0 B10R1.17 BrC=C=Cc1ccccc1 Amb17673290 [0,0,0,0,0,0|2,0,2]=4 1 B10R1.17 BrCCCc1c[n]c[n]c1 Amb25092294 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.17 BrCCCc1cc[n]cc1 Amb24094393 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.17 BrCCCc1cccnc1 Amb1102301 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.17 BrCCCc1cccnc1 Amb17610084 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.17 BrCCOc1cccc[n]1 Amb25808972 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.17 BrCCOc1ccccc1 Amb1152333 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.17 Br[Mg]C#Cc1ccccc1 Amb22353480 [0,0,0,0,0,0|2,0,2]=4 8 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [0,0,0,0,0,0|2,0,0]=2 9 B10R1.17 Br[Zn]C#Cc1ccccc1 Amb22898101 [0,0,0,0,0,0|2,0,2]=4 10 B10R1.17 Br[Zn]CCc1ccccc1 Amb22000434 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.17 Br\C=C/Oc1ccccc1 Amb25794486 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.17 Br\C=C\Cc1ccccc1 Amb22053885 [0,0,0,0,0,0|2,0,1]=3 13 B10R1.17 Br\C=N/Nc1ccccc1 Amb25783866 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.17 Br\C=N\Nc1ccccc1 Amb25274154 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.17 C#CC#Cc1ccccc1 Amb24585690 [0,0,0,0,0,0|2,0,2]=4 16 B10R1.17 C#CCCc1c[n]ccc1 Amb24085226 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.17 C#CCCc1cc[n]cc1 Amb24091331 [0,0,0,0,0,0|3,0,0]=3 18 B10R1.17 C#CCCc1cccc[n]1 Amb24571654 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.17 C#CCNc1c[n]ccc1 Amb24752597 [0,0,0,0,0,0|4,0,0]=4 20 B10R1.17 C#CCNc1cc[n]cc1 Amb18284709 [0,0,0,0,0,0|4,0,0]=4 21 B10R1.17 C#CCNc1cccc[n]1 Amb18959521 [0,0,0,0,0,0|4,0,0]=4 22 B10R1.17 C#CCNc1ccccc1 Amb21953889 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.17 C#CCOc1c[n]ccc1 Amb22586592 [0,0,0,0,0,0|4,0,0]=4 24 B10R1.17 C#CCOc1cc[n]cc1 Amb24117045 [0,0,0,0,0,0|4,0,0]=4 25 B10R1.17 C#CCOc1cccc[n]1 Amb24407701 [0,0,0,0,0,0|4,0,0]=4 26 B10R1.17 C#CCSc1cccc[n]1 Amb24070203 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.17 C#C\C=C\c1ccccc1 Amb25146407 [0,0,0,0,0,0|2,0,2]=4 28 B10R1.17 C=C/C=C/c1ccccc1 Amb17938988 [0,0,0,0,0,0|2,0,2]=4 29 B10R1.17 C=C=CCc1cccc[n]1 Amb24649907 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.17 C=C=COc1ccccc1 Amb17673264 [0,0,0,0,0,0|3,0,1]=4 31 B10R1.17 C=CC#Cc1ccccc1 Amb25696607 [0,0,0,0,0,0|2,0,2]=4 32 B10R1.17 C=CCCc1c[n]ccc1 Amb24477186 [0,0,0,0,0,0|3,0,0]=3 33 B10R1.17 C=CCCc1cc[n]cc1 Amb25719590 [0,0,0,0,0,0|3,0,0]=3 34 B10R1.17 C=CCCc1cccc[n]1 Amb25337662 [0,0,0,0,0,0|3,0,0]=3 35 B10R1.17 C=CCNc1cc[n]cc1 Amb18986519 [0,0,0,0,0,0|4,0,0]=4 36 B10R1.17 C=CCOc1cc[n]cc1 Amb25234559 [0,0,0,0,0,0|4,0,0]=4 37 B10R1.17 C=CCSc1cc[n]cc1 Amb25725359 [0,0,0,0,0,0|4,0,0]=4 38 B10R1.17 C=CC[Se]c1cccc[n]1 Amb24101157 [0,0,0,0,0,0|4,0,0]=4 39 B10R1.17 C=CC[Se]c1ccccc1 Amb22729991 [0,0,0,0,0,0|3,0,0]=3 40 B10R1.17 C=CNCc1ccccc1 Amb24505107 [0,0,0,0,0,0|3,0,0]=3 41 B10R1.17 C=COCc1ccccc1 Amb17940722 [0,0,0,0,0,0|3,0,0]=3 42 B10R1.17 C=NOCc1ccccc1 Amb24704253 [0,0,0,0,0,0|2,0,1]=3 43 B10R1.17 CC#COc1ccccc1 Amb25146348 [0,0,0,0,0,0|3,0,1]=4 44 B10R1.17 CC/C=C/c1ccccc1 Amb17673826 [0,0,0,0,0,0|2,0,2]=4 45 B10R1.17 CCCCC1C=CC=CN1 Amb25721630 [0,0,0,0,0,0|3,0,1]=4 46 B10R1.17 CCCCc1[n]ccc[n]1 Amb24104101 [0,0,0,0,0,0|4,0,0]=4 47 B10R1.17 CCCCc1c[n]c[n]c1 Amb24071084 [0,0,0,0,0,0|4,0,0]=4 48 B10R1.17 CCCCc1cc[n]c[n]1 Amb24091332 [0,0,0,0,0,0|4,0,0]=4 49 B10R1.17 CCCCc1ccc[n][n]1 Amb22235740 [0,0,0,0,0,0|4,0,0]=4 50 B10R1.17 CCCCc1ccccn1 Amb10574134 [0,0,0,0,0,0|3,0,0]=3 51 B10R1.17 CCCCc1ccncc1 Amb10555008 [0,0,0,0,0,0|3,0,0]=3 52 B10R1.17 CCCNc1ccccc1 Amb22284540 [0,0,0,0,0,0|3,0,0]=3 53 B10R1.17 CCCOc1c[n]ccc1 Amb25064833 [0,0,0,0,0,0|4,0,0]=4 54 B10R1.17 CCCOc1cccc[n]1 Amb24096899 [0,0,0,0,0,0|4,0,0]=4 55 B10R1.17 CCCSc1cccc[n]1 Amb24733306 [0,0,0,0,0,0|4,0,0]=4 56 B10R1.17 CCN=Cc1ccccc1 Amb15692852 [0,0,0,0,0,0|3,0,1]=4 57 B10R1.17 CCNCc1c[n]ccc1 Amb21972163 [0,0,0,0,0,0|4,0,0]=4 58 B10R1.17 CCNCc1ccncc1 Amb1214646 [0,0,0,0,0,0|4,0,0]=4 59 B10R1.17 CC\N=C\c1ccccc1 Amb10558476 [0,0,0,0,0,0|3,0,1]=4 60 B10R1.17 CN/N=C/c1ccccc1 Amb17867553 [0,0,0,0,0,0|2,0,1]=3 61 B10R1.17 CN=C=Nc1ccccc1 Amb24096797 [0,0,0,0,0,0|2,0,2]=4 62 B10R1.17 CNCCc1[n][n]cc[n]1 Amb18224135 [0,0,0,0,0,0|4,0,0]=4 63 B10R1.17 CNCCc1[n]c[n]c[n]1 Amb18861081 [0,0,0,0,0,0|4,0,0]=4 64 B10R1.17 CNCCc1c[n]cc[n]1 Amb22059364 [0,0,0,0,0,0|3,0,0]=3 65 B10R1.17 CNCCc1cc[n]cc1 Amb19958269 [0,0,0,0,0,0|2,0,0]=2 66 B10R1.17 CNCCc1cccc[n]1 Amb22167479 [0,0,0,0,0,0|2,0,0]=2 67 B10R1.17 CNCCc1ccccc1 Amb1132990 [0,0,0,0,0,0|1,0,0]=1 68 B10R1.17 CNCCc1ccccc1 Amb2119452 [0,0,0,0,0,0|1,0,0]=1 69 B10R1.17 CNCCc1ccccn1 Amb1651624 [0,0,0,0,0,0|2,0,0]=2 70 B10R1.17 CNCCc1cccnc1 Amb10068754 [0,0,0,0,0,0|2,0,0]=2 71 B10R1.17 CNCCc1cccnc1 Amb10576212 [0,0,0,0,0,0|2,0,0]=2 72 B10R1.17 CNCCc1cccnc1 Amb10576410 [0,0,0,0,0,0|2,0,0]=2 73 B10R1.17 CNCCc1ccncc1 Amb10071184 [0,0,0,0,0,0|2,0,0]=2 74 B10R1.17 CNNCc1c[n]ccc1 Amb24558769 [0,0,0,0,0,0|3,0,0]=3 75 B10R1.17 CNNCc1ccccc1 Amb10553073 [0,0,0,0,0,0|2,0,0]=2 76 B10R1.17 CNOCc1ccccc1 Amb22059601 [0,0,0,0,0,0|2,0,0]=2 77 B10R1.17 CN\C=N\c1c[n]ccc1 Amb24671021 [0,0,0,0,0,0|3,0,1]=4 78 B10R1.17 CN\C=N\c1cc[n]cc1 Amb25147549 [0,0,0,0,0,0|3,0,1]=4 79 B10R1.17 CN\C=N\c1ccccc1 Amb25348617 [0,0,0,0,0,0|2,0,1]=3 80 B10R1.17 CN\N=C\c1cc[n]cc1 Amb25071810 [0,0,0,0,0,0|3,0,1]=4 81 B10R1.17 CN\N=C\c1cccc[n]1 Amb24356439 [0,0,0,0,0,0|3,0,1]=4 82 B10R1.17 CN\N=N/c1cc[n]cc1 Amb24103183 [0,0,0,0,0,0|4,0,0]=4 83 B10R1.17 CN\N=N\c1ccccc1 Amb25720206 [0,0,0,0,0,0|3,0,0]=3 84 B10R1.17 COCCN1CC=CC=C1 Amb24064033 [0,0,0,0,0,0|3,0,1]=4 85 B10R1.17 COCC[n+]1ccccc1 Amb10554471 [0,0,0,0,0,0|3,0,0]=3 86 B10R1.17 COCCc1cccc[n]1 Amb24089662 [0,0,0,0,0,0|3,0,0]=3 87 B10R1.17 COCNc1ccccc1 Amb10565397 [0,0,0,0,0,0|3,0,0]=3 88 B10R1.17 COCOc1cccnc1 Amb10561791 [0,0,0,0,0,0|4,0,0]=4 89 B10R1.17 COCSc1cc[n]cc1 Amb25185189 [0,0,0,0,0,0|4,0,0]=4 90 B10R1.17 COCSc1cccc[n]1 Amb24482838 [0,0,0,0,0,0|4,0,0]=4 91 B10R1.17 CON=Cc1ccccc1 Amb22896936 [0,0,0,0,0,0|3,0,1]=4 92 B10R1.17 CONCc1c[n]ccc1 Amb24062508 [0,0,0,0,0,0|4,0,0]=4 93 B10R1.17 CONCc1cc[n]cc1 Amb25046027 [0,0,0,0,0,0|4,0,0]=4 94 B10R1.17 CONCc1cccc[n]1 Amb25723329 [0,0,0,0,0,0|4,0,0]=4 95 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [0,0,0,0,0,0|2,0,2]=4 96 B10R1.17 CO\N=C\c1ccccc1 Amb25762975 [0,0,0,0,0,0|3,0,1]=4 97 B10R1.17 CSCCc1cccc[n]1 Amb24552366 [0,0,0,0,0,0|3,0,0]=3 98 B10R1.17 CSCCc1ccncc1 Amb1864660 [0,0,0,0,0,0|3,0,0]=3 99 B10R1.17 CSCOc1ccccc1 Amb22231357 [0,0,0,0,0,0|3,0,0]=3 100 B10R1.17 CSCSc1cccc[n]1 Amb24658343 [0,0,0,0,0,0|4,0,0]=4 101 B10R1.17 CSCSc1ccccc1 Amb25162526 [0,0,0,0,0,0|3,0,0]=3 102 B10R1.17 CSSCc1ccccc1 Amb22230274 [0,0,0,0,0,0|3,0,0]=3 103 B10R1.17 C\C=C\C[n+]1ccccc1 Amb24464480 [0,0,0,0,0,0|3,0,1]=4 104 B10R1.17 C\C=C\Oc1ccccc1 Amb10564701 [0,0,0,0,0,0|3,0,1]=4 105 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [0,0,0,0,0,0|3,0,1]=4 106 B10R1.17 C\C=N\Cc1cc[n]cc1 Amb25243601 [0,0,0,0,0,0|4,0,0]=4 107 B10R1.17 ClC=C=Cc1ccccc1 Amb17670635 [0,0,0,0,0,0|2,0,2]=4 108 B10R1.17 ClC=CCc1ccccc1 Amb24093913 [0,0,0,0,0,0|2,0,1]=3 109 B10R1.17 ClCC#Cc1ccccc1 Amb17772264 [0,0,0,0,0,0|2,0,2]=4 110 B10R1.17 ClCCC[n+]1ccccc1 Amb24487853 [0,0,0,0,0,0|3,0,0]=3 111 B10R1.17 ClCCCc1[n]ccc[n]1 Amb24657327 [0,0,0,0,0,0|4,0,0]=4 112 B10R1.17 ClCCCc1cc[n]cc1 Amb21961566 [0,0,0,0,0,0|3,0,0]=3 113 B10R1.17 ClCCCc1ccccn1 Amb17477793 [0,0,0,0,0,0|3,0,0]=3 114 B10R1.17 ClCCCc1cccnc1 Amb17477795 [0,0,0,0,0,0|3,0,0]=3 115 B10R1.17 ClCCCc1ccncc1 Amb17477794 [0,0,0,0,0,0|3,0,0]=3 116 B10R1.17 ClCCNc1ccccc1 Amb17334388 [0,0,0,0,0,0|3,0,0]=3 117 B10R1.17 ClCCOc1c[n]ccc1 Amb19878080 [0,0,0,0,0,0|4,0,0]=4 118 B10R1.17 ClCCOc1c[n]ccc1 Amb22052586 [0,0,0,0,0,0|4,0,0]=4 119 B10R1.17 ClCCOc1cccc[n]1 Amb25098766 [0,0,0,0,0,0|4,0,0]=4 120 B10R1.17 ClCCPc1ccccc1 Amb24390336 [0,0,0,0,0,0|3,0,0]=3 121 B10R1.17 ClCSCc1ccccc1 Amb16231183 [0,0,0,0,0,0|3,0,0]=3 122 B10R1.17 ClC[SiH2]Cc1ccccc1 Amb24433498 [0,0,0,0,0,0|2,1,0]=3 123 B10R1.17 Cl[Mg]CCc1ccccc1 Amb22338391 [0,0,0,0,0,0|2,0,0]=2 124 B10R1.17 Cl\C=C\C[n+]1ccccc1 Amb24396864 [0,0,0,0,0,0|3,0,1]=4 125 B10R1.17 Cl\C=C\Cc1cc[n]cc1 Amb24697784 [0,0,0,0,0,0|3,0,1]=4 126 B10R1.17 Cl\C=C\Cc1ccccc1 Amb24384369 [0,0,0,0,0,0|2,0,1]=3 127 B10R1.17 FCC#Cc1ccccc1 Amb24586400 [0,0,0,0,0,0|2,0,2]=4 128 B10R1.17 FCCCc1ccccc1 Amb25737014 [0,0,0,0,0,0|2,0,0]=2 129 B10R1.17 FCCNc1c[n]ccc1 Amb24062313 [0,0,0,0,0,0|4,0,0]=4 130 B10R1.17 FCCNc1cc[n]cc1 Amb24099520 [0,0,0,0,0,0|4,0,0]=4 131 B10R1.17 FCCNc1cccc[n]1 Amb24509379 [0,0,0,0,0,0|4,0,0]=4 132 B10R1.17 FCCOc1c[n]ccc1 Amb24750081 [0,0,0,0,0,0|4,0,0]=4 133 B10R1.17 FCCOc1cccc[n]1 Amb24349895 [0,0,0,0,0,0|4,0,0]=4 134 B10R1.17 FCCOc1ccccc1 Amb25350055 [0,0,0,0,0,0|3,0,0]=3 135 B10R1.17 ICCCc1ccccc1 Amb10605506 [0,0,0,0,0,0|2,0,0]=2 136 B10R1.17 ICCOc1ccccc1 Amb10608588 [0,0,0,0,0,0|3,0,0]=3 137 B10R1.17 N#CC#Cc1ccccc1 Amb17593333 [0,0,0,0,0,0|1,0,3]=4 138 B10R1.17 N#CCCc1c[n]cc[n]1 Amb25830701 [0,0,0,0,0,0|3,0,1]=4 139 B10R1.17 N#CCCc1ccccn1 Amb1102488 [0,0,0,0,0,0|2,0,1]=3 140 B10R1.17 N#CCCc1cccnc1 Amb10605345 [0,0,0,0,0,0|2,0,1]=3 141 B10R1.17 N#CCNc1c[n]ccc1 Amb25757230 [0,0,0,0,0,0|3,0,1]=4 142 B10R1.17 N#CCNc1cccc[n]1 Amb22052191 [0,0,0,0,0,0|3,0,1]=4 143 B10R1.17 N#CCNc1ccccc1 Amb1651088 [0,0,0,0,0,0|2,0,1]=3 144 B10R1.17 N#CCOc1ccccn1 Amb2459771 [0,0,0,0,0,0|3,0,1]=4 145 B10R1.17 N#CCOc1cccnc1 Amb17399827 [0,0,0,0,0,0|3,0,1]=4 146 B10R1.17 N#CCSc1cc[n]cc1 Amb25725230 [0,0,0,0,0,0|3,0,1]=4 147 B10R1.17 N#CCSc1ccccn1 Amb2496389 [0,0,0,0,0,0|3,0,1]=4 148 B10R1.17 N#CNCc1cccnc1 Amb16186969 [0,0,0,0,0,0|3,0,1]=4 149 B10R1.17 N#CSCc1cc[n]cc1 Amb24596154 [0,0,0,0,0,0|3,0,1]=4 150 B10R1.17 N#C[Se]Cc1ccccc1 Amb22731764 [0,0,0,0,0,0|2,0,1]=3 151 B10R1.17 N#C\C=C\c1ccccc1 Amb1678044 [0,0,0,0,0,0|1,0,3]=4 152 B10R1.17 N=COCc1ccccc1 Amb22269902 [0,0,0,0,0,0|2,0,1]=3 153 B10R1.17 N=COCc1ccccc1 Amb24652885 [0,0,0,0,0,0|2,0,1]=3 154 B10R1.17 NCC#Cc1c[n]ccc1 Amb18281095 [0,0,0,0,0,0|2,0,2]=4 155 B10R1.17 NCC#Cc1cccc[n]1 Amb20668332 [0,0,0,0,0,0|2,0,2]=4 156 B10R1.17 NCC#Cc1ccccc1 Amb1239477 [0,0,0,0,0,0|1,0,2]=3 157 B10R1.17 NCC#Cc1ccccc1 Amb2371766 [0,0,0,0,0,0|1,0,2]=3 158 B10R1.17 NCCCc1[n][n]cc[n]1 Amb18203026 [0,0,0,0,0,0|4,0,0]=4 159 B10R1.17 NCCCc1[n]c[n]c[n]1 Amb18224126 [0,0,0,0,0,0|4,0,0]=4 160 B10R1.17 NCCCc1[n]ccc[n]1 Amb18064230 [0,0,0,0,0,0|3,0,0]=3 161 B10R1.17 NCCCc1c[n][n]cc1 Amb23559549 [0,0,0,0,0,0|3,0,0]=3 162 B10R1.17 NCCCc1c[n]c[n]c1 Amb22751643 [0,0,0,0,0,0|3,0,0]=3 163 B10R1.17 NCCCc1c[n]cc[n]1 Amb18832322 [0,0,0,0,0,0|3,0,0]=3 164 B10R1.17 NCCCc1c[n]cc[n]1 Amb20622876 [0,0,0,0,0,0|3,0,0]=3 165 B10R1.17 NCCCc1c[n]ccc1 Amb18363942 [0,0,0,0,0,0|2,0,0]=2 166 B10R1.17 NCCCc1cc[n]c[n]1 Amb18981848 [0,0,0,0,0,0|3,0,0]=3 167 B10R1.17 NCCCc1cc[n]cc1 Amb22490382 [0,0,0,0,0,0|2,0,0]=2 168 B10R1.17 NCCCc1cc[n]cc1 Amb24099592 [0,0,0,0,0,0|2,0,0]=2 169 B10R1.17 NCCCc1ccc[n][n]1 Amb25031583 [0,0,0,0,0,0|3,0,0]=3 170 B10R1.17 NCCCc1cccc[n]1 Amb21954278 [0,0,0,0,0,0|2,0,0]=2 171 B10R1.17 NCCCc1ccccc1 Amb22490482 [0,0,0,0,0,0|1,0,0]=1 172 B10R1.17 NCCCc1ccccn1 Amb1088884 [0,0,0,0,0,0|2,0,0]=2 173 B10R1.17 NCCNc1c[n][n]cc1 Amb25290327 [0,0,0,0,0,0|4,0,0]=4 174 B10R1.17 NCCNc1c[n]c[n]c1 Amb18298014 [0,0,0,0,0,0|4,0,0]=4 175 B10R1.17 NCCNc1cc[n]c[n]1 Amb18973879 [0,0,0,0,0,0|4,0,0]=4 176 B10R1.17 NCCNc1cc[n]cc1 Amb19887545 [0,0,0,0,0,0|3,0,0]=3 177 B10R1.17 NCCNc1ccc[n][n]1 Amb18298689 [0,0,0,0,0,0|4,0,0]=4 178 B10R1.17 NCCNc1ccccc1 Amb23412206 [0,0,0,0,0,0|2,0,0]=2 179 B10R1.17 NCCNc1ccccn1 Amb10608961 [0,0,0,0,0,0|3,0,0]=3 180 B10R1.17 NCCNc1ccccn1 Amb1154294 [0,0,0,0,0,0|3,0,0]=3 181 B10R1.17 NCCNc1cccnc1 Amb10607840 [0,0,0,0,0,0|3,0,0]=3 182 B10R1.17 NCCNc1cnccn1 Amb1108614 [0,0,0,0,0,0|4,0,0]=4 183 B10R1.17 NCCNc1ncccn1 Amb1108055 [0,0,0,0,0,0|4,0,0]=4 184 B10R1.17 NCCNc1ncccn1 Amb15740843 [0,0,0,0,0,0|4,0,0]=4 185 B10R1.17 NCCOc1[n]ccc[n]1 Amb18292247 [0,0,0,0,0,0|4,0,0]=4 186 B10R1.17 NCCOc1c[n]cc[n]1 Amb18296473 [0,0,0,0,0,0|4,0,0]=4 187 B10R1.17 NCCOc1cc[n]c[n]1 Amb18292252 [0,0,0,0,0,0|4,0,0]=4 188 B10R1.17 NCCOc1cc[n]cc1 Amb18988858 [0,0,0,0,0,0|3,0,0]=3 189 B10R1.17 NCCOc1cc[n]cc1 Amb22728098 [0,0,0,0,0,0|3,0,0]=3 190 B10R1.17 NCCOc1cc[n]cc1 Amb24182077 [0,0,0,0,0,0|3,0,0]=3 191 B10R1.17 NCCOc1ccc[n][n]1 Amb18298723 [0,0,0,0,0,0|4,0,0]=4 192 B10R1.17 NCCOc1ccccc1 Amb1214559 [0,0,0,0,0,0|2,0,0]=2 193 B10R1.17 NCCOc1ccccc1 Amb2099529 [0,0,0,0,0,0|2,0,0]=2 194 B10R1.17 NCCOc1ccccn1 Amb2237065 [0,0,0,0,0,0|3,0,0]=3 195 B10R1.17 NCCPc1ccccc1 Amb24482461 [0,0,0,0,0,0|2,0,0]=2 196 B10R1.17 NCCSc1c[n]cc[n]1 Amb18251482 [0,0,0,0,0,0|4,0,0]=4 197 B10R1.17 NCCSc1cc[n]c[n]1 Amb18251484 [0,0,0,0,0,0|4,0,0]=4 198 B10R1.17 NCCSc1cc[n]cc1 Amb21861873 [0,0,0,0,0,0|3,0,0]=3 199 B10R1.17 NCCSc1ccccn1 Amb13949032 [0,0,0,0,0,0|3,0,0]=3 200 B10R1.17 NC\C=C/c1c[n]ccc1 Amb25349251 [0,0,0,0,0,0|2,0,2]=4 201 B10R1.17 NC\C=C/c1cc[n]cc1 Amb25295348 [0,0,0,0,0,0|2,0,2]=4 202 B10R1.17 NC\C=C/c1cccc[n]1 Amb25299216 [0,0,0,0,0,0|2,0,2]=4 203 B10R1.17 NC\C=C/c1ccccc1 Amb24746209 [0,0,0,0,0,0|1,0,2]=3 204 B10R1.17 NC\C=C\c1c[n]ccc1 Amb18063302 [0,0,0,0,0,0|2,0,2]=4 205 B10R1.17 NC\C=C\c1cc[n]cc1 Amb18062333 [0,0,0,0,0,0|2,0,2]=4 206 B10R1.17 NC\C=C\c1cccc[n]1 Amb18063261 [0,0,0,0,0,0|2,0,2]=4 207 B10R1.17 NC\C=C\c1ccccc1 Amb16187112 [0,0,0,0,0,0|1,0,2]=3 208 B10R1.17 NNC#Cc1ccccc1 Amb24443265 [0,0,0,0,0,0|0,0,2]=2 209 B10R1.17 NNCCc1c[n]ccc1 Amb22491198 [0,0,0,0,0,0|1,0,0]=1 210 B10R1.17 NNCCc1cccc[n]1 Amb20669588 [0,0,0,0,0,0|1,0,0]=1 211 B10R1.17 NNCCc1ccccc1 Amb10608987 [0,0,0,0,0,0|0,0,0]=0 212 B10R1.17 NNCCc1ccccc1 Amb1117029 [0,0,0,0,0,0|0,0,0]=0 213 B10R1.17 NOCCc1c[n]ccc1 Amb25779030 [0,0,0,0,0,0|2,0,0]=2 214 B10R1.17 NOCCc1ccccn1 Amb17231907 [0,0,0,0,0,0|2,0,0]=2 215 B10R1.17 NOCCc1ccncc1 Amb17231908 [0,0,0,0,0,0|2,0,0]=2 216 B10R1.17 O=C=NCc1cccnc1 Amb17090261 [0,0,0,0,0,0|4,0,0]=4 217 B10R1.17 O=C=NCc1ccncc1 Amb17090262 [0,0,0,0,0,0|4,0,0]=4 218 B10R1.17 O=CCCc1[n]ccc[n]1 Amb24056162 [0,0,0,0,0,0|4,0,0]=4 219 B10R1.17 O=CCCc1c[n]c[n]c1 Amb24657168 [0,0,0,0,0,0|4,0,0]=4 220 B10R1.17 O=CCCc1ccccn1 Amb17081674 [0,0,0,0,0,0|3,0,0]=3 221 B10R1.17 O=CCCc1cccnc1 Amb17081675 [0,0,0,0,0,0|3,0,0]=3 222 B10R1.17 O=CCNc1cccc[n]1 Amb24100487 [0,0,0,0,0,0|4,0,0]=4 223 B10R1.17 O=CCNc1ccccc1 Amb24566865 [0,0,0,0,0,0|3,0,0]=3 224 B10R1.17 O=CCOc1c[n]ccc1 Amb24068437 [0,0,0,0,0,0|4,0,0]=4 225 B10R1.17 O=CCOc1cc[n]cc1 Amb24068570 [0,0,0,0,0,0|4,0,0]=4 226 B10R1.17 O=CCSc1cc[n]cc1 Amb24475471 [0,0,0,0,0,0|4,0,0]=4 227 B10R1.17 O=CCSc1cccc[n]1 Amb18799459 [0,0,0,0,0,0|4,0,0]=4 228 B10R1.17 O=CCSc1ccccc1 Amb17082903 [0,0,0,0,0,0|3,0,0]=3 229 B10R1.17 O=CNCc1cccc[n]1 Amb22370826 [0,0,0,0,0,0|4,0,0]=4 230 B10R1.17 O=CNCc1ccccc1 Amb1916036 [0,0,0,0,0,0|3,0,0]=3 231 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [0,0,0,0,0,0|2,0,2]=4 232 B10R1.17 O=C\C=N\c1ccccc1 Amb24561719 [0,0,0,0,0,0|3,0,1]=4 233 B10R1.17 O=NC#Cc1ccccc1 Amb24068843 [0,0,0,0,0,0|1,0,3]=4 234 B10R1.17 OCCCC=1CC=CCC1 Amb22047467 [0,0,0,0,0,0|2,0,2]=4 235 B10R1.17 OCCCc1[n]ccc[n]1 Amb22499265 [0,0,0,0,0,0|4,0,0]=4 236 B10R1.17 OCCCc1c[n][n]cc1 Amb23559794 [0,0,0,0,0,0|4,0,0]=4 237 B10R1.17 OCCCc1c[n]c[n]c1 Amb24063145 [0,0,0,0,0,0|4,0,0]=4 238 B10R1.17 OCCCc1c[n]cc[n]1 Amb22499266 [0,0,0,0,0,0|4,0,0]=4 239 B10R1.17 OCCCc1cc[n]c[n]1 Amb24099660 [0,0,0,0,0,0|4,0,0]=4 240 B10R1.17 OCCCc1cccc[n]1 Amb22749323 [0,0,0,0,0,0|3,0,0]=3 241 B10R1.17 OCCNc1c[n]ccc1 Amb18266115 [0,0,0,0,0,0|4,0,0]=4 242 B10R1.17 OCCNc1ccccc1 Amb24065196 [0,0,0,0,0,0|3,0,0]=3 243 B10R1.17 OCCNc1ccccc1 Amb24065197 [0,0,0,0,0,0|3,0,0]=3 244 B10R1.17 OCCNc1ccccn1 Amb10809152 [0,0,0,0,0,0|4,0,0]=4 245 B10R1.17 OCCOc1c[n]ccc1 Amb19333986 [0,0,0,0,0,0|4,0,0]=4 246 B10R1.17 OCCOc1cccc[n]1 Amb23598433 [0,0,0,0,0,0|4,0,0]=4 247 B10R1.17 OCCOc1ccccc1 Amb2209344 [0,0,0,0,0,0|3,0,0]=3 248 B10R1.17 OCCOc1ccncc1 Amb10552812 [0,0,0,0,0,0|4,0,0]=4 249 B10R1.17 OCCSc1c[n]ccc1 Amb25343843 [0,0,0,0,0,0|4,0,0]=4 250 B10R1.17 OCNCc1ccccc1 Amb24756521 [0,0,0,0,0,0|3,0,0]=3 251 B10R1.17 OCOCc1ccccc1 Amb25727798 [0,0,0,0,0,0|3,0,0]=3 252 B10R1.17 OC\C=N\c1ccccc1 Amb25740591 [0,0,0,0,0,0|3,0,1]=4 253 B10R1.17 OC\N=C\c1ccccc1 Amb25105990 [0,0,0,0,0,0|3,0,1]=4 254 B10R1.17 ONCCc1ccccc1 Amb24117032 [0,0,0,0,0,0|1,0,0]=1 255 B10R1.17 S=C=CNc1ccccc1 Amb25728146 [0,0,0,0,0,0|3,0,1]=4 256 B10R1.17 S=C=NCc1ccccc1 Amb1102095 [0,0,0,0,0,0|3,0,0]=3 257 B10R1.17 S=C=NCc1cccnc1 Amb1107163 [0,0,0,0,0,0|4,0,0]=4 258 B10R1.17 SCCCc1ccccn1 Amb17399950 [0,0,0,0,0,0|3,0,0]=3 259 B10R1.17 SCCCc1cccnc1 Amb17399951 [0,0,0,0,0,0|3,0,0]=3 260 B10R1.17 SCCCc1ccncc1 Amb17399952 [0,0,0,0,0,0|3,0,0]=3 261 B10R1.17 SCCNc1cccc[n]1 Amb24340493 [0,0,0,0,0,0|4,0,0]=4 262 B10R1.17 SCCNc1ccccc1 Amb24065195 [0,0,0,0,0,0|3,0,0]=3 263 B10R1.17 SCCOc1c[n]ccc1 Amb25741157 [0,0,0,0,0,0|4,0,0]=4 264 B10R1.17 SCCSc1ccccc1 Amb13881734 [0,0,0,0,0,0|3,0,0]=3 265 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [0,0,0,0,0,0|1,0,1]=2 266 B10R1.17 [C-]#[N+]CCc1ccncc1 Amb2235948 [0,0,0,0,0,0|2,0,1]=3 267 B10R1.17 [N-]=[N+]=NCc1cc[n]cc1 Amb19373643 [0,0,0,0,0,0|2,0,2]=4 268 B10R1.17 [N-]=[N+]=NCc1ccccn1 Amb10608487 [0,0,0,0,0,0|2,0,2]=4 269 B10R1.17 [N-]=[N+]=NCc1cccnc1 Amb10608488 [0,0,0,0,0,0|2,0,2]=4 270 B10R1.17 [NH-]\[NH+]=N\Cc1ccccc1 Amb25857928 [0,0,0,0,0,0|1,0,2]=3 271 B10R1.17 [NH3+]CC#Cc1ccccc1 Amb10555899 [0,0,0,0,0,0|1,0,3]=4 272 B10R1.17 [SiH3]CCCc1c[n]ccc1 Amb24085247 [0,0,0,0,0,0|3,0,0]=3 273 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [0,0,0,0,0,0|2,0,0]=2 274 B9R1.8 BOCc1cccc[n]1 Amb24406683 [1,0,0,0,0,0|3,0,0]=4 275 B9R1.8 BrC#Cc1ccccc1 Amb16233213 [1,0,0,0,0,0|1,0,2]=4 276 B9R1.8 BrCCc1c[n]c[n]c1 Amb18327370 [1,0,0,0,0,0|3,0,0]=4 277 B9R1.8 BrCCc1c[n]cc[n]1 Amb24652166 [1,0,0,0,0,0|3,0,0]=4 278 B9R1.8 BrCCc1c[n]ccc1 Amb19069960 [1,0,0,0,0,0|2,0,0]=3 279 B9R1.8 BrCCc1c[n]ccc1 Amb19372982 [1,0,0,0,0,0|2,0,0]=3 280 B9R1.8 BrCCc1cc[n]c[n]1 Amb25681855 [1,0,0,0,0,0|3,0,0]=4 281 B9R1.8 BrCCc1cc[n]cc1 Amb18326675 [1,0,0,0,0,0|2,0,0]=3 282 B9R1.8 BrCCc1ccccn1 Amb1102303 [1,0,0,0,0,0|2,0,0]=3 283 B9R1.8 BrCCc1ccccn1 Amb17935743 [1,0,0,0,0,0|2,0,0]=3 284 B9R1.8 BrCNc1ccccc1 Amb25758335 [1,0,0,0,0,0|2,0,0]=3 285 B9R1.8 Br[Mg]Cc1ccccc1 Amb20240676 [1,0,0,0,0,0|2,0,0]=3 286 B9R1.8 Br[Zn]Cc1ccccc1 Amb22000396 [1,0,0,0,0,0|2,0,0]=3 287 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [1,0,0,0,0,0|1,0,2]=4 288 B9R1.8 C#CC[n+]1ccccc1 Amb2227878 [1,0,0,0,0,0|2,0,1]=4 289 B9R1.8 C#CCc1cc[n]cc1 Amb24478677 [1,0,0,0,0,0|2,0,1]=4 290 B9R1.8 C#CCc1cccc[n]1 Amb25759001 [1,0,0,0,0,0|2,0,1]=4 291 B9R1.8 C#CSc1ccccc1 Amb17940373 [1,0,0,0,0,0|2,0,1]=4 292 B9R1.8 C#C[I+]c1ccccc1 Amb19883870 [1,0,0,0,0,0|2,0,1]=4 293 B9R1.8 C=CC[n+]1ccccc1 Amb10554482 [1,0,0,0,0,0|2,0,1]=4 294 B9R1.8 C=CC[n+]1ccccc1 Amb10573243 [1,0,0,0,0,0|2,0,1]=4 295 B9R1.8 C=CCc1c[n]ccc1 Amb24477831 [1,0,0,0,0,0|2,0,1]=4 296 B9R1.8 C=CNc1ccccc1 Amb24476658 [1,0,0,0,0,0|2,0,1]=4 297 B9R1.8 C=COc1ccccc1 Amb10564213 [1,0,0,0,0,0|2,0,1]=4 298 B9R1.8 C=NCc1c[n]ccc1 Amb24062506 [1,0,0,0,0,0|2,0,1]=4 299 B9R1.8 CCC[n+]1ccccc1 Amb24325390 [1,0,0,0,0,0|2,0,0]=3 300 B9R1.8 CCCc1[n]ccc[n]1 Amb24084965 [1,0,0,0,0,0|3,0,0]=4 301 B9R1.8 CCCc1c[n]c[n]c1 Amb24071652 [1,0,0,0,0,0|3,0,0]=4 302 B9R1.8 CCCc1cc[n]c[n]1 Amb24070638 [1,0,0,0,0,0|3,0,0]=4 303 B9R1.8 CCCc1ccc[n][n]1 Amb24447402 [1,0,0,0,0,0|3,0,0]=4 304 B9R1.8 CCCc1ccccc1 Amb2447143 [1,0,0,0,0,0|1,0,0]=2 305 B9R1.8 CCNc1ccccc1 Amb22731692 [1,0,0,0,0,0|2,0,0]=3 306 B9R1.8 CCOc1cccnc1 Amb10573342 [1,0,0,0,0,0|3,0,0]=4 307 B9R1.8 CNCc1[n]ccc[n]1 Amb22886406 [1,0,0,0,0,0|3,0,0]=4 308 B9R1.8 CNCc1c[n][n]cc1 Amb24183593 [1,0,0,0,0,0|3,0,0]=4 309 B9R1.8 CNCc1c[n]cc[n]1 Amb21959600 [1,0,0,0,0,0|3,0,0]=4 310 B9R1.8 CNCc1c[n]cc[n]1 Amb22498352 [1,0,0,0,0,0|3,0,0]=4 311 B9R1.8 CNCc1cc[n]c[n]1 Amb21962059 [1,0,0,0,0,0|3,0,0]=4 312 B9R1.8 CNCc1cc[n]c[n]1 Amb22587684 [1,0,0,0,0,0|3,0,0]=4 313 B9R1.8 CNCc1ccccn1 Amb10068750 [1,0,0,0,0,0|2,0,0]=3 314 B9R1.8 CNCc1ccccn1 Amb10576408 [1,0,0,0,0,0|2,0,0]=3 315 B9R1.8 CNCc1cccnc1 Amb10066918 [1,0,0,0,0,0|2,0,0]=3 316 B9R1.8 CNCc1cccnc1 Amb10576409 [1,0,0,0,0,0|2,0,0]=3 317 B9R1.8 CNCc1cccnc1 Amb1648828 [1,0,0,0,0,0|2,0,0]=3 318 B9R1.8 CNCc1ccncc1 Amb10068773 [1,0,0,0,0,0|2,0,0]=3 319 B9R1.8 CNCc1ccncc1 Amb10576211 [1,0,0,0,0,0|2,0,0]=3 320 B9R1.8 CNCc1ccncc1 Amb1115812 [1,0,0,0,0,0|2,0,0]=3 321 B9R1.8 CNCc1cnccn1 Amb1094140 [1,0,0,0,0,0|3,0,0]=4 322 B9R1.8 CNNc1cccc[n]1 Amb25146742 [1,0,0,0,0,0|3,0,0]=4 323 B9R1.8 CNNc1ccccc1 Amb20242875 [1,0,0,0,0,0|2,0,0]=3 324 B9R1.8 CNSc1ccccc1 Amb25811332 [1,0,0,0,0,0|2,0,0]=3 325 B9R1.8 COC[n+]1ccccc1 Amb25309455 [1,0,0,0,0,0|3,0,0]=4 326 B9R1.8 COCc1c[n]ccc1 Amb24106446 [1,0,0,0,0,0|3,0,0]=4 327 B9R1.8 COCc1cc[n]cc1 Amb24075931 [1,0,0,0,0,0|3,0,0]=4 328 B9R1.8 COPc1ccccc1 Amb22729661 [1,0,0,0,0,0|3,0,0]=4 329 B9R1.8 CSCc1c[n]ccc1 Amb24523080 [1,0,0,0,0,0|3,0,0]=4 330 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [1,0,0,0,0,0|1,0,1]=3 331 B9R1.8 ClC#Cc1ccccc1 Amb17670521 [1,0,0,0,0,0|1,0,2]=4 332 B9R1.8 ClC=Pc1ccccc1 Amb24480023 [1,0,0,0,0,0|2,0,1]=4 333 B9R1.8 ClCCc1[n]ccc[n]1 Amb25845186 [1,0,0,0,0,0|3,0,0]=4 334 B9R1.8 ClCCc1c[n]c[n]c1 Amb24529105 [1,0,0,0,0,0|3,0,0]=4 335 B9R1.8 ClCCc1c[n]cc[n]1 Amb24477833 [1,0,0,0,0,0|3,0,0]=4 336 B9R1.8 ClCCc1c[n]ccc1 Amb20241066 [1,0,0,0,0,0|2,0,0]=3 337 B9R1.8 ClCCc1c[n]ccc1 Amb24061504 [1,0,0,0,0,0|2,0,0]=3 338 B9R1.8 ClCCc1cc[n]c[n]1 Amb25100826 [1,0,0,0,0,0|3,0,0]=4 339 B9R1.8 ClCCc1cc[n]cc1 Amb23400891 [1,0,0,0,0,0|2,0,0]=3 340 B9R1.8 ClCCc1ccc[n][n]1 Amb25373976 [1,0,0,0,0,0|3,0,0]=4 341 B9R1.8 ClCCc1cccc[n]1 Amb19892295 [1,0,0,0,0,0|2,0,0]=3 342 B9R1.8 ClCCc1ccccn1 Amb1102254 [1,0,0,0,0,0|2,0,0]=3 343 B9R1.8 ClCNc1ccccc1 Amb25836772 [1,0,0,0,0,0|2,0,0]=3 344 B9R1.8 ClCOc1c[n]ccc1 Amb25780203 [1,0,0,0,0,0|3,0,0]=4 345 B9R1.8 ClCOc1ccccc1 Amb22059503 [1,0,0,0,0,0|2,0,0]=3 346 B9R1.8 ClCPc1ccccc1 Amb25294535 [1,0,0,0,0,0|2,0,0]=3 347 B9R1.8 ClCSc1c[n]ccc1 Amb25837457 [1,0,0,0,0,0|3,0,0]=4 348 B9R1.8 ClC[SiH2]c1ccccc1 Amb22230170 [1,0,0,0,0,0|1,1,0]=3 349 B9R1.8 ClSSc1ccccc1 Amb25248198 [1,0,0,0,0,0|3,0,0]=4 350 B9R1.8 Cl[Hg]Cc1ccccc1 Amb22360147 [1,0,0,0,0,0|2,0,0]=3 351 B9R1.8 Cl[Zn]Cc1cccc[n]1 Amb22000362 [1,0,0,0,0,0|3,0,0]=4 352 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [1,0,0,0,0,0|1,0,2]=4 353 B9R1.8 Cl\C=N\c1ccccc1 Amb24710175 [1,0,0,0,0,0|2,0,1]=4 354 B9R1.8 FC#Cc1ccccc1 Amb25080554 [1,0,0,0,0,0|1,0,2]=4 355 B9R1.8 FCCc1c[n]ccc1 Amb24085191 [1,0,0,0,0,0|2,0,0]=3 356 B9R1.8 FCCc1cc[n]cc1 Amb24102730 [1,0,0,0,0,0|2,0,0]=3 357 B9R1.8 FCCc1cccc[n]1 Amb24070130 [1,0,0,0,0,0|2,0,0]=3 358 B9R1.8 FCOc1ccccc1 Amb24099991 [1,0,0,0,0,0|2,0,0]=3 359 B9R1.8 FCSc1cccc[n]1 Amb24106749 [1,0,0,0,0,0|3,0,0]=4 360 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [1,0,0,0,0,0|1,0,2]=4 361 B9R1.8 ICCc1cccc[n]1 Amb24573930 [1,0,0,0,0,0|2,0,0]=3 362 B9R1.8 I[Hg]Cc1ccccc1 Amb22347189 [1,0,0,0,0,0|2,0,0]=3 363 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [1,0,0,0,0,0|1,0,2]=4 364 B9R1.8 N#CC[n+]1ccccc1 Amb10554489 [1,0,0,0,0,0|1,0,2]=4 365 B9R1.8 N#COc1ccccc1 Amb15692860 [1,0,0,0,0,0|1,0,2]=4 366 B9R1.8 N#C[13CH2]c1ccccc1 Amb22337751 [1,0,0,0,0,0|0,0,2]=3 367 B9R1.8 N#[13C]Cc1ccccc1 Amb22363279 [1,0,0,0,0,0|0,0,2]=3 368 B9R1.8 N#[13C][13CH2]c1ccccc1 Amb22367491 [1,0,0,0,0,0|0,0,2]=3 369 B9R1.8 NCCc1[n][n]cc[n]1 Amb18832893 [1,0,0,0,0,0|3,0,0]=4 370 B9R1.8 NCCc1[n]c[n]c[n]1 Amb18221652 [1,0,0,0,0,0|3,0,0]=4 371 B9R1.8 NCCc1[n]ccc[n]1 Amb18199432 [1,0,0,0,0,0|2,0,0]=3 372 B9R1.8 NCCc1[n]ccc[n]1 Amb23399636 [1,0,0,0,0,0|2,0,0]=3 373 B9R1.8 NCCc1[n]ccc[n]1 