,0,0]=4 9133 B12R1.252 CC(O)CCNc1cccc[n]1 Amb25361843 [0,2,0,0,0,0|2,0,0]=4 9134 B12R1.252 CC(O)CCNc1ccccc1 Amb25376877 [0,2,0,0,0,0|1,0,0]=3 9135 B12R1.252 CC(O)CNNc1ccccc1 Amb24719484 [0,2,0,0,0,0|1,0,0]=3 9136 B12R1.252 CC(O)C\C=C\c1c[n]ccc1 Amb25047994 [0,2,0,0,0,0|2,0,0]=4 9137 B12R1.252 CC(O)C\C=C\c1ccccc1 Amb24645318 [0,2,0,0,0,0|1,0,0]=3 9138 B12R1.252 CC(O)C\N=N\c1ccccc1 Amb25855784 [0,2,0,0,0,0|1,0,0]=3 9139 B12R1.252 CC(O)\C=N\Nc1ccccc1 Amb25816526 [0,2,0,0,0,0|1,0,1]=4 9140 B12R1.252 CC(S)CNCc1ccccc1 Amb18648551 [0,2,0,0,0,0|1,1,0]=4 9141 B12R1.252 CN(C)CCOc1cccc[n]1 Amb24089708 [0,2,0,0,0,0|2,0,0]=4 9142 B12R1.252 CN(C)CCOc1ccccc1 Amb22499767 [0,2,0,0,0,0|1,0,0]=3 9143 B12R1.252 CN(CCCc1ccccc1)C Amb1085936 [0,2,0,0,0,0|2,0,0]=4 9144 B12R1.252 CN(N)CCNc1ccccc1 Amb18646399 [0,2,0,0,0,0|2,0,0]=4 9145 B12R1.252 CN(N)CCOc1ccccc1 Amb18563757 [0,2,0,0,0,0|1,0,0]=3 9146 B12R1.252 CS(=O)CCNc1ccccc1 Amb24562694 [0,2,0,0,0,0|1,0,1]=4 9147 B12R1.252 C[C@@H](COCc1ccccc1)N Amb17061656 [0,2,0,0,0,0|1,0,0]=3 9148 B12R1.252 C[C@@H](N)COCc1ccccc1 Amb18529657 [0,2,0,0,0,0|1,0,0]=3 9149 B12R1.252 C[C@@H](O)CNCc1ccccc1 Amb25708513 [0,2,0,0,0,0|1,0,0]=3 9150 B12R1.252 C[C@@H](O)COCc1ccccc1 Amb22169747 [0,2,0,0,0,0|0,0,0]=2 9151 B12R1.252 C[C@@H](O)C\C=C\c1c[n]ccc1 Amb25157958 [0,2,0,0,0,0|2,0,0]=4 9152 B12R1.252 C[C@@H](O)C\C=C\c1ccccc1 Amb25846224 [0,2,0,0,0,0|1,0,0]=3 9153 B12R1.252 C[C@@H](O)C\N=C\c1ccccc1 Amb25369326 [0,2,0,0,0,0|1,0,0]=3 9154 B12R1.252 C[C@@H](O)\C=C\Sc1ccccc1 Amb25052220 [0,2,0,0,0,0|0,1,1]=4 9155 B12R1.252 C[C@@H](O)\C=N\Nc1ccccc1 Amb24608055 [0,2,0,0,0,0|1,0,1]=4 9156 B12R1.252 C[C@H](N)CNCc1ccccc1 Amb25047295 [0,2,0,0,0,0|2,0,0]=4 9157 B12R1.252 C[C@H](O)CC#Cc1ccccc1 Amb24593809 [0,2,0,0,0,0|1,0,0]=3 9158 B12R1.252 C[C@H](O)CCNc1cc[n]cc1 Amb25334540 [0,2,0,0,0,0|2,0,0]=4 9159 B12R1.252 C[C@H](O)CCNc1cccc[n]1 Amb24676365 [0,2,0,0,0,0|2,0,0]=4 9160 B12R1.252 C[C@H](O)COCc1ccccc1 Amb22044890 [0,2,0,0,0,0|0,0,0]=2 9161 B12R1.252 C[C@H](O)C\C=C\c1ccccc1 Amb25080010 [0,2,0,0,0,0|1,0,0]=3 9162 B12R1.252 C[C@H](O)C\N=C\c1ccccc1 Amb24642411 [0,2,0,0,0,0|1,0,0]=3 9163 B12R1.252 C[C@H](O)\C=N\Nc1ccccc1 Amb25816090 [0,2,0,0,0,0|1,0,1]=4 9164 B12R1.252 C[SiH](C)CCCc1ccccc1 Amb22366558 [0,2,0,0,0,0|2,0,0]=4 9165 B12R1.252 ClC(=O)CCSc1ccccc1 Amb10064363 [0,2,0,0,0,0|0,1,1]=4 9166 B12R1.252 Cl[SiH](Cl)CCCc1ccccc1 Amb22232507 [0,2,0,0,0,0|2,0,0]=4 9167 B12R1.252 FC(CNCc1ccccc1)F Amb16229911 [0,2,0,0,0,0|2,0,0]=4 9168 B12R1.252 FC(F)CSCc1ccccc1 Amb22008716 [0,2,0,0,0,0|1,1,0]=4 9169 B12R1.252 NC(=S)CCNc1ccccc1 Amb17233757 [0,2,0,0,0,0|1,1,0]=4 9170 B12R1.252 NC(=S)CCSc1ccccc1 Amb17307558 [0,2,0,0,0,0|0,2,0]=4 9171 B12R1.252 OB(O)CCCc1ccccc1 Amb21928056 [0,2,0,0,0,0|1,0,0]=3 9172 B12R1.252 OC(=O)C#COc1ccccc1 Amb24634223 [0,2,0,0,0,0|0,0,2]=4 9173 B12R1.252 OC(=O)CC#Cc1ccccc1 Amb18296382 [0,2,0,0,0,0|1,0,1]=4 9174 B12R1.252 OC(=O)CCC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22056045 [0,2,0,0,0,0|1,0,0]=3 9175 B12R1.252 OC(=O)CCCc1cc[n]cc1 Amb19929548 [0,2,0,0,0,0|2,0,0]=4 9176 B12R1.252 OC(=O)CCCc1cccc[n]1 Amb19356883 [0,2,0,0,0,0|2,0,0]=4 9177 B12R1.252 OC(=O)CCCc1ccccc1 Amb2388283 [0,2,0,0,0,0|1,0,0]=3 9178 B12R1.252 OC(=O)CCCc1ccccn1 Amb1099328 [0,2,0,0,0,0|2,0,0]=4 9179 B12R1.252 OC(=O)CCCc1cccnc1 Amb17232526 [0,2,0,0,0,0|2,0,0]=4 9180 B12R1.252 OC(=O)CCCc1ccncc1 Amb1099336 [0,2,0,0,0,0|2,0,0]=4 9181 B12R1.252 OC(=O)CCNc1ccc[n]c1 Amb18269696 [0,2,0,0,0,0|2,0,0]=4 9182 B12R1.252 OC(=O)CCNc1ccccc1 Amb1207377 [0,2,0,0,0,0|1,0,0]=3 9183 B12R1.252 OC(=O)CCNc1ccccn1 Amb10609119 [0,2,0,0,0,0|2,0,0]=4 9184 B12R1.252 OC(=O)CCOc1ccccc1 Amb1206804 [0,2,0,0,0,0|0,0,0]=2 9185 B12R1.252 OC(=O)CCSc1ccccc1 Amb1036581 [0,2,0,0,0,0|0,1,0]=3 9186 B12R1.252 OC(=O)CCSc1ccccn1 Amb1133894 [0,2,0,0,0,0|1,1,0]=4 9187 B12R1.252 OC(=O)CNNc1ccccc1 Amb25258415 [0,2,0,0,0,0|1,0,1]=4 9188 B12R1.252 OC(=O)COCc1ccncc1 Amb13883046 [0,2,0,0,0,0|1,0,1]=4 9189 B12R1.252 OC(=O)CONc1cccc[n]1 Amb24497875 [0,2,0,0,0,0|1,0,1]=4 9190 B12R1.252 OC(=O)C[NH2+]Cc1ccccc1 Amb24113880 [0,2,0,0,0,0|1,0,1]=4 9191 B12R1.252 OC(=O)C\N=C\c1ccccc1 Amb24627161 [0,2,0,0,0,0|1,0,1]=4 9192 B12R1.252 OC(=O)\C=C\Oc1ccccc1 Amb18645970 [0,2,0,0,0,0|0,0,2]=4 9193 B12R1.252 [O-]C(=O)CCCc1ccccc1 Amb15690987 [0,2,0,0,0,0|1,0,1]=4 9194 B12R1.252 [O-]C(=O)CC[NH2+]c1ccccc1 Amb22499683 [0,2,0,0,0,0|1,0,1]=4 9195 B12R1.43 Br[C@@H](C(=O)O)Cc1ccccc1 Amb17610062 [0,2,0,0,0,0|1,0,1]=4 9196 B12R1.43 Br[C@H](C(=O)O)Cc1ccccc1 Amb17610063 [0,2,0,0,0,0|1,0,1]=4 9197 B12R1.43 C=C(Oc1ccccc1)C(O)=O Amb24692764 [0,2,0,0,0,0|0,0,2]=4 9198 B12R1.43 CC(=O)[C@@H](C)Oc1ccccc1 Amb25833650 [0,2,0,0,0,0|0,0,2]=4 9199 B12R1.43 CC(Br)C(=O)Oc1ccccc1 Amb24367978 [0,2,0,0,0,0|1,0,1]=4 9200 B12R1.43 CC(C(=O)C)Oc1ccccc1 Amb2439364 [0,2,0,0,0,0|0,0,2]=4 9201 B12R1.43 CC(C(=O)Nc1ccccc1)O Amb1230509 [0,2,0,0,0,0|1,0,1]=4 9202 B12R1.43 CC(C(=O)O)Nc1ccccc1 Amb1213440 [0,2,0,0,0,0|1,0,1]=4 9203 B12R1.43 CC(C(=O)O)Sc1ccccc1 Amb1215286 [0,2,0,0,0,0|0,1,1]=4 9204 B12R1.43 CC(C(=O)Oc1ccccc1)N Amb17334632 [0,2,0,0,0,0|1,0,1]=4 9205 B12R1.43 CC(C(=S)N)Oc1ccccc1 Amb17233851 [0,2,0,0,0,0|0,1,1]=4 9206 B12R1.43 CC(C(N)C)Cc1ccccc1 Amb17232438 [0,2,0,0,0,0|2,0,0]=4 9207 B12R1.43 CC(C(O)C)Cc1ccccc1 Amb17232485 [0,2,0,0,0,0|1,0,0]=3 9208 B12R1.43 CC(C)C(Br)Cc1ccccc1 Amb25690703 [0,2,0,0,0,0|2,0,0]=4 9209 B12R1.43 CC(C)C(C)Oc1c[n]ccc1 Amb24504513 [0,2,0,0,0,0|2,0,0]=4 9210 B12R1.43 CC(C)C(Cl)Cc1ccccc1 Amb19045146 [0,2,0,0,0,0|2,0,0]=4 9211 B12R1.43 CC(C)[C@@H](C)Nc1ccccc1 Amb25375808 [0,2,0,0,0,0|2,0,0]=4 9212 B12R1.43 CC(Cc1cc[n]cc1)C(C)O Amb25710238 [0,2,0,0,0,0|2,0,0]=4 9213 B12R1.43 CC(Cc1cccc[n]1)C(C)O Amb24341829 [0,2,0,0,0,0|2,0,0]=4 9214 B12R1.43 CC(Cc1ccccc1)C(C)Br Amb24751375 [0,2,0,0,0,0|2,0,0]=4 9215 B12R1.43 CC(Cc1ccccc1)C(C)Cl Amb19074260 [0,2,0,0,0,0|2,0,0]=4 9216 B12R1.43 CC(N)C(F)Cc1ccccc1 Amb25850180 [0,2,0,0,0,0|2,0,0]=4 9217 B12R1.43 CC(N)C(F)Sc1ccccc1 Amb24385932 [0,2,0,0,0,0|1,1,0]=4 9218 B12R1.43 CC(N)C(O)Cc1ccccc1 Amb18828237 [0,2,0,0,0,0|2,0,0]=4 9219 B12R1.43 CC(N)[C@H](O)Cc1ccccc1 Amb24389484 [0,2,0,0,0,0|2,0,0]=4 9220 B12R1.43 CC(Nc1cc[n]cc1)C(C)O Amb24593774 [0,2,0,0,0,0|2,0,0]=4 9221 B12R1.43 CC(Nc1cccc[n]1)C(C)O Amb25817172 [0,2,0,0,0,0|2,0,0]=4 9222 B12R1.43 CC(Nc1ccccc1)C(C)N Amb18646160 [0,2,0,0,0,0|2,0,0]=4 9223 B12R1.43 CC(Nc1ccccc1)P(O)=O Amb25270636 [0,2,0,0,0,0|2,0,0]=4 9224 B12R1.43 CC(O)C(=C)Cc1ccccc1 Amb25155687 [0,2,0,0,0,0|1,0,1]=4 9225 B12R1.43 CC(O)C(=O)Cc1ccccc1 Amb24487306 [0,2,0,0,0,0|1,0,1]=4 9226 B12R1.43 CC(O)C(=O)Oc1ccc[n]c1 Amb25182794 [0,2,0,0,0,0|1,0,1]=4 9227 B12R1.43 CC(O)C(=O)Oc1ccccc1 Amb25154221 [0,2,0,0,0,0|0,0,1]=3 9228 B12R1.43 CC(O)C(Cl)Cc1ccccc1 Amb25082706 [0,2,0,0,0,0|1,0,0]=3 9229 B12R1.43 CC(O)C(N)Cc1ccccc1 Amb18646379 [0,2,0,0,0,0|1,0,0]=3 9230 B12R1.43 CC(O)C(O)Cc1cc[n]cc1 Amb25158222 [0,2,0,0,0,0|2,0,0]=4 9231 B12R1.43 CC(O)C(O)Cc1ccccc1 Amb25159724 [0,2,0,0,0,0|1,0,0]=3 9232 B12R1.43 CC(O)[C@@H](N)Cc1ccccc1 Amb24682603 [0,2,0,0,0,0|1,0,0]=3 9233 B12R1.43 CC(O)[C@@H](O)Cc1ccccc1 Amb24354395 [0,2,0,0,0,0|1,0,0]=3 9234 B12R1.43 CC(O)[C@H](N)Cc1ccccc1 Amb25730054 [0,2,0,0,0,0|1,0,0]=3 9235 B12R1.43 CC(Oc1ccccc1)C(C)Cl Amb24532569 [0,2,0,0,0,0|1,0,0]=3 9236 B12R1.43 CC(Oc1ccccc1)C(C)N Amb18291409 [0,2,0,0,0,0|1,0,0]=3 9237 B12R1.43 CC(Oc1ccccc1)C(C)O Amb18801039 [0,2,0,0,0,0|0,0,0]=2 9238 B12R1.43 CC(Oc1ccccc1)C(N)=N Amb18798297 [0,2,0,0,0,0|1,0,1]=4 9239 B12R1.43 CC(Oc1ccccc1)[C@H](C)N Amb25089792 [0,2,0,0,0,0|1,0,0]=3 9240 B12R1.43 CC(Pc1ccccc1)C(O)=O Amb25059181 [0,2,0,0,0,0|1,0,1]=4 9241 B12R1.43 CC(Sc1ccccc1)C(C)Cl Amb25290258 [0,2,0,0,0,0|1,1,0]=4 9242 B12R1.43 CC(Sc1ccccc1)C(C)N Amb18648553 [0,2,0,0,0,0|1,1,0]=4 9243 B12R1.43 C[C@@H](C(=O)O)Cc1ccccc1 Amb10844541 [0,2,0,0,0,0|1,0,1]=4 9244 B12R1.43 C[C@@H](Cc1ccccc1)C(C)O Amb25769503 [0,2,0,0,0,0|1,0,0]=3 9245 B12R1.43 C[C@@H](Cc1ccccc1)[C@@H](C)O Amb25795494 [0,2,0,0,0,0|1,0,0]=3 9246 B12R1.43 C[C@@H](Cc1ccccc1)[C@H](C)Cl Amb25275062 [0,2,0,0,0,0|2,0,0]=4 9247 B12R1.43 C[C@@H](Cl)[C@@H](Cl)Oc1ccccc1 Amb24611251 [0,2,0,0,0,0|1,0,0]=3 9248 B12R1.43 C[C@@H](N)[C@@H](N)Cc1ccccc1 Amb24407278 [0,2,0,0,0,0|2,0,0]=4 9249 B12R1.43 C[C@@H](N)[C@@H](O)Cc1ccccc1 Amb25202137 [0,2,0,0,0,0|2,0,0]=4 9250 B12R1.43 C[C@@H](N)[C@H](O)Cc1ccccc1 Amb25258010 [0,2,0,0,0,0|2,0,0]=4 9251 B12R1.43 C[C@@H](Nc1ccccc1)C(O)=O Amb22801823 [0,2,0,0,0,0|1,0,1]=4 9252 B12R1.43 C[C@@H](Nc1ccccc1)[C@H](C)N Amb25237533 [0,2,0,0,0,0|2,0,0]=4 9253 B12R1.43 C[C@@H](Nc1ccccc1)[C@H](C)O Amb24382503 [0,2,0,0,0,0|1,0,0]=3 9254 B12R1.43 C[C@@H](O)C(=O)Cc1ccccc1 Amb25792955 [0,2,0,0,0,0|1,0,1]=4 9255 B12R1.43 C[C@@H](O)C(=O)Nc1ccccc1 Amb25229042 [0,2,0,0,0,0|1,0,1]=4 9256 B12R1.43 C[C@@H](O)C(=O)Oc1ccc[n]c1 Amb24343534 [0,2,0,0,0,0|1,0,1]=4 9257 B12R1.43 C[C@@H](O)C(=O)Oc1ccccc1 Amb25763938 [0,2,0,0,0,0|0,0,1]=3 9258 B12R1.43 C[C@@H](O)C(=O)Sc1ccccc1 Amb25847054 [0,2,0,0,0,0|0,1,1]=4 9259 B12R1.43 C[C@@H](O)[C@@H](O)Cc1ccccc1 Amb25847064 [0,2,0,0,0,0|1,0,0]=3 9260 B12R1.43 C[C@@H](O)[C@H](Cl)Cc1ccccc1 Amb25823111 [0,2,0,0,0,0|1,0,0]=3 9261 B12R1.43 C[C@@H](O)[C@H](N)Cc1ccccc1 Amb24664138 [0,2,0,0,0,0|1,0,0]=3 9262 B12R1.43 C[C@@H](Oc1ccccc1)C(O)=O Amb22736710 [0,2,0,0,0,0|0,0,1]=3 9263 B12R1.43 C[C@@H](Oc1ccccc1)[C@@H](C)O Amb25687748 [0,2,0,0,0,0|0,0,0]=2 9264 B12R1.43 C[C@@H](Oc1ccccc1)[C@H](C)N Amb24407272 [0,2,0,0,0,0|1,0,0]=3 9265 B12R1.43 C[C@@H](Oc1ccccc1)[C@H](C)O Amb25284620 [0,2,0,0,0,0|0,0,0]=2 9266 B12R1.43 C[C@@H](Sc1ccccc1)[C@@H](C)N Amb25074048 [0,2,0,0,0,0|1,1,0]=4 9267 B12R1.43 C[C@@H](Sc1ccccc1)[C@@H](C)O Amb24414998 [0,2,0,0,0,0|0,1,0]=3 9268 B12R1.43 C[C@@H](Sc1ccccc1)[C@H](C)Cl Amb24444921 [0,2,0,0,0,0|1,1,0]=4 9269 B12R1.43 C[C@H](C(=O)O)Cc1ccccc1 Amb10844540 [0,2,0,0,0,0|1,0,1]=4 9270 B12R1.43 C[C@H](Cc1ccccc1)[C@@H](C)O Amb25157972 [0,2,0,0,0,0|1,0,0]=3 9271 B12R1.43 C[C@H](Cc1ccccc1)[C@H](C)O Amb25769397 [0,2,0,0,0,0|1,0,0]=3 9272 B12R1.43 C[C@H](N)[C@@H](N)Cc1ccccc1 Amb25152488 [0,2,0,0,0,0|2,0,0]=4 9273 B12R1.43 C[C@H](Nc1ccccc1)C(O)=O Amb24434019 [0,2,0,0,0,0|1,0,1]=4 9274 B12R1.43 C[C@H](O)C(=O)Cc1ccccc1 Amb25143432 [0,2,0,0,0,0|1,0,1]=4 9275 B12R1.43 C[C@H](O)C(=O)Oc1ccccc1 Amb25769345 [0,2,0,0,0,0|0,0,1]=3 9276 B12R1.43 C[C@H](O)[C@@H](N)Cc1ccccc1 Amb25690953 [0,2,0,0,0,0|1,0,0]=3 9277 B12R1.43 C[C@H](O)[C@@H](O)Cc1ccccc1 Amb24496614 [0,2,0,0,0,0|1,0,0]=3 9278 B12R1.43 C[C@H](O)[C@H](N)Cc1ccccc1 Amb25375788 [0,2,0,0,0,0|1,0,0]=3 9279 B12R1.43 C[C@H](Oc1ccccc1)C(O)=O Amb22736711 [0,2,0,0,0,0|0,0,1]=3 9280 B12R1.43 C[C@H](Sc1ccccc1)C(O)=O Amb24390829 [0,2,0,0,0,0|0,1,1]=4 9281 B12R1.43 C[C@H](Sc1ccccc1)[C@H](C)O Amb24661261 [0,2,0,0,0,0|0,1,0]=3 9282 B12R1.43 C\C(=C/c1ccccc1)\[C@@H](C)O Amb25816522 [0,2,0,0,0,0|1,0,1]=4 9283 B12R1.43 ClC(C(=O)O)Cc1ccccc1 Amb17204339 [0,2,0,0,0,0|1,0,1]=4 9284 B12R1.43 NC(=O)C(N)Oc1ccccc1 Amb25696007 [0,2,0,0,0,0|0,0,2]=4 9285 B12R1.43 NC(C(C)C)Cc1ccccc1 Amb17138565 [0,2,0,0,0,0|2,0,0]=4 9286 B12R1.43 NC(C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22367486 [0,2,0,0,0,0|1,0,1]=4 9287 B12R1.43 NC(Cc1ccccc1)C(O)=O Amb19958284 [0,2,0,0,0,0|1,0,1]=4 9288 B12R1.43 NC(Cc1ccccc1)P(O)O Amb25227409 [0,2,0,0,0,0|2,0,0]=4 9289 B12R1.43 NC(Cc1ccccc1)[13C](O)=O Amb22363196 [0,2,0,0,0,0|1,0,1]=4 9290 B12R1.43 NC(Oc1ccccc1)C(O)=O Amb25060706 [0,2,0,0,0,0|0,0,1]=3 9291 B12R1.43 NC([13CH2]c1ccccc1)C(O)=O Amb22363309 [0,2,0,0,0,0|1,0,1]=4 9292 B12R1.43 N[13C@@H](Cc1ccccc1)C(O)=O Amb22351319 [0,2,0,0,0,0|1,0,1]=4 9293 B12R1.43 N[13CH](Cc1ccccc1)C(O)=O Amb22367538 [0,2,0,0,0,0|1,0,1]=4 9294 B12R1.43 N[14CH]([14CH2]c1ccccc1)[14C](O)=O Amb22352760 [0,2,0,0,0,0|1,0,1]=4 9295 B12R1.43 N[C@@H](C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22353689 [0,2,0,0,0,0|1,0,1]=4 9296 B12R1.43 N[C@@H](Cc1ccccc1)B(O)O Amb25366514 [0,2,0,0,0,0|2,0,0]=4 9297 B12R1.43 N[C@@H](Cc1ccccc1)C(O)=O Amb22351110 [0,2,0,0,0,0|1,0,1]=4 9298 B12R1.43 N[C@@H](Cc1ccccc1)P(O)O Amb25828976 [0,2,0,0,0,0|2,0,0]=4 9299 B12R1.43 N[C@H](Cc1ccccc1)P(O)=O Amb24355910 [0,2,0,0,0,0|2,0,0]=4 9300 B12R1.43 O=C(Oc1ccccc1)C(F)F Amb25297093 [0,2,0,0,0,0|1,0,1]=4 9301 B12R1.43 OB(O)C(Cl)Cc1ccccc1 Amb24419999 [0,2,0,0,0,0|2,0,0]=4 9302 B12R1.43 OB(O)[C@H](Cl)Cc1ccccc1 Amb25779933 [0,2,0,0,0,0|2,0,0]=4 9303 B12R1.43 OC(=O)C(Br)Oc1ccccc1 Amb24406770 [0,2,0,0,0,0|0,0,1]=3 9304 B12R1.43 OC(=O)C(Cc1ccccc1)Br Amb16210937 [0,2,0,0,0,0|1,0,1]=4 9305 B12R1.43 OC(=O)C(Cl)Oc1ccccc1 Amb24635704 [0,2,0,0,0,0|0,0,1]=3 9306 B12R1.43 OC(=O)C(F)Oc1ccccc1 Amb24433426 [0,2,0,0,0,0|0,0,1]=3 9307 B12R1.43 OC(=O)C(F)Sc1ccccc1 Amb24350687 [0,2,0,0,0,0|0,1,1]=4 9308 B12R1.43 OC(=O)C(O)Sc1ccccc1 Amb24748903 [0,2,0,0,0,0|0,1,1]=4 9309 B12R1.43 OC(=O)C(S)Cc1ccccc1 Amb18289035 [0,2,0,0,0,0|1,0,1]=4 9310 B12R1.43 OC(=O)[C@@H](Cl)Cc1ccccc1 Amb24707843 [0,2,0,0,0,0|1,0,1]=4 9311 B12R1.43 OC(=O)[C@@H](S)Cc1ccccc1 Amb25124079 [0,2,0,0,0,0|1,0,1]=4 9312 B12R1.43 OC(=O)[C@H](Cl)Cc1ccccc1 Amb22225171 [0,2,0,0,0,0|1,0,1]=4 9313 B12R1.43 OC(=O)[C@H](F)Cc1ccccc1 Amb25061394 [0,2,0,0,0,0|1,0,1]=4 9314 B12R1.43 OC(=S)C(I)Cc1ccccc1 Amb24061263 [0,2,0,0,0,0|1,0,1]=4 9315 B12R1.43 OC(C(C)C)Cc1ccccc1 Amb17138584 [0,2,0,0,0,0|2,0,0]=4 9316 B12R1.43 OC(Cc1ccccc1)C(F)Cl Amb25288246 [0,2,0,0,0,0|2,0,0]=4 9317 B12R1.43 OC(Cc1ccccc1)C(F)F Amb24665165 [0,2,0,0,0,0|2,0,0]=4 9318 B12R1.43 OC(Cl)C(=O)Oc1ccccc1 Amb24658483 [0,2,0,0,0,0|0,0,1]=3 9319 B12R1.43 OC(S)C(=O)Oc1ccccc1 Amb25285714 [0,2,0,0,0,0|0,0,1]=3 9320 B12R1.43 O[C@@H](Cc1ccccc1)C(F)F Amb24371353 [0,2,0,0,0,0|2,0,0]=4 9321 B12R1.43 O[C@@H](Cc1ccccc1)[C@H](F)Cl Amb24373884 [0,2,0,0,0,0|2,0,0]=4 9322 B12R1.43 O[C@H](Cc1ccccc1)C(F)F Amb25129748 [0,2,0,0,0,0|2,0,0]=4 9323 B12R1.43 [15NH2]C(Cc1ccccc1)C(O)=O Amb22338047 [0,2,0,0,0,0|1,0,1]=4 9324 B12R1.118 C#CC(CO)Cc1ccccc1 Amb25105982 [0,2,0,0,0,0|1,0,0]=3 9325 B12R1.118 C=C=C(CO)Cc1ccccc1 Amb25777134 [0,2,0,0,0,0|1,0,1]=4 9326 B12R1.118 C=CC(CO)Nc1cc[n]cc1 Amb24343558 [0,2,0,0,0,0|2,0,0]=4 9327 B12R1.118 C=C[C@@H](CO)Nc1ccccc1 Amb25763187 [0,2,0,0,0,0|1,0,0]=3 9328 B12R1.118 CCC(C#C)Nc1ccccc1 Amb25689867 [0,2,0,0,0,0|2,0,0]=4 9329 B12R1.118 CCC(C#N)Nc1ccccc1 Amb18289853 [0,2,0,0,0,0|2,0,0]=4 9330 B12R1.118 CCC(C#N)Oc1c[n]ccc1 Amb25744434 [0,2,0,0,0,0|2,0,0]=4 9331 B12R1.118 CCC(C#N)Oc1ccccc1 Amb18797968 [0,2,0,0,0,0|1,0,0]=3 9332 B12R1.118 CCC(CC)Oc1cccc[n]1 Amb24100574 [0,2,0,0,0,0|2,0,0]=4 9333 B12R1.118 CCC(CN)Oc1ccccc1 Amb18311092 [0,2,0,0,0,0|1,0,0]=3 9334 B12R1.118 CCC(CO)Oc1ccccc1 Amb23538023 [0,2,0,0,0,0|0,0,0]=2 9335 B12R1.118 CCC(Cc1ccccc1)CN Amb10778756 [0,2,0,0,0,0|2,0,0]=4 9336 B12R1.118 CCC(Cc1ccccc1)NC Amb18792514 [0,2,0,0,0,0|2,0,0]=4 9337 B12R1.118 CCC(Nc1ccccc1)CO Amb13952611 [0,2,0,0,0,0|1,0,0]=3 9338 B12R1.118 CCC(Sc1ccccc1)C#N Amb10565503 [0,2,0,0,0,0|1,1,0]=4 9339 B12R1.118 CC[C@@H](CO)Nc1cc[n]cc1 Amb25160371 [0,2,0,0,0,0|2,0,0]=4 9340 B12R1.118 CN[C@@H](CO)Cc1ccccc1 Amb22745072 [0,2,0,0,0,0|1,0,0]=3 9341 B12R1.118 COC(CN)Cc1ccccc1 Amb21954040 [0,2,0,0,0,0|2,0,0]=4 9342 B12R1.118 COC(CN)Oc1ccccc1 Amb24061283 [0,2,0,0,0,0|1,0,0]=3 9343 B12R1.118 N#CC(CBr)Cc1ccccc1 Amb25821723 [0,2,0,0,0,0|2,0,0]=4 9344 B12R1.118 N#CC(CCl)Cc1ccccc1 Amb24753458 [0,2,0,0,0,0|2,0,0]=4 9345 B12R1.118 N#CC(CCl)Nc1ccccc1 Amb25151143 [0,2,0,0,0,0|2,0,0]=4 9346 B12R1.118 N#CC(CO)Cc1c[n]ccc1 Amb23537654 [0,2,0,0,0,0|2,0,0]=4 9347 B12R1.118 N#CC(CO)Cc1cc[n]cc1 Amb23538040 [0,2,0,0,0,0|2,0,0]=4 9348 B12R1.118 N#CC(CO)Cc1cccc[n]1 Amb23538039 [0,2,0,0,0,0|2,0,0]=4 9349 B12R1.118 N#CC(CO)Cc1ccccc1 Amb18110109 [0,2,0,0,0,0|1,0,0]=3 9350 B12R1.118 NCC(CO)Cc1ccccc1 Amb22899484 [0,2,0,0,0,0|1,0,0]=3 9351 B12R1.118 NCC(CO)Nc1ccccc1 Amb25776544 [0,2,0,0,0,0|1,0,0]=3 9352 B12R1.118 NCC(Cc1ccccc1)C#N Amb18908588 [0,2,0,0,0,0|2,0,0]=4 9353 B12R1.118 OCC(CO)=Cc1ccccc1 Amb25077955 [0,2,0,0,0,0|1,0,1]=4 9354 B12R1.118 OCC(CO)Nc1cccc[n]1 Amb24402792 [0,2,0,0,0,0|2,0,0]=4 9355 B12R1.118 OCC(CO)Nc1ccccc1 Amb25060728 [0,2,0,0,0,0|1,0,0]=3 9356 B12R1.118 OC\C(\Cc1ccccc1)=C\F Amb25037074 [0,2,0,0,0,0|1,0,1]=4 9357 B12R1.118 OC\C(\Cc1ccccc1)=N\O Amb25052256 [0,2,0,0,0,0|1,0,1]=4 9358 B12R1.118 O\C=C(/C=O)\Oc1ccccc1 Amb24625847 [0,2,0,0,0,0|0,0,2]=4 9359 B12R1.194 BrCC(Oc1ccccc1)(C)C Amb17248430 [0,2,0,0,0,0|1,0,0]=3 9360 B12R1.194 CC(C)(C=O)Oc1ccccc1 Amb25104993 [0,2,0,0,0,0|0,0,2]=4 9361 B12R1.194 CC(C)(CN)Cc1ccccc1 Amb19310600 [0,2,0,0,0,0|2,0,0]=4 9362 B12R1.194 CC(C)(CN)Oc1ccccc1 Amb19515084 [0,2,0,0,0,0|1,0,0]=3 9363 B12R1.194 CC(C)(CN)Sc1ccccc1 Amb18909240 [0,2,0,0,0,0|1,1,0]=4 9364 B12R1.194 CC(C)(CO)Nc1c[n]ccc1 Amb18267817 [0,2,0,0,0,0|2,0,0]=4 9365 B12R1.194 CC(C)(CO)Nc1ccccc1 Amb18269010 [0,2,0,0,0,0|1,0,0]=3 9366 B12R1.194 CC(C)(CO)Sc1ccccc1 Amb24557142 [0,2,0,0,0,0|0,1,0]=3 9367 B12R1.194 CC(C)(Cc1ccccc1)NO Amb24411489 [0,2,0,0,0,0|2,0,0]=4 9368 B12R1.194 CC(Cl)(CO)Cc1ccccc1 Amb25115909 [0,2,0,0,0,0|1,0,0]=3 9369 B12R1.194 CC(N)(CO)Cc1ccccc1 Amb19001800 [0,2,0,0,0,0|1,0,0]=3 9370 B12R1.194 CC(N)(Cc1ccccc1)CN Amb19001789 [0,2,0,0,0,0|2,0,0]=4 9371 B12R1.194 CCC(C)(Cl)Cc1ccccc1 Amb25080041 [0,2,0,0,0,0|2,0,0]=4 9372 B12R1.194 CCS(=O)(=O)Oc1ccccc1 Amb23496964 [0,2,0,0,0,0|2,0,0]=4 9373 B12R1.194 C[C@@](O)(Cc1ccccc1)CO Amb25817130 [0,2,0,0,0,0|1,0,0]=3 9374 B12R1.194 C[C@](O)(Cc1ccccc1)CO Amb24474165 [0,2,0,0,0,0|1,0,0]=3 9375 B12R1.194 ClCC(Oc1ccccc1)(C)C Amb17234167 [0,2,0,0,0,0|1,0,0]=3 9376 B12R1.194 FC(F)(CCl)Oc1ccccc1 Amb24565773 [0,2,0,0,0,0|1,0,0]=3 9377 B12R1.194 FC(F)(CCl)Sc1ccccc1 Amb24376612 [0,2,0,0,0,0|1,1,0]=4 9378 B12R1.194 NCC(Cc1ccccc1)(C)C Amb17333839 [0,2,0,0,0,0|2,0,0]=4 9379 B12R1.194 NCC(Cc1ccccc1)(O)C Amb17082131 [0,2,0,0,0,0|2,0,0]=4 9380 B12R1.194 NCC(F)(F)Cc1ccccc1 Amb25103781 [0,2,0,0,0,0|2,0,0]=4 9381 B12R1.194 NCC(Oc1ccccc1)(C)C Amb17074797 [0,2,0,0,0,0|1,0,0]=3 9382 B12R1.194 O=S(=O)(CBr)Oc1ccccc1 Amb25788705 [0,2,0,0,0,0|2,0,0]=4 9383 B12R1.194 O=S(=O)(CCl)Oc1ccccc1 Amb25065457 [0,2,0,0,0,0|2,0,0]=4 9384 B12R1.194 OCC(F)(Cl)Cc1ccccc1 Amb25182929 [0,2,0,0,0,0|1,0,0]=3 9385 B12R1.194 OCC(F)(F)Cc1ccccc1 Amb25847026 [0,2,0,0,0,0|1,0,0]=3 9386 B12R1.194 OCC(F)(F)Sc1ccccc1 Amb25097690 [0,2,0,0,0,0|0,1,0]=3 9387 B12R1.194 OCC(Oc1ccccc1)(C)C Amb17232597 [0,2,0,0,0,0|0,0,0]=2 9388 B12R1.194 ONC(Cc1ccccc1)(C)C Amb17615684 [0,2,0,0,0,0|2,0,0]=4 9389 B12R1.891 CC(C)(C)CCc1ccccc1 Amb24470690 [0,2,0,0,0,0|2,0,0]=4 9390 B12R1.891 CC(C)(C)CNc1ccccc1 Amb22394914 [0,2,0,0,0,0|2,0,0]=4 9391 B12R1.891 CC(C)(C)COc1ccccc1 Amb24487425 [0,2,0,0,0,0|1,0,0]=3 9392 B12R1.891 CC(C)(N)CCc1ccccc1 Amb19373033 [0,2,0,0,0,0|2,0,0]=4 9393 B12R1.891 CC(C)(N)CNc1ccccc1 Amb18974263 [0,2,0,0,0,0|2,0,0]=4 9394 B12R1.891 CC(C)(N)COc1cc[n]cc1 Amb25733143 [0,2,0,0,0,0|2,0,0]=4 9395 B12R1.891 CC(C)(N)COc1cccc[n]1 Amb22522749 [0,2,0,0,0,0|2,0,0]=4 9396 B12R1.891 CC(C)(O)CCc1ccccc1 Amb18540684 [0,2,0,0,0,0|1,0,0]=3 9397 B12R1.891 CC(C)(O)COc1ccccc1 Amb18180107 [0,2,0,0,0,0|0,0,0]=2 9398 B12R1.891 CC(C)(O)CSc1cc[n]cc1 Amb24487399 [0,2,0,0,0,0|1,1,0]=4 9399 B12R1.891 CC(C)(O)CSc1cccc[n]1 Amb19057238 [0,2,0,0,0,0|1,1,0]=4 9400 B12R1.891 CC(C)(O)CSc1ccccc1 Amb18321685 [0,2,0,0,0,0|0,1,0]=3 9401 B12R1.891 CC(C)(S)CNc1ccccc1 Amb25764000 [0,2,0,0,0,0|1,1,0]=4 9402 B12R1.891 CC(CCc1ccccc1)(N)C Amb17334588 [0,2,0,0,0,0|2,0,0]=4 9403 B12R1.891 CC(CNc1ccccc1)(C)C Amb10889788 [0,2,0,0,0,0|2,0,0]=4 9404 B12R1.891 CC(CNc1ccccc1)(O)C Amb17138596 [0,2,0,0,0,0|1,0,0]=3 9405 B12R1.891 CC(COc1ccccc1)(N)C Amb17074732 [0,2,0,0,0,0|1,0,0]=3 9406 B12R1.891 CC(CSc1ccccc1)(N)C Amb17485972 [0,2,0,0,0,0|1,1,0]=4 9407 B12R1.891 CC(F)(F)CNc1ccccc1 Amb25323931 [0,2,0,0,0,0|2,0,0]=4 9408 B12R1.891 ClC(Cl)(Cl)CCc1ccccc1 Amb24418534 [0,2,0,0,0,0|2,0,0]=4 9409 B12R1.891 FC(COc1ccccc1)(F)F Amb10840984 [0,2,0,0,0,0|1,0,0]=3 9410 B12R1.891 FC(F)(Br)CNc1ccccc1 Amb25837719 [0,2,0,0,0,0|2,0,0]=4 9411 B12R1.891 FC(F)(F)COc1cc[n]cc1 Amb23599020 [0,2,0,0,0,0|2,0,0]=4 9412 B12R1.891 FC(F)(F)COc1cccc[n]1 Amb25760679 [0,2,0,0,0,0|2,0,0]=4 9413 B12R1.891 FC(F)(F)CSc1ccccc1 Amb17673273 [0,2,0,0,0,0|1,1,0]=4 9414 B12R1.891 F[B-](F)(F)COc1ccccc1 Amb20242897 [0,2,0,0,0,0|2,0,0]=4 9415 B12R1.891 OS(=O)(=O)CCc1ccccc1 Amb19866568 [0,2,0,0,0,0|2,0,0]=4 9416 B12R1.891 OS(=O)(=O)COc1cccc[n]1 Amb22051656 [0,2,0,0,0,0|2,0,0]=4 9417 B10R1.30 C=C1C=CC(=O)CC1CO Amb25713605 [0,0,1,1,0,0|2,0,0]=4 9418 B10R1.78 C=C1CCCCC=CC=C1 Amb22342435 [0,0,1,1,0,0|2,0,0]=4 9419 B10R1.5 OCCn1cccc1C=O Amb17116748 [0,0,1,1,0,0|2,0,0]=4 9420 B10R1.96 C=CCc1ccc(CO)o1 Amb25283317 [0,0,1,1,0,0|0,0,2]=4 9421 B10R1.172 C=Cc1cccc(CO)c1 Amb24405968 [0,0,1,1,0,0|1,0,1]=4 9422 B10R2.6 C1CC1c2c[n]ccc2 Amb22235730 [1,0,0,1,0,0|2,0,0]=4 9423 B10R2.6 C1NC1c2c[n]ccc2 Amb18221862 [1,0,0,1,0,0|2,0,0]=4 9424 B10R2.6 C1NC1c2cc[n]cc2 Amb18221868 [1,0,0,1,0,0|2,0,0]=4 9425 B10R2.6 C1NC1c2cccc[n]2 Amb18860383 [1,0,0,1,0,0|2,0,0]=4 9426 B10R2.6 C1NC1c2ccccc2 Amb25082886 [1,0,0,1,0,0|1,0,0]=3 9427 B10R2.6 C1OC1c2c[n]c[n]c2 Amb24657638 [1,0,0,1,0,0|2,0,0]=4 9428 B10R2.6 C1OC1c2c[n]cc[n]2 Amb25104129 [1,0,0,1,0,0|2,0,0]=4 9429 B10R2.6 C1O[C@@H]1c2c[n]cc[n]2 Amb24481608 [1,0,0,1,0,0|2,0,0]=4 9430 B10R2.6 C1O[C@@H]1c2c[n]ccc2 Amb25758556 [1,0,0,1,0,0|1,0,0]=3 9431 B10R2.6 C1O[C@@H]1c2cc[n]cc2 Amb24103202 [1,0,0,1,0,0|1,0,0]=3 9432 B10R2.6 C1O[C@@H]1c2cccc[n]2 Amb24481607 [1,0,0,1,0,0|1,0,0]=3 9433 B10R2.6 C1O[C@H]1c2c[n]cc[n]2 Amb24481609 [1,0,0,1,0,0|2,0,0]=4 9434 B10R2.6 C1O[C@H]1c2cc[n]cc2 Amb24103149 [1,0,0,1,0,0|1,0,0]=3 9435 B10R2.6 C1O[C@H]1c2cccc[n]2 Amb24101968 [1,0,0,1,0,0|1,0,0]=3 9436 B10R2.6 C1SC1c2ccccc2 Amb17666888 [1,0,0,1,0,0|0,1,0]=3 9437 B10R2.6 O1CC1c2ccncc2 Amb17090250 [1,0,0,1,0,0|1,0,0]=3 9438 B10R2.6 c1ccc(cn1)C2CO2 Amb17090249 [1,0,0,1,0,0|1,0,0]=3 9439 B10R2.6 c1ccc(nc1)C2CO2 Amb17090248 [1,0,0,1,0,0|1,0,0]=3 9440 B10R2.7 C1CC[n+]2ccccc21 Amb25852290 [1,0,0,1,0,0|2,0,0]=4 9441 B10R2.7 C1CCc2cc[n]cc21 Amb22233572 [1,0,0,1,0,0|2,0,0]=4 9442 B10R2.7 C1CN2C=CC=CC2=N1 Amb24101571 [1,0,0,1,0,0|2,0,0]=4 9443 B10R2.7 C1CNc2c[n]ccc21 Amb19516033 [1,0,0,1,0,0|2,0,0]=4 9444 B10R2.7 C1CNc2c[n]ccc21 Amb22495003 [1,0,0,1,0,0|2,0,0]=4 9445 B10R2.7 C1CNc2c[n]ccc21 Amb23412122 [1,0,0,1,0,0|2,0,0]=4 9446 B10R2.7 C1CNc2cc[n]cc21 Amb19515489 [1,0,0,1,0,0|2,0,0]=4 9447 B10R2.7 C1CNc2cc[n]cc21 Amb22372217 [1,0,0,1,0,0|2,0,0]=4 9448 B10R2.7 C1CNc2ccc[n]c21 Amb18833005 [1,0,0,1,0,0|2,0,0]=4 9449 B10R2.7 C1CNc2ccc[n]c21 Amb22494916 [1,0,0,1,0,0|2,0,0]=4 9450 B10R2.7 C1COc2[n]cccc21 Amb25337454 [1,0,0,1,0,0|1,0,0]=3 9451 B10R2.7 C1COc2c[n]ccc21 Amb22372207 [1,0,0,1,0,0|1,0,0]=3 9452 B10R2.7 C1COc2cc[n]cc21 Amb24101562 [1,0,0,1,0,0|1,0,0]=3 9453 B10R2.7 C1COc2ccc[n]c21 Amb23455396 [1,0,0,1,0,0|1,0,0]=3 9454 B10R2.7 C1CPc2ccccc21 Amb24477880 [1,0,0,1,0,0|1,0,0]=3 9455 B10R2.7 C1CSc2c[n]ccc21 Amb24101588 [1,0,0,1,0,0|1,1,0]=4 9456 B10R2.7 C1CSc2ccccc21 Amb24101549 [1,0,0,1,0,0|0,1,0]=3 9457 B10R2.7 C1C[n+]2ccccc2O1 Amb22364467 [1,0,0,1,0,0|1,0,0]=3 9458 B10R2.7 C1N=Cc2ccccc21 Amb20241766 [1,0,0,1,0,0|2,0,0]=4 9459 B10R2.7 C1N=c2ccccc2=N1 Amb24100741 [1,0,0,1,0,0|2,0,0]=4 9460 B10R2.7 C1NCc2ccccc12 Amb17739945 [1,0,0,1,0,0|2,0,0]=4 9461 B10R2.7 C1Nc2ccccc2P1 Amb25102824 [1,0,0,1,0,0|2,0,0]=4 9462 B10R2.7 C1OSc2ccccc21 Amb25250664 [1,0,0,1,0,0|1,1,0]=4 9463 B10R2.7 C1Oc2c[n]c[n]c2O1 Amb24060681 [1,0,0,1,0,0|2,0,0]=4 9464 B10R2.7 C1Oc2c[n]ccc2S1 Amb25116284 [1,0,0,1,0,0|1,1,0]=4 9465 B10R2.7 C1Oc2ccc[n]c2O1 Amb21858055 [1,0,0,1,0,0|1,0,0]=3 9466 B10R2.7 C1Oc2ccccc2S1 Amb21963815 [1,0,0,1,0,0|0,1,0]=3 9467 B10R2.7 C1SCc2ccccc21 Amb21962922 [1,0,0,1,0,0|2,0,0]=4 9468 B10R2.7 [bH]1oc2ccccc2o1 Amb22731069 [1,0,0,1,0,0|1,0,0]=3 9469 B10R2.7 c1[n]ccc2OSOc21 Amb24060623 [1,0,0,1,0,0|2,0,0]=4 9470 B10R2.7 c1ccc2[n+](c1)CCN2 Amb10552798 [1,0,0,1,0,0|2,0,0]=4 9471 B10R2.7 c1ccc2[n+](c1)OCC2 Amb10560834 [1,0,0,1,0,0|1,0,0]=3 9472 B10R2.7 c1ccc2c(c1)C=CC2 Amb2383760 [1,0,0,1,0,0|1,0,1]=4 9473 B10R2.7 c1ccc2c(c1)NCC2 Amb1869493 [1,0,0,1,0,0|1,0,0]=3 9474 B10R2.7 c1ccc2c(c1)onc2 Amb1233398 [1,0,0,1,0,0|1,0,1]=4 9475 B10R2.320 CC1Cc2ccccc12 Amb17778870 [1,0,0,1,0,0|1,0,0]=3 9476 B10R2.320 ClC1Cc2ccccc12 Amb17778800 [1,0,0,1,0,0|1,0,0]=3 9477 B10R2.320 OC1=Cc2ccccc21 Amb22002555 [1,0,0,1,0,0|0,0,2]=4 9478 B10R2.320 OC1Cc2c[n]ccc21 Amb24478648 [1,0,0,1,0,0|1,0,0]=3 9479 B10R2.320 OC1Cc2ccccc12 Amb17778676 [1,0,0,1,0,0|0,0,0]=2 9480 B10R2.320 O[C@@H]1Cc2ccccc21 Amb25676494 [1,0,0,1,0,0|0,0,0]=2 9481 B10R2.320 O[C@H]1Cc2ccccc21 Amb24704470 [1,0,0,1,0,0|0,0,0]=2 9482 B10R2.320 [NH3+]C1Cc2ccccc12 Amb17778877 [1,0,0,1,0,0|1,0,0]=3 9483 B10R2.5 BrC1CC1=C2C=CC=C2 Amb24522972 [0,0,0,1,1,0|2,0,0]=4 9484 B10R2.32 BrC1CC=C2C=CC=C21 Amb24635905 [0,0,0,1,1,0|2,0,0]=4 9485 B10R2.32 OC1CCc2c1ccs2 Amb17087941 [0,0,0,1,1,0|2,0,0]=4 9486 B10R2.32 OC1CCc2c[s]cc21 Amb18202846 [0,0,0,1,1,0|2,0,0]=4 9487 B10R2.32 OC1CCc2cc[s]c21 Amb24675555 [0,0,0,1,1,0|2,0,0]=4 9488 B10R2.193 C1CC1Oc2ccco2 Amb24439276 [0,0,0,1,1,0|2,0,0]=4 9489 B10R2.193 C1CC1Oc2cocc2 Amb24481813 [0,0,0,1,1,0|2,0,0]=4 9490 B10R2.193 C1OC1Cc2c[s]cc2 Amb24392264 [0,0,0,1,1,0|2,0,0]=4 9491 B10R2.193 C1OC1Cc2ccc[nH]2 Amb25062577 [0,0,0,1,1,0|2,0,0]=4 9492 B12R2.586 O=C1COC=2CC=CC=CC21 Amb25151516 [0,0,0,1,0,1|0,0,2]=4 9493 B12R2.586 OC1CCC2=CC=CC=CC21 Amb25056856 [0,0,0,1,0,1|1,0,0]=3 9494 B12R2.586 OC1CCC=2CC=CC=CC21 Amb24466334 [0,0,0,1,0,1|1,0,0]=3 9495 B12R2.2017 C1CCCC2=CC=CC=C1N2 Amb25213582 [0,0,0,1,0,1|2,0,0]=4 9496 B12R2.24 BrC1CCc2c(C1)cccc2 Amb13952699 [0,1,0,1,0,0|2,0,0]=4 9497 B12R2.24 Brc1cc2CCCSc2cc1 Amb18755837 [0,1,0,1,0,0|1,1,0]=4 9498 B12R2.24 Brc1cc2NCCNc2cc1 Amb22231980 [0,1,0,1,0,0|2,0,0]=4 9499 B12R2.24 Brc1cc2NCCOc2[n]c1 Amb22756067 [0,1,0,1,0,0|2,0,0]=4 9500 B12R2.24 Brc1cc2NCCOc2cc1 Amb21964574 [0,1,0,1,0,0|1,0,0]=3 9501 B12R2.24 Brc1cc2NCCSc2cc1 Amb24487014 [0,1,0,1,0,0|1,1,0]=4 9502 B12R2.24 Brc1cc2OC=COc2cc1 Amb25147864 [0,1,0,1,0,0|0,0,2]=4 9503 B12R2.24 Brc1cc2OCCNc2cc1 Amb19958005 [0,1,0,1,0,0|1,0,0]=3 9504 B12R2.24 Brc1cc2OCCOc2nc1 Amb13889671 [0,1,0,1,0,0|1,0,0]=3 9505 B12R2.24 Brc1cc2SCCNc2cc1 Amb25086833 [0,1,0,1,0,0|1,1,0]=4 9506 B12R2.24 Brc1cc2SCCOc2cc1 Amb24719830 [0,1,0,1,0,0|0,1,0]=3 9507 B12R2.24 Brc1ccc2CCCOc2c1 Amb23440336 [0,1,0,1,0,0|1,0,0]=3 9508 B12R2.24 Brc1ccc2CCCSc2c1 Amb25728354 [0,1,0,1,0,0|1,1,0]=4 9509 B12R2.24 Brc1ccc2OCC=Cc2c1 Amb22231978 [0,1,0,1,0,0|1,0,1]=4 9510 B12R2.24 Brc1ccc2OCCNc2[n]1 Amb21864617 [0,1,0,1,0,0|2,0,0]=4 9511 B12R2.24 Brc1ccc2c(c1)CCCN2 Amb1090469 [0,1,0,1,0,0|2,0,0]=4 9512 B12R2.24 Brc1ccc2c(c1)COCO2 Amb16231031 [0,1,0,1,0,0|2,0,0]=4 9513 B12R2.24 Brc1ccc2c(c1)NCCC2 Amb10576260 [0,1,0,1,0,0|2,0,0]=4 9514 B12R2.24 Brc1ccc2c(c1)NCCC2 Amb2383341 [0,1,0,1,0,0|2,0,0]=4 9515 B12R2.24 Brc1ccc2c(c1)NCCO2 Amb2383447 [0,1,0,1,0,0|1,0,0]=3 9516 B12R2.24 Brc1ccc2c(c1)OCCN2 Amb10603903 [0,1,0,1,0,0|1,0,0]=3 9517 B12R2.24 Brc1ccc2c(c1)OCCO2 Amb1152259 [0,1,0,1,0,0|0,0,0]=2 9518 B12R2.24 Brc1ccc2c(n1)OCCN2 Amb13890276 [0,1,0,1,0,0|2,0,0]=4 9519 B12R2.24 C=C1Cc2ccccc2OC1 Amb25087646 [0,1,0,1,0,0|1,0,1]=4 9520 B12R2.24 CC1C=Cc2ccccc2O1 Amb24715788 [0,1,0,1,0,0|1,0,1]=4 9521 B12R2.24 CC1CCc2c(N1)cccc2 Amb2525824 [0,1,0,1,0,0|2,0,0]=4 9522 B12R2.24 CC1CCc2ccccc2N1 Amb22499773 [0,1,0,1,0,0|2,0,0]=4 9523 B12R2.24 CC1CCc2ccccc2O1 Amb19515436 [0,1,0,1,0,0|1,0,0]=3 9524 B12R2.24 CC1CCc2ccccc2S1 Amb25706129 [0,1,0,1,0,0|1,1,0]=4 9525 B12R2.24 CC1CNc2[n]cccc2O1 Amb24709310 [0,1,0,1,0,0|2,0,0]=4 9526 B12R2.24 CC1CNc2c(O1)cccc2 Amb17097653 [0,1,0,1,0,0|1,0,0]=3 9527 B12R2.24 CC1COc2ccc[n]c2N1 Amb25137304 [0,1,0,1,0,0|2,0,0]=4 9528 B12R2.24 CC1COc2ccc[n]c2O1 Amb24485964 [0,1,0,1,0,0|1,0,0]=3 9529 B12R2.24 CC1CSc2ccccc2N1 Amb20622496 [0,1,0,1,0,0|1,1,0]=4 9530 B12R2.24 CC1Cc2ccccc2NC1 Amb22501042 [0,1,0,1,0,0|2,0,0]=4 9531 B12R2.24 CC1Cc2ccccc2OC1 Amb25189640 [0,1,0,1,0,0|1,0,0]=3 9532 B12R2.24 CC=1COc2ccccc2C1 Amb24484437 [0,1,0,1,0,0|1,0,1]=4 9533 B12R2.24 C[C@@H]1CCc2ccccc2N1 Amb22751676 [0,1,0,1,0,0|2,0,0]=4 9534 B12R2.24 C[C@H]1CCc2ccccc2N1 Amb25138125 [0,1,0,1,0,0|2,0,0]=4 9535 B12R2.24 C[C@H]1CNc2ccccc2N1 Amb25348686 [0,1,0,1,0,0|2,0,0]=4 9536 B12R2.24 C[C@H]1COc2ccc[n]c2N1 Amb24488013 [0,1,0,1,0,0|2,0,0]=4 9537 B12R2.24 Cc1cc2CCCNc2cc1 Amb22499776 [0,1,0,1,0,0|2,0,0]=4 9538 B12R2.24 Cc1cc2CCCSc2cc1 Amb24642871 [0,1,0,1,0,0|1,1,0]=4 9539 B12R2.24 Cc1cc2COCOc2cc1 Amb24648861 [0,1,0,1,0,0|2,0,0]=4 9540 B12R2.24 Cc1cc2NCCNc2cc1 Amb20080170 [0,1,0,1,0,0|2,0,0]=4 9541 B12R2.24 Cc1cc2NCCOc2[n]c1 Amb22059623 [0,1,0,1,0,0|2,0,0]=4 9542 B12R2.24 Cc1cc2NCCOc2cc1 Amb22234866 [0,1,0,1,0,0|1,0,0]=3 9543 B12R2.24 Cc1cc2NCCSc2cc1 Amb22886453 [0,1,0,1,0,0|1,1,0]=4 9544 B12R2.24 Cc1cc2OCCNc2[n]c1 Amb24727299 [0,1,0,1,0,0|2,0,0]=4 9545 B12R2.24 Cc1cc2OCCOc2c[n]1 Amb22751371 [0,1,0,1,0,0|1,0,0]=3 9546 B12R2.24 Cc1cc2OCCOc2cc1 Amb22741143 [0,1,0,1,0,0|0,0,0]=2 9547 B12R2.24 Cc1cc2SCCNc2cc1 Amb22498966 [0,1,0,1,0,0|1,1,0]=4 9548 B12R2.24 Cc1ccc2CCCCc2c1 Amb17673387 [0,1,0,1,0,0|2,0,0]=4 9549 B12R2.24 Cc1ccc2CCCNc2c1 Amb22000879 [0,1,0,1,0,0|2,0,0]=4 9550 B12R2.24 Cc1ccc2NCCOc2[n]1 Amb22059721 [0,1,0,1,0,0|2,0,0]=4 9551 B12R2.24 Cc1ccc2OCC=Cc2c1 Amb23441455 [0,1,0,1,0,0|1,0,1]=4 9552 B12R2.24 Cc1ccc2OCCNc2[n]1 Amb21858358 [0,1,0,1,0,0|2,0,0]=4 9553 B12R2.24 Cc1ccc2OCCOc2[n]1 Amb24073998 [0,1,0,1,0,0|1,0,0]=3 9554 B12R2.24 Cc1ccc2c(c1)CCCO2 Amb13951730 [0,1,0,1,0,0|1,0,0]=3 9555 B12R2.24 Cc1ccc2c(c1)NCCC2 Amb1089737 [0,1,0,1,0,0|2,0,0]=4 9556 B12R2.24 Cc1ccc2c(c1)NCCC2 Amb2099820 [0,1,0,1,0,0|2,0,0]=4 9557 B12R2.24 Cc1ccc2c(c1)NCCO2 Amb2383451 [0,1,0,1,0,0|1,0,0]=3 9558 B12R2.24 Cc1ccc2c(c1)OCCN2 Amb17496858 [0,1,0,1,0,0|1,0,0]=3 9559 B12R2.24 ClC1CCc2ccccc2C1 Amb17672772 [0,1,0,1,0,0|2,0,0]=4 9560 B12R2.24 ClC1CCc2ccccc2O1 Amb24509296 [0,1,0,1,0,0|1,0,0]=3 9561 B12R2.24 ClC1CCc2ccccc2S1 Amb24487897 [0,1,0,1,0,0|1,1,0]=4 9562 B12R2.24 ClC=1COc2ccccc2N1 Amb18118341 [0,1,0,1,0,0|1,0,1]=4 9563 B12R2.24 Clc1cc2CCCOc2cc1 Amb22498254 [0,1,0,1,0,0|1,0,0]=3 9564 B12R2.24 Clc1cc2CCCSc2cc1 Amb25783030 [0,1,0,1,0,0|1,1,0]=4 9565 B12R2.24 Clc1cc2NCCOc2[n]c1 Amb25347381 [0,1,0,1,0,0|2,0,0]=4 9566 B12R2.24 Clc1cc2NCCOc2c[n]1 Amb24486945 [0,1,0,1,0,0|2,0,0]=4 9567 B12R2.24 Clc1cc2NCCOc2cc1 Amb22490751 [0,1,0,1,0,0|1,0,0]=3 9568 B12R2.24 Clc1cc2OCC=Cc2cc1 Amb24349799 [0,1,0,1,0,0|1,0,1]=4 9569 B12R2.24 Clc1cc2OCCNc2[n]c1 Amb25336448 [0,1,0,1,0,0|2,0,0]=4 9570 B12R2.24 Clc1cc2OCCOc2[n][n]1 Amb22234512 [0,1,0,1,0,0|2,0,0]=4 9571 B12R2.24 Clc1cc2OCCOc2[n]c1 Amb21959416 [0,1,0,1,0,0|1,0,0]=3 9572 B12R2.24 Clc1cc2SCCNc2cc1 Amb25151172 [0,1,0,1,0,0|1,1,0]=4 9573 B12R2.24 Clc1ccc2CCCOc2c1 Amb25103951 [0,1,0,1,0,0|1,0,0]=3 9574 B12R2.24 Clc1ccc2OCC=Cc2c1 Amb22586260 [0,1,0,1,0,0|1,0,1]=4 9575 B12R2.24 Clc1ccc2OCCNc2[n]1 Amb24509092 [0,1,0,1,0,0|2,0,0]=4 9576 B12R2.24 Clc1ccc2c(c1)CCCN2 Amb1133229 [0,1,0,1,0,0|2,0,0]=4 9577 B12R2.24 Clc1ccc2c(c1)NCCC2 Amb10576261 [0,1,0,1,0,0|2,0,0]=4 9578 B12R2.24 Clc1ccc2c(c1)NCCC2 Amb2383339 [0,1,0,1,0,0|2,0,0]=4 9579 B12R2.24 Clc1ccc2c(c1)NCCN2 Amb10605577 [0,1,0,1,0,0|2,0,0]=4 9580 B12R2.24 Clc1ccc2c(c1)NCCO2 Amb2383445 [0,1,0,1,0,0|1,0,0]=3 9581 B12R2.24 Clc1ccc2c(c1)NCCS2 Amb2371893 [0,1,0,1,0,0|1,1,0]=4 9582 B12R2.24 Clc1ccc2c(c1)OCC=N2 Amb10603916 [0,1,0,1,0,0|1,0,1]=4 9583 B12R2.24 Clc1ccc2c(c1)OCCO2 Amb13951123 [0,1,0,1,0,0|0,0,0]=2 9584 B12R2.24 FC1CNc2ccccc2O1 Amb25301702 [0,1,0,1,0,0|1,0,0]=3 9585 B12R2.24 FC1Cc2ccccc2NC1 Amb25207965 [0,1,0,1,0,0|2,0,0]=4 9586 B12R2.24 Fc1cc2CCCOc2cc1 Amb21864763 [0,1,0,1,0,0|1,0,0]=3 9587 B12R2.24 Fc1cc2CCCOc2nc1 Amb13889669 [0,1,0,1,0,0|2,0,0]=4 9588 B12R2.24 Fc1cc2NCCOc2[n]c1 Amb25736367 [0,1,0,1,0,0|2,0,0]=4 9589 B12R2.24 Fc1cc2NCCSc2cc1 Amb25713881 [0,1,0,1,0,0|1,1,0]=4 9590 B12R2.24 Fc1cc2OCC=Cc2cc1 Amb24485991 [0,1,0,1,0,0|1,0,1]=4 9591 B12R2.24 Fc1cc2OCCOc2cc1 Amb22546380 [0,1,0,1,0,0|0,0,0]=2 9592 B12R2.24 Fc1ccc2CCCNc2c1 Amb22586301 [0,1,0,1,0,0|2,0,0]=4 9593 B12R2.24 Fc1ccc2CCCOc2c1 Amb25065166 [0,1,0,1,0,0|1,0,0]=3 9594 B12R2.24 Fc1ccc2CCCSc2c1 Amb25132871 [0,1,0,1,0,0|1,1,0]=4 9595 B12R2.24 Fc1ccc2OCC=Cc2c1 Amb25770785 [0,1,0,1,0,0|1,0,1]=4 9596 B12R2.24 Fc1ccc2c(c1)CCCN2 Amb1107937 [0,1,0,1,0,0|2,0,0]=4 9597 B12R2.24 Fc1ccc2c(c1)NCCC2 Amb2383340 [0,1,0,1,0,0|2,0,0]=4 9598 B12R2.24 Fc1ccc2c(c1)NCCO2 Amb10603189 [0,1,0,1,0,0|1,0,0]=3 9599 B12R2.24 Fc1ccc2c(c1)NCCO2 Amb2383446 [0,1,0,1,0,0|1,0,0]=3 9600 B12R2.24 Fc1ccc2c(c1)OCCN2 Amb10974785 [0,1,0,1,0,0|1,0,0]=3 9601 B12R2.24 Ic1cc2CCCOc2[n]c1 Amb21961014 [0,1,0,1,0,0|2,0,0]=4 9602 B12R2.24 Ic1cc2CCCOc2cc1 Amb22498253 [0,1,0,1,0,0|1,0,0]=3 9603 B12R2.24 Ic1cc2NCCOc2cc1 Amb22586266 [0,1,0,1,0,0|1,0,0]=3 9604 B12R2.24 Ic1cc2OCCOc2nc1 Amb13889674 [0,1,0,1,0,0|1,0,0]=3 9605 B12R2.24 Ic1ccc2CCCNc2c1 Amb22586311 [0,1,0,1,0,0|2,0,0]=4 9606 B12R2.24 Ic1ccc2OCCCc2[n]1 Amb21959447 [0,1,0,1,0,0|2,0,0]=4 9607 B12R2.24 Ic1ccc2OCCNc2[n]1 Amb21962491 [0,1,0,1,0,0|2,0,0]=4 9608 B12R2.24 Ic1ccc2c(c1)NCCC2 Amb2383346 [0,1,0,1,0,0|2,0,0]=4 9609 B12R2.24 Ic1ccc2c(c1)NCCO2 Amb2383453 [0,1,0,1,0,0|1,0,0]=3 9610 B12R2.24 Ic1ccc2c(n1)OCCN2 Amb13890275 [0,1,0,1,0,0|2,0,0]=4 9611 B12R2.24 Ic1ccc2c(n1)OCCO2 Amb13889672 [0,1,0,1,0,0|1,0,0]=3 9612 B12R2.24 NC1C=Cc2ccccc2O1 Amb24618074 [0,1,0,1,0,0|1,0,1]=4 9613 B12R2.24 NC1CCc2c(C1)cccc2 Amb13952050 [0,1,0,1,0,0|2,0,0]=4 9614 B12R2.24 NC1CCc2c(C1)cccc2 Amb2383251 [0,1,0,1,0,0|2,0,0]=4 9615 B12R2.24 NC1CNc2ccccc2O1 Amb24417784 [0,1,0,1,0,0|1,0,0]=3 9616 B12R2.24 NC1COc2c(C1)cccc2 Amb2383393 [0,1,0,1,0,0|1,0,0]=3 9617 B12R2.24 NC1Cc2ccccc2SC1 Amb18646412 [0,1,0,1,0,0|1,1,0]=4 9618 B12R2.24 NC=1COc2ccccc2N1 Amb18124903 [0,1,0,1,0,0|1,0,1]=4 9619 B12R2.24 N[C@@H]1Cc2ccccc2OC1 Amb22756584 [0,1,0,1,0,0|1,0,0]=3 9620 B12R2.24 N[C@H]1Cc2ccccc2CC1 Amb25113422 [0,1,0,1,0,0|2,0,0]=4 9621 B12R2.24 N[C@H]1Cc2ccccc2NC1 Amb25224756 [0,1,0,1,0,0|2,0,0]=4 9622 B12R2.24 N[C@H]1Cc2ccccc2OC1 Amb23385337 [0,1,0,1,0,0|1,0,0]=3 9623 B12R2.24 N[C@H]1Cc2ccccc2OC1 Amb24485980 [0,1,0,1,0,0|1,0,0]=3 9624 B12R2.24 Nc1cc2CCCOc2[n]c1 Amb21961016 [0,1,0,1,0,0|2,0,0]=4 9625 B12R2.24 Nc1cc2CCCOc2c[n]1 Amb18201906 [0,1,0,1,0,0|2,0,0]=4 9626 B12R2.24 Nc1cc2CCCSc2cc1 Amb18828001 [0,1,0,1,0,0|1,1,0]=4 9627 B12R2.24 Nc1cc2N=CCOc2cc1 Amb24093681 [0,1,0,1,0,0|1,0,1]=4 9628 B12R2.24 Nc1cc2NCCOc2[n]c1 Amb25810070 [0,1,0,1,0,0|2,0,0]=4 9629 B12R2.24 Nc1cc2OC=COc2cc1 Amb25808195 [0,1,0,1,0,0|0,0,2]=4 9630 B12R2.24 Nc1cc2OCCOc2[n]c1 Amb21959405 [0,1,0,1,0,0|1,0,0]=3 9631 B12R2.24 Nc1ccc2CCCNc2c1 Amb22494228 [0,1,0,1,0,0|2,0,0]=4 9632 B12R2.24 Nc1ccc2CCCOc2c1 Amb25324386 [0,1,0,1,0,0|1,0,0]=3 9633 B12R2.24 Nc1ccc2COCOc2c1 Amb24509308 [0,1,0,1,0,0|2,0,0]=4 9634 B12R2.24 Nc1ccc2OCC=Cc2c1 Amb23441460 [0,1,0,1,0,0|1,0,1]=4 9635 B12R2.24 Nc1ccc2c(c1)CCCC2 Amb1084712 [0,1,0,1,0,0|2,0,0]=4 9636 B12R2.24 Nc1ccc2c(c1)CCCN2 Amb17598307 [0,1,0,1,0,0|2,0,0]=4 9637 B12R2.24 Nc1ccc2c(c1)CCCO2 Amb13952453 [0,1,0,1,0,0|1,0,0]=3 9638 B12R2.24 Nc1ccc2c(c1)NCCC2 Amb17598306 [0,1,0,1,0,0|2,0,0]=4 9639 B12R2.24 Nc1ccc2c(c1)NCCN2 Amb10606637 [0,1,0,1,0,0|2,0,0]=4 9640 B12R2.24 Nc1ccc2c(c1)NCCO2 Amb15695267 [0,1,0,1,0,0|1,0,0]=3 9641 B12R2.24 Nc1ccc2c(c1)NCCS2 Amb13881705 [0,1,0,1,0,0|1,1,0]=4 9642 B12R2.24 Nc1ccc2c(c1)OCCO2 Amb2539754 [0,1,0,1,0,0|0,0,0]=2 9643 B12R2.24 O=C1C=C2NCCOC2=CN1 Amb24634638 [0,1,0,1,0,0|2,0,0]=4 9644 B12R2.24 O=C1CNc2ccccc2O1 Amb22166855 [0,1,0,1,0,0|1,0,1]=4 9645 B12R2.24 O=C1COc2c(C1)cccc2 Amb15692703 [0,1,0,1,0,0|0,0,2]=4 9646 B12R2.24 O=C1COc2c(N1)cccc2 Amb1011836 [0,1,0,1,0,0|0,0,2]=4 9647 B12R2.24 OC1=COc2ccccc2O1 Amb24060689 [0,1,0,1,0,0|0,0,2]=4 9648 B12R2.24 OC1=Nc2c(NC1)cccc2 Amb2373483 [0,1,0,1,0,0|1,0,1]=4 9649 B12R2.24 OC1C=Cc2ccccc2O1 Amb21964141 [0,1,0,1,0,0|1,0,1]=4 9650 B12R2.24 OC1CCc2[n]cccc2O1 Amb24417236 [0,1,0,1,0,0|2,0,0]=4 9651 B12R2.24 OC1CCc2ccccc2O1 Amb22230405 [0,1,0,1,0,0|1,0,0]=3 9652 B12R2.24 OC1CN=C2C=CC=CN2C1 Amb17773345 [0,1,0,1,0,0|2,0,0]=4 9653 B12R2.24 OC1CN=C2C=CC=CN2C1 Amb17873523 [0,1,0,1,0,0|2,0,0]=4 9654 B12R2.24 OC1CNc2cccc[n+]2C1 Amb21867773 [0,1,0,1,0,0|2,0,0]=4 9655 B12R2.24 OC1CNc2ccccc2O1 Amb24485948 [0,1,0,1,0,0|1,0,0]=3 9656 B12R2.24 OC1COc2c(O1)cccc2 Amb10552971 [0,1,0,1,0,0|0,0,0]=2 9657 B12R2.24 OC1CSc2ccccc2O1 Amb25072247 [0,1,0,1,0,0|0,1,0]=3 9658 B12R2.24 OC1Cc2[n]cccc2CC1 Amb24070827 [0,1,0,1,0,0|2,0,0]=4 9659 B12R2.24 OC1Cc2ccccc2NC1 Amb23590875 [0,1,0,1,0,0|1,0,0]=3 9660 B12R2.24 OC1Cc2ccccc2OC1 Amb22498287 [0,1,0,1,0,0|0,0,0]=2 9661 B12R2.24 OC1Cc2ccccc2SC1 Amb25832476 [0,1,0,1,0,0|0,1,0]=3 9662 B12R2.24 OC1OCc2c(C1)cccc2 Amb17593730 [0,1,0,1,0,0|2,0,0]=4 9663 B12R2.24 OC=1COc2ccccc2C1 Amb22498277 [0,1,0,1,0,0|0,0,1]=3 9664 B12R2.24 OC=1COc2ccccc2N1 Amb22330533 [0,1,0,1,0,0|0,0,1]=3 9665 B12R2.24 ON1Cc2ccccc2CC1 Amb24533074 [0,1,0,1,0,0|2,0,0]=4 9666 B12R2.24 O[C@@H]1Cc2ccccc2CC1 Amb25149682 [0,1,0,1,0,0|1,0,0]=3 9667 B12R2.24 O[C@H]1Cc2ccccc2C=C1 Amb25792328 [0,1,0,1,0,0|1,0,1]=4 9668 B12R2.24 O[C@H]1Cc2ccccc2CC1 Amb25043599 [0,1,0,1,0,0|1,0,0]=3 9669 B12R2.24 O[C@H]1Cc2ccccc2NC1 Amb24426871 [0,1,0,1,0,0|1,0,0]=3 9670 B12R2.24 Oc1cc2CCCOc2cc1 Amb18243510 [0,1,0,1,0,0|1,0,0]=3 9671 B12R2.24 Oc1cc2NCCOc2cc1 Amb21953873 [0,1,0,1,0,0|1,0,0]=3 9672 B12R2.24 Oc1cc2NCCOc2cc1 Amb22498359 [0,1,0,1,0,0|1,0,0]=3 9673 B12R2.24 Oc1cc2OCCNc2cc1 Amb22371507 [0,1,0,1,0,0|1,0,0]=3 9674 B12R2.24 Oc1cc2OCCNc2cc1 Amb22495584 [0,1,0,1,0,0|1,0,0]=3 9675 B12R2.24 Oc1cc2OCCOc2[n]c1 Amb19959863 [0,1,0,1,0,0|1,0,0]=3 9676 B12R2.24 Oc1cc2SCCOc2cc1 Amb22584035 [0,1,0,1,0,0|0,1,0]=3 9677 B12R2.24 Oc1ccc2CCCOc2c1 Amb18125116 [0,1,0,1,0,0|1,0,0]=3 9678 B12R2.24 Oc1ccc2COCOc2c1 Amb25802023 [0,1,0,1,0,0|2,0,0]=4 9679 B12R2.24 Oc1ccc2OCC=Cc2c1 Amb18124873 [0,1,0,1,0,0|1,0,1]=4 9680 B12R2.24 Oc1ccc2c(c1)OCCO2 Amb1157176 [0,1,0,1,0,0|0,0,0]=2 9681 B12R2.24 S=C1CCc2ccccc2O1 Amb24104591 [0,1,0,1,0,0|1,0,1]=4 9682 B12R2.24 S=C1COc2c(N1)cccc2 Amb10070958 [0,1,0,1,0,0|0,1,1]=4 9683 B12R2.24 SC1CCc2ccccc2C1 Amb17672773 [0,1,0,1,0,0|1,1,0]=4 9684 B12R2.24 Sc1cc2CCCOc2cc1 Amb18180108 [0,1,0,1,0,0|1,0,0]=3 9685 B12R2.24 Sc1cc2CCCSc2cc1 Amb24509702 [0,1,0,1,0,0|1,1,0]=4 9686 B12R2.24 Sc1cc2NCCOc2cc1 Amb18664649 [0,1,0,1,0,0|1,0,0]=3 9687 B12R2.24 Sc1ccc2c(c1)OCCO2 Amb2370522 [0,1,0,1,0,0|0,0,0]=2 9688 B12R2.79 Br[C@@H]1C[C@H]1c2ccc(I)cc2 Amb25113713 [0,1,0,1,0,0|2,0,0]=4 9689 B12R2.79 Brc1ccc(cc1)C2CC2Br Amb23454932 [0,1,0,1,0,0|2,0,0]=4 9690 B12R2.79 CC1CC1c2ccc(Br)cc2 Amb23247702 [0,1,0,1,0,0|2,0,0]=4 9691 B12R2.79 CC1CC1c2ccc(F)cc2 Amb24662198 [0,1,0,1,0,0|2,0,0]=4 9692 B12R2.79 CC1CC1c2ccc(N)cc2 Amb23247694 [0,1,0,1,0,0|2,0,0]=4 9693 B12R2.79 Cc1ccc(cc1)C2CC2O Amb24527656 [0,1,0,1,0,0|1,0,0]=3 9694 B12R2.79 Cc1ccc(cc1)[C@@H]2C[C@@H]2Cl Amb25179016 [0,1,0,1,0,0|2,0,0]=4 9695 B12R2.79 Cc1ccc(cc1)[C@@H]2C[C@H]2Cl Amb25210810 [0,1,0,1,0,0|2,0,0]=4 9696 B12R2.79 Cc1ccc(cc1)[C@@H]2C[C@H]2N Amb24100233 [0,1,0,1,0,0|2,0,0]=4 9697 B12R2.79 Clc1ccc(cc1)C2CC2Br Amb23454925 [0,1,0,1,0,0|2,0,0]=4 9698 B12R2.79 Fc1ccc(cc1)C2CC2Br Amb23454928 [0,1,0,1,0,0|2,0,0]=4 9699 B12R2.79 NC1CC1c2ccc(Br)cc2 Amb19346488 [0,1,0,1,0,0|2,0,0]=4 9700 B12R2.79 NC1CC1c2ccc(Cl)cc2 Amb19373427 [0,1,0,1,0,0|2,0,0]=4 9701 B12R2.79 NC1CC1c2ccc(F)cc2 Amb19514916 [0,1,0,1,0,0|2,0,0]=4 9702 B12R2.79 NC1CC1c2ccc(cc2)O Amb17568133 [0,1,0,1,0,0|2,0,0]=4 9703 B12R2.79 N[C@@H]1C[C@@H]1c2ccc(Br)cc2 Amb24763920 [0,1,0,1,0,0|2,0,0]=4 9704 B12R2.79 N[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb24655057 [0,1,0,1,0,0|2,0,0]=4 9705 B12R2.79 N[C@@H]1C[C@H]1c2ccc(F)cc2 Amb24100231 [0,1,0,1,0,0|2,0,0]=4 9706 B12R2.79 N[C@H]1CC1c2ccc(Cl)cc2 Amb25690946 [0,1,0,1,0,0|2,0,0]=4 9707 B12R2.79 N[C@H]1C[C@@H]1c2ccc(Cl)cc2 Amb24512288 [0,1,0,1,0,0|2,0,0]=4 9708 B12R2.79 N[C@H]1C[C@@H]1c2ccc(F)cc2 Amb25168877 [0,1,0,1,0,0|2,0,0]=4 9709 B12R2.79 N[C@H]1C[C@H]1c2ccc(Br)cc2 Amb25365231 [0,1,0,1,0,0|2,0,0]=4 9710 B12R2.79 N[C@H]1C[C@H]1c2ccc(Cl)cc2 Amb25326697 [0,1,0,1,0,0|2,0,0]=4 9711 B12R2.79 OC1CC1c2ccc(F)cc2 Amb24639281 [0,1,0,1,0,0|1,0,0]=3 9712 B12R2.132 Brc1ccc2CCC(Br)c2c1 Amb24707166 [0,1,0,1,0,0|2,0,0]=4 9713 B12R2.132 Brc1ccc2c(c1)C(=O)CO2 Amb2383542 [0,1,0,1,0,0|0,0,2]=4 9714 B12R2.132 Brc1ccc2c(c1)C(N)CC2 Amb2383225 [0,1,0,1,0,0|2,0,0]=4 9715 B12R2.132 Brc1ccc2c(c1)C(N)CO2 Amb2383235 [0,1,0,1,0,0|1,0,0]=3 9716 B12R2.132 CC1CCc2ccc(O)cc21 Amb24099164 [0,1,0,1,0,0|2,0,0]=4 9717 B12R2.132 CC1CNc2ccc(Br)cc21 Amb18561153 [0,1,0,1,0,0|2,0,0]=4 9718 B12R2.132 CC1CNc2ccc(Cl)cc21 Amb18063404 [0,1,0,1,0,0|2,0,0]=4 9719 B12R2.132 CC1CNc2ccc(F)cc21 Amb18063403 [0,1,0,1,0,0|2,0,0]=4 9720 B12R2.132 CC1COc2ccc(N)cc21 Amb24688008 [0,1,0,1,0,0|1,0,0]=3 9721 B12R2.132 Cc1cc2C(N)COc2c[n]1 Amb25215007 [0,1,0,1,0,0|2,0,0]=4 9722 B12R2.132 Cc1cc2C(N)COc2cc1 Amb20626372 [0,1,0,1,0,0|1,0,0]=3 9723 B12R2.132 Cc1cc2C(O)OCc2cc1 Amb25151988 [0,1,0,1,0,0|2,0,0]=4 9724 B12R2.132 Cc1cc2[C@@H](N)COc2cc1 Amb25367329 [0,1,0,1,0,0|1,0,0]=3 9725 B12R2.132 Cc1cc2[C@H](N)COc2cc1 Amb25781341 [0,1,0,1,0,0|1,0,0]=3 9726 B12R2.132 Cc1ccc2CCC(N)c2c1 Amb19301139 [0,1,0,1,0,0|2,0,0]=4 9727 B12R2.132 Cc1ccc2CCC(O)c2[n]1 Amb24105117 [0,1,0,1,0,0|2,0,0]=4 9728 B12R2.132 Cc1ccc2CC[C@@H](N)c2c1 Amb25367187 [0,1,0,1,0,0|2,0,0]=4 9729 B12R2.132 Cc1ccc2CC[C@H](N)c2c1 Amb25172752 [0,1,0,1,0,0|2,0,0]=4 9730 B12R2.132 Cc1ccc2CC[C@H](O)c2c1 Amb25337667 [0,1,0,1,0,0|1,0,0]=3 9731 B12R2.132 Cc1ccc2c(c1)C(C)CN2 Amb17040660 [0,1,0,1,0,0|2,0,0]=4 9732 B12R2.132 Cc1ccc2c(c1)C(O)CC2 Amb17087924 [0,1,0,1,0,0|1,0,0]=3 9733 B12R2.132 ClC1CCc2ccc(I)cc21 Amb25293402 [0,1,0,1,0,0|2,0,0]=4 9734 B12R2.132 Clc1ccc2c(c1)C(=O)CO2 Amb2383540 [0,1,0,1,0,0|0,0,2]=4 9735 B12R2.132 Clc1ccc2c(c1)C(N)CC2 Amb2383223 [0,1,0,1,0,0|2,0,0]=4 9736 B12R2.132 Clc1ccc2c(c1)C(N)CO2 Amb2383233 [0,1,0,1,0,0|1,0,0]=3 9737 B12R2.132 Clc1ccc2c(n1)C(O)CC2 Amb16233494 [0,1,0,1,0,0|2,0,0]=4 9738 B12R2.132 Fc1ccc2CCC(Br)c2c1 Amb20623851 [0,1,0,1,0,0|2,0,0]=4 9739 B12R2.132 Fc1ccc2CCC(F)c2c1 Amb24514102 [0,1,0,1,0,0|2,0,0]=4 9740 B12R2.132 Fc1ccc2c(c1)C(=O)CO2 Amb2383541 [0,1,0,1,0,0|0,0,2]=4 9741 B12R2.132 Fc1ccc2c(c1)C(Cl)CC2 Amb17087975 [0,1,0,1,0,0|2,0,0]=4 9742 B12R2.132 Fc1ccc2c(c1)C(N)CC2 Amb2383224 [0,1,0,1,0,0|2,0,0]=4 9743 B12R2.132 Fc1ccc2c(c1)C(N)CO2 Amb2383234 [0,1,0,1,0,0|1,0,0]=3 9744 B12R2.132 Fc1ccc2c(c1)C(O)CC2 Amb17087925 [0,1,0,1,0,0|1,0,0]=3 9745 B12R2.132 Fc1ccc2c(c1)[C@H](N)CC2 Amb16233798 [0,1,0,1,0,0|2,0,0]=4 9746 B12R2.132 NC1CCc2ccc(Br)cc21 Amb22277084 [0,1,0,1,0,0|2,0,0]=4 9747 B12R2.132 NC1CCc2ccc(Cl)cc21 Amb21964442 [0,1,0,1,0,0|2,0,0]=4 9748 B12R2.132 NC1CCc2ccc(F)cc21 Amb19373327 [0,1,0,1,0,0|2,0,0]=4 9749 B12R2.132 NC1CCc2ccc(O)cc21 Amb20241032 [0,1,0,1,0,0|2,0,0]=4 9750 B12R2.132 NC1CCc2ccc(S)cc21 Amb24485773 [0,1,0,1,0,0|2,0,0]=4 9751 B12R2.132 NC1CNc2ccc(Cl)cc21 Amb25239513 [0,1,0,1,0,0|2,0,0]=4 9752 B12R2.132 NC1COc2[n]cc(F)cc21 Amb24620418 [0,1,0,1,0,0|2,0,0]=4 9753 B12R2.132 NC1COc2c[n]c(Cl)cc21 Amb25751032 [0,1,0,1,0,0|2,0,0]=4 9754 B12R2.132 NC1COc2ccc(Br)cc21 Amb22751415 [0,1,0,1,0,0|1,0,0]=3 9755 B12R2.132 NC1COc2ccc(Cl)cc21 Amb20626373 [0,1,0,1,0,0|1,0,0]=3 9756 B12R2.132 NC1COc2ccc(O)cc21 Amb25843807 [0,1,0,1,0,0|1,0,0]=3 9757 B12R2.132 N[C@@H]1CCc2ccc(Br)cc21 Amb22899040 [0,1,0,1,0,0|2,0,0]=4 9758 B12R2.132 N[C@@H]1CCc2ccc(Cl)cc21 Amb24523004 [0,1,0,1,0,0|2,0,0]=4 9759 B12R2.132 N[C@@H]1CCc2ccc(F)cc21 Amb22388617 [0,1,0,1,0,0|2,0,0]=4 9760 B12R2.132 N[C@@H]1CCc2ccc(I)cc21 Amb24653732 [0,1,0,1,0,0|2,0,0]=4 9761 B12R2.132 N[C@@H]1COc2ccc(Br)cc21 Amb24756687 [0,1,0,1,0,0|1,0,0]=3 9762 B12R2.132 N[C@@H]1COc2ccc(Cl)cc21 Amb25760690 [0,1,0,1,0,0|1,0,0]=3 9763 B12R2.132 N[C@@H]1COc2ccc(S)cc21 Amb24560332 [0,1,0,1,0,0|1,0,0]=3 9764 B12R2.132 N[C@H]1CCc2ccc(Cl)cc21 Amb24648664 [0,1,0,1,0,0|2,0,0]=4 9765 B12R2.132 N[C@H]1CCc2ccc(F)cc21 Amb22288710 [0,1,0,1,0,0|2,0,0]=4 9766 B12R2.132 N[C@H]1CCc2ccc(O)cc21 Amb19929575 [0,1,0,1,0,0|2,0,0]=4 9767 B12R2.132 N[C@H]1COc2ccc(Cl)cc21 Amb25335375 [0,1,0,1,0,0|1,0,0]=3 9768 B12R2.132 N[C@H]1COc2ccc(I)cc21 Amb24386301 [0,1,0,1,0,0|1,0,0]=3 9769 B12R2.132 N[C@H]1COc2ccc(O)cc21 Amb25829417 [0,1,0,1,0,0|1,0,0]=3 9770 B12R2.132 N[C@H]1COc2ccc(S)cc21 Amb25111596 [0,1,0,1,0,0|1,0,0]=3 9771 B12R2.132 Nc1ccc2CCC(O)c2c1 Amb22490266 [0,1,0,1,0,0|1,0,0]=3 9772 B12R2.132 Nc1ccc2CC[C@@H](N)c2c1 Amb19889681 [0,1,0,1,0,0|2,0,0]=4 9773 B12R2.132 Nc1ccc2CC[C@H](N)c2c1 Amb19889682 [0,1,0,1,0,0|2,0,0]=4 9774 B12R2.132 Nc1ccc2CC[C@H](O)c2c1 Amb24363627 [0,1,0,1,0,0|1,0,0]=3 9775 B12R2.132 Nc1ccc2OC[C@@H](N)c2c1 Amb25073245 [0,1,0,1,0,0|1,0,0]=3 9776 B12R2.132 Nc1ccc2OC[C@H](N)c2c1 Amb25136105 [0,1,0,1,0,0|1,0,0]=3 9777 B12R2.132 Nc1ccc2c(c1)C(=O)CO2 Amb15772360 [0,1,0,1,0,0|0,0,2]=4 9778 B12R2.132 OC1CCc2ccc(Br)cc12 Amb17779324 [0,1,0,1,0,0|1,0,0]=3 9779 B12R2.132 OC1CCc2ccc(I)cc21 Amb25119131 [0,1,0,1,0,0|1,0,0]=3 9780 B12R2.132 OC1CNc2ccc(Br)cc21 Amb25352190 [0,1,0,1,0,0|1,0,0]=3 9781 B12R2.132 OC1COc2ccc(Br)cc21 Amb22059757 [0,1,0,1,0,0|0,0,0]=2 9782 B12R2.132 OC1COc2ccc(Cl)cc21 Amb24104573 [0,1,0,1,0,0|0,0,0]=2 9783 B12R2.132 OC1COc2ccc(F)cc21 Amb22739671 [0,1,0,1,0,0|0,0,0]=2 9784 B12R2.132 OC1OCc2ccc(Br)cc21 Amb22751581 [0,1,0,1,0,0|2,0,0]=4 9785 B12R2.132 O[C@@H]1CCc2ccc(Br)cc21 Amb25147882 [0,1,0,1,0,0|1,0,0]=3 9786 B12R2.132 O[C@H]1CCc2ccc(Br)cc21 Amb25149044 [0,1,0,1,0,0|1,0,0]=3 9787 B12R2.132 O[C@H]1CCc2ccc(Cl)[n]c21 Amb25152676 [0,1,0,1,0,0|2,0,0]=4 9788 B12R2.132 O[C@H]1CCc2ccc(Cl)cc21 Amb25169483 [0,1,0,1,0,0|1,0,0]=3 9789 B12R2.132 O[C@H]1CCc2ccc(I)cc21 Amb25084197 [0,1,0,1,0,0|1,0,0]=3 9790 B12R2.132 Oc1cc2C(=O)COc2cc1 Amb24061522 [0,1,0,1,0,0|0,0,2]=4 9791 B12R2.132 Oc1ccc2CCC(O)c2c1 Amb25209331 [0,1,0,1,0,0|1,0,0]=3 9792 B12R2.132 Oc1ccc2OC[C@H](O)c2c1 Amb24408412 [0,1,0,1,0,0|0,0,0]=2 9793 B12R2.132 Oc1ccc2c(c1)[C@H](N)CC2 Amb10608774 [0,1,0,1,0,0|2,0,0]=4 9794 B12R2.132 SC1CCc2ccc(Br)cc21 Amb25150782 [0,1,0,1,0,0|1,1,0]=4 9795 B12R2.294 Brc1ccc([n]c1)OC2CC2 Amb23538034 [0,1,0,1,0,0|2,0,0]=4 9796 B12R2.294 Brc1ccc(cc1)OC2CC2 Amb22227906 [0,1,0,1,0,0|1,0,0]=3 9797 B12R2.294 Cc1ccc(CC2CO2)c[n]1 Amb25139245 [0,1,0,1,0,0|2,0,0]=4 9798 B12R2.294 Cc1ccc([n]c1)OC2CC2 Amb25289981 [0,1,0,1,0,0|2,0,0]=4 9799 B12R2.294 Cc1ccc(cc1)NC2CC2 Amb24623216 [0,1,0,1,0,0|2,0,0]=4 9800 B12R2.294 Clc1ccc(CC2CC2)cc1 Amb22751349 [0,1,0,1,0,0|2,0,0]=4 9801 B12R2.294 Clc1ccc(CC2CO2)cc1 Amb24712110 [0,1,0,1,0,0|1,0,0]=3 9802 B12R2.294 Clc1ccc([n]c1)OC2CC2 Amb25106898 [0,1,0,1,0,0|2,0,0]=4 9803 B12R2.294 Clc1ccc(cc1)NC2CC2 Amb18267475 [0,1,0,1,0,0|2,0,0]=4 9804 B12R2.294 Clc1ccc(cc1)OC2CC2 Amb24406546 [0,1,0,1,0,0|1,0,0]=3 9805 B12R2.294 Fc1ccc(CC2CO2)cc1 Amb24390098 [0,1,0,1,0,0|1,0,0]=3 9806 B12R2.294 Fc1ccc(c[n]1)OC2CC2 Amb25151416 [0,1,0,1,0,0|2,0,0]=4 9807 B12R2.294 Fc1ccc(cc1)NC2CC2 Amb18267946 [0,1,0,1,0,0|2,0,0]=4 9808 B12R2.294 Fc1ccc(cc1)OC2CC2 Amb25829442 [0,1,0,1,0,0|1,0,0]=3 9809 B12R2.294 Fc1ccc(cc1)SC2CC2 Amb24591737 [0,1,0,1,0,0|1,1,0]=4 9810 B12R2.294 Nc1ccc(c[n]1)OC2CC2 Amb25143981 [0,1,0,1,0,0|2,0,0]=4 9811 B12R2.294 Nc1ccc(cc1)OC2CC2 Amb22011836 [0,1,0,1,0,0|1,0,0]=3 9812 B12R2.294 O=C1C=CN(CC2CO2)C=C1 Amb18787427 [0,1,0,1,0,0|2,0,0]=4 9813 B12R2.294 O=C1C=CN(C[C@H]2CO2)C=C1 Amb25284678 [0,1,0,1,0,0|2,0,0]=4 9814 B12R2.294 Oc1ccc(CC2CO2)cc1 Amb25338853 [0,1,0,1,0,0|1,0,0]=3 9815 B12R2.294 Oc1ccc([n]c1)OC2CC2 Amb24556078 [0,1,0,1,0,0|2,0,0]=4 9816 B12R2.294 