Amb24066982 [1,0,0,0,0,0|2,0,0]=3 374 B9R1.8 NCCc1c[n]c[n][n]1 Amb18832894 [1,0,0,0,0,0|3,0,0]=4 375 B9R1.8 NCCc1c[n]cc[n]1 Amb22756001 [1,0,0,0,0,0|2,0,0]=3 376 B9R1.8 NCCc1c[n]cc[n]1 Amb24066949 [1,0,0,0,0,0|2,0,0]=3 377 B9R1.8 NCCc1c[n]ccc1 Amb20241523 [1,0,0,0,0,0|1,0,0]=2 378 B9R1.8 NCCc1cc[n]c[n]1 Amb22899210 [1,0,0,0,0,0|2,0,0]=3 379 B9R1.8 NCCc1cc[n]cc1 Amb20240779 [1,0,0,0,0,0|1,0,0]=2 380 B9R1.8 NCCc1ccc[n][n]1 Amb23592188 [1,0,0,0,0,0|2,0,0]=3 381 B9R1.8 NCCc1cccc[n]1 Amb24065228 [1,0,0,0,0,0|1,0,0]=2 382 B9R1.8 NCCc1cccc[n]1 Amb24066975 [1,0,0,0,0,0|1,0,0]=2 383 B9R1.8 NCCc1ccccc1 Amb17772283 [1,0,0,0,0,0|0,0,0]=1 384 B9R1.8 NCCc1ccccc1 Amb17843439 [1,0,0,0,0,0|0,0,0]=1 385 B9R1.8 NCCc1ccccc1 Amb22360716 [1,0,0,0,0,0|0,0,0]=1 386 B9R1.8 NCCc1ccccc1 Amb24325112 [1,0,0,0,0,0|0,0,0]=1 387 B9R1.8 NCCc1ccccc1 Amb24325408 [1,0,0,0,0,0|0,0,0]=1 388 B9R1.8 NCCc1ccccn1 Amb1156071 [1,0,0,0,0,0|1,0,0]=2 389 B9R1.8 NCCc1cccnc1 Amb1134784 [1,0,0,0,0,0|1,0,0]=2 390 B9R1.8 NCCc1cccnc1 Amb16230500 [1,0,0,0,0,0|1,0,0]=2 391 B9R1.8 NCCc1ccncc1 Amb1102164 [1,0,0,0,0,0|1,0,0]=2 392 B9R1.8 NCCc1cnccn1 Amb10067912 [1,0,0,0,0,0|2,0,0]=3 393 B9R1.8 NCCc1cnccn1 Amb1995199 [1,0,0,0,0,0|2,0,0]=3 394 B9R1.8 NCCc1ncccn1 Amb17074351 [1,0,0,0,0,0|2,0,0]=3 395 B9R1.8 NCNc1ccccc1 Amb17117015 [1,0,0,0,0,0|1,0,0]=2 396 B9R1.8 NCOc1ccccc1 Amb25128781 [1,0,0,0,0,0|1,0,0]=2 397 B9R1.8 NCSc1ccccc1 Amb25128061 [1,0,0,0,0,0|1,0,0]=2 398 B9R1.8 NC[13CH2]c1ccccc1 Amb22367506 [1,0,0,0,0,0|0,0,0]=1 399 B9R1.8 NClNc1cc[n]cc1 Amb25207337 [1,0,0,0,0,0|3,0,0]=4 400 B9R1.8 NN=Cc1c[n]ccc1 Amb24082007 [1,0,0,0,0,0|1,0,2]=4 401 B9R1.8 NNCc1[n]ccc[n]1 Amb23439061 [1,0,0,0,0,0|2,0,0]=3 402 B9R1.8 NNCc1c[n][n]cc1 Amb23586392 [1,0,0,0,0,0|2,0,0]=3 403 B9R1.8 NNCc1c[n]c[n]c1 Amb21960158 [1,0,0,0,0,0|2,0,0]=3 404 B9R1.8 NNCc1c[n]c[n]c1 Amb22899760 [1,0,0,0,0,0|2,0,0]=3 405 B9R1.8 NNCc1c[n]cc[n]1 Amb21964577 [1,0,0,0,0,0|2,0,0]=3 406 B9R1.8 NNCc1c[n]ccc1 Amb19893243 [1,0,0,0,0,0|1,0,0]=2 407 B9R1.8 NNCc1c[n]ccc1 Amb22491471 [1,0,0,0,0,0|1,0,0]=2 408 B9R1.8 NNCc1cc[n]c[n]1 Amb23586399 [1,0,0,0,0,0|2,0,0]=3 409 B9R1.8 NNCc1cc[n]cc1 Amb19893255 [1,0,0,0,0,0|1,0,0]=2 410 B9R1.8 NNCc1ccc[n][n]1 Amb23586393 [1,0,0,0,0,0|2,0,0]=3 411 B9R1.8 NNCc1cccc[n]1 Amb19893254 [1,0,0,0,0,0|1,0,0]=2 412 B9R1.8 NNCc1ccccc1 Amb1105200 [1,0,0,0,0,0|0,0,0]=1 413 B9R1.8 NNCc1ccccc1 Amb16231890 [1,0,0,0,0,0|0,0,0]=1 414 B9R1.8 NNCc1ccccc1 Amb22492438 [1,0,0,0,0,0|0,0,0]=1 415 B9R1.8 NNCc1ccccn1 Amb1117330 [1,0,0,0,0,0|1,0,0]=2 416 B9R1.8 NNCc1cccnc1 Amb1121062 [1,0,0,0,0,0|1,0,0]=2 417 B9R1.8 NNCc1ccncc1 Amb1118337 [1,0,0,0,0,0|1,0,0]=2 418 B9R1.8 NOCc1[n]ccc[n]1 Amb25702287 [1,0,0,0,0,0|3,0,0]=4 419 B9R1.8 NOCc1c[n]ccc1 Amb22059440 [1,0,0,0,0,0|2,0,0]=3 420 B9R1.8 NOCc1c[n]ccc1 Amb24074265 [1,0,0,0,0,0|2,0,0]=3 421 B9R1.8 NOCc1cc[n]cc1 Amb22397036 [1,0,0,0,0,0|2,0,0]=3 422 B9R1.8 NOCc1cccc[n]1 Amb18642195 [1,0,0,0,0,0|2,0,0]=3 423 B9R1.8 NOCc1ccccc1 Amb1154307 [1,0,0,0,0,0|1,0,0]=2 424 B9R1.8 NOCc1ccccc1 Amb16204809 [1,0,0,0,0,0|1,0,0]=2 425 B9R1.8 NOCc1ccccc1 Amb22489499 [1,0,0,0,0,0|1,0,0]=2 426 B9R1.8 N[13CH2][13CH2]c1ccccc1 Amb22367507 [1,0,0,0,0,0|0,0,0]=1 427 B9R1.8 N\C=C/c1cc[n]cc1 Amb24068867 [1,0,0,0,0,0|1,0,2]=4 428 B9R1.8 N\C=C\c1cc[n]cc1 Amb24749618 [1,0,0,0,0,0|1,0,2]=4 429 B9R1.8 N\C=C\c1cccc[n]1 Amb24518526 [1,0,0,0,0,0|1,0,2]=4 430 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [1,0,0,0,0,0|1,0,1]=3 431 B9R1.8 N\N=C/c1cc[n]cc1 Amb25146897 [1,0,0,0,0,0|1,0,2]=4 432 B9R1.8 N\N=C\c1ccccc1 Amb2539422 [1,0,0,0,0,0|0,0,2]=3 433 B9R1.8 O=C=Cc1ccccc1 Amb25348365 [1,0,0,0,0,0|1,0,2]=4 434 B9R1.8 O=C=Nc1ccccc1 Amb22336344 [1,0,0,0,0,0|2,0,1]=4 435 B9R1.8 O=CCc1ccccn1 Amb17089528 [1,0,0,0,0,0|2,0,1]=4 436 B9R1.8 O=CCc1ccncc1 Amb17089529 [1,0,0,0,0,0|2,0,1]=4 437 B9R1.8 O=COc1ccccc1 Amb22002710 [1,0,0,0,0,0|2,0,1]=4 438 B9R1.8 OCC[n+]1ccccc1 Amb22364462 [1,0,0,0,0,0|2,0,0]=3 439 B9R1.8 OCCc1[n]ccc[n]1 Amb22896758 [1,0,0,0,0,0|3,0,0]=4 440 B9R1.8 OCCc1c[n][n]cc1 Amb23559765 [1,0,0,0,0,0|3,0,0]=4 441 B9R1.8 OCCc1c[n]c[n]c1 Amb20240921 [1,0,0,0,0,0|3,0,0]=4 442 B9R1.8 OCCc1cc[n]cc1 Amb24325389 [1,0,0,0,0,0|2,0,0]=3 443 B9R1.8 OCCc1ccc[n][n]1 Amb25086060 [1,0,0,0,0,0|3,0,0]=4 444 B9R1.8 OCCc1ccncn1 Amb17593271 [1,0,0,0,0,0|3,0,0]=4 445 B9R1.8 OCNc1cccc[n]1 Amb25066721 [1,0,0,0,0,0|3,0,0]=4 446 B9R1.8 OCOc1ccccc1 Amb25847006 [1,0,0,0,0,0|2,0,0]=3 447 B9R1.8 ONCc1[n]ccc[n]1 Amb23586395 [1,0,0,0,0,0|3,0,0]=4 448 B9R1.8 ONCc1c[n][n]cc1 Amb23586390 [1,0,0,0,0,0|3,0,0]=4 449 B9R1.8 ONCc1c[n]ccc1 Amb25147084 [1,0,0,0,0,0|2,0,0]=3 450 B9R1.8 ONCc1cc[n]c[n]1 Amb23586394 [1,0,0,0,0,0|3,0,0]=4 451 B9R1.8 ONCc1cc[n]cc1 Amb25851052 [1,0,0,0,0,0|2,0,0]=3 452 B9R1.8 ONCc1ccc[n][n]1 Amb23586391 [1,0,0,0,0,0|3,0,0]=4 453 B9R1.8 ONCc1ccccc1 Amb22001943 [1,0,0,0,0,0|1,0,0]=2 454 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [1,0,0,0,0,0|1,0,2]=4 455 B9R1.8 S=C=Cc1ccccc1 Amb24084687 [1,0,0,0,0,0|1,0,2]=4 456 B9R1.8 S=C=Nc1ccccc1 Amb1161696 [1,0,0,0,0,0|2,0,1]=4 457 B9R1.8 S=CNc1ccccc1 Amb25788857 [1,0,0,0,0,0|2,0,1]=4 458 B9R1.8 SCCc1c[n]ccc1 Amb22008806 [1,0,0,0,0,0|2,0,0]=3 459 B9R1.8 SCCc1ccccn1 Amb17619707 [1,0,0,0,0,0|2,0,0]=3 460 B9R1.8 SCCc1ccncc1 Amb10552830 [1,0,0,0,0,0|2,0,0]=3 461 B9R1.8 [2H]C#Cc1ccccc1 Amb22351662 [1,0,0,0,0,0|1,0,2]=4 462 B9R1.8 [2H]\C=C/c1ccccc1 Amb22338396 [1,0,0,0,0,0|1,0,2]=4 463 B9R1.8 [2H]\C=C\c1ccccc1 Amb22351848 [1,0,0,0,0,0|1,0,2]=4 464 B9R1.8 [C-]#[N+]Cc1ccccc1 Amb2234859 [1,0,0,0,0,0|1,0,1]=3 465 B9R1.8 [C-]#[N+]Cc1ccccn1 Amb1981098 [1,0,0,0,0,0|2,0,1]=4 466 B9R1.8 [C-]#[N+]Cc1cccnc1 Amb1981058 [1,0,0,0,0,0|2,0,1]=4 467 B9R1.8 [C-]#[N+]Cc1ccncc1 Amb1981059 [1,0,0,0,0,0|2,0,1]=4 468 B9R1.8 [CH2-]\C=C\c1ccccc1 Amb22748801 [1,0,0,0,0,0|1,0,2]=4 469 B9R1.8 [Cu]C#Cc1ccccc1 Amb2480676 [1,0,0,0,0,0|1,0,2]=4 470 B9R1.8 [Li]C#Cc1ccccc1 Amb22336681 [1,0,0,0,0,0|1,0,2]=4 471 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [1,0,0,0,0,0|0,0,3]=4 472 B9R1.8 [NH3+]CCc1cc[nH+]cc1 Amb10553712 [1,0,0,0,0,0|1,0,1]=3 473 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [1,0,0,0,0,0|0,0,1]=2 474 B11R1.1 BrCCCc1ccc(I)cc1 Amb25083701 [0,1,0,0,0,0|2,0,0]=3 475 B11R1.1 BrCCCc1ccc(cc1)Br Amb17104577 [0,1,0,0,0,0|2,0,0]=3 476 B11R1.1 BrCCCc1ccc(cc1)C Amb17104554 [0,1,0,0,0,0|2,0,0]=3 477 B11R1.1 BrCCCc1ccc(cc1)Cl Amb17104562 [0,1,0,0,0,0|2,0,0]=3 478 B11R1.1 BrCCCc1ccc(cc1)F Amb17104556 [0,1,0,0,0,0|2,0,0]=3 479 B11R1.1 BrCCOc1ccc(cc1)Br Amb1106775 [0,1,0,0,0,0|3,0,0]=4 480 B11R1.1 BrCCOc1ccc(cc1)C Amb1397755 [0,1,0,0,0,0|3,0,0]=4 481 B11R1.1 BrCCOc1ccc(cc1)Cl Amb1151965 [0,1,0,0,0,0|3,0,0]=4 482 B11R1.1 BrCCOc1ccc(cc1)F Amb1152775 [0,1,0,0,0,0|3,0,0]=4 483 B11R1.1 Br[Zn]CCc1ccc(cc1)Br Amb13890855 [0,1,0,0,0,0|2,0,0]=3 484 B11R1.1 Brc1ccc(C[Se]C#N)cc1 Amb17779550 [0,1,0,0,0,0|2,0,1]=4 485 B11R1.1 C#CCCN1C=CC(=O)C=C1 Amb24471657 [0,1,0,0,0,0|3,0,0]=4 486 B11R1.1 C#CCCc1ccc(Br)cc1 Amb18116967 [0,1,0,0,0,0|2,0,0]=3 487 B11R1.1 C#CCCc1ccc(Cl)cc1 Amb18116815 [0,1,0,0,0,0|2,0,0]=3 488 B11R1.1 C#CCCc1ccc(F)cc1 Amb18116891 [0,1,0,0,0,0|2,0,0]=3 489 B11R1.1 C#CCNc1ccc(F)cc1 Amb24070273 [0,1,0,0,0,0|3,0,0]=4 490 B11R1.1 C#CCNc1ccc(I)cc1 Amb25195277 [0,1,0,0,0,0|3,0,0]=4 491 B11R1.1 C#CCNc1ccc(O)cc1 Amb24563278 [0,1,0,0,0,0|3,0,0]=4 492 B11R1.1 C#CCOc1ccc(F)cc1 Amb18182727 [0,1,0,0,0,0|3,0,0]=4 493 B11R1.1 C#CCOc1ccc(I)cc1 Amb24476574 [0,1,0,0,0,0|3,0,0]=4 494 B11R1.1 C#CCOc1ccc(N)cc1 Amb22587338 [0,1,0,0,0,0|3,0,0]=4 495 B11R1.1 C#CCOc1ccc(cc1)N Amb13783679 [0,1,0,0,0,0|3,0,0]=4 496 B11R1.1 C#CCSc1ccc(Br)cc1 Amb24669370 [0,1,0,0,0,0|3,0,0]=4 497 B11R1.1 C#CCSc1ccc(F)cc1 Amb18801035 [0,1,0,0,0,0|3,0,0]=4 498 B11R1.1 C#CCSc1ccc(O)cc1 Amb18792578 [0,1,0,0,0,0|3,0,0]=4 499 B11R1.1 C=CCCc1ccc(Br)c[n]1 Amb24759377 [0,1,0,0,0,0|3,0,0]=4 500 B11R1.1 C=CCCc1ccc(I)cc1 Amb25349986 [0,1,0,0,0,0|2,0,0]=3 501 B11R1.1 C=CCCc1ccc(N)cc1 Amb18124837 [0,1,0,0,0,0|2,0,0]=3 502 B11R1.1 C=CCCc1ccc(O)cc1 Amb25249578 [0,1,0,0,0,0|2,0,0]=3 503 B11R1.1 C=CCNc1ccc(N)cc1 Amb18991898 [0,1,0,0,0,0|3,0,0]=4 504 B11R1.1 C=CCNc1ccc(cc1)Br Amb17306795 [0,1,0,0,0,0|3,0,0]=4 505 B11R1.1 C=CCNc1ccc(cc1)C Amb17306868 [0,1,0,0,0,0|3,0,0]=4 506 B11R1.1 C=CCNc1ccc(cc1)Cl Amb17307236 [0,1,0,0,0,0|3,0,0]=4 507 B11R1.1 C=CCNc1ccc(cc1)F Amb17306180 [0,1,0,0,0,0|3,0,0]=4 508 B11R1.1 C=CCNc1ccc(cc1)I Amb17306247 [0,1,0,0,0,0|3,0,0]=4 509 B11R1.1 C=CCOc1ccc(Cl)cc1 Amb17933920 [0,1,0,0,0,0|3,0,0]=4 510 B11R1.1 C=CCOc1ccc(I)cc1 Amb25699607 [0,1,0,0,0,0|3,0,0]=4 511 B11R1.1 C=CCSc1ccc(F)cc1 Amb24615573 [0,1,0,0,0,0|3,0,0]=4 512 B11R1.1 C=NCCc1ccc(O)cc1 Amb25327788 [0,1,0,0,0,0|1,0,1]=3 513 B11R1.1 CC=CCc1ccc(O)cc1 Amb24094301 [0,1,0,0,0,0|2,0,1]=4 514 B11R1.1 CCCCN1C=CC(=N)C=C1 Amb19805017 [0,1,0,0,0,0|3,0,0]=4 515 B11R1.1 CCCCN1C=CC(=N)C=C1 Amb21922071 [0,1,0,0,0,0|3,0,0]=4 516 B11R1.1 CCCCN1C=CC(=[NH2+])C=C1 Amb22555482 [0,1,0,0,0,0|3,0,0]=4 517 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22350531 [0,1,0,0,0,0|3,0,0]=4 518 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22350545 [0,1,0,0,0,0|3,0,0]=4 519 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22353653 [0,1,0,0,0,0|3,0,0]=4 520 B11R1.1 CCCCc1ccc(Br)c[n]1 Amb24483961 [0,1,0,0,0,0|3,0,0]=4 521 B11R1.1 CCCCc1ccc(Cl)[n]c1 Amb21963887 [0,1,0,0,0,0|3,0,0]=4 522 B11R1.1 CCCCc1ccc(F)cc1 Amb22730516 [0,1,0,0,0,0|2,0,0]=3 523 B11R1.1 CCCCc1ccc(O)c[n]1 Amb25831110 [0,1,0,0,0,0|3,0,0]=4 524 B11R1.1 CCCNc1ccc(Cl)cc1 Amb19407162 [0,1,0,0,0,0|3,0,0]=4 525 B11R1.1 CCCOc1ccc(Cl)cc1 Amb25126411 [0,1,0,0,0,0|3,0,0]=4 526 B11R1.1 CCCOc1ccc(F)cc1 Amb24105714 [0,1,0,0,0,0|3,0,0]=4 527 B11R1.1 CCCOc1ccc(I)cc1 Amb24064716 [0,1,0,0,0,0|3,0,0]=4 528 B11R1.1 CCCOc1ccc(S)cc1 Amb25225762 [0,1,0,0,0,0|3,0,0]=4 529 B11R1.1 CCCOc1ccc(cc1)N Amb1125044 [0,1,0,0,0,0|3,0,0]=4 530 B11R1.1 CCCOc1ccc(cc1)O Amb1810008 [0,1,0,0,0,0|3,0,0]=4 531 B11R1.1 CCCSc1ccc(N)cc1 Amb22588114 [0,1,0,0,0,0|3,0,0]=4 532 B11R1.1 CCCSc1ccc(O)cc1 Amb18180159 [0,1,0,0,0,0|3,0,0]=4 533 B11R1.1 CCCSc1ccc(S)cc1 Amb24362640 [0,1,0,0,0,0|3,0,0]=4 534 B11R1.1 CCNCc1ccc(I)cc1 Amb25050868 [0,1,0,0,0,0|3,0,0]=4 535 B11R1.1 CCNCc1ccc(cc1)O Amb13952053 [0,1,0,0,0,0|3,0,0]=4 536 B11R1.1 CCOCc1ccc(Br)cc1 Amb19415022 [0,1,0,0,0,0|3,0,0]=4 537 B11R1.1 CCOCc1ccc(O)cc1 Amb18125402 [0,1,0,0,0,0|3,0,0]=4 538 B11R1.1 CCOCc1ccc(cc1)N Amb1125782 [0,1,0,0,0,0|3,0,0]=4 539 B11R1.1 CCSCc1ccc(Br)cc1 Amb25684606 [0,1,0,0,0,0|3,0,0]=4 540 B11R1.1 CCSCc1ccc(Cl)cc1 Amb24402210 [0,1,0,0,0,0|3,0,0]=4 541 B11R1.1 CCSCc1ccc(F)cc1 Amb24486978 [0,1,0,0,0,0|3,0,0]=4 542 B11R1.1 CCSCc1ccc(O)cc1 Amb18126551 [0,1,0,0,0,0|3,0,0]=4 543 B11R1.1 CN/N=C/c1ccc(F)cc1 Amb17805862 [0,1,0,0,0,0|2,0,1]=4 544 B11R1.1 CN/N=C/c1ccc(O)cc1 Amb17696985 [0,1,0,0,0,0|2,0,1]=4 545 B11R1.1 CNCCN1C=CC(=O)C=C1 Amb18999197 [0,1,0,0,0,0|2,0,0]=3 546 B11R1.1 CNCC[n+]1ccc(C)cc1 Amb25289045 [0,1,0,0,0,0|2,0,0]=3 547 B11R1.1 CNCCc1[n]cc(Br)c[n]1 Amb25189084 [0,1,0,0,0,0|3,0,0]=4 548 B11R1.1 CNCCc1ccc(N)c[n]1 Amb24387854 [0,1,0,0,0,0|2,0,0]=3 549 B11R1.1 CNCCc1ccc(N)cc1 Amb18290354 [0,1,0,0,0,0|1,0,0]=2 550 B11R1.1 CNCCc1ccc(cc1)O Amb15690577 [0,1,0,0,0,0|1,0,0]=2 551 B11R1.1 CNN=Nc1ccc(Cl)cc1 Amb24064378 [0,1,0,0,0,0|3,0,0]=4 552 B11R1.1 CN\N=C/c1ccc(F)cc1 Amb24100277 [0,1,0,0,0,0|2,0,1]=4 553 B11R1.1 CN\N=C\c1ccc(cc1)Br Amb16842488 [0,1,0,0,0,0|2,0,1]=4 554 B11R1.1 COCCN1C=CC(=O)C=C1 Amb24460542 [0,1,0,0,0,0|3,0,0]=4 555 B11R1.1 COCCc1ccc(Cl)cc1 Amb24118075 [0,1,0,0,0,0|2,0,0]=3 556 B11R1.1 COCCc1ccc(I)cc1 Amb25360538 [0,1,0,0,0,0|2,0,0]=3 557 B11R1.1 COCCc1ccc(cc1)N Amb1139224 [0,1,0,0,0,0|2,0,0]=3 558 B11R1.1 COCNc1ccc(F)cc1 Amb24070274 [0,1,0,0,0,0|3,0,0]=4 559 B11R1.1 COCOc1ccc(Br)cc1 Amb22001005 [0,1,0,0,0,0|3,0,0]=4 560 B11R1.1 COCOc1ccc(F)cc1 Amb22546791 [0,1,0,0,0,0|3,0,0]=4 561 B11R1.1 COCOc1ccc(N)cc1 Amb24092674 [0,1,0,0,0,0|3,0,0]=4 562 B11R1.1 COCOc1ccc(O)cc1 Amb25268752 [0,1,0,0,0,0|3,0,0]=4 563 B11R1.1 COCSc1ccc(Br)cc1 Amb24473100 [0,1,0,0,0,0|3,0,0]=4 564 B11R1.1 COCSc1ccc(Cl)cc1 Amb24393521 [0,1,0,0,0,0|3,0,0]=4 565 B11R1.1 COCSc1ccc(N)cc1 Amb25714979 [0,1,0,0,0,0|3,0,0]=4 566 B11R1.1 CONCc1ccc(Br)cc1 Amb25151171 [0,1,0,0,0,0|3,0,0]=4 567 B11R1.1 CONCc1ccc(O)cc1 Amb24383951 [0,1,0,0,0,0|3,0,0]=4 568 B11R1.1 CSCCN1C=CC(=O)C=C1 Amb24376848 [0,1,0,0,0,0|3,0,0]=4 569 B11R1.1 CSCCc1ccc(N)cc1 Amb18971649 [0,1,0,0,0,0|2,0,0]=3 570 B11R1.1 CSCOc1ccc(Cl)cc1 Amb24553356 [0,1,0,0,0,0|3,0,0]=4 571 B11R1.1 CSCOc1ccc(F)cc1 Amb24645973 [0,1,0,0,0,0|3,0,0]=4 572 B11R1.1 CSCSc1ccc(Br)cc1 Amb25162619 [0,1,0,0,0,0|3,0,0]=4 573 B11R1.1 CSCSc1ccc(F)cc1 Amb25768258 [0,1,0,0,0,0|3,0,0]=4 574 B11R1.1 C\C=C\Cc1ccc(N)cc1 Amb22751067 [0,1,0,0,0,0|2,0,1]=4 575 B11R1.1 C\C=C\Cc1ccc(O)cc1 Amb18124917 [0,1,0,0,0,0|2,0,1]=4 576 B11R1.1 Cc1[n]cc(CCCN)c[n]1 Amb18201573 [0,1,0,0,0,0|3,0,0]=4 577 B11R1.1 Cc1c[n]c(CCCN)[n]c1 Amb24477627 [0,1,0,0,0,0|3,0,0]=4 578 B11R1.1 Cc1c[n]c(CCCN)c[n]1 Amb18201571 [0,1,0,0,0,0|3,0,0]=4 579 B11R1.1 Cc1cc[n+](CCCO)cc1 Amb24466262 [0,1,0,0,0,0|3,0,0]=4 580 B11R1.1 Cc1ccc(CCC#C)cc1 Amb18634818 [0,1,0,0,0,0|2,0,0]=3 581 B11R1.1 Cc1ccc(CCC#N)[n]c1 Amb18124806 [0,1,0,0,0,0|2,0,1]=4 582 B11R1.1 Cc1ccc(CCC=C)[n]c1 Amb24100505 [0,1,0,0,0,0|3,0,0]=4 583 B11R1.1 Cc1ccc(CCC=O)[n]c1 Amb25723084 [0,1,0,0,0,0|3,0,0]=4 584 B11R1.1 Cc1ccc(CCCC)[n]c1 Amb24676615 [0,1,0,0,0,0|3,0,0]=4 585 B11R1.1 Cc1ccc(CCCC)cc1 Amb22002059 [0,1,0,0,0,0|2,0,0]=3 586 B11R1.1 Cc1ccc(CCCN)[n]c1 Amb25348517 [0,1,0,0,0,0|2,0,0]=3 587 B11R1.1 Cc1ccc(CCCN)c[n]1 Amb22886484 [0,1,0,0,0,0|2,0,0]=3 588 B11R1.1 Cc1ccc(CCCN)c[n]1 Amb25069217 [0,1,0,0,0,0|2,0,0]=3 589 B11R1.1 Cc1ccc(CCCO)[n]c1 Amb25073187 [0,1,0,0,0,0|3,0,0]=4 590 B11R1.1 Cc1ccc(CCCO)c[n]1 Amb24533220 [0,1,0,0,0,0|3,0,0]=4 591 B11R1.1 Cc1ccc(CCNC)[n]c1 Amb18125195 [0,1,0,0,0,0|2,0,0]=3 592 B11R1.1 Cc1ccc(CCNN)c[n]1 Amb24666011 [0,1,0,0,0,0|1,0,0]=2 593 B11R1.1 Cc1ccc(CSC#N)cc1 Amb19944266 [0,1,0,0,0,0|2,0,1]=4 594 B11R1.1 Cc1ccc(CSCC)cc1 Amb24536616 [0,1,0,0,0,0|3,0,0]=4 595 B11R1.1 Cc1ccc(CSCCl)cc1 Amb25108662 [0,1,0,0,0,0|3,0,0]=4 596 B11R1.1 Cc1ccc(C[Se]C#N)cc1 Amb17779544 [0,1,0,0,0,0|2,0,1]=4 597 B11R1.1 Cc1ccc(C\C=C\Br)cc1 Amb25720563 [0,1,0,0,0,0|2,0,1]=4 598 B11R1.1 Cc1ccc(NCCN)[n]c1 Amb19515509 [0,1,0,0,0,0|3,0,0]=4 599 B11R1.1 Cc1ccc([n]c1)OCCN Amb18296482 [0,1,0,0,0,0|3,0,0]=4 600 B11R1.1 Cc1ccc(\C=C\CN)cc1 Amb18563249 [0,1,0,0,0,0|1,0,2]=4 601 B11R1.1 Cc1ccc(\C=C\NO)cc1 Amb24621859 [0,1,0,0,0,0|1,0,2]=4 602 B11R1.1 Cc1ccc(\C=N\NC)cc1 Amb25333383 [0,1,0,0,0,0|2,0,1]=4 603 B11R1.1 Cc1ccc(c[n]1)NCCN Amb24477635 [0,1,0,0,0,0|3,0,0]=4 604 B11R1.1 Cc1ccc(c[n]1)OCCN Amb18992842 [0,1,0,0,0,0|3,0,0]=4 605 B11R1.1 Cc1ccc(cc1)C#CCN Amb18281200 [0,1,0,0,0,0|1,0,2]=4 606 B11R1.1 Cc1ccc(cc1)NCC#C Amb21953776 [0,1,0,0,0,0|3,0,0]=4 607 B11R1.1 Cc1ccc(cc1)NCCBr Amb24575185 [0,1,0,0,0,0|3,0,0]=4 608 B11R1.1 Cc1ccc(cc1)NCCS Amb24538179 [0,1,0,0,0,0|3,0,0]=4 609 B11R1.1 Cc1ccc(cc1)NCOC Amb25301269 [0,1,0,0,0,0|3,0,0]=4 610 B11R1.1 Cc1ccc(cc1)OCC#C Amb19373357 [0,1,0,0,0,0|3,0,0]=4 611 B11R1.1 Cc1ccc(cc1)OCOC Amb20241783 [0,1,0,0,0,0|3,0,0]=4 612 B11R1.1 Cc1ccc(cc1)SCOC Amb25032720 [0,1,0,0,0,0|3,0,0]=4 613 B11R1.1 ClCCCc1ccc(cc1)Br Amb17104549 [0,1,0,0,0,0|2,0,0]=3 614 B11R1.1 ClCCCc1ccc(cc1)C Amb17104527 [0,1,0,0,0,0|2,0,0]=3 615 B11R1.1 ClCCCc1ccc(cc1)F Amb17104529 [0,1,0,0,0,0|2,0,0]=3 616 B11R1.1 ClCCCc1ccc(cc1)N Amb17477708 [0,1,0,0,0,0|2,0,0]=3 617 B11R1.1 ClCCCc1ccc(cc1)O Amb17477722 [0,1,0,0,0,0|2,0,0]=3 618 B11R1.1 ClCCNc1ccc(cc1)Br Amb17346195 [0,1,0,0,0,0|3,0,0]=4 619 B11R1.1 ClCCNc1ccc(cc1)C Amb17334787 [0,1,0,0,0,0|3,0,0]=4 620 B11R1.1 ClCCNc1ccc(cc1)Cl Amb17336182 [0,1,0,0,0,0|3,0,0]=4 621 B11R1.1 ClCCNc1ccc(cc1)F Amb17334965 [0,1,0,0,0,0|3,0,0]=4 622 B11R1.1 ClCCSc1ccc(cc1)C Amb1657286 [0,1,0,0,0,0|3,0,0]=4 623 B11R1.1 ClCCSc1ccc(cc1)Cl Amb1154201 [0,1,0,0,0,0|3,0,0]=4 624 B11R1.1 ClCOCc1ccc(Br)cc1 Amb24376347 [0,1,0,0,0,0|3,0,0]=4 625 B11R1.1 Clc1ccc(CC[Mg]Cl)cc1 Amb22897275 [0,1,0,0,0,0|2,0,0]=3 626 B11R1.1 Clc1ccc(CC[Zn]Br)cc1 Amb22000488 [0,1,0,0,0,0|2,0,0]=3 627 B11R1.1 Clc1ccc(CC[Zn]Cl)cc1 Amb22897728 [0,1,0,0,0,0|2,0,0]=3 628 B11R1.1 Clc1ccc(CSCCl)cc1 Amb25704966 [0,1,0,0,0,0|3,0,0]=4 629 B11R1.1 Clc1ccc(cc1)OCCI Amb25833023 [0,1,0,0,0,0|3,0,0]=4 630 B11R1.1 FCCOc1ccc(Br)cc1 Amb22227902 [0,1,0,0,0,0|3,0,0]=4 631 B11R1.1 FCCOc1ccc(I)cc1 Amb22227565 [0,1,0,0,0,0|3,0,0]=4 632 B11R1.1 FCCOc1ccc(S)cc1 Amb23580141 [0,1,0,0,0,0|3,0,0]=4 633 B11R1.1 FCCSc1ccc(Cl)cc1 Amb24644973 [0,1,0,0,0,0|3,0,0]=4 634 B11R1.1 FCSCc1ccc(Cl)cc1 Amb24437363 [0,1,0,0,0,0|3,0,0]=4 635 B11R1.1 Fc1ccc(CC[Zn]Br)cc1 Amb22000495 [0,1,0,0,0,0|2,0,0]=3 636 B11R1.1 Fc1ccc(CNC=S)cc1 Amb25241123 [0,1,0,0,0,0|3,0,0]=4 637 B11R1.1 Fc1ccc(C[Se]C#N)cc1 Amb17779547 [0,1,0,0,0,0|2,0,1]=4 638 B11R1.1 Fc1ccc(cc1)NCCS Amb24545874 [0,1,0,0,0,0|3,0,0]=4 639 B11R1.1 Fc1ccc(cc1)OCCF Amb24686958 [0,1,0,0,0,0|3,0,0]=4 640 B11R1.1 Fc1ccc(cc1)SCCF Amb24484072 [0,1,0,0,0,0|3,0,0]=4 641 B11R1.1 Fc1ccc(cc1)SCCS Amb24689240 [0,1,0,0,0,0|3,0,0]=4 642 B11R1.1 N#CCCN1C=CC(=O)C=C1 Amb18039989 [0,1,0,0,0,0|2,0,1]=4 643 B11R1.1 N#CCCc1ccc(I)cc1 Amb25785381 [0,1,0,0,0,0|1,0,1]=3 644 B11R1.1 N#CCCc1ccc(cc1)C Amb17204297 [0,1,0,0,0,0|1,0,1]=3 645 B11R1.1 N#CCCc1ccc(cc1)F Amb17204299 [0,1,0,0,0,0|1,0,1]=3 646 B11R1.1 N#CCCn1ccc(=O)cc1 Amb10552965 [0,1,0,0,0,0|2,0,1]=4 647 B11R1.1 N#CCSc1ccc(O)cc1 Amb18180090 [0,1,0,0,0,0|2,0,1]=4 648 B11R1.1 N#CCSc1ccc(cc1)Br Amb17644 [0,1,0,0,0,0|2,0,1]=4 649 B11R1.1 N#CCSc1ccc(cc1)Cl Amb1156063 [0,1,0,0,0,0|2,0,1]=4 650 B11R1.1 N#CCSc1ccc(cc1)F Amb1152494 [0,1,0,0,0,0|2,0,1]=4 651 B11R1.1 N#CNCc1ccc(Br)cc1 Amb25761722 [0,1,0,0,0,0|2,0,1]=4 652 B11R1.1 N#CNCc1ccc(O)cc1 Amb25683003 [0,1,0,0,0,0|2,0,1]=4 653 B11R1.1 N#CNCc1ccc(cc1)C Amb16186976 [0,1,0,0,0,0|2,0,1]=4 654 B11R1.1 N#CNCc1ccc(cc1)Cl Amb16186974 [0,1,0,0,0,0|2,0,1]=4 655 B11R1.1 N#CNCc1ccc(cc1)F Amb16186972 [0,1,0,0,0,0|2,0,1]=4 656 B11R1.1 N#CSCc1ccc(Br)cc1 Amb21959352 [0,1,0,0,0,0|2,0,1]=4 657 B11R1.1 N#CSCc1ccc(Cl)cc1 Amb19889458 [0,1,0,0,0,0|2,0,1]=4 658 B11R1.1 N#CSCc1ccc(cc1)F Amb10789219 [0,1,0,0,0,0|2,0,1]=4 659 B11R1.1 NCC#Cc1ccc(Br)cc1 Amb18253475 [0,1,0,0,0,0|1,0,2]=4 660 B11R1.1 NCC#Cc1ccc(Cl)cc1 Amb18950127 [0,1,0,0,0,0|1,0,2]=4 661 B11R1.1 NCC#Cc1ccc(F)cc1 Amb18949804 [0,1,0,0,0,0|1,0,2]=4 662 B11R1.1 NCCCN1C=CC(=O)C=C1 Amb18029471 [0,1,0,0,0,0|2,0,0]=3 663 B11R1.1 NCCCN1C=NC(=O)C=C1 Amb18201102 [0,1,0,0,0,0|3,0,0]=4 664 B11R1.1 NCCCc1c[n]c(Cl)[n]c1 Amb25085992 [0,1,0,0,0,0|3,0,0]=4 665 B11R1.1 NCCCc1c[n]c(O)[n]c1 Amb25359917 [0,1,0,0,0,0|3,0,0]=4 666 B11R1.1 NCCCc1c[n]c(S)[n]c1 Amb25223889 [0,1,0,0,0,0|3,0,0]=4 667 B11R1.1 NCCCc1cc[n+]([O-])cc1 Amb25145870 [0,1,0,0,0,0|2,0,0]=3 668 B11R1.1 NCCCc1ccc(Br)[n]c1 Amb24453424 [0,1,0,0,0,0|2,0,0]=3 669 B11R1.1 NCCCc1ccc(Cl)[n]c1 Amb25849321 [0,1,0,0,0,0|2,0,0]=3 670 B11R1.1 NCCCc1ccc(I)cc1 Amb25172834 [0,1,0,0,0,0|1,0,0]=2 671 B11R1.1 NCCCc1ccc(S)cc1 Amb25228495 [0,1,0,0,0,0|1,0,0]=2 672 B11R1.1 NCCCc1ccc(cc1)Cl Amb1092541 [0,1,0,0,0,0|1,0,0]=2 673 B11R1.1 NCCCc1ccc(cc1)Cl Amb13952055 [0,1,0,0,0,0|1,0,0]=2 674 B11R1.1 NCCCc1ccc(cc1)N Amb17477693 [0,1,0,0,0,0|1,0,0]=2 675 B11R1.1 NCCCc1ccc(cc1)O Amb10066893 [0,1,0,0,0,0|1,0,0]=2 676 B11R1.1 NCCCc1ccc(cc1)O Amb17598403 [0,1,0,0,0,0|1,0,0]=2 677 B11R1.1 NCCNc1ccc(F)c[n]1 Amb18291560 [0,1,0,0,0,0|3,0,0]=4 678 B11R1.1 NCCNc1ccc(F)cc1 Amb17845075 [0,1,0,0,0,0|2,0,0]=3 679 B11R1.1 NCCNc1ccc(cc1)Br Amb17057752 [0,1,0,0,0,0|2,0,0]=3 680 B11R1.1 NCCNc1ccc(cc1)C Amb17057746 [0,1,0,0,0,0|2,0,0]=3 681 B11R1.1 NCCNc1ccc(cc1)Cl Amb17057751 [0,1,0,0,0,0|2,0,0]=3 682 B11R1.1 NCCOc1c[n]c(I)cc1 Amb24707119 [0,1,0,0,0,0|3,0,0]=4 683 B11R1.1 NCCOc1ccc(Br)c[n]1 Amb18988876 [0,1,0,0,0,0|3,0,0]=4 684 B11R1.1 NCCOc1ccc(Br)cc1 Amb19338687 [0,1,0,0,0,0|2,0,0]=3 685 B11R1.1 NCCOc1ccc(Cl)c[n]1 Amb18988875 [0,1,0,0,0,0|3,0,0]=4 686 B11R1.1 NCCOc1ccc(Cl)c[n]1 Amb20631070 [0,1,0,0,0,0|3,0,0]=4 687 B11R1.1 NCCOc1ccc(F)c[n]1 Amb18296419 [0,1,0,0,0,0|3,0,0]=4 688 B11R1.1 NCCOc1ccc(O)cc1 Amb18125536 [0,1,0,0,0,0|2,0,0]=3 689 B11R1.1 NCCOc1ccc(cc1)Br Amb1098668 [0,1,0,0,0,0|2,0,0]=3 690 B11R1.1 NCCOc1ccc(cc1)C Amb1101721 [0,1,0,0,0,0|2,0,0]=3 691 B11R1.1 NCCOc1ccc(cc1)C Amb2196480 [0,1,0,0,0,0|2,0,0]=3 692 B11R1.1 NCCOc1ccc(cc1)Cl Amb1153919 [0,1,0,0,0,0|2,0,0]=3 693 B11R1.1 NCCOc1ccc(cc1)F Amb1102015 [0,1,0,0,0,0|2,0,0]=3 694 B11R1.1 NCCSc1ccc(Br)c[n]1 Amb24509248 [0,1,0,0,0,0|3,0,0]=4 695 B11R1.1 NCCSc1ccc(Cl)c[n]1 Amb18252999 [0,1,0,0,0,0|3,0,0]=4 696 B11R1.1 NCCSc1ccc(O)cc1 Amb18971693 [0,1,0,0,0,0|2,0,0]=3 697 B11R1.1 NCCSc1ccc(cc1)Br Amb1105170 [0,1,0,0,0,0|2,0,0]=3 698 B11R1.1 NCCSc1ccc(cc1)Cl Amb2236679 [0,1,0,0,0,0|2,0,0]=3 699 B11R1.1 NC\C=C/c1ccc(cc1)C Amb10560257 [0,1,0,0,0,0|1,0,2]=4 700 B11R1.1 NC\C=C\c1ccc(Br)cc1 Amb18066634 [0,1,0,0,0,0|1,0,2]=4 701 B11R1.1 NC\C=C\c1ccc(Cl)cc1 Amb18563824 [0,1,0,0,0,0|1,0,2]=4 702 B11R1.1 NC\C=C\c1ccc(F)cc1 Amb18065348 [0,1,0,0,0,0|1,0,2]=4 703 B11R1.1 NC\C=C\c1ccc(O)cc1 Amb18124993 [0,1,0,0,0,0|1,0,2]=4 704 B11R1.1 NNCCc1ccc(Br)c[n]1 Amb25300628 [0,1,0,0,0,0|1,0,0]=2 705 B11R1.1 NOCCN1C=CC(=O)C=C1 Amb25263439 [0,1,0,0,0,0|2,0,0]=3 706 B11R1.1 NOCCc1ccc(F)cc1 Amb22896631 [0,1,0,0,0,0|1,0,0]=2 707 B11R1.1 NOCCc1ccc(O)cc1 Amb25053130 [0,1,0,0,0,0|1,0,0]=2 708 B11R1.1 Nc1ccc(CCCBr)cc1 Amb22229466 [0,1,0,0,0,0|2,0,0]=3 709 B11R1.1 Nc1ccc(CCCF)cc1 Amb25697152 [0,1,0,0,0,0|2,0,0]=3 710 B11R1.1 Nc1ccc(CCCO)cc1 Amb21964655 [0,1,0,0,0,0|2,0,0]=3 711 B11R1.1 Nc1ccc(CNC=O)cc1 Amb24072314 [0,1,0,0,0,0|3,0,0]=4 712 B11R1.1 Nc1ccc(COCF)cc1 Amb25764872 [0,1,0,0,0,0|3,0,0]=4 713 B11R1.1 Nc1ccc([n]c1)SCCN Amb18291131 [0,1,0,0,0,0|3,0,0]=4 714 B11R1.1 Nc1ccc(\C=C\CN)cc1 Amb24527675 [0,1,0,0,0,0|1,0,2]=4 715 B11R1.1 Nc1ccc(c[n]1)NCCN Amb18991503 [0,1,0,0,0,0|3,0,0]=4 716 B11R1.1 Nc1ccc(c[n]1)SCCN Amb18291321 [0,1,0,0,0,0|3,0,0]=4 717 B11R1.1 Nc1ccc(cc1)NCC#N Amb24089891 [0,1,0,0,0,0|2,0,1]=4 718 B11R1.1 Nc1ccc(cc1)NCCF Amb25804656 [0,1,0,0,0,0|3,0,0]=4 719 B11R1.1 Nc1ccc(cc1)NCCN Amb18298668 [0,1,0,0,0,0|2,0,0]=3 720 B11R1.1 Nc1ccc(cc1)N\N=C\N Amb24637265 [0,1,0,0,0,0|3,0,0]=4 721 B11R1.1 Nc1ccc(cc1)OCCBr Amb20620461 [0,1,0,0,0,0|3,0,0]=4 722 B11R1.1 Nc1ccc(cc1)OCCCl Amb18126855 [0,1,0,0,0,0|3,0,0]=4 723 B11R1.1 Nc1ccc(cc1)OCCF Amb23579951 [0,1,0,0,0,0|3,0,0]=4 724 B11R1.1 Nc1ccc(cc1)OCCN Amb23401881 [0,1,0,0,0,0|2,0,0]=3 725 B11R1.1 Nc1ccc(cc1)SCCN Amb18975711 [0,1,0,0,0,0|2,0,0]=3 726 B11R1.1 O=C1C=CN(CCCBr)C=C1 Amb24350690 [0,1,0,0,0,0|3,0,0]=4 727 B11R1.1 O=C1C=CN(CCCCl)C=C1 Amb18178000 [0,1,0,0,0,0|3,0,0]=4 728 B11R1.1 O=C1C=CN(CCCF)C=C1 Amb24453605 [0,1,0,0,0,0|3,0,0]=4 729 B11R1.1 O=C1C=CN(CCCS)C=C1 Amb25792215 [0,1,0,0,0,0|3,0,0]=4 730 B11R1.1 O=C=NCc1ccc(cc1)O Amb17090278 [0,1,0,0,0,0|3,0,0]=4 731 B11R1.1 O=CCCN1C=CC(=O)C=C1 Amb18177172 [0,1,0,0,0,0|3,0,0]=4 732 B11R1.1 O=CCCc1ccc(Br)c[n]1 Amb24704728 [0,1,0,0,0,0|3,0,0]=4 733 B11R1.1 O=CCCc1ccc(cc1)Br Amb10602155 [0,1,0,0,0,0|2,0,0]=3 734 B11R1.1 O=CCCc1ccc(cc1)F Amb10602156 [0,1,0,0,0,0|2,0,0]=3 735 B11R1.1 O=CCCc1ccc(cc1)O Amb17081693 [0,1,0,0,0,0|2,0,0]=3 736 B11R1.1 O=CCOc1ccc(cc1)Br Amb17099949 [0,1,0,0,0,0|3,0,0]=4 737 B11R1.1 O=CCSc1ccc(cc1)Br Amb17082907 [0,1,0,0,0,0|3,0,0]=4 738 B11R1.1 O=CCSc1ccc(cc1)C Amb17082904 [0,1,0,0,0,0|3,0,0]=4 739 B11R1.1 O=CCSc1ccc(cc1)Cl Amb17082906 [0,1,0,0,0,0|3,0,0]=4 740 B11R1.1 O=CCSc1ccc(cc1)F Amb17082905 [0,1,0,0,0,0|3,0,0]=4 741 B11R1.1 O=CNCc1ccc(Cl)cc1 Amb24486673 [0,1,0,0,0,0|3,0,0]=4 742 B11R1.1 O=CNCc1ccc(cc1)C Amb1916037 [0,1,0,0,0,0|3,0,0]=4 743 B11R1.1 OCCCN1C=CC(=O)C=C1 Amb18041267 [0,1,0,0,0,0|3,0,0]=4 744 B11R1.1 OCCCc1ccc(Br)[n]c1 Amb21963678 [0,1,0,0,0,0|3,0,0]=4 745 B11R1.1 OCCCc1ccc(Br)c[n]1 Amb25309177 [0,1,0,0,0,0|3,0,0]=4 746 B11R1.1 OCCCc1ccc(Cl)[n]c1 Amb21963672 [0,1,0,0,0,0|3,0,0]=4 747 B11R1.1 OCCCc1ccc(F)[n]c1 Amb24085299 [0,1,0,0,0,0|3,0,0]=4 748 B11R1.1 OCCCc1ccc(I)cc1 Amb24406298 [0,1,0,0,0,0|2,0,0]=3 749 B11R1.1 OCCCc1ccc(cc1)Br Amb13883587 [0,1,0,0,0,0|2,0,0]=3 750 B11R1.1 OCCCc1ccc(cc1)F Amb17089497 [0,1,0,0,0,0|2,0,0]=3 751 B11R1.1 OCCCc1ccc(cc1)N Amb17477700 [0,1,0,0,0,0|2,0,0]=3 752 B11R1.1 OCCOc1ccc(S)cc1 Amb24100726 [0,1,0,0,0,0|3,0,0]=4 753 B11R1.1 OCCOc1ccc(cc1)C Amb2209347 [0,1,0,0,0,0|3,0,0]=4 754 B11R1.1 OCCOc1ccc(cc1)Cl Amb2209356 [0,1,0,0,0,0|3,0,0]=4 755 B11R1.1 OCCOc1ccc(cc1)N Amb15740917 [0,1,0,0,0,0|3,0,0]=4 756 B11R1.1 OCCSc1ccc(cc1)O Amb10575943 [0,1,0,0,0,0|3,0,0]=4 757 B11R1.1 Oc1ccc(CCCBr)cc1 Amb25703932 [0,1,0,0,0,0|2,0,0]=3 758 B11R1.1 Oc1ccc(CNC=O)cc1 Amb25172814 [0,1,0,0,0,0|3,0,0]=4 759 B11R1.1 Oc1ccc(C\C=C\Cl)cc1 Amb25724911 [0,1,0,0,0,0|2,0,1]=4 760 B11R1.1 Oc1ccc(C\C=N\O)cc1 Amb25705671 [0,1,0,0,0,0|1,0,2]=4 761 B11R1.1 Oc1ccc(cc1)OCC=O Amb18125345 [0,1,0,0,0,0|3,0,0]=4 762 B11R1.1 Oc1ccc(cc1)OCCCl Amb18126982 [0,1,0,0,0,0|3,0,0]=4 763 B11R1.1 Oc1ccc(cc1)OCCF Amb24543531 [0,1,0,0,0,0|3,0,0]=4 764 B11R1.1 Oc1ccc(cc1)SCCCl Amb18650050 [0,1,0,0,0,0|3,0,0]=4 765 B11R1.1 Oc1ccc(cc1)SCCF Amb25699332 [0,1,0,0,0,0|3,0,0]=4 766 B11R1.1 S=C=NCc1ccc(I)cc1 Amb24504908 [0,1,0,0,0,0|3,0,0]=4 767 B11R1.1 S=C=NCc1ccc(cc1)Cl Amb2092731 [0,1,0,0,0,0|3,0,0]=4 768 B11R1.1 S=C=NCc1ccc(cc1)O Amb17615159 [0,1,0,0,0,0|3,0,0]=4 769 B11R1.1 SCCCc1ccc(cc1)Br Amb17407562 [0,1,0,0,0,0|2,0,0]=3 770 B11R1.1 SCCCc1ccc(cc1)C Amb17400220 [0,1,0,0,0,0|2,0,0]=3 771 B11R1.1 SCCCc1ccc(cc1)Cl Amb17401097 [0,1,0,0,0,0|2,0,0]=3 772 B11R1.1 SCCCc1ccc(cc1)F Amb17400333 [0,1,0,0,0,0|2,0,0]=3 773 B11R1.1 SCCNc1ccc(Cl)cc1 Amb25696044 [0,1,0,0,0,0|3,0,0]=4 774 B11R1.1 SCCOc1ccc(cc1)F Amb17232868 [0,1,0,0,0,0|3,0,0]=4 775 B11R1.1 SCCOc1ccc(cc1)N Amb17504126 [0,1,0,0,0,0|3,0,0]=4 776 B11R1.1 SCCSc1ccc(cc1)C Amb13881735 [0,1,0,0,0,0|3,0,0]=4 777 B11R1.1 SCCSc1ccc(cc1)Cl Amb13881736 [0,1,0,0,0,0|3,0,0]=4 778 B11R1.1 [C-]#[N+]CCc1ccc(O)cc1 Amb25730088 [0,1,0,0,0,0|1,0,1]=3 779 B11R1.1 [C-]#[N+]CSc1ccc(C)cc1 Amb25777926 [0,1,0,0,0,0|2,0,1]=4 780 B11R1.1 [N-]=[N+]=NCc1ccc(I)cc1 Amb22059741 [0,1,0,0,0,0|1,0,2]=4 781 B11R1.1 [NH3+]c1ccc(cc1)OCCF Amb22455028 [0,1,0,0,0,0|3,0,0]=4 782 B11R1.16 BrCCC(Br)c1ccccc1 Amb23456167 [0,1,0,0,0,0|2,0,0]=3 783 B11R1.16 C#CCC(Cl)c1ccccc1 Amb25264417 [0,1,0,0,0,0|2,0,0]=3 784 B11R1.16 C#CCC(N)c1c[n]ccc1 Amb18959769 [0,1,0,0,0,0|3,0,0]=4 785 B11R1.16 C#CCC(N)c1cc[n]cc1 Amb18959770 [0,1,0,0,0,0|3,0,0]=4 786 B11R1.16 C#CCC(N)c1cccc[n]1 Amb18284997 [0,1,0,0,0,0|3,0,0]=4 787 B11R1.16 C#CCC(N)c1ccccc1 Amb18959773 [0,1,0,0,0,0|2,0,0]=3 788 B11R1.16 C#CCC(O)c1c[n]ccc1 Amb22756005 [0,1,0,0,0,0|3,0,0]=4 789 B11R1.16 C#CCC(O)c1cccc[n]1 Amb19373060 [0,1,0,0,0,0|3,0,0]=4 790 B11R1.16 C#CCS(=O)c1ccccc1 Amb25241742 [0,1,0,0,0,0|3,0,0]=4 791 B11R1.16 C#CC[C@@H](N)c1ccccc1 Amb24181858 [0,1,0,0,0,0|2,0,0]=3 792 B11R1.16 C#CC[C@H](N)c1ccccc1 Amb25169470 [0,1,0,0,0,0|2,0,0]=3 793 B11R1.16 C#CC[C@H](O)c1c[n]ccc1 Amb25373838 [0,1,0,0,0,0|3,0,0]=4 794 B11R1.16 C=C=CC(O)c1ccccc1 Amb25198813 [0,1,0,0,0,0|2,0,1]=4 795 B11R1.16 C=C=C[C@@H](O)c1ccccc1 Amb25045780 [0,1,0,0,0,0|2,0,1]=4 796 B11R1.16 C=CCC(=O)c1ccccc1 Amb17334260 [0,1,0,0,0,0|2,0,1]=4 797 B11R1.16 C=CCC(Br)c1ccccc1 Amb24668989 [0,1,0,0,0,0|2,0,0]=3 798 B11R1.16 C=CCC(N)c1c[n]ccc1 Amb18292092 [0,1,0,0,0,0|3,0,0]=4 799 B11R1.16 C=CCC(N)c1cc[n]cc1 Amb18292093 [0,1,0,0,0,0|3,0,0]=4 800 B11R1.16 C=CCC(N)c1cc[n]cc1 Amb19374106 [0,1,0,0,0,0|3,0,0]=4 801 B11R1.16 C=CCC(N)c1cccc[n]1 Amb18977590 [0,1,0,0,0,0|3,0,0]=4 802 B11R1.16 C=CCC(N)c1ccccc1 Amb22831520 [0,1,0,0,0,0|2,0,0]=3 803 B11R1.16 C=CCC(O)c1cccc[n]1 Amb25735233 [0,1,0,0,0,0|3,0,0]=4 804 B11R1.16 C=CCC(O)c1ccccc1 Amb22228007 [0,1,0,0,0,0|2,0,0]=3 805 B11R1.16 C=CCC(c1ccccc1)N Amb17226687 [0,1,0,0,0,0|2,0,0]=3 806 B11R1.16 C=CCC(c1ccccc1)O Amb2389146 [0,1,0,0,0,0|2,0,0]=3 807 B11R1.16 C=CCN(c1ccccc1)N Amb17226668 [0,1,0,0,0,0|3,0,0]=4 808 B11R1.16 C=CCS(=O)c1ccccc1 Amb17933936 [0,1,0,0,0,0|3,0,0]=4 809 B11R1.16 C=CC[C@@H](N)c1c[n]ccc1 Amb24487504 [0,1,0,0,0,0|3,0,0]=4 810 B11R1.16 C=CC[C@@H](N)c1cccc[n]1 Amb25844369 [0,1,0,0,0,0|3,0,0]=4 811 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22829899 [0,1,0,0,0,0|2,0,0]=3 812 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22831832 [0,1,0,0,0,0|2,0,0]=3 813 B11R1.16 C=CC[C@@H](O)c1ccccc1 Amb24726216 [0,1,0,0,0,0|2,0,0]=3 814 B11R1.16 C=CC[C@H](N)c1c[n]ccc1 Amb24699940 [0,1,0,0,0,0|3,0,0]=4 815 B11R1.16 C=CC[C@H](N)c1cccc[n]1 Amb25117558 [0,1,0,0,0,0|3,0,0]=4 816 B11R1.16 C=CC[C@H](O)c1c[n]ccc1 Amb25724316 [0,1,0,0,0,0|3,0,0]=4 817 B11R1.16 C=CC[C@H](O)c1cc[n]cc1 Amb25854958 [0,1,0,0,0,0|3,0,0]=4 818 B11R1.16 C=CC[S@@](=O)c1ccccc1 Amb22747466 [0,1,0,0,0,0|3,0,0]=4 819 B11R1.16 CC#CC(N)c1ccccc1 Amb25113894 [0,1,0,0,0,0|2,0,1]=4 820 B11R1.16 CC#CC(O)c1ccccc1 Amb25148346 [0,1,0,0,0,0|2,0,1]=4 821 B11R1.16 CC#C[C@@H](O)c1ccccc1 Amb25188578 [0,1,0,0,0,0|2,0,1]=4 822 B11R1.16 CC(CC#C)c1ccccc1 Amb18117214 [0,1,0,0,0,0|2,0,0]=3 823 B11R1.16 CC(CC#N)c1cc[n]cc1 Amb18124804 [0,1,0,0,0,0|2,0,1]=4 824 B11R1.16 CC(CC#N)c1cccc[n]1 Amb25073965 [0,1,0,0,0,0|2,0,1]=4 825 B11R1.16 CC(CC=C)c1c[n]ccc1 Amb24085283 [0,1,0,0,0,0|3,0,0]=4 826 B11R1.16 CC(CC=C)c1ccccc1 Amb25829403 [0,1,0,0,0,0|2,0,0]=3 827 B11R1.16 CC(CC=O)c1c[n]ccc1 Amb18125013 [0,1,0,0,0,0|3,0,0]=4 828 B11R1.16 CC(CC=O)c1cc[n]cc1 Amb25283017 [0,1,0,0,0,0|3,0,0]=4 829 B11R1.16 CC(CCN)c1c[n]c[n]c1 Amb24467901 [0,1,0,0,0,0|3,0,0]=4 830 B11R1.16 CC(CCN)c1c[n]ccc1 Amb18293554 [0,1,0,0,0,0|2,0,0]=3 831 B11R1.16 CC(CCN)c1cc[n]cc1 Amb18293553 [0,1,0,0,0,0|2,0,0]=3 832 B11R1.16 CC(CCN)c1cccc[n]1 Amb18981390 [0,1,0,0,0,0|2,0,0]=3 833 B11R1.16 CC(CCN)c1ccccc1 Amb17991256 [0,1,0,0,0,0|1,0,0]=2 834 B11R1.16 CC(CCO)c1c[n]ccc1 Amb25808756 [0,1,0,0,0,0|3,0,0]=4 835 B11R1.16 CC(CNN)c1c[n]ccc1 Amb25734660 [0,1,0,0,0,0|1,0,0]=2 836 B11R1.16 CC(CNN)c1ccccc1 Amb18791463 [0,1,0,0,0,0|0,0,0]=1 837 B11R1.16 CC(C[Zn]Br)c1ccccc1 Amb22897843 [0,1,0,0,0,0|2,0,0]=3 838 B11R1.16 CC(N=[N+]=[N-])c1ccccc1 Amb18632995 [0,1,0,0,0,0|1,0,2]=4 839 B11R1.16 CC(NC=S)c1ccccc1 Amb25191191 [0,1,0,0,0,0|3,0,0]=4 840 B11R1.16 CC(NN=O)c1ccccc1 Amb24392128 [0,1,0,0,0,0|2,0,1]=4 841 B11R1.16 CC(OC=C)c1ccccc1 Amb22522122 [0,1,0,0,0,0|3,0,0]=4 842 B11R1.16 CC(OC=O)c1ccccc1 Amb22735162 [0,1,0,0,0,0|3,0,0]=4 843 B11R1.16 CC(OCO)c1ccccc1 Amb24613529 [0,1,0,0,0,0|3,0,0]=4 844 B11R1.16 CC(SCCl)c1ccccc1 Amb24487902 [0,1,0,0,0,0|3,0,0]=4 845 B11R1.16 CC(\C=C\Cl)c1ccccc1 Amb24710339 [0,1,0,0,0,0|2,0,1]=4 846 B11R1.16 CC(\C=N\N)c1ccccc1 Amb24412748 [0,1,0,0,0,0|0,0,2]=3 847 B11R1.16 CC(c1ccccc1)CC#N Amb17593643 [0,1,0,0,0,0|1,0,1]=3 848 B11R1.16 CC(c1ccccc1)N=C=O Amb2092860 [0,1,0,0,0,0|3,0,0]=4 849 B11R1.16 CC=CC(O)c1ccccc1 Amb22228005 [0,1,0,0,0,0|2,0,1]=4 850 B11R1.16 CCCC(=C)c1ccccc1 Amb24669524 [0,1,0,0,0,0|2,0,1]=4 851 B11R1.16 CCCC(Br)c1cccc[n]1 Amb25675709 [0,1,0,0,0,0|3,0,0]=4 852 B11R1.16 CCCC(Cl)c1cc[n]cc1 Amb24102654 [0,1,0,0,0,0|3,0,0]=4 853 B11R1.16 CCCC(N)c1c[n]ccc1 Amb18984960 [0,1,0,0,0,0|3,0,0]=4 854 B11R1.16 CCCC(N)c1cc[n]cc1 Amb18984961 [0,1,0,0,0,0|3,0,0]=4 855 B11R1.16 CCCC(N)c1cccc[n]1 Amb18984959 [0,1,0,0,0,0|3,0,0]=4 856 B11R1.16 CCCC(O)c1cc[n]cc1 Amb18179398 [0,1,0,0,0,0|3,0,0]=4 857 B11R1.16 CCCC(O)c1cccc[n]1 Amb18179397 [0,1,0,0,0,0|3,0,0]=4 858 B11R1.16 CCCC(c1ccccc1)[NH3+] Amb10560246 [0,1,0,0,0,0|2,0,0]=3 859 B11R1.16 CCCC(c1cccnc1)O Amb17232090 [0,1,0,0,0,0|3,0,0]=4 860 B11R1.16 CCCN(O)c1ccccc1 Amb25349642 [0,1,0,0,0,0|3,0,0]=4 861 B11R1.16 CCC[C@@H](N)c1c[n]ccc1 Amb24617547 [0,1,0,0,0,0|3,0,0]=4 862 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb22388605 [0,1,0,0,0,0|2,0,0]=3 863 B11R1.16 CCC[C@@H](O)c1cc[n]cc1 Amb24429371 [0,1,0,0,0,0|3,0,0]=4 864 B11R1.16 CCC[C@@H](O)c1cccc[n]1 Amb25795692 [0,1,0,0,0,0|3,0,0]=4 865 B11R1.16 CCC[C@@H](O)c1ccccc1 Amb22338826 [0,1,0,0,0,0|2,0,0]=3 866 B11R1.16 CCC[C@H](N)c1cccc[n]1 Amb25836783 [0,1,0,0,0,0|3,0,0]=4 867 B11R1.16 CCC[C@H](N)c1ccccc1 Amb20241164 [0,1,0,0,0,0|2,0,0]=3 868 B11R1.16 CCC[C@H](N)c1ccccc1 Amb23385315 [0,1,0,0,0,0|2,0,0]=3 869 B11R1.16 CCC[C@H](O)c1c[n]ccc1 Amb25845549 [0,1,0,0,0,0|3,0,0]=4 870 B11R1.16 CCC[C@H](O)c1cc[n]cc1 Amb24414462 [0,1,0,0,0,0|3,0,0]=4 871 B11R1.16 CCC[C@H](O)c1ccccc1 Amb22338698 [0,1,0,0,0,0|2,0,0]=3 872 B11R1.16 CCC[C@H](c1ccccc1)N Amb16233791 [0,1,0,0,0,0|2,0,0]=3 873 B11R1.16 CCNC(c1ccccc1)C Amb1771733 [0,1,0,0,0,0|3,0,0]=4 874 B11R1.16 CCN[C@H](C)c1ccccc1 Amb24363134 [0,1,0,0,0,0|3,0,0]=4 875 B11R1.16 CCOC(C)c1ccccc1 Amb17940188 [0,1,0,0,0,0|3,0,0]=4 876 B11R1.16 CCOC(Cl)c1ccccc1 Amb24419639 [0,1,0,0,0,0|3,0,0]=4 877 B11R1.16 CCSC(Cl)c1ccccc1 Amb25109977 [0,1,0,0,0,0|3,0,0]=4 878 B11R1.16 CN(CC#C)c1ccccc1 Amb19514873 [0,1,0,0,0,0|3,0,0]=4 879 B11R1.16 CN(CCBr)c1ccccc1 Amb24477466 [0,1,0,0,0,0|3,0,0]=4 880 B11R1.16 CN(CCF)c1ccccc1 Amb24485344 [0,1,0,0,0,0|3,0,0]=4 881 B11R1.16 CN(CCN)c1cc[n]cc1 Amb18993102 [0,1,0,0,0,0|3,0,0]=4 882 B11R1.16 CN(CCN)c1cccc[n]1 Amb18302344 [0,1,0,0,0,0|3,0,0]=4 883 B11R1.16 CN(\N=C\N)c1ccccc1 Amb25840394 [0,1,0,0,0,0|3,0,0]=4 884 B11R1.16 CNCC(=C)c1ccccc1 Amb18124860 [0,1,0,0,0,0|1,0,1]=3 885 B11R1.16 CNCC(Br)c1ccccc1 Amb25224394 [0,1,0,0,0,0|1,0,0]=2 886 B11R1.16 CNCC(C)c1cccc[n]1 Amb18644449 [0,1,0,0,0,0|2,0,0]=3 887 B11R1.16 CNCC(F)c1cc[n]cc1 Amb25331906 [0,1,0,0,0,0|2,0,0]=3 888 B11R1.16 CNCC(F)c1ccccc1 Amb24710254 [0,1,0,0,0,0|1,0,0]=2 889 B11R1.16 CNCC(N)c1ccccc1 Amb18290185 [0,1,0,0,0,0|1,0,0]=2 890 B11R1.16 CNCC(O)c1c[n]c[n]c1 Amb25141262 [0,1,0,0,0,0|3,0,0]=4 891 B11R1.16 CNCC(O)c1c[n]ccc1 Amb19515701 [0,1,0,0,0,0|2,0,0]=3 892 B11R1.16 CNCC(S)c1ccccc1 Amb25685409 [0,1,0,0,0,0|1,0,0]=2 893 B11R1.16 CNCC(c1ccccc1)C Amb17619365 [0,1,0,0,0,0|1,0,0]=2 894 B11R1.16 CNCC(c1ccccc1)N Amb13883001 [0,1,0,0,0,0|1,0,0]=2 895 B11R1.16 CNCC(c1ccccn1)O Amb17138440 [0,1,0,0,0,0|2,0,0]=3 896 B11R1.16 CNCC(c1cccnc1)O Amb17138441 [0,1,0,0,0,0|2,0,0]=3 897 B11R1.16 CNCC(c1ccncc1)O Amb17138442 [0,1,0,0,0,0|2,0,0]=3 898 B11R1.16 CNC[C@@H](N)c1ccccc1 Amb24487965 [0,1,0,0,0,0|1,0,0]=2 899 B11R1.16 CNC[C@@H](O)c1c[n]cc[n]1 Amb25719382 [0,1,0,0,0,0|3,0,0]=4 900 B11R1.16 CNC[C@H](C)c1ccccc1 Amb24399611 [0,1,0,0,0,0|1,0,0]=2 901 B11R1.16 CNC[C@H](N)c1ccccc1 Amb25040662 [0,1,0,0,0,0|1,0,0]=2 902 B11R1.16 CNC[C@H](O)c1c[n]cc[n]1 Amb24692961 [0,1,0,0,0,0|3,0,0]=4 903 B11R1.16 CNC[C@H](O)c1c[n]ccc1 Amb25172815 [0,1,0,0,0,0|2,0,0]=3 904 B11R1.16 CNC[C@H](O)c1ccccc1 Amb25674653 [0,1,0,0,0,0|1,0,0]=2 905 B11R1.16 CNN=C(N)c1ccccc1 Amb20623020 [0,1,0,0,0,0|2,0,1]=4 906 B11R1.16 CNNC(=O)c1ccccc1 Amb24096729 [0,1,0,0,0,0|2,0,1]=4 907 B11R1.16 CNNC(=S)c1ccccc1 Amb25084578 [0,1,0,0,0,0|2,0,1]=4 908 B11R1.16 CNNC(Br)c1ccccc1 Amb24643804 [0,1,0,0,0,0|2,0,0]=3 909 B11R1.16 CNOC(=O)c1ccccc1 Amb25240574 [0,1,0,0,0,0|2,0,1]=4 910 B11R1.16 COCC(Br)c1cccc[n]1 Amb24469291 [0,1,0,0,0,0|3,0,0]=4 911 B11R1.16 COCC(C)c1ccccc1 Amb24079980 [0,1,0,0,0,0|2,0,0]=3 912 B11R1.16 COCC(Cl)c1ccccc1 Amb24509304 [0,1,0,0,0,0|2,0,0]=3 913 B11R1.16 COCC(N)c1c[n]ccc1 Amb18292631 [0,1,0,0,0,0|3,0,0]=4 914 B11R1.16 COCC(O)c1c[n]ccc1 Amb18179473 [0,1,0,0,0,0|3,0,0]=4 915 B11R1.16 COCC(O)c1ccccc1 Amb18791504 [0,1,0,0,0,0|2,0,0]=3 916 B11R1.16 COCC(S)c1ccccc1 Amb25698414 [0,1,0,0,0,0|2,0,0]=3 917 B11R1.16 COCC(c1ccccc1)N Amb1134749 [0,1,0,0,0,0|2,0,0]=3 918 B11R1.16 COCC(c1ccccc1)N Amb13952604 [0,1,0,0,0,0|2,0,0]=3 919 B11R1.16 COCC(c1ccccn1)N Amb10607922 [0,1,0,0,0,0|3,0,0]=4 920 B11R1.16 COCC(c1ccccn1)N Amb13949181 [0,1,0,0,0,0|3,0,0]=4 921 B11R1.16 COC[C@@H](N)c1c[n]ccc1 Amb24351094 [0,1,0,0,0,0|3,0,0]=4 922 B11R1.16 COC[C@@H](N)c1cc[n]cc1 Amb24428710 [0,1,0,0,0,0|3,0,0]=4 923 B11R1.16 COC[C@@H](N)c1cccc[n]1 Amb25104762 [0,1,0,0,0,0|3,0,0]=4 924 B11R1.16 COC[C@@H](O)c1ccccc1 Amb22746575 [0,1,0,0,0,0|2,0,0]=3 925 B11R1.16 COC[C@H](N)c1c[n]ccc1 Amb24533043 [0,1,0,0,0,0|3,0,0]=4 926 B11R1.16 COC[C@H](N)c1ccccc1 Amb22737495 [0,1,0,0,0,0|2,0,0]=3 927 B11R1.16 COC[C@H](c1ccccc1)N Amb17061641 [0,1,0,0,0,0|2,0,0]=3 928 B11R1.16 CONC(C)c1ccccc1 Amb22896960 [0,1,0,0,0,0|3,0,0]=4 929 B11R1.16 CP(CCN)c1ccccc1 Amb25685240 [0,1,0,0,0,0|2,0,0]=3 930 B11R1.16 CSCC(C)c1ccccc1 Amb25143821 [0,1,0,0,0,0|2,0,0]=3 931 B11R1.16 CSCC(N)c1c[n]ccc1 Amb18300195 [0,1,0,0,0,0|3,0,0]=4 932 B11R1.16 CSCC(N)c1ccccc1 Amb18300065 [0,1,0,0,0,0|2,0,0]=3 933 B11R1.16 CSCC(O)c1c[n]ccc1 Amb18801395 [0,1,0,0,0,0|3,0,0]=4 934 B11R1.16 CSCC(O)c1ccccc1 Amb18793198 [0,1,0,0,0,0|2,0,0]=3 935 B11R1.16 CSC[C@@H](N)c1ccccc1 Amb25368447 [0,1,0,0,0,0|2,0,0]=3 936 B11R1.16 C[C@@H](CCBr)c1ccccc1 Amb24395063 [0,1,0,0,0,0|2,0,0]=3 937 B11R1.16 C[C@@H](N=[N+]=[N-])c1ccccc1 Amb24671324 [0,1,0,0,0,0|1,0,2]=4 938 B11R1.16 C[C@H](CC=O)c1ccccc1 Amb25843699 [0,1,0,0,0,0|2,0,0]=3 939 B11R1.16 C[C@H](CCBr)c1ccccc1 Amb25690423 [0,1,0,0,0,0|2,0,0]=3 940 B11R1.16 C[C@H](CCO)c1ccccc1 Amb24371178 [0,1,0,0,0,0|2,0,0]=3 941 B11R1.16 C[C@H](NC=O)c1ccccc1 Amb24696096 [0,1,0,0,0,0|3,0,0]=4 942 B11R1.16 C\C(=C/CN)\c1ccccc1 Amb23555622 [0,1,0,0,0,0|1,0,2]=4 943 B11R1.16 C\C(=C\CN)\c1ccccc1 Amb25145810 [0,1,0,0,0,0|1,0,2]=4 944 B11R1.16 C\C(=N\NC)\c1ccccc1 Amb25099332 [0,1,0,0,0,0|2,0,1]=4 945 B11R1.16 C\C=C\C(N)c1ccccc1 Amb18124850 [0,1,0,0,0,0|2,0,1]=4 946 B11R1.16 C\C=C\[C@@H](O)c1ccccc1 Amb25760539 [0,1,0,0,0,0|2,0,1]=4 947 B11R1.16 C\C=C\[C@H](O)c1ccccc1 Amb25190477 [0,1,0,0,0,0|2,0,1]=4 948 B11R1.16 ClCCC(Br)c1ccccc1 Amb21856734 [0,1,0,0,0,0|2,0,0]=3 949 B11R1.16 ClCCC(Cl)c1ccccc1 Amb17872667 [0,1,0,0,0,0|2,0,0]=3 950 B11R1.16 ClCCC(c1ccccc1)C Amb17232691 [0,1,0,0,0,0|2,0,0]=3 951 B11R1.16 ClCCC(c1ccccc1)O Amb17611064 [0,1,0,0,0,0|2,0,0]=3 952 B11R1.16 ClCCN(c1ccccc1)C Amb17334788 [0,1,0,0,0,0|3,0,0]=4 953 B11R1.16 ClCCP(Cl)c1ccccc1 Amb24398805 [0,1,0,0,0,0|3,0,0]=4 954 B11R1.16 ClCC[C@@H](c1ccccc1)O Amb17611058 [0,1,0,0,0,0|2,0,0]=3 955 B11R1.16 Cl\C=C\C(Cl)c1ccccc1 Amb24634048 [0,1,0,0,0,0|2,0,1]=4 956 B11R1.16 FCCC(=O)c1ccccc1 Amb10603695 [0,1,0,0,0,0|2,0,1]=4 957 B11R1.16 N#CCC(=O)c1ccccc1 Amb1644485 [0,1,0,0,0,0|1,0,2]=4 958 B11R1.16 N#CCC(Cl)c1ccccc1 Amb25238256 [0,1,0,0,0,0|1,0,1]=3 959 B11R1.16 N#CCC(F)c1ccccc1 Amb25127669 [0,1,0,0,0,0|1,0,1]=3 960 B11R1.16 N#CCC(O)c1c[n]ccc1 Amb24062545 [0,1,0,0,0,0|2,0,1]=4 961 B11R1.16 N#CCC(O)c1cccc[n]1 Amb25149159 [0,1,0,0,0,0|2,0,1]=4 962 B11R1.16 N#CCS(=O)c1ccccc1 Amb22505329 [0,1,0,0,0,0|2,0,1]=4 963 B11R1.16 N#CC[C@@H](O)c1c[n]ccc1 Amb24675507 [0,1,0,0,0,0|2,0,1]=4 964 B11R1.16 N#CC[C@@H](O)c1ccccc1 Amb25680039 [0,1,0,0,0,0|1,0,1]=3 965 B11R1.16 N#CC[C@H](O)c1cc[n]cc1 Amb24398008 [0,1,0,0,0,0|2,0,1]=4 966 B11R1.16 N#CC[C@H](O)c1ccccc1 Amb24617537 [0,1,0,0,0,0|1,0,1]=3 967 B11R1.16 N=CCC(=O)c1ccccc1 Amb24408300 [0,1,0,0,0,0|1,0,2]=4 968 B11R1.16 NC(CC#N)c1c[n]ccc1 Amb18064998 [0,1,0,0,0,0|2,0,1]=4 969 B11R1.16 NC(CC#N)c1cc[n]cc1 Amb18065148 [0,1,0,0,0,0|2,0,1]=4 970 B11R1.16 NC(CC#N)c1cccc[n]1 Amb18064993 [0,1,0,0,0,0|2,0,1]=4 971 B11R1.16 NC(CC#N)c1ccccc1 Amb18964887 [0,1,0,0,0,0|1,0,1]=3 972 B11R1.16 NC(CC#N)c1ccccc1 Amb20632783 [0,1,0,0,0,0|1,0,1]=3 973 B11R1.16 NC(CCCl)c1cccc[n]1 Amb24355932 [0,1,0,0,0,0|3,0,0]=4 974 B11R1.16 NC(CCO)c1cccc[n]1 Amb18120551 [0,1,0,0,0,0|3,0,0]=4 975 B11R1.16 NC(CCO)c1ccccc1 Amb22730035 [0,1,0,0,0,0|2,0,0]=3 976 B11R1.16 NCCC(=O)c1cc[n]cc1 Amb18639595 [0,1,0,0,0,0|2,0,1]=4 977 B11R1.16 NCCC(=O)c1ccc[n]c1 Amb18121496 [0,1,0,0,0,0|2,0,1]=4 978 B11R1.16 NCCC(=O)c1cccc[n]1 Amb18121375 [0,1,0,0,0,0|2,0,1]=4 979 B11R1.16 NCCC(Cl)c1ccccc1 Amb24487859 [0,1,0,0,0,0|1,0,0]=2 980 B11R1.16 NCCC(F)c1c[n]cc[n]1 Amb24486934 [0,1,0,0,0,0|3,0,0]=4 981 B11R1.16 NCCC(F)c1cc[n]cc1 Amb25329368 [0,1,0,0,0,0|2,0,0]=3 982 B11R1.16 NCCC(N)c1cccc[n]1 Amb24580750 [0,1,0,0,0,0|2,0,0]=3 983 B11R1.16 NCCC(N)c1ccccc1 Amb18972395 [0,1,0,0,0,0|1,0,0]=2 984 B11R1.16 NCCC(O)c1c[n]cc[n]1 Amb23512600 [0,1,0,0,0,0|3,0,0]=4 985 B11R1.16 NCCC(O)c1c[n]ccc1 Amb18639338 [0,1,0,0,0,0|2,0,0]=3 986 B11R1.16 NCCC(O)c1cc[n]cc1 Amb18121042 [0,1,0,0,0,0|2,0,0]=3 987 B11R1.16 NCCC(O)c1cccc[n]1 Amb18121017 [0,1,0,0,0,0|2,0,0]=3 988 B11R1.16 NCCC(O)c1ccccc1 Amb21984527 [0,1,0,0,0,0|1,0,0]=2 989 B11R1.16 NCCC(S)c1ccccc1 Amb18251942 [0,1,0,0,0,0|1,0,0]=2 990 B11R1.16 NCCC(c1ccccc1)O Amb2383139 [0,1,0,0,0,0|1,0,0]=2 991 B11R1.16 NCCN(c1ccccc1)C Amb13949227 [0,1,0,0,0,0|2,0,0]=3 992 B11R1.16 NCCN(c1ccccc1)C Amb2371516 [0,1,0,0,0,0|2,0,0]=3 993 B11R1.16 NCCS(=O)c1ccccc1 Amb18974516 [0,1,0,0,0,0|2,0,0]=3 994 B11R1.16 NCCS(=O)c1ccccc1 Amb19349568 [0,1,0,0,0,0|2,0,0]=3 995 B11R1.16 NCC[C@@H](N)c1ccccc1 Amb25210474 [0,1,0,0,0,0|1,0,0]=2 996 B11R1.16 NCC[C@@H](O)c1ccccc1 Amb22225304 [0,1,0,0,0,0|1,0,0]=2 997 B11R1.16 NCC[C@H](N)c1cccc[n]1 Amb25326719 [0,1,0,0,0,0|2,0,0]=3 998 B11R1.16 NCC[C@H](O)c1ccccc1 Amb22226644 [0,1,0,0,0,0|1,0,0]=2 999 B11R1.16 NCNC(=O)c1ccccc1 Amb24072660 [0,1,0,0,0,0|2,0,1]=4 1000 B11R1.16 NN(CCO)c1ccccc1 Amb24555138 [0,1,0,0,0,0|3,0,0]=4 1001 B11R1.16 NNCC(=O)c1cc[n]cc1 Amb25694854 [0,1,0,0,0,0|1,0,1]=3 1002 B11R1.16 NNCC(=O)c1ccccc1 Amb18125154 [0,1,0,0,0,0|0,0,1]=2 1003 B11R1.16 NNCC(F)c1ccccc1 Amb25061630 [0,1,0,0,0,0|0,0,0]=1 1004 B11R1.16 NNCC(O)c1cc[n]cc1 Amb18065401 [0,1,0,0,0,0|1,0,0]=2 1005 B11R1.16 NNCC(O)c1cccc[n]1 Amb18065400 [0,1,0,0,0,0|1,0,0]=2 1006 B11R1.16 NNCC(c1ccccc1)O Amb17232104 [0,1,0,0,0,0|0,0,0]=1 1007 B11R1.16 NNCC(c1cccnc1)O Amb17232118 [0,1,0,0,0,0|1,0,0]=2 1008 B11R1.16 NNC[C@@H](O)c1ccccc1 Amb24466315 [0,1,0,0,0,0|0,0,0]=1 1009 B11R1.16 NNC[C@H](O)c1ccccc1 Amb25236157 [0,1,0,0,0,0|0,0,0]=1 1010 B11R1.16 NOCC(=O)c1ccccc1 Amb22729387 [0,1,0,0,0,0|1,0,1]=3 1011 B11R1.16 NOCC(c1ccccc1)O Amb17334342 [0,1,0,0,0,0|1,0,0]=2 1012 B11R1.16 NOC[C@@H](O)c1ccccc1 Amb25152160 [0,1,0,0,0,0|1,0,0]=2 1013 B11R1.16 NSCC(=O)c1ccccc1 Amb24564884 [0,1,0,0,0,0|1,0,1]=3 1014 B11R1.16 N[C@@H](CC#N)c1cccc[n]1 Amb25843751 [0,1,0,0,0,0|2,0,1]=4 1015 B11R1.16 N[C@@H](CCO)c1cc[n]cc1 Amb25131721 [0,1,0,0,0,0|3,0,0]=4 1016 B11R1.16 N[C@H](CC#N)c1c[n]ccc1 Amb24700424 [0,1,0,0,0,0|2,0,1]=4 1017 B11R1.16 N[C@H](CC#N)c1cc[n]cc1 Amb25090361 [0,1,0,0,0,0|2,0,1]=4 1018 B11R1.16 N[C@H](CC#N)c1cccc[n]1 Amb24761314 [0,1,0,0,0,0|2,0,1]=4 1019 B11R1.16 N[C@H](CCO)c1cc[n]cc1 Amb25843798 [0,1,0,0,0,0|3,0,0]=4 1020 B11R1.16 N[C@H](CCO)c1cccc[n]1 Amb25789774 [0,1,0,0,0,0|3,0,0]=4 1021 B11R1.16 N[C@H](CCO)c1ccccc1 Amb22265524 [0,1,0,0,0,0|2,0,0]=3 1022 B11R1.16 N\C=C/C(=O)c1ccccc1 Amb24706769 [0,1,0,0,0,0|1,0,2]=4 1023 B11R1.16 N\C=C\C(=O)c1ccccc1 Amb25730024 [0,1,0,0,0,0|1,0,2]=4 1024 B11R1.16 O=C(CN=O)c1ccccc1 Amb25821412 [0,1,0,0,0,0|1,0,2]=4 1025 B11R1.16 O=CCC(=S)c1ccccc1 Amb25351016 [0,1,0,0,0,0|2,0,1]=4 1026 B11R1.16 O=CCC(Cl)c1ccccc1 Amb24470053 [0,1,0,0,0,0|2,0,0]=3 1027 B11R1.16 O=CCC(S)c1ccccc1 Amb18126455 [0,1,0,0,0,0|2,0,0]=3 1028 B11R1.16 O=CCS(=O)c1ccccc1 Amb25674931 [0,1,0,0,0,0|3,0,0]=4 1029 B11R1.16 O=COC(Cl)c1ccccc1 Amb24710112 [0,1,0,0,0,0|3,0,0]=4 1030 B11R1.16 O=NCC(Cl)c1ccccc1 Amb25177516 [0,1,0,0,0,0|1,0,1]=3 1031 B11R1.16 OC(CC=O)c1cc[n]cc1 Amb24434533 [0,1,0,0,0,0|3,0,0]=4 1032 B11R1.16 OC(CC=O)c1ccccc1 Amb18125126 [0,1,0,0,0,0|2,0,0]=3 1033 B11R1.16 OC(CCF)c1ccccc1 Amb24412986 [0,1,0,0,0,0|2,0,0]=3 1034 B11R1.16 OC(CCS)c1ccccc1 Amb25837914 [0,1,0,0,0,0|2,0,0]=3 1035 B11R1.16 OC(CNO)c1ccccc1 Amb22366087 [0,1,0,0,0,0|1,0,0]=2 1036 B11R1.16 OC(c1ccccc1)C#CBr Amb1083115 [0,1,0,0,0,0|2,0,1]=4 1037 B11R1.16 OCCC(=O)c1ccccc1 Amb16231606 [0,1,0,0,0,0|2,0,1]=4 1038 B11R1.16 OCCC(O)c1cc[n]cc1 Amb25760239 [0,1,0,0,0,0|3,0,0]=4 1039 B11R1.16 OCCC(O)c1cccc[n]1 Amb22756156 [0,1,0,0,0,0|3,0,0]=4 1040 B11R1.16 OCCC(O)c1ccccc1 Amb17777842 [0,1,0,0,0,0|2,0,0]=3 1041 B11R1.16 OCCC(c1ccccc1)N Amb1993953 [0,1,0,0,0,0|2,0,0]=3 1042 B11R1.16 OCC[C@H](O)c1cc[n]cc1 Amb24715913 [0,1,0,0,0,0|3,0,0]=4 1043 B11R1.16 ONCC(c1ccccn1)O Amb17334345 [0,1,0,0,0,0|2,0,0]=3 1044 B11R1.16 ONCC(c1cccnc1)O Amb17334346 [0,1,0,0,0,0|2,0,0]=3 1045 B11R1.16 ONCC(c1ccncc1)O Amb17334347 [0,1,0,0,0,0|2,0,0]=3 1046 B11R1.16 OSCC(O)c1ccccc1 Amb25686224 [0,1,0,0,0,0|2,0,0]=3 1047 B11R1.16 OSC[C@@H](O)c1ccccc1 Amb25787381 [0,1,0,0,0,0|2,0,0]=3 1048 B11R1.16 O[C@H](CC=O)c1cc[n]cc1 Amb25142585 [0,1,0,0,0,0|3,0,0]=4 1049 B11R1.16 O[C@H](CC=O)c1ccccc1 Amb24533175 [0,1,0,0,0,0|2,0,0]=3 1050 B11R1.16 O\N=C\C(O)c1ccccc1 Amb25149681 [0,1,0,0,0,0|1,0,2]=4 1051 B11R1.16 SCCC(=O)c1ccccc1 Amb17400214 [0,1,0,0,0,0|2,0,1]=4 1052 B11R1.16 SCCN(c1ccccc1)C Amb13881732 [0,1,0,0,0,0|3,0,0]=4 1053 B11R1.16 [N-]=[N+]=NC(O)c1ccccc1 Amb24724629 [0,1,0,0,0,0|1,0,2]=4 1054 B11R1.16 [O-]SOC(O)c1ccccc1 Amb24403740 [0,1,0,0,0,0|3,0,0]=4 1055 B11R1.17 BrCCCc1ccccc1C Amb17104552 [0,1,0,0,0,0|2,0,0]=3 1056 B11R1.17 BrCCCc1ccccc1Cl Amb17104560 [0,1,0,0,0,0|2,0,0]=3 1057 B11R1.17 BrCCCc1ccccc1F Amb17104555 [0,1,0,0,0,0|2,0,0]=3 1058 B11R1.17 BrCCOc1ccccc1C Amb1105693 [0,1,0,0,0,0|3,0,0]=4 1059 B11R1.17 BrCCOc1ccccc1Cl Amb1150980 [0,1,0,0,0,0|3,0,0]=4 1060 B11R1.17 BrCCOc1ccccc1F Amb1103643 [0,1,0,0,0,0|3,0,0]=4 1061 B11R1.17 Br[Mg]CCc1ccccc1F Amb13890864 [0,1,0,0,0,0|2,0,0]=3 1062 B11R1.17 Br[Zn]CCc1ccccc1F Amb13890853 [0,1,0,0,0,0|2,0,0]=3 1063 B11R1.17 Brc1c[n]ccc1CCCBr Amb24416596 [0,1,0,0,0,0|3,0,0]=4 1064 B11R1.17 Brc1ccccc1CCCI Amb25329656 [0,1,0,0,0,0|2,0,0]=3 1065 B11R1.17 C#CCCN1C=CC=CC1=O Amb24748736 [0,1,0,0,0,0|3,0,0]=4 1066 B11R1.17 C#CCCc1c[n]ccc1N Amb25075508 [0,1,0,0,0,0|3,0,0]=4 1067 B11R1.17 C#CCCc1ccccc1Cl Amb18116938 [0,1,0,0,0,0|2,0,0]=3 1068 B11R1.17 C#CCCc1ccccc1F Amb18636110 [0,1,0,0,0,0|2,0,0]=3 1069 B11R1.17 C#CCNc1ccccc1Br Amb25790145 [0,1,0,0,0,0|3,0,0]=4 1070 B11R1.17 C#CCNc1ccccc1Cl Amb18800988 [0,1,0,0,0,0|3,0,0]=4 1071 B11R1.17 C#CCNc1ccccc1N Amb24060500 [0,1,0,0,0,0|3,0,0]=4 1072 B11R1.17 C#CCOc1ccccc1Cl Amb18183540 [0,1,0,0,0,0|3,0,0]=4 1073 B11R1.17 C#CCOc1ccccc1F Amb18799352 [0,1,0,0,0,0|3,0,0]=4 1074 B11R1.17 C#CCOc1ccccc1N Amb22492402 [0,1,0,0,0,0|3,0,0]=4 1075 B11R1.17 C#CCSc1ccccc1Cl Amb18325307 [0,1,0,0,0,0|3,0,0]=4 1076 B11R1.17 C#CCSc1ccccc1F Amb18801036 [0,1,0,0,0,0|3,0,0]=4 1077 B11R1.17 C#CCSc1ccccc1O Amb18788312 [0,1,0,0,0,0|3,0,0]=4 1078 B11R1.17 C=CCCc1c[n]ccc1O Amb24334707 [0,1,0,0,0,0|3,0,0]=4 1079 B11R1.17 C=CCCc1cc[n]cc1Cl Amb24693753 [0,1,0,0,0,0|3,0,0]=4 1080 B11R1.17 C=CCCc1ccccc1N Amb18124836 [0,1,0,0,0,0|2,0,0]=3 1081 B11R1.17 C=CCCc1ccccc1O Amb18124913 [0,1,0,0,0,0|2,0,0]=3 1082 B11R1.17 C=CCNc1ccccc1Br Amb17306217 [0,1,0,0,0,0|3,0,0]=4 1083 B11R1.17 C=CCNc1ccccc1Cl Amb18185559 [0,1,0,0,0,0|3,0,0]=4 1084 B11R1.17 C=CCNc1ccccc1F Amb17306139 [0,1,0,0,0,0|3,0,0]=4 1085 B11R1.17 C=CCNc1ccccc1N Amb18992164 [0,1,0,0,0,0|3,0,0]=4 1086 B11R1.17 C=CCOc1ccccc1I Amb24384940 [0,1,0,0,0,0|3,0,0]=4 1087 B11R1.17 C=CCOc1ccccc1N Amb2081548 [0,1,0,0,0,0|3,0,0]=4 1088 B11R1.17 C=CCSc1ccccc1Br Amb25188543 [0,1,0,0,0,0|3,0,0]=4 1089 B11R1.17 C=CCSc1ccccc1N Amb22462667 [0,1,0,0,0,0|3,0,0]=4 1090 B11R1.17 C=CCSc1ccccc1O Amb18788504 [0,1,0,0,0,0|3,0,0]=4 1091 B11R1.17 C=COCc1ccccc1Br Amb25679589 [0,1,0,0,0,0|3,0,0]=4 1092 B11R1.17 C=COCc1ccccc1F Amb24569429 [0,1,0,0,0,0|3,0,0]=4 1093 B11R1.17 CC=CCc1ccccc1O Amb24089583 [0,1,0,0,0,0|2,0,1]=4 1094 B11R1.17 CCCCC1=CC=CNC1=O Amb25270944 [0,1,0,0,0,0|3,0,0]=4 1095 B11R1.17 CCCCN1C=CC=CC1=O Amb22739996 [0,1,0,0,0,0|3,0,0]=4 1096 B11R1.17 CCCCN1C=CC=CC1=S Amb24415294 [0,1,0,0,0,0|3,0,0]=4 1097 B11R1.17 CCCC[n+]1ccccc1C Amb25794246 [0,1,0,0,0,0|3,0,0]=4 1098 B11R1.17 CCCCc1c[n]ccc1N Amb25785815 [0,1,0,0,0,0|3,0,0]=4 1099 B11R1.17 CCCCc1cc[n]cc1Cl Amb24086569 [0,1,0,0,0,0|3,0,0]=4 1100 B11R1.17 CCCCc1ccc[n]c1Cl Amb24538109 [0,1,0,0,0,0|3,0,0]=4 1101 B11R1.17 CCCCc1ccccc1Br Amb15690808 [0,1,0,0,0,0|2,0,0]=3 1102 B11R1.17 CCCCc1ccccc1F Amb24426932 [0,1,0,0,0,0|2,0,0]=3 1103 B11R1.17 CCCCc1ccccc1O Amb25744605 [0,1,0,0,0,0|2,0,0]=3 1104 B11R1.17 