Oc1ccc(cc1)OC2CC2 Amb24738590 [0,1,0,1,0,0|1,0,0]=3 9817 B12R2.294 Oc1ccc(cc1)SC2CC2 Amb24487005 [0,1,0,1,0,0|1,1,0]=4 9818 B12R2.294 Sc1ccc(cc1)OC2CC2 Amb24484395 [0,1,0,1,0,0|1,0,0]=3 9819 B12R2.1175 C=C1C=CC2(C=C1)OCCO2 Amb25151338 [0,1,0,1,0,0|0,0,1]=3 9820 B12R2.1175 O=C1C=CC2(C=C1)OCCO2 Amb24060705 [0,1,0,1,0,0|0,0,1]=3 9821 B12R2.1728 NCC1Cc2ccc(O)cc21 Amb25324245 [0,1,0,1,0,0|2,0,0]=4 9822 B12R2.2302 Brc1ccc(cc1)C2CCC2 Amb20617091 [0,1,0,1,0,0|2,0,0]=4 9823 B12R2.2302 Brc1ccc(cc1)C2CCO2 Amb24414336 [0,1,0,1,0,0|1,0,0]=3 9824 B12R2.2302 Cc1ccc(cc1)C2CCC2 Amb25381443 [0,1,0,1,0,0|2,0,0]=4 9825 B12R2.2302 Cc1ccc(cc1)C=2CCC2 Amb24672557 [0,1,0,1,0,0|2,0,0]=4 9826 B12R2.2302 Clc1ccc(cc1)C2CCC2 Amb24713440 [0,1,0,1,0,0|2,0,0]=4 9827 B12R2.2302 Clc1ccc(cc1)C2CCN2 Amb19370175 [0,1,0,1,0,0|2,0,0]=4 9828 B12R2.2302 Clc1ccc(cc1)C2CCN2 Amb22059427 [0,1,0,1,0,0|2,0,0]=4 9829 B12R2.2302 Clc1ccc(cc1)C2CCO2 Amb24369540 [0,1,0,1,0,0|1,0,0]=3 9830 B12R2.2302 Clc1ccc(cc1)C2CCS2 Amb24640005 [0,1,0,1,0,0|1,1,0]=4 9831 B12R2.2302 Clc1ccc(cc1)[C@@H]2CCN2 Amb24585046 [0,1,0,1,0,0|2,0,0]=4 9832 B12R2.2302 Fc1ccc(cc1)[C@H]2CCN2 Amb25757757 [0,1,0,1,0,0|2,0,0]=4 9833 B12R2.2302 Ic1ccc(cc1)[C@@H]2CCN2 Amb24417322 [0,1,0,1,0,0|2,0,0]=4 9834 B12R2.2302 Nc1ccc(cc1)C2CCC2 Amb20617092 [0,1,0,1,0,0|2,0,0]=4 9835 B12R2.2302 Nc1ccc(cc1)C2CCN2 Amb25843764 [0,1,0,1,0,0|2,0,0]=4 9836 B12R2.2302 Nc1ccc(cc1)C2CCO2 Amb25705796 [0,1,0,1,0,0|1,0,0]=3 9837 B12R2.2302 Nc1ccc(cc1)N2CCC2 Amb22387333 [0,1,0,1,0,0|2,0,0]=4 9838 B12R2.2302 Nc1ccc(cc1)[C@H]2CCN2 Amb24583496 [0,1,0,1,0,0|2,0,0]=4 9839 B12R2.2302 Oc1ccc(cc1)C2CCC2 Amb20617093 [0,1,0,1,0,0|2,0,0]=4 9840 B12R2.2302 Oc1ccc(cc1)C2CCN2 Amb24533045 [0,1,0,1,0,0|2,0,0]=4 9841 B12R2.2302 Oc1ccc(cc1)N2CCC2 Amb24579625 [0,1,0,1,0,0|2,0,0]=4 9842 B12R2.2302 Oc1ccc(cc1)[C@H]2CCN2 Amb25762318 [0,1,0,1,0,0|2,0,0]=4 9843 B12R2.2302 Sc1ccc(cc1)C2CCN2 Amb24484464 [0,1,0,1,0,0|2,0,0]=4 9844 B12R2.2 C1C=COC1c2ccccc2 Amb24081226 [0,1,0,1,0,0|1,0,1]=4 9845 B12R2.2 C1CC(ON1)c2cc[n]cc2 Amb24102629 [0,1,0,1,0,0|2,0,0]=4 9846 B12R2.2 C1CC=C(N1)c2ccccc2 Amb17938860 [0,1,0,1,0,0|2,0,0]=4 9847 B12R2.2 C1CCC(O1)c2cccc[n]2 Amb24729132 [0,1,0,1,0,0|2,0,0]=4 9848 B12R2.2 C1CCC(S1)c2ccccc2 Amb25801021 [0,1,0,1,0,0|1,1,0]=4 9849 B12R2.2 C1CCCB1c2ccccc2 Amb25240096 [0,1,0,1,0,0|2,0,0]=4 9850 B12R2.2 C1CC[C@@H](N1)c2ccccc2 Amb20241932 [0,1,0,1,0,0|2,0,0]=4 9851 B12R2.2 C1CC[C@H](N1)c2ccccc2 Amb20241933 [0,1,0,1,0,0|2,0,0]=4 9852 B12R2.2 C1CC[S+](C1)c2ccccc2 Amb10576181 [0,1,0,1,0,0|1,1,0]=4 9853 B12R2.2 C1CC[S+](C1)c2ccccc2 Amb2447150 [0,1,0,1,0,0|1,1,0]=4 9854 B12R2.2 C1CN(C=N1)c2ccccc2 Amb22527125 [0,1,0,1,0,0|2,0,0]=4 9855 B12R2.2 C1CNC(C1)c2ccccc2 Amb10808365 [0,1,0,1,0,0|2,0,0]=4 9856 B12R2.2 C1CNC(C1)c2ccccc2 Amb1106311 [0,1,0,1,0,0|2,0,0]=4 9857 B12R2.2 C1CNN=C1c2ccccc2 Amb25354740 [0,1,0,1,0,0|2,0,0]=4 9858 B12R2.2 C1COB(O1)c2c[n]ccc2 Amb25103771 [0,1,0,1,0,0|1,0,0]=3 9859 B12R2.2 C1COB(O1)c2cccc[n]2 Amb22490930 [0,1,0,1,0,0|1,0,0]=3 9860 B12R2.2 C1COC(=C1)c2cccc[n]2 Amb25358340 [0,1,0,1,0,0|2,0,0]=4 9861 B12R2.2 C1COC(=N1)c2cccc[n]2 Amb24100586 [0,1,0,1,0,0|2,0,0]=4 9862 B12R2.2 C1COC(=N1)c2ccccc2 Amb18063911 [0,1,0,1,0,0|1,0,0]=3 9863 B12R2.2 C1COC(C1)c2ccccc2 Amb17334283 [0,1,0,1,0,0|1,0,0]=3 9864 B12R2.2 C1COC(N1)c2ccccc2 Amb17334284 [0,1,0,1,0,0|1,0,0]=3 9865 B12R2.2 C1COC(N1)c2ccccn2 Amb17334298 [0,1,0,1,0,0|2,0,0]=4 9866 B12R2.2 C1COC(N1)c2cccnc2 Amb17334299 [0,1,0,1,0,0|2,0,0]=4 9867 B12R2.2 C1COC(N1)c2ccncc2 Amb17334300 [0,1,0,1,0,0|2,0,0]=4 9868 B12R2.2 C1COC(O1)c2c[n]c[n]c2 Amb25710715 [0,1,0,1,0,0|2,0,0]=4 9869 B12R2.2 C1COC(O1)c2ccccn2 Amb17334307 [0,1,0,1,0,0|1,0,0]=3 9870 B12R2.2 C1COC(O1)c2cccnc2 Amb17334308 [0,1,0,1,0,0|1,0,0]=3 9871 B12R2.2 C1COC(O1)c2ccncc2 Amb17334309 [0,1,0,1,0,0|1,0,0]=3 9872 B12R2.2 C1CSC(S1)c2ccccc2 Amb23401446 [0,1,0,1,0,0|0,2,0]=4 9873 B12R2.2 C1NC(CO1)c2ccccc2 Amb25258799 [0,1,0,1,0,0|2,0,0]=4 9874 B12R2.2 C1NC(CS1)c2ccccc2 Amb24460745 [0,1,0,1,0,0|2,0,0]=4 9875 B12R2.2 C1NCC(C1)c2ccccc2 Amb10069263 [0,1,0,1,0,0|2,0,0]=4 9876 B12R2.2 C1NCC(C1)c2ccccc2 Amb10072809 [0,1,0,1,0,0|2,0,0]=4 9877 B12R2.2 C1NCC(O1)c2c[n]ccc2 Amb18065317 [0,1,0,1,0,0|2,0,0]=4 9878 B12R2.2 C1NCC(O1)c2cc[n]cc2 Amb18065319 [0,1,0,1,0,0|2,0,0]=4 9879 B12R2.2 C1NCC(O1)c2cccc[n]2 Amb18065316 [0,1,0,1,0,0|2,0,0]=4 9880 B12R2.2 C1NCC(O1)c2ccccc2 Amb18065307 [0,1,0,1,0,0|1,0,0]=3 9881 B12R2.2 C1NCC=C1c2ccccc2 Amb22059494 [0,1,0,1,0,0|2,0,0]=4 9882 B12R2.2 C1NCC[C@@H]1c2ccccc2 Amb19887561 [0,1,0,1,0,0|2,0,0]=4 9883 B12R2.2 C1NCC[C@@H]1c2ccccc2 Amb24183516 [0,1,0,1,0,0|2,0,0]=4 9884 B12R2.2 C1NCC[C@H]1c2ccccc2 Amb19888399 [0,1,0,1,0,0|2,0,0]=4 9885 B12R2.2 C1OCCC1c2c[n]ccc2 Amb24320767 [0,1,0,1,0,0|2,0,0]=4 9886 B12R2.2 C1OCCC1c2cc[n]cc2 Amb24320766 [0,1,0,1,0,0|2,0,0]=4 9887 B12R2.2 C1OCCC1c2cccc[n]2 Amb24320768 [0,1,0,1,0,0|2,0,0]=4 9888 B12R2.2 C1OCCC1c2ccccc2 Amb21960825 [0,1,0,1,0,0|1,0,0]=3 9889 B12R2.2 C1OCOC1c2cc[n]cc2 Amb24102637 [0,1,0,1,0,0|2,0,0]=4 9890 B12R2.2 C1OCOC1c2cccc[n]2 Amb24069912 [0,1,0,1,0,0|2,0,0]=4 9891 B12R2.2 C1OCOC1c2ccccc2 Amb24101078 [0,1,0,1,0,0|1,0,0]=3 9892 B12R2.2 N1=CN(CC1)c2ccccc2 Amb16226120 [0,1,0,1,0,0|2,0,0]=4 9893 B12R2.2 c1ccc(cc1)C2=NCCC2 Amb1106418 [0,1,0,1,0,0|2,0,0]=4 9894 B12R2.2 c1ccc(cc1)C2=NCCS2 Amb10572887 [0,1,0,1,0,0|1,1,0]=4 9895 B12R2.2 c1ccc(cn1)C2=NCCO2 Amb10813641 [0,1,0,1,0,0|2,0,0]=4 9896 B12R2.22 BrC1CC(=C1)c2ccccc2 Amb24669104 [0,1,0,1,0,0|2,0,0]=4 9897 B12R2.22 Br[C@@H]1C[C@H](C1)c2ccccc2 Amb25119213 [0,1,0,1,0,0|2,0,0]=4 9898 B12R2.22 NC1CC(C1)c2ccccc2 Amb19514746 [0,1,0,1,0,0|2,0,0]=4 9899 B12R2.22 NC1CN(C1)c2ccccc2 Amb23598844 [0,1,0,1,0,0|2,0,0]=4 9900 B12R2.22 N[C@@H]1C[C@@H](C1)c2ccccc2 Amb23439754 [0,1,0,1,0,0|2,0,0]=4 9901 B12R2.22 N[C@@H]1C[C@H](C1)c2ccccc2 Amb23439755 [0,1,0,1,0,0|2,0,0]=4 9902 B12R2.22 OC1CC(=C1)c2ccccc2 Amb25198298 [0,1,0,1,0,0|1,0,0]=3 9903 B12R2.22 OC1CC(C1)c2cc[n]cc2 Amb25737321 [0,1,0,1,0,0|2,0,0]=4 9904 B12R2.22 OC1CC(C1)c2ccc[n]c2 Amb25063552 [0,1,0,1,0,0|2,0,0]=4 9905 B12R2.22 OC1CC(C1)c2cccc[n]2 Amb24759509 [0,1,0,1,0,0|2,0,0]=4 9906 B12R2.22 OC1CC(C1)c2ccccc2 Amb20627950 [0,1,0,1,0,0|1,0,0]=3 9907 B12R2.22 OC1CN(C1)c2c[n]ccc2 Amb23598855 [0,1,0,1,0,0|2,0,0]=4 9908 B12R2.22 OC1CN(C1)c2cc[n]cc2 Amb23598876 [0,1,0,1,0,0|2,0,0]=4 9909 B12R2.22 OC1CN(C1)c2cccc[n]2 Amb23598856 [0,1,0,1,0,0|2,0,0]=4 9910 B12R2.22 OC1CN(C1)c2ccccc2 Amb23598700 [0,1,0,1,0,0|1,0,0]=3 9911 B12R2.22 O[C@@H]1C[C@@H](C1)c2ccc[n]c2 Amb24729402 [0,1,0,1,0,0|2,0,0]=4 9912 B12R2.22 O[C@@H]1C[C@@H](C1)c2cccc[n]2 Amb25082461 [0,1,0,1,0,0|2,0,0]=4 9913 B12R2.22 O[C@@H]1C[C@H](C1)c2ccc[n]c2 Amb25081533 [0,1,0,1,0,0|2,0,0]=4 9914 B12R2.22 O[C@@H]1C[C@H](C1)c2ccccc2 Amb25749083 [0,1,0,1,0,0|1,0,0]=3 9915 B12R2.22 SC1CC(C1)c2ccccc2 Amb24690234 [0,1,0,1,0,0|1,1,0]=4 9916 B12R2.27 BrCC1CC1c2ccccc2 Amb25099525 [0,1,0,1,0,0|2,0,0]=4 9917 B12R2.27 BrCC1OC1c2ccccc2 Amb25695964 [0,1,0,1,0,0|1,0,0]=3 9918 B12R2.27 BrC[C@@H]1O[C@@H]1c2ccccc2 Amb24540282 [0,1,0,1,0,0|1,0,0]=3 9919 B12R2.27 BrC[C@H]1O[C@@H]1c2ccccc2 Amb25287176 [0,1,0,1,0,0|1,0,0]=3 9920 B12R2.27 C#CC1CC1c2ccccc2 Amb22002424 [0,1,0,1,0,0|2,0,0]=4 9921 B12R2.27 C=CC1OC1c2ccccc2 Amb24624086 [0,1,0,1,0,0|1,0,1]=4 9922 B12R2.27 CNC1CC1c2ccccc2 Amb18957298 [0,1,0,1,0,0|2,0,0]=4 9923 B12R2.27 CNC1CC1c2ccccc2 Amb20630184 [0,1,0,1,0,0|2,0,0]=4 9924 B12R2.27 COC1OC1c2ccccc2 Amb24613179 [0,1,0,1,0,0|2,0,0]=4 9925 B12R2.27 CSC1CC1c2ccccc2 Amb25086341 [0,1,0,1,0,0|1,1,0]=4 9926 B12R2.27 ClCC1OC1c2ccccc2 Amb25169273 [0,1,0,1,0,0|1,0,0]=3 9927 B12R2.27 ClC[C@H]1O[C@@H]1c2ccccc2 Amb24568308 [0,1,0,1,0,0|1,0,0]=3 9928 B12R2.27 ClC[C@H]1O[C@H]1c2ccccc2 Amb24562256 [0,1,0,1,0,0|1,0,0]=3 9929 B12R2.27 N#CC1CC1c2ccccc2 Amb17231961 [0,1,0,1,0,0|2,0,0]=4 9930 B12R2.27 N#CC1OC1c2ccccc2 Amb17593640 [0,1,0,1,0,0|1,0,1]=4 9931 B12R2.27 N#C[C@@H]1C[C@H]1c2ccccc2 Amb25309014 [0,1,0,1,0,0|2,0,0]=4 9932 B12R2.27 N#C[C@H]1CC1c2ccccc2 Amb24544864 [0,1,0,1,0,0|2,0,0]=4 9933 B12R2.27 NCC1CC1c2ccccc2 Amb17232030 [0,1,0,1,0,0|2,0,0]=4 9934 B12R2.27 NCC1CC1c2ccccc2 Amb19515036 [0,1,0,1,0,0|2,0,0]=4 9935 B12R2.27 NCC1OC1c2ccccc2 Amb25836323 [0,1,0,1,0,0|1,0,0]=3 9936 B12R2.27 NC[C@@H]1CC1c2ccccc2 Amb17605571 [0,1,0,1,0,0|2,0,0]=4 9937 B12R2.27 NC[C@@H]1C[C@H]1c2ccccc2 Amb24514797 [0,1,0,1,0,0|2,0,0]=4 9938 B12R2.27 NC[C@H]1C[C@@H]1c2ccccc2 Amb24606663 [0,1,0,1,0,0|2,0,0]=4 9939 B12R2.27 NNC1CC1c2ccccc2 Amb25244653 [0,1,0,1,0,0|2,0,0]=4 9940 B12R2.27 O=CC1CC1c2ccccc2 Amb10844842 [0,1,0,1,0,0|1,0,1]=4 9941 B12R2.27 O=CC1C[C@@H]1c2ccccc2 Amb24619601 [0,1,0,1,0,0|1,0,1]=4 9942 B12R2.27 O=CC1OC1c2ccccc2 Amb25737974 [0,1,0,1,0,0|0,0,2]=4 9943 B12R2.27 O=C[C@@H]1CC1c2ccccc2 Amb25128247 [0,1,0,1,0,0|1,0,1]=4 9944 B12R2.27 O=C[C@@H]1C[C@H]1c2ccccc2 Amb25368620 [0,1,0,1,0,0|1,0,1]=4 9945 B12R2.27 O=C[C@H]1CC1c2ccccc2 Amb24484808 [0,1,0,1,0,0|1,0,1]=4 9946 B12R2.27 OCC1CC1c2c[n]ccc2 Amb23442765 [0,1,0,1,0,0|2,0,0]=4 9947 B12R2.27 OCC1CC1c2cc[n]cc2 Amb23536862 [0,1,0,1,0,0|2,0,0]=4 9948 B12R2.27 OCC1CC1c2cccc[n]2 Amb23536863 [0,1,0,1,0,0|2,0,0]=4 9949 B12R2.27 OCC1CC1c2ccccc2 Amb17605543 [0,1,0,1,0,0|1,0,0]=3 9950 B12R2.27 OCC1OC1c2cccc[n]2 Amb25215385 [0,1,0,1,0,0|1,0,0]=3 9951 B12R2.27 OCC1OC1c2ccccc2 Amb24063567 [0,1,0,1,0,0|0,0,0]=2 9952 B12R2.27 OC[C@@H]1C[C@@H]1c2c[n]ccc2 Amb22744875 [0,1,0,1,0,0|2,0,0]=4 9953 B12R2.27 OC[C@@H]1C[C@H]1c2c[n]ccc2 Amb25339316 [0,1,0,1,0,0|2,0,0]=4 9954 B12R2.27 OC[C@@H]1N=C1c2ccccc2 Amb25346057 [0,1,0,1,0,0|1,0,0]=3 9955 B12R2.27 OC[C@H]1C[C@@H]1c2c[n]ccc2 Amb24632610 [0,1,0,1,0,0|2,0,0]=4 9956 B12R2.27 OC[C@H]1N=C1c2ccccc2 Amb25848732 [0,1,0,1,0,0|1,0,0]=3 9957 B12R2.27 OC[C@H]1O[C@@H]1c2ccccc2 Amb20242388 [0,1,0,1,0,0|0,0,0]=2 9958 B12R2.116 CC1(CCO1)c2ccccc2 Amb22497354 [0,1,0,1,0,0|1,0,0]=3 9959 B12R2.116 NC1(CCC1)c2ccccc2 Amb2371533 [0,1,0,1,0,0|2,0,0]=4 9960 B12R2.116 OC1(CCC1)c2ccccc2 Amb20668463 [0,1,0,1,0,0|2,0,0]=4 9961 B12R2.235 CC1(CC1Cl)c2ccccc2 Amb25275063 [0,1,0,1,0,0|2,0,0]=4 9962 B12R2.235 CC1(CC1N)c2ccccc2 Amb18947391 [0,1,0,1,0,0|2,0,0]=4 9963 B12R2.235 CC1(CC1N)c2ccccc2 Amb19148136 [0,1,0,1,0,0|2,0,0]=4 9964 B12R2.235 C[C@@]1(C[C@@H]1Br)c2ccccc2 Amb25176508 [0,1,0,1,0,0|2,0,0]=4 9965 B12R2.235 C[C@]1(C[C@@H]1Cl)c2ccccc2 Amb24557815 [0,1,0,1,0,0|2,0,0]=4 9966 B12R2.235 NC1(CC1F)c2ccccc2 Amb25194668 [0,1,0,1,0,0|2,0,0]=4 9967 B12R2.235 N[C@@H]1C[C@@]1(F)c2ccccc2 Amb24100224 [0,1,0,1,0,0|2,0,0]=4 9968 B12R2.235 N[C@@H]1C[C@]1(F)c2ccccc2 Amb24100239 [0,1,0,1,0,0|2,0,0]=4 9969 B12R2.235 N[C@@]1(C[C@H]1F)c2ccccc2 Amb24655079 [0,1,0,1,0,0|2,0,0]=4 9970 B12R2.235 N[C@H]1C[C@]1(F)c2ccccc2 Amb24539890 [0,1,0,1,0,0|2,0,0]=4 9971 B12R2.235 N[C@]1(C[C@@H]1F)c2ccccc2 Amb24100238 [0,1,0,1,0,0|2,0,0]=4 9972 B12R2.235 N[C@]1(C[C@H]1F)c2ccccc2 Amb24744741 [0,1,0,1,0,0|2,0,0]=4 9973 B12R2.931 CNCC1Cc2ccccc21 Amb24670284 [0,1,0,1,0,0|2,0,0]=4 9974 B12R2.931 NCCC1Cc2ccccc21 Amb24600610 [0,1,0,1,0,0|2,0,0]=4 9975 B12R2.931 NNCC1Cc2ccccc21 Amb25149107 [0,1,0,1,0,0|2,0,0]=4 9976 B12R2.931 NOCC1Cc2ccccc21 Amb24340346 [0,1,0,1,0,0|1,0,0]=3 9977 B12R2.931 O=CCC1Cc2ccccc21 Amb25808254 [0,1,0,1,0,0|1,0,1]=4 9978 B12R2.931 OCCC1=Cc2ccccc21 Amb24414369 [0,1,0,1,0,0|1,0,0]=3 9979 B12R2.1081 BrC1CCOc2[n]cccc21 Amb25149325 [0,1,0,1,0,0|2,0,0]=4 9980 B12R2.1081 BrC1CCOc2ccc[n]c21 Amb24597058 [0,1,0,1,0,0|2,0,0]=4 9981 B12R2.1081 BrC1COCc2ccccc21 Amb25095651 [0,1,0,1,0,0|1,0,0]=3 9982 B12R2.1081 BrC1OCCc2ccccc21 Amb23441457 [0,1,0,1,0,0|2,0,0]=4 9983 B12R2.1081 Brc1[n]ccc2OCCNc21 Amb23400109 [0,1,0,1,0,0|2,0,0]=4 9984 B12R2.1081 Brc1c[n]cc2NCCOc21 Amb23403699 [0,1,0,1,0,0|2,0,0]=4 9985 B12R2.1081 Brc1cc[n]c2NCCOc21 Amb25070632 [0,1,0,1,0,0|2,0,0]=4 9986 B12R2.1081 Brc1cc[n]c2OCCOc21 Amb22494093 [0,1,0,1,0,0|1,0,0]=3 9987 B12R2.1081 Brc1cccc2C=CCOc21 Amb25032493 [0,1,0,1,0,0|1,0,1]=4 9988 B12R2.1081 Brc1cccc2CCCOc21 Amb18769314 [0,1,0,1,0,0|1,0,0]=3 9989 B12R2.1081 Brc1cccc2CCCSc21 Amb18161542 [0,1,0,1,0,0|1,1,0]=4 9990 B12R2.1081 Brc1cccc2NCCNc21 Amb24647259 [0,1,0,1,0,0|2,0,0]=4 9991 B12R2.1081 Brc1cccc2NCCOc21 Amb21964594 [0,1,0,1,0,0|1,0,0]=3 9992 B12R2.1081 Brc1cccc2NCCSc21 Amb25715188 [0,1,0,1,0,0|1,1,0]=4 9993 B12R2.1081 Brc1cccc2OCCCc21 Amb24081434 [0,1,0,1,0,0|1,0,0]=3 9994 B12R2.1081 Brc1cccc2OCCOc21 Amb20171376 [0,1,0,1,0,0|0,0,0]=2 9995 B12R2.1081 Brc1cccc2SCCNc21 Amb22491567 [0,1,0,1,0,0|1,1,0]=4 9996 B12R2.1081 Brc1cccc2SCCSc21 Amb25351754 [0,1,0,1,0,0|0,2,0]=4 9997 B12R2.1081 Brc1cccc2c1CCCN2 Amb16231479 [0,1,0,1,0,0|2,0,0]=4 9998 B12R2.1081 Brc1cccc2c1CCCN2 Amb2383331 [0,1,0,1,0,0|2,0,0]=4 9999 B12R2.1081 Brc1cccc2c1NCCC2 Amb1134947 [0,1,0,1,0,0|2,0,0]=4 10000 B12R2.1081 Brc1cccc2c1NCCC2 Amb13951989 [0,1,0,1,0,0|2,0,0]=4 10001 B12R2.1081 Brc1cccc2c1OCCN2 Amb2383437 [0,1,0,1,0,0|1,0,0]=3 10002 B12R2.1081 Brc1cncc2c1NCCO2 Amb13890267 [0,1,0,1,0,0|2,0,0]=4 10003 B12R2.1081 C=C1CCCc2ccccc21 Amb25736652 [0,1,0,1,0,0|2,0,0]=4 10004 B12R2.1081 C=C1CCOc2[n]cccc21 Amb24414842 [0,1,0,1,0,0|2,0,0]=4 10005 B12R2.1081 C=C1CCOc2cc[n]cc21 Amb25047683 [0,1,0,1,0,0|2,0,0]=4 10006 B12R2.1081 C=C1CCOc2ccc[n]c21 Amb20241442 [0,1,0,1,0,0|2,0,0]=4 10007 B12R2.1081 C=C1CCSc2ccccc21 Amb25088063 [0,1,0,1,0,0|1,1,0]=4 10008 B12R2.1081 C=C1COCc2ccccc21 Amb24486797 [0,1,0,1,0,0|1,0,1]=4 10009 B12R2.1081 CC1=CCOc2ccccc21 Amb25694360 [0,1,0,1,0,0|1,0,1]=4 10010 B12R2.1081 CC1CCCc2ccccc21 Amb22730060 [0,1,0,1,0,0|2,0,0]=4 10011 B12R2.1081 CC1CCOc2ccc[n]c21 Amb25320654 [0,1,0,1,0,0|2,0,0]=4 10012 B12R2.1081 CC1CCSc2ccccc21 Amb24104681 [0,1,0,1,0,0|1,1,0]=4 10013 B12R2.1081 CC1CNCc2c1cccc2 Amb17399906 [0,1,0,1,0,0|2,0,0]=4 10014 B12R2.1081 CC1CNCc2ccccc21 Amb22275944 [0,1,0,1,0,0|2,0,0]=4 10015 B12R2.1081 CC1COCc2ccccc21 Amb23580749 [0,1,0,1,0,0|1,0,0]=3 10016 B12R2.1081 CC1NCCc2ccccc21 Amb19514854 [0,1,0,1,0,0|2,0,0]=4 10017 B12R2.1081 CC1NCOc2ccccc21 Amb24637522 [0,1,0,1,0,0|1,0,0]=3 10018 B12R2.1081 CC1OCCc2ccccc21 Amb25773190 [0,1,0,1,0,0|2,0,0]=4 10019 B12R2.1081 CC1OCOc2ccccc21 Amb24070527 [0,1,0,1,0,0|1,0,0]=3 10020 B12R2.1081 CN1CCCc2c1cccc2 Amb15692645 [0,1,0,1,0,0|2,0,0]=4 10021 B12R2.1081 CN1CCNc2c1cccc2 Amb2383679 [0,1,0,1,0,0|2,0,0]=4 10022 B12R2.1081 CN1CCNc2ccccc12 Amb19957895 [0,1,0,1,0,0|2,0,0]=4 10023 B12R2.1081 CN1CCNc2ccccc12 Amb22490719 [0,1,0,1,0,0|2,0,0]=4 10024 B12R2.1081 CN1CCOc2c1cccc2 Amb10569245 [0,1,0,1,0,0|1,0,0]=3 10025 B12R2.1081 CN1CCSc2ccccc12 Amb25220195 [0,1,0,1,0,0|1,1,0]=4 10026 B12R2.1081 C[C@@H]1CCNc2ccccc21 Amb25281259 [0,1,0,1,0,0|2,0,0]=4 10027 B12R2.1081 C[C@@H]1CNCc2ccccc21 Amb22751935 [0,1,0,1,0,0|2,0,0]=4 10028 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22751772 [0,1,0,1,0,0|2,0,0]=4 10029 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22756655 [0,1,0,1,0,0|2,0,0]=4 10030 B12R2.1081 C[C@H]1CCNc2ccccc21 Amb24375115 [0,1,0,1,0,0|2,0,0]=4 10031 B12R2.1081 C[C@H]1CNCc2ccccc21 Amb22886463 [0,1,0,1,0,0|2,0,0]=4 10032 B12R2.1081 Cc1[n]ccc2OCCOc21 Amb25169463 [0,1,0,1,0,0|1,0,0]=3 10033 B12R2.1081 Cc1cc[n]c2NCCOc21 Amb25114182 [0,1,0,1,0,0|2,0,0]=4 10034 B12R2.1081 Cc1cccc2C=CCOc21 Amb23441445 [0,1,0,1,0,0|1,0,1]=4 10035 B12R2.1081 Cc1cccc2CCCCc21 Amb22731111 [0,1,0,1,0,0|2,0,0]=4 10036 B12R2.1081 Cc1cccc2CCCNc21 Amb22499779 [0,1,0,1,0,0|2,0,0]=4 10037 B12R2.1081 Cc1cccc2CCCOc21 Amb25797643 [0,1,0,1,0,0|1,0,0]=3 10038 B12R2.1081 Cc1cccc2NCCCc21 Amb19957907 [0,1,0,1,0,0|2,0,0]=4 10039 B12R2.1081 Cc1cccc2NCCOc21 Amb22230187 [0,1,0,1,0,0|1,0,0]=3 10040 B12R2.1081 Cc1cccc2OCC=Cc21 Amb24484436 [0,1,0,1,0,0|1,0,1]=4 10041 B12R2.1081 Cc1cccc2OCCOc21 Amb25245087 [0,1,0,1,0,0|0,0,0]=2 10042 B12R2.1081 Cc1cccc2OCCSc21 Amb25087100 [0,1,0,1,0,0|0,1,0]=3 10043 B12R2.1081 Cc1cccc2c1CCCN2 Amb2383335 [0,1,0,1,0,0|2,0,0]=4 