CCCCn1ccccc1=O Amb10553753 [0,1,0,0,0,0|3,0,0]=4 1105 B11R1.17 CCCNc1ccccc1O Amb18644480 [0,1,0,0,0,0|3,0,0]=4 1106 B11R1.17 CCCOc1ccccc1Cl Amb25216415 [0,1,0,0,0,0|3,0,0]=4 1107 B11R1.17 CCCOc1ccccc1F Amb21856719 [0,1,0,0,0,0|3,0,0]=4 1108 B11R1.17 CCCOc1ccccc1N Amb1210617 [0,1,0,0,0,0|3,0,0]=4 1109 B11R1.17 CCCSc1ccccc1N Amb22588094 [0,1,0,0,0,0|3,0,0]=4 1110 B11R1.17 CCCSc1ccccc1O Amb18177881 [0,1,0,0,0,0|3,0,0]=4 1111 B11R1.17 CCNCc1ccccc1I Amb21861742 [0,1,0,0,0,0|3,0,0]=4 1112 B11R1.17 CCOCc1ccccc1Br Amb22227882 [0,1,0,0,0,0|3,0,0]=4 1113 B11R1.17 CCOCc1ccccc1O Amb10560038 [0,1,0,0,0,0|3,0,0]=4 1114 B11R1.17 CCSCc1ccccc1Br Amb22228180 [0,1,0,0,0,0|3,0,0]=4 1115 B11R1.17 CCSCc1ccccc1Cl Amb25676288 [0,1,0,0,0,0|3,0,0]=4 1116 B11R1.17 CCSCc1ccccc1O Amb18126550 [0,1,0,0,0,0|3,0,0]=4 1117 B11R1.17 CN/N=C/c1ccccc1Cl Amb17866944 [0,1,0,0,0,0|2,0,1]=4 1118 B11R1.17 CN/N=C/c1ccccc1F Amb17704011 [0,1,0,0,0,0|2,0,1]=4 1119 B11R1.17 CN/N=C/c1ccccc1O Amb17705197 [0,1,0,0,0,0|2,0,1]=4 1120 B11R1.17 CNCCN1C=CC=CC1=O Amb18299423 [0,1,0,0,0,0|2,0,0]=3 1121 B11R1.17 CNCCN1C=CC=NC1=O Amb18992761 [0,1,0,0,0,0|3,0,0]=4 1122 B11R1.17 CNCCN1C=CN=CC1=O Amb25360229 [0,1,0,0,0,0|3,0,0]=4 1123 B11R1.17 CNCCN1N=CC=CC1=O Amb18301680 [0,1,0,0,0,0|3,0,0]=4 1124 B11R1.17 CNCCc1[n]cccc1Br Amb18657771 [0,1,0,0,0,0|2,0,0]=3 1125 B11R1.17 CNCCc1[n]cccc1Cl Amb18126745 [0,1,0,0,0,0|2,0,0]=3 1126 B11R1.17 CNCCc1[n]cccc1F Amb24636895 [0,1,0,0,0,0|2,0,0]=3 1127 B11R1.17 CNCCc1c[n]ccc1Br Amb25804895 [0,1,0,0,0,0|2,0,0]=3 1128 B11R1.17 CNCCc1c[n]ccc1N Amb24436455 [0,1,0,0,0,0|2,0,0]=3 1129 B11R1.17 CNCCc1cc[n]cc1F Amb24593125 [0,1,0,0,0,0|2,0,0]=3 1130 B11R1.17 CNCCc1ccccc1Br Amb18299468 [0,1,0,0,0,0|1,0,0]=2 1131 B11R1.17 CNCCc1ccccc1N Amb24106838 [0,1,0,0,0,0|1,0,0]=2 1132 B11R1.17 CNCCc1ccccc1O Amb18560895 [0,1,0,0,0,0|1,0,0]=2 1133 B11R1.17 CN\N=C/c1ccccc1F Amb24100270 [0,1,0,0,0,0|2,0,1]=4 1134 B11R1.17 CN\N=C\c1ccccc1Br Amb16842474 [0,1,0,0,0,0|2,0,1]=4 1135 B11R1.17 COCC[n+]1ccccc1Br Amb25072030 [0,1,0,0,0,0|3,0,0]=4 1136 B11R1.17 COCC[n+]1ccccc1C Amb24685943 [0,1,0,0,0,0|3,0,0]=4 1137 B11R1.17 COCCc1c[n]ccc1N Amb25209393 [0,1,0,0,0,0|3,0,0]=4 1138 B11R1.17 COCCc1cccc[n+]1[O-] Amb10573566 [0,1,0,0,0,0|3,0,0]=4 1139 B11R1.17 COCCc1ccccc1Cl Amb24518157 [0,1,0,0,0,0|2,0,0]=3 1140 B11R1.17 COCCc1ccccc1I Amb24483388 [0,1,0,0,0,0|2,0,0]=3 1141 B11R1.17 COCCc1ccccc1N Amb18992153 [0,1,0,0,0,0|2,0,0]=3 1142 B11R1.17 COCCc1ccccc1O Amb22055702 [0,1,0,0,0,0|2,0,0]=3 1143 B11R1.17 COCCn1ccccc1=O Amb10707822 [0,1,0,0,0,0|3,0,0]=4 1144 B11R1.17 COCNc1ccccc1F Amb24084241 [0,1,0,0,0,0|3,0,0]=4 1145 B11R1.17 COCOc1ccccc1Br Amb21912438 [0,1,0,0,0,0|3,0,0]=4 1146 B11R1.17 COCOc1ccccc1C Amb10559613 [0,1,0,0,0,0|3,0,0]=4 1147 B11R1.17 COCOc1ccccc1Cl Amb25840223 [0,1,0,0,0,0|3,0,0]=4 1148 B11R1.17 COCOc1ccccc1F Amb22546792 [0,1,0,0,0,0|3,0,0]=4 1149 B11R1.17 COCOc1ccccc1I Amb22284514 [0,1,0,0,0,0|3,0,0]=4 1150 B11R1.17 COCOc1ccccc1N Amb23599107 [0,1,0,0,0,0|3,0,0]=4 1151 B11R1.17 COCOc1ccccc1O Amb24486480 [0,1,0,0,0,0|3,0,0]=4 1152 B11R1.17 COCSc1ccccc1N Amb17305638 [0,1,0,0,0,0|3,0,0]=4 1153 B11R1.17 CONCc1ccccc1F Amb24725975 [0,1,0,0,0,0|3,0,0]=4 1154 B11R1.17 CONCc1ccccc1O Amb24432475 [0,1,0,0,0,0|3,0,0]=4 1155 B11R1.17 CSCCN1C=CC=CC1=O Amb24488179 [0,1,0,0,0,0|3,0,0]=4 1156 B11R1.17 CSCCc1c[n]ccc1N Amb25839494 [0,1,0,0,0,0|3,0,0]=4 1157 B11R1.17 CSCCc1ccccc1Cl Amb25222784 [0,1,0,0,0,0|2,0,0]=3 1158 B11R1.17 CSCCc1ccccc1N Amb18299122 [0,1,0,0,0,0|2,0,0]=3 1159 B11R1.17 CSCOc1ccccc1Br Amb25358756 [0,1,0,0,0,0|3,0,0]=4 1160 B11R1.17 CSCOc1ccccc1Cl Amb24459326 [0,1,0,0,0,0|3,0,0]=4 1161 B11R1.17 CSCSc1ccccc1Br Amb24516501 [0,1,0,0,0,0|3,0,0]=4 1162 B11R1.17 C\C=C/Cc1ccccc1O Amb25345359 [0,1,0,0,0,0|2,0,1]=4 1163 B11R1.17 C\C=C\Cc1ccccc1N Amb18644343 [0,1,0,0,0,0|2,0,1]=4 1164 B11R1.17 C\N=C\Cc1ccccc1O Amb25844316 [0,1,0,0,0,0|1,0,2]=4 1165 B11R1.17 Cc1[n]cc[n]c1CCCN Amb18201572 [0,1,0,0,0,0|3,0,0]=4 1166 B11R1.17 Cc1[n]cccc1CCCCl Amb25847080 [0,1,0,0,0,0|3,0,0]=4 1167 B11R1.17 Cc1[n]cccc1CCCO Amb24360630 [0,1,0,0,0,0|3,0,0]=4 1168 B11R1.17 Cc1[n]cccc1CCNC Amb24635443 [0,1,0,0,0,0|2,0,0]=3 1169 B11R1.17 Cc1c[n]c[n]c1CCCN Amb18201574 [0,1,0,0,0,0|3,0,0]=4 1170 B11R1.17 Cc1c[n]ccc1CCC=C Amb24102788 [0,1,0,0,0,0|3,0,0]=4 1171 B11R1.17 Cc1c[n]ccc1CCCBr Amb24611779 [0,1,0,0,0,0|3,0,0]=4 1172 B11R1.17 Cc1c[n]ccc1CCOC Amb24577461 [0,1,0,0,0,0|3,0,0]=4 1173 B11R1.17 Cc1cc[n]cc1CCCBr Amb25089629 [0,1,0,0,0,0|3,0,0]=4 1174 B11R1.17 Cc1cc[n]cc1CCCC Amb25075221 [0,1,0,0,0,0|3,0,0]=4 1175 B11R1.17 Cc1cc[n]cc1CCCO Amb25717118 [0,1,0,0,0,0|3,0,0]=4 1176 B11R1.17 Cc1ccc[n]c1CCC#N Amb24085237 [0,1,0,0,0,0|2,0,1]=4 1177 B11R1.17 Cc1ccc[n]c1CCC=C Amb24100504 [0,1,0,0,0,0|3,0,0]=4 1178 B11R1.17 Cc1ccc[n]c1CCCC Amb24062201 [0,1,0,0,0,0|3,0,0]=4 1179 B11R1.17 Cc1ccc[n]c1CCCN Amb22886485 [0,1,0,0,0,0|2,0,0]=3 1180 B11R1.17 Cc1ccc[n]c1CCCO Amb24685021 [0,1,0,0,0,0|3,0,0]=4 1181 B11R1.17 Cc1ccc[n]c1CCNC Amb18125193 [0,1,0,0,0,0|2,0,0]=3 1182 B11R1.17 Cc1ccc[n]c1OCCN Amb18988881 [0,1,0,0,0,0|3,0,0]=4 1183 B11R1.17 Cc1ccc[n]c1SCCN Amb18908765 [0,1,0,0,0,0|3,0,0]=4 1184 B11R1.17 Cc1ccccc1C#CCN Amb18949803 [0,1,0,0,0,0|1,0,2]=4 1185 B11R1.17 Cc1ccccc1CCC#C Amb18636111 [0,1,0,0,0,0|2,0,0]=3 1186 B11R1.17 Cc1ccccc1CCCC Amb25825024 [0,1,0,0,0,0|2,0,0]=3 1187 B11R1.17 Cc1ccccc1CCNC Amb19959980 [0,1,0,0,0,0|1,0,0]=2 1188 B11R1.17 Cc1ccccc1CC[Zn]Br Amb22000497 [0,1,0,0,0,0|2,0,0]=3 1189 B11R1.17 Cc1ccccc1CNC=O Amb21859038 [0,1,0,0,0,0|3,0,0]=4 1190 B11R1.17 Cc1ccccc1COC=O Amb17778964 [0,1,0,0,0,0|3,0,0]=4 1191 B11R1.17 Cc1ccccc1COCCl Amb24352480 [0,1,0,0,0,0|3,0,0]=4 1192 B11R1.17 Cc1ccccc1CSC#N Amb17778963 [0,1,0,0,0,0|2,0,1]=4 1193 B11R1.17 Cc1ccccc1CSCC Amb24690023 [0,1,0,0,0,0|3,0,0]=4 1194 B11R1.17 Cc1ccccc1C\C=C\Cl Amb25109327 [0,1,0,0,0,0|2,0,1]=4 1195 B11R1.17 Cc1ccccc1NCC#C Amb25677805 [0,1,0,0,0,0|3,0,0]=4 1196 B11R1.17 Cc1ccccc1NCCF Amb24560861 [0,1,0,0,0,0|3,0,0]=4 1197 B11R1.17 Cc1ccccc1NCOC Amb25690923 [0,1,0,0,0,0|3,0,0]=4 1198 B11R1.17 Cc1ccccc1OCC#C Amb19373366 [0,1,0,0,0,0|3,0,0]=4 1199 B11R1.17 Cc1ccccc1SCC#C Amb18788142 [0,1,0,0,0,0|3,0,0]=4 1200 B11R1.17 Cc1ccccc1SCC#N Amb18792512 [0,1,0,0,0,0|2,0,1]=4 1201 B11R1.17 Cc1ccccc1SCC=C Amb25231651 [0,1,0,0,0,0|3,0,0]=4 1202 B11R1.17 Cc1ccccc1SCC=O Amb18183536 [0,1,0,0,0,0|3,0,0]=4 1203 B11R1.17 Cc1ccccc1SCCC Amb24674923 [0,1,0,0,0,0|3,0,0]=4 1204 B11R1.17 Cc1ccccc1SCCCl Amb19059017 [0,1,0,0,0,0|3,0,0]=4 1205 B11R1.17 Cc1ccccc1SCCN Amb18992759 [0,1,0,0,0,0|2,0,0]=3 1206 B11R1.17 Cc1ccccc1SCCO Amb18180155 [0,1,0,0,0,0|3,0,0]=4 1207 B11R1.17 Cc1ccccc1SCSC Amb24631994 [0,1,0,0,0,0|3,0,0]=4 1208 B11R1.17 Cc1ccccc1\C=C\CN Amb18065178 [0,1,0,0,0,0|1,0,2]=4 1209 B11R1.17 Cc1ccccc1\N=C\NC Amb25312744 [0,1,0,0,0,0|2,0,1]=4 1210 B11R1.17 ClCCCc1[n]cccc1Br Amb25089986 [0,1,0,0,0,0|3,0,0]=4 1211 B11R1.17 ClCCCc1ccccc1C Amb17104525 [0,1,0,0,0,0|2,0,0]=3 1212 B11R1.17 ClCCCc1ccccc1Cl Amb17104533 [0,1,0,0,0,0|2,0,0]=3 1213 B11R1.17 ClCCCc1ccccc1F Amb17104528 [0,1,0,0,0,0|2,0,0]=3 1214 B11R1.17 ClCCCc1ccccc1N Amb17477710 [0,1,0,0,0,0|2,0,0]=3 1215 B11R1.17 ClCCCc1ccccc1O Amb17477721 [0,1,0,0,0,0|2,0,0]=3 1216 B11R1.17 ClCCNc1ccccc1Br Amb17346196 [0,1,0,0,0,0|3,0,0]=4 1217 B11R1.17 ClCCNc1ccccc1C Amb17334785 [0,1,0,0,0,0|3,0,0]=4 1218 B11R1.17 ClCCNc1ccccc1Cl Amb17336180 [0,1,0,0,0,0|3,0,0]=4 1219 B11R1.17 ClCCNc1ccccc1F Amb17334964 [0,1,0,0,0,0|3,0,0]=4 1220 B11R1.17 ClCCSc1ccccc1F Amb1154202 [0,1,0,0,0,0|3,0,0]=4 1221 B11R1.17 ClCOCc1ccccc1Br Amb25679464 [0,1,0,0,0,0|3,0,0]=4 1222 B11R1.17 Clc1c[n]ccc1CCCBr Amb25851696 [0,1,0,0,0,0|3,0,0]=4 1223 B11R1.17 Clc1c[n]ccc1CCCCl Amb25344160 [0,1,0,0,0,0|3,0,0]=4 1224 B11R1.17 Clc1ccccc1CC[Zn]Br Amb22898141 [0,1,0,0,0,0|2,0,0]=3 1225 B11R1.17 Clc1ccccc1CC[Zn]Cl Amb22897727 [0,1,0,0,0,0|2,0,0]=3 1226 B11R1.17 FCCSc1ccccc1Br Amb22227854 [0,1,0,0,0,0|3,0,0]=4 1227 B11R1.17 Fc1c[n]ccc1CCCBr Amb24486812 [0,1,0,0,0,0|3,0,0]=4 1228 B11R1.17 Fc1ccccc1OCCF Amb25692641 [0,1,0,0,0,0|3,0,0]=4 1229 B11R1.17 Fc1ccccc1OCCI Amb25151268 [0,1,0,0,0,0|3,0,0]=4 1230 B11R1.17 N#CCCN1C=CC=CC1=O Amb18542616 [0,1,0,0,0,0|2,0,1]=4 1231 B11R1.17 N#CCCc1cccc[n+]1[O-] Amb24740142 [0,1,0,0,0,0|2,0,1]=4 1232 B11R1.17 N#CCCc1ccccc1Br Amb17204424 [0,1,0,0,0,0|1,0,1]=3 1233 B11R1.17 N#CCCc1ccccc1C Amb17204295 [0,1,0,0,0,0|1,0,1]=3 1234 B11R1.17 N#CCCc1ccccc1F Amb17204298 [0,1,0,0,0,0|1,0,1]=3 1235 B11R1.17 N#CCCc1ccccc1O Amb17509008 [0,1,0,0,0,0|1,0,1]=3 1236 B11R1.17 N#CCSc1ccccc1O Amb18177810 [0,1,0,0,0,0|2,0,1]=4 1237 B11R1.17 N#CNCc1ccccc1Br Amb25045111 [0,1,0,0,0,0|2,0,1]=4 1238 B11R1.17 N#CNCc1ccccc1C Amb16186975 [0,1,0,0,0,0|2,0,1]=4 1239 B11R1.17 N#CNCc1ccccc1Cl Amb16186973 [0,1,0,0,0,0|2,0,1]=4 1240 B11R1.17 N#CNCc1ccccc1F Amb16186971 [0,1,0,0,0,0|2,0,1]=4 1241 B11R1.17 N#CSCc1ccccc1Br Amb21959350 [0,1,0,0,0,0|2,0,1]=4 1242 B11R1.17 N#CSCc1ccccc1Cl Amb19889456 [0,1,0,0,0,0|2,0,1]=4 1243 B11R1.17 N#CSCc1ccccc1F Amb10789221 [0,1,0,0,0,0|2,0,1]=4 1244 B11R1.17 N=C=NCc1ccccc1O Amb24486464 [0,1,0,0,0,0|2,0,1]=4 1245 B11R1.17 NCC#Cc1ccccc1Br Amb25727777 [0,1,0,0,0,0|1,0,2]=4 1246 B11R1.17 NCC#Cc1ccccc1Cl Amb18281655 [0,1,0,0,0,0|1,0,2]=4 1247 B11R1.17 NCC#Cc1ccccc1F Amb18962138 [0,1,0,0,0,0|1,0,2]=4 1248 B11R1.17 NCC#Cc1ccccc1I Amb24454628 [0,1,0,0,0,0|1,0,2]=4 1249 B11R1.17 NCC#Cc1ccccc1O Amb25304022 [0,1,0,0,0,0|1,0,2]=4 1250 B11R1.17 NCCCN1C=CC=CC1=O Amb18535490 [0,1,0,0,0,0|2,0,0]=3 1251 B11R1.17 NCCCN1C=CC=CC1=O Amb19514396 [0,1,0,0,0,0|2,0,0]=3 1252 B11R1.17 NCCCN1C=CC=NC1=O Amb18540352 [0,1,0,0,0,0|3,0,0]=4 1253 B11R1.17 NCCCN1N=CC=CC1=O Amb18998096 [0,1,0,0,0,0|3,0,0]=4 1254 B11R1.17 NCCCc1[n]cccc1Br Amb25771023 [0,1,0,0,0,0|2,0,0]=3 1255 B11R1.17 NCCCc1[n]cccc1F Amb25032548 [0,1,0,0,0,0|2,0,0]=3 1256 B11R1.17 NCCCc1[n]cccc1O Amb25111600 [0,1,0,0,0,0|2,0,0]=3 1257 B11R1.17 NCCCc1cc[n]cc1Cl Amb23596508 [0,1,0,0,0,0|2,0,0]=3 1258 B11R1.17 NCCCc1cc[n]cc1F Amb25111554 [0,1,0,0,0,0|2,0,0]=3 1259 B11R1.17 NCCCc1ccccc1Cl Amb1090913 [0,1,0,0,0,0|1,0,0]=2 1260 B11R1.17 NCCCc1ccccc1Cl Amb19373405 [0,1,0,0,0,0|1,0,0]=2 1261 B11R1.17 NCCCc1ccccc1F Amb13949158 [0,1,0,0,0,0|1,0,0]=2 1262 B11R1.17 NCCCc1ccccc1N Amb17477695 [0,1,0,0,0,0|1,0,0]=2 1263 B11R1.17 NCCNc1[n]cccc1Br Amb18979379 [0,1,0,0,0,0|3,0,0]=4 1264 B11R1.17 NCCNc1[n]cccc1F Amb18996005 [0,1,0,0,0,0|3,0,0]=4 1265 B11R1.17 NCCNc1cc[n]cc1Br Amb24768461 [0,1,0,0,0,0|3,0,0]=4 1266 B11R1.17 NCCNc1cc[n]cc1F Amb24739193 [0,1,0,0,0,0|3,0,0]=4 1267 B11R1.17 NCCNc1ccc[n]c1Br Amb24729303 [0,1,0,0,0,0|3,0,0]=4 1268 B11R1.17 NCCNc1ccc[n]c1Cl Amb25187389 [0,1,0,0,0,0|3,0,0]=4 1269 B11R1.17 NCCNc1cccc[n+]1[O-] Amb24726506 [0,1,0,0,0,0|3,0,0]=4 1270 B11R1.17 NCCNc1ccccc1Br Amb17091073 [0,1,0,0,0,0|2,0,0]=3 1271 B11R1.17 NCCNc1ccccc1C Amb17057744 [0,1,0,0,0,0|2,0,0]=3 1272 B11R1.17 NCCNc1ccccc1Cl Amb17057749 [0,1,0,0,0,0|2,0,0]=3 1273 B11R1.17 NCCNc1ccccc1F Amb17057747 [0,1,0,0,0,0|2,0,0]=3 1274 B11R1.17 NCCNc1ccccc1N Amb1397489 [0,1,0,0,0,0|2,0,0]=3 1275 B11R1.17 NCCNc1ccccc1O Amb18251377 [0,1,0,0,0,0|2,0,0]=3 1276 B11R1.17 NCCNc1ncccc1C Amb10607838 [0,1,0,0,0,0|3,0,0]=4 1277 B11R1.17 NCCOc1[n]cccc1Br Amb18988886 [0,1,0,0,0,0|3,0,0]=4 1278 B11R1.17 NCCOc1[n]cccc1Cl Amb18988869 [0,1,0,0,0,0|3,0,0]=4 1279 B11R1.17 NCCOc1[n]cccc1Cl Amb20631069 [0,1,0,0,0,0|3,0,0]=4 1280 B11R1.17 NCCOc1[n]cccc1F Amb18996066 [0,1,0,0,0,0|3,0,0]=4 1281 B11R1.17 NCCOc1[n]cccc1I Amb25208739 [0,1,0,0,0,0|3,0,0]=4 1282 B11R1.17 NCCOc1cc[n]cc1Br Amb24353235 [0,1,0,0,0,0|3,0,0]=4 1283 B11R1.17 NCCOc1ccccc1Br Amb10609932 [0,1,0,0,0,0|2,0,0]=3 1284 B11R1.17 NCCOc1ccccc1C Amb1098984 [0,1,0,0,0,0|2,0,0]=3 1285 B11R1.17 NCCOc1ccccc1C Amb2052283 [0,1,0,0,0,0|2,0,0]=3 1286 B11R1.17 NCCOc1ccccc1Cl Amb2137131 [0,1,0,0,0,0|2,0,0]=3 1287 B11R1.17 NCCOc1ccccc1F Amb1105167 [0,1,0,0,0,0|2,0,0]=3 1288 B11R1.17 NCCOc1ccccc1O Amb17615721 [0,1,0,0,0,0|2,0,0]=3 1289 B11R1.17 NCCSc1[n]cccc1Cl Amb18252966 [0,1,0,0,0,0|3,0,0]=4 1290 B11R1.17 NCCSc1ccccc1O Amb18984794 [0,1,0,0,0,0|2,0,0]=3 1291 B11R1.17 NC\C=C\c1ccccc1Br Amb18569373 [0,1,0,0,0,0|1,0,2]=4 1292 B11R1.17 NC\C=C\c1ccccc1Cl Amb18065473 [0,1,0,0,0,0|1,0,2]=4 1293 B11R1.17 NC\C=C\c1ccccc1F Amb18065347 [0,1,0,0,0,0|1,0,2]=4 1294 B11R1.17 NNCCN1C=CC=CC1=O Amb24421929 [0,1,0,0,0,0|1,0,0]=2 1295 B11R1.17 NNCCc1ccccc1Br Amb24701935 [0,1,0,0,0,0|0,0,0]=1 1296 B11R1.17 NNCCc1ccccc1F Amb20668135 [0,1,0,0,0,0|0,0,0]=1 1297 B11R1.17 NOCCN1C=CC=CC1=O Amb22364493 [0,1,0,0,0,0|2,0,0]=3 1298 B11R1.17 NOCCN1N=CC=CC1=O Amb24588766 [0,1,0,0,0,0|3,0,0]=4 1299 B11R1.17 NOCCc1ccccc1Br Amb18657908 [0,1,0,0,0,0|1,0,0]=2 1300 B11R1.17 NOCCc1ccccc1Cl Amb18647570 [0,1,0,0,0,0|1,0,0]=2 1301 B11R1.17 NOCCc1ccccc1F Amb22896629 [0,1,0,0,0,0|1,0,0]=2 1302 B11R1.17 Nc1[n]cccc1CCC=O Amb25244379 [0,1,0,0,0,0|3,0,0]=4 1303 B11R1.17 Nc1[n]cccc1CCCBr Amb25763348 [0,1,0,0,0,0|3,0,0]=4 1304 B11R1.17 Nc1[n]cccc1CCCCl Amb24486006 [0,1,0,0,0,0|3,0,0]=4 1305 B11R1.17 Nc1[n]cccc1CCNN Amb25841161 [0,1,0,0,0,0|1,0,0]=2 1306 B11R1.17 Nc1[n]cccc1NCCN Amb24486768 [0,1,0,0,0,0|3,0,0]=4 1307 B11R1.17 Nc1c[n]ccc1NCCN Amb18991504 [0,1,0,0,0,0|3,0,0]=4 1308 B11R1.17 Nc1c[n]ccc1SCCN Amb18291318 [0,1,0,0,0,0|3,0,0]=4 1309 B11R1.17 Nc1cc[n]cc1CCC=O Amb25742213 [0,1,0,0,0,0|3,0,0]=4 1310 B11R1.17 Nc1cc[n]cc1CCCO Amb24355779 [0,1,0,0,0,0|3,0,0]=4 1311 B11R1.17 Nc1cc[n]cc1NCCN Amb25682895 [0,1,0,0,0,0|3,0,0]=4 1312 B11R1.17 Nc1ccc[n]c1NCCN Amb18991500 [0,1,0,0,0,0|3,0,0]=4 1313 B11R1.17 Nc1ccc[n]c1OCCN Amb25858100 [0,1,0,0,0,0|3,0,0]=4 1314 B11R1.17 Nc1ccc[n]c1SCCN Amb18291324 [0,1,0,0,0,0|3,0,0]=4 1315 B11R1.17 Nc1ccccc1CCC#N Amb18124793 [0,1,0,0,0,0|1,0,1]=3 1316 B11R1.17 Nc1ccccc1CCC=O Amb25208520 [0,1,0,0,0,0|2,0,0]=3 1317 B11R1.17 Nc1ccccc1CCCBr Amb22228093 [0,1,0,0,0,0|2,0,0]=3 1318 B11R1.17 Nc1ccccc1CCCBr Amb25217893 [0,1,0,0,0,0|2,0,0]=3 1319 B11R1.17 Nc1ccccc1CNC=O Amb24096445 [0,1,0,0,0,0|3,0,0]=4 1320 B11R1.17 Nc1ccccc1OCCF Amb23579999 [0,1,0,0,0,0|3,0,0]=4 1321 B11R1.17 Nc1ccccc1OCCN Amb18251366 [0,1,0,0,0,0|2,0,0]=3 1322 B11R1.17 Nc1ccccc1SCCCl Amb18129706 [0,1,0,0,0,0|3,0,0]=4 1323 B11R1.17 Nc1ccccc1SCCF Amb24533142 [0,1,0,0,0,0|3,0,0]=4 1324 B11R1.17 Nc1ccccc1SCCN Amb18291073 [0,1,0,0,0,0|2,0,0]=3 1325 B11R1.17 Nc1ncccc1CCCO Amb13890002 [0,1,0,0,0,0|3,0,0]=4 1326 B11R1.17 O=C1C=CC=CN1CCCCl Amb18183682 [0,1,0,0,0,0|3,0,0]=4 1327 B11R1.17 O=C=NCc1ccccc1Br Amb25251434 [0,1,0,0,0,0|3,0,0]=4 1328 B11R1.17 O=CCCN1C=CC=CC1=O Amb18177171 [0,1,0,0,0,0|3,0,0]=4 1329 B11R1.17 O=CCCc1[n]cccc1Cl Amb25336372 [0,1,0,0,0,0|3,0,0]=4 1330 B11R1.17 O=CCCc1cc[n]cc1F Amb25677089 [0,1,0,0,0,0|3,0,0]=4 1331 B11R1.17 O=CCCc1ccccc1Br Amb22498060 [0,1,0,0,0,0|2,0,0]=3 1332 B11R1.17 O=CCCc1ccccc1Cl Amb17081678 [0,1,0,0,0,0|2,0,0]=3 1333 B11R1.17 O=CCCc1ccccc1F Amb10602147 [0,1,0,0,0,0|2,0,0]=3 1334 B11R1.17 O=CCCc1ccccc1I Amb24093007 [0,1,0,0,0,0|2,0,0]=3 1335 B11R1.17 O=CCCc1ccccc1S Amb25325144 [0,1,0,0,0,0|2,0,0]=3 1336 B11R1.17 O=CCOc1ccccc1Br Amb17099950 [0,1,0,0,0,0|3,0,0]=4 1337 B11R1.17 O=CCOc1ccccc1F Amb18182892 [0,1,0,0,0,0|3,0,0]=4 1338 B11R1.17 O=CCSc1ccccc1Cl Amb19075897 [0,1,0,0,0,0|3,0,0]=4 1339 B11R1.17 O=CCSc1ccccc1F Amb18185632 [0,1,0,0,0,0|3,0,0]=4 1340 B11R1.17 O=CNCc1ccccc1Cl Amb19871473 [0,1,0,0,0,0|3,0,0]=4 1341 B11R1.17 O=CNCc1ccccc1F Amb25369873 [0,1,0,0,0,0|3,0,0]=4 1342 B11R1.17 OCCCN1C=CC=CC1=O Amb18041289 [0,1,0,0,0,0|3,0,0]=4 1343 B11R1.17 OCCCc1[n]cccc1Br Amb25273165 [0,1,0,0,0,0|3,0,0]=4 1344 B11R1.17 OCCCc1cc[n]cc1Cl Amb23596495 [0,1,0,0,0,0|3,0,0]=4 1345 B11R1.17 OCCCc1cc[n]cc1F Amb25825625 [0,1,0,0,0,0|3,0,0]=4 1346 B11R1.17 OCCCc1ccccc1Br Amb15692692 [0,1,0,0,0,0|2,0,0]=3 1347 B11R1.17 OCCCc1ccccc1C Amb17089494 [0,1,0,0,0,0|2,0,0]=3 1348 B11R1.17 OCCCc1ccccc1Cl Amb17089499 [0,1,0,0,0,0|2,0,0]=3 1349 B11R1.17 OCCCc1ccccc1F Amb17089496 [0,1,0,0,0,0|2,0,0]=3 1350 B11R1.17 OCCCc1ccccc1N Amb17477702 [0,1,0,0,0,0|2,0,0]=3 1351 B11R1.17 OCCCc1ccccc1O Amb17477714 [0,1,0,0,0,0|2,0,0]=3 1352 B11R1.17 OCCCc1ccncc1C Amb10573523 [0,1,0,0,0,0|3,0,0]=4 1353 B11R1.17 OCCOc1ccccc1C Amb2209345 [0,1,0,0,0,0|3,0,0]=4 1354 B11R1.17 OCCOc1ccccc1Cl Amb2209355 [0,1,0,0,0,0|3,0,0]=4 1355 B11R1.17 OCCOc1ccccc1I Amb25761613 [0,1,0,0,0,0|3,0,0]=4 1356 B11R1.17 OCCOc1ccccc1O Amb1144452 [0,1,0,0,0,0|3,0,0]=4 1357 B11R1.17 O\N=C/Cc1ccccc1F Amb24100286 [0,1,0,0,0,0|1,0,2]=4 1358 B11R1.17 O\N=C\Cc1ccccc1F Amb25206635 [0,1,0,0,0,0|1,0,2]=4 1359 B11R1.17 Oc1ccc[n]c1CCCO Amb18125538 [0,1,0,0,0,0|3,0,0]=4 1360 B11R1.17 Oc1ccccc1CCC=O Amb22228954 [0,1,0,0,0,0|2,0,0]=3 1361 B11R1.17 Oc1ccccc1CCCF Amb24100539 [0,1,0,0,0,0|2,0,0]=3 1362 B11R1.17 Oc1ccccc1C\C=C/Cl Amb24578313 [0,1,0,0,0,0|2,0,1]=4 1363 B11R1.17 Oc1ccccc1C\C=C\Cl Amb18647090 [0,1,0,0,0,0|2,0,1]=4 1364 B11R1.17 Oc1ccccc1NCC=O Amb24096359 [0,1,0,0,0,0|3,0,0]=4 1365 B11R1.17 Oc1ccccc1NCCO Amb18644558 [0,1,0,0,0,0|3,0,0]=4 1366 B11R1.17 Oc1ccccc1OCCBr Amb25189201 [0,1,0,0,0,0|3,0,0]=4 1367 B11R1.17 Oc1ccccc1SCC=O Amb25290203 [0,1,0,0,0,0|3,0,0]=4 1368 B11R1.17 Oc1ccccc1SCCO Amb18177935 [0,1,0,0,0,0|3,0,0]=4 1369 B11R1.17 Oc1ccncc1CCCO Amb13889999 [0,1,0,0,0,0|3,0,0]=4 1370 B11R1.17 S=C=NCc1ccccc1Br Amb24402120 [0,1,0,0,0,0|3,0,0]=4 1371 B11R1.17 SCCCc1ccccc1Br Amb18070447 [0,1,0,0,0,0|2,0,0]=3 1372 B11R1.17 SCCCc1ccccc1C Amb17400218 [0,1,0,0,0,0|2,0,0]=3 1373 B11R1.17 SCCCc1ccccc1Cl Amb17401095 [0,1,0,0,0,0|2,0,0]=3 1374 B11R1.17 SCCCc1ccccc1F Amb17400332 [0,1,0,0,0,0|2,0,0]=3 1375 B11R1.17 SCCOc1ccccc1Br Amb17250554 [0,1,0,0,0,0|3,0,0]=4 1376 B11R1.17 SCCSc1ccccc1Br Amb25306099 [0,1,0,0,0,0|3,0,0]=4 1377 B11R1.17 Sc1ccccc1CCCBr Amb25196016 [0,1,0,0,0,0|2,0,0]=3 1378 B11R1.17 Sc1ccccc1NCCS Amb25118736 [0,1,0,0,0,0|3,0,0]=4 1379 B11R1.17 [C-]#[N+]CCc1ccccc1O Amb24644224 [0,1,0,0,0,0|1,0,1]=3 1380 B11R1.24 BrCCCc1cccc(c1)Br Amb17104576 [0,1,0,0,0,0|2,0,0]=3 1381 B11R1.24 BrCCCc1cccc(c1)C Amb17104553 [0,1,0,0,0,0|2,0,0]=3 1382 B11R1.24 BrCCCc1cccc(c1)Cl Amb17104561 [0,1,0,0,0,0|2,0,0]=3 1383 B11R1.24 BrCCOc1cccc(c1)Br Amb1150981 [0,1,0,0,0,0|3,0,0]=4 1384 B11R1.24 BrCCOc1cccc(c1)C Amb1643479 [0,1,0,0,0,0|3,0,0]=4 1385 B11R1.24 BrCCOc1cccc(c1)Cl Amb1152965 [0,1,0,0,0,0|3,0,0]=4 1386 B11R1.24 Br[Zn]CCc1cccc(c1)Br Amb13890856 [0,1,0,0,0,0|2,0,0]=3 1387 B11R1.24 Brc1cc(ccc1)OCCI Amb25151269 [0,1,0,0,0,0|3,0,0]=4 1388 B11R1.24 C#CCCc1cccc(Cl)c1 Amb18116942 [0,1,0,0,0,0|2,0,0]=3 1389 B11R1.24 C#CCCc1cccc(F)c1 Amb18118085 [0,1,0,0,0,0|2,0,0]=3 1390 B11R1.24 C#CCNc1cccc(Cl)c1 Amb18800989 [0,1,0,0,0,0|3,0,0]=4 1391 B11R1.24 C#CCNc1cccc(F)c1 Amb24102181 [0,1,0,0,0,0|3,0,0]=4 1392 B11R1.24 C#CCNc1cccc(I)c1 Amb25312865 [0,1,0,0,0,0|3,0,0]=4 1393 B11R1.24 C#CCNc1cccc(O)c1 Amb25138473 [0,1,0,0,0,0|3,0,0]=4 1394 B11R1.24 C#CCOc1cccc(Cl)c1 Amb18183541 [0,1,0,0,0,0|3,0,0]=4 1395 B11R1.24 C#CCOc1cccc(F)c1 Amb18182728 [0,1,0,0,0,0|3,0,0]=4 1396 B11R1.24 C#CCOc1cccc(c1)N Amb13783680 [0,1,0,0,0,0|3,0,0]=4 1397 B11R1.24 C#CCSc1cccc(Cl)c1 Amb19068162 [0,1,0,0,0,0|3,0,0]=4 1398 B11R1.24 C#CCSc1cccc(N)c1 Amb25675317 [0,1,0,0,0,0|3,0,0]=4 1399 B11R1.24 C#CCSc1cccc(O)c1 Amb24657054 [0,1,0,0,0,0|3,0,0]=4 1400 B11R1.24 C=CCCC1=CC=CC(=O)N1 Amb25849768 [0,1,0,0,0,0|3,0,0]=4 1401 B11R1.24 C=CCCc1cc[n]c(N)c1 Amb24378060 [0,1,0,0,0,0|3,0,0]=4 1402 B11R1.24 C=CCCc1cccc(N)[n]1 Amb25189109 [0,1,0,0,0,0|3,0,0]=4 1403 B11R1.24 C=CCCc1cccc(O)c1 Amb25275934 [0,1,0,0,0,0|2,0,0]=3 1404 B11R1.24 C=CCNc1cccc(c1)Br Amb17306222 [0,1,0,0,0,0|3,0,0]=4 1405 B11R1.24 C=CCNc1cccc(c1)C Amb17306547 [0,1,0,0,0,0|3,0,0]=4 1406 B11R1.24 C=CCNc1cccc(c1)Cl Amb17307127 [0,1,0,0,0,0|3,0,0]=4 1407 B11R1.24 C=CCNc1cccc(c1)F Amb17306228 [0,1,0,0,0,0|3,0,0]=4 1408 B11R1.24 C=CCOc1cccc(F)c1 Amb24649594 [0,1,0,0,0,0|3,0,0]=4 1409 B11R1.24 C=CCOc1cccc(I)c1 Amb22896684 [0,1,0,0,0,0|3,0,0]=4 1410 B11R1.24 C=CCOc1cccc(c1)N Amb2094493 [0,1,0,0,0,0|3,0,0]=4 1411 B11R1.24 C=CCSc1cccc(N)c1 Amb24707774 [0,1,0,0,0,0|3,0,0]=4 1412 B11R1.24 CCCCC1=CC=CC(=S)N1 Amb25720838 [0,1,0,0,0,0|3,0,0]=4 1413 B11R1.24 CCCC[n+]1cc(C)ccc1 Amb22047356 [0,1,0,0,0,0|3,0,0]=4 1414 B11R1.24 CCCC[n+]1cc(C)ccc1 Amb22264602 [0,1,0,0,0,0|3,0,0]=4 1415 B11R1.24 CCCC[n+]1cc(C)ccc1 Amb22411627 [0,1,0,0,0,0|3,0,0]=4 1416 B11R1.24 CCCC[n+]1cc(C)ccc1 Amb24323548 [0,1,0,0,0,0|3,0,0]=4 1417 B11R1.24 CCCCc1c[n]cc(N)c1 Amb24757999 [0,1,0,0,0,0|3,0,0]=4 1418 B11R1.24 CCCCc1cc(Br)cc[n]1 Amb24083005 [0,1,0,0,0,0|3,0,0]=4 1419 B11R1.24 CCCCc1cc(O)cc[n]1 Amb25109626 [0,1,0,0,0,0|3,0,0]=4 1420 B11R1.24 CCCCc1cc[n]c(N)c1 Amb24629138 [0,1,0,0,0,0|3,0,0]=4 1421 B11R1.24 CCCCc1cc[n]c(O)c1 Amb22749775 [0,1,0,0,0,0|3,0,0]=4 1422 B11R1.24 CCCCc1cccc(Br)c1 Amb19944057 [0,1,0,0,0,0|2,0,0]=3 1423 B11R1.24 CCCCc1cccc(I)c1 Amb19944046 [0,1,0,0,0,0|2,0,0]=3 1424 B11R1.24 CCCCc1cccc(N)[n]1 Amb18644442 [0,1,0,0,0,0|3,0,0]=4 1425 B11R1.24 CCCCc1cccc(S)c1 Amb24415059 [0,1,0,0,0,0|2,0,0]=3 1426 B11R1.24 CCCCc1cccc(c1)N Amb17593719 [0,1,0,0,0,0|2,0,0]=3 1427 B11R1.24 CCCOc1cc(Cl)ccc1 Amb25787001 [0,1,0,0,0,0|3,0,0]=4 1428 B11R1.24 CCCOc1cc(F)ccc1 Amb25700428 [0,1,0,0,0,0|3,0,0]=4 1429 B11R1.24 CCCOc1cccc(c1)C Amb10573406 [0,1,0,0,0,0|3,0,0]=4 1430 B11R1.24 CCCOc1cccc(c1)N Amb1138945 [0,1,0,0,0,0|3,0,0]=4 1431 B11R1.24 CCCSc1cc(Br)ccc1 Amb24538191 [0,1,0,0,0,0|3,0,0]=4 1432 B11R1.24 CCCSc1cc(Cl)ccc1 Amb25801816 [0,1,0,0,0,0|3,0,0]=4 1433 B11R1.24 CCCSc1cc(F)ccc1 Amb25806371 [0,1,0,0,0,0|3,0,0]=4 1434 B11R1.24 CCCSc1cc(N)ccc1 Amb18289141 [0,1,0,0,0,0|3,0,0]=4 1435 B11R1.24 CCCSc1cc(O)ccc1 Amb18126556 [0,1,0,0,0,0|3,0,0]=4 1436 B11R1.24 CCNCc1cc(I)ccc1 Amb24066806 [0,1,0,0,0,0|3,0,0]=4 1437 B11R1.24 CCNCc1cc(I)ccc1 Amb24066807 [0,1,0,0,0,0|3,0,0]=4 1438 B11R1.24 CCNCc1cc(N)ccc1 Amb18290000 [0,1,0,0,0,0|3,0,0]=4 1439 B11R1.24 CCNCc1cc(S)ccc1 Amb25705598 [0,1,0,0,0,0|3,0,0]=4 1440 B11R1.24 CCNCc1cccc(c1)Br Amb13949217 [0,1,0,0,0,0|3,0,0]=4 1441 B11R1.24 CCOCc1cc(Br)ccc1 Amb23512545 [0,1,0,0,0,0|3,0,0]=4 1442 B11R1.24 CCOCc1cc(Cl)ccc1 Amb24486866 [0,1,0,0,0,0|3,0,0]=4 1443 B11R1.24 CCOCc1cc(O)ccc1 Amb23443319 [0,1,0,0,0,0|3,0,0]=4 1444 B11R1.24 CCSCc1cc(Br)ccc1 Amb24476579 [0,1,0,0,0,0|3,0,0]=4 1445 B11R1.24 CCSCc1cc(O)ccc1 Amb18126555 [0,1,0,0,0,0|3,0,0]=4 1446 B11R1.24 CN/N=C/c1cccc(O)c1 Amb17803818 [0,1,0,0,0,0|2,0,1]=4 1447 B11R1.24 CNCCC=1C=CNC(=O)C1 Amb24759313 [0,1,0,0,0,0|2,0,0]=3 1448 B11R1.24 CNCCc1[n]c(O)cc[n]1 Amb18862495 [0,1,0,0,0,0|3,0,0]=4 1449 B11R1.24 CNCCc1c[n]cc(Br)c1 Amb25149055 [0,1,0,0,0,0|2,0,0]=3 1450 B11R1.24 CNCCc1c[n]cc(F)c1 Amb18993612 [0,1,0,0,0,0|2,0,0]=3 1451 B11R1.24 CNCCc1cc(Cl)cc[n]1 Amb25163179 [0,1,0,0,0,0|2,0,0]=3 1452 B11R1.24 CNCCc1cc(O)[n]c[n]1 Amb18224341 [0,1,0,0,0,0|3,0,0]=4 1453 B11R1.24 CNCCc1cc[n]c(Cl)c1 Amb24407156 [0,1,0,0,0,0|2,0,0]=3 1454 B11R1.24 CNCCc1cccc(Br)[n]1 Amb25324918 [0,1,0,0,0,0|2,0,0]=3 1455 B11R1.24 CNCCc1cccc(Cl)[n]1 Amb24679236 [0,1,0,0,0,0|2,0,0]=3 1456 B11R1.24 CNCCc1cccc(F)[n]1 Amb24596710 [0,1,0,0,0,0|2,0,0]=3 1457 B11R1.24 CNCCc1cccc(I)c1 Amb25187651 [0,1,0,0,0,0|1,0,0]=2 1458 B11R1.24 CNCCc1cccc(N)c1 Amb18550411 [0,1,0,0,0,0|1,0,0]=2 1459 B11R1.24 CNCCc1cccc(O)c1 Amb18560894 [0,1,0,0,0,0|1,0,0]=2 1460 B11R1.24 CNCCc1cccc(c1)Br Amb16230486 [0,1,0,0,0,0|1,0,0]=2 1461 B11R1.24 CNCCc1cccc(c1)C Amb16230487 [0,1,0,0,0,0|1,0,0]=2 1462 B11R1.24 CNNCc1cccc(Cl)c1 Amb22469834 [0,1,0,0,0,0|2,0,0]=3 1463 B11R1.24 CN\N=C/c1cccc(F)c1 Amb24100271 [0,1,0,0,0,0|2,0,1]=4 1464 B11R1.24 CN\N=C/c1cccc(O)c1 Amb24085681 [0,1,0,0,0,0|2,0,1]=4 1465 B11R1.24 CN\N=C\c1cccc(F)c1 Amb24371798 [0,1,0,0,0,0|2,0,1]=4 1466 B11R1.24 CN\N=C\c1cccc(c1)Br Amb16842805 [0,1,0,0,0,0|2,0,1]=4 1467 B11R1.24 COCCC1=CC=CC(=O)N1 Amb24485973 [0,1,0,0,0,0|3,0,0]=4 1468 B11R1.24 COCC[n+]1cc(C)ccc1 Amb25127531 [0,1,0,0,0,0|3,0,0]=4 1469 B11R1.24 COCC[n+]1cc(O)ccc1 Amb25822049 [0,1,0,0,0,0|3,0,0]=4 1470 B11R1.24 