10044 B12R2.1081 Cc1cccc2c1NCCC2 Amb1107915 [0,1,0,1,0,0|2,0,0]=4 10045 B12R2.1081 Cc1cccc2c1OCCN2 Amb2383441 [0,1,0,1,0,0|1,0,0]=3 10046 B12R2.1081 ClC1CCNc2ccccc21 Amb24636938 [0,1,0,1,0,0|2,0,0]=4 10047 B12R2.1081 ClC1COCc2ccccc21 Amb22490656 [0,1,0,1,0,0|1,0,0]=3 10048 B12R2.1081 ClC1SCCc2ccccc21 Amb24634203 [0,1,0,1,0,0|2,0,0]=4 10049 B12R2.1081 ClC=1NC=CC2=NCCOC21 Amb24563399 [0,1,0,1,0,0|2,0,0]=4 10050 B12R2.1081 Clc1[n]ccc2NCCOc21 Amb22899316 [0,1,0,1,0,0|2,0,0]=4 10051 B12R2.1081 Clc1[n]ccc2OCCNc21 Amb21964225 [0,1,0,1,0,0|2,0,0]=4 10052 B12R2.1081 Clc1c[n]cc2NCCOc21 Amb25150559 [0,1,0,1,0,0|2,0,0]=4 10053 B12R2.1081 Clc1c[n]cc2OCCNc21 Amb24485940 [0,1,0,1,0,0|2,0,0]=4 10054 B12R2.1081 Clc1cc[n]c2NCCOc21 Amb25709760 [0,1,0,1,0,0|2,0,0]=4 10055 B12R2.1081 Clc1cc[n]c2OCCNc21 Amb25765845 [0,1,0,1,0,0|2,0,0]=4 10056 B12R2.1081 Clc1cccc2C=CCOc21 Amb22586336 [0,1,0,1,0,0|1,0,1]=4 10057 B12R2.1081 Clc1cccc2CCCCc21 Amb25797430 [0,1,0,1,0,0|2,0,0]=4 10058 B12R2.1081 Clc1cccc2CCCNc21 Amb19373263 [0,1,0,1,0,0|2,0,0]=4 10059 B12R2.1081 Clc1cccc2NCCCc21 Amb19957902 [0,1,0,1,0,0|2,0,0]=4 10060 B12R2.1081 Clc1cccc2NCCNc21 Amb25282036 [0,1,0,1,0,0|2,0,0]=4 10061 B12R2.1081 Clc1cccc2NCCSc21 Amb22886397 [0,1,0,1,0,0|1,1,0]=4 10062 B12R2.1081 Clc1cccc2OCCCc21 Amb25308190 [0,1,0,1,0,0|1,0,0]=3 10063 B12R2.1081 Clc1cccc2SCCNc21 Amb22886398 [0,1,0,1,0,0|1,1,0]=4 10064 B12R2.1081 Clc1cccc2c1CCCN2 Amb2383329 [0,1,0,1,0,0|2,0,0]=4 10065 B12R2.1081 Clc1cccc2c1NCCC2 Amb1140461 [0,1,0,1,0,0|2,0,0]=4 10066 B12R2.1081 Clc1cccc2c1OCCN2 Amb2383435 [0,1,0,1,0,0|1,0,0]=3 10067 B12R2.1081 Clc1ccnc2c1OCCO2 Amb13889675 [0,1,0,1,0,0|1,0,0]=3 10068 B12R2.1081 FC1CCOc2ccccc21 Amb24396221 [0,1,0,1,0,0|1,0,0]=3 10069 B12R2.1081 FC1CCSc2ccccc21 Amb25249840 [0,1,0,1,0,0|1,1,0]=4 10070 B12R2.1081 FC1CNCc2c1cccc2 Amb10841578 [0,1,0,1,0,0|2,0,0]=4 10071 B12R2.1081 FC1COCc2ccccc21 Amb25768367 [0,1,0,1,0,0|1,0,0]=3 10072 B12R2.1081 FC1OCCc2ccccc21 Amb25073157 [0,1,0,1,0,0|2,0,0]=4 10073 B12R2.1081 Fc1cccc2C=CCOc21 Amb22586337 [0,1,0,1,0,0|1,0,1]=4 10074 B12R2.1081 Fc1cccc2CCCCc21 Amb25768617 [0,1,0,1,0,0|2,0,0]=4 10075 B12R2.1081 Fc1cccc2CCCOc21 Amb24554425 [0,1,0,1,0,0|1,0,0]=3 10076 B12R2.1081 Fc1cccc2CCCSc21 Amb25198716 [0,1,0,1,0,0|1,1,0]=4 10077 B12R2.1081 Fc1cccc2NCCCc21 Amb19958505 [0,1,0,1,0,0|2,0,0]=4 10078 B12R2.1081 Fc1cccc2OCCCc21 Amb25084997 [0,1,0,1,0,0|1,0,0]=3 10079 B12R2.1081 Fc1cccc2OCCNc21 Amb18831161 [0,1,0,1,0,0|1,0,0]=3 10080 B12R2.1081 Fc1cccc2c1CCCN2 Amb2383330 [0,1,0,1,0,0|2,0,0]=4 10081 B12R2.1081 Fc1cccc2c1NCCC2 Amb1108527 [0,1,0,1,0,0|2,0,0]=4 10082 B12R2.1081 Fc1cccc2c1NCCC2 Amb13951184 [0,1,0,1,0,0|2,0,0]=4 10083 B12R2.1081 Fc1cccc2c1OCCN2 Amb10603942 [0,1,0,1,0,0|1,0,0]=3 10084 B12R2.1081 Fc1cccc2c1OCCN2 Amb2383436 [0,1,0,1,0,0|1,0,0]=3 10085 B12R2.1081 IC1CCNc2ccccc21 Amb24754405 [0,1,0,1,0,0|2,0,0]=4 10086 B12R2.1081 IC1OCCc2ccccc21 Amb25309346 [0,1,0,1,0,0|2,0,0]=4 10087 B12R2.1081 Ic1cccc2NCCCc21 Amb22586210 [0,1,0,1,0,0|2,0,0]=4 10088 B12R2.1081 Ic1cccc2NCCOc21 Amb22586347 [0,1,0,1,0,0|1,0,0]=3 10089 B12R2.1081 Ic1cccc2OCCCc21 Amb24707108 [0,1,0,1,0,0|1,0,0]=3 10090 B12R2.1081 Ic1cccc2OCCOc21 Amb22499097 [0,1,0,1,0,0|0,0,0]=2 10091 B12R2.1081 Ic1cccc2c1CCCN2 Amb2383337 [0,1,0,1,0,0|2,0,0]=4 10092 B12R2.1081 Ic1cccc2c1OCCN2 Amb2383443 [0,1,0,1,0,0|1,0,0]=3 10093 B12R2.1081 Ic1ccnc2c1OCCO2 Amb13889673 [0,1,0,1,0,0|1,0,0]=3 10094 B12R2.1081 Ic1cncc2c1OCCC2 Amb13889665 [0,1,0,1,0,0|2,0,0]=4 10095 B12R2.1081 NC1CC=Cc2ccccc21 Amb24385870 [0,1,0,1,0,0|2,0,0]=4 10096 B12R2.1081 NC1CCCc2c1cccc2 Amb1154594 [0,1,0,1,0,0|2,0,0]=4 10097 B12R2.1081 NC1CCCc2ccccc21 Amb24273096 [0,1,0,1,0,0|2,0,0]=4 10098 B12R2.1081 NC1CCNc2ccccc21 Amb22233827 [0,1,0,1,0,0|2,0,0]=4 10099 B12R2.1081 NC1CCNc2ccccc21 Amb22757242 [0,1,0,1,0,0|2,0,0]=4 10100 B12R2.1081 NC1CCOc2[n]cccc21 Amb25806168 [0,1,0,1,0,0|2,0,0]=4 10101 B12R2.1081 NC1CCOc2c1cccc2 Amb1107562 [0,1,0,1,0,0|1,0,0]=3 10102 B12R2.1081 NC1CCOc2cc[n]cc21 Amb24591818 [0,1,0,1,0,0|2,0,0]=4 10103 B12R2.1081 NC1CCOc2ccc[n]c21 Amb21858508 [0,1,0,1,0,0|2,0,0]=4 10104 B12R2.1081 NC1CCSc2c1cccc2 Amb1107564 [0,1,0,1,0,0|1,1,0]=4 10105 B12R2.1081 NC1CNCc2ccccc21 Amb19929632 [0,1,0,1,0,0|2,0,0]=4 10106 B12R2.1081 NC1CNCc2ccccc21 Amb22494720 [0,1,0,1,0,0|2,0,0]=4 10107 B12R2.1081 NC1CNCc2ccccc21 Amb22494721 [0,1,0,1,0,0|2,0,0]=4 10108 B12R2.1081 NC1COCc2c1cccc2 Amb10067658 [0,1,0,1,0,0|1,0,0]=3 10109 B12R2.1081 NC1COCc2ccccc21 Amb18202067 [0,1,0,1,0,0|1,0,0]=3 10110 B12R2.1081 NC1CSCc2c1cccc2 Amb10067686 [0,1,0,1,0,0|1,1,0]=4 10111 B12R2.1081 NC1NCCc2ccccc21 Amb22491370 [0,1,0,1,0,0|2,0,0]=4 10112 B12R2.1081 NC1NCCc2ccccc21 Amb25798402 [0,1,0,1,0,0|2,0,0]=4 10113 B12R2.1081 NN1CCOc2ccccc12 Amb18125145 [0,1,0,1,0,0|1,0,0]=3 10114 B12R2.1081 NN1CCOc2ccccc12 Amb22228837 [0,1,0,1,0,0|1,0,0]=3 10115 B12R2.1081 NN1CCSc2ccccc12 Amb24454763 [0,1,0,1,0,0|1,1,0]=4 10116 B12R2.1081 N[C@@H]1CCCc2c1cccc2 Amb10844952 [0,1,0,1,0,0|2,0,0]=4 10117 B12R2.1081 N[C@@H]1CCCc2ccccc21 Amb22167169 [0,1,0,1,0,0|2,0,0]=4 10118 B12R2.1081 N[C@@H]1CCOc2c1cccc2 Amb13953038 [0,1,0,1,0,0|1,0,0]=3 10119 B12R2.1081 N[C@@H]1CCOc2ccccc21 Amb19515762 [0,1,0,1,0,0|1,0,0]=3 10120 B12R2.1081 N[C@@H]1CCSc2c1cccc2 Amb13952927 [0,1,0,1,0,0|1,1,0]=4 10121 B12R2.1081 N[C@H]1CCCc2ccccc21 Amb19929634 [0,1,0,1,0,0|2,0,0]=4 10122 B12R2.1081 N[C@H]1CCNc2ccccc21 Amb25697589 [0,1,0,1,0,0|2,0,0]=4 10123 B12R2.1081 N[C@H]1CCOc2c1cccc2 Amb13953039 [0,1,0,1,0,0|1,0,0]=3 10124 B12R2.1081 N[C@H]1CCOc2ccccc21 Amb24052964 [0,1,0,1,0,0|1,0,0]=3 10125 B12R2.1081 N[C@H]1CCSc2c1cccc2 Amb13952928 [0,1,0,1,0,0|1,1,0]=4 10126 B12R2.1081 Nc1[n]c[n]c2OCCOc21 Amb18201154 [0,1,0,1,0,0|2,0,0]=4 10127 B12R2.1081 Nc1cc[n]c2OCCNc21 Amb24485900 [0,1,0,1,0,0|2,0,0]=4 10128 B12R2.1081 Nc1cccc2CCCNc21 Amb22494247 [0,1,0,1,0,0|2,0,0]=4 10129 B12R2.1081 Nc1cccc2CCCSc21 Amb18126429 [0,1,0,1,0,0|1,1,0]=4 10130 B12R2.1081 Nc1cccc2OCC=Nc21 Amb24093680 [0,1,0,1,0,0|1,0,1]=4 10131 B12R2.1081 Nc1cccc2c1C=CCO2 Amb17569992 [0,1,0,1,0,0|1,0,1]=4 10132 B12R2.1081 Nc1cccc2c1CCCC2 Amb1088906 [0,1,0,1,0,0|2,0,0]=4 10133 B12R2.1081 Nc1cccc2c1CCCN2 Amb17232045 [0,1,0,1,0,0|2,0,0]=4 10134 B12R2.1081 Nc1cccc2c1CCCO2 Amb17570000 [0,1,0,1,0,0|1,0,0]=3 10135 B12R2.1081 Nc1cccc2c1COCO2 Amb17570009 [0,1,0,1,0,0|2,0,0]=4 10136 B12R2.1081 Nc1cccc2c1NCCO2 Amb16191975 [0,1,0,1,0,0|1,0,0]=3 10137 B12R2.1081 Nc1cccc2c1OCC=C2 Amb17569990 [0,1,0,1,0,0|1,0,1]=4 10138 B12R2.1081 Nc1cccc2c1OCCC2 Amb17569999 [0,1,0,1,0,0|1,0,0]=3 10139 B12R2.1081 Nc1cccc2c1OCCN2 Amb10067597 [0,1,0,1,0,0|1,0,0]=3 10140 B12R2.1081 Nc1cccc2c1OCCO2 Amb10071734 [0,1,0,1,0,0|0,0,0]=2 10141 B12R2.1081 Nc1cccc2c1OCCS2 Amb17570122 [0,1,0,1,0,0|0,1,0]=3 10142 B12R2.1081 Nc1cccc2c1OCOC2 Amb17570008 [0,1,0,1,0,0|2,0,0]=4 10143 B12R2.1081 Nc1ccnc2c1OCCO2 Amb13889678 [0,1,0,1,0,0|1,0,0]=3 10144 B12R2.1081 O=C1CCC[13c]2[13cH][13cH][13cH][13cH][13c]21 Amb22056230 [0,1,0,1,0,0|1,0,1]=4 10145 B12R2.1081 O=C1CCNc2c1cccc2 Amb10067080 [0,1,0,1,0,0|1,0,1]=4 10146 B12R2.1081 O=C1CCOc2[n]cccc21 Amb24061183 [0,1,0,1,0,0|1,0,1]=4 10147 B12R2.1081 O=C1CCOc2c1cccc2 Amb1153759 [0,1,0,1,0,0|0,0,1]=3 10148 B12R2.1081 O=C1CCOc2c1nccc2 Amb10602517 [0,1,0,1,0,0|1,0,1]=4 10149 B12R2.1081 O=C1CCOc2cc[n]cc21 Amb21857915 [0,1,0,1,0,0|1,0,1]=4 10150 B12R2.1081 O=C1CCSc2c1cccc2 Amb1151631 [0,1,0,1,0,0|0,1,1]=4 10151 B12R2.1081 O=C1CNOc2ccccc21 Amb25086617 [0,1,0,1,0,0|0,0,2]=4 10152 B12R2.1081 O=C1COCc2c1cccc2 Amb10067824 [0,1,0,1,0,0|0,0,2]=4 10153 B12R2.1081 O=C1NCOc2ccccc21 Amb24104580 [0,1,0,1,0,0|0,0,2]=4 10154 B12R2.1081 O=C1OCOc2ccccc21 Amb24066081 [0,1,0,1,0,0|0,0,2]=4 10155 B12R2.1081 O=S1CCNc2c1cccc2 Amb1106281 [0,1,0,1,0,0|1,0,1]=4 10156 B12R2.1081 OB1OCCc2c1cccc2 Amb10070693 [0,1,0,1,0,0|2,0,0]=4 10157 B12R2.1081 OC1=COCc2c1cccc2 Amb10603427 [0,1,0,1,0,0|0,0,2]=4 10158 B12R2.1081 OC1C=COc2ccccc21 Amb25758786 [0,1,0,1,0,0|0,0,1]=3 10159 B12R2.1081 OC1CC=Cc2[n]cccc21 Amb24070852 [0,1,0,1,0,0|2,0,0]=4 10160 B12R2.1081 OC1CC=Cc2ccc[n]c21 Amb24091947 [0,1,0,1,0,0|2,0,0]=4 10161 B12R2.1081 OC1CC=Cc2ccccc21 Amb25122696 [0,1,0,1,0,0|1,0,0]=3 10162 B12R2.1081 OC1CCCc2c1cccc2 Amb1151324 [0,1,0,1,0,0|1,0,0]=3 10163 B12R2.1081 OC1CCCc2c[n]ccc21 Amb23399822 [0,1,0,1,0,0|2,0,0]=4 10164 B12R2.1081 OC1CCCc2cc[n]cc21 Amb24070835 [0,1,0,1,0,0|2,0,0]=4 10165 B12R2.1081 OC1CCCc2cccnc12 Amb17935812 [0,1,0,1,0,0|2,0,0]=4 10166 B12R2.1081 OC1CCNc2c1cccc2 Amb10553386 [0,1,0,1,0,0|1,0,0]=3 10167 B12R2.1081 OC1CCNc2ccccc21 Amb22276045 [0,1,0,1,0,0|1,0,0]=3 10168 B12R2.1081 OC1CCNc2ccccc21 Amb22497677 [0,1,0,1,0,0|1,0,0]=3 10169 B12R2.1081 OC1CCOc2c1nccc2 Amb16233154 [0,1,0,1,0,0|1,0,0]=3 10170 B12R2.1081 OC1CCOc2cc[n]cc21 Amb25064593 [0,1,0,1,0,0|1,0,0]=3 10171 B12R2.1081 OC1CNCc2[n]cccc21 Amb18201914 [0,1,0,1,0,0|2,0,0]=4 10172 B12R2.1081 OC1CNCc2c1cccc2 Amb16233378 [0,1,0,1,0,0|1,0,0]=3 10173 B12R2.1081 OC1CNCc2ccccc21 Amb22587041 [0,1,0,1,0,0|1,0,0]=3 10174 B12R2.1081 OC1COCc2ccccc21 Amb20171360 [0,1,0,1,0,0|0,0,0]=2 10175 B12R2.1081 OC1ON=Cc2ccccc21 Amb25129790 [0,1,0,1,0,0|2,0,0]=4 10176 B12R2.1081 ON1CCCc2ccccc12 Amb24085481 [0,1,0,1,0,0|1,0,0]=3 10177 B12R2.1081 O[C@@H]1C=CCc2ccccc21 Amb25149702 [0,1,0,1,0,0|1,0,1]=4 10178 B12R2.1081 O[C@@H]1C=COc2ccccc21 Amb25108504 [0,1,0,1,0,0|0,0,1]=3 10179 B12R2.1081 O[C@@H]1CCCc2cc[n]cc21 Amb25357624 [0,1,0,1,0,0|2,0,0]=4 10180 B12R2.1081 O[C@@H]1CCCc2ccc[n]c21 Amb24062853 [0,1,0,1,0,0|2,0,0]=4 10181 B12R2.1081 O[C@@H]1CCCc2ccccc21 Amb22337827 [0,1,0,1,0,0|1,0,0]=3 10182 B12R2.1081 O[C@@H]1CCOc2cc[n]cc21 Amb24511691 [0,1,0,1,0,0|1,0,0]=3 10183 B12R2.1081 O[C@@H]1CCSc2c1cccc2 Amb13952924 [0,1,0,1,0,0|0,1,0]=3 10184 B12R2.1081 O[C@@H]1CNCc2ccccc21 Amb24746212 [0,1,0,1,0,0|1,0,0]=3 10185 B12R2.1081 O[C@@H]1COCc2ccccc21 Amb22748516 [0,1,0,1,0,0|0,0,0]=2 10186 B12R2.1081 O[C@H]1CCCc2[n]cccc21 Amb24386952 [0,1,0,1,0,0|2,0,0]=4 10187 B12R2.1081 O[C@H]1CCCc2cc[n]cc21 Amb24340473 [0,1,0,1,0,0|2,0,0]=4 10188 B12R2.1081 O[C@H]1CCCc2ccc[n]c21 Amb24083650 [0,1,0,1,0,0|2,0,0]=4 10189 B12R2.1081 O[C@H]1CCCc2ccccc21 Amb22336192 [0,1,0,1,0,0|1,0,0]=3 10190 B12R2.1081 O[C@H]1CCOc2cc[n]cc21 Amb24579304 [0,1,0,1,0,0|1,0,0]=3 10191 B12R2.1081 O[C@H]1CCSc2c1cccc2 Amb13952926 [0,1,0,1,0,0|0,1,0]=3 10192 B12R2.1081 O[C@H]1CNCc2ccccc21 Amb24533225 [0,1,0,1,0,0|1,0,0]=3 10193 B12R2.1081 O[C@H]1COCc2ccccc21 Amb25748982 [0,1,0,1,0,0|0,0,0]=2 10194 B12R2.1081 Oc1c[n]cc2OCCCc21 Amb25201780 [0,1,0,1,0,0|2,0,0]=4 10195 B12R2.1081 Oc1cc[n]c2CCCOc21 Amb24455519 [0,1,0,1,0,0|2,0,0]=4 10196 B12R2.1081 Oc1cccc2CCCOc21 Amb25142441 [0,1,0,1,0,0|1,0,0]=3 10197 B12R2.1081 Oc1cccc2CCCSc21 Amb24715725 [0,1,0,1,0,0|1,1,0]=4 10198 B12R2.1081 Oc1cccc2NCCCc21 Amb18124994 [0,1,0,1,0,0|2,0,0]=4 10199 B12R2.1081 Oc1cccc2NCCNc21 Amb20080169 [0,1,0,1,0,0|2,0,0]=4 10200 B12R2.1081 Oc1cccc2OCC=Cc21 Amb18124878 [0,1,0,1,0,0|1,0,1]=4 10201 B12R2.1081 Oc1cccc2OCOCc21 Amb24566795 [0,1,0,1,0,0|2,0,0]=4 10202 B12R2.1081 Oc1cccc2c1CCCC2 Amb2041248 [0,1,0,1,0,0|2,0,0]=4 10203 B12R2.1081 Oc1cccc2c1NCCC2 Amb1057683 [0,1,0,1,0,0|2,0,0]=4 10204 B12R2.1081 Oc1cccc2c1OCCO2 Amb2548386 [0,1,0,1,0,0|0,0,0]=2 10205 B12R2.1081 Oc1ccnc2c1OCCO2 Amb13889680 [0,1,0,1,0,0|1,0,0]=3 10206 B12R2.1081 Sc1cccc2OCCOc21 Amb24688690 [0,1,0,1,0,0|0,0,0]=2 10207 B12R2.1081 [NH3+]C1CCCc2ccccc21 Amb24113843 [0,1,0,1,0,0|2,0,0]=4 10208 B12R2.1081 [NH3+]C1CCOc2ccccc21 Amb21862674 [0,1,0,1,0,0|1,0,0]=3 10209 B12R2.2028 C=C1CC(Cl)c2ccccc21 Amb24513606 [0,1,0,1,0,0|2,0,0]=4 10210 B12R2.2028 C=C1C[C@@H](O)c2ccccc21 Amb25149657 [0,1,0,1,0,0|1,0,0]=3 10211 B12R2.2028 CC1=CC(O)c2ccccc12 Amb17778893 [0,1,0,1,0,0|1,0,1]=4 10212 B12R2.2028 CC1CC(Br)c2ccccc21 Amb25131825 [0,1,0,1,0,0|2,0,0]=4 10213 B12R2.2028 CC1CC(N)c2ccccc21 Amb19373084 [0,1,0,1,0,0|2,0,0]=4 10214 B12R2.2028 CC1CC(O)c2cc[n]cc21 Amb25129412 [0,1,0,1,0,0|2,0,0]=4 10215 B12R2.2028 CC1CC(O)c2ccccc21 Amb25709313 [0,1,0,1,0,0|1,0,0]=3 10216 B12R2.2028 CC1CC(S)c2ccccc21 Amb24465175 [0,1,0,1,0,0|1,1,0]=4 10217 B12R2.2028 CC1CN(N)c2ccccc21 Amb24519067 [0,1,0,1,0,0|2,0,0]=4 10218 B12R2.2028 CN1CC(O)c2ccccc12 Amb24632103 [0,1,0,1,0,0|1,0,0]=3 10219 B12R2.2028 C[C@@H]1CC(=O)c2ccccc21 Amb24467053 [0,1,0,1,0,0|2,0,0]=4 10220 B12R2.2028 C[C@@H]1CC(O)c2ccccc21 Amb25188702 [0,1,0,1,0,0|1,0,0]=3 10221 B12R2.2028 C[C@@H]1C[C@@H](O)c2cc[n]cc21 Amb25102087 [0,1,0,1,0,0|2,0,0]=4 10222 B12R2.2028 C[C@@H]1C[C@H](Br)c2ccccc21 Amb24741831 [0,1,0,1,0,0|2,0,0]=4 10223 B12R2.2028 C[C@@H]1C[C@H](O)c2cc[n]cc21 Amb24694361 [0,1,0,1,0,0|2,0,0]=4 10224 B12R2.2028 C[C@H]1CC(=O)c2ccccc21 Amb25768595 [0,1,0,1,0,0|2,0,0]=4 10225 B12R2.2028 C[C@H]1CC(O)c2ccccc21 Amb24533800 [0,1,0,1,0,0|1,0,0]=3 10226 B12R2.2028 C[C@H]1C[C@@H](O)c2cc[n]cc21 Amb24601331 [0,1,0,1,0,0|2,0,0]=4 10227 B12R2.2028 C[C@H]1C[C@@H](O)c2ccccc21 Amb24740911 [0,1,0,1,0,0|1,0,0]=3 10228 B12R2.2028 N=C1CN(O)c2ccccc21 Amb24078909 [0,1,0,1,0,0|2,0,0]=4 10229 B12R2.2028 NC1CC(=O)c2ccccc21 Amb21955324 [0,1,0,1,0,0|2,0,0]=4 10230 B12R2.2028 NC1CC(F)c2ccccc21 Amb24117897 [0,1,0,1,0,0|2,0,0]=4 10231 B12R2.2028 NC1CC(F)c2ccccc21 Amb24361429 [0,1,0,1,0,0|2,0,0]=4 10232 B12R2.2028 N[C@@H]1CC(O)c2ccccc21 Amb25317541 [0,1,0,1,0,0|1,0,0]=3 10233 B12R2.2028 N[C@@H]1C[C@@H](O)c2ccccc21 Amb25213011 [0,1,0,1,0,0|1,0,0]=3 10234 B12R2.2028 N[C@@H]1C[C@H](O)c2ccccc21 Amb24657326 [0,1,0,1,0,0|1,0,0]=3 10235 B12R2.2028 N[C@H]1CC(O)c2ccccc21 Amb25716664 [0,1,0,1,0,0|1,0,0]=3 10236 B12R2.2028 O=C1CC(c2c1cccc2)Br Amb10068269 [0,1,0,1,0,0|2,0,0]=4 10237 B12R2.2028 O=C1CC(c2c1cccc2)N Amb17470381 [0,1,0,1,0,0|2,0,0]=4 10238 B12R2.2028 O=C1NC(c2c1cccc2)O Amb17593710 [0,1,0,1,0,0|2,0,0]=4 10239 B12R2.2028 O=C1OC(c2c1cccc2)O Amb10552913 [0,1,0,1,0,0|2,0,0]=4 10240 B12R2.2028 O=C1OC(c2c1cccc2)O Amb16226896 [0,1,0,1,0,0|2,0,0]=4 10241 B12R2.2028 OC1CC(=O)c2[n]cccc21 Amb22750353 [0,1,0,1,0,0|2,0,0]=4 10242 B12R2.2028 OC1CC(=O)c2c[n]ccc21 Amb24071455 [0,1,0,1,0,0|2,0,0]=4 10243 B12R2.2028 OC1CC(c2c1cccc2)N Amb17470387 [0,1,0,1,0,0|1,0,0]=3 10244 B12R2.2028 OC1CC(c2c1cccc2)O Amb1110942 [0,1,0,1,0,0|1,0,0]=3 10245 B12R2.2028 OC1NC(O)c2ccccc21 Amb24441685 [0,1,0,1,0,0|2,0,0]=4 10246 B12R2.2028 OC1OS(=O)c2ccccc21 Amb25234822 [0,1,0,1,0,0|1,1,0]=4 10247 B12R2.2028 ON1CC(=O)c2ccccc12 Amb24078911 [0,1,0,1,0,0|2,0,0]=4 10248 B12R2.2028 O[C@@H]1CC(=O)c2ccccc21 Amb24724027 [0,1,0,1,0,0|1,0,0]=3 10249 B12R2.2028 O[C@H]1CC(=O)c2ccccc21 Amb25188743 [0,1,0,1,0,0|1,0,0]=3 10250 B12R2.2028 O[C@H]1C[C@@H](O)c2ccccc12 Amb17938072 [0,1,0,1,0,0|1,0,0]=3 10251 B12R2.2028 O[C@H]1C[C@@H](c2c1cccc2)O Amb10068281 [0,1,0,1,0,0|1,0,0]=3 10252 B12R2.2047 CC1C(CO)c2ccccc21 Amb24541544 [0,1,0,1,0,0|1,0,0]=3 10253 B12R2.2075 BrC(C1CC1)c2ccccc2 Amb25205179 [0,1,0,1,0,0|2,0,0]=4 10254 B12R2.2075 ClC(C1CC1)c2ccccc2 Amb18792883 [0,1,0,1,0,0|2,0,0]=4 10255 B12R2.2075 FC(C1CO1)c2ccccc2 Amb24611783 [0,1,0,1,0,0|1,0,0]=3 10256 B12R2.2075 NC(c1ccccc1)C2CC2 Amb2371625 [0,1,0,1,0,0|2,0,0]=4 10257 B12R2.2075 N[C@@H](C1CC1)c2ccccc2 Amb22406367 [0,1,0,1,0,0|2,0,0]=4 10258 B12R2.2075 N[C@@H](C1CC1)c2ccccc2 Amb22744981 [0,1,0,1,0,0|2,0,0]=4 10259 B12R2.2075 N[C@H](C1CC1)c2ccccc2 Amb22406366 [0,1,0,1,0,0|2,0,0]=4 10260 B12R2.2075 O=C(C1CO1)c2ccccc2 Amb24376086 [0,1,0,1,0,0|1,0,0]=3 10261 B12R2.2075 O=C([C@@H]1CO1)c2ccccc2 Amb25735777 [0,1,0,1,0,0|1,0,0]=3 10262 B12R2.2075 O[C@@H]([C@H]1CO1)c2ccccc2 Amb24700386 [0,1,0,1,0,0|1,0,0]=3 10263 B12R2.2075 O[C@H](C1CC1)c2ccccc2 Amb25260486 [0,1,0,1,0,0|2,0,0]=4 10264 B12R2.2075 O[C@H]([C@@H]1CO1)c2ccccc2 Amb24718405 [0,1,0,1,0,0|1,0,0]=3 10265 B12R2.2075 SC(C1CC1)c2ccccc2 Amb18788326 [0,1,0,1,0,0|2,0,0]=4 10266 B12R2.32 BrCC1Cc2c(O1)cccc2 Amb17040446 [0,1,0,1,0,0|1,0,0]=3 10267 