COCCc1c[n]cc(N)c1 Amb23570649 [0,1,0,0,0,0|3,0,0]=4 1471 B11R1.24 COCCc1cc(Br)cc[n]1 Amb25735992 [0,1,0,0,0,0|3,0,0]=4 1472 B11R1.24 COCCc1cccc(Br)[n]1 Amb25194969 [0,1,0,0,0,0|3,0,0]=4 1473 B11R1.24 COCCc1cccc(N)c1 Amb24373231 [0,1,0,0,0,0|2,0,0]=3 1474 B11R1.24 COCCc1cccc(O)c1 Amb22055706 [0,1,0,0,0,0|2,0,0]=3 1475 B11R1.24 COCCc1nccc(c1)C Amb10573767 [0,1,0,0,0,0|3,0,0]=4 1476 B11R1.24 COCNc1cccc(F)c1 Amb24102182 [0,1,0,0,0,0|3,0,0]=4 1477 B11R1.24 COCOc1cc(Br)ccc1 Amb25810590 [0,1,0,0,0,0|3,0,0]=4 1478 B11R1.24 COCOc1cc(Cl)ccc1 Amb24551706 [0,1,0,0,0,0|3,0,0]=4 1479 B11R1.24 COCOc1cc(F)ccc1 Amb21858121 [0,1,0,0,0,0|3,0,0]=4 1480 B11R1.24 COCOc1cc(N)ccc1 Amb25096531 [0,1,0,0,0,0|3,0,0]=4 1481 B11R1.24 COCSc1cccc(Cl)c1 Amb24706398 [0,1,0,0,0,0|3,0,0]=4 1482 B11R1.24 COCSc1cccc(N)c1 Amb24532948 [0,1,0,0,0,0|3,0,0]=4 1483 B11R1.24 CONCc1cccc(I)c1 Amb25719180 [0,1,0,0,0,0|3,0,0]=4 1484 B11R1.24 CSCCc1cccc(N)c1 Amb25364016 [0,1,0,0,0,0|2,0,0]=3 1485 B11R1.24 CSCOc1cccc(Cl)c1 Amb24516553 [0,1,0,0,0,0|3,0,0]=4 1486 B11R1.24 CSCSc1cc(Cl)ccc1 Amb24631399 [0,1,0,0,0,0|3,0,0]=4 1487 B11R1.24 Cc1[n]c(CCCN)cc[n]1 Amb18981849 [0,1,0,0,0,0|3,0,0]=4 1488 B11R1.24 Cc1[n]c(CCNC)cc[n]1 Amb25357841 [0,1,0,0,0,0|3,0,0]=4 1489 B11R1.24 Cc1c[n]cc(CCCC)c1 Amb24062203 [0,1,0,0,0,0|3,0,0]=4 1490 B11R1.24 Cc1c[n]cc(CCNC)[n]1 Amb25351862 [0,1,0,0,0,0|3,0,0]=4 1491 B11R1.24 Cc1cc(CCC#N)[n]cc1 Amb18124805 [0,1,0,0,0,0|2,0,1]=4 1492 B11R1.24 Cc1cc(CCC=C)[n]cc1 Amb24104089 [0,1,0,0,0,0|3,0,0]=4 1493 B11R1.24 Cc1cc(CCCCl)c[n]c1 Amb24538216 [0,1,0,0,0,0|3,0,0]=4 1494 B11R1.24 Cc1cc(CCCN)[n]c[n]1 Amb18201567 [0,1,0,0,0,0|3,0,0]=4 1495 B11R1.24 Cc1cc(CCCN)[n]cc1 Amb18201862 [0,1,0,0,0,0|2,0,0]=3 1496 B11R1.24 Cc1cc(CCCN)[n]cc1 Amb22886487 [0,1,0,0,0,0|2,0,0]=3 1497 B11R1.24 Cc1cc(CCCN)c[n]c1 Amb24509275 [0,1,0,0,0,0|2,0,0]=3 1498 B11R1.24 Cc1cc(CCCN)cc[n]1 Amb18201861 [0,1,0,0,0,0|2,0,0]=3 1499 B11R1.24 Cc1cc(CCNC)[n]c[n]1 Amb18224297 [0,1,0,0,0,0|3,0,0]=4 1500 B11R1.24 Cc1cc(CCON)ccc1 Amb25704227 [0,1,0,0,0,0|1,0,0]=2 1501 B11R1.24 Cc1cc(CNC#N)ccc1 Amb25782843 [0,1,0,0,0,0|2,0,1]=4 1502 B11R1.24 Cc1cc(COCCl)ccc1 Amb24443129 [0,1,0,0,0,0|3,0,0]=4 1503 B11R1.24 Cc1cc(CSCCl)ccc1 Amb25732759 [0,1,0,0,0,0|3,0,0]=4 1504 B11R1.24 Cc1cc(NCCN)ncc1 Amb10607842 [0,1,0,0,0,0|3,0,0]=4 1505 B11R1.24 Cc1cc([n]cc1)OCCN Amb18988887 [0,1,0,0,0,0|3,0,0]=4 1506 B11R1.24 Cc1cc([n]cc1)SCCN Amb18908763 [0,1,0,0,0,0|3,0,0]=4 1507 B11R1.24 Cc1cc(\C=C\CN)ccc1 Amb18065182 [0,1,0,0,0,0|1,0,2]=4 1508 B11R1.24 Cc1cc(c[n]c1)NCCN Amb24731510 [0,1,0,0,0,0|3,0,0]=4 1509 B11R1.24 Cc1cc(cc[n]1)NCCN Amb24383516 [0,1,0,0,0,0|3,0,0]=4 1510 B11R1.24 Cc1cc(ccc1)C#CCN Amb18949797 [0,1,0,0,0,0|1,0,2]=4 1511 B11R1.24 Cc1cc(ccc1)OCC#C Amb19373318 [0,1,0,0,0,0|3,0,0]=4 1512 B11R1.24 Cc1cc(ccc1)OCC=C Amb25688938 [0,1,0,0,0,0|3,0,0]=4 1513 B11R1.24 Cc1cc(ccc1)OCCF Amb25711593 [0,1,0,0,0,0|3,0,0]=4 1514 B11R1.24 Cc1cc(ccc1)SCC#C Amb18788143 [0,1,0,0,0,0|3,0,0]=4 1515 B11R1.24 Cc1cc(ccc1)SCC#N Amb18788233 [0,1,0,0,0,0|2,0,1]=4 1516 B11R1.24 Cc1cc(ccc1)SCCBr Amb24753608 [0,1,0,0,0,0|3,0,0]=4 1517 B11R1.24 Cc1cc(ccc1)SCCCl Amb18316731 [0,1,0,0,0,0|3,0,0]=4 1518 B11R1.24 Cc1cc(ccc1)SCCF Amb25307210 [0,1,0,0,0,0|3,0,0]=4 1519 B11R1.24 Cc1cc[n]c(CCCC)c1 Amb24065447 [0,1,0,0,0,0|3,0,0]=4 1520 B11R1.24 Cc1cc[n]c(CCCN)[n]1 Amb18064067 [0,1,0,0,0,0|3,0,0]=4 1521 B11R1.24 Cc1cc[n]c(CCNC)c1 Amb18125194 [0,1,0,0,0,0|2,0,0]=3 1522 B11R1.24 Cc1cccc(CCC#N)[n]1 Amb24085300 [0,1,0,0,0,0|2,0,1]=4 1523 B11R1.24 Cc1cccc(CCC=C)[n]1 Amb24100506 [0,1,0,0,0,0|3,0,0]=4 1524 B11R1.24 Cc1cccc(CCCC)[n]1 Amb24065450 [0,1,0,0,0,0|3,0,0]=4 1525 B11R1.24 Cc1cccc(CCCC)c1 Amb22730119 [0,1,0,0,0,0|2,0,0]=3 1526 B11R1.24 Cc1cccc(CCNC)[n]1 Amb18125196 [0,1,0,0,0,0|2,0,0]=3 1527 B11R1.24 Cc1cccc(CNOC)c1 Amb25362893 [0,1,0,0,0,0|3,0,0]=4 1528 B11R1.24 Cc1cccc(CSCC)c1 Amb25838308 [0,1,0,0,0,0|3,0,0]=4 1529 B11R1.24 Cc1cccc(NCCN)[n]1 Amb18970380 [0,1,0,0,0,0|3,0,0]=4 1530 B11R1.24 Cc1cccc(NCCN)[n]1 Amb19440303 [0,1,0,0,0,0|3,0,0]=4 1531 B11R1.24 Cc1cccc([n]1)OCCN Amb18296490 [0,1,0,0,0,0|3,0,0]=4 1532 B11R1.24 Cc1cccc([n]1)SCCN Amb18908762 [0,1,0,0,0,0|3,0,0]=4 1533 B11R1.24 Cc1cccc(c1)SCOC Amb25235859 [0,1,0,0,0,0|3,0,0]=4 1534 B11R1.24 ClCCCc1cccc(I)c1 Amb25239109 [0,1,0,0,0,0|2,0,0]=3 1535 B11R1.24 ClCCCc1cccc(c1)Br Amb17104548 [0,1,0,0,0,0|2,0,0]=3 1536 B11R1.24 ClCCCc1cccc(c1)C Amb17104526 [0,1,0,0,0,0|2,0,0]=3 1537 B11R1.24 ClCCCc1cccc(c1)Cl Amb17104534 [0,1,0,0,0,0|2,0,0]=3 1538 B11R1.24 ClCCCc1cccc(c1)N Amb17477709 [0,1,0,0,0,0|2,0,0]=3 1539 B11R1.24 ClCCCc1cccc(c1)O Amb17477723 [0,1,0,0,0,0|2,0,0]=3 1540 B11R1.24 ClCCNc1cccc(c1)Br Amb17346197 [0,1,0,0,0,0|3,0,0]=4 1541 B11R1.24 ClCCNc1cccc(c1)C Amb17334786 [0,1,0,0,0,0|3,0,0]=4 1542 B11R1.24 ClCCNc1cccc(c1)Cl Amb17336181 [0,1,0,0,0,0|3,0,0]=4 1543 B11R1.24 ClCCNc1cccc(c1)F Amb17334966 [0,1,0,0,0,0|3,0,0]=4 1544 B11R1.24 ClCCOc1cccc(c1)N Amb10608112 [0,1,0,0,0,0|3,0,0]=4 1545 B11R1.24 Clc1cc(ccc1)OCCI Amb25334122 [0,1,0,0,0,0|3,0,0]=4 1546 B11R1.24 Clc1cccc(c1)SCCCl Amb25857042 [0,1,0,0,0,0|3,0,0]=4 1547 B11R1.24 FCCNc1cc(Br)ccc1 Amb25307539 [0,1,0,0,0,0|3,0,0]=4 1548 B11R1.24 FCCNc1cc(Cl)ccc1 Amb24427077 [0,1,0,0,0,0|3,0,0]=4 1549 B11R1.24 FCCOc1cc(Br)ccc1 Amb22227889 [0,1,0,0,0,0|3,0,0]=4 1550 B11R1.24 FCCOc1cc(Cl)ccc1 Amb24659046 [0,1,0,0,0,0|3,0,0]=4 1551 B11R1.24 FCCSc1cc(Cl)ccc1 Amb25266256 [0,1,0,0,0,0|3,0,0]=4 1552 B11R1.24 Fc1cc(CCCBr)ccc1 Amb22886712 [0,1,0,0,0,0|2,0,0]=3 1553 B11R1.24 Fc1cc(CCCCl)c[n]c1 Amb24486007 [0,1,0,0,0,0|3,0,0]=4 1554 B11R1.24 Fc1cc(CCCCl)ccc1 Amb18803316 [0,1,0,0,0,0|2,0,0]=3 1555 B11R1.24 Fc1cc(CCCS)ccc1 Amb18065480 [0,1,0,0,0,0|2,0,0]=3 1556 B11R1.24 Fc1cc(CC[Zn]Br)ccc1 Amb22000496 [0,1,0,0,0,0|2,0,0]=3 1557 B11R1.24 Fc1cc(ccc1)NCCBr Amb25311264 [0,1,0,0,0,0|3,0,0]=4 1558 B11R1.24 Fc1cc(ccc1)SCCCl Amb25779976 [0,1,0,0,0,0|3,0,0]=4 1559 B11R1.24 Fc1cccc(c1)OCCF Amb22232794 [0,1,0,0,0,0|3,0,0]=4 1560 B11R1.24 N#CCCc1cccc(I)c1 Amb25312666 [0,1,0,0,0,0|1,0,1]=3 1561 B11R1.24 N#CCCc1cccc(c1)C Amb17204296 [0,1,0,0,0,0|1,0,1]=3 1562 B11R1.24 N#CCCc1cccc(c1)Cl Amb17204310 [0,1,0,0,0,0|1,0,1]=3 1563 B11R1.24 N#CCCc1cccc(c1)F Amb10841716 [0,1,0,0,0,0|1,0,1]=3 1564 B11R1.24 N#CCSc1cccc(Br)c1 Amb20642031 [0,1,0,0,0,0|2,0,1]=4 1565 B11R1.24 N#CCSc1cccc(Cl)c1 Amb18324763 [0,1,0,0,0,0|2,0,1]=4 1566 B11R1.24 N#CCSc1cccc(O)c1 Amb25748990 [0,1,0,0,0,0|2,0,1]=4 1567 B11R1.24 N#CNCc1cccc(Cl)c1 Amb18183546 [0,1,0,0,0,0|2,0,1]=4 1568 B11R1.24 N#CNCc1cccc(F)c1 Amb18799358 [0,1,0,0,0,0|2,0,1]=4 1569 B11R1.24 N#CSCc1cccc(Br)c1 Amb21959351 [0,1,0,0,0,0|2,0,1]=4 1570 B11R1.24 N#CSCc1cccc(Cl)c1 Amb19889457 [0,1,0,0,0,0|2,0,1]=4 1571 B11R1.24 N#CSCc1cccc(c1)F Amb10789220 [0,1,0,0,0,0|2,0,1]=4 1572 B11R1.24 NCC#Cc1cc(Cl)ccc1 Amb18957240 [0,1,0,0,0,0|1,0,2]=4 1573 B11R1.24 NCC#Cc1cc(F)ccc1 Amb18949810 [0,1,0,0,0,0|1,0,2]=4 1574 B11R1.24 NCC#Cc1cc(O)ccc1 Amb25084990 [0,1,0,0,0,0|1,0,2]=4 1575 B11R1.24 NCCCc1[n]c(O)cc[n]1 Amb18224336 [0,1,0,0,0,0|3,0,0]=4 1576 B11R1.24 NCCCc1c[n]cc(Br)c1 Amb25277365 [0,1,0,0,0,0|2,0,0]=3 1577 B11R1.24 NCCCc1c[n]cc(Cl)c1 Amb25793558 [0,1,0,0,0,0|2,0,0]=3 1578 B11R1.24 NCCCc1c[n]cc(F)c1 Amb25204369 [0,1,0,0,0,0|2,0,0]=3 1579 B11R1.24 NCCCc1cc(Cl)cc[n]1 Amb24432795 [0,1,0,0,0,0|2,0,0]=3 1580 B11R1.24 NCCCc1cc(O)[n]c[n]1 Amb18224337 [0,1,0,0,0,0|3,0,0]=4 1581 B11R1.24 NCCCc1cc[n]c(Br)c1 Amb25686087 [0,1,0,0,0,0|2,0,0]=3 1582 B11R1.24 NCCCc1cc[n]c(Cl)c1 Amb25340473 [0,1,0,0,0,0|2,0,0]=3 1583 B11R1.24 NCCCc1cc[n]c(S)[n]1 Amb18199035 [0,1,0,0,0,0|3,0,0]=4 1584 B11R1.24 NCCCc1cccc(Br)[n]1 Amb25055843 [0,1,0,0,0,0|2,0,0]=3 1585 B11R1.24 NCCCc1cccc(Br)c1 Amb19373503 [0,1,0,0,0,0|1,0,0]=2 1586 B11R1.24 NCCCc1cccc(c1)Cl Amb13951536 [0,1,0,0,0,0|1,0,0]=2 1587 B11R1.24 NCCCc1cccc(c1)F Amb13949159 [0,1,0,0,0,0|1,0,0]=2 1588 B11R1.24 NCCCc1cccc(c1)N Amb17477694 [0,1,0,0,0,0|1,0,0]=2 1589 B11R1.24 NCCCc1cccc(c1)O Amb17101314 [0,1,0,0,0,0|1,0,0]=2 1590 B11R1.24 NCCNc1cc(Br)c[n]c1 Amb24440030 [0,1,0,0,0,0|3,0,0]=4 1591 B11R1.24 NCCNc1cc(F)c[n]c1 Amb18999334 [0,1,0,0,0,0|3,0,0]=4 1592 B11R1.24 NCCNc1cccc(F)[n]1 Amb24072626 [0,1,0,0,0,0|3,0,0]=4 1593 B11R1.24 NCCNc1cccc(c1)Br Amb17091074 [0,1,0,0,0,0|2,0,0]=3 1594 B11R1.24 NCCNc1cccc(c1)C Amb17057745 [0,1,0,0,0,0|2,0,0]=3 1595 B11R1.24 NCCNc1cccc(c1)Cl Amb17057750 [0,1,0,0,0,0|2,0,0]=3 1596 B11R1.24 NCCNc1cccc(c1)F Amb17057748 [0,1,0,0,0,0|2,0,0]=3 1597 B11R1.24 NCCOc1c[n]cc(Br)c1 Amb22275981 [0,1,0,0,0,0|3,0,0]=4 1598 B11R1.24 NCCOc1c[n]cc(Br)c1 Amb22275982 [0,1,0,0,0,0|3,0,0]=4 1599 B11R1.24 NCCOc1cc(Br)cc[n]1 Amb24334875 [0,1,0,0,0,0|3,0,0]=4 1600 B11R1.24 NCCOc1cc(Cl)cc[n]1 Amb22236327 [0,1,0,0,0,0|3,0,0]=4 1601 B11R1.24 NCCOc1cc(O)ccc1 Amb24085157 [0,1,0,0,0,0|2,0,0]=3 1602 B11R1.24 NCCOc1cccc(c1)Br Amb10609758 [0,1,0,0,0,0|2,0,0]=3 1603 B11R1.24 NCCOc1cccc(c1)Br Amb1111484 [0,1,0,0,0,0|2,0,0]=3 1604 B11R1.24 NCCOc1cccc(c1)C Amb1098983 [0,1,0,0,0,0|2,0,0]=3 1605 B11R1.24 NCCOc1cccc(c1)Cl Amb1098576 [0,1,0,0,0,0|2,0,0]=3 1606 B11R1.24 NCCOc1cccc(c1)F Amb1126100 [0,1,0,0,0,0|2,0,0]=3 1607 B11R1.24 NCCSc1cc(Br)ccc1 Amb18998111 [0,1,0,0,0,0|2,0,0]=3 1608 B11R1.24 NCCSc1cc(Cl)[n]cc1 Amb24533119 [0,1,0,0,0,0|3,0,0]=4 1609 B11R1.24 NCCSc1cc(F)ccc1 Amb21861531 [0,1,0,0,0,0|2,0,0]=3 1610 B11R1.24 NCCSc1cccc(c1)C Amb17083043 [0,1,0,0,0,0|2,0,0]=3 1611 B11R1.24 NCCSc1cccc(c1)Cl Amb17083052 [0,1,0,0,0,0|2,0,0]=3 1612 B11R1.24 NC\C=C\c1cccc(Br)c1 Amb18066633 [0,1,0,0,0,0|1,0,2]=4 1613 B11R1.24 NC\C=C\c1cccc(Cl)c1 Amb18065474 [0,1,0,0,0,0|1,0,2]=4 1614 B11R1.24 NC\C=C\c1cccc(F)c1 Amb18065349 [0,1,0,0,0,0|1,0,2]=4 1615 B11R1.24 NNCCc1cccc(Cl)c1 Amb24064170 [0,1,0,0,0,0|0,0,0]=1 1616 B11R1.24 NNCCc1cccc(c1)Br Amb17404394 [0,1,0,0,0,0|0,0,0]=1 1617 B11R1.24 NNCCc1cccc(c1)C Amb17399915 [0,1,0,0,0,0|0,0,0]=1 1618 B11R1.24 NNCCc1cccc(c1)Cl Amb17400340 [0,1,0,0,0,0|0,0,0]=1 1619 B11R1.24 NOCCc1cccc(Cl)c1 Amb25152729 [0,1,0,0,0,0|1,0,0]=2 1620 B11R1.24 NOCCc1cccc(F)c1 Amb22896630 [0,1,0,0,0,0|1,0,0]=2 1621 B11R1.24 Nc1cc(CCC=O)cc[n]1 Amb25052314 [0,1,0,0,0,0|3,0,0]=4 1622 B11R1.24 Nc1cc(CCC=O)ccc1 Amb24486988 [0,1,0,0,0,0|2,0,0]=3 1623 B11R1.24 Nc1cc(CCNN)cc[n]1 Amb25288641 [0,1,0,0,0,0|1,0,0]=2 1624 B11R1.24 Nc1cc(CNC#N)ccc1 Amb25148290 [0,1,0,0,0,0|2,0,1]=4 1625 B11R1.24 Nc1cc(ccc1)OCCCl Amb22587140 [0,1,0,0,0,0|3,0,0]=4 1626 B11R1.24 Nc1cc(ccc1)OCCF Amb20669100 [0,1,0,0,0,0|3,0,0]=4 1627 B11R1.24 Nc1cc(ccc1)SCCO Amb18289366 [0,1,0,0,0,0|3,0,0]=4 1628 B11R1.24 Nc1cc[n]c(c1)NCCN Amb18298681 [0,1,0,0,0,0|3,0,0]=4 1629 B11R1.24 Nc1cccc(CCC#N)[n]1 Amb24085292 [0,1,0,0,0,0|2,0,1]=4 1630 B11R1.24 Nc1cccc(CCCN)[n]1 Amb24411537 [0,1,0,0,0,0|2,0,0]=3 1631 B11R1.24 Nc1cccc(c1)NCCN Amb18991498 [0,1,0,0,0,0|2,0,0]=3 1632 B11R1.24 Nc1cccc(c1)OCCN Amb18251365 [0,1,0,0,0,0|2,0,0]=3 1633 B11R1.24 Nc1cccc(c1)SCCN Amb25149157 [0,1,0,0,0,0|2,0,0]=3 1634 B11R1.24 O=C1C=CC=C(CCCBr)N1 Amb25679555 [0,1,0,0,0,0|3,0,0]=4 1635 B11R1.24 O=C1C=CC=C(CCCCl)O1 Amb25279515 [0,1,0,0,0,0|3,0,0]=4 1636 B11R1.24 O=C=NCc1cccc(c1)Br Amb17090280 [0,1,0,0,0,0|3,0,0]=4 1637 B11R1.24 O=C=NCc1cccc(c1)Cl Amb17090264 [0,1,0,0,0,0|3,0,0]=4 1638 B11R1.24 O=C=NCc1cccc(c1)O Amb17090279 [0,1,0,0,0,0|3,0,0]=4 1639 B11R1.24 O=CCCc1cc[n]c(Cl)c1 Amb24619570 [0,1,0,0,0,0|3,0,0]=4 1640 B11R1.24 O=CCCc1cccc(Cl)[n]1 Amb24511743 [0,1,0,0,0,0|3,0,0]=4 1641 B11R1.24 O=CCCc1cccc(I)c1 Amb24637998 [0,1,0,0,0,0|2,0,0]=3 1642 B11R1.24 O=CCCc1cccc(S)c1 Amb24615973 [0,1,0,0,0,0|2,0,0]=3 1643 B11R1.24 O=CCCc1cccc(c1)Br Amb17081695 [0,1,0,0,0,0|2,0,0]=3 1644 B11R1.24 O=CCCc1cccc(c1)O Amb17081694 [0,1,0,0,0,0|2,0,0]=3 1645 B11R1.24 O=CCOc1cccc(Cl)c1 Amb18806821 [0,1,0,0,0,0|3,0,0]=4 1646 B11R1.24 O=CCOc1cccc(F)c1 Amb18182893 [0,1,0,0,0,0|3,0,0]=4 1647 B11R1.24 O=CCOc1cccc(c1)Br Amb17099951 [0,1,0,0,0,0|3,0,0]=4 1648 B11R1.24 O=CCSc1cccc(c1)C Amb17082932 [0,1,0,0,0,0|3,0,0]=4 1649 B11R1.24 O=CCSc1cccc(c1)Cl Amb17082942 [0,1,0,0,0,0|3,0,0]=4 1650 B11R1.24 O=CNCc1cccc(Cl)c1 Amb24544518 [0,1,0,0,0,0|3,0,0]=4 1651 B11R1.24 O=CNCc1cccc(F)c1 Amb19958743 [0,1,0,0,0,0|3,0,0]=4 1652 B11R1.24 OCCCc1cc[n]c(Br)c1 Amb24763525 [0,1,0,0,0,0|3,0,0]=4 1653 B11R1.24 OCCCc1cccc(F)[n]1 Amb24546387 [0,1,0,0,0,0|3,0,0]=4 1654 B11R1.24 OCCCc1cccc(I)c1 Amb25075756 [0,1,0,0,0,0|2,0,0]=3 1655 B11R1.24 OCCCc1cccc(c1)Br Amb17089515 [0,1,0,0,0,0|2,0,0]=3 1656 B11R1.24 OCCCc1cccc(c1)C Amb17089495 [0,1,0,0,0,0|2,0,0]=3 1657 B11R1.24 OCCCc1cccc(c1)Cl Amb17089500 [0,1,0,0,0,0|2,0,0]=3 1658 B11R1.24 OCCCc1cccc(c1)F Amb17605781 [0,1,0,0,0,0|2,0,0]=3 1659 B11R1.24 OCCCc1cccc(c1)N Amb17477701 [0,1,0,0,0,0|2,0,0]=3 1660 B11R1.24 OCCCc1cccc(c1)O Amb17089514 [0,1,0,0,0,0|2,0,0]=3 1661 B11R1.24 OCCOc1cccc(c1)C Amb2209346 [0,1,0,0,0,0|3,0,0]=4 1662 B11R1.24 OCCSc1cc(Br)ccc1 Amb21861665 [0,1,0,0,0,0|3,0,0]=4 1663 B11R1.24 Oc1cc(CCCBr)ccc1 Amb18657769 [0,1,0,0,0,0|2,0,0]=3 1664 B11R1.24 Oc1cc(CNC=O)ccc1 Amb18179387 [0,1,0,0,0,0|3,0,0]=4 1665 B11R1.24 Oc1cc(ccc1)OCCF Amb24484451 [0,1,0,0,0,0|3,0,0]=4 1666 B11R1.24 Oc1cc(ccc1)SCCF Amb24486779 [0,1,0,0,0,0|3,0,0]=4 1667 B11R1.24 SCCCc1cccc(c1)Br Amb17407561 [0,1,0,0,0,0|2,0,0]=3 1668 B11R1.24 SCCCc1cccc(c1)C Amb17400219 [0,1,0,0,0,0|2,0,0]=3 1669 B11R1.24 SCCCc1cccc(c1)Cl Amb17401096 [0,1,0,0,0,0|2,0,0]=3 1670 B11R1.24 SCCOc1cc(I)ccc1 Amb25189185 [0,1,0,0,0,0|3,0,0]=4 1671 B11R1.24 SCCOc1cccc(c1)C Amb17232680 [0,1,0,0,0,0|3,0,0]=4 1672 B11R1.24 SCCOc1cccc(c1)F Amb17232867 [0,1,0,0,0,0|3,0,0]=4 1673 B11R1.24 SCCOc1cccc(c1)N Amb17504035 [0,1,0,0,0,0|3,0,0]=4 1674 B11R1.24 SCCSc1cc(Br)ccc1 Amb25058330 [0,1,0,0,0,0|3,0,0]=4 1675 B11R1.24 [N-]=[N+]=NCc1cccc(O)c1 Amb24447426 [0,1,0,0,0,0|1,0,2]=4 1676 B11R1.24 [NH3+]c1cc(ccc1)OCCF Amb22455032 [0,1,0,0,0,0|3,0,0]=4 1677 B11R1.28 BrCCCCc1cc[n]cc1 Amb24102841 [0,1,0,0,0,0|3,0,0]=4 1678 B11R1.28 BrCCCOc1c[n]ccc1 Amb22900113 [0,1,0,0,0,0|3,0,0]=4 1679 B11R1.28 BrCCCOc1ccccc1 Amb1154134 [0,1,0,0,0,0|2,0,0]=3 1680 B11R1.28 BrCCNCc1ccccc1 Amb18131678 [0,1,0,0,0,0|2,0,0]=3 1681 B11R1.28 BrCC\C=C\c1ccccc1 Amb17140564 [0,1,0,0,0,0|2,0,1]=4 1682 B11R1.28 BrCC\N=C\c1ccccc1 Amb25076253 [0,1,0,0,0,0|2,0,1]=4 1683 B11R1.28 BrC\C=C\Cc1ccccc1 Amb25039914 [0,1,0,0,0,0|2,0,1]=4 1684 B11R1.28 Br[Zn]CCCc1ccccc1 Amb22000503 [0,1,0,0,0,0|2,0,0]=3 1685 B11R1.28 Br\C=C/CNc1ccccc1 Amb25063133 [0,1,0,0,0,0|2,0,1]=4 1686 B11R1.28 C#CCC#Cc1ccccc1 Amb16233222 [0,1,0,0,0,0|2,0,1]=4 1687 B11R1.28 C#CCCCc1ccccc1 Amb10071067 [0,1,0,0,0,0|2,0,0]=3 1688 B11R1.28 C#CCCNc1cccc[n]1 Amb25189260 [0,1,0,0,0,0|3,0,0]=4 1689 B11R1.28 C#CCCNc1ccccc1 Amb25063678 [0,1,0,0,0,0|2,0,0]=3 1690 B11R1.28 C#CCCOc1c[n]ccc1 Amb25151770 [0,1,0,0,0,0|3,0,0]=4 1691 B11R1.28 C#CCCSc1cccc[n]1 Amb25783289 [0,1,0,0,0,0|3,0,0]=4 1692 B11R1.28 C#CCCSc1ccccc1 Amb24477610 [0,1,0,0,0,0|2,0,0]=3 1693 B11R1.28 C#CCNCc1ccccc1 Amb21972217 [0,1,0,0,0,0|2,0,0]=3 1694 B11R1.28 C#CCOCc1cccc[n]1 Amb24101369 [0,1,0,0,0,0|3,0,0]=4 1695 B11R1.28 C#CCSCc1c[n]ccc1 Amb25741316 [0,1,0,0,0,0|3,0,0]=4 1696 B11R1.28 C#CCSCc1ccccc1 Amb18800670 [0,1,0,0,0,0|2,0,0]=3 1697 B11R1.28 C#CC\N=C\c1ccccc1 Amb17609064 [0,1,0,0,0,0|2,0,1]=4 1698 B11R1.28 C/C=C/CCc1ccccc1 Amb17940149 [0,1,0,0,0,0|2,0,0]=3 1699 B11R1.28 C=CCC#Cc1ccccc1 Amb10571530 [0,1,0,0,0,0|2,0,1]=4 1700 B11R1.28 C=CCCCc1ccccc1 Amb24062985 [0,1,0,0,0,0|2,0,0]=3 1701 B11R1.28 C=CCCNc1cc[n]cc1 Amb25853434 [0,1,0,0,0,0|3,0,0]=4 1702 B11R1.28 C=CCCOc1c[n]ccc1 Amb24085225 [0,1,0,0,0,0|3,0,0]=4 1703 B11R1.28 C=CCCOc1cc[n]cc1 Amb24750926 [0,1,0,0,0,0|3,0,0]=4 1704 B11R1.28 C=CCNCc1c[n]ccc1 Amb19890377 [0,1,0,0,0,0|3,0,0]=4 1705 B11R1.28 C=CCNCc1c[n]ccc1 Amb19891174 [0,1,0,0,0,0|3,0,0]=4 1706 B11R1.28 C=CCNCc1cc[n]cc1 Amb19890311 [0,1,0,0,0,0|3,0,0]=4 1707 B11R1.28 C=CCNCc1cc[n]cc1 Amb19890811 [0,1,0,0,0,0|3,0,0]=4 1708 B11R1.28 C=CCNCc1cccc[n]1 Amb19890291 [0,1,0,0,0,0|3,0,0]=4 1709 B11R1.28 C=CCNCc1cccc[n]1 Amb19891173 [0,1,0,0,0,0|3,0,0]=4 1710 B11R1.28 C=CCOCc1cc[n]cc1 Amb24103231 [0,1,0,0,0,0|3,0,0]=4 1711 B11R1.28 C=CCOCc1cccc[n]1 Amb24106728 [0,1,0,0,0,0|3,0,0]=4 1712 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [0,1,0,0,0,0|2,0,0]=3 1713 B11R1.28 C=CCSCc1ccccc1 Amb17799426 [0,1,0,0,0,0|2,0,0]=3 1714 B11R1.28 C=CC\C=N\c1ccccc1 Amb10574759 [0,1,0,0,0,0|2,0,1]=4 1715 B11R1.28 C=CC\N=C/c1ccccc1 Amb24108502 [0,1,0,0,0,0|2,0,1]=4 1716 B11R1.28 C=NCCNc1ccccc1 Amb24486057 [0,1,0,0,0,0|1,0,1]=3 1717 B11R1.28 CC#CCNc1ccccc1 Amb21953777 [0,1,0,0,0,0|2,0,1]=4 1718 B11R1.28 CC#CCOc1ccccc1 Amb25119404 [0,1,0,0,0,0|2,0,1]=4 1719 B11R1.28 CC=CCCc1cccc[n]1 Amb24100575 [0,1,0,0,0,0|3,0,0]=4 1720 B11R1.28 CC=CCCc1ccccc1 Amb24062987 [0,1,0,0,0,0|2,0,0]=3 1721 B11R1.28 CCCCC[n+]1ccccc1 Amb24754723 [0,1,0,0,0,0|3,0,0]=4 1722 B11R1.28 CCCCCc1cccnc1 Amb17672949 [0,1,0,0,0,0|3,0,0]=4 1723 B11R1.28 CCCCCc1ccncc1 Amb17672950 [0,1,0,0,0,0|3,0,0]=4 1724 B11R1.28 CCCCOc1c[n]ccc1 Amb25382997 [0,1,0,0,0,0|3,0,0]=4 1725 B11R1.28 CCCCOc1cc[n]cc1 Amb25383158 [0,1,0,0,0,0|3,0,0]=4 1726 B11R1.28 CCCCSc1cccc[n]1 Amb25383894 [0,1,0,0,0,0|3,0,0]=4 1727 B11R1.28 CCCNCc1c[n]ccc1 Amb19890575 [0,1,0,0,0,0|3,0,0]=4 1728 B11R1.28 CCCNCc1cc[n]cc1 Amb19890591 [0,1,0,0,0,0|3,0,0]=4 1729 B11R1.28 CCCNCc1cccc[n]1 Amb19890306 [0,1,0,0,0,0|3,0,0]=4 1730 B11R1.28 CCCNCc1cccc[n]1 Amb19890563 [0,1,0,0,0,0|3,0,0]=4 1731 B11R1.28 CCCNCc1ccccc1 Amb1105937 [0,1,0,0,0,0|2,0,0]=3 1732 B11R1.28 CCCSSc1ccccc1 Amb25383743 [0,1,0,0,0,0|3,0,0]=4 1733 B11R1.28 CCC\C=N\c1ccccc1 Amb16231172 [0,1,0,0,0,0|2,0,1]=4 1734 B11R1.28 CCNCC[n+]1ccccc1 Amb25383240 [0,1,0,0,0,0|2,0,0]=3 1735 B11R1.28 CCNCCc1[n]ccc[n]1 Amb19028710 [0,1,0,0,0,0|3,0,0]=4 1736 B11R1.28 CCNCCc1c[n]c[n]c1 Amb18312962 [0,1,0,0,0,0|3,0,0]=4 1737 B11R1.28 CCNCCc1c[n]cc[n]1 Amb24750672 [0,1,0,0,0,0|3,0,0]=4 1738 B11R1.28 CCNCCc1c[n]ccc1 Amb18303850 [0,1,0,0,0,0|2,0,0]=3 1739 B11R1.28 CCNCCc1ccccc1 Amb2119468 [0,1,0,0,0,0|1,0,0]=2 1740 B11R1.28 CCOCC[n+]1ccccc1 Amb24762647 [0,1,0,0,0,0|3,0,0]=4 1741 B11R1.28 CCOCNc1ccccc1 Amb25856976 [0,1,0,0,0,0|3,0,0]=4 1742 B11R1.28 CCOCSc1ccccc1 Amb24762591 [0,1,0,0,0,0|3,0,0]=4 1743 B11R1.28 CCONCc1ccccc1 Amb25151184 [0,1,0,0,0,0|3,0,0]=4 1744 B11R1.28 CCSCSc1ccccc1 Amb25380606 [0,1,0,0,0,0|3,0,0]=4 1745 B11R1.28 CNCC#Cc1c[n]ccc1 Amb25367338 [0,1,0,0,0,0|2,0,1]=4 1746 B11R1.28 CNCC#Cc1ccccc1 Amb18296119 [0,1,0,0,0,0|1,0,1]=3 1747 B11R1.28 CNCCCc1c[n]ccc1 Amb23442716 [0,1,0,0,0,0|2,0,0]=3 1748 B11R1.28 CNCCCc1cc[n]cc1 Amb19025185 [0,1,0,0,0,0|2,0,0]=3 1749 B11R1.28 CNCCCc1cccc[n]1 Amb18312462 [0,1,0,0,0,0|2,0,0]=3 1750 B11R1.28 CNCCCc1ccccc1 Amb21954280 [0,1,0,0,0,0|1,0,0]=2 1751 B11R1.28 CNCCNc1[n]ccc[n]1 Amb18313181 [0,1,0,0,0,0|3,0,0]=4 1752 B11R1.28 CNCCNc1c[n]cc[n]1 Amb18313332 [0,1,0,0,0,0|3,0,0]=4 1753 B11R1.28 CNCCNc1cc[n]c[n]1 Amb18313343 [0,1,0,0,0,0|3,0,0]=4 1754 B11R1.28 CNCCNc1cc[n]cc1 Amb18313323 [0,1,0,0,0,0|2,0,0]=3 1755 B11R1.28 CNCCNc1ccc[n][n]1 Amb19027499 [0,1,0,0,0,0|3,0,0]=4 1756 B11R1.28 CNCCNc1cccc[n]1 Amb18313466 [0,1,0,0,0,0|2,0,0]=3 1757 B11R1.28 CNCCOc1[n]ccc[n]1 Amb19020814 [0,1,0,0,0,0|3,0,0]=4 1758 B11R1.28 CNCCOc1c[n]c[n]c1 Amb24095071 [0,1,0,0,0,0|3,0,0]=4 1759 B11R1.28 CNCCOc1c[n]cc[n]1 Amb19020813 [0,1,0,0,0,0|3,0,0]=4 1760 B11R1.28 CNCCOc1c[n]ccc1 Amb18312519 [0,1,0,0,0,0|2,0,0]=3 1761 B11R1.28 CNCCOc1cc[n]c[n]1 Amb19020825 [0,1,0,0,0,0|3,0,0]=4 1762 B11R1.28 CNCCOc1cc[n]cc1 Amb19020798 [0,1,0,0,0,0|2,0,0]=3 1763 B11R1.28 CNCCOc1ccc[n][n]1 Amb19023212 [0,1,0,0,0,0|3,0,0]=4 1764 B11R1.28 CNCCOc1cccc[n]1 Amb19020802 [0,1,0,0,0,0|2,0,0]=3 1765 B11R1.28 CNCCOc1ccccc1 Amb1105525 [0,1,0,0,0,0|1,0,0]=2 1766 B11R1.28 CNCCSc1[n]ccc[n]1 Amb18312269 [0,1,0,0,0,0|3,0,0]=4 1767 B11R1.28 CNCCSc1cccc[n]1 Amb19024669 [0,1,0,0,0,0|2,0,0]=3 1768 B11R1.28 CNCCSc1ccccc1 Amb10608735 [0,1,0,0,0,0|1,0,0]=2 1769 B11R1.28 CNCCSc1ccccc1 Amb17622507 [0,1,0,0,0,0|1,0,0]=2 1770 B11R1.28 CNC\C=C\c1c[n]ccc1 Amb23442752 [0,1,0,0,0,0|2,0,1]=4 1771 B11R1.28 CNC\C=C\c1ccccc1 Amb2114273 [0,1,0,0,0,0|1,0,1]=3 1772 B11R1.28 COCC#Cc1ccccc1 Amb25308232 [0,1,0,0,0,0|2,0,1]=4 1773 B11R1.28 COCCCc1c[n]ccc1 Amb25382996 [0,1,0,0,0,0|3,0,0]=4 1774 B11R1.28 COCCCc1cccc[n]1 Amb25383067 [0,1,0,0,0,0|3,0,0]=4 1775 B11R1.28 COCCNc1c[n]ccc1 Amb18268638 [0,1,0,0,0,0|3,0,0]=4 1776 B11R1.28 COCCOc1c[n]ccc1 Amb25383068 [0,1,0,0,0,0|3,0,0]=4 1777 B11R1.28 COCCOc1cc[n]cc1 Amb25383069 [0,1,0,0,0,0|3,0,0]=4 1778 B11R1.28 COCCOc1cccc[n]1 Amb24070160 [0,1,0,0,0,0|3,0,0]=4 1779 B11R1.28 COCCSc1ccccn1 Amb17760116 [0,1,0,0,0,0|3,0,0]=4 1780 B11R1.28 COCNCc1ccccc1 Amb25053350 [0,1,0,0,0,0|2,0,0]=3 1781 B11R1.28 CONCCc1cccc[n]1 Amb24763045 [0,1,0,0,0,0|2,0,0]=3 1782 B11R1.28 CONCCc1ccccc1 Amb22897018 [0,1,0,0,0,0|1,0,0]=2 1783 B11R1.28 CONCOc1ccccc1 Amb24096695 [0,1,0,0,0,0|2,0,0]=3 1784 B11R1.28 CSCCCc1cc[n]cc1 Amb25382938 [0,1,0,0,0,0|3,0,0]=4 1785 B11R1.28 CSCCCc1ccccc1 Amb25383748 [0,1,0,0,0,0|2,0,0]=3 1786 B11R1.28 CSCCNc1ccccc1 Amb17307504 [0,1,0,0,0,0|2,0,0]=3 1787 B11R1.28 CSCSCc1ccccc1 Amb25380610 [0,1,0,0,0,0|2,0,0]=3 1788 B11R1.28 C\C=C\CCc1cc[n]cc1 Amb25830692 [0,1,0,0,0,0|3,0,0]=4 1789 B11R1.28 C\C=N\OCc1ccccc1 Amb24334870 [0,1,0,0,0,0|2,0,1]=4 1790 B11R1.28 ClCC#CCc1ccccc1 Amb24453719 [0,1,0,0,0,0|2,0,1]=4 1791 B11R1.28 ClCCC#Cc1ccccc1 Amb18792613 [0,1,0,0,0,0|2,0,1]=4 1792 B11R1.28 ClCCCCc1c[n]ccc1 Amb24762958 [0,1,0,0,0,0|3,0,0]=4 1793 B11R1.28 ClCCCCc1cc[n]cc1 Amb20622009 [0,1,0,0,0,0|3,0,0]=4 1794 B11R1.28 ClCCCCc1cc[n]cc1 Amb21962609 [0,1,0,0,0,0|3,0,0]=4 1795 B11R1.28 ClCCCCc1cccc[n]1 Amb24762960 [0,1,0,0,0,0|3,0,0]=4 1796 B11R1.28 ClCCCNc1cc[n]cc1 Amb25246119 [0,1,0,0,0,0|3,0,0]=4 1797 B11R1.28 ClCCCOc1ccccc1 Amb1128627 [0,1,0,0,0,0|2,0,0]=3 1798 B11R1.28 ClCCCSc1cc[n]cc1 Amb25386236 [0,1,0,0,0,0|3,0,0]=4 1799 B11R1.28 ClCCCSc1ccccc1 Amb1132759 [0,1,0,0,0,0|2,0,0]=3 1800 B11R1.28 ClCCNCc1ccccn1 Amb17334832 [0,1,0,0,0,0|3,0,0]=4 1801 B11R1.28 ClCCNCc1cccnc1 Amb17334833 [0,1,0,0,0,0|3,0,0]=4 1802 B11R1.28 ClCCNCc1ccncc1 Amb17334834 [0,1,0,0,0,0|3,0,0]=4 1803 B11R1.28 ClCC\C=C\c1ccccc1 Amb17232628 [0,1,0,0,0,0|2,0,1]=4 1804 B11R1.28 ClC\C=C\Cc1ccccc1 Amb24462747 [0,1,0,0,0,0|2,0,1]=4 1805 B11R1.28 Cl[Mg]CCCc1ccccc1 Amb19928784 [0,1,0,0,0,0|2,0,0]=3 1806 B11R1.28 Cl[Zn]C\C=C\c1ccccc1 Amb22897734 [0,1,0,0,0,0|2,0,1]=4 1807 B11R1.28 Cl\C=C/CNc1ccccc1 Amb25241241 [0,1,0,0,0,0|2,0,1]=4 1808 B11R1.28 Cl\C=C\CNc1ccccc1 Amb25148081 [0,1,0,0,0,0|2,0,1]=4 1809 B11R1.28 FCCCOc1c[n]ccc1 Amb25379590 [0,1,0,0,0,0|3,0,0]=4 1810 B11R1.28 FCCCOc1cccc[n]1 Amb24762368 [0,1,0,0,0,0|3,0,0]=4 1811 B11R1.28 FCCCOc1ccccc1 Amb22008296 [0,1,0,0,0,0|2,0,0]=3 1812 B11R1.28 FCCCSc1cc[n]cc1 Amb25382657 [0,1,0,0,0,0|3,0,0]=4 1813 B11R1.28 FCCCSc1cccc[n]1 Amb25382655 [0,1,0,0,0,0|3,0,0]=4 1814 B11R1.28 FCCCSc1ccccc1 Amb25382654 [0,1,0,0,0,0|2,0,0]=3 1815 B11R1.28 FCCNCc1ccccc1 Amb24611358 [0,1,0,0,0,0|2,0,0]=3 1816 B11R1.28 ICCCCc1ccccc1 Amb25380384 [0,1,0,0,0,0|2,0,0]=3 1817 B11R1.28 ICCNCc1ccccc1 Amb25188796 [0,1,0,0,0,0|2,0,0]=3 1818 B11R1.28 ICCOCc1ccccc1 Amb16191915 [0,1,0,0,0,0|2,0,0]=3 1819 B11R1.28 N#CCC#Cc1ccccc1 Amb25705489 [0,1,0,0,0,0|1,0,2]=4 1820 B11R1.28 N#CCCC[n+]1ccccc1 Amb22339033 [0,1,0,0,0,0|2,0,1]=4 1821 B11R1.28 N#CCCCc1c[n]ccc1 Amb18124797 [0,1,0,0,0,0|2,0,1]=4 1822 B11R1.28 N#CCCCc1cc[n]cc1 Amb24083114 [0,1,0,0,0,0|2,0,1]=4 1823 B11R1.28 N#CCCCc1ccccn1 Amb1102455 [0,1,0,0,0,0|2,0,1]=4 1824 B11R1.28 N#CCCNc1c[n]ccc1 Amb24085246 [0,1,0,0,0,0|2,0,1]=4 1825 B11R1.28 N#CCCNc1ccccc1 Amb1645915 [0,1,0,0,0,0|1,0,1]=3 1826 B11R1.28 N#CCCOc1ccccc1 Amb1202508 [0,1,0,0,0,0|1,0,1]=3 1827 B11R1.28 N#CCNCc1ccccc1 Amb22491357 [0,1,0,0,0,0|1,0,1]=3 1828 B11R1.28 N#CCOCc1c[n]ccc1 Amb24068451 [0,1,0,0,0,0|2,0,1]=4 1829 B11R1.28 N#CCOCc1cccc[n]1 Amb24100494 [0,1,0,0,0,0|2,0,1]=4 1830 B11R1.28 N#CC[NH2+]Cc1ccccc1 Amb24113886 [0,1,0,0,0,0|1,0,1]=3 1831 B11R1.28 N#CNCCc1c[n]ccc1 