B12R2.32 BrCC1Cc2ccccc2C1 Amb22235471 [0,1,0,1,0,0|2,0,0]=4 10268 B12R2.32 BrC[C@H]1Cc2ccccc2O1 Amb25695955 [0,1,0,1,0,0|1,0,0]=3 10269 B12R2.32 BrCc1[n]c2ccccc2o1 Amb21856130 [0,1,0,1,0,0|1,0,1]=4 10270 B12R2.32 CCC1Nc2ccccc2N1 Amb25374201 [0,1,0,1,0,0|2,0,0]=4 10271 B12R2.32 CCC1Nc2ccccc2S1 Amb24086400 [0,1,0,1,0,0|1,1,0]=4 10272 B12R2.32 CCC1Oc2ccccc2O1 Amb24485882 [0,1,0,1,0,0|1,0,0]=3 10273 B12R2.32 CC[b]1oc2ccccc2o1 Amb25062092 [0,1,0,1,0,0|2,0,0]=4 10274 B12R2.32 COC1Cc2ccccc2O1 Amb24084536 [0,1,0,1,0,0|2,0,0]=4 10275 B12R2.32 COC1Oc2ccccc2O1 Amb24753207 [0,1,0,1,0,0|2,0,0]=4 10276 B12R2.32 ClCC1Cc2ccccc2S1 Amb24688554 [0,1,0,1,0,0|1,1,0]=4 10277 B12R2.32 ClCC1Sc2ccccc2S1 Amb25063644 [0,1,0,1,0,0|1,1,0]=4 10278 B12R2.32 FCC1Cc2ccccc2N1 Amb25276456 [0,1,0,1,0,0|2,0,0]=4 10279 B12R2.32 FC[C@@H]1Cc2ccccc2N1 Amb25041577 [0,1,0,1,0,0|2,0,0]=4 10280 B12R2.32 FCc1[n]c2ccccc2o1 Amb24101298 [0,1,0,1,0,0|1,0,1]=4 10281 B12R2.32 FCc1cc2ccccc2o1 Amb24627366 [0,1,0,1,0,0|1,0,1]=4 10282 B12R2.32 ICC1Cc2ccccc2N1 Amb24061262 [0,1,0,1,0,0|2,0,0]=4 10283 B12R2.32 ICC1Cc2ccccc2O1 Amb23513694 [0,1,0,1,0,0|1,0,0]=3 10284 B12R2.32 ICc1[n]c2ccccc2o1 Amb25731165 [0,1,0,1,0,0|1,0,1]=4 10285 B12R2.32 N#CC1Cc2ccccc2O1 Amb24384661 [0,1,0,1,0,0|1,0,1]=4 10286 B12R2.32 NCC1Cc2c(O1)cccc2 Amb1088943 [0,1,0,1,0,0|1,0,0]=3 10287 B12R2.32 NCC1Cc2ccccc2C1 Amb19287049 [0,1,0,1,0,0|2,0,0]=4 10288 B12R2.32 NCC1Nc2ccccc2N1 Amb24334873 [0,1,0,1,0,0|2,0,0]=4 10289 B12R2.32 NCC1Oc2ccccc2O1 Amb24060644 [0,1,0,1,0,0|1,0,0]=3 10290 B12R2.32 NCc1nc2c(o1)cccc2 Amb1102725 [0,1,0,1,0,0|1,0,1]=4 10291 B12R2.32 OCC1C=C2C=CC=CC2=C1 Amb25151986 [0,1,0,1,0,0|1,0,0]=3 10292 B12R2.32 OCC1Cc2[n]cccc2N1 Amb25311460 [0,1,0,1,0,0|2,0,0]=4 10293 B12R2.32 OCC1Cc2c[n]ccc2C1 Amb24071780 [0,1,0,1,0,0|2,0,0]=4 10294 B12R2.32 OCC1Cc2ccc[n]c2C1 Amb25141923 [0,1,0,1,0,0|2,0,0]=4 10295 B12R2.32 OCC1Cc2ccccc2C1 Amb19516120 [0,1,0,1,0,0|1,0,0]=3 10296 B12R2.32 OCC1Cc2ccccc2S1 Amb24513744 [0,1,0,1,0,0|0,1,0]=3 10297 B12R2.32 OCC1Oc2ccc[n]c2O1 Amb24060666 [0,1,0,1,0,0|1,0,0]=3 10298 B12R2.32 OCC1Oc2ccccc2O1 Amb24060645 [0,1,0,1,0,0|0,0,0]=2 10299 B12R2.32 OCC=1Cc2ccccc2C1 Amb22494117 [0,1,0,1,0,0|1,0,1]=4 10300 B12R2.32 OC[C@@H]1Cc2ccc[n]c2C1 Amb24068721 [0,1,0,1,0,0|2,0,0]=4 10301 B12R2.32 OC[C@@H]1Cc2ccccc2N1 Amb22336386 [0,1,0,1,0,0|1,0,0]=3 10302 B12R2.32 OC[C@H]1Cc2ccccc2N1 Amb24746775 [0,1,0,1,0,0|1,0,0]=3 10303 B12R2.32 OCc1cc2c(o1)cccc2 Amb1156663 [0,1,0,1,0,0|0,0,1]=3 10304 B12R2.32 OCc1cc2c(o1)cccn2 Amb13890155 [0,1,0,1,0,0|1,0,1]=4 10305 B12R2.32 OCc1cc2c[n]ccc2o1 Amb23536096 [0,1,0,1,0,0|1,0,1]=4 10306 B12R2.32 OCc1cc2cc[n]cc2o1 Amb24081789 [0,1,0,1,0,0|1,0,1]=4 10307 B12R2.32 OCc1cc2ccc[n]c2o1 Amb24081775 [0,1,0,1,0,0|1,0,1]=4 10308 B12R2.32 ONC1Nc2ccccc2O1 Amb24523067 [0,1,0,1,0,0|1,0,0]=3 10309 B12R2.32 O\N=C/1\Cc2ccccc2O1 Amb24727728 [0,1,0,1,0,0|1,0,1]=4 10310 B12R2.32 SCC1Cc2ccccc2S1 Amb25149129 [0,1,0,1,0,0|0,2,0]=4 10311 B12R2.32 SCc1[n]c2ccccc2o1 Amb25232011 [0,1,0,1,0,0|0,1,1]=4 10312 B12R2.115 BrC1CC1c2ccccc2I Amb25150585 [0,1,0,1,0,0|2,0,0]=4 10313 B12R2.115 Brc1ccccc1C2CC2Br Amb23454930 [0,1,0,1,0,0|2,0,0]=4 10314 B12R2.115 CC1CC1c2ccccc2Br Amb23247715 [0,1,0,1,0,0|2,0,0]=4 10315 B12R2.115 CC1CC1c2ccccc2N Amb24378033 [0,1,0,1,0,0|2,0,0]=4 10316 B12R2.115 C[C@@H]1C[C@H]1c2ccccc2N Amb24581604 [0,1,0,1,0,0|2,0,0]=4 10317 B12R2.115 C[C@@H]1C[C@H]1c2ccccc2O Amb25373423 [0,1,0,1,0,0|2,0,0]=4 10318 B12R2.115 C[C@H]1C[C@@H]1c2ccccc2N Amb25228469 [0,1,0,1,0,0|2,0,0]=4 10319 B12R2.115 C[C@H]1C[C@H]1c2ccccc2N Amb24514820 [0,1,0,1,0,0|2,0,0]=4 10320 B12R2.115 Cc1ccccc1C2CC2Br Amb24484845 [0,1,0,1,0,0|2,0,0]=4 10321 B12R2.115 Cc1ccccc1C2CC2N Amb19374843 [0,1,0,1,0,0|2,0,0]=4 10322 B12R2.115 Cc1ccccc1C2CC2O Amb24526800 [0,1,0,1,0,0|1,0,0]=3 10323 B12R2.115 Cc1ccccc1[C@@H]2C[C@@H]2Br Amb24718273 [0,1,0,1,0,0|2,0,0]=4 10324 B12R2.115 Cc1ccccc1[C@@H]2C[C@@H]2Cl Amb25176073 [0,1,0,1,0,0|2,0,0]=4 10325 B12R2.115 Cc1ccccc1[C@@H]2C[C@H]2Br Amb24624562 [0,1,0,1,0,0|2,0,0]=4 10326 B12R2.115 Cc1ccccc1[C@@H]2C[C@H]2Cl Amb24540820 [0,1,0,1,0,0|2,0,0]=4 10327 B12R2.115 Cc1ccccc1[C@@H]2C[C@H]2N Amb24560305 [0,1,0,1,0,0|2,0,0]=4 10328 B12R2.115 Clc1ccccc1C2CC2Br Amb23454909 [0,1,0,1,0,0|2,0,0]=4 10329 B12R2.115 Fc1ccccc1C2CC2Br Amb23454901 [0,1,0,1,0,0|2,0,0]=4 10330 B12R2.115 NC1CC1c2ccccc2Br Amb19373270 [0,1,0,1,0,0|2,0,0]=4 10331 B12R2.115 NC1CC1c2ccccc2Cl Amb19346493 [0,1,0,1,0,0|2,0,0]=4 10332 B12R2.115 NC1CC1c2ccccc2F Amb19514922 [0,1,0,1,0,0|2,0,0]=4 10333 B12R2.115 NC1CC1c2ccccc2O Amb25223496 [0,1,0,1,0,0|2,0,0]=4 10334 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2Cl Amb25095403 [0,1,0,1,0,0|2,0,0]=4 10335 B12R2.196 CC1CCc2c(O)cccc21 Amb24099162 [0,1,0,1,0,0|2,0,0]=4 10336 B12R2.196 CC1CNc2c(Cl)cccc21 Amb18063135 [0,1,0,1,0,0|2,0,0]=4 10337 B12R2.196 CC1CNc2c(F)cccc21 Amb18063405 [0,1,0,1,0,0|2,0,0]=4 10338 B12R2.196 CC1CNc2c1cccc2C Amb17040659 [0,1,0,1,0,0|2,0,0]=4 10339 B12R2.196 Cc1cc[n]c2C(O)CCc21 Amb25151969 [0,1,0,1,0,0|2,0,0]=4 10340 B12R2.196 Cc1cc[n]c2[C@H](O)CCc21 Amb25077951 [0,1,0,1,0,0|2,0,0]=4 10341 B12R2.196 Cc1cccc2C(Br)CCc21 Amb25319083 [0,1,0,1,0,0|2,0,0]=4 10342 B12R2.196 Cc1cccc2C(N)CCc21 Amb19514831 [0,1,0,1,0,0|2,0,0]=4 10343 B12R2.196 Cc1cccc2C(O)COc21 Amb24431963 [0,1,0,1,0,0|0,0,0]=2 10344 B12R2.196 Cc1cccc2[C@@H](N)CCc21 Amb25145813 [0,1,0,1,0,0|2,0,0]=4 10345 B12R2.196 Cc1cccc2[C@@H](N)COc21 Amb24589207 [0,1,0,1,0,0|1,0,0]=3 10346 B12R2.196 Cc1cccc2[C@H](N)COc21 Amb25689740 [0,1,0,1,0,0|1,0,0]=3 10347 B12R2.196 ClC1CCc2c(Br)cccc21 Amb22059235 [0,1,0,1,0,0|2,0,0]=4 10348 B12R2.196 ClC1CCc2c1cccc2C Amb17087981 [0,1,0,1,0,0|2,0,0]=4 10349 B12R2.196 ClC1CCc2c1cccc2Cl Amb17087984 [0,1,0,1,0,0|2,0,0]=4 10350 B12R2.196 ClC1CCc2c1cccc2F Amb17087983 [0,1,0,1,0,0|2,0,0]=4 10351 B12R2.196 Fc1cccc2C(Br)CCc21 Amb20623563 [0,1,0,1,0,0|2,0,0]=4 10352 B12R2.196 Fc1cccc2C(F)CCc12 Amb24514103 [0,1,0,1,0,0|2,0,0]=4 10353 B12R2.196 NC1CCc2c(Br)cccc21 Amb19342600 [0,1,0,1,0,0|2,0,0]=4 10354 B12R2.196 NC1CCc2c(I)cccc21 Amb25691610 [0,1,0,1,0,0|2,0,0]=4 10355 B12R2.196 NC1CCc2c1cccc2Cl Amb10609924 [0,1,0,1,0,0|2,0,0]=4 10356 B12R2.196 NC1CCc2c1cccc2Cl Amb2383228 [0,1,0,1,0,0|2,0,0]=4 10357 B12R2.196 NC1CCc2c1cccc2F Amb10609944 [0,1,0,1,0,0|2,0,0]=4 10358 B12R2.196 NC1CCc2c1cccc2F Amb2383229 [0,1,0,1,0,0|2,0,0]=4 10359 B12R2.196 NC1COc2c(Cl)[n]ccc21 Amb24672743 [0,1,0,1,0,0|2,0,0]=4 10360 B12R2.196 NC1COc2c(Cl)cccc21 Amb20626374 [0,1,0,1,0,0|1,0,0]=3 10361 B12R2.196 NC1COc2c(F)cccc21 Amb22586304 [0,1,0,1,0,0|1,0,0]=3 10362 B12R2.196 NC1COc2c(S)cccc21 Amb24533042 [0,1,0,1,0,0|1,0,0]=3 10363 B12R2.196 NC1COc2c1cccc2Cl Amb2383238 [0,1,0,1,0,0|1,0,0]=3 10364 B12R2.196 NC1COc2c1cccc2F Amb2383239 [0,1,0,1,0,0|1,0,0]=3 10365 B12R2.196 N[C@@H]1CCc2c(Br)cccc21 Amb22288665 [0,1,0,1,0,0|2,0,0]=4 10366 B12R2.196 N[C@@H]1CCc2c(F)cccc21 Amb22288666 [0,1,0,1,0,0|2,0,0]=4 10367 B12R2.196 N[C@@H]1CCc2c(F)cccc21 Amb22746050 [0,1,0,1,0,0|2,0,0]=4 10368 B12R2.196 N[C@@H]1CCc2c(I)cccc21 Amb25697307 [0,1,0,1,0,0|2,0,0]=4 10369 B12R2.196 N[C@@H]1CCc2c(S)cccc21 Amb24484494 [0,1,0,1,0,0|2,0,0]=4 10370 B12R2.196 N[C@@H]1CCc2c1cccc2Cl Amb13953028 [0,1,0,1,0,0|2,0,0]=4 10371 B12R2.196 N[C@@H]1COc2c(Br)cccc21 Amb25055297 [0,1,0,1,0,0|1,0,0]=3 10372 B12R2.196 N[C@@H]1COc2c(F)cccc21 Amb25060202 [0,1,0,1,0,0|1,0,0]=3 10373 B12R2.196 N[C@@H]1COc2c(I)cccc21 Amb24561110 [0,1,0,1,0,0|1,0,0]=3 10374 B12R2.196 N[C@@H]1COc2c(O)cccc21 Amb25837299 [0,1,0,1,0,0|1,0,0]=3 10375 B12R2.196 N[C@@H]1COc2c(S)cccc21 Amb24484516 [0,1,0,1,0,0|1,0,0]=3 10376 B12R2.196 N[C@H]1CCc2c(Br)cccc21 Amb22288709 [0,1,0,1,0,0|2,0,0]=4 10377 B12R2.196 N[C@H]1CCc2c(F)cccc21 Amb22388651 [0,1,0,1,0,0|2,0,0]=4 10378 B12R2.196 N[C@H]1CCc2c1cccc2Cl Amb13953027 [0,1,0,1,0,0|2,0,0]=4 10379 B12R2.196 N[C@H]1CCc2c1cccc2F Amb16233799 [0,1,0,1,0,0|2,0,0]=4 10380 B12R2.196 N[C@H]1COc2c(S)cccc21 Amb25791602 [0,1,0,1,0,0|1,0,0]=3 10381 B12R2.196 Nc1cccc2C(=O)COc21 Amb18202194 [0,1,0,1,0,0|0,0,2]=4 10382 B12R2.196 Nc1cccc2C(N)CCc12 Amb24436510 [0,1,0,1,0,0|2,0,0]=4 10383 B12R2.196 Nc1cccc2C(N)COc12 Amb24671202 [0,1,0,1,0,0|1,0,0]=3 10384 B12R2.196 Nc1cccc2[C@H](N)COc12 Amb24484515 [0,1,0,1,0,0|1,0,0]=3 10385 B12R2.196 O=C1COc2c1cccc2Cl Amb2383545 [0,1,0,1,0,0|0,0,2]=4 10386 B12R2.196 O=C1COc2c1cccc2F Amb2383546 [0,1,0,1,0,0|0,0,2]=4 10387 B12R2.196 OC1CCc2c(Br)cccc21 Amb20171517 [0,1,0,1,0,0|1,0,0]=3 10388 B12R2.196 OC1CCc2c(Cl)cc[n]c21 Amb19957874 [0,1,0,1,0,0|2,0,0]=4 10389 B12R2.196 OC1CCc2c1cccc2C Amb17087931 [0,1,0,1,0,0|1,0,0]=3 10390 B12R2.196 OC1CCc2c1cccc2Cl Amb17087934 [0,1,0,1,0,0|1,0,0]=3 10391 B12R2.196 OC1CCc2c1cccc2F Amb17087933 [0,1,0,1,0,0|1,0,0]=3 10392 B12R2.196 OC1COc2c(Br)cccc21 Amb22751583 [0,1,0,1,0,0|0,0,0]=2 10393 B12R2.196 OC1COc2c(F)cccc21 Amb24504909 [0,1,0,1,0,0|0,0,0]=2 10394 B12R2.196 OC1CSc2c(Cl)cccc21 Amb25356310 [0,1,0,1,0,0|0,1,0]=3 10395 B12R2.196 OC1OCc2c(F)cccc21 Amb25266840 [0,1,0,1,0,0|2,0,0]=4 10396 B12R2.196 O[C@@H]1CCc2c(Br)cccc21 Amb22756414 [0,1,0,1,0,0|1,0,0]=3 10397 B12R2.196 O[C@@H]1CCc2c(F)cccc21 Amb24432762 [0,1,0,1,0,0|1,0,0]=3 10398 B12R2.196 O[C@@H]1CCc2c1cccc2Cl Amb13953026 [0,1,0,1,0,0|1,0,0]=3 10399 B12R2.196 O[C@H]1CCc2c1cccc2Cl Amb13953025 [0,1,0,1,0,0|1,0,0]=3 10400 B12R2.196 Oc1cccc2C(=O)COc21 Amb22490978 [0,1,0,1,0,0|0,0,2]=4 10401 B12R2.196 Oc1cccc2C(F)CCc21 Amb24511704 [0,1,0,1,0,0|2,0,0]=4 10402 B12R2.196 Oc1cccc2C(O)CCc12 Amb18179372 [0,1,0,1,0,0|1,0,0]=3 10403 B12R2.196 Oc1cccc2C(O)COc12 Amb24388501 [0,1,0,1,0,0|0,0,0]=2 10404 B12R2.196 Oc1cccc2[C@@H](O)CCc12 Amb25032411 [0,1,0,1,0,0|1,0,0]=3 10405 B12R2.196 Oc1cccc2c1occ2O Amb24061734 [0,1,0,1,0,0|0,0,2]=4 10406 B12R2.196 SC1CCc2c(Br)cccc21 Amb24352616 [0,1,0,1,0,0|1,1,0]=4 10407 B12R2.225 Brc1ccccc1OC2CC2 Amb25771923 [0,1,0,1,0,0|1,0,0]=3 10408 B12R2.225 Cc1[n]cccc1OC2CC2 Amb24636775 [0,1,0,1,0,0|2,0,0]=4 10409 B12R2.225 Cc1c[n]ccc1OC2CC2 Amb24415288 [0,1,0,1,0,0|2,0,0]=4 10410 B12R2.225 Cc1cc[n]cc1CC2CO2 Amb25784408 [0,1,0,1,0,0|2,0,0]=4 10411 B12R2.225 Cc1ccc[n]c1OC2CC2 Amb25219964 [0,1,0,1,0,0|2,0,0]=4 10412 B12R2.225 Cc1ccccc1CC2CO2 Amb25122222 [0,1,0,1,0,0|1,0,0]=3 10413 B12R2.225 Cc1ccccc1SC2CC2 Amb25149493 [0,1,0,1,0,0|1,1,0]=4 10414 B12R2.225 Clc1ccccc1CC2CO2 Amb25094935 [0,1,0,1,0,0|1,0,0]=3 10415 B12R2.225 Clc1ccccc1NC2CC2 Amb18267914 [0,1,0,1,0,0|2,0,0]=4 10416 B12R2.225 Fc1ccccc1NC2CC2 Amb18930891 [0,1,0,1,0,0|2,0,0]=4 10417 B12R2.225 Fc1ccccc1SC2CC2 Amb24717992 [0,1,0,1,0,0|1,1,0]=4 10418 B12R2.225 Ic1[n]cccc1OC2CC2 Amb25291966 [0,1,0,1,0,0|2,0,0]=4 10419 B12R2.225 Ic1ccccc1NC2CC2 Amb25213888 [0,1,0,1,0,0|2,0,0]=4 10420 B12R2.225 Nc1[n]cccc1OC2CC2 Amb24565242 [0,1,0,1,0,0|2,0,0]=4 10421 B12R2.225 Nc1cc[n]cc1OC2CC2 Amb25295329 [0,1,0,1,0,0|2,0,0]=4 10422 B12R2.225 Nc1ccccc1CC2CC2 Amb24117001 [0,1,0,1,0,0|2,0,0]=4 10423 B12R2.225 Nc1ccccc1SC2CC2 Amb25302953 [0,1,0,1,0,0|1,1,0]=4 10424 B12R2.225 O=C1C=CC=CN1CC2CO2 Amb18181684 [0,1,0,1,0,0|2,0,0]=4 10425 B12R2.225 O=C1C=CC=CN1C[C@H]2CO2 Amb24501797 [0,1,0,1,0,0|2,0,0]=4 10426 B12R2.225 Oc1ccccc1CC2CC2 Amb22752448 [0,1,0,1,0,0|2,0,0]=4 10427 B12R2.225 Oc1ccccc1CC2CO2 Amb24364096 [0,1,0,1,0,0|1,0,0]=3 10428 B12R2.225 Oc1ccccc1C[C@@H]2CO2 Amb24724020 [0,1,0,1,0,0|1,0,0]=3 10429 B12R2.225 Oc1ccccc1SC2CC2 Amb25287926 [0,1,0,1,0,0|1,1,0]=4 10430 B12R2.517 Brc1ccccc1C2CCC2 Amb20617096 [0,1,0,1,0,0|2,0,0]=4 10431 B12R2.517 Brc1ccccc1C2CCN2 Amb22054565 [0,1,0,1,0,0|2,0,0]=4 10432 B12R2.517 Brc1ccccc1N2CCC2 Amb25247790 [0,1,0,1,0,0|2,0,0]=4 10433 B12R2.517 Brc1ccccc1[C@@H]2CCN2 Amb25301204 [0,1,0,1,0,0|2,0,0]=4 10434 B12R2.517 Brc1ccccc1[C@H]2CCN2 Amb25805155 [0,1,0,1,0,0|2,0,0]=4 10435 B12R2.517 Cc1ccccc1[C@@H]2CCN2 Amb24446967 [0,1,0,1,0,0|2,0,0]=4 10436 B12R2.517 Cc1ccccc1[C@H]2CCN2 Amb25694410 [0,1,0,1,0,0|2,0,0]=4 10437 B12R2.517 Clc1ccccc1C2CCN2 Amb23555564 [0,1,0,1,0,0|2,0,0]=4 10438 B12R2.517 Clc1ccccc1[C@@H]2CCN2 Amb25840853 [0,1,0,1,0,0|2,0,0]=4 10439 B12R2.517 Fc1ccccc1C2CCN2 Amb20623300 [0,1,0,1,0,0|2,0,0]=4 10440 B12R2.517 Fc1ccccc1C2CCN2 Amb22059455 [0,1,0,1,0,0|2,0,0]=4 10441 B12R2.517 Fc1ccccc1[C@@H]2CCN2 Amb25145827 [0,1,0,1,0,0|2,0,0]=4 10442 B12R2.517 Ic1ccccc1C2CCN2 Amb25047375 [0,1,0,1,0,0|2,0,0]=4 10443 B12R2.517 Ic1ccccc1[C@@H]2CCN2 Amb25858528 [0,1,0,1,0,0|2,0,0]=4 10444 B12R2.517 Ic1ccccc1[C@H]2CCN2 Amb25116697 [0,1,0,1,0,0|2,0,0]=4 10445 B12R2.517 Nc1ccccc1C2CCC2 Amb20617097 [0,1,0,1,0,0|2,0,0]=4 10446 B12R2.517 Nc1ccccc1C2CCN2 Amb24484457 [0,1,0,1,0,0|2,0,0]=4 10447 B12R2.517 Nc1ccccc1N2CCC2 Amb25824180 [0,1,0,1,0,0|2,0,0]=4 10448 B12R2.517 Oc1ccccc1C2CCC2 Amb20617098 [0,1,0,1,0,0|2,0,0]=4 10449 B12R2.517 Oc1ccccc1C2CCN2 Amb24715881 [0,1,0,1,0,0|2,0,0]=4 10450 B12R2.517 Oc1ccccc1[C@H]2CCN2 Amb25111618 [0,1,0,1,0,0|2,0,0]=4 10451 B12R2.517 Sc1ccccc1[C@@H]2CCN2 Amb25736329 [0,1,0,1,0,0|2,0,0]=4 10452 B12R2.517 Sc1ccccc1[C@H]2CCN2 Amb25152747 [0,1,0,1,0,0|2,0,0]=4 10453 B12R2.80 Brc1cccc(c1)C2CC2Br Amb23454931 [0,1,0,1,0,0|2,0,0]=4 10454 B12R2.80 CC1CC1c2cc(O)ccc2 Amb24662408 [0,1,0,1,0,0|2,0,0]=4 10455 B12R2.80 Cc1cc(ccc1)[C@@H]2C[C@@H]2Br Amb24519928 [0,1,0,1,0,0|2,0,0]=4 10456 B12R2.80 Cc1cc(ccc1)[C@@H]2C[C@H]2N Amb24100230 [0,1,0,1,0,0|2,0,0]=4 10457 B12R2.80 Clc1cc(ccc1)C2CC2Br Amb23454924 [0,1,0,1,0,0|2,0,0]=4 10458 B12R2.80 Fc1cc(ccc1)C2CC2Br Amb23454927 [0,1,0,1,0,0|2,0,0]=4 10459 B12R2.80 Fc1cc(ccc1)[C@@H]2C[C@@H]2Br Amb24671390 [0,1,0,1,0,0|2,0,0]=4 10460 B12R2.80 NC1CC1c2cc(Br)ccc2 Amb19346489 [0,1,0,1,0,0|2,0,0]=4 10461 B12R2.80 NC1CC1c2cc(Cl)ccc2 Amb19374842 [0,1,0,1,0,0|2,0,0]=4 10462 B12R2.80 NC1CC1c2cc(F)ccc2 Amb19514818 [0,1,0,1,0,0|2,0,0]=4 10463 B12R2.80 NC1CC1c2cccc(c2)O Amb17568188 [0,1,0,1,0,0|2,0,0]=4 10464 B12R2.80 N[C@@H]1C[C@H]1c2cc(Br)ccc2 Amb25307909 [0,1,0,1,0,0|2,0,0]=4 10465 B12R2.80 N[C@@H]1C[C@H]1c2cc(Cl)ccc2 Amb25683521 [0,1,0,1,0,0|2,0,0]=4 10466 B12R2.80 N[C@@H]1C[C@H]1c2cc(F)ccc2 Amb24100228 [0,1,0,1,0,0|2,0,0]=4 10467 B12R2.80 N[C@H]1C[C@@H]1c2cc(F)ccc2 Amb24552874 [0,1,0,1,0,0|2,0,0]=4 10468 B12R2.80 OC1CC1c2cc(F)ccc2 Amb24756969 [0,1,0,1,0,0|1,0,0]=3 10469 B12R2.203 CC1CCc2cccc(N)c21 Amb24654837 [0,1,0,1,0,0|2,0,0]=4 10470 B12R2.203 CC1CCc2cccc(O)c21 Amb24631584 [0,1,0,1,0,0|2,0,0]=4 10471 B12R2.203 CC1CNc2cccc(F)c21 Amb24596681 [0,1,0,1,0,0|2,0,0]=4 10472 B12R2.203 CC1CNc2cccc(O)c21 Amb18124995 [0,1,0,1,0,0|2,0,0]=4 10473 B12R2.203 CC1COc2cccc(N)c21 Amb25694320 [0,1,0,1,0,0|1,0,0]=3 10474 B12R2.203 Cc1cccc2CCC(F)c21 Amb25207950 [0,1,0,1,0,0|2,0,0]=4 10475 B12R2.203 Cc1cccc2CCC(O)c21 Amb22886909 [0,1,0,1,0,0|1,0,0]=3 10476 B12R2.203 Cc1cccc2CC[C@@H](N)c21 Amb24398373 [0,1,0,1,0,0|2,0,0]=4 10477 B12R2.203 Cc1cccc2CC[C@@H](O)c21 Amb25032595 [0,1,0,1,0,0|1,0,0]=3 10478 B12R2.203 Cc1cccc2CC[C@H](O)c21 Amb24412154 [0,1,0,1,0,0|1,0,0]=3 10479 B12R2.203 Cc1cccc2OCC(=O)c21 Amb18202264 [0,1,0,1,0,0|0,0,2]=4 10480 B12R2.203 Cc1cccc2o[n]c(O)c21 Amb21857266 [0,1,0,1,0,0|1,0,1]=4 10481 B12R2.203 NC1CCc2cccc(Br)c21 Amb24667972 [0,1,0,1,0,0|2,0,0]=4 10482 B12R2.203 NC1CCc2cccc(F)c21 Amb25279315 [0,1,0,1,0,0|2,0,0]=4 10483 B12R2.203 NC1CCc2cccc(O)c21 Amb25800015 [0,1,0,1,0,0|2,0,0]=4 10484 B12R2.203 NC1CCc2cccc(S)c21 Amb25702433 [0,1,0,1,0,0|2,0,0]=4 10485 B12R2.203 NC1COc2cccc(Br)c21 Amb24428244 [0,1,0,1,0,0|1,0,0]=3 10486 B12R2.203 N[C@@H]1CCc2cccc(Cl)c21 Amb25073529 [0,1,0,1,0,0|2,0,0]=4 10487 B12R2.203 N[C@@H]1CCc2cccc(I)c21 Amb25685478 [0,1,0,1,0,0|2,0,0]=4 10488 B12R2.203 N[C@@H]1CCc2cccc(O)c21 Amb24700449 [0,1,0,1,0,0|2,0,0]=4 10489 B12R2.203 N[C@@H]1COc2cccc(Cl)c21 Amb25335511 [0,1,0,1,0,0|1,0,0]=3 10490 B12R2.203 N[C@@H]1COc2cccc(F)c21 Amb24377677 [0,1,0,1,0,0|1,0,0]=3 10491 B12R2.203 N[C@@H]1COc2cccc(I)c21 Amb24663226 [0,1,0,1,0,0|1,0,0]=3 10492 B12R2.203 N[C@H]1CCc2cccc(Br)c21 Amb24728314 [0,1,0,1,0,0|2,0,0]=4 10493 B12R2.203 N[C@H]1CCc2cccc(I)c21 Amb25780692 [0,1,0,1,0,0|2,0,0]=4 10494 B12R2.203 N[C@H]1CCc2cccc(O)c21 Amb25068419 [0,1,0,1,0,0|2,0,0]=4 10495 B12R2.203 N[C@H]1CCc2cccc(S)c21 Amb24726197 [0,1,0,1,0,0|2,0,0]=4 10496 B12R2.203 N[C@H]1COc2cccc(Br)c21 Amb25322414 [0,1,0,1,0,0|1,0,0]=3 10497 B12R2.203 N[C@H]1COc2cccc(I)c21 Amb25147881 [0,1,0,1,0,0|1,0,0]=3 10498 B12R2.203 N[C@H]1COc2cccc(O)c21 Amb25152826 [0,1,0,1,0,0|1,0,0]=3 10499 B12R2.203 Nc1cccc2CC[C@@H](N)c12 Amb25066858 [0,1,0,1,0,0|2,0,0]=4 10500 B12R2.203 Nc1cccc2OC[C@@H](N)c12 Amb25277392 [0,1,0,1,0,0|1,0,0]=3 10501 B12R2.203 O=C1COc2c1c(Br)ccc2 Amb16233082 [0,1,0,1,0,0|0,0,2]=4 10502 B12R2.203 O=C1COc2c1c(F)ccc2 Amb10840768 [0,1,0,1,0,0|0,0,2]=4 10503 B12R2.203 O=C1COc2cccc(Cl)c21 Amb18199151 [0,1,0,1,0,0|0,0,2]=4 10504 B12R2.203 O=C1COc2cccc(I)c21 Amb21964893 [0,1,0,1,0,0|0,0,2]=4 10505 B12R2.203 OC1CCC2=CC=CC(=O)N21 Amb25734398 [0,1,0,1,0,0|2,0,0]=4 10506 B12R2.203 OC1CCc2cccc(Br)c21 Amb24439435 [0,1,0,1,0,0|1,0,0]=3 10507 B12R2.203 OC1COc2cccc(Cl)c21 Amb25806676 [0,1,0,1,0,0|0,0,0]=2 10508 B12R2.203 OC1CSc2cccc(Cl)c21 Amb24386853 [0,1,0,1,0,0|0,1,0]=3 10509 B12R2.203 Oc1ccc[n+]2CCC(O)c21 Amb25156843 [0,1,0,1,0,0|2,0,0]=4 10510 B12R2.203 Oc1cccc2CCC(O)c12 Amb18125105 [0,1,0,1,0,0|1,0,0]=3 10511 B12R2.203 Oc1cccc2CC[C@@H](O)c12 Amb24449232 [0,1,0,1,0,0|1,0,0]=3 10512 B12R2.203 Oc1cccc2CC[C@H](O)c12 Amb24746238 [0,1,0,1,0,0|1,0,0]=3 10513 B12R2.203 Oc1cccc2OCC(=O)c21 Amb18125055 [0,1,0,1,0,0|0,0,2]=4 10514 B12R2.203 Oc1cccc2OCC(O)c12 Amb25334991 [0,1,0,1,0,0|0,0,0]=2 10515 B12R2.612 Brc1ccc2c(c1)CCC2N Amb10609946 [0,1,0,1,0,0|2,0,0]=4 10516 B12R2.612 Brc1ccc2c(c1)OCC2=O Amb10070946 [0,1,0,1,0,0|0,0,2]=4 10517 B12R2.612 Brc1ccc2c(c1)onc2O Amb10975705 [0,1,0,1,0,0|1,0,1]=4 10518 B12R2.612 CC1CCc2cc(N)ccc21 Amb25150570 [0,1,0,1,0,0|2,0,0]=4 10519 B12R2.612 CC1CCc2cc(O)ccc21 Amb24099163 [0,1,0,1,0,0|2,0,0]=4 10520 B12R2.612 CC1CNc2cc(Br)ccc21 Amb25103823 [0,1,0,1,0,0|2,0,0]=4 10521 B12R2.612 CC1CNc2cc(O)ccc21 Amb24401085 [0,1,0,1,0,0|2,0,0]=4 10522 B12R2.612 CC1COc2cc(F)ccc21 Amb24438567 [0,1,0,1,0,0|1,0,0]=3 10523 B12R2.612 CC1COc2cc(O)ccc21 Amb18125119 [0,1,0,1,0,0|1,0,0]=3 10524 B12R2.612 Cc1cc2CCC(Cl)c2cc1 Amb24484465 [0,1,0,1,0,0|2,0,0]=4 10525 B12R2.612 Cc1cc2CCC(O)c2cc1 Amb21964865 [0,1,0,1,0,0|1,0,0]=3 10526 B12R2.612 Cc1cc2OCC(=O)c2cc1 Amb18202265 [0,1,0,1,0,0|0,0,2]=4 10527 B12R2.612 Cc1cc2OCC(O)c2cc1 Amb25136134 [0,1,0,1,0,0|0,0,0]=2 10528 B12R2.612 Cc1cc2OC[C@@H](N)c2cc1 Amb24365216 [0,1,0,1,0,0|1,0,0]=3 10529 B12R2.612 Cc1cc2OC[C@H](N)c2cc1 Amb25335510 [0,1,0,1,0,0|1,0,0]=3 10530 B12R2.612 Cc1cc2o[n]c(O)c2cc1 Amb22015153 [0,1,0,1,0,0|1,0,1]=4 10531 B12R2.612 Cc1ccc2C(O)OCc2c1 Amb24354413 [0,1,0,1,0,0|2,0,0]=4 10532 B12R2.612 Cc1ccc2c(c1)CCC2N Amb10609950 [0,1,0,1,0,0|2,0,0]=4 10533 B12R2.612 ClC1CCc2cc(Br)ccc21 Amb22001687 [0,1,0,1,0,0|2,0,0]=4 10534 B12R2.612 Clc1ccc2C(Cl)CCc2c1 Amb25351129 [0,1,0,1,0,0|2,0,0]=4 10535 B12R2.612 Clc1ccc2c(c1)CCC2N Amb10609861 [0,1,0,1,0,0|2,0,0]=4 10536 B12R2.612 Clc1ccc2c(c1)CC[C@@H]2N Amb13953031 [0,1,0,1,0,0|2,0,0]=4 10537 B12R2.612 Clc1ccc2c(c1)CC[C@@H]2O Amb13953030 [0,1,0,1,0,0|1,0,0]=3 10538 B12R2.612 Clc1ccc2c(c1)CC[C@H]2N Amb13953032 [0,1,0,1,0,0|2,0,0]=4 10539 B12R2.612 Clc1ccc2c(c1)CC[C@H]2O Amb13953029 [0,1,0,1,0,0|1,0,0]=3 10540 B12R2.612 Clc1ccc2c(c1)OCC2=O Amb10070947 [0,1,0,1,0,0|0,0,2]=4 10541 B12R2.612 FC1CCc2cc(Cl)ccc21 Amb24513908 [0,1,0,1,0,0|2,0,0]=4 10542 B12R2.612 Fc1cc2CCC(Br)c2cc1 Amb24461653 [0,1,0,1,0,0|2,0,0]=4 10543 B12R2.612 Fc1ccc2c(c1)CCC2N Amb10609896 [0,1,0,1,0,0|2,0,0]=4 10544 B12R2.612 Fc1ccc2c(c1)CC[C@@H]2N Amb13953037 [0,1,0,1,0,0|2,0,0]=4 10545 B12R2.612 Fc1ccc2c(c1)CC[C@@H]2O Amb13953033 [0,1,0,1,0,0|1,0,0]=3 10546 B12R2.612 Fc1ccc2c(c1)CC[C@H]2N Amb13953036 [0,1,0,1,0,0|2,0,0]=4 10547 B12R2.612 Fc1ccc2c(c1)CC[C@H]2O Amb13953035 [0,1,0,1,0,0|1,0,0]=3 10548 B12R2.612 Fc1ccc2c(c1)OCC2=O Amb10840769 [0,1,0,1,0,0|0,0,2]=4 10549 B12R2.612 Ic1ccc2c(c1)OCC2=O Amb16233079 [0,1,0,1,0,0|0,0,2]=4 10550 B12R2.612 NC1CCc2cc(I)ccc21 Amb25215234 [0,1,0,1,0,0|2,0,0]=4 10551 B12R2.612 NC1CCc2cc(S)ccc21 Amb25378804 [0,1,0,1,0,0|2,0,0]=4 10552 B12R2.612 NC1CNc2cc(Br)ccc21 Amb25311429 [0,1,0,1,0,0|2,0,0]=4 10553 B12R2.612 NC1COc2[n]c(Cl)ccc21 Amb24486646 [0,1,0,1,0,0|2,0,0]=4 10554 B12R2.612 NC1COc2cc(Br)ccc21 Amb19516088 [0,1,0,1,0,0|1,0,0]=3 10555 B12R2.612 NC1COc2cc(Br)ccc21 Amb21962144 [0,1,0,1,0,0|1,0,0]=3 10556 B12R2.612 NC1COc2cc(I)ccc21 Amb25731928 [0,1,0,1,0,0|1,0,0]=3 10557 B12R2.612 NC1COc2cc(S)ccc21 Amb24484478 [0,1,0,1,0,0|1,0,0]=3 10558 B12R2.612 N[C@@H]1CCc2cc(Br)ccc21 Amb22745142 [0,1,0,1,0,0|2,0,0]=4 10559 B12R2.612 N[C@@H]1CCc2cc(Br)ccc21 Amb22745143 [0,1,0,1,0,0|2,0,0]=4 10560 B12R2.612 N[C@@H]1CCc2cc(F)ccc21 Amb22288667 [0,1,0,1,0,0|2,0,0]=4 10561 B12R2.612 N[C@@H]1CCc2cc(I)ccc21 Amb25726414 [0,1,0,1,0,0|2,0,0]=4 10562 B12R2.612 N[C@@H]1CCc2cc(O)ccc21 Amb25841173 [0,1,0,1,0,0|2,0,0]=4 10563 B12R2.612 N[C@@H]1COc2cc(Br)ccc21 Amb24462735 [0,1,0,1,0,0|1,0,0]=3 10564 B12R2.612 N[C@@H]1COc2cc(O)ccc21 Amb24418721 [0,1,0,1,0,0|1,0,0]=3 10565 B12R2.612 N[C@H]1CCc2cc(F)ccc21 Amb22270166 [0,1,0,1,0,0|2,0,0]=4 10566 B12R2.612 N[C@H]1COc2cc(I)ccc21 Amb25764549 [0,1,0,1,0,0|1,0,0]=3 10567 B12R2.612 N[C@H]1COc2cc(O)ccc21 Amb25737189 [0,1,0,1,0,0|1,0,0]=3 10568 B12R2.612 Nc1cc2CCC(O)c2cc1 Amb24386265 [0,1,0,1,0,0|1,0,0]=3 10569 B12R2.612 Nc1cc2CC[C@@H](O)c2cc1 Amb24474275 [0,1,0,1,0,0|1,0,0]=3 10570 B12R2.612 Nc1cc2CC[C@H](O)c2cc1 Amb24733416 [0,1,0,1,0,0|1,0,0]=3 10571 B12R2.612 Nc1ccc2C(N)COc2c1 Amb24763672 [0,1,0,1,0,0|1,0,0]=3 10572 B12R2.612 Nc1ccc2[C@@H](N)COc2c1 Amb25719428 [0,1,0,1,0,0|1,0,0]=3 10573 B12R2.612 Nc1ccc2c(c1)CCC2N Amb13952222 [0,1,0,1,0,0|2,0,0]=4 10574 B12R2.612 OC1CCc2[n]c(Br)ccc21 Amb25723038 [0,1,0,1,0,0|2,0,0]=4 10575 B12R2.612 OC1CCc2[n]c(Cl)ccc21 Amb25735914 [0,1,0,1,0,0|2,0,0]=4 10576 B12R2.612 OC1CCc2cc(Br)c[n]c21 Amb24451685 [0,1,0,1,0,0|2,0,0]=4 10577 B12R2.612 OC1CCc2cc(Cl)ccc21 Amb22001631 [0,1,0,1,0,0|1,0,0]=3 10578 B12R2.612 OC1CCc2cc(F)ccc21 Amb22756387 [0,1,0,1,0,0|1,0,0]=3 10579 B12R2.612 OC1COc2cc(Br)ccc21 Amb22751582 [0,1,0,1,0,0|0,0,0]=2 10580 B12R2.612 OC1OCc2cc(Cl)ccc21 Amb22751579 [0,1,0,1,0,0|2,0,0]=4 10581 B12R2.612 O[C@@H]1CCc2cc(Br)ccc21 Amb22886733 [0,1,0,1,0,0|1,0,0]=3 10582 B12R2.612 O[C@H]1CCc2cc(Br)ccc21 Amb24420879 [0,1,0,1,0,0|1,0,0]=3 10583 B12R2.612 Oc1cc2occ(O)c2cc1 Amb24061705 [0,1,0,1,0,0|0,0,2]=4 10584 B12R2.612 Oc1ccc2C(O)CCc2c1 Amb22001818 [0,1,0,1,0,0|1,0,0]=3 10585 B12R2.612 Oc1ccc2c(c1)OCC2=O Amb1155533 [0,1,0,1,0,0|0,0,2]=4 10586 B12R2.612 Oc1ccc2c(c1)OCC2N Amb1131908 [0,1,0,1,0,0|1,0,0]=3 10587 B12R2.612 SC1CCc2cc(Br)ccc21 Amb25821808 [0,1,0,1,0,0|1,1,0]=4 10588 B12R2.612 SC1CCc2cc(Cl)ccc21 Amb24639650 [0,1,0,1,0,0|1,1,0]=4 10589 B12R2.1286 Brc1cc([n]cc1)OC2CC2 Amb22276478 [0,1,0,1,0,0|2,0,0]=4 10590 B12R2.1286 Brc1cc(ccc1)NC2CC2 Amb24622562 [0,1,0,1,0,0|2,0,0]=4 10591 B12R2.1286 Brc1cc(ccc1)OC2CC2 Amb22057669 [0,1,0,1,0,0|1,0,0]=3 10592 B12R2.1286 Brc1cc(ccc1)SC2CC2 Amb22831516 [0,1,0,1,0,0|1,1,0]=4 10593 B12R2.1286 Brc1cccc([n]1)OC2CC2 Amb24610576 [0,1,0,1,0,0|2,0,0]=4 10594 B12R2.1286 Cc1cc(c[n]c1)OC2CC2 Amb24717126 [0,1,0,1,0,0|2,0,0]=4 10595 B12R2.1286 Cc1cc(cc[n]1)OC2CC2 Amb24455504 [0,1,0,1,0,0|2,0,0]=4 10596 B12R2.1286 Cc1cc(ccc1)NC2CC2 Amb25068491 [0,1,0,1,0,0|2,0,0]=4 10597 B12R2.1286 Cc1cc(ccc1)OC2CC2 Amb24753468 [0,1,0,1,0,0|1,0,0]=3 10598 B12R2.1286 Clc1cc([n]cc1)OC2CC2 Amb22276511 [0,1,0,1,0,0|2,0,0]=4 10599 B12R2.1286 Clc1cc(ccc1)NC2CC2 Amb18930890 [0,1,0,1,0,0|2,0,0]=4 10600 B12R2.1286 Clc1cccc([n]1)OC2CC2 Amb24352134 [0,1,0,1,0,0|2,0,0]=4 10601 B12R2.1286 Fc1cc(CC2CO2)c[n]c1 Amb25211203 [0,1,0,1,0,0|2,0,0]=4 10602 B12R2.1286 Fc1cc(CC2CO2)ccc1 Amb24558530 [0,1,0,1,0,0|1,0,0]=3 10603 B12R2.1286 Fc1cc(ccc1)NC2CC2 Amb18270328 [0,1,0,1,0,0|2,0,0]=4 10604 B12R2.1286 Fc1cc(ccc1)OC2CC2 Amb25798491 [0,1,0,1,0,0|1,0,0]=3 10605 B12R2.1286 Nc1cc(ccc1)OC2CC2 Amb22011837 [0,1,0,1,0,0|1,0,0]=3 10606 B12R2.1286 Nc1cccc([n]1)OC2CC2 Amb25850038 [0,1,0,1,0,0|2,0,0]=4 10607 B12R2.1286 Oc1cc(ccc1)NC2CC2 Amb24464849 [0,1,0,1,0,0|2,0,0]=4 10608 B12R2.1286 Oc1cc(ccc1)OC2CC2 Amb24085348 [0,1,0,1,0,0|1,0,0]=3 10609 B12R2.1286 Oc1cc(ccc1)SC2CC2 Amb24695084 [0,1,0,1,0,0|1,1,0]=4 10610 B12R2.1286 Sc1cc(ccc1)OC2CC2 Amb25831029 [0,1,0,1,0,0|1,0,0]=3 10611 B12R2.2313 Brc1cc(ccc1)C2CCC2 Amb20617094 [0,1,0,1,0,0|2,0,0]=4 10612 B12R2.2313 Brc1cc(ccc1)C=2CCC2 Amb24707396 [0,1,0,1,0,0|2,0,0]=4 10613 B12R2.2313 Brc1cc(ccc1)[C@H]2CCN2 Amb25149014 [0,1,0,1,0,0|2,0,0]=4 10614 B12R2.2313 Fc1cc(ccc1)C2CCN2 Amb19375411 [0,1,0,1,0,0|2,0,0]=4 10615 B12R2.2313 Fc1cc(ccc1)C2CCN2 Amb25273667 [0,1,0,1,0,0|2,0,0]=4 10616 B12R2.2313 Fc1cc(ccc1)[C@@H]2CCN2 Amb24753481 [0,1,0,1,0,0|2,0,0]=4 10617 B12R2.2313 Ic1cc(ccc1)C2CCN2 Amb24444284 [0,1,0,1,0,0|2,0,0]=4 10618 B12R2.2313 Nc1cc(ccc1)C2CCC2 Amb20617095 [0,1,0,1,0,0|2,0,0]=4 10619 B12R2.2313 Nc1cc(ccc1)[C@@H]2CCN2 Amb25152853 [0,1,0,1,0,0|2,0,0]=4 10620 B12R2.2313 Nc1cc(ccc1)[C@H]2CCN2 Amb25839840 [0,1,0,1,0,0|2,0,0]=4 10621 B12R2.2313 Oc1cc(ccc1)C2CCC2 Amb20617090 [0,1,0,1,0,0|2,0,0]=4 10622 B12R2.2313 Oc1cc(ccc1)C2CCN2 Amb24085164 [0,1,0,1,0,0|2,0,0]=4 10623 B12R2.2313 Oc1cc(ccc1)[C@@H]2CCN2 Amb25064272 [0,1,0,1,0,0|2,0,0]=4 10624 B12R2.2313 Sc1cc(ccc1)[C@@H]2CCN2 Amb24465071 [0,1,0,1,0,0|2,0,0]=4 10625 B12R2.1 BrCC1C=Cc2ccccc21 Amb25095724 [0,1,0,1,0,0|2,0,0]=4 10626 B12R2.1 BrCC1CCc2ccccc21 Amb22500999 [0,1,0,1,0,0|2,0,0]=4 10627 B12R2.1 BrCC1COc2ccccc21 Amb25063018 [0,1,0,1,0,0|1,0,0]=3 10628 B12R2.1 BrCC1CSc2ccccc21 Amb25720096 [0,1,0,1,0,0|1,1,0]=4 10629 B12R2.1 BrC[C@@H]1COc2ccccc21 Amb25694007 [0,1,0,1,0,0|1,0,0]=3 10630 B12R2.1 BrC[C@H]1COc2ccccc21 Amb24368636 [0,1,0,1,0,0|1,0,0]=3 10631 B12R2.1 BrCc1coc2ccccc21 Amb23401826 [0,1,0,1,0,0|1,0,1]=4 10632 B12R2.1 C=CC1CNc2ccccc21 Amb24486031 [0,1,0,1,0,0|2,0,0]=4 10633 B12R2.1 CCC1CCc2ccccc21 Amb20248519 [0,1,0,1,0,0|2,0,0]=4 10634 B12R2.1 CCC1NCc2ccccc21 Amb24377125 [0,1,0,1,0,0|2,0,0]=4 10635 B12R2.1 CCC1SCc2ccccc21 Amb24092839 [0,1,0,1,0,0|1,1,0]=4 10636 B12R2.1 CCN1CCc2ccccc12 Amb17689295 [0,1,0,1,0,0|2,0,0]=4 10637 B12R2.1 CCN1CNc2ccccc12 Amb24064698 [0,1,0,1,0,0|2,0,0]=4 10638 B12R2.1 CCN1COc2ccccc12 Amb24102073 [0,1,0,1,0,0|1,0,0]=3 10639 B12R2.1 CCN1CSc2c1cccc2 Amb10571430 [0,1,0,1,0,0|1,1,0]=4 10640 B12R2.1 CNC1CCc2c1cccc2 Amb1117068 [0,1,0,1,0,0|2,0,0]=4 10641 B12R2.1 CNC1CCc2ccccc21 Amb22757336 [0,1,0,1,0,0|2,0,0]=4 10642 B12R2.1 CN[C@@H]1CCc2ccccc21 Amb25808104 [0,1,0,1,0,0|2,0,0]=4 10643 B12R2.1 COC1COc2ccccc21 Amb24102318 [0,1,0,1,0,0|0,0,0]=2 10644 B12R2.1 COC1OCc2ccccc21 Amb24323529 [0,1,0,1,0,0|2,0,0]=4 10645 B12R2.1 COc1[n]oc2ccccc12 Amb23571257 [0,1,0,1,0,0|1,0,1]=4 10646 B12R2.1 CSC1CCc2ccccc21 Amb24684843 [0,1,0,1,0,0|1,1,0]=4 10647 B12R2.1 ClCC1C=Cc2ccccc21 Amb24556989 [0,1,0,1,0,0|2,0,0]=4 10648 B12R2.1 ClCC1CCc2ccccc21 Amb22500998 [0,1,0,1,0,0|2,0,0]=4 10649 B12R2.1 ClC[N+]1=c2ccccc2=NC1 Amb10552956 [0,1,0,1,0,0|2,0,0]=4 10650 B12R2.1 FCC1CNc2ccccc21 Amb25178926 [0,1,0,1,0,0|2,0,0]=4 10651 B12R2.1 ICC1CCc2ccccc21 Amb24721376 [0,1,0,1,0,0|2,0,0]=4 10652 B12R2.1 ICC1COc2ccccc21 Amb24060947 [0,1,0,1,0,0|1,0,0]=3 10653 B12R2.1 ICC1CSc2ccccc21 Amb24513745 [0,1,0,1,0,0|1,1,0]=4 10654 B12R2.1 N#CC1CNc2ccccc21 Amb18063484 [0,1,0,1,0,0|2,0,0]=4 10655 B12R2.1 N#CC1COc2ccccc21 Amb23586274 [0,1,0,1,0,0|1,0,0]=3 10656 B12R2.1 N#CC1CSc2ccccc21 Amb18126297 [0,1,0,1,0,0|1,1,0]=4 10657 B12R2.1 NCC1C=Cc2c1cccc2 Amb17470375 [0,1,0,1,0,0|2,0,0]=4 10658 B12R2.1 NCC1CCc2ccccc21 Amb22500956 [0,1,0,1,0,0|2,0,0]=4 10659 B12R2.1 NCC1CNc2ccccc21 Amb18063038 [0,1,0,1,0,0|2,0,0]=4 10660 B12R2.1 NCC1COc2c[n]ccc21 Amb22756834 [0,1,0,1,0,0|2,0,0]=4 10661 B12R2.1 NCC1COc2ccccc21 Amb18644395 [0,1,0,1,0,0|1,0,0]=3 10662 B12R2.1 NCC1COc2ccccc21 Amb20668243 [0,1,0,1,0,0|1,0,0]=3 10663 B12R2.1 NCc1coc2ccccc21 Amb19373967 [0,1,0,1,0,0|1,0,1]=4 10664 B12R2.1 NCc1coc2ccccc21 Amb19649824 [0,1,0,1,0,0|1,0,1]=4 10665 B12R2.1 NOC1CCc2ccccc21 Amb25808729 [0,1,0,1,0,0|1,0,0]=3 10666 B12R2.1 O=CC1CCc2ccccc21 Amb18644272 [0,1,0,1,0,0|1,0,1]=4 10667 B12R2.1 O=CC1CNc2ccccc21 Amb23590098 [0,1,0,1,0,0|1,0,1]=4 10668 B12R2.1 O=CC1COc2ccccc21 Amb23586276 [0,1,0,1,0,0|0,0,1]=3 10669 B12R2.1 OCC1=CCc2ccccc12 Amb25797665 [0,1,0,1,0,0|1,0,1]=4 10670 B12R2.1 OCC1CCc2[n]cccc21 Amb24616681 [0,1,0,1,0,0|2,0,0]=4 10671 B12R2.1 OCC1CCc2ccccc21 Amb19329220 [0,1,0,1,0,0|1,0,0]=3 10672 B12R2.1 OCC1CNc2ccccc21 Amb18063448 [0,1,0,1,0,0|1,0,0]=3 10673 B12R2.1 OCC1COc2ccccc21 Amb22224879 [0,1,0,1,0,0|0,0,0]=2 10674 B12R2.1 OCC1CSc2ccccc21 Amb24615579 [0,1,0,1,0,0|0,1,0]=3 10675 B12R2.1 OCC1NCc2ccccc21 Amb25736151 [0,1,0,1,0,0|1,0,0]=3 10676 B12R2.1 OC[C@@H]1COc2ccccc21 Amb24487044 [0,1,0,1,0,0|0,0,0]=2 10677 B12R2.1 OC[C@H]1OCc2ccccc21 Amb24412216 [0,1,0,1,0,0|0,0,0]=2 10678 B12R2.1 OC[N]1=c2ccccc2=NN1 Amb17918406 [0,1,0,1,0,0|2,0,0]=4 10679 B12R2.1 OC[n]1[n]cc2ccccc12 Amb23441644 [0,1,0,1,0,0|2,0,0]=4 10680 B12R2.1 OC[n]1ccc2ccccc12 Amb25374111 [0,1,0,1,0,0|1,0,1]=4 10681 B12R2.1 OCc1[n]oc2ccccc21 Amb22498744 [0,1,0,1,0,0|0,0,1]=3 10682 B12R2.1 OCc1c[nH]c2c1cccc2 Amb1153804 [0,1,0,1,0,0|1,0,1]=4 10683 B12R2.1 OCc1c[nH]c2c1cccc2 Amb16231311 [0,1,0,1,0,0|1,0,1]=4 10684 B12R2.1 OCc1coc2[n]cccc21 Amb24081779 [0,1,0,1,0,0|1,0,1]=4 10685 B12R2.1 OCc1coc2c1cccc2 Amb10572402 [0,1,0,1,0,0|0,0,1]=3 10686 B12R2.1 OCc1coc2c[n]ccc21 Amb25280745 [0,1,0,1,0,0|1,0,1]=4 10687 B12R2.1 OCc1coc2cc[n]cc21 Amb24514107 [0,1,0,1,0,0|1,0,1]=4 10688 B12R2.1 OCc1n[nH]c2c1cccc2 Amb1070698 [0,1,0,1,0,0|1,0,1]=4 10689 B12R2.1 OCn1cnc2c1cccc2 Amb1151978 [0,1,0,1,0,0|1,0,1]=4 10690 B12R2.1 OCn1nnc2c1cccc2 Amb1350546 [0,1,0,1,0,0|2,0,0]=4 10691 B12R2.1 ONc1[n]oc2ccccc21 Amb25151938 [0,1,0,1,0,0|1,0,1]=4 10692 B12R2.1 O\N=C/1\CCc2ccccc21 Amb24121339 [0,1,0,1,0,0|1,0,1]=4 10693 B12R2.1 O\N=C/1\CSc2ccccc21 Amb24611046 [0,1,0,1,0,0|0,1,1]=4 10694 B12R2.1 O\N=C\1/CCc2ccccc21 Amb22731286 [0,1,0,1,0,0|1,0,1]=4 10695 B12R2.1 O\N=C\1/COc2ccccc21 Amb19650724 [0,1,0,1,0,0|0,0,1]=3 10696 B12R2.1 SCc1coc2ccccc21 Amb24405838 [0,1,0,1,0,0|0,1,1]=4 10697 B12R2.1 SCc1occ2ccccc21 Amb24061114 [0,1,0,1,0,0|0,1,1]=4 10698 B12R2.11 Br[C@@H]1C[C@@H]1Cc2ccccc2 Amb25280103 [0,1,0,1,0,0|2,0,0]=4 10699 B12R2.11 CC1CC1Nc2ccccc2 Amb24743217 [0,1,0,1,0,0|2,0,0]=4 10700 B12R2.11 C[C@H]1C[C@@H]1Nc2ccccc2 Amb24581235 [0,1,0,1,0,0|2,0,0]=4 10701 B12R2.11 ClC1CC1Oc2ccccc2 Amb25799021 [0,1,0,1,0,0|1,0,0]=3 10702 B12R2.11 Cl[C@@H]1C[C@@H]1Oc2ccccc2 Amb24652641 [0,1,0,1,0,0|1,0,0]=3 10703 B12R2.11 NC1CC1Cc2ccccc2 Amb18960797 [0,1,0,1,0,0|2,0,0]=4 10704 B12R2.11 NC1CC1Cc2ccccc2 Amb19375025 [0,1,0,1,0,0|2,0,0]=4 10705 B12R2.11 NC1CC1Oc2ccccc2 Amb24761155 [0,1,0,1,0,0|1,0,0]=3 10706 B12R2.11 OC1CC1Cc2ccccc2 Amb25145316 [0,1,0,1,0,0|1,0,0]=3 10707 B12R2.11 OC1CC1Sc2ccccc2 Amb25788139 [0,1,0,1,0,0|0,1,0]=3 10708 B12R2.11 O[C@H]1C[C@@H]1Cc2ccccc2 Amb25326057 [0,1,0,1,0,0|1,0,0]=3 10709 B12R2.11 O[C@H]1C[C@@H]1Sc2ccccc2 Amb24745857 [0,1,0,1,0,0|0,1,0]=3 10710 B12R2.23 BrC1COC1c2ccccc2 Amb24484887 [0,1,0,1,0,0|1,0,0]=3 10711 B12R2.23 Br[C@@H]1CO[C@H]1c2ccccc2 Amb25198843 [0,1,0,1,0,0|1,0,0]=3 10712 B12R2.23 CC1CNC1c2ccccc2 Amb19338009 [0,1,0,1,0,0|2,0,0]=4 10713 B12R2.23 CC1NCC1c2ccccc2 Amb25842786 [0,1,0,1,0,0|2,0,0]=4 10714 B12R2.23 C[C@@H]1NC[C@H]1c2ccccc2 Amb24618159 [0,1,0,1,0,0|2,0,0]=4 10715 B12R2.23 NC1CCC1c2ccccc2 Amb19335290 [0,1,0,1,0,0|2,0,0]=4 10716 B12R2.23 NC1CCC1c2ccccc2 Amb24120632 [0,1,0,1,0,0|2,0,0]=4 10717 B12R2.23 NC1CSC1c2ccccc2 Amb25076286 [0,1,0,1,0,0|1,1,0]=4 10718 