Amb25821764 [0,1,0,0,0,0|1,0,1]=3 1832 B11R1.28 N#CNCCc1cc[n]cc1 Amb25851038 [0,1,0,0,0,0|1,0,1]=3 1833 B11R1.28 N#CN\C=N\c1ccccc1 Amb22001821 [0,1,0,0,0,0|1,0,2]=4 1834 B11R1.28 N=N=NCSc1ccccc1 Amb22360722 [0,1,0,0,0,0|1,0,2]=4 1835 B11R1.28 NCC#CCc1c[n]ccc1 Amb24553113 [0,1,0,0,0,0|2,0,1]=4 1836 B11R1.28 NCC#CCc1ccccc1 Amb25104593 [0,1,0,0,0,0|1,0,1]=3 1837 B11R1.28 NCC#CSc1ccccc1 Amb24468721 [0,1,0,0,0,0|1,0,2]=4 1838 B11R1.28 NCCC#Cc1c[n]ccc1 Amb24484386 [0,1,0,0,0,0|2,0,1]=4 1839 B11R1.28 NCCC#Cc1ccccc1 Amb18993041 [0,1,0,0,0,0|1,0,1]=3 1840 B11R1.28 NCCCCc1[n]ccc[n]1 Amb25385067 [0,1,0,0,0,0|3,0,0]=4 1841 B11R1.28 NCCCCc1c[n]c[n]c1 Amb18125322 [0,1,0,0,0,0|3,0,0]=4 1842 B11R1.28 NCCCCc1c[n]cc[n]1 Amb25385068 [0,1,0,0,0,0|3,0,0]=4 1843 B11R1.28 NCCCCc1cc[n]c[n]1 Amb18831236 [0,1,0,0,0,0|3,0,0]=4 1844 B11R1.28 NCCCCc1cc[n]cc1 Amb17991253 [0,1,0,0,0,0|2,0,0]=3 1845 B11R1.28 NCCCCc1ccc[n][n]1 Amb18201561 [0,1,0,0,0,0|3,0,0]=4 1846 B11R1.28 NCCCCc1ccccc1 Amb1227740 [0,1,0,0,0,0|1,0,0]=2 1847 B11R1.28 NCCCCc1ccccc1 Amb19929939 [0,1,0,0,0,0|1,0,0]=2 1848 B11R1.28 NCCCCc1ccccn1 Amb1102767 [0,1,0,0,0,0|2,0,0]=3 1849 B11R1.28 NCCCNc1c[n]c[n]c1 Amb19023659 [0,1,0,0,0,0|3,0,0]=4 1850 B11R1.28 NCCCNc1cc[n]c[n]1 Amb18305869 [0,1,0,0,0,0|3,0,0]=4 1851 B11R1.28 NCCCNc1ccc[n][n]1 Amb19023321 [0,1,0,0,0,0|3,0,0]=4 1852 B11R1.28 NCCCNc1ccccc1 Amb10086594 [0,1,0,0,0,0|1,0,0]=2 1853 B11R1.28 NCCCNc1cccnc1 Amb10607841 [0,1,0,0,0,0|2,0,0]=3 1854 B11R1.28 NCCCOc1[n]ccc[n]1 Amb18308494 [0,1,0,0,0,0|3,0,0]=4 1855 B11R1.28 NCCCOc1c[n]cc[n]1 Amb18308518 [0,1,0,0,0,0|3,0,0]=4 1856 B11R1.28 NCCCOc1cc[n]c[n]1 Amb18308503 [0,1,0,0,0,0|3,0,0]=4 1857 B11R1.28 NCCCOc1cc[n]cc1 Amb18308513 [0,1,0,0,0,0|2,0,0]=3 1858 B11R1.28 NCCCOc1ccc[n][n]1 Amb18311417 [0,1,0,0,0,0|3,0,0]=4 1859 B11R1.28 NCCCOc1cccc[n]1 Amb19020881 [0,1,0,0,0,0|2,0,0]=3 1860 B11R1.28 NCCCOc1ccccc1 Amb1108619 [0,1,0,0,0,0|1,0,0]=2 1861 B11R1.28 NCCCSc1ccccc1 Amb1089343 [0,1,0,0,0,0|1,0,0]=2 1862 B11R1.28 NCCCSc1ccccc1 Amb2099802 [0,1,0,0,0,0|1,0,0]=2 1863 B11R1.28 NCCCSc1ncccn1 Amb2012644 [0,1,0,0,0,0|3,0,0]=4 1864 B11R1.28 NCCNCc1[n]ccc[n]1 Amb19028574 [0,1,0,0,0,0|3,0,0]=4 1865 B11R1.28 NCCNCc1c[n]c[n]c1 Amb19032084 [0,1,0,0,0,0|3,0,0]=4 1866 B11R1.28 NCCNCc1c[n]cc[n]1 Amb19030094 [0,1,0,0,0,0|3,0,0]=4 1867 B11R1.28 NCCNCc1cc[n]c[n]1 Amb19030352 [0,1,0,0,0,0|3,0,0]=4 1868 B11R1.28 NCCNCc1ccccn1 Amb17091028 [0,1,0,0,0,0|2,0,0]=3 1869 B11R1.28 NCCNCc1cccnc1 Amb17091029 [0,1,0,0,0,0|2,0,0]=3 1870 B11R1.28 NCCNCc1ccncc1 Amb17091030 [0,1,0,0,0,0|2,0,0]=3 1871 B11R1.28 NCCNNc1ccccc1 Amb24763429 [0,1,0,0,0,0|2,0,0]=3 1872 B11R1.28 NCCOCc1[n]ccc[n]1 Amb19028700 [0,1,0,0,0,0|3,0,0]=4 1873 B11R1.28 NCCOCc1c[n]ccc1 Amb18307736 [0,1,0,0,0,0|2,0,0]=3 1874 B11R1.28 NCCOCc1cc[n]cc1 Amb19020767 [0,1,0,0,0,0|2,0,0]=3 1875 B11R1.28 NCCOCc1cccc[n]1 Amb18181726 [0,1,0,0,0,0|2,0,0]=3 1876 B11R1.28 NCCOCc1ccccc1 Amb1081962 [0,1,0,0,0,0|1,0,0]=2 1877 B11R1.28 NCCOCc1ccccc1 Amb2137059 [0,1,0,0,0,0|1,0,0]=2 1878 B11R1.28 NCCSCc1[n]ccc[n]1 Amb19028691 [0,1,0,0,0,0|3,0,0]=4 1879 B11R1.28 NCCSCc1ccc[n][n]1 Amb25385198 [0,1,0,0,0,0|3,0,0]=4 1880 B11R1.28 NCCSSc1cc[n]cc1 Amb24764696 [0,1,0,0,0,0|3,0,0]=4 1881 B11R1.28 NCCSSc1cccc[n]1 Amb22523455 [0,1,0,0,0,0|3,0,0]=4 1882 B11R1.28 NCCSSc1ccccn1 Amb17619715 [0,1,0,0,0,0|3,0,0]=4 1883 B11R1.28 NCC\C=C\c1c[n]ccc1 Amb25061778 [0,1,0,0,0,0|2,0,1]=4 1884 B11R1.28 NCC\C=C\c1cc[n]cc1 Amb24678309 [0,1,0,0,0,0|2,0,1]=4 1885 B11R1.28 NCC\C=C\c1cccc[n]1 Amb24383569 [0,1,0,0,0,0|2,0,1]=4 1886 B11R1.28 NCC\C=C\c1ccccc1 Amb17138419 [0,1,0,0,0,0|1,0,1]=3 1887 B11R1.28 NCC\N=C\c1cc[n]cc1 Amb24486118 [0,1,0,0,0,0|2,0,1]=4 1888 B11R1.28 NCNCCc1ccccc1 Amb25385258 [0,1,0,0,0,0|0,0,0]=1 1889 B11R1.28 NC\C=C\Cc1ccccc1 Amb24351087 [0,1,0,0,0,0|1,0,1]=3 1890 B11R1.28 NNCCCc1c[n]ccc1 Amb18125323 [0,1,0,0,0,0|1,0,0]=2 1891 B11R1.28 NNCCCc1ccccc1 Amb19373221 [0,1,0,0,0,0|0,0,0]=1 1892 B11R1.28 NNCCSc1ccccc1 Amb18126564 [0,1,0,0,0,0|0,0,0]=1 1893 B11R1.28 NNC\C=C\c1ccccc1 Amb24563952 [0,1,0,0,0,0|0,0,1]=2 1894 B11R1.28 NNNCNc1ccccc1 Amb25251558 [0,1,0,0,0,0|1,0,0]=2 1895 B11R1.28 NOCC#Cc1c[n]ccc1 Amb24085699 [0,1,0,0,0,0|2,0,1]=4 1896 B11R1.28 NOCC#Cc1cccc[n]1 Amb22896641 [0,1,0,0,0,0|2,0,1]=4 1897 B11R1.28 NOCC#Cc1cccc[n]1 Amb24600127 [0,1,0,0,0,0|2,0,1]=4 1898 B11R1.28 NOCCCc1ccccc1 Amb22231356 [0,1,0,0,0,0|1,0,0]=2 1899 B11R1.28 NOCCCc1ccccn1 Amb17089546 [0,1,0,0,0,0|2,0,0]=3 1900 B11R1.28 NOCCCc1cccnc1 Amb17089547 [0,1,0,0,0,0|2,0,0]=3 1901 B11R1.28 NOCCCc1ccncc1 Amb17089548 [0,1,0,0,0,0|2,0,0]=3 1902 B11R1.28 NOCCNc1ccccc1 Amb24486573 [0,1,0,0,0,0|1,0,0]=2 1903 B11R1.28 NOCCOc1ccccc1 Amb17088287 [0,1,0,0,0,0|1,0,0]=2 1904 B11R1.28 NOCCOc1ccccc1 Amb19894640 [0,1,0,0,0,0|1,0,0]=2 1905 B11R1.28 NOCCSc1[n]ccc[n]1 Amb24762884 [0,1,0,0,0,0|3,0,0]=4 1906 B11R1.28 NOCCSc1c[n]cc[n]1 Amb24762811 [0,1,0,0,0,0|3,0,0]=4 1907 B11R1.28 NOCCSc1cc[n]c[n]1 Amb24762817 [0,1,0,0,0,0|3,0,0]=4 1908 B11R1.28 NOCCSc1cc[n]cc1 Amb24762878 [0,1,0,0,0,0|2,0,0]=3 1909 B11R1.28 NOCCSc1cccc[n]1 Amb24762881 [0,1,0,0,0,0|2,0,0]=3 1910 B11R1.28 NOCOCc1ccccc1 Amb10606697 [0,1,0,0,0,0|1,0,0]=2 1911 B11R1.28 NOC\C=C\c1c[n]ccc1 Amb24085612 [0,1,0,0,0,0|2,0,1]=4 1912 B11R1.28 NOC\C=C\c1ccccc1 Amb18124997 [0,1,0,0,0,0|1,0,1]=3 1913 B11R1.28 N\C=C\C=Cc1ccccc1 Amb24628941 [0,1,0,0,0,0|1,0,2]=4 1914 B11R1.28 N\C=C\C=Nc1ccccc1 Amb24697696 [0,1,0,0,0,0|1,0,2]=4 1915 B11R1.28 N\C=N\N=Cc1ccccc1 Amb24655535 [0,1,0,0,0,0|1,0,2]=4 1916 B11R1.28 O=C=NCCc1cc[n]cc1 Amb24477613 [0,1,0,0,0,0|2,0,1]=4 1917 B11R1.28 O=C=NCCc1cccc[n]1 Amb24390560 [0,1,0,0,0,0|2,0,1]=4 1918 B11R1.28 O=C=NCCc1ccccc1 Amb2092802 [0,1,0,0,0,0|1,0,1]=3 1919 B11R1.28 O=C=NCCc1cccnc1 Amb17232038 [0,1,0,0,0,0|2,0,1]=4 1920 B11R1.28 O=C=NCOc1ccccc1 Amb20668487 [0,1,0,0,0,0|2,0,1]=4 1921 B11R1.28 O=CC#CCc1ccccc1 Amb25189233 [0,1,0,0,0,0|2,0,1]=4 1922 B11R1.28 O=CCCCc1c[n]ccc1 Amb24099514 [0,1,0,0,0,0|3,0,0]=4 1923 B11R1.28 O=CCCCc1cc[n]cc1 Amb24099515 [0,1,0,0,0,0|3,0,0]=4 1924 B11R1.28 O=CCCCc1cccc[n]1 Amb22897023 [0,1,0,0,0,0|3,0,0]=4 1925 B11R1.28 O=CCCOc1cccc[n]1 Amb24762999 [0,1,0,0,0,0|3,0,0]=4 1926 B11R1.28 O=CCCSc1cccc[n]1 Amb18177861 [0,1,0,0,0,0|3,0,0]=4 1927 B11R1.28 O=CCCSc1ccccc1 Amb17082943 [0,1,0,0,0,0|2,0,0]=3 1928 B11R1.28 O=CCNCc1ccccc1 Amb19886524 [0,1,0,0,0,0|2,0,0]=3 1929 B11R1.28 O=CCONc1ccccc1 Amb24434643 [0,1,0,0,0,0|3,0,0]=4 1930 B11R1.28 O=CCSCc1cc[n]cc1 Amb25383559 [0,1,0,0,0,0|3,0,0]=4 1931 B11R1.28 O=CCSCc1ccccc1 Amb18801121 [0,1,0,0,0,0|2,0,0]=3 1932 B11R1.28 O=CC\C=C\c1ccccc1 Amb18644267 [0,1,0,0,0,0|2,0,1]=4 1933 B11R1.28 O=CNCCc1c[n]cc[n]1 Amb24546681 [0,1,0,0,0,0|3,0,0]=4 1934 B11R1.28 O=CNCCc1c[n]ccc1 Amb24592209 [0,1,0,0,0,0|2,0,0]=3 1935 B11R1.28 O=CNCCc1cc[n]cc1 Amb24371433 [0,1,0,0,0,0|2,0,0]=3 1936 B11R1.28 O=CNCCc1ccccc1 Amb10559023 [0,1,0,0,0,0|1,0,0]=2 1937 B11R1.28 O=CNCSc1ccccc1 Amb24382608 [0,1,0,0,0,0|2,0,0]=3 1938 B11R1.28 O=CN\C=C\c1ccccc1 Amb25327993 [0,1,0,0,0,0|1,0,2]=4 1939 B11R1.28 O=C\C=C\Cc1ccccc1 Amb18124787 [0,1,0,0,0,0|2,0,1]=4 1940 B11R1.28 OCCCCc1c[n]ccc1 Amb22732495 [0,1,0,0,0,0|3,0,0]=4 1941 B11R1.28 OCCCCc1cccc[n]1 Amb21520414 [0,1,0,0,0,0|3,0,0]=4 1942 B11R1.28 OCCCCc1ccncc1 Amb17740015 [0,1,0,0,0,0|3,0,0]=4 1943 B11R1.28 OCCCNc1c[n]ccc1 Amb18267758 [0,1,0,0,0,0|3,0,0]=4 1944 B11R1.28 OCCCNc1ccccc1 Amb17307125 [0,1,0,0,0,0|2,0,0]=3 1945 B11R1.28 OCCCNc1ccccc1 Amb17772314 [0,1,0,0,0,0|2,0,0]=3 1946 B11R1.28 OCCCOc1cccc[n]1 Amb25383036 [0,1,0,0,0,0|3,0,0]=4 1947 B11R1.28 OCCN=Cc1ccccc1 Amb24065097 [0,1,0,0,0,0|2,0,1]=4 1948 B11R1.28 OCCNCc1cccc[n]1 Amb21955286 [0,1,0,0,0,0|3,0,0]=4 1949 B11R1.28 OCCNCc1ccccc1 Amb1835287 [0,1,0,0,0,0|2,0,0]=3 1950 B11R1.28 OCC\C=C\c1ccccc1 Amb24756581 [0,1,0,0,0,0|2,0,1]=4 1951 B11R1.28 OCC\N=C\c1ccccc1 Amb20622247 [0,1,0,0,0,0|2,0,1]=4 1952 B11R1.28 OC\C=C\Cc1ccccc1 Amb25074433 [0,1,0,0,0,0|2,0,1]=4 1953 B11R1.28 ONCCOc1ccccc1 Amb17088413 [0,1,0,0,0,0|1,0,0]=2 1954 B11R1.28 O\N=C\CNc1ccccc1 Amb25211715 [0,1,0,0,0,0|1,0,2]=4 1955 B11R1.28 S=C=NCCc1c[n]ccc1 Amb18035937 [0,1,0,0,0,0|2,0,1]=4 1956 B11R1.28 S=C=NCCc1cc[n]cc1 Amb18792582 [0,1,0,0,0,0|2,0,1]=4 1957 B11R1.28 SCCCCc1c[n]ccc1 Amb18563823 [0,1,0,0,0,0|3,0,0]=4 1958 B11R1.28 SCCCCc1cc[n]cc1 Amb18065469 [0,1,0,0,0,0|3,0,0]=4 1959 B11R1.28 SCCCCc1cccc[n]1 Amb18563822 [0,1,0,0,0,0|3,0,0]=4 1960 B11R1.28 SCCCCc1ccccc1 Amb17400224 [0,1,0,0,0,0|2,0,0]=3 1961 B11R1.28 SCCCNc1c[n]ccc1 Amb25059157 [0,1,0,0,0,0|3,0,0]=4 1962 B11R1.28 SCC\C=C\c1ccccc1 Amb24390438 [0,1,0,0,0,0|2,0,1]=4 1963 B11R1.28 [N-]=[N+]=NCCc1cccc[n]1 Amb24476581 [0,1,0,0,0,0|1,0,2]=4 1964 B11R1.28 [N-]=[N+]=NCCc1ccccc1 Amb19149244 [0,1,0,0,0,0|0,0,2]=3 1965 B11R1.28 [N-]=[N+]=NCSc1ccccc1 Amb22735141 [0,1,0,0,0,0|1,0,2]=4 1966 B11R1.28 [NH3+]CCCCc1ccccc1 Amb22733934 [0,1,0,0,0,0|1,0,1]=3 1967 B11R1.28 [NH3+]OCCOc1ccccc1 Amb2420800 [0,1,0,0,0,0|1,0,1]=3 1968 B11R1.40 BrC(Cc1ccccc1)C#N Amb1154191 [0,1,0,0,0,0|1,0,1]=3 1969 B11R1.40 BrCC(=O)Cc1ccccc1 Amb17569850 [0,1,0,0,0,0|2,0,1]=4 1970 B11R1.40 BrCC(C[n+]1ccccc1)Br Amb1154041 [0,1,0,0,0,0|3,0,0]=4 1971 B11R1.40 BrCC(Cc1ccccc1)O Amb17595843 [0,1,0,0,0,0|2,0,0]=3 1972 B11R1.40 BrCC(Oc1ccccc1)C Amb17241866 [0,1,0,0,0,0|3,0,0]=4 1973 B11R1.40 C#CC(=O)Cc1ccccc1 Amb22059749 [0,1,0,0,0,0|2,0,1]=4 1974 B11R1.40 C#CC(Cl)Cc1ccccc1 Amb24398624 [0,1,0,0,0,0|2,0,0]=3 1975 B11R1.40 C#CC(N)Cc1c[n]ccc1 Amb25132596 [0,1,0,0,0,0|3,0,0]=4 1976 B11R1.40 C#CC(N)Cc1cccc[n]1 Amb25340965 [0,1,0,0,0,0|3,0,0]=4 1977 B11R1.40 C#CC(N)Cc1ccccc1 Amb24699229 [0,1,0,0,0,0|2,0,0]=3 1978 B11R1.40 C#CC(O)Cc1c[n]ccc1 Amb24704924 [0,1,0,0,0,0|3,0,0]=4 1979 B11R1.40 C#CC(O)Nc1ccccc1 Amb24561876 [0,1,0,0,0,0|3,0,0]=4 1980 B11R1.40 C#C[C@@H](O)Cc1ccccc1 Amb25056589 [0,1,0,0,0,0|2,0,0]=3 1981 B11R1.40 C=C(Cc1ccccc1)CCl Amb25185403 [0,1,0,0,0,0|2,0,1]=4 1982 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [0,1,0,0,0,0|2,0,1]=4 1983 B11R1.40 C=CC(Cl)Oc1ccccc1 Amb25363210 [0,1,0,0,0,0|3,0,0]=4 1984 B11R1.40 C=CC(N)Cc1cccc[n]1 Amb25077646 [0,1,0,0,0,0|3,0,0]=4 1985 B11R1.40 C=CC(N)Cc1ccccc1 Amb25064298 [0,1,0,0,0,0|2,0,0]=3 1986 B11R1.40 C=CC(O)Cc1c[n]ccc1 Amb25097959 [0,1,0,0,0,0|3,0,0]=4 1987 B11R1.40 C=CC(O)Cc1cccc[n]1 Amb25241001 [0,1,0,0,0,0|3,0,0]=4 1988 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [0,1,0,0,0,0|2,0,0]=3 1989 B11R1.40 C=C[C@H](Cc1ccccc1)N Amb10982592 [0,1,0,0,0,0|2,0,0]=3 1990 B11R1.40 C=C[C@H](N)Cc1ccccc1 Amb19929662 [0,1,0,0,0,0|2,0,0]=3 1991 B11R1.40 C=C[C@H](O)Cc1cccc[n]1 Amb25806691 [0,1,0,0,0,0|3,0,0]=4 1992 B11R1.40 CC(C#N)Sc1ccccc1 Amb18800724 [0,1,0,0,0,0|2,0,1]=4 1993 B11R1.40 CC(C=C)Nc1ccccc1 Amb24122661 [0,1,0,0,0,0|3,0,0]=4 1994 B11R1.40 CC(C=C)Oc1ccccc1 Amb25151239 [0,1,0,0,0,0|3,0,0]=4 1995 B11R1.40 CC(C=C)Sc1ccccc1 Amb25787941 [0,1,0,0,0,0|3,0,0]=4 1996 B11R1.40 CC(C=O)Oc1ccccc1 Amb22011729 [0,1,0,0,0,0|3,0,0]=4 1997 B11R1.40 CC(C=O)Sc1ccccc1 Amb18646621 [0,1,0,0,0,0|3,0,0]=4 1998 B11R1.40 CC(CBr)Cc1c[n]ccc1 Amb25345425 [0,1,0,0,0,0|3,0,0]=4 1999 B11R1.40 CC(CBr)Cc1ccccc1 Amb25151397 [0,1,0,0,0,0|2,0,0]=3 2000 B11R1.40 CC(CCl)Sc1ccccc1 Amb25772834 [0,1,0,0,0,0|3,0,0]=4 2001 B11R1.40 CC(CN)Cc1c[n]cc[n]1 Amb25136575 [0,1,0,0,0,0|3,0,0]=4 2002 B11R1.40 CC(CN)Cc1ccccc1 Amb18010535 [0,1,0,0,0,0|1,0,0]=2 2003 B11R1.40 CC(CN)Nc1cc[n]cc1 Amb18908422 [0,1,0,0,0,0|3,0,0]=4 2004 B11R1.40 CC(CN)Nc1cccc[n]1 Amb24477483 [0,1,0,0,0,0|3,0,0]=4 2005 B11R1.40 CC(CN)Nc1ccccc1 Amb18644448 [0,1,0,0,0,0|2,0,0]=3 2006 B11R1.40 CC(CN)Oc1cccc[n]1 Amb22522747 [0,1,0,0,0,0|3,0,0]=4 2007 B11R1.40 CC(CN)Sc1cc[n]cc1 Amb18252034 [0,1,0,0,0,0|3,0,0]=4 2008 B11R1.40 CC(CN)Sc1cccc[n]1 Amb18992825 [0,1,0,0,0,0|3,0,0]=4 2009 B11R1.40 CC(CO)Cc1cc[n]cc1 Amb25374015 [0,1,0,0,0,0|3,0,0]=4 2010 B11R1.40 CC(CO)Nc1ccccc1 Amb18971804 [0,1,0,0,0,0|3,0,0]=4 2011 B11R1.40 CC(CO)Sc1ccccc1 Amb23449852 [0,1,0,0,0,0|3,0,0]=4 2012 B11R1.40 CC(Cc1c[n]ccc1)NN Amb25341062 [0,1,0,0,0,0|1,0,0]=2 2013 B11R1.40 CC(Cc1ccccc1)=[N+]=[N-] Amb25173943 [0,1,0,0,0,0|0,0,3]=4 2014 B11R1.40 CC(Cc1ccccc1)C#N Amb24402121 [0,1,0,0,0,0|1,0,1]=3 2015 B11R1.40 CC(Cc1ccccc1)C=C Amb25850978 [0,1,0,0,0,0|2,0,0]=3 2016 B11R1.40 CC(Cc1ccccc1)NN Amb22487303 [0,1,0,0,0,0|0,0,0]=1 2017 B11R1.40 CC(Cc1ccccc1)[Mg]Br Amb22897350 [0,1,0,0,0,0|2,0,0]=3 2018 B11R1.40 CC(Cc1ccccc1)[Zn]Br Amb22897866 [0,1,0,0,0,0|2,0,0]=3 2019 B11R1.40 CC(NC)Cc1cnccn1 Amb1995173 [0,1,0,0,0,0|3,0,0]=4 2020 B11R1.40 CC(Nc1ccccc1)C#N Amb17399903 [0,1,0,0,0,0|2,0,1]=4 2021 B11R1.40 CCC(Br)Cc1cc[n]cc1 Amb24353281 [0,1,0,0,0,0|3,0,0]=4 2022 B11R1.40 CCC(Br)Cc1ccccc1 Amb25189250 [0,1,0,0,0,0|2,0,0]=3 2023 B11R1.40 CCC(C)Cc1c[n]ccc1 Amb24085206 [0,1,0,0,0,0|3,0,0]=4 2024 B11R1.40 CCC(C)Cc1cccc[n]1 Amb24089681 [0,1,0,0,0,0|3,0,0]=4 2025 B11R1.40 CCC(C)Oc1ccccc1 Amb24350256 [0,1,0,0,0,0|3,0,0]=4 2026 B11R1.40 CCC(C)Sc1ccccc1 Amb25698974 [0,1,0,0,0,0|3,0,0]=4 2027 B11R1.40 CCC(Cc1ccccn1)Cl Amb17477711 [0,1,0,0,0,0|3,0,0]=4 2028 B11R1.40 CCC(Cc1ccccn1)O Amb17477703 [0,1,0,0,0,0|3,0,0]=4 2029 B11R1.40 CCC(Cc1cccnc1)Cl Amb17477713 [0,1,0,0,0,0|3,0,0]=4 2030 B11R1.40 CCC(Cc1cccnc1)O Amb17477705 [0,1,0,0,0,0|3,0,0]=4 2031 B11R1.40 CCC(Cc1ccncc1)Cl Amb17477712 [0,1,0,0,0,0|3,0,0]=4 2032 B11R1.40 CCC(Cc1ccncc1)O Amb17477704 [0,1,0,0,0,0|3,0,0]=4 2033 B11R1.40 CCC(Cl)Cc1ccccc1 Amb18177890 [0,1,0,0,0,0|2,0,0]=3 2034 B11R1.40 CCN(Cc1ccccc1)C Amb10807414 [0,1,0,0,0,0|3,0,0]=4 2035 B11R1.40 CCN(Cc1ccccc1)N Amb17232076 [0,1,0,0,0,0|3,0,0]=4 2036 B11R1.40 CCS(=O)Cc1ccccc1 Amb24485048 [0,1,0,0,0,0|3,0,0]=4 2037 B11R1.40 CC[C@@H](Br)Cc1ccccc1 Amb25770013 [0,1,0,0,0,0|2,0,0]=3 2038 B11R1.40 CC[C@@H](Cl)Cc1ccccc1 Amb24710145 [0,1,0,0,0,0|2,0,0]=3 2039 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb22748727 [0,1,0,0,0,0|2,0,0]=3 2040 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb25141525 [0,1,0,0,0,0|2,0,0]=3 2041 B11R1.40 CC[C@@H](O)Cc1ccccc1 Amb19375372 [0,1,0,0,0,0|2,0,0]=3 2042 B11R1.40 CC[C@H](Cl)Cc1ccccc1 Amb25765719 [0,1,0,0,0,0|2,0,0]=3 2043 B11R1.40 CC[C@H](N)Cc1cccc[n]1 Amb24432851 [0,1,0,0,0,0|3,0,0]=4 2044 B11R1.40 CC[C@H](N)Cc1ccccc1 Amb19929690 [0,1,0,0,0,0|2,0,0]=3 2045 B11R1.40 CN(CCl)Cc1ccccc1 Amb25324443 [0,1,0,0,0,0|3,0,0]=4 2046 B11R1.40 CN(CO)Cc1ccccc1 Amb24555500 [0,1,0,0,0,0|3,0,0]=4 2047 B11R1.40 CN(Cc1ccccc1)C#N Amb25072835 [0,1,0,0,0,0|2,0,1]=4 2048 B11R1.40 CN(Cc1ccccc1)C=S Amb25793091 [0,1,0,0,0,0|3,0,0]=4 2049 B11R1.40 CN(Cc1ccccc1)N=O Amb24074071 [0,1,0,0,0,0|2,0,1]=4 2050 B11R1.40 CNC(=N)Cc1cccc[n]1 Amb25261557 [0,1,0,0,0,0|2,0,1]=4 2051 B11R1.40 CNC(=O)C[n+]1ccccc1 Amb10553027 [0,1,0,0,0,0|2,0,1]=4 2052 B11R1.40 CNC(=O)Cc1cccnc1 Amb16231203 [0,1,0,0,0,0|2,0,1]=4 2053 B11R1.40 CNC(=O)Cc1ccncc1 Amb16231202 [0,1,0,0,0,0|2,0,1]=4 2054 B11R1.40 CNC(=S)Cc1ccccc1 Amb24559245 [0,1,0,0,0,0|1,0,1]=3 2055 B11R1.40 CNC(Cc1ccccc1)C Amb17616872 [0,1,0,0,0,0|1,0,0]=2 2056 B11R1.40 CNC(Cc1ccccn1)C Amb1995150 [0,1,0,0,0,0|2,0,0]=3 2057 B11R1.40 CN[C@H](Cc1ccccc1)C Amb17616868 [0,1,0,0,0,0|1,0,0]=2 2058 B11R1.40 CN\C(\Cl)=N\c1ccccc1 Amb24670343 [0,1,0,0,0,0|2,0,1]=4 2059 B11R1.40 COC(=N)Cc1ccccc1 Amb17673180 [0,1,0,0,0,0|2,0,1]=4 2060 B11R1.40 COC(=N)Cc1ccccc1 Amb22366095 [0,1,0,0,0,0|2,0,1]=4 2061 B11R1.40 COC(C)Cc1cc[n]cc1 Amb24485830 [0,1,0,0,0,0|3,0,0]=4 2062 B11R1.40 COC(Cl)Cc1ccccc1 Amb24711453 [0,1,0,0,0,0|2,0,0]=3 2063 B11R1.40 COC(O)Cc1ccccc1 Amb24659514 [0,1,0,0,0,0|2,0,0]=3 2064 B11R1.40 CO[SiH](C)Cc1ccccc1 Amb19893555 [0,1,0,0,0,0|2,1,0]=4 2065 B11R1.40 CSC(=N)Cc1ccccc1 Amb25211803 [0,1,0,0,0,0|2,0,1]=4 2066 B11R1.40 CSC(=O)Cc1ccccc1 Amb25293907 [0,1,0,0,0,0|2,0,1]=4 2067 B11R1.40 C[C@@H](C=O)Nc1ccccc1 Amb25836355 [0,1,0,0,0,0|3,0,0]=4 2068 B11R1.40 C[C@@H](C=O)Oc1ccccc1 Amb24504931 [0,1,0,0,0,0|3,0,0]=4 2069 B11R1.40 C[C@@H](CN)Cc1ccccc1 Amb24615612 [0,1,0,0,0,0|1,0,0]=2 2070 B11R1.40 C[C@@H](CO)Sc1ccccc1 Amb25043604 [0,1,0,0,0,0|3,0,0]=4 2071 B11R1.40 C[C@@H](Cc1cc[n]cc1)C=O Amb24608169 [0,1,0,0,0,0|3,0,0]=4 2072 B11R1.40 C[C@H](CN)Cc1cc[n]cc1 Amb24745496 [0,1,0,0,0,0|2,0,0]=3 2073 B11R1.40 C[C@H](CO)Cc1ccccc1 Amb25266388 [0,1,0,0,0,0|2,0,0]=3 2074 B11R1.40 C[C@H](Cc1ccccc1)C=O Amb25255421 [0,1,0,0,0,0|2,0,0]=3 2075 B11R1.40 C\C(=C/c1ccccc1)\NC Amb25825428 [0,1,0,0,0,0|1,0,2]=4 2076 B11R1.40 C\C(\CN)=C/c1ccccc1 Amb25076849 [0,1,0,0,0,0|1,0,2]=4 2077 B11R1.40 C\C(\CN)=C\c1ccccc1 Amb24634730 [0,1,0,0,0,0|1,0,2]=4 2078 B11R1.40 C\C(\Cc1cccc[n]1)=N\N Amb25760219 [0,1,0,0,0,0|1,0,2]=4 2079 B11R1.40 C\C(\Cc1ccccc1)=C\Cl Amb24718044 [0,1,0,0,0,0|2,0,1]=4 2080 B11R1.40 C\C(\Cc1ccccc1)=N\N Amb24501436 [0,1,0,0,0,0|0,0,2]=3 2081 B11R1.40 C\N=C(\N)/Cc1ccccc1 Amb23569051 [0,1,0,0,0,0|1,0,2]=4 2082 B11R1.40 ClC(Cc1ccccc1)C#N Amb1103676 [0,1,0,0,0,0|1,0,1]=3 2083 B11R1.40 ClCC(=O)Cc1ccccc1 Amb2371529 [0,1,0,0,0,0|2,0,1]=4 2084 B11R1.40 ClCC(Cc1ccccc1)C Amb17477588 [0,1,0,0,0,0|2,0,0]=3 2085 B11R1.40 ClCC(Cl)Cc1ccccc1 Amb25061392 [0,1,0,0,0,0|2,0,0]=3 2086 B11R1.40 ClCC(Cl)Oc1ccccc1 Amb24358073 [0,1,0,0,0,0|3,0,0]=4 2087 B11R1.40 ClCC(Cl)Sc1ccccc1 Amb24653564 [0,1,0,0,0,0|3,0,0]=4 2088 B11R1.40 ClCC(Oc1ccccc1)C Amb17232796 [0,1,0,0,0,0|3,0,0]=4 2089 B11R1.40 FC(CCl)Sc1ccccc1 Amb24390863 [0,1,0,0,0,0|3,0,0]=4 2090 B11R1.40 FCC(Br)Cc1ccccc1 Amb24611243 [0,1,0,0,0,0|2,0,0]=3 2091 B11R1.40 FCC(Cc1ccccc1)N Amb17614462 [0,1,0,0,0,0|2,0,0]=3 2092 B11R1.40 FCC(F)Cc1ccccc1 Amb22641518 [0,1,0,0,0,0|2,0,0]=3 2093 B11R1.40 N#CC(F)Sc1ccccc1 Amb24323242 [0,1,0,0,0,0|2,0,1]=4 2094 B11R1.40 N#CC(O)Cc1c[n]ccc1 Amb24062544 [0,1,0,0,0,0|2,0,1]=4 2095 B11R1.40 N#CC(O)Cc1cccc[n]1 Amb25722520 [0,1,0,0,0,0|2,0,1]=4 2096 B11R1.40 N#C[C@@H](O)Cc1ccccc1 Amb24715921 [0,1,0,0,0,0|1,0,1]=3 2097 B11R1.40 N#C[C@H](O)Cc1ccccc1 Amb25846935 [0,1,0,0,0,0|1,0,1]=3 2098 B11R1.40 N=C(Cc1ccccc1)NO Amb20671380 [0,1,0,0,0,0|1,0,1]=3 2099 B11R1.40 NC(CBr)Cc1ccccc1 Amb22489725 [0,1,0,0,0,0|2,0,0]=3 2100 B11R1.40 NC(Cc1c[n]ccc1)=NN Amb18182746 [0,1,0,0,0,0|1,0,2]=4 2101 B11R1.40 NC(Cc1c[n]ccc1)C#N Amb23557154 [0,1,0,0,0,0|2,0,1]=4 2102 B11R1.40 NC(Cc1cc[n]cc1)=NN Amb18182747 [0,1,0,0,0,0|1,0,2]=4 2103 B11R1.40 NC(Cc1cc[n]cc1)C#N Amb23557155 [0,1,0,0,0,0|2,0,1]=4 2104 B11R1.40 NC(Cc1cccc[n]1)C#N Amb23557153 [0,1,0,0,0,0|2,0,1]=4 2105 B11R1.40 NC(Cc1ccccc1)=S=O Amb25053951 [0,1,0,0,0,0|2,0,1]=4 2106 B11R1.40 NC(Cc1ccccc1)C#N Amb1127111 [0,1,0,0,0,0|1,0,1]=3 2107 B11R1.40 NC(Cc1ccccc1)NO Amb25047325 [0,1,0,0,0,0|1,0,0]=2 2108 B11R1.40 NCC(=N)Nc1ccccc1 Amb24746458 [0,1,0,0,0,0|2,0,1]=4 2109 B11R1.40 NCC(=O)Cc1c[n]ccc1 Amb18251321 [0,1,0,0,0,0|2,0,1]=4 2110 B11R1.40 NCC(=O)Cc1cc[n]cc1 Amb18201930 [0,1,0,0,0,0|2,0,1]=4 2111 B11R1.40 NCC(=O)Cc1cccc[n]1 Amb18908409 [0,1,0,0,0,0|2,0,1]=4 2112 B11R1.40 NCC(=O)Cc1ccccc1 Amb18202084 [0,1,0,0,0,0|1,0,1]=3 2113 B11R1.40 NCC(=O)Cc1ccccc1 Amb19516183 [0,1,0,0,0,0|1,0,1]=3 2114 B11R1.40 NCC(=O)Nc1ccccc1 Amb10609338 [0,1,0,0,0,0|2,0,1]=4 2115 B11R1.40 NCC(=O)Oc1ccccc1 Amb17334310 [0,1,0,0,0,0|2,0,1]=4 2116 B11R1.40 NCC(=S)Nc1ccccc1 Amb25128037 [0,1,0,0,0,0|2,0,1]=4 2117 B11R1.40 NCC(Cc1cccnc1)O Amb17232103 [0,1,0,0,0,0|2,0,0]=3 2118 B11R1.40 NCC(Cl)Cc1ccccc1 Amb24740670 [0,1,0,0,0,0|1,0,0]=2 2119 B11R1.40 NCC(F)Cc1c[n]ccc1 Amb25757490 [0,1,0,0,0,0|2,0,0]=3 2120 B11R1.40 NCC(F)Cc1ccccc1 Amb24434017 [0,1,0,0,0,0|1,0,0]=2 2121 B11R1.40 NCC(O)Cc1cc[n]cc1 Amb18201350 [0,1,0,0,0,0|2,0,0]=3 2122 B11R1.40 NCC(O)Cc1cccc[n]1 Amb18201349 [0,1,0,0,0,0|2,0,0]=3 2123 B11R1.40 NCC(O)Cc1cccc[n]1 Amb22898917 [0,1,0,0,0,0|2,0,0]=3 2124 B11R1.40 NCC(S)Cc1ccccc1 Amb18251941 [0,1,0,0,0,0|1,0,0]=2 2125 B11R1.40 NCC(Sc1ccccc1)C Amb17485971 [0,1,0,0,0,0|2,0,0]=3 2126 B11R1.40 NC[C@@H](Cc1ccccc1)N Amb17619359 [0,1,0,0,0,0|1,0,0]=2 2127 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb22746804 [0,1,0,0,0,0|1,0,0]=2 2128 B11R1.40 NC[C@H](Cc1ccccc1)N Amb17619360 [0,1,0,0,0,0|1,0,0]=2 2129 B11R1.40 NC[C@H](O)Cc1ccccc1 Amb24538166 [0,1,0,0,0,0|1,0,0]=2 2130 B11R1.40 NC\C(\Cl)=C\c1ccccc1 Amb25259250 [0,1,0,0,0,0|1,0,2]=4 2131 B11R1.40 NNC(=N)Nc1ccccc1 Amb22459345 [0,1,0,0,0,0|1,0,1]=3 2132 B11R1.40 NNC(=O)C[N]1=CC=CC=C1 Amb17836433 [0,1,0,0,0,0|1,0,1]=3 2133 B11R1.40 NNC(=O)C[n+]1ccccc1 Amb10552843 [0,1,0,0,0,0|1,0,1]=3 2134 B11R1.40 NNC(=O)C[n+]1ccccc1 Amb1154171 [0,1,0,0,0,0|1,0,1]=3 2135 B11R1.40 NNC(=O)C[n+]1ccccc1 Amb19748594 [0,1,0,0,0,0|1,0,1]=3 2136 B11R1.40 NNC(=O)Cc1c[n]c[n]c1 Amb20092729 [0,1,0,0,0,0|2,0,1]=4 2137 B11R1.40 NNC(=O)Cc1c[n]cc[n]1 Amb25306562 [0,1,0,0,0,0|2,0,1]=4 2138 B11R1.40 NNC(=O)Cc1cccc[n]1 Amb19373217 [0,1,0,0,0,0|1,0,1]=3 2139 B11R1.40 NNC(=O)Cc1ccccc1 Amb24081244 [0,1,0,0,0,0|0,0,1]=2 2140 B11R1.40 NNC(=O)Cc1ccncc1 Amb1133661 [0,1,0,0,0,0|1,0,1]=3 2141 B11R1.40 NNC(=O)Nc1c[n]ccc1 Amb24433263 [0,1,0,0,0,0|2,0,1]=4 2142 B11R1.40 NNC(=O)Nc1cc[n]cc1 Amb25148277 [0,1,0,0,0,0|2,0,1]=4 2143 B11R1.40 NNC(=O)Nc1ccccc1 Amb1204373 [0,1,0,0,0,0|1,0,1]=3 2144 B11R1.40 NNC(=S)Cc1ccccc1 Amb24377114 [0,1,0,0,0,0|0,0,1]=2 2145 B11R1.40 NNC(=S)Nc1cc[n]cc1 Amb25824211 [0,1,0,0,0,0|2,0,1]=4 2146 B11R1.40 NNC(=S)Nc1cccc[n]1 Amb20668225 [0,1,0,0,0,0|2,0,1]=4 2147 B11R1.40 NN\C(=N/c1ccccc1)\S Amb2502886 [0,1,0,0,0,0|1,0,1]=3 2148 B11R1.40 NOC(=O)Nc1ccccc1 Amb24484939 [0,1,0,0,0,0|2,0,1]=4 2149 B11R1.40 N[C@@H](CBr)Cc1ccccc1 Amb22747782 [0,1,0,0,0,0|2,0,0]=3 2150 B11R1.40 N[C@@H](CCl)Cc1ccccc1 Amb24758237 [0,1,0,0,0,0|2,0,0]=3 2151 B11R1.40 N[C@@H](CF)Cc1ccccc1 Amb24484482 [0,1,0,0,0,0|2,0,0]=3 2152 B11R1.40 N[C@@H](CO)Cc1ccccc1 Amb20242871 [0,1,0,0,0,0|2,0,0]=3 2153 B11R1.40 N[C@@H](CS)Cc1ccccc1 Amb25073967 [0,1,0,0,0,0|2,0,0]=3 2154 B11R1.40 N[C@@H](Cc1ccccc1)C#N Amb17399902 [0,1,0,0,0,0|1,0,1]=3 2155 B11R1.40 N[C@H](CCl)Cc1ccccc1 Amb24533056 [0,1,0,0,0,0|2,0,0]=3 2156 B11R1.40 N[C@H](CF)Cc1ccccc1 Amb25151303 [0,1,0,0,0,0|2,0,0]=3 2157 B11R1.40 N[C@H](CS)Cc1ccccc1 Amb25765677 [0,1,0,0,0,0|2,0,0]=3 2158 B11R1.40 N[C@H](Cc1ccccc1)C=O Amb24746755 [0,1,0,0,0,0|2,0,0]=3 2159 B11R1.40 N\C(\Cc1cccc[n]1)=N\N Amb18177153 [0,1,0,0,0,0|1,0,2]=4 2160 B11R1.40 N\C(\Cc1ccccc1)=C\O Amb25152159 [0,1,0,0,0,0|2,0,1]=4 2161 B11R1.40 N\C(\Cc1ccccc1)=N/N Amb17933233 [0,1,0,0,0,0|0,0,2]=3 2162 B11R1.40 N\C(\Cc1ccccc1)=N\Cl Amb25689858 [0,1,0,0,0,0|1,0,2]=4 2163 B11R1.40 N\C(\Nc1ccccc1)=N\N Amb25046170 [0,1,0,0,0,0|1,0,2]=4 2164 B11R1.40 N\N=C(\Cl)/Cc1ccccc1 Amb25188651 [0,1,0,0,0,0|0,0,2]=3 2165 B11R1.40 O=C(Cc1ccccc1)CF Amb22234964 [0,1,0,0,0,0|2,0,1]=4 2166 B11R1.40 O=C(Cc1ccccc1)CS Amb25294429 [0,1,0,0,0,0|2,0,1]=4 2167 B11R1.40 O=C(Cc1ccccc1)O[Ag] Amb22359200 [0,1,0,0,0,0|2,0,1]=4 2168 B11R1.40 O=C(Nc1ccccc1)NCl Amb25756195 [0,1,0,0,0,0|2,0,1]=4 2169 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [0,1,0,0,0,0|2,0,1]=4 2170 B11R1.40 O=CC(Br)Cc1c[n]ccc1 Amb25365114 [0,1,0,0,0,0|3,0,0]=4 2171 B11R1.40 O=CC(Br)Cc1ccccc1 Amb18657408 [0,1,0,0,0,0|2,0,0]=3 2172 B11R1.40 O=CC(Cc1ccccc1)Cl Amb17204312 [0,1,0,0,0,0|2,0,0]=3 2173 B11R1.40 O=CC(F)Cc1cc[n]cc1 Amb25053677 [0,1,0,0,0,0|3,0,0]=4 2174 B11R1.40 O=CC(F)Cc1ccccc1 Amb24714702 [0,1,0,0,0,0|2,0,0]=3 2175 B11R1.40 O=C[C@@H](Br)Cc1ccccc1 Amb24461614 [0,1,0,0,0,0|2,0,0]=3 2176 B11R1.40 O=C[C@@H](F)Cc1ccccc1 Amb24724556 [0,1,0,0,0,0|2,0,0]=3 2177 B11R1.40 O=C[C@H](Br)Cc1ccccc1 Amb25778238 [0,1,0,0,0,0|2,0,0]=3 2178 B11R1.40 O=NC(Cc1ccccn1)C Amb10549352 [0,1,0,0,0,0|2,0,1]=4 2179 B11R1.40 O=S(CCl)Cc1ccccc1 Amb24373167 [0,1,0,0,0,0|3,0,0]=4 2180 B11R1.40 OC(CBr)Oc1ccccc1 Amb24724811 [0,1,0,0,0,0|3,0,0]=4 2181 B11R1.40 OC(CBr)Sc1ccccc1 Amb24065441 [0,1,0,0,0,0|3,0,0]=4 2182 B11R1.40 OC(CCl)C[n+]1ccccc1 Amb22346544 [0,1,0,0,0,0|3,0,0]=4 2183 B11R1.40 OC(CCl)Cc1c[n]ccc1 Amb25189476 [0,1,0,0,0,0|3,0,0]=4 2184 B11R1.40 OC(CCl)Oc1ccccc1 Amb24635839 [0,1,0,0,0,0|3,0,0]=4 2185 B11R1.40 OC(CF)Cc1ccccc1 Amb24733743 [0,1,0,0,0,0|2,0,0]=3 2186 B11R1.40 OC(CS)Cc1ccccc1 Amb25740621 [0,1,0,0,0,0|2,0,0]=3 