B12R2.23 N[C@@H]1CC[C@H]1c2ccccc2 Amb25174969 [0,1,0,1,0,0|2,0,0]=4 10719 B12R2.23 O=C1CCC1c2ccccc2 Amb19515483 [0,1,0,1,0,0|1,0,1]=4 10720 B12R2.23 O=C1CCN1c2ccccc2 Amb16191926 [0,1,0,1,0,0|1,0,1]=4 10721 B12R2.23 O=C1COC1c2ccccc2 Amb23456091 [0,1,0,1,0,0|0,0,2]=4 10722 B12R2.23 OC1CCC1c2ccccc2 Amb19374437 [0,1,0,1,0,0|1,0,0]=3 10723 B12R2.23 OC1CNC1c2ccc[n]c2 Amb25145873 [0,1,0,1,0,0|2,0,0]=4 10724 B12R2.23 OC1CNC1c2ccccc2 Amb25680030 [0,1,0,1,0,0|1,0,0]=3 10725 B12R2.23 O[C@@H]1CC[C@H]1c2ccccc2 Amb24620488 [0,1,0,1,0,0|1,0,0]=3 10726 B12R2.23 O[C@@H]1CS[C@H]1c2ccccc2 Amb25334761 [0,1,0,1,0,0|0,1,0]=3 10727 B12R2.23 O[C@H]1CS[C@H]1c2ccccc2 Amb25176781 [0,1,0,1,0,0|0,1,0]=3 10728 B12R2.23 S=C1CCN1c2ccccc2 Amb24709242 [0,1,0,1,0,0|1,1,0]=4 10729 B12R2.2057 C(NC1CC1)c2ccccc2 Amb19515725 [0,1,0,1,0,0|2,0,0]=4 10730 B12R2.2057 C(Nc1ccccc1)C2CC2 Amb22586372 [0,1,0,1,0,0|2,0,0]=4 10731 B12R2.2057 C(Oc1cc[n]cc1)C2CC2 Amb25368058 [0,1,0,1,0,0|2,0,0]=4 10732 B12R2.2057 C(Oc1cccc[n]1)C2CC2 Amb24725808 [0,1,0,1,0,0|2,0,0]=4 10733 B12R2.2057 C(Oc1ccccc1)C2CC2 Amb22752457 [0,1,0,1,0,0|1,0,0]=3 10734 B12R2.2057 C(Oc1ccccc1)C2CO2 Amb22366990 [0,1,0,1,0,0|0,0,0]=2 10735 B12R2.2057 C(SC1CC1)c2ccccc2 Amb25824339 [0,1,0,1,0,0|1,1,0]=4 10736 B12R2.2057 C1C=C1CNc2ccccc2 Amb25824311 [0,1,0,1,0,0|2,0,0]=4 10737 B12R2.2057 C1CC1CNc2ccccc2 Amb2383311 [0,1,0,1,0,0|2,0,0]=4 10738 B12R2.2057 C1OC1C#Cc2ccccc2 Amb25309852 [0,1,0,1,0,0|1,0,0]=3 10739 B12R2.2057 C1OC1CCc2c[n]ccc2 Amb24085696 [0,1,0,1,0,0|2,0,0]=4 10740 B12R2.2057 C1OC1CCc2cc[n]cc2 Amb24356834 [0,1,0,1,0,0|2,0,0]=4 10741 B12R2.2057 C1OC1CCc2cccc[n]2 Amb24450397 [0,1,0,1,0,0|2,0,0]=4 10742 B12R2.2057 C1OC1CCc2ccccc2 Amb24105379 [0,1,0,1,0,0|1,0,0]=3 10743 B12R2.2057 C1OC1CSc2cc[n]cc2 Amb24673368 [0,1,0,1,0,0|1,1,0]=4 10744 B12R2.2057 C1OC1\C=C\c2cccc[n]2 Amb24411009 [0,1,0,1,0,0|2,0,0]=4 10745 B12R2.2057 C1OC1\C=C\c2ccccc2 Amb24418540 [0,1,0,1,0,0|1,0,0]=3 10746 B12R2.2057 C1O[C@@H]1CSc2ccccc2 Amb25680899 [0,1,0,1,0,0|0,1,0]=3 10747 B12R2.2057 C1O[C@@H]1OCc2ccccc2 Amb24631881 [0,1,0,1,0,0|0,0,0]=2 10748 B12R2.2058 B1CC(C1)Cc2ccccc2 Amb25243383 [0,1,0,1,0,0|2,0,0]=4 10749 B12R2.2058 C(C1CCN1)c2ccccc2 Amb20623701 [0,1,0,1,0,0|2,0,0]=4 10750 B12R2.2058 C1CC(C1)Sc2ccccc2 Amb10976023 [0,1,0,1,0,0|1,1,0]=4 10751 B12R2.2058 C1CCC1Nc2ccccc2 Amb18283820 [0,1,0,1,0,0|2,0,0]=4 10752 B12R2.2058 C1NCC1Cc2ccccc2 Amb19373673 [0,1,0,1,0,0|2,0,0]=4 10753 B12R2.2058 C1NCC1Oc2c[n]ccc2 Amb21956447 [0,1,0,1,0,0|2,0,0]=4 10754 B12R2.2058 C1NCC1Oc2c[n]ccc2 Amb22490470 [0,1,0,1,0,0|2,0,0]=4 10755 B12R2.2058 C1NCC1Oc2cc[n]cc2 Amb19373091 [0,1,0,1,0,0|2,0,0]=4 10756 B12R2.2058 C1NCC1Oc2cccc[n]2 Amb22642174 [0,1,0,1,0,0|2,0,0]=4 10757 B12R2.2058 C1NCC1Oc2ccccc2 Amb19312256 [0,1,0,1,0,0|1,0,0]=3 10758 B12R2.2058 C1NCC1Sc2ccccc2 Amb18798478 [0,1,0,1,0,0|1,1,0]=4 10759 B12R2.2058 C1OCC1Nc2ccccc2 Amb22737358 [0,1,0,1,0,0|1,0,0]=3 10760 B12R2.2058 C1OCC1Sc2cccc[n]2 Amb24354925 [0,1,0,1,0,0|1,1,0]=4 10761 B12R2.2058 C1OCC1Sc2ccccc2 Amb25145934 [0,1,0,1,0,0|0,1,0]=3 10762 B12R2.2058 C1SCC1Nc2ccccc2 Amb25362257 [0,1,0,1,0,0|1,1,0]=4 10763 B12R2.2058 N1CC(C1)Cc2ccccc2 Amb1123190 [0,1,0,1,0,0|2,0,0]=4 10764 B12R2.2058 N1CC(C1)Oc2ccccc2 Amb15701497 [0,1,0,1,0,0|1,0,0]=3 10765 B12R2.18 BrC1Oc2ccccc2C1Br Amb25694128 [0,1,0,1,0,0|1,0,0]=3 10766 B12R2.18 C=C1Cc2ccccc2C1O Amb25045696 [0,1,0,1,0,0|1,0,1]=4 10767 B12R2.18 C=C1Oc2ccccc2C1O Amb25852741 [0,1,0,1,0,0|0,0,1]=3 10768 B12R2.18 CC1=Cc2ccccc2C1O Amb17778950 [0,1,0,1,0,0|1,0,1]=4 10769 B12R2.18 CC1C(=O)Oc2ccccc21 Amb25150504 [0,1,0,1,0,0|1,0,1]=4 10770 B12R2.18 CC1C(C)Nc2c1cccc2 Amb17593676 [0,1,0,1,0,0|2,0,0]=4 10771 B12R2.18 CC1C(N)Cc2ccccc21 Amb18124847 [0,1,0,1,0,0|2,0,0]=4 10772 B12R2.18 CC1C(O)Cc2ccccc21 Amb20622729 [0,1,0,1,0,0|2,0,0]=4 10773 B12R2.18 CC1Cc2ccccc2C1Br Amb25106421 [0,1,0,1,0,0|2,0,0]=4 10774 B12R2.18 CC1Cc2ccccc2C1Cl Amb18183547 [0,1,0,1,0,0|2,0,0]=4 10775 B12R2.18 CC1Cc2ccccc2C1N Amb19373701 [0,1,0,1,0,0|2,0,0]=4 10776 B12R2.18 CC1Oc2[n]cccc2C1O Amb22372218 [0,1,0,1,0,0|1,0,0]=3 10777 B12R2.18 CC1Oc2ccccc2C1N Amb18943788 [0,1,0,1,0,0|1,0,0]=3 10778 B12R2.18 CC1Oc2ccccc2C1O Amb24572207 [0,1,0,1,0,0|0,0,0]=2 10779 B12R2.18 CC1Sc2ccccc2C1N Amb18278067 [0,1,0,1,0,0|1,1,0]=4 10780 B12R2.18 C[C@@H]1Cc2ccccc2[C@@H]1N Amb24578752 [0,1,0,1,0,0|2,0,0]=4 10781 B12R2.18 C[C@@H]1Oc2ccccc2[C@@H]1O Amb25344981 [0,1,0,1,0,0|0,0,0]=2 10782 B12R2.18 C[C@@H]1[C@@H](O)Cc2ccccc21 Amb25176418 [0,1,0,1,0,0|2,0,0]=4 10783 B12R2.18 C[C@@H]1[C@H](O)Cc2ccccc21 Amb24546023 [0,1,0,1,0,0|2,0,0]=4 10784 B12R2.18 C[C@H]1Nc2ccccc2[C@@H]1O Amb24629727 [0,1,0,1,0,0|1,0,0]=3 10785 B12R2.18 C[C@H]1[C@@H](N)Cc2ccccc21 Amb24562844 [0,1,0,1,0,0|2,0,0]=4 10786 B12R2.18 ClC1Cc2ccccc2C1Cl Amb25770688 [0,1,0,1,0,0|2,0,0]=4 10787 B12R2.18 Cl[C@@H]1Cc2ccccc2[C@@H]1Cl Amb25366590 [0,1,0,1,0,0|2,0,0]=4 10788 B12R2.18 Cl[C@@H]1Cc2ccccc2[C@H]1Cl Amb25242520 [0,1,0,1,0,0|2,0,0]=4 10789 B12R2.18 Cl[C@@H]1Oc2ccccc2[C@@H]1Cl Amb24563414 [0,1,0,1,0,0|1,0,0]=3 10790 B12R2.18 Cl[C@H]1Oc2ccccc2[C@@H]1Cl Amb25258397 [0,1,0,1,0,0|1,0,0]=3 10791 B12R2.18 Cl[C@H]1Oc2ccccc2[C@H]1Cl Amb24711440 [0,1,0,1,0,0|1,0,0]=3 10792 B12R2.18 FC1C(Br)Cc2ccccc21 Amb25857057 [0,1,0,1,0,0|2,0,0]=4 10793 B12R2.18 FC1Oc2ccccc2C1F Amb24101526 [0,1,0,1,0,0|1,0,0]=3 10794 B12R2.18 NC1C(C)Cc2c1cccc2 Amb17232033 [0,1,0,1,0,0|2,0,0]=4 10795 B12R2.18 NC1C(F)Cc2ccccc21 Amb24459876 [0,1,0,1,0,0|2,0,0]=4 10796 B12R2.18 NC1C(N)Cc2c1cccc2 Amb13953204 [0,1,0,1,0,0|2,0,0]=4 10797 B12R2.18 NC1C(O)Nc2ccccc21 Amb25722216 [0,1,0,1,0,0|2,0,0]=4 10798 B12R2.18 NC1Cc2[n]cccc2C1O Amb25364253 [0,1,0,1,0,0|2,0,0]=4 10799 B12R2.18 NC1Cc2ccccc2C1F Amb24655749 [0,1,0,1,0,0|2,0,0]=4 10800 B12R2.18 NC1Cc2ccccc2C1O Amb20623676 [0,1,0,1,0,0|1,0,0]=3 10801 B12R2.18 NC1Oc2ccccc2C1=O Amb24349623 [0,1,0,1,0,0|0,0,2]=4 10802 B12R2.18 NC1[C@H](O)Cc2ccccc21 Amb24401902 [0,1,0,1,0,0|2,0,0]=4 10803 B12R2.18 N[C@@H]1C(=O)Oc2ccccc21 Amb25324246 [0,1,0,1,0,0|1,0,1]=4 10804 B12R2.18 N[C@@H]1Cc2ccccc2C1O Amb25209005 [0,1,0,1,0,0|1,0,0]=3 10805 B12R2.18 N[C@@H]1Cc2ccccc2[C@@H]1N Amb22745804 [0,1,0,1,0,0|2,0,0]=4 10806 B12R2.18 N[C@@H]1Cc2ccccc2[C@@H]1O Amb24501357 [0,1,0,1,0,0|1,0,0]=3 10807 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1N Amb22748292 [0,1,0,1,0,0|2,0,0]=4 10808 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb22388538 [0,1,0,1,0,0|1,0,0]=3 10809 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb25379044 [0,1,0,1,0,0|1,0,0]=3 10810 B12R2.18 N[C@@H]1[C@@H](Cl)Cc2ccccc21 Amb24519208 [0,1,0,1,0,0|2,0,0]=4 10811 B12R2.18 N[C@@H]1[C@@H](F)Cc2ccccc21 Amb25252184 [0,1,0,1,0,0|2,0,0]=4 10812 B12R2.18 N[C@@H]1[C@@H](O)Cc2c1cccc2 Amb10842191 [0,1,0,1,0,0|2,0,0]=4 10813 B12R2.18 N[C@@H]1[C@H](Cl)Cc2ccccc21 Amb24641556 [0,1,0,1,0,0|2,0,0]=4 10814 B12R2.18 N[C@@H]1[C@H](O)Cc2ccccc12 Amb17779311 [0,1,0,1,0,0|2,0,0]=4 10815 B12R2.18 N[C@H]1C(O)Cc2ccccc21 Amb24427360 [0,1,0,1,0,0|2,0,0]=4 10816 B12R2.18 N[C@H]1Cc2ccccc2[C@@H]1N Amb24624674 [0,1,0,1,0,0|2,0,0]=4 10817 B12R2.18 N[C@H]1Cc2ccccc2[C@H]1O Amb24540566 [0,1,0,1,0,0|1,0,0]=3 10818 B12R2.18 N[C@H]1[C@H](O)Cc2c1cccc2 Amb10842210 [0,1,0,1,0,0|2,0,0]=4 10819 B12R2.18 O=C1C(Br)Oc2ccccc21 Amb25835380 [0,1,0,1,0,0|0,0,2]=4 10820 B12R2.18 O=C1C(Cl)Oc2ccccc21 Amb24061516 [0,1,0,1,0,0|0,0,2]=4 10821 B12R2.18 O=C1Oc2ccccc2C1Cl Amb25124107 [0,1,0,1,0,0|1,0,1]=4 10822 B12R2.18 OC1C(=O)Oc2ccccc21 Amb24102222 [0,1,0,1,0,0|0,0,1]=3 10823 B12R2.18 OC1C(Br)Cc2c1cccc2 Amb1159074 [0,1,0,1,0,0|1,0,0]=3 10824 B12R2.18 OC1C(F)Cc2ccccc21 Amb24423988 [0,1,0,1,0,0|1,0,0]=3 10825 B12R2.18 OC1C(N)Cc2c1cccc2 Amb2383051 [0,1,0,1,0,0|1,0,0]=3 10826 B12R2.18 OC1C(O)C[n+]2ccccc21 Amb25739707 [0,1,0,1,0,0|2,0,0]=4 10827 B12R2.18 OC1Cc2ccccc2C1Br Amb25785578 [0,1,0,1,0,0|2,0,0]=4 10828 B12R2.18 OC1Cc2ccccc2C1F Amb24672733 [0,1,0,1,0,0|2,0,0]=4 10829 B12R2.18 OC1Cc2ccccc2C1O Amb24323306 [0,1,0,1,0,0|1,0,0]=3 10830 B12R2.18 OC1Cc2ccccc2C1S Amb24430077 [0,1,0,1,0,0|1,1,0]=4 10831 B12R2.18 OC1Nc2ccccc2C1O Amb24090494 [0,1,0,1,0,0|1,0,0]=3 10832 B12R2.18 OC1Oc2ccccc2C1=O Amb24061518 [0,1,0,1,0,0|0,0,2]=4 10833 B12R2.18 O[C@@H]1C(Br)Cc2ccccc21 Amb25061997 [0,1,0,1,0,0|1,0,0]=3 10834 B12R2.18 O[C@@H]1Cc2ccccc2[C@@H]1Cl Amb24650956 [0,1,0,1,0,0|2,0,0]=4 10835 B12R2.18 O[C@@H]1Cc2ccccc2[C@@H]1O Amb22800784 [0,1,0,1,0,0|1,0,0]=3 10836 B12R2.18 O[C@@H]1Oc2ccccc2[C@H]1O Amb25284399 [0,1,0,1,0,0|0,0,0]=2 10837 B12R2.18 O[C@@H]1Sc2ccccc2[C@@H]1O Amb25215688 [0,1,0,1,0,0|0,1,0]=3 10838 B12R2.18 O[C@@H]1[C@@H](F)Cc2ccccc21 Amb25200299 [0,1,0,1,0,0|1,0,0]=3 10839 B12R2.18 O[C@@H]1[C@H](F)Cc2ccccc21 Amb25176954 [0,1,0,1,0,0|1,0,0]=3 10840 B12R2.18 O[C@H]1C(=O)Nc2ccccc21 Amb25152859 [0,1,0,1,0,0|1,0,1]=4 10841 B12R2.18 O[C@H]1Cc2ccccc2[C@@H]1Br Amb24682797 [0,1,0,1,0,0|2,0,0]=4 10842 B12R2.18 O[C@H]1Cc2ccccc2[C@@H]1F Amb25240021 [0,1,0,1,0,0|2,0,0]=4 10843 B12R2.18 O[C@H]1Cc2ccccc2[C@H]1O Amb22230411 [0,1,0,1,0,0|1,0,0]=3 10844 B12R2.18 O[C@H]1Sc2ccccc2[C@H]1O Amb25256602 [0,1,0,1,0,0|0,1,0]=3 10845 B12R2.18 O[C@H]1[C@H](Cl)Cc2ccccc21 Amb24519428 [0,1,0,1,0,0|1,0,0]=3 10846 B12R2.18 O[C@H]1[C@H](O)Cc2c1cccc2 Amb10982589 [0,1,0,1,0,0|1,0,0]=3 10847 B12R2.18 Oc1c2ccccc2oc1O Amb24060920 [0,1,0,1,0,0|0,0,2]=4 10848 B12R2.18 [NH3+][C@@H]1Cc2ccccc2[C@H]1O Amb22224837 [0,1,0,1,0,0|1,0,0]=3 10849 B12R2.37 CC1C(O)C1c2ccccc2 Amb24457875 [0,1,0,1,0,0|1,0,0]=3 10850 B12R2.37 C[C@@H]1[C@H](Cl)[C@@H]1c2ccccc2 Amb25321015 [0,1,0,1,0,0|2,0,0]=4 10851 B12R2.37 C[C@@H]1[C@H](Cl)[C@H]1c2ccccc2 Amb24511894 [0,1,0,1,0,0|2,0,0]=4 10852 B12R2.37 C[C@H]1C(Cl)[C@@H]1c2ccccc2 Amb25173083 [0,1,0,1,0,0|2,0,0]=4 10853 B12R2.37 C[C@H]1[C@H](Cl)[C@@H]1c2ccccc2 Amb25320879 [0,1,0,1,0,0|2,0,0]=4 10854 B12R2.37 N[C@@H]1[C@H]([C@@H]1N)c2ccccc2 Amb24761507 [0,1,0,1,0,0|2,0,0]=4 10855 B12R2.37 N[C@H]1C([C@@H]1N)c2ccccc2 Amb25230184 [0,1,0,1,0,0|2,0,0]=4 10856 B12R2.94 IC1(CC1)Sc2ccccc2 Amb25163645 [0,1,0,1,0,0|1,1,0]=4 10857 B12R2.94 NC1(Cc2ccccc2)CC1 Amb22587208 [0,1,0,1,0,0|2,0,0]=4 10858 B12R2.94 OC1(Cc2ccccc2)CC1 Amb19374431 [0,1,0,1,0,0|2,0,0]=4 10859 B12R2.92 BrC1(Br)CC1c2ccccc2 Amb22363907 [0,1,0,1,0,0|2,0,0]=4 10860 B12R2.92 CC1(C)CC1c2ccccc2 Amb22052702 [0,1,0,1,0,0|2,0,0]=4 10861 B12R2.92 CC1(O)OC1c2ccccc2 Amb24353312 [0,1,0,1,0,0|2,0,0]=4 10862 B12R2.92 C[C@@]1(N)C[C@H]1c2ccccc2 Amb25378765 [0,1,0,1,0,0|2,0,0]=4 10863 B12R2.92 C[C@]1(N)C[C@@H]1c2ccccc2 Amb24613115 [0,1,0,1,0,0|2,0,0]=4 10864 B12R2.92 FC1(F)CC1c2ccccc2 Amb22227684 [0,1,0,1,0,0|2,0,0]=4 10865 B12R2.2403 CC1(C)CCc2ccccc12 Amb24657207 [0,1,0,1,0,0|2,0,0]=4 10866 B12R2.2403 CC1(C)CNc2c1cccc2 Amb17232031 [0,1,0,1,0,0|2,0,0]=4 10867 B12R2.2403 CC1(C)CNc2ccccc12 Amb20630653 [0,1,0,1,0,0|2,0,0]=4 10868 B12R2.2403 CC1(C)COc2[n]cccc12 Amb24085425 [0,1,0,1,0,0|2,0,0]=4 10869 B12R2.2403 CC1(C)COc2c[n]ccc12 Amb24085426 [0,1,0,1,0,0|2,0,0]=4 10870 B12R2.2403 CC1(C)COc2cc[n]cc12 Amb24085427 [0,1,0,1,0,0|2,0,0]=4 10871 B12R2.2403 N[C@]1(O)CCc2ccccc12 Amb24472858 [0,1,0,1,0,0|1,0,0]=3 10872 B12R2.2403 OC1(Br)CNc2ccccc12 Amb25195439 [0,1,0,1,0,0|1,0,0]=3 10873 B12R2.3190 CC(O)C1Cc2ccccc21 Amb24538275 [0,1,0,1,0,0|1,0,0]=3 10874 B12R2.3190 C[C@@H](N)C1Cc2ccccc21 Amb25047176 [0,1,0,1,0,0|2,0,0]=4 10875 B12R2.3190 C[C@@H](O)C1Cc2ccccc21 Amb25151401 [0,1,0,1,0,0|1,0,0]=3 10876 B12R2.3190 C[C@H](O)C1Cc2ccccc21 Amb25172779 [0,1,0,1,0,0|1,0,0]=3 10877 B12R3.12 c1ccc2c(c1)C3OC3C2 Amb1131588 [0,0,0,2,0,0|1,0,0]=3 10878 B8R1.8 BrCC[n]1cccc1 Amb17933298 [1,0,0,0,1,0|2,0,0]=4 10879 B8R1.8 BrCCc1c[nH]cc1 Amb18862863 [1,0,0,0,1,0|2,0,0]=4 10880 B8R1.8 BrCCc1c[s]cc1 Amb18325324 [1,0,0,0,1,0|2,0,0]=4 10881 B8R1.8 BrCCc1ccc[nH]1 Amb25312927 [1,0,0,0,1,0|2,0,0]=4 10882 B8R1.8 BrCCc1ccco1 Amb22752866 [1,0,0,0,1,0|2,0,0]=4 10883 B8R1.8 BrCCc1cccs1 Amb16234134 [1,0,0,0,1,0|2,0,0]=4 10884 B8R1.8 BrCCc1cocc1 Amb19374721 [1,0,0,0,1,0|2,0,0]=4 10885 B8R1.8 CCCc1ccco1 Amb10070288 [1,0,0,0,1,0|2,0,0]=4 10886 B8R1.8 CCCc1ccsc1 Amb17689448 [1,0,0,0,1,0|2,0,0]=4 10887 B8R1.8 CCCc1cocc1 Amb24332079 [1,0,0,0,1,0|2,0,0]=4 10888 B8R1.8 CCN[n]1cccc1 Amb25277204 [1,0,0,0,1,0|2,0,0]=4 10889 B8R1.8 CCNc1c[nH]cc1 Amb25717948 [1,0,0,0,1,0|2,0,0]=4 10890 B8R1.8 CCNc1c[s]cc1 Amb25743947 [1,0,0,0,1,0|2,0,0]=4 10891 B8R1.8 CCNc1ccc[s]1 Amb18055004 [1,0,0,0,1,0|2,0,0]=4 10892 B8R1.8 CCOc1c[nH][n]c1 Amb23556513 [1,0,0,0,1,0|2,0,0]=4 10893 B8R1.8 CCOc1c[nH]cn1 Amb13883552 [1,0,0,0,1,0|2,0,0]=4 10894 B8R1.8 CCOc1c[n]c[s]1 Amb24511805 [1,0,0,0,1,0|2,0,0]=4 10895 B8R1.8 CCOc1c[s]c[n]1 Amb24086633 [1,0,0,0,1,0|2,0,0]=4 10896 B8R1.8 CCOc1cc[s][n]1 Amb24689281 [1,0,0,0,1,0|2,0,0]=4 10897 B8R1.8 CCOc1ccc[nH]1 Amb22756799 [1,0,0,0,1,0|1,0,0]=3 10898 B8R1.8 CCOc1ccco1 Amb25222294 [1,0,0,0,1,0|1,0,0]=3 10899 B8R1.8 CCOc1nccs1 Amb2455931 [1,0,0,0,1,0|2,0,0]=4 10900 B8R1.8 CCOn1cncc1 Amb2429214 [1,0,0,0,1,0|2,0,0]=4 10901 B8R1.8 CCSc1c[nH]cc1 Amb24481314 [1,0,0,0,1,0|1,1,0]=4 10902 B8R1.8 CCSc1cccs1 Amb17845323 [1,0,0,0,1,0|1,1,0]=4 10903 B8R1.8 C[SiH2]Oc1ccco1 Amb25025922 [1,0,0,0,1,0|1,1,0]=4 10904 B8R1.8 ClCC[n]1cccc1 Amb19944678 [1,0,0,0,1,0|2,0,0]=4 10905 B8R1.8 ClCCc1c[nH]cc1 Amb18222716 [1,0,0,0,1,0|2,0,0]=4 10906 B8R1.8 ClCCc1ccco1 Amb24555129 [1,0,0,0,1,0|2,0,0]=4 10907 B8R1.8 ICCc1c[s]cc1 Amb25857183 [1,0,0,0,1,0|2,0,0]=4 10908 B8R1.8 ICCc1ccc[s]1 Amb25106538 [1,0,0,0,1,0|2,0,0]=4 10909 B8R1.8 NCC[n]1cccc1 Amb22757166 [1,0,0,0,1,0|2,0,0]=4 10910 B8R1.8 NCC[n]1cccc1 Amb22904207 [1,0,0,0,1,0|2,0,0]=4 10911 B8R1.8 NCCc1c[nH]cc1 Amb18061637 [1,0,0,0,1,0|2,0,0]=4 10912 B8R1.8 NCCc1ccc[nH]1 Amb18281448 [1,0,0,0,1,0|2,0,0]=4 10913 B8R1.8 NCCc1ccc[nH]1 Amb22497242 [1,0,0,0,1,0|2,0,0]=4 10914 B8R1.8 NCCc1ccc[nH]1 Amb22751407 [1,0,0,0,1,0|2,0,0]=4 10915 B8R1.8 NCCc1ccco1 Amb1080943 [1,0,0,0,1,0|2,0,0]=4 10916 B8R1.8 NCCc1ccco1 Amb22587649 [1,0,0,0,1,0|2,0,0]=4 10917 B8R1.8 NCCc1cccs1 Amb1073690 [1,0,0,0,1,0|2,0,0]=4 10918 B8R1.8 NCCc1cocc1 Amb18833105 [1,0,0,0,1,0|2,0,0]=4 10919 B8R1.8 NCCc1cscc1 Amb2236392 [1,0,0,0,1,0|2,0,0]=4 10920 B8R1.8 NCCn1cccc1 Amb2422800 [1,0,0,0,1,0|2,0,0]=4 10921 B8R1.8 OCCC1=CCC=C1 Amb25700126 [1,0,0,0,1,0|0,0,1]=3 10922 B8R1.8 OCCC1C=CC=C1 Amb25356398 [1,0,0,0,1,0|0,0,1]=3 10923 B8R1.8 OCCC=1CC=CC1 Amb25795365 [1,0,0,0,1,0|0,0,1]=3 10924 B8R1.8 OCC[n+]1c[s]cc1 Amb24518966 [1,0,0,0,1,0|2,0,0]=4 10925 B8R1.8 OCCc1[n]cc[s]1 Amb22235225 [1,0,0,0,1,0|2,0,0]=4 10926 B8R1.8 OCCc1c[nH]cc1 Amb18860246 [1,0,0,0,1,0|1,0,0]=3 10927 B8R1.8 OCCc1c[nH]nc1 Amb1935046 [1,0,0,0,1,0|2,0,0]=4 10928 B8R1.8 OCCc1c[n]c[nH]1 Amb22436833 [1,0,0,0,1,0|2,0,0]=4 10929 B8R1.8 OCCc1c[n]c[s]1 Amb22371829 [1,0,0,0,1,0|2,0,0]=4 10930 B8R1.8 OCCc1c[s]c[n]1 Amb23536235 [1,0,0,0,1,0|2,0,0]=4 10931 B8R1.8 OCCc1cc[nH][n]1 Amb22728903 [1,0,0,0,1,0|2,0,0]=4 10932 B8R1.8 OCCc1cc[n][s]1 Amb23441022 [1,0,0,0,1,0|2,0,0]=4 10933 B8R1.8 OCCc1ccc[nH]1 Amb17593146 [1,0,0,0,1,0|1,0,0]=3 10934 B8R1.8 OCCc1ccco1 Amb17089516 [1,0,0,0,1,0|1,0,0]=3 10935 B8R1.8 OCCc1cccs1 Amb2099445 [1,0,0,0,1,0|1,0,0]=3 10936 B8R1.8 OCCc1cocc1 Amb25802261 [1,0,0,0,1,0|1,0,0]=3 10937 B8R1.8 OCCc1cocn1 Amb17399797 [1,0,0,0,1,0|2,0,0]=4 10938 B8R1.8 OCCc1conc1 Amb1971497 [1,0,0,0,1,0|2,0,0]=4 10939 B8R1.8 ONCc1c[nH]cc1 Amb25677397 [1,0,0,0,1,0|2,0,0]=4 10940 B8R1.8 ONCc1ccc[nH]1 Amb25071150 [1,0,0,0,1,0|2,0,0]=4 10941 B8R1.8 ONCc1ccc[s]1 Amb23449451 [1,0,0,0,1,0|2,0,0]=4 10942 B8R1.8 ONCc1ccco1 Amb23449450 [1,0,0,0,1,0|2,0,0]=4 10943 B8R1.8 SCCc1c[nH]cc1 Amb18560654 [1,0,0,0,1,0|1,1,0]=4 10944 B8R1.8 SCCc1c[s]cc1 Amb25300451 [1,0,0,0,1,0|1,1,0]=4 10945 B8R1.8 SCCc1ccco1 Amb24511324 [1,0,0,0,1,0|1,1,0]=4 10946 B8R1.8 SCCc1cccs1 Amb17399886 [1,0,0,0,1,0|1,1,0]=4 10947 B12R1.329 OCCCC=1C=CC=CC=CC1 Amb25225983 [0,0,0,0,0,2|1,0,0]=3