2187 B11R1.40 OC(Cc1c[n]ccc1)C=O Amb24533570 [0,1,0,0,0,0|3,0,0]=4 2188 B11R1.40 OC(Cc1cc[n]cc1)C=O Amb24751695 [0,1,0,0,0,0|3,0,0]=4 2189 B11R1.40 OC(Cc1ccccc1)C=O Amb25065752 [0,1,0,0,0,0|2,0,0]=3 2190 B11R1.40 OCC(=O)Cc1ccccc1 Amb18182729 [0,1,0,0,0,0|2,0,1]=4 2191 B11R1.40 OCC(Cc1ccccc1)C Amb17477578 [0,1,0,0,0,0|2,0,0]=3 2192 B11R1.40 OCC(Cc1ccccc1)O Amb17593786 [0,1,0,0,0,0|2,0,0]=3 2193 B11R1.40 OCC(Cc1ccccn1)N Amb17062682 [0,1,0,0,0,0|3,0,0]=4 2194 B11R1.40 OCC(Cc1cccnc1)N Amb17062683 [0,1,0,0,0,0|3,0,0]=4 2195 B11R1.40 OCC(Cc1ccncc1)N Amb17062684 [0,1,0,0,0,0|3,0,0]=4 2196 B11R1.40 OCC(Cl)Cc1ccccc1 Amb24373181 [0,1,0,0,0,0|2,0,0]=3 2197 B11R1.40 OCC(F)Cc1ccccc1 Amb25225922 [0,1,0,0,0,0|2,0,0]=3 2198 B11R1.40 OCC(O)Nc1ccccc1 Amb25369775 [0,1,0,0,0,0|3,0,0]=4 2199 B11R1.40 OCC(Oc1ccccc1)C Amb17232100 [0,1,0,0,0,0|3,0,0]=4 2200 B11R1.40 OC[C@@H](O)Cc1ccccc1 Amb25204361 [0,1,0,0,0,0|2,0,0]=3 2201 B11R1.40 OC[C@H](Br)Cc1ccccc1 Amb24639076 [0,1,0,0,0,0|2,0,0]=3 2202 B11R1.40 OC[C@H](O)Cc1ccccc1 Amb24392862 [0,1,0,0,0,0|2,0,0]=3 2203 B11R1.40 ONC(=O)Cc1ccc[n]c1 Amb25052392 [0,1,0,0,0,0|2,0,1]=4 2204 B11R1.40 ONC(=O)Oc1ccccc1 Amb22493600 [0,1,0,0,0,0|2,0,1]=4 2205 B11R1.40 O[C@@H](CCl)Cc1ccccc1 Amb19929327 [0,1,0,0,0,0|2,0,0]=3 2206 B11R1.40 O[C@H](CBr)Cc1ccccc1 Amb24392488 [0,1,0,0,0,0|2,0,0]=3 2207 B11R1.40 O[C@H](CCl)Cc1ccccc1 Amb19929332 [0,1,0,0,0,0|2,0,0]=3 2208 B11R1.40 O[C@H](Cc1ccccc1)C=O Amb25683436 [0,1,0,0,0,0|2,0,0]=3 2209 B11R1.40 O\C(\Cc1ccccc1)=N/O Amb19986986 [0,1,0,0,0,0|1,0,2]=4 2210 B11R1.40 O\N=C(/Cc1ccccc1)\N Amb1106303 [0,1,0,0,0,0|1,0,2]=4 2211 B11R1.40 O\N=C(\Cc1ccccc1)/N Amb1159399 [0,1,0,0,0,0|1,0,2]=4 2212 B11R1.40 O\N=C(\Cl)/Cc1ccccc1 Amb25721012 [0,1,0,0,0,0|1,0,2]=4 2213 B11R1.91 C=C(Br)CSc1ccccc1 Amb24458275 [0,1,0,0,0,0|3,0,0]=4 2214 B11R1.91 C=C(Cl)CNc1ccccc1 Amb18289308 [0,1,0,0,0,0|3,0,0]=4 2215 B11R1.91 CC(=C)COc1ccccc1 Amb10601706 [0,1,0,0,0,0|3,0,0]=4 2216 B11R1.91 CC(=C)OCc1ccccc1 Amb22731238 [0,1,0,0,0,0|3,0,0]=4 2217 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [0,1,0,0,0,0|2,0,1]=4 2218 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [0,1,0,0,0,0|2,0,1]=4 2219 B11R1.91 CC(=NCc1ccccc1)C Amb10568469 [0,1,0,0,0,0|3,0,0]=4 2220 B11R1.91 CC(=O)CCc1ccccn1 Amb17507163 [0,1,0,0,0,0|3,0,0]=4 2221 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [0,1,0,0,0,0|3,0,0]=4 2222 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [0,1,0,0,0,0|3,0,0]=4 2223 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [0,1,0,0,0,0|3,0,0]=4 2224 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [0,1,0,0,0,0|3,0,0]=4 2225 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [0,1,0,0,0,0|3,0,0]=4 2226 B11R1.91 CC(=S)OCc1ccccc1 Amb22168133 [0,1,0,0,0,0|3,0,0]=4 2227 B11R1.91 CC(Br)COc1ccccc1 Amb25278262 [0,1,0,0,0,0|3,0,0]=4 2228 B11R1.91 CC(CCc1ccccn1)N Amb17507327 [0,1,0,0,0,0|2,0,0]=3 2229 B11R1.91 CC(CCc1ccccn1)O Amb17507263 [0,1,0,0,0,0|3,0,0]=4 2230 B11R1.91 CC(CCc1cccnc1)N Amb17507328 [0,1,0,0,0,0|2,0,0]=3 2231 B11R1.91 CC(CCc1cccnc1)O Amb17507264 [0,1,0,0,0,0|3,0,0]=4 2232 B11R1.91 CC(CCc1ccncc1)N Amb17507329 [0,1,0,0,0,0|2,0,0]=3 2233 B11R1.91 CC(CCc1ccncc1)O Amb17507265 [0,1,0,0,0,0|3,0,0]=4 2234 B11R1.91 CC(COc1ccccc1)N Amb10609380 [0,1,0,0,0,0|2,0,0]=3 2235 B11R1.91 CC(COc1ccccc1)N Amb1126967 [0,1,0,0,0,0|2,0,0]=3 2236 B11R1.91 CC(Cl)CCc1c[n]ccc1 Amb24486010 [0,1,0,0,0,0|3,0,0]=4 2237 B11R1.91 CC(Cl)CCc1cc[n]cc1 Amb24369393 [0,1,0,0,0,0|3,0,0]=4 2238 B11R1.91 CC(Cl)COc1ccccc1 Amb20248050 [0,1,0,0,0,0|3,0,0]=4 2239 B11R1.91 CC(Cl)CSc1ccccc1 Amb25361088 [0,1,0,0,0,0|3,0,0]=4 2240 B11R1.91 CC(N)C=Cc1ccccc1 Amb23536549 [0,1,0,0,0,0|1,0,2]=4 2241 B11R1.91 CC(N)CCc1c[n]c[n]c1 Amb18125321 [0,1,0,0,0,0|3,0,0]=4 2242 B11R1.91 CC(N)CCc1c[n]cc[n]1 Amb25691782 [0,1,0,0,0,0|3,0,0]=4 2243 B11R1.91 CC(N)CCc1cc[n]c[n]1 Amb18201527 [0,1,0,0,0,0|3,0,0]=4 2244 B11R1.91 CC(N)CNc1cc[n]cc1 Amb25288005 [0,1,0,0,0,0|3,0,0]=4 2245 B11R1.91 CC(N)CNc1cccc[n]1 Amb18125324 [0,1,0,0,0,0|3,0,0]=4 2246 B11R1.91 CC(N)CNc1ccccc1 Amb18972362 [0,1,0,0,0,0|2,0,0]=3 2247 B11R1.91 CC(N)CSc1cccc[n]1 Amb22642666 [0,1,0,0,0,0|3,0,0]=4 2248 B11R1.91 CC(N)CSc1ccccc1 Amb18065472 [0,1,0,0,0,0|2,0,0]=3 2249 B11R1.91 CC(N)CSc1ccccc1 Amb21988436 [0,1,0,0,0,0|2,0,0]=3 2250 B11R1.91 CC(N)OCc1cccc[n]1 Amb24432123 [0,1,0,0,0,0|3,0,0]=4 2251 B11R1.91 CC(N)\C=C\c1ccccc1 Amb18124854 [0,1,0,0,0,0|1,0,2]=4 2252 B11R1.91 CC(N)\C=C\c1ccccc1 Amb21961471 [0,1,0,0,0,0|1,0,2]=4 2253 B11R1.91 CC(NCc1ccccc1)C Amb2118435 [0,1,0,0,0,0|3,0,0]=4 2254 B11R1.91 CC(O)CSc1ccccc1 Amb18793066 [0,1,0,0,0,0|3,0,0]=4 2255 B11R1.91 CC(O)OCc1ccccc1 Amb25070837 [0,1,0,0,0,0|3,0,0]=4 2256 B11R1.91 CC(S)CNc1ccccc1 Amb25701720 [0,1,0,0,0,0|3,0,0]=4 2257 B11R1.91 CN(C)/N=C/c1ccccc1 Amb17703328 [0,1,0,0,0,0|2,0,1]=4 2258 B11R1.91 CN(C)CCc1cc[n]cc1 Amb24073816 [0,1,0,0,0,0|2,0,0]=3 2259 B11R1.91 CN(C)CCc1ccccc1 Amb22350299 [0,1,0,0,0,0|1,0,0]=2 2260 B11R1.91 CN(C)NCc1cc[n]cc1 Amb25151715 [0,1,0,0,0,0|3,0,0]=4 2261 B11R1.91 CN(C)OCc1ccccc1 Amb24735469 [0,1,0,0,0,0|2,0,0]=3 2262 B11R1.91 CN(C)\C=C\c1ccccc1 Amb25056753 [0,1,0,0,0,0|1,0,2]=4 2263 B11R1.91 CN(C)\C=N\c1ccccc1 Amb22357796 [0,1,0,0,0,0|2,0,1]=4 2264 B11R1.91 CN(N)CCc1cccc[n]1 Amb25725193 [0,1,0,0,0,0|1,0,0]=2 2265 B11R1.91 CN(N)CCc1ccccc1 Amb18064284 [0,1,0,0,0,0|0,0,0]=1 2266 B11R1.91 CN(O)CCc1cc[n]cc1 Amb25684228 [0,1,0,0,0,0|2,0,0]=3 2267 B11R1.91 CN(O)N=Nc1ccccc1 Amb24064881 [0,1,0,0,0,0|3,0,0]=4 2268 B11R1.91 C[C@@H](COc1ccccc1)N Amb17232092 [0,1,0,0,0,0|2,0,0]=3 2269 B11R1.91 C[C@@H](N)CCc1cc[n]cc1 Amb24551017 [0,1,0,0,0,0|2,0,0]=3 2270 B11R1.91 C[C@@H](N)CCc1cccc[n]1 Amb25076768 [0,1,0,0,0,0|2,0,0]=3 2271 B11R1.91 C[C@@H](N)CNc1cccc[n]1 Amb25320231 [0,1,0,0,0,0|3,0,0]=4 2272 B11R1.91 C[C@@H](N)CNc1ccccc1 Amb24392348 [0,1,0,0,0,0|2,0,0]=3 2273 B11R1.91 C[C@@H](N)COc1ccccc1 Amb18538481 [0,1,0,0,0,0|2,0,0]=3 2274 B11R1.91 C[C@@H](N)CSc1cccc[n]1 Amb24488293 [0,1,0,0,0,0|3,0,0]=4 2275 B11R1.91 C[C@@H](N)CSc1ccccc1 Amb24692771 [0,1,0,0,0,0|2,0,0]=3 2276 B11R1.91 C[C@@H](N)\C=C\c1ccccc1 Amb24359903 [0,1,0,0,0,0|1,0,2]=4 2277 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [0,1,0,0,0,0|2,0,0]=3 2278 B11R1.91 C[C@@H](O)CSc1ccccc1 Amb25148170 [0,1,0,0,0,0|3,0,0]=4 2279 B11R1.91 C[C@H](N)C#Cc1ccccc1 Amb24408567 [0,1,0,0,0,0|1,0,2]=4 2280 B11R1.91 C[C@H](N)CCc1cc[n]cc1 Amb24715801 [0,1,0,0,0,0|2,0,0]=3 2281 B11R1.91 C[C@H](N)CNc1cccc[n]1 Amb24620429 [0,1,0,0,0,0|3,0,0]=4 2282 B11R1.91 C[C@H](N)CNc1ccccc1 Amb24423922 [0,1,0,0,0,0|2,0,0]=3 2283 B11R1.91 C[C@H](N)CSc1cc[n]cc1 Amb25051842 [0,1,0,0,0,0|3,0,0]=4 2284 B11R1.91 C[C@H](N)CSc1cccc[n]1 Amb24488292 [0,1,0,0,0,0|3,0,0]=4 2285 B11R1.91 C[C@H](N)CSc1ccccc1 Amb24486596 [0,1,0,0,0,0|2,0,0]=3 2286 B11R1.91 C[C@H](N)\C=C\c1ccccc1 Amb25809484 [0,1,0,0,0,0|1,0,2]=4 2287 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [0,1,0,0,0,0|2,0,0]=3 2288 B11R1.91 C[C@H](O)CNc1ccccc1 Amb25060992 [0,1,0,0,0,0|3,0,0]=4 2289 B11R1.91 C[C@H](O)COc1ccccc1 Amb25786939 [0,1,0,0,0,0|3,0,0]=4 2290 B11R1.91 C[C@H](O)CSc1ccccc1 Amb25852129 [0,1,0,0,0,0|3,0,0]=4 2291 B11R1.91 C[SiH](C)CCc1ccccc1 Amb22338692 [0,1,0,0,0,0|2,0,0]=3 2292 B11R1.91 C\C(\N)=C\Oc1ccccc1 Amb24674154 [0,1,0,0,0,0|2,0,1]=4 2293 B11R1.91 C\C(\N)=N/Cc1c[n]ccc1 Amb24098048 [0,1,0,0,0,0|3,0,0]=4 2294 B11R1.91 C\C(\N)=N\Nc1ccccc1 Amb24417520 [0,1,0,0,0,0|3,0,0]=4 2295 B11R1.91 C\C(\N)=N\Oc1ccccc1 Amb25042875 [0,1,0,0,0,0|3,0,0]=4 2296 B11R1.91 ClC(Cl)CNc1ccccc1 Amb24720107 [0,1,0,0,0,0|3,0,0]=4 2297 B11R1.91 ClC(Cl)COc1ccccc1 Amb24417608 [0,1,0,0,0,0|3,0,0]=4 2298 B11R1.91 ClP(Cl)OCc1ccccc1 Amb22054434 [0,1,0,0,0,0|2,1,0]=4 2299 B11R1.91 FC(F)CNc1ccccc1 Amb18791799 [0,1,0,0,0,0|3,0,0]=4 2300 B11R1.91 FC(F)CNc1ccccc1 Amb20623918 [0,1,0,0,0,0|3,0,0]=4 2301 B11R1.91 FC(F)COc1ccccc1 Amb22008298 [0,1,0,0,0,0|3,0,0]=4 2302 B11R1.91 FC(F)CSc1ccccc1 Amb25668847 [0,1,0,0,0,0|3,0,0]=4 2303 B11R1.91 N=C(/N)\SCc1ccccc1 Amb20655654 [0,1,0,0,0,0|2,0,0]=3 2304 B11R1.91 N=C([NH3+])SCc1ccccc1 Amb24113839 [0,1,0,0,0,0|2,0,1]=4 2305 B11R1.91 NC(=N)C=Cc1ccccc1 Amb22464717 [0,1,0,0,0,0|1,0,2]=4 2306 B11R1.91 NC(=N)CCc1cccc[n]1 Amb22304703 [0,1,0,0,0,0|2,0,0]=3 2307 B11R1.91 NC(=N)CNc1ccccc1 Amb24426634 [0,1,0,0,0,0|2,0,0]=3 2308 B11R1.91 NC(=N)CSc1cc[n]cc1 Amb24675096 [0,1,0,0,0,0|3,0,0]=4 2309 B11R1.91 NC(=N)NCc1cc[n]cc1 Amb22586445 [0,1,0,0,0,0|3,0,0]=4 2310 B11R1.91 NC(=N)NCc1cc[n]cc1 Amb22586971 [0,1,0,0,0,0|3,0,0]=4 2311 B11R1.91 NC(=N)NCc1ccc[n]c1 Amb20631269 [0,1,0,0,0,0|3,0,0]=4 2312 B11R1.91 NC(=N)NCc1ccc[n]c1 Amb22586970 [0,1,0,0,0,0|3,0,0]=4 2313 B11R1.91 NC(=N)NCc1ccccc1 Amb21955695 [0,1,0,0,0,0|2,0,0]=3 2314 B11R1.91 NC(=N)NCc1ccccc1 Amb22370878 [0,1,0,0,0,0|2,0,0]=3 2315 B11R1.91 NC(=N)NCc1ccccn1 Amb13995592 [0,1,0,0,0,0|3,0,0]=4 2316 B11R1.91 NC(=N)NCc1cccnc1 Amb10607729 [0,1,0,0,0,0|3,0,0]=4 2317 B11R1.91 NC(=N)NCc1ccncc1 Amb10607730 [0,1,0,0,0,0|3,0,0]=4 2318 B11R1.91 NC(=N)SCc1cc[n]cc1 Amb23538018 [0,1,0,0,0,0|3,0,0]=4 2319 B11R1.91 NC(=N)SCc1ccccc1 Amb20676044 [0,1,0,0,0,0|2,0,0]=3 2320 B11R1.91 NC(=N)SCc1cccnc1 Amb16229677 [0,1,0,0,0,0|3,0,0]=4 2321 B11R1.91 NC(=N)[NH2+]Cc1ccccc1 Amb22269907 [0,1,0,0,0,0|2,0,0]=3 2322 B11R1.91 NC(=N)\C=C\c1ccccc1 Amb22755484 [0,1,0,0,0,0|1,0,2]=4 2323 B11R1.91 NC(=N)\C=C\c1ccccc1 Amb22756994 [0,1,0,0,0,0|1,0,2]=4 2324 B11R1.91 NC(=N)\N=C\c1ccccc1 Amb24435682 [0,1,0,0,0,0|2,0,1]=4 2325 B11R1.91 NC(=NCc1ccccc1)N Amb16231121 [0,1,0,0,0,0|2,0,0]=3 2326 B11R1.91 NC(=O)CCc1[n]ccc[n]1 Amb24355296 [0,1,0,0,0,0|3,0,0]=4 2327 B11R1.91 NC(=O)CCc1c[n]c[n]c1 Amb23571326 [0,1,0,0,0,0|3,0,0]=4 2328 B11R1.91 NC(=O)CCc1c[n]cc[n]1 Amb25321905 [0,1,0,0,0,0|3,0,0]=4 2329 B11R1.91 NC(=O)CCc1ccc[n][n]1 Amb25061349 [0,1,0,0,0,0|3,0,0]=4 2330 B11R1.91 NC(=O)CCc1ccccn1 Amb17399914 [0,1,0,0,0,0|2,0,0]=3 2331 B11R1.91 NC(=O)CCc1ccncc1 Amb10553007 [0,1,0,0,0,0|2,0,0]=3 2332 B11R1.91 NC(=O)CSc1ccccn1 Amb1292665 [0,1,0,0,0,0|3,0,0]=4 2333 B11R1.91 NC(=O)NCc1ccccc1 Amb2435042 [0,1,0,0,0,0|2,0,0]=3 2334 B11R1.91 NC(=O)NCc1ccccn1 Amb1050832 [0,1,0,0,0,0|3,0,0]=4 2335 B11R1.91 NC(=O)NCc1cccnc1 Amb2435041 [0,1,0,0,0,0|3,0,0]=4 2336 B11R1.91 NC(=O)NOc1ccccc1 Amb24726052 [0,1,0,0,0,0|3,0,0]=4 2337 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [0,1,0,0,0,0|1,0,0]=2 2338 B11R1.91 NC(=S)CCc1cccnc1 Amb17232623 [0,1,0,0,0,0|2,0,0]=3 2339 B11R1.91 NC(=S)CCc1ccncc1 Amb17400216 [0,1,0,0,0,0|2,0,0]=3 2340 B11R1.91 NC(=S)CNc1ccccc1 Amb17232624 [0,1,0,0,0,0|2,0,0]=3 2341 B11R1.91 NC(=S)COc1ccccc1 Amb1155418 [0,1,0,0,0,0|2,0,0]=3 2342 B11R1.91 NC(=S)NCc1ccccc1 Amb1207502 [0,1,0,0,0,0|2,0,0]=3 2343 B11R1.91 NC(=S)NCc1cccnc1 Amb2445857 [0,1,0,0,0,0|3,0,0]=4 2344 B11R1.91 NC(=S)SCc1ccccc1 Amb19999447 [0,1,0,0,0,0|2,0,0]=3 2345 B11R1.91 NC(=S)\C=C\c1ccccc1 Amb18105844 [0,1,0,0,0,0|1,0,2]=4 2346 B11R1.91 NC(=[NH2+])NCc1ccccc1 Amb22730911 [0,1,0,0,0,0|2,0,0]=3 2347 B11R1.91 NC(=[NH2+])SCc1ccccc1 Amb2407328 [0,1,0,0,0,0|2,0,0]=3 2348 B11R1.91 NC(N)=NCc1ccccc1 Amb19374239 [0,1,0,0,0,0|2,0,0]=3 2349 B11R1.91 NC(N)=NNc1ccccc1 Amb24726173 [0,1,0,0,0,0|3,0,0]=4 2350 B11R1.91 O=C(Cl)CCc1ccc[n]c1 Amb24077445 [0,1,0,0,0,0|3,0,0]=4 2351 B11R1.91 O=C(Cl)NCc1ccccc1 Amb25772230 [0,1,0,0,0,0|3,0,0]=4 2352 B11R1.91 O=C(S)CCc1ccccc1 Amb24733716 [0,1,0,0,0,0|2,0,0]=3 2353 B11R1.91 O=S(Cl)CCc1ccccc1 Amb25371638 [0,1,0,0,0,0|2,0,0]=3 2354 B11R1.91 OB(CCc1ccccc1)O Amb2456045 [0,1,0,0,0,0|2,0,0]=3 2355 B11R1.91 OB(O)CCc1c[n]ccc1 Amb25259201 [0,1,0,0,0,0|3,0,0]=4 2356 B11R1.91 OB(O)CCc1cccc[n]1 Amb24392967 [0,1,0,0,0,0|3,0,0]=4 2357 B11R1.91 OC(=O)CCc1ccccc1 Amb22366916 [0,1,0,0,0,0|2,0,0]=3 2358 B11R1.91 OC(=O)CCc1ccccn1 Amb1102533 [0,1,0,0,0,0|3,0,0]=4 2359 B11R1.91 OC(=O)CCc1cccnc1 Amb1214870 [0,1,0,0,0,0|3,0,0]=4 2360 B11R1.91 OC(=O)CCc1ccncc1 Amb1090849 [0,1,0,0,0,0|3,0,0]=4 2361 B11R1.91 OC(=O)COc1ccccc1 Amb1213413 [0,1,0,0,0,0|3,0,0]=4 2362 B11R1.91 OC(=O)COc1ccccc1 Amb22274444 [0,1,0,0,0,0|3,0,0]=4 2363 B11R1.91 OC(=O)CPc1ccccc1 Amb24487808 [0,1,0,0,0,0|3,0,0]=4 2364 B11R1.91 OC(=O)CSc1ccccc1 Amb1038999 [0,1,0,0,0,0|3,0,0]=4 2365 B11R1.91 OC(=O)NCc1ccccc1 Amb10603977 [0,1,0,0,0,0|3,0,0]=4 2366 B11R1.91 OC(=O)[13CH2][13CH2]c1ccccc1 Amb22336575 [0,1,0,0,0,0|2,0,0]=3 2367 B11R1.91 OC(O)CCc1ccccc1 Amb25829695 [0,1,0,0,0,0|2,0,0]=3 2368 B11R1.91 OS(=O)CCc1cc[n]cc1 Amb24546017 [0,1,0,0,0,0|3,0,0]=4 2369 B11R1.91 OS(=O)CNc1ccccc1 Amb25798133 [0,1,0,0,0,0|3,0,0]=4 2370 B11R1.91 O[13C](=O)[13CH2][13CH2]c1ccccc1 Amb22336771 [0,1,0,0,0,0|2,0,0]=3 2371 B11R1.91 SC(=S)CCc1ccccc1 Amb24439493 [0,1,0,0,0,0|2,0,0]=3 2372 B11R1.91 SC(=S)OCc1ccccc1 Amb10553124 [0,1,0,0,0,0|3,0,0]=4 2373 B11R1.91 SC(=S)OCc1ccccc1 Amb25721135 [0,1,0,0,0,0|3,0,0]=4 2374 B11R1.91 [O-]C(=O)CCc1ccccc1 Amb22233349 [0,1,0,0,0,0|2,0,0]=3 2375 B11R1.91 [O-]C(=O)CNc1ccccc1 Amb21520409 [0,1,0,0,0,0|3,0,0]=4 2376 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22167530 [0,1,0,0,0,0|3,0,0]=4 2377 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22734447 [0,1,0,0,0,0|3,0,0]=4 2378 B11R1.91 [O-]P(=O)OCc1ccccc1 Amb22461723 [0,1,0,0,0,0|2,1,0]=4 2379 B11R1.91 [O-]S(=O)NCc1ccccc1 Amb22641608 [0,1,0,0,0,0|3,0,0]=4 2380 B11R1.91 [O-][N+](=O)CCc1ccccc1 Amb16192705 [0,1,0,0,0,0|1,0,1]=3 2381 B11R1.91 [O-][N+](=O)CCc1ccccn1 Amb17399924 [0,1,0,0,0,0|2,0,1]=4 2382 B11R1.91 [O-][N+](=O)CCc1cccnc1 Amb17399925 [0,1,0,0,0,0|2,0,1]=4 2383 B11R1.91 [O-][N+](=O)CCc1ccncc1 Amb17399926 [0,1,0,0,0,0|2,0,1]=4 2384 B11R1.91 [O-][N+](=O)CSc1ccccc1 Amb25689622 [0,1,0,0,0,0|2,0,1]=4 2385 B9R0.18 C=CCCC(=C)CCCN Amb24444742 [0,0,1,0,0,0|1,0,2]=4 2386 B9R0.18 C=CCCC(=O)\C=C\C=C Amb24583790 [0,0,1,0,0,0|3,0,0]=4 2387 B9R0.18 CCCCC(=C)\C=C\C=O Amb18124519 [0,0,1,0,0,0|3,0,0]=4 2388 B9R0.18 CCCCC(=O)\C=C\C=C Amb25338203 [0,0,1,0,0,0|3,0,0]=4 2389 B9R0.40 C=C\C(\CCCCl)=C/C=O Amb24478178 [0,0,1,0,0,0|3,0,0]=4 2390 B9R0.45 CCCC\C=C/C=C/C=O Amb25770096 [0,0,1,0,0,0|3,0,0]=4 2391 B11R2.1 BN1CCc2ccccc12 Amb25180693 [0,0,0,1,0,0|1,0,0]=2 2392 B11R2.1 BrC1NCc2ccccc21 Amb22500144 [0,0,0,1,0,0|3,0,0]=4 2393 B11R2.1 Br[n]1[n]cc2ccccc12 Amb25311339 [0,0,0,1,0,0|2,0,1]=4 2394 B11R2.1 Br[n]1c[n]c2ccccc12 Amb25146351 [0,0,0,1,0,0|2,0,1]=4 2395 B11R2.1 C=C1CCc2ccccc21 Amb24458532 [0,0,0,1,0,0|2,0,0]=3 2396 B11R2.1 CC1=CCc2ccccc12 Amb17778909 [0,0,0,1,0,0|2,0,1]=4 2397 B11R2.1 CC1CCc2[n]cccc21 Amb24071595 [0,0,0,1,0,0|3,0,0]=4 2398 B11R2.1 CC1CCc2c[n]ccc21 Amb25691244 [0,0,0,1,0,0|3,0,0]=4 2399 B11R2.1 CC1CNc2ccccc21 Amb20241016 [0,0,0,1,0,0|3,0,0]=4 2400 B11R2.1 CC1CSc2ccccc12 Amb17939280 [0,0,0,1,0,0|3,0,0]=4 2401 B11R2.1 CC1NCc2ccccc21 Amb20623497 [0,0,0,1,0,0|3,0,0]=4 2402 B11R2.1 CC1SCc2ccccc21 Amb24092837 [0,0,0,1,0,0|3,0,0]=4 2403 B11R2.1 CN1CC[n+]2c1cccc2 Amb10565842 [0,0,0,1,0,0|2,0,0]=3 2404 B11R2.1 CN1CCc2c1cccc2 Amb15691717 [0,0,0,1,0,0|1,0,0]=2 2405 B11R2.1 CN1CCc2c[n]ccc12 Amb25836379 [0,0,0,1,0,0|2,0,0]=3 2406 B11R2.1 CN1CNc2ccccc12 Amb25260683 [0,0,0,1,0,0|2,0,0]=3 2407 B11R2.1 C[C@@H]1CNc2ccccc21 Amb25069285 [0,0,0,1,0,0|3,0,0]=4 2408 B11R2.1 C[C@@H]1NCc2ccccc21 Amb25353679 [0,0,0,1,0,0|3,0,0]=4 2409 B11R2.1 C[N+]1=CCc2c1cccc2 Amb10553677 [0,0,0,1,0,0|1,0,2]=4 2410 B11R2.1 C[SiH]1CCc2ccccc12 Amb24065297 [0,0,0,1,0,0|2,0,0]=3 2411 B11R2.1 ClC1CCc2[n]cccc21 Amb25321724 [0,0,0,1,0,0|3,0,0]=4 2412 B11R2.1 Cl[n]1c[n]c2ccccc12 Amb24351571 [0,0,0,1,0,0|2,0,1]=4 2413 B11R2.1 Cln1nnc2c1cccc2 Amb10067847 [0,0,0,1,0,0|3,0,0]=4 2414 B11R2.1 Cn1cnc2c1cccc2 Amb10562077 [0,0,0,1,0,0|2,0,1]=4 2415 B11R2.1 FC1CCc2ccccc21 Amb25311534 [0,0,0,1,0,0|2,0,0]=3 2416 B11R2.1 FC1CNc2ccccc21 Amb20242176 [0,0,0,1,0,0|3,0,0]=4 2417 B11R2.1 FC1NCc2ccccc21 Amb22504231 [0,0,0,1,0,0|3,0,0]=4 2418 B11R2.1 N=S1CNc2ccccc12 Amb24465157 [0,0,0,1,0,0|2,0,1]=4 2419 B11R2.1 NC1C=Cc2c1cccc2 Amb17470367 [0,0,0,1,0,0|1,0,2]=4 2420 B11R2.1 NC1CCc2[n]cccc21 Amb21858247 [0,0,0,1,0,0|2,0,0]=3 2421 B11R2.1 NC1CCc2[n]cccc21 Amb22490383 [0,0,0,1,0,0|2,0,0]=3 2422 B11R2.1 NC1CCc2c1cccc2 Amb1158023 [0,0,0,1,0,0|1,0,0]=2 2423 B11R2.1 NC1CCc2c1cccc2 Amb16233857 [0,0,0,1,0,0|1,0,0]=2 2424 B11R2.1 NC1CCc2c[n]c[n]c21 Amb18203097 [0,0,0,1,0,0|3,0,0]=4 2425 B11R2.1 NC1CCc2c[n]ccc21 Amb22900659 [0,0,0,1,0,0|2,0,0]=3 2426 B11R2.1 NC1CCc2cc[n]cc21 Amb24738463 [0,0,0,1,0,0|2,0,0]=3 2427 B11R2.1 NC1CCc2ccc[n]c21 Amb21858242 [0,0,0,1,0,0|2,0,0]=3 2428 B11R2.1 NC1CCc2ccc[n]c21 Amb22436792 [0,0,0,1,0,0|2,0,0]=3 2429 B11R2.1 NC1CCc2ccccc21 Amb24078253 [0,0,0,1,0,0|1,0,0]=2 2430 B11R2.1 NC1CNc2ccccc21 Amb24555894 [0,0,0,1,0,0|2,0,0]=3 2431 B11R2.1 NC1COc2[n]cccc21 Amb25324317 [0,0,0,1,0,0|3,0,0]=4 2432 B11R2.1 NC1COc2c1cccc2 Amb13951643 [0,0,0,1,0,0|2,0,0]=3 2433 B11R2.1 NC1COc2c1cccc2 Amb2383232 [0,0,0,1,0,0|2,0,0]=3 2434 B11R2.1 N[C@@H]1CCc2c1cccc2 Amb16233854 [0,0,0,1,0,0|1,0,0]=2 2435 B11R2.1 N[C@@H]1CCc2ccc[n]c21 Amb22748121 [0,0,0,1,0,0|2,0,0]=3 2436 B11R2.1 N[C@@H]1COc2ccccc21 Amb23440344 [0,0,0,1,0,0|2,0,0]=3 2437 B11R2.1 N[C@@H]1COc2ccccc21 Amb24426876 [0,0,0,1,0,0|2,0,0]=3 2438 B11R2.1 N[C@H]1CCc2cc[n]cc21 Amb24502269 [0,0,0,1,0,0|2,0,0]=3 2439 B11R2.1 N[C@H]1CCc2ccccc21 Amb20242239 [0,0,0,1,0,0|1,0,0]=2 2440 B11R2.1 N[C@H]1COc2ccccc21 Amb25147252 [0,0,0,1,0,0|2,0,0]=3 2441 B11R2.1 N[n]1[n][n]c2c[n]ccc12 Amb24064706 [0,0,0,1,0,0|3,0,0]=4 2442 B11R2.1 N[n]1c[n]c2c[n]ccc12 Amb24433302 [0,0,0,1,0,0|2,0,1]=4 2443 B11R2.1 N[n]1c[n]c2ccc[n]c12 Amb24481081 [0,0,0,1,0,0|2,0,1]=4 2444 B11R2.1 N[n]1ccc2[n]cccc12 Amb24692464 [0,0,0,1,0,0|1,0,2]=4 2445 B11R2.1 N[n]1ccc2ccc[n]c12 Amb20671415 [0,0,0,1,0,0|1,0,2]=4 2446 B11R2.1 Nc1[nH]cc2ccccc21 Amb24479060 [0,0,0,1,0,0|2,0,1]=4 2447 B11R2.1 Nc1[n][nH]c2ccccc21 Amb22491340 [0,0,0,1,0,0|3,0,0]=4 2448 B11R2.1 Nc1[n][nH]c2ccccc21 Amb22491341 [0,0,0,1,0,0|3,0,0]=4 2449 B11R2.1 Nc1c[s]c2ccccc21 Amb19957699 [0,0,0,1,0,0|2,0,1]=4 2450 B11R2.1 Nc1coc2ccccc21 Amb24371464 [0,0,0,1,0,0|2,0,1]=4 2451 B11R2.1 Nc1csc2c1cccc2 Amb13890519 [0,0,0,1,0,0|2,0,1]=4 2452 B11R2.1 Nc1n[nH]c2c1cccc2 Amb1103847 [0,0,0,1,0,0|3,0,0]=4 2453 B11R2.1 Nc1noc2c1cccc2 Amb1323334 [0,0,0,1,0,0|3,0,0]=4 2454 B11R2.1 Nc1nsc2c1cccc2 Amb1147286 [0,0,0,1,0,0|3,0,0]=4 2455 B11R2.1 Nc1o[n]c2ccccc21 Amb21857107 [0,0,0,1,0,0|3,0,0]=4 2456 B11R2.1 Nc1occ2ccccc21 Amb24463840 [0,0,0,1,0,0|2,0,1]=4 2457 B11R2.1 Nc1snc2c1cccc2 Amb1100345 [0,0,0,1,0,0|3,0,0]=4 2458 B11R2.1 Nn1ccc2c1cccc2 Amb16233739 [0,0,0,1,0,0|0,0,2]=3 2459 B11R2.1 Nn1nnc2c1cccc2 Amb1147316 [0,0,0,1,0,0|2,0,0]=3 2460 B11R2.1 O=C1CCc2[n]cccc21 Amb22275948 [0,0,0,1,0,0|3,0,0]=4 2461 B11R2.1 O=C1CCc2c1nccc2 Amb10602809 [0,0,0,1,0,0|3,0,0]=4 2462 B11R2.1 O=C1CCc2c[n]ccc21 Amb22235532 [0,0,0,1,0,0|3,0,0]=4 2463 B11R2.1 O=C1CCc2cc[n]cc21 Amb22491415 [0,0,0,1,0,0|3,0,0]=4 2464 B11R2.1 O=C1CNc2c1cccc2 Amb17593399 [0,0,0,1,0,0|3,0,0]=4 2465 B11R2.1 O=C1CNc2ccccc21 Amb22899450 [0,0,0,1,0,0|3,0,0]=4 2466 B11R2.1 O=C1COc2c1cccc2 Amb2383539 [0,0,0,1,0,0|3,0,0]=4 2467 B11R2.1 O=C1SCc2c1cccc2 Amb2421358 [0,0,0,1,0,0|3,0,0]=4 2468 B11R2.1 O=S1CNc2ccccc12 Amb24091032 [0,0,0,1,0,0|3,0,0]=4 2469 B11R2.1 OB1COc2ccccc21 Amb25132941 [0,0,0,1,0,0|3,0,0]=4 2470 B11R2.1 OB1OCc2c1cccc2 Amb1027843 [0,0,0,1,0,0|3,0,0]=4 2471 B11R2.1 OC1CCc2c1cccn2 Amb16231393 [0,0,0,1,0,0|3,0,0]=4 2472 B11R2.1 OC1CCc2ccc[n]c21 Amb19958431 [0,0,0,1,0,0|3,0,0]=4 2473 B11R2.1 OC1COc2ccccc21 Amb24104532 [0,0,0,1,0,0|3,0,0]=4 2474 B11R2.1 OC1OCc2ccccc21 Amb21858794 [0,0,0,1,0,0|3,0,0]=4 2475 B11R2.1 O[C@@H]1CCc2[n]cccc21 Amb24511690 [0,0,0,1,0,0|3,0,0]=4 2476 B11R2.1 O[C@@H]1CCc2c1cccc2 Amb13953023 [0,0,0,1,0,0|2,0,0]=3 2477 B11R2.1 O[C@@H]1CCc2ccc[n]c21 Amb22745812 [0,0,0,1,0,0|3,0,0]=4 2478 B11R2.1 O[C@H]1CCc2c1cccc2 Amb13953022 [0,0,0,1,0,0|2,0,0]=3 2479 B11R2.1 O[C@H]1CSc2ccccc21 Amb25356604 [0,0,0,1,0,0|3,0,0]=4 2480 B11R2.1 On1nnc2c1cccc2 Amb1151367 [0,0,0,1,0,0|3,0,0]=4 2481 B11R2.1 S=C1NCc2ccccc21 Amb24662530 [0,0,0,1,0,0|3,0,0]=4 2482 B11R2.1 SC1CCc2ccc[n]c21 Amb24071779 [0,0,0,1,0,0|3,0,0]=4 2483 B11R2.1 [NH3+]C1=NCc2c1cccc2 Amb2540026 [0,0,0,1,0,0|2,0,1]=4 2484 B11R2.1 [Na]n1nnc2c1cccc2 Amb10559304 [0,0,0,1,0,0|3,0,0]=4 2485 B11R2.1 [O-][N+]1=CCc2ccccc12 Amb25338460 [0,0,0,1,0,0|1,0,2]=4 2486 B11R2.1 [S-][n]1[n][n]c2ccccc12 Amb25756895 [0,0,0,1,0,0|3,0,0]=4 2487 B11R2.4 BrC1CC1c2ccc[n]c2 Amb24411334 [0,0,0,1,0,0|3,0,0]=4 2488 B11R2.4 BrC1CC1c2ccccc2 Amb23454923 [0,0,0,1,0,0|2,0,0]=3 2489 B11R2.4 Br[C@@H]1C[C@H]1c2cc[n]cc2 Amb24673977 [0,0,0,1,0,0|3,0,0]=4 2490 B11R2.4 Br[C@@H]1C[C@H]1c2cccc[n]2 Amb25840547 [0,0,0,1,0,0|3,0,0]=4 2491 B11R2.4 Br[C@@H]1C[C@H]1c2ccccc2 Amb25791511 [0,0,0,1,0,0|2,0,0]=3 2492 B11R2.4 C=C1CC1c2ccccc2 Amb22733871 [0,0,0,1,0,0|2,0,0]=3 2493 B11R2.4 CC1CC1c2ccccc2 Amb16236859 [0,0,0,1,0,0|2,0,0]=3 2494 B11R2.4 CC1NC1c2ccccc2 Amb24056775 [0,0,0,1,0,0|3,0,0]=4 2495 B11R2.4 CC1OC1c2ccccc2 Amb1129298 [0,0,0,1,0,0|3,0,0]=4 2496 B11R2.4 CN1NC1c2ccccc2 Amb25766657 [0,0,0,1,0,0|2,0,0]=3 2497 B11R2.4 CN1OC1c2cccc[n]2 Amb24586710 [0,0,0,1,0,0|3,0,0]=4 2498 B11R2.4 C[C@@H]1O[C@H]1c2ccccc2 Amb22367029 [0,0,0,1,0,0|3,0,0]=4 2499 B11R2.4 C[C@H]1O[C@@H]1c2ccccc2 Amb22224838 [0,0,0,1,0,0|3,0,0]=4 2500 B11R2.4 ClC1OC1c2ccccc2 Amb24372881 [0,0,0,1,0,0|3,0,0]=4 2501 B11R2.4 FC1CC1c2ccccc2 Amb25267358 [0,0,0,1,0,0|2,0,0]=3 2502 B11R2.4 F[C@@H]1C[C@@H]1c2ccccc2 Amb24600206 [0,0,0,1,0,0|2,0,0]=3 2503 B11R2.4 F[C@@H]1C[C@H]1c2ccccc2 Amb24538986 [0,0,0,1,0,0|2,0,0]=3 2504 B11R2.4 NC1CC1c2ccccc2 Amb19514914 [0,0,0,1,0,0|1,0,0]=2 2505 B11R2.4 NC1CC1c2ccccc2 Amb22729761 [0,0,0,1,0,0|1,0,0]=2 2506 B11R2.4 NC1OC1c2ccccc2 Amb25724793 [0,0,0,1,0,0|2,0,0]=3 2507 B11R2.4 NN1CC1c2ccccc2 Amb17593419 [0,0,0,1,0,0|0,0,0]=1 2508 B11R2.4 N[C@@H]1CC1c2ccccc2 Amb25077262 [0,0,0,1,0,0|1,0,0]=2 2509 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24183509 [0,0,0,1,0,0|1,0,0]=2 2510 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24579866 [0,0,0,1,0,0|1,0,0]=2 2511 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb22231696 [0,0,0,1,0,0|1,0,0]=2 2512 B11R2.4 N[C@H]1C[C@@H]1c2ccc[n]c2 Amb24604839 [0,0,0,1,0,0|2,0,0]=3 2513 B11R2.4 N[C@H]1C[C@@H]1c2ccccc2 Amb22735917 [0,0,0,1,0,0|1,0,0]=2 2514 B11R2.4 O=C1CC1c2ccccc2 Amb25689197 [0,0,0,1,0,0|2,0,0]=3 2515 B11R2.4 OC1CC1c2ccccc2 Amb17593413 [0,0,0,1,0,0|2,0,0]=3 2516 B11R2.4 O[C@H]1C[C@@H]1c2ccccc2 Amb17689138 [0,0,0,1,0,0|2,0,0]=3 2517 B11R2.20 B1OCc2ccccc2O1 Amb25185117 [0,0,0,1,0,0|3,0,0]=4 2518 B11R2.20 C1=Cc2c(CC1)cccc2 Amb1162229 [0,0,0,1,0,0|2,0,0]=3 2519 B11R2.20 C1=Cc2c(NC1)cccc2 Amb17593383 [0,0,0,1,0,0|1,0,2]=4 2520 B11R2.20 C1=Nc2c(CN1)cccc2 Amb10552960 [0,0,0,1,0,0|2,0,1]=4 2521 B11R2.20 C1=Nc2c(NC1)cccc2 Amb10174686 [0,0,0,1,0,0|2,0,1]=4 2522 B11R2.20 C1=Nc2c(SC1)cccc2 Amb10976509 [0,0,0,1,0,0|2,0,1]=4 2523 B11R2.20 C1C=CNc2ccccc21 Amb24700458 [0,0,0,1,0,0|1,0,1]=3 2524 B11R2.20 C1C=COc2ccccc21 Amb24715811 [0,0,0,1,0,0|2,0,1]=4 2525 B11R2.20 C1C=CSc2ccccc21 Amb25349026 [0,0,0,1,0,0|2,0,1]=4 2526 B11R2.20 C1CC=Cc2[n]cccc21 Amb25837322 [0,0,0,1,0,0|3,0,0]=4 2527 B11R2.20 C1CC=Cc2c[n]ccc21 Amb25064667 [0,0,0,1,0,0|3,0,0]=4 2528 B11R2.20 C1CCCc2ccccc21 Amb22351371 [0,0,0,1,0,0|2,0,0]=3 2529 B11R2.20 C1CCN2C=CC=CC2=N1 Amb22055140 [0,0,0,1,0,0|2,0,1]=4 2530 B11R2.20 C1CCNc2[n]c[n]cc21 Amb18832493 [0,0,0,1,0,0|3,0,0]=4 2531 B11R2.20 C1CCNc2[n]cc[n]c21 Amb18832490 [0,0,0,1,0,0|3,0,0]=4 2532 B11R2.20 C1CCNc2c[n][n]cc21 Amb25189782 [0,0,0,1,0,0|3,0,0]=4 2533 B11R2.20 C1CCNc2c[n]c[n]c21 Amb18203099 [0,0,0,1,0,0|3,0,0]=4 2534 B11R2.20 C1CCNc2c[n]ccc21 Amb21864834 [0,0,0,1,0,0|2,0,0]=3 2535 B11R2.20 C1CCNc2c[n]ccc21 Amb22491315 [0,0,0,1,0,0|2,0,0]=3 2536 B11R2.20 C1CCNc2c[n]ccc21 Amb22751690 [0,0,0,1,0,0|2,0,0]=3 2537 B11R2.20 C1CCOc2[n]cccc21 Amb22753924 [0,0,0,1,0,0|3,0,0]=4 2538 B11R2.20 C1CCc2c(C1)nccc2 Amb2390042 [0,0,0,1,0,0|3,0,0]=4 2539 B11R2.20 C1CCc2c(N1)cccc2 Amb10072811 [0,0,0,1,0,0|1,0,0]=2 2540 B11R2.20 C1CCc2c(N1)cccc2 Amb1869492 [0,0,0,1,0,0|1,0,0]=2 2541 B11R2.20 C1CCc2c(S1)cccc2 Amb2237019 [0,0,0,1,0,0|2,0,0]=3 2542 B11R2.20 C1CNNc2ccccc21 Amb24564127 [0,0,0,1,0,0|0,0,0]=1 2543 B11R2.20 C1CNc2c(C1)cccn2 Amb15692065 [0,0,0,1,0,0|2,0,0]=3 2544 B11R2.20 C1CNc2c(N1)nccc2 Amb10603351 [0,0,0,1,0,0|3,0,0]=4 2545 B11R2.20 C1CNc2c(O1)cccc2 Amb2371970 [0,0,0,1,0,0|2,0,0]=3 2546 B11R2.20 C1CNc2c(S1)cccc2 Amb1104964 [0,0,0,1,0,0|2,0,0]=3 2547 B11R2.20 C1CNc2c[n]ccc2N1 Amb20622788 [0,0,0,1,0,0|3,0,0]=4 2548 B11R2.20 C1CONc2[n]c[n]cc21 Amb24626072 [0,0,0,1,0,0|3,0,0]=4 2549 B11R2.20 C1COc2c(C1)cncc2 Amb13889664 [0,0,0,1,0,0|3,0,0]=4 2550 B11R2.20 C1COc2c(C1)nccc2 Amb13889663 [0,0,0,1,0,0|3,0,0]=4 2551 B11R2.20 C1COc2c(N1)cccn2 Amb13890253 [0,0,0,1,0,0|3,0,0]=4 2552 B11R2.20 C1COc2c(N1)ccnc2 Amb13890252 [0,0,0,1,0,0|3,0,0]=4 2553 B11R2.20 C1COc2cc[n]cc2N1 Amb20622566 [0,0,0,1,0,0|3,0,0]=4 2554 B11R2.20 C1COc2ccccc2N1 Amb18090793 [0,0,0,1,0,0|2,0,0]=3 2555 B11R2.20 C1CSc2[n]cccc2N1 Amb19148121 [0,0,0,1,0,0|3,0,0]=4 2556 B11R2.20 C1CSc2cc[n]cc2N1 Amb20667582 [0,0,0,1,0,0|3,0,0]=4 2557 B11R2.20 C1CSc2ccccc2O1 Amb19374957 [0,0,0,1,0,0|3,0,0]=4 2558 B11R2.20 C1C[NH+]=Cc2ccccc21 Amb23569648 [0,0,0,1,0,0|1,0,1]=3 2559 B11R2.20 C1N=CNc2[n]cccc21 Amb25760705 [0,0,0,1,0,0|3,0,0]=4 2560 B11R2.20 C1N=CNc2ccccc21 Amb19374085 [0,0,0,1,0,0|2,0,0]=3 2561 B11R2.20 C1NCCc2[n]c[n]cc21 Amb19515826 [0,0,0,1,0,0|3,0,0]=4 2562 B11R2.20 C1NCCc2[n]c[n]cc21 Amb19957549 [0,0,0,1,0,0|3,0,0]=4 2563 B11R2.20 C1NCCc2[n]c[n]cc21 Amb22728973 [0,0,0,1,0,0|3,0,0]=4 2564 B11R2.20 C1NCCc2[n]cc[n]c21 Amb24081290 [0,0,0,1,0,0|3,0,0]=4 2565 B11R2.20 C1NCCc2[n]cccc21 Amb19373278 [0,0,0,1,0,0|2,0,0]=3 2566 B11R2.20 C1NCCc2[n]cccc21 Amb19958501 [0,0,0,1,0,0|2,0,0]=3 2567 B11R2.20 C1NCCc2[n]cccc21 Amb22002369 [0,0,0,1,0,0|2,0,0]=3 2568 B11R2.20 C1NCCc2c[n]c[n]c21 Amb18832496 [0,0,0,1,0,0|3,0,0]=4 2569 B11R2.20 C1NCCc2c[n]c[n]c21 Amb22494240 [0,0,0,1,0,0|3,0,0]=4 2570 B11R2.20 C1NCCc2c[n]ccc21 Amb18124435 [0,0,0,1,0,0|2,0,0]=3 2571 B11R2.20 C1NCCc2c[n]ccc21 Amb20075877 [0,0,0,1,0,0|2,0,0]=3 2572 B11R2.20 C1NCCc2c[n]ccc21 Amb22752076 [0,0,0,1,0,0|2,0,0]=3 2573 B11R2.20 C1NCCc2cc[n]cc21 Amb19958148 [0,0,0,1,0,0|2,0,0]=3 2574 B11R2.20 C1NCCc2cc[n]cc21 Amb21858409 [0,0,0,1,0,0|2,0,0]=3 2575 B11R2.20 C1NCCc2ccc[n]c21 Amb21858385 [0,0,0,1,0,0|2,0,0]=3 2576 B11R2.20 C1NCCc2ccc[n]c21 Amb22436767 [0,0,0,1,0,0|2,0,0]=3 2577 B11R2.20 C1NCNc2[n]cccc21 Amb24746456 [0,0,0,1,0,0|3,0,0]=4 2578 B11R2.20 C1NCNc2ccccc21 Amb25147572 [0,0,0,1,0,0|2,0,0]=3 2579 B11R2.20 C1NCOc2ccccc21 Amb24087478 [0,0,0,1,0,0|2,0,0]=3 2580 B11R2.20 C1NCc2c(C1)nccc2 Amb10608993 [0,0,0,1,0,0|2,0,0]=3 2581 B11R2.20 C1NCc2c(C1)ncnc2 Amb17072186 [0,0,0,1,0,0|3,0,0]=4 2582 B11R2.20 C1NNCc2ccccc21 Amb22497223 [0,0,0,1,0,0|2,0,0]=3 2583 B11R2.20 C1Nc2ccccc2C=N1 Amb25147432 [0,0,0,1,0,0|2,0,1]=4 2584 B11R2.20 C1OCCc2ccc[n]c21 Amb24070918 [0,0,0,1,0,0|3,0,0]=4 2585 B11R2.20 C1OCOc2ccccc21 Amb24066080 [0,0,0,1,0,0|3,0,0]=4 2586 B11R2.20 C1ON=Cc2ccccc21 Amb25217160 [0,0,0,1,0,0|2,0,1]=4 2587 B11R2.20 C1Oc2ccccc2C=C1 Amb17844055 [0,0,0,1,0,0|3,0,0]=4 2588 B11R2.20 C1PCNc2ccccc21 Amb25737691 [0,0,0,1,0,0|2,0,0]=3 2589 B11R2.20 C1SC=Cc2ccccc21 Amb25231190 [0,0,0,1,0,0|3,0,0]=4 2590 B11R2.20 C1SCCc2ccccc21 Amb24085482 [0,0,0,1,0,0|2,0,0]=3 2591 B11R2.20 C1SSCc2ccccc21 Amb25839327 [0,0,0,1,0,0|3,0,0]=4 2592 B11R2.20 C=1NNc2[n]cccc2N1 Amb25116885 [0,0,0,1,0,0|2,0,1]=4 2593 B11R2.20 C=1Nc2ccccc2NN1 Amb24479128 [0,0,0,1,0,0|1,0,2]=4 2594 B11R2.20 N1CCc2c(C1)cccc2 Amb2383348 [0,0,0,1,0,0|1,0,0]=2 2595 B11R2.20 c1[n]ccc2C=CNNc21 Amb24461248 [0,0,0,1,0,0|1,0,2]=4 2596 B11R2.20 c1[n]ccc2N=CNNc21 Amb25254888 [0,0,0,1,0,0|2,0,1]=4 2597 B11R2.20 c1ccc2c(c1)C=NCC2 Amb10603654 [0,0,0,1,0,0|1,0,1]=3 2598 B11R2.20 c1ccc2c(c1)C=[NH+]CC2 Amb10553686 [0,0,0,1,0,0|1,0,1]=3 2599 B11R2.20 c1cccc2NC=CNc21 Amb25217865 [0,0,0,1,0,0|2,0,1]=4 2600 B11R2.238 C(C1CC1)c2ccccc2 Amb22490220 [0,0,0,1,0,0|2,0,0]=3 2601 B11R2.238 C1CC1C[n+]2ccccc2 Amb10554474 [0,0,0,1,0,0|3,0,0]=4 2602 B11R2.238 C1CC1C[n+]2ccccc2 Amb10554486 [0,0,0,1,0,0|3,0,0]=4 2603 B11R2.238 C1CC1Nc2ccccc2 Amb18270529 [0,0,0,1,0,0|3,0,0]=4 2604 B11R2.238 C1N=C1Cc2ccccc2 Amb22498074 [0,0,0,1,0,0|1,0,2]=4 2605 B11R2.238 C1OC1Cc2cc[n]cc2 Amb24677560 [0,0,0,1,0,0|3,0,0]=4 2606 B11R2.238 C1OC1Cc2cccc[n]2 Amb24649901 [0,0,0,1,0,0|3,0,0]=4 2607 B11R2.238 N1CC1Cc2ccccc2 Amb10072810 [0,0,0,1,0,0|1,0,0]=2 2608 B11R2.238 N1C[C@@H]1Cc2ccccc2 Amb15690958 [0,0,0,1,0,0|1,0,0]=2 2609 B11R2.238 N1C[C@H]1Cc2ccccc2 Amb10603217 [0,0,0,1,0,0|1,0,0]=2 2610 B11R2.239 C1CC(N1)c2cc[n]c[n]2 Amb25274242 [0,0,0,1,0,0|3,0,0]=4 2611 B11R2.239 C1CC(N1)c2ccc[n][n]2 Amb25229662 [0,0,0,1,0,0|3,0,0]=4 2612 B11R2.239 C1CC(N1)c2cccc[n]2 Amb25849292 [0,0,0,1,0,0|2,0,0]=3 2613 B11R2.239 C1CC(O1)c2ccccc2 Amb22298601 [0,0,0,1,0,0|2,0,0]=3 2614 B11R2.239 C1CCC1c2cc[n]cc2 Amb22898826 [0,0,0,1,0,0|3,0,0]=4 2615 B11R2.239 C1C[C@@H](N1)c2c[n]cc[n]2 Amb24657231 [0,0,0,1,0,0|3,0,0]=4 2616 B11R2.239 C1C[C@@H](N1)c2cc[n]cc2 Amb25761359 [0,0,0,1,0,0|2,0,0]=3 2617 B11R2.239 C1C[C@@H](O1)c2ccccc2 Amb24479262 [0,0,0,1,0,0|2,0,0]=3 2618 B11R2.239 C1C[C@H](N1)c2c[n]cc[n]2 Amb25791186 [0,0,0,1,0,0|3,0,0]=4 2619 B11R2.239 C1C[C@H](N1)c2cccc[n]2 Amb24732378 [0,0,0,1,0,0|2,0,0]=3 2620 B11R2.239 C1C[C@H](O1)c2ccccc2 Amb25721124 [0,0,0,1,0,0|2,0,0]=3 2621 B11R2.239 C1NCC1c2c[n]ccc2 Amb19516797 [0,0,0,1,0,0|2,0,0]=3 2622 B11R2.239 C1NCC1c2c[n]ccc2 Amb20620349 [0,0,0,1,0,0|2,0,0]=3 2623 B11R2.239 C1NCC1c2cc[n]c[n]2 Amb23401381 [0,0,0,1,0,0|3,0,0]=4 2624 B11R2.239 C1NCC1c2cc[n]cc2 Amb19516821 [0,0,0,1,0,0|2,0,0]=3 2625 B11R2.239 C1NCC1c2cc[n]cc2 Amb20620350 [0,0,0,1,0,0|2,0,0]=3 2626 B11R2.239 C1NCC1c2cc[n]cc2 Amb22749029 [0,0,0,1,0,0|2,0,0]=3 2627 B11R2.239 C1NCC1c2ccc[n][n]2 Amb25786757 [0,0,0,1,0,0|3,0,0]=4 2628 B11R2.239 C1NCC1c2cccc[n]2 Amb19516701 [0,0,0,1,0,0|2,0,0]=3 2629 B11R2.239 C1OCC1c2cccc[n]2 Amb24100566 [0,0,0,1,0,0|3,0,0]=4 2630 B11R2.239 C1OCC1c2ccccc2 Amb21963191 [0,0,0,1,0,0|2,0,0]=3 2631 B11R2.239 N1CC(C1)c2ccccc2 Amb10603719 [0,0,0,1,0,0|1,0,0]=2 2632 B11R2.239 N1CC(C1)c2ccccn2 Amb15695195 [0,0,0,1,0,0|2,0,0]=3 2633 B11R2.988 C=CC1Cc2ccccc12 Amb17778869 [0,0,0,1,0,0|2,0,0]=3 2634 B11R2.988 CCC1Cc2ccccc21 Amb24647895 [0,0,0,1,0,0|2,0,0]=3 2635 B11R2.988 COC1Cc2ccccc21 Amb24455687 [0,0,0,1,0,0|2,0,0]=3 2636 B11R2.988 ClCC1Cc2ccccc21 Amb24588110 [0,0,0,1,0,0|2,0,0]=3 2637 B11R2.988 ICC1Cc2ccccc21 Amb24354685 [0,0,0,1,0,0|2,0,0]=3 2638 B11R2.988 NCC1=Cc2ccccc21 Amb24596883 [0,0,0,1,0,0|1,0,2]=4 2639 B11R2.988 NCC1Cc2c1cccc2 Amb10609227 [0,0,0,1,0,0|1,0,0]=2 2640 B11R2.988 NC[C@@H]1Cc2ccccc21 Amb24182000 [0,0,0,1,0,0|1,0,0]=2 2641 B11R2.988 NNC1Cc2ccccc21 Amb25326415 [0,0,0,1,0,0|0,0,0]=1 2642 B11R2.988 O=CC1Cc2c1cccc2 Amb16230472 [0,0,0,1,0,0|2,0,0]=3 2643 B9R1.12 BrCCCc1ccco1 Amb17104550 [0,0,0,0,1,0|3,0,0]=4 2644 B9R1.12 BrCCCc1cccs1 Amb17104551 [0,0,0,0,1,0|3,0,0]=4 2645 B9R1.12 BrCCCc1cocc1 Amb24593084 [0,0,0,0,1,0|3,0,0]=4 2646 B9R1.12 BrCCCn1cccc1 Amb10608810 [0,0,0,0,1,0|3,0,0]=4 2647 B9R1.12 C=CCCC=1C=CCC1 Amb24596038 [0,0,0,0,1,0|2,0,1]=4 2648 B9R1.12 C=CCCc1ccc[nH]1 Amb25858739 [0,0,0,0,1,0|3,0,0]=4 2649 B9R1.12 CCCCC1C=CC=C1 Amb21962871 [0,0,0,0,1,0|2,0,1]=4 2650 B9R1.12 CCCCc1c[nH]cc1 Amb25771565 [0,0,0,0,1,0|3,0,0]=4 2651 B9R1.12 CCCCc1ccco1 Amb10070290 [0,0,0,0,1,0|3,0,0]=4 2652 B9R1.12 CCCCc1ccsc1 Amb17779303 [0,0,0,0,1,0|3,0,0]=4 2653 B9R1.12 CNCCC=1CC=CC1 Amb25755843 [0,0,0,0,1,0|1,0,1]=3 2654 B9R1.12 CNCC[n]1c[n]cc1 Amb21954316 [0,0,0,0,1,0|3,0,0]=4 2655 B9R1.12 CNCC[n]1c[n]cc1 Amb22586829 [0,0,0,0,1,0|3,0,0]=4 2656 B9R1.12 CNCC[n]1ccc[n]1 Amb18299424 [0,0,0,0,1,0|3,0,0]=4 2657 B9R1.12 CNCC[n]1cccc1 Amb18994357 [0,0,0,0,1,0|2,0,0]=3 2658 B9R1.12 CNCCc1[nH]cc[n]1 Amb18222179 [0,0,0,0,1,0|3,0,0]=4 2659 B9R1.12 CNCCc1[n]cco1 Amb18222315 [0,0,0,0,1,0|3,0,0]=4 2660 B9R1.12 CNCCc1c[nH][n]c1 Amb22587664 [0,0,0,0,1,0|3,0,0]=4 2661 B9R1.12 CNCCc1c[nH]c[n]1 Amb22367617 [0,0,0,0,1,0|3,0,0]=4 2662 B9R1.12 CNCCc1c[nH]c[n]1 Amb23603746 [0,0,0,0,1,0|3,0,0]=4 2663 B9R1.12 CNCCc1c[nH]cc1 Amb18062858 [0,0,0,0,1,0|2,0,0]=3 2664 B9R1.12 CNCCc1c[nH]nc1 Amb1995188 [0,0,0,0,1,0|3,0,0]=4 2665 B9R1.12 CNCCc1ccc[s]1 Amb21959880 [0,0,0,0,1,0|2,0,0]=3 2666 B9R1.12 CNCCc1ccco1 Amb17399803 [0,0,0,0,1,0|2,0,0]=3 2667 B9R1.12 CNCCc1cco[n]1 Amb25078186 [0,0,0,0,1,0|3,0,0]=4 2668 B9R1.12 CNCCc1cocc1 Amb25682417 [0,0,0,0,1,0|2,0,0]=3 2669 B9R1.12 COCCc1ccc[s]1 Amb25147094 [0,0,0,0,1,0|3,0,0]=4 2670 B9R1.12 COCCc1ccco1 Amb25147016 [0,0,0,0,1,0|3,0,0]=4 2671 B9R1.12 CSCC[n]1cccc1 Amb24501482 [0,0,0,0,1,0|3,0,0]=4 2672 B9R1.12 CSCCc1c[s]cc1 Amb24394930 [0,0,0,0,1,0|3,0,0]=4 2673 B9R1.12 ClCCC[n]1cccc1 Amb21912596 [0,0,0,0,1,0|3,0,0]=4 2674 B9R1.12 ClCCCc1c[s]cc1 Amb18797934 [0,0,0,0,1,0|3,0,0]=4 2675 B9R1.12 ClCCCc1ccc[nH]1 Amb24502221 [0,0,0,0,1,0|3,0,0]=4 2676 B9R1.12 ClCCCc1cccs1 Amb17104524 [0,0,0,0,1,0|3,0,0]=4 2677 B9R1.12 ClCCCc1cocc1 Amb25720433 [0,0,0,0,1,0|3,0,0]=4 2678 B9R1.12 ClNCCc1c[nH]c[n]1 Amb24684146 [0,0,0,0,1,0|3,0,0]=4 2679 B9R1.12 FCCC[n]1cccc1 Amb24659970 [0,0,0,0,1,0|3,0,0]=4 2680 B9R1.12 N#CCCc1c[nH]cc1 Amb18221693 [0,0,0,0,1,0|2,0,1]=4 2681 B9R1.12 N#CCCc1c[s]cc1 Amb24524148 [0,0,0,0,1,0|2,0,1]=4 2682 B9R1.12 N#CCCc1ccc[nH]1 Amb24424952 [0,0,0,0,1,0|2,0,1]=4 2683 B9R1.12 N#CCCc1ccco1 Amb20623925 [0,0,0,0,1,0|2,0,1]=4 2684 B9R1.12 N#CCCc1cccs1 Amb17226709 [0,0,0,0,1,0|2,0,1]=4 2685 B9R1.12 N#CCCc1cocc1 Amb25146999 [0,0,0,0,1,0|2,0,1]=4 2686 B9R1.12 NCCCc1[nH]cc[n]1 Amb21961564 [0,0,0,0,1,0|3,0,0]=4 2687 B9R1.12 NCCCc1[n]cc[s]1 Amb19351883 [0,0,0,0,1,0|3,0,0]=4 2688 B9R1.12 NCCCc1[n]cco1 Amb18061835 [0,0,0,0,1,0|3,0,0]=4 2689 B9R1.12 NCCCc1c[nH][n]c1 Amb21955238 [0,0,0,0,1,0|3,0,0]=4 2690 B9R1.12 NCCCc1c[nH][n]c1 Amb24053252 [0,0,0,0,1,0|3,0,0]=4 2691 B9R1.12 NCCCc1c[nH]c[n]1 Amb18642332 [0,0,0,0,1,0|3,0,0]=4 2692 B9R1.12 NCCCc1c[nH]cc1 Amb18560456 [0,0,0,0,1,0|2,0,0]=3 2693 B9R1.12 NCCCc1c[nH]nc1 Amb1995198 [0,0,0,0,1,0|3,0,0]=4 2694 B9R1.12 NCCCc1c[n]c[s]1 Amb18831614 [0,0,0,0,1,0|3,0,0]=4 2695 B9R1.12 NCCCc1c[s]c[n]1 Amb18523794 [0,0,0,0,1,0|3,0,0]=4 2696 B9R1.12 NCCCc1c[s]cc1 Amb19373237 [0,0,0,0,1,0|2,0,0]=3 2697 B9R1.12 NCCCc1cc[nH][n]1 Amb18832795 [0,0,0,0,1,0|3,0,0]=4 2698 B9R1.12 NCCCc1cc[n][nH]1 Amb24117990 [0,0,0,0,1,0|3,0,0]=4 2699 B9R1.12 NCCCc1cc[n][s]1 Amb25367273 [0,0,0,0,1,0|3,0,0]=4 2700 B9R1.12 NCCCc1cc[n]o1 Amb18832760 [0,0,0,0,1,0|3,0,0]=4 2701 B9R1.12 NCCCc1cc[s][n]1 Amb18202563 [0,0,0,0,1,0|3,0,0]=4 2702 B9R1.12 NCCCc1ccc[nH]1 Amb25076791 [0,0,0,0,1,0|2,0,0]=3 2703 B9R1.12 NCCCc1ccc[s]1 Amb24094214 [0,0,0,0,1,0|2,0,0]=3 2704 B9R1.12 NCCCc1coc[n]1 Amb18832743 [0,0,0,0,1,0|3,0,0]=4 2705 B9R1.12 NCCCc1cocc1 Amb25789662 [0,0,0,0,1,0|2,0,0]=3 2706 B9R1.12 NCCCn1cccn1 Amb10549338 [0,0,0,0,1,0|3,0,0]=4 2707 B9R1.12 NCCCn1cccn1 Amb1136640 [0,0,0,0,1,0|3,0,0]=4 2708 B9R1.12 NCCNc1c[s]cc1 Amb25794987 [0,0,0,0,1,0|3,0,0]=4 2709 B9R1.12 NCCNc1ccc[s]1 Amb18299161 [0,0,0,0,1,0|3,0,0]=4 2710 B9R1.12 NNCC[n]1c[n]c[n]1 Amb24712157 [0,0,0,0,1,0|3,0,0]=4 2711 B9R1.12 NNCC[n]1ccc[n]1 Amb24660738 [0,0,0,0,1,0|2,0,0]=3 2712 B9R1.12 NNCCc1c[s][n][n]1 Amb25319149 [0,0,0,0,1,0|3,0,0]=4 2713 B9R1.12 NNCCc1cocc1 Amb25100152 [0,0,0,0,1,0|1,0,0]=2 2714 B9R1.12 NOCC[n]1c[n]cc1 Amb25116073 [0,0,0,0,1,0|3,0,0]=4 2715 B9R1.12 NOCCc1c[s]cc1 Amb25799465 [0,0,0,0,1,0|2,0,0]=3 2716 B9R1.12 NOCCc1ccc[nH]1 Amb25280155 [0,0,0,0,1,0|2,0,0]=3 2717 B9R1.12 NOCCc1ccc[s]1 Amb25130652 [0,0,0,0,1,0|2,0,0]=3 2718 B9R1.12 NOCCc1ccco1 Amb25208726 [0,0,0,0,1,0|2,0,0]=3 2719 B9R1.12 O=CCC[n]1cccc1 Amb24062842 [0,0,0,0,1,0|3,0,0]=4 2720 B9R1.12 O=CCCc1ccc[nH]1 Amb24760290 [0,0,0,0,1,0|3,0,0]=4 2721 B9R1.12 O=CCCc1ccco1 Amb17081672 [0,0,0,0,1,0|3,0,0]=4 2722 B9R1.12 O=CCCc1cccs1 Amb17081673 [0,0,0,0,1,0|3,0,0]=4 2723 B9R1.12 OCCCC=1CC=CC1 Amb25851384 [0,0,0,0,1,0|2,0,1]=4 2724 B9R1.12 OCCCc1c[nH]cc1 Amb18222128 [0,0,0,0,1,0|3,0,0]=4 2725 B9R1.12 OCCCc1ccc[nH]1 Amb24428704 [0,0,0,0,1,0|3,0,0]=4 2726 B9R1.12 OCCCc1cccs1 Amb17089493 [0,0,0,0,1,0|3,0,0]=4 2727 B9R1.12 OCCCc1cscc1 Amb17605794 [0,0,0,0,1,0|3,0,0]=4 2728 B9R1.12 OCCCn1cccc1 Amb17593298 [0,0,0,0,1,0|3,0,0]=4 2729 B9R1.12 ONCCc1c[n]c[nH]1 Amb25178668 [0,0,0,0,1,0|3,0,0]=4 2730 B9R1.12 SCCCc1c[s]cc1 Amb25180709 [0,0,0,0,1,0|3,0,0]=4 2731 B9R1.12 SCCCc1ccc[nH]1 Amb24722505 [0,0,0,0,1,0|3,0,0]=4 2732 B9R1.12 SCCCc1ccco1 Amb17399874 [0,0,0,0,1,0|3,0,0]=4 2733 B9R1.12 SCCCc1cccs1 Amb17400036 [0,0,0,0,1,0|3,0,0]=4 2734 B9R1.12 [C-]#[N+]CCc1ccco1 Amb24743086 [0,0,0,0,1,0|2,0,1]=4 2735 B11R1.203 NCCCC1=CNC=CC=C1 Amb25114442 [0,0,0,0,0,1|1,0,0]=2 2736 B11R1.203 OCCOC=1C=CNC=CC1 Amb24069979 [0,0,0,0,0,1|3,0,0]=4 2737 B8R0.1 CCCC(=O)\C=C\C=C Amb25233730 [1,0,1,0,0,0|2,0,0]=4 2738 B8R0.4 C=CCC\C=C\CCN Amb25746401 [1,0,1,0,0,0|0,0,2]=4 2739 B8R0.4 C=C\C=C\CCCCN Amb18642357 [1,0,1,0,0,0|0,0,2]=4 2740 B8R0.4 CCC\C=C\C=C\C=C Amb22641675 [1,0,1,0,0,0|1,0,0]=3 2741 B8R0.4 C\C=C\C=CCCCN Amb25261065 [1,0,1,0,0,0|0,0,2]=4 2742 B8R0.11 C=CC(=CCCN)C=C Amb25368455 [1,0,1,0,0,0|1,0,1]=4 2743 B8R0.22 CC=C(CCN)\C=C\C Amb25679269 [1,0,1,0,0,0|0,0,2]=4 2744 B8R1.2 BrC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367404 [2,0,0,0,0,0|1,0,0]=3 2745 B8R1.2 BrC[13c]1ccccc1 Amb22367396 [2,0,0,0,0,0|1,0,0]=3 2746 B8R1.2 BrCc1cc[n]cc1 Amb22753071 [2,0,0,0,0,0|2,0,0]=4 2747 B8R1.2 BrCc1cccc[n]1 Amb22751621 [2,0,0,0,0,0|2,0,0]=4 2748 B8R1.2 Br[13CH2]c1ccccc1 Amb22366910 [2,0,0,0,0,0|1,0,0]=3 2749 B8R1.2 Br[Hg]c1ccccc1 Amb22369231 [2,0,0,0,0,0|2,0,0]=4 2750 B8R1.2 C#[13C]c1ccccc1 Amb22367126 [2,0,0,0,0,0|0,0,2]=4 2751 B8R1.2 C=Cc1ccccc1 Amb22337033 [2,0,0,0,0,0|0,0,2]=4 2752 B8R1.2 C=Cc1ccccc1 Amb22337871 [2,0,0,0,0,0|0,0,2]=4 2753 B8R1.2 C=Cc1ccccc1 Amb22337937 [2,0,0,0,0,0|0,0,2]=4 2754 B8R1.2 C=Cc1ccccc1 Amb22338204 [2,0,0,0,0,0|0,0,2]=4 2755 B8R1.2 C=Cc1ccccc1 Amb22338475 [2,0,0,0,0,0|0,0,2]=4 2756 B8R1.2 C=Cc1ccccc1 Amb22351316 [2,0,0,0,0,0|0,0,2]=4 2757 B8R1.2 C=Cc1ccccc1 Amb22731028 [2,0,0,0,0,0|0,0,2]=4 2758 B8R1.2 C=Cc1ccccc1 Amb22733123 [2,0,0,0,0,0|0,0,2]=4 2759 B8R1.2 C=Nc1ccccc1 Amb24605672 [2,0,0,0,0,0|1,0,1]=4 2760 B8R1.2 CCC1=CCC=CN1 Amb24524490 [2,0,0,0,0,0|1,0,1]=4 2761 B8R1.2 CCC=1CC=CCC1 Amb22227940 [2,0,0,0,0,0|0,0,2]=4 2762 B8R1.2 CC[n+]1ccccc1 Amb22739693 [2,0,0,0,0,0|1,0,0]=3 2763 B8R1.2 CCc1[n]ccc[n]1 Amb24095641 [2,0,0,0,0,0|2,0,0]=4 2764 B8R1.2 CCc1c[n]c[n]c1 Amb24097063 [2,0,0,0,0,0|2,0,0]=4 2765 B8R1.2 CCc1c[n]cc[n]1 Amb20620291 [2,0,0,0,0,0|2,0,0]=4 2766 B8R1.2 CCc1cc[n]c[n]1 Amb20242304 [2,0,0,0,0,0|2,0,0]=4 2767 B8R1.2 CCc1ccccc1 Amb22336270 [2,0,0,0,0,0|0,0,0]=2 2768 B8R1.2 CCc1ccccc1 Amb22366965 [2,0,0,0,0,0|0,0,0]=2 2769 B8R1.2 CCc1ccccc1 Amb2447474 [2,0,0,0,0,0|0,0,0]=2 2770 B8R1.2 CO[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17608460 [2,0,0,0,0,0|1,0,0]=3 2771 B8R1.2 CO[13c]1ccccc1 Amb22362658 [2,0,0,0,0,0|1,0,0]=3 2772 B8R1.2 CO[n+]1ccccc1 Amb10552605 [2,0,0,0,0,0|2,0,0]=4 2773 B8R1.2 COc1cc[n]cc1 Amb24079672 [2,0,0,0,0,0|2,0,0]=4 2774 B8R1.2 COc1cccnc1 Amb10573360 [2,0,0,0,0,0|2,0,0]=4 2775 B8R1.2 CPc1ccccc1 Amb25341327 [2,0,0,0,0,0|1,0,0]=3 2776 B8R1.2 CSc1c[n]ccc1 Amb24087396 [2,0,0,0,0,0|2,0,0]=4 2777 B8R1.2 CSc1cc[n]cc1 Amb24103013 [2,0,0,0,0,0|2,0,0]=4 2778 B8R1.2 CSc1cccc[n]1 Amb24081200 [2,0,0,0,0,0|2,0,0]=4 2779 B8R1.2 C[13CH2]c1ccccc1 Amb22362696 [2,0,0,0,0,0|0,0,0]=2 2780 B8R1.2 C[SiH2]c1ccccc1 Amb19893954 [2,0,0,0,0,0|0,1,0]=3 2781 B8R1.2 ClC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367253 [2,0,0,0,0,0|1,0,0]=3 2782 B8R1.2 ClCc1cccc[n]1 Amb22489454 [2,0,0,0,0,0|2,0,0]=4 2783 B8R1.2 ClCc1ccccc1 Amb22363332 [2,0,0,0,0,0|1,0,0]=3 2784 B8R1.2 ClCc1ccncc1 Amb1933717 [2,0,0,0,0,0|2,0,0]=4 2785 B8R1.2 ClNc1cccc[n]1 Amb24481501 [2,0,0,0,0,0|2,0,0]=4 2786 B8R1.2 ClSc1ccccc1 Amb10575597 [2,0,0,0,0,0|2,0,0]=4 2787 B8R1.2 Cl[13CH2]c1ccccc1 Amb22351323 [2,0,0,0,0,0|1,0,0]=3 2788 B8R1.2 Cl[SiH2]c1ccccc1 Amb22351128 [2,0,0,0,0,0|1,1,0]=4 2789 B8R1.2 FCc1c[n]ccc1 Amb25259171 [2,0,0,0,0,0|2,0,0]=4 2790 B8R1.2 FCc1cc[n]cc1 Amb22372287 [2,0,0,0,0,0|2,0,0]=4 2791 B8R1.2 FCc1cccc[n]1 Amb24093657 [2,0,0,0,0,0|2,0,0]=4 2792 B8R1.2 FCc1ccccc1 Amb10838335 [2,0,0,0,0,0|1,0,0]=3 2793 B8R1.2 FNc1cccc[n]1 Amb25320751 [2,0,0,0,0,0|2,0,0]=4 2794 B8R1.2 FSc1ccccc1 Amb25198589 [2,0,0,0,0,0|2,0,0]=4 2795 B8R1.2 ICc1cc[n]cc1 Amb22489735 [2,0,0,0,0,0|2,0,0]=4 2796 B8R1.2 ICc1cc[n]cc1 Amb22748952 [2,0,0,0,0,0|2,0,0]=4 2797 B8R1.2 ICc1cccnc1 Amb10602162 [2,0,0,0,0,0|2,0,0]=4 2798 B8R1.2 I[Hg]c1ccccc1 Amb22347346 [2,0,0,0,0,0|2,0,0]=4 2799 B8R1.2 I[Mg]c1ccccc1 Amb22730124 [2,0,0,0,0,0|2,0,0]=4 2800 B8R1.2 I[Se]c1ccccc1 Amb10601593 [2,0,0,0,0,0|2,0,0]=4 2801 B8R1.2 N#Cc1ccccc1 Amb21864642 [2,0,0,0,0,0|0,0,2]=4 2802 B8R1.2 N#Cc1ccccc1 Amb22167299 [2,0,0,0,0,0|0,0,2]=4 2803 B8R1.2 N#[N+]c1ccccc1 Amb10564805 [2,0,0,0,0,0|0,0,2]=4 2804 B8R1.2 NCC1=CC=CCO1 Amb25128002 [2,0,0,0,0,0|1,0,1]=4 2805 B8R1.2 NC[n+]1ccccc1 Amb24716810 [2,0,0,0,0,0|1,0,0]=3 2806 B8R1.2 NCc1[n]ccc[n]1 Amb20668380 [2,0,0,0,0,0|2,0,0]=4 2807 B8R1.2 NCc1[n]ccc[n]1 Amb22267718 [2,0,0,0,0,0|2,0,0]=4 2808 B8R1.2 NCc1[n]ccc[n]1 Amb22491384 [2,0,0,0,0,0|2,0,0]=4 2809 B8R1.2 NCc1c[n][n]cc1 Amb19957512 [2,0,0,0,0,0|2,0,0]=4 2810 B8R1.2 NCc1c[n][n]cc1 Amb22405863 [2,0,0,0,0,0|2,0,0]=4 2811 B8R1.2 NCc1c[n]c[n]c1 Amb22899160 [2,0,0,0,0,0|2,0,0]=4 2812 B8R1.2 NCc1cc[n]cc1 Amb20620293 [2,0,0,0,0,0|1,0,0]=3 2813 B8R1.2 NCc1cc[n]cc1 Amb20622010 [2,0,0,0,0,0|1,0,0]=3 2814 B8R1.2 NCc1ccc[n][n]1 Amb24183396 [2,0,0,0,0,0|2,0,0]=4 2815 B8R1.2 NCc1cccc[n]1 Amb20620292 [2,0,0,0,0,0|1,0,0]=3 2816 B8R1.2 NCc1cccc[n]1 Amb22274458 [2,0,0,0,0,0|1,0,0]=3 2817 B8R1.2 NCc1ccccc1 Amb19958612 [2,0,0,0,0,0|0,0,0]=2 2818 B8R1.2 NCc1ccccc1 Amb22052549 [2,0,0,0,0,0|0,0,0]=2 2819 B8R1.2 NCc1ccccc1 Amb23459863 [2,0,0,0,0,0|0,0,0]=2 2820 B8R1.2 NCc1ccccc1 Amb24325406 [2,0,0,0,0,0|0,0,0]=2 2821 B8R1.2 NCc1cccnc1 Amb1481403 [2,0,0,0,0,0|1,0,0]=3 2822 B8R1.2 NCc1cccnc1 Amb2189172 [2,0,0,0,0,0|1,0,0]=3 2823 B8R1.2 NCc1ccncc1 Amb1156526 [2,0,0,0,0,0|1,0,0]=3 2824 B8R1.2 NCc1cnccn1 Amb10067734 [2,0,0,0,0,0|2,0,0]=4 2825 B8R1.2 NCc1cnccn1 Amb1099257 [2,0,0,0,0,0|2,0,0]=4 2826 B8R1.2 NCc1ncccn1 Amb10068909 [2,0,0,0,0,0|2,0,0]=4 2827 B8R1.2 NCc1ncccn1 Amb1139642 [2,0,0,0,0,0|2,0,0]=4 2828 B8R1.2 NCc1nccnc1 Amb10068908 [2,0,0,0,0,0|2,0,0]=4 2829 B8R1.2 NNc1[n]ccc[n]1 Amb22587655 [2,0,0,0,0,0|2,0,0]=4 2830 B8R1.2 NNc1c[n][n]cc1 Amb22896609 [2,0,0,0,0,0|2,0,0]=4 2831 B8R1.2 NNc1c[n]c[n]c1 Amb25843840 [2,0,0,0,0,0|2,0,0]=4 2832 B8R1.2 NNc1cc[n]c[n]1 Amb22011554 [2,0,0,0,0,0|2,0,0]=4 2833 B8R1.2 NNc1cc[n]c[n]1 Amb22757340 [2,0,0,0,0,0|2,0,0]=4 2834 B8R1.2 NNc1cc[n]cc1 Amb19893272 [2,0,0,0,0,0|1,0,0]=3 2835 B8R1.2 NNc1cccc[n]1 Amb22494294 [2,0,0,0,0,0|1,0,0]=3 2836 B8R1.2 NNc1ccccc1 Amb22002446 [2,0,0,0,0,0|0,0,0]=2 2837 B8R1.2 NNc1ccccc1 Amb22166856 [2,0,0,0,0,0|0,0,0]=2 2838 B8R1.2 NNc1ccccc1 Amb22731573 [2,0,0,0,0,0|0,0,0]=2 2839 B8R1.2 NNc1ccccn1 Amb1104567 [2,0,0,0,0,0|1,0,0]=3 2840 B8R1.2 NNc1cccnc1 Amb10177783 [2,0,0,0,0,0|1,0,0]=3 2841 B8R1.2 NNc1cccnc1 Amb16192849 [2,0,0,0,0,0|1,0,0]=3 2842 B8R1.2 NNc1cccnc1 Amb2092671 [2,0,0,0,0,0|1,0,0]=3 2843 B8R1.2 NNc1cccnn1 Amb16185786 [2,0,0,0,0,0|2,0,0]=4 2844 B8R1.2 NNc1cccnn1 Amb16231295 [2,0,0,0,0,0|2,0,0]=4 2845 B8R1.2 NNc1cnccn1 Amb1111598 [2,0,0,0,0,0|2,0,0]=4 2846 B8R1.2 NNc1ncccn1 Amb1114665 [2,0,0,0,0,0|2,0,0]=4 2847 B8R1.2 NNc1ncccn1 Amb2182937 [2,0,0,0,0,0|2,0,0]=4 2848 B8R1.2 NOc1cccc[n]1 Amb24101187 [2,0,0,0,0,0|2,0,0]=4 2849 B8R1.2 NOc1ccccc1 Amb18123833 [2,0,0,0,0,0|1,0,0]=3 2850 B8R1.2 NOc1ccccc1 Amb22231364 [2,0,0,0,0,0|1,0,0]=3 2851 B8R1.2 NSc1cc[n]cc1 Amb24575022 [2,0,0,0,0,0|2,0,0]=4 2852 B8R1.2 NSc1cccc[n]1 Amb24061291 [2,0,0,0,0,0|2,0,0]=4 2853 B8R1.2 N\N=C\1/C=CC=CN1 Amb22732534 [2,0,0,0,0,0|1,0,1]=4 2854 B8R1.2 O=Bc1ccccc1 Amb25221658 [2,0,0,0,0,0|2,0,0]=4 2855 B8R1.2 O=C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367549 [2,0,0,0,0,0|1,0,1]=4 2856 B8R1.2 O=[13CH]c1ccccc1 Amb22349200 [2,0,0,0,0,0|1,0,1]=4 2857 B8R1.2 O=[I]c1ccccc1 Amb15692855 [2,0,0,0,0,0|2,0,0]=4 2858 B8R1.2 OC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367395 [2,0,0,0,0,0|1,0,0]=3 2859 B8R1.2 OCc1c[n]ccc1 Amb20622013 [2,0,0,0,0,0|2,0,0]=4 2860 B8R1.2 OCc1c[n]ccc1 Amb22434305 [2,0,0,0,0,0|2,0,0]=4 2861 B8R1.2 OCc1cc[n]cc1 Amb24183964 [2,0,0,0,0,0|2,0,0]=4 2862 B8R1.2 OCc1ccccn1 Amb16231923 [2,0,0,0,0,0|2,0,0]=4 2863 B8R1.2 OCc1ccncc1 Amb16231990 [2,0,0,0,0,0|2,0,0]=4 2864 B8R1.2 ONc1cccc[n]1 Amb25057797 [2,0,0,0,0,0|2,0,0]=4 2865 B8R1.2 ONc1ccccc1 Amb17672282 [2,0,0,0,0,0|1,0,0]=3 2866 B8R1.2 ONc1ccccc1 Amb22445293 [2,0,0,0,0,0|1,0,0]=3 2867 B8R1.2 OSc1ccccc1 Amb25200260 [2,0,0,0,0,0|2,0,0]=4 2868 B8R1.2 O[13CH2]c1ccccc1 Amb22363258 [2,0,0,0,0,0|1,0,0]=3 2869 B8R1.2 O[14CH2]c1ccccc1 Amb22733558 [2,0,0,0,0,0|1,0,0]=3 2870 B8R1.2 O[Hg]c1ccccc1 Amb17940723 [2,0,0,0,0,0|2,0,0]=4 2871 B8R1.2 SCc1c[n]ccc1 Amb21984718 [2,0,0,0,0,0|2,0,0]=4 2872 B8R1.2 SCc1cc[n]cc1 Amb22008603 [2,0,0,0,0,0|2,0,0]=4 2873 B8R1.2 SCc1cccc[n]1 Amb20622005 [2,0,0,0,0,0|2,0,0]=4 2874 B8R1.2 [13CH3]Cc1ccccc1 Amb22353602 [2,0,0,0,0,0|0,0,0]=2 2875 B8R1.2 [15NH2]Cc1ccccc1 Amb22351500 [2,0,0,0,0,0|0,0,0]=2 2876 B8R1.2 [C-]#Cc1ccccc1 Amb22731283 [2,0,0,0,0,0|0,0,2]=4 2877 B8R1.2 [C-]#Cc1ccccc1 Amb22731714 [2,0,0,0,0,0|0,0,2]=4 2878 B8R1.2 [C-]#Cc1ccccc1 Amb22733589 [2,0,0,0,0,0|0,0,2]=4 2879 B8R1.2 [C-]#[N+]c1ccccc1 Amb1107613 [2,0,0,0,0,0|1,0,1]=4 2880 B8R1.2 [Li]Sc1ccccc1 Amb17939763 [2,0,0,0,0,0|2,0,0]=4 2881 B8R1.2 [Mg+]Cc1ccccc1 Amb22043988 [2,0,0,0,0,0|1,0,0]=3 2882 B8R1.2 [NH3+]Cc1ccccc1 Amb10555897 [2,0,0,0,0,0|0,0,1]=3 2883 B8R1.2 [NH3+]Oc1ccccc1 Amb10552602 [2,0,0,0,0,0|1,0,1]=4 2884 B8R1.2 [Na]Sc1ccccc1 Amb22353443 [2,0,0,0,0,0|2,0,0]=4 2885 B8R1.2 [O-]Cc1ccccc1 Amb22367041 [2,0,0,0,0,0|1,0,0]=3 2886 B8R1.2 [SiH3]Cc1ccccc1 Amb22347052 [2,0,0,0,0,0|0,1,0]=3 2887 B8R1.2 [Tl]Sc1ccccc1 Amb22366489 [2,0,0,0,0,0|2,0,0]=4 2888 B10R0.71 CCCCC\C=C/C=CC=C Amb22336558 [0,1,1,0,0,0|2,0,0]=4 2889 B10R0.71 CCCCC\C=C\C=C/C=C Amb22546765 [0,1,1,0,0,0|2,0,0]=4 2890 B10R0.71 CCCCC\C=C\C=C\C=C Amb22730166 [0,1,1,0,0,0|2,0,0]=4 2891 B10R1.1 BrCC[n+]1ccc(cc1)C Amb2228343 [1,1,0,0,0,0|2,0,0]=4 2892 B10R1.1 BrCCc1ccc(I)cc1 Amb25266376 [1,1,0,0,0,0|1,0,0]=3 2893 B10R1.1 BrCCc1ccc(cc1)N Amb17595296 [1,1,0,0,0,0|1,0,0]=3 2894 B10R1.1 Br[Zn]Cc1ccc(I)cc1 Amb22000470 [1,1,0,0,0,0|2,0,0]=4 2895 B10R1.1 Brc1ccc(CCBr)[n]c1 Amb25187280 [1,1,0,0,0,0|2,0,0]=4 2896 B10R1.1 Brc1ccc(CCI)cc1 Amb22002540 [1,1,0,0,0,0|1,0,0]=3 2897 B10R1.1 Brc1ccc(C[Mg]Br)cc1 Amb22000536 [1,1,0,0,0,0|2,0,0]=4 2898 B10R1.1 Brc1ccc(C[Zn]Br)cc1 Amb22000432 [1,1,0,0,0,0|2,0,0]=4 2899 B10R1.1 C#CCc1ccc(F)cc1 Amb25679386 [1,1,0,0,0,0|1,0,1]=4 2900 B10R1.1 C=CCc1ccc(O)cc1 Amb18124422 [1,1,0,0,0,0|1,0,1]=4 2901 B10R1.1 CCCN1C=CC(=N)C=C1 Amb19805039 [1,1,0,0,0,0|2,0,0]=4 2902 B10R1.1 CCCN1C=CC(=N)C=C1 Amb21922068 [1,1,0,0,0,0|2,0,0]=4 2903 B10R1.1 CCCN1C=CC(=[NH2+])C=C1 Amb22553587 [1,1,0,0,0,0|2,0,0]=4 2904 B10R1.1 CCC[n+]1ccc(C)cc1 Amb22346436 [1,1,0,0,0,0|2,0,0]=4 2905 B10R1.1 CCC[n+]1ccc(N)cc1 Amb25292318 [1,1,0,0,0,0|2,0,0]=4 2906 B10R1.1 CCCc1ccc(Br)c[n]1 Amb24321438 [1,1,0,0,0,0|2,0,0]=4 2907 B10R1.1 CCCc1ccc(cc1)F Amb10845722 [1,1,0,0,0,0|1,0,0]=3 2908 B10R1.1 CCCc1ccc(cn1)N Amb10600808 [1,1,0,0,0,0|2,0,0]=4 2909 B10R1.1 CCCc1ccc(cn1)O Amb10553035 [1,1,0,0,0,0|2,0,0]=4 2910 B10R1.1 CCCc1ccc(nc1)Br Amb10600786 [1,1,0,0,0,0|2,0,0]=4 2911 B10R1.1 CCCc1ccc(nc1)N Amb10600788 [1,1,0,0,0,0|2,0,0]=4 2912 B10R1.1 CCCc1ccc(nc1)O Amb10600789 [1,1,0,0,0,0|2,0,0]=4 2913 B10R1.1 CCNc1ccc(Br)cc1 Amb19959109 [1,1,0,0,0,0|2,0,0]=4 2914 B10R1.1 CCNc1ccc(cc1)F Amb1214999 [1,1,0,0,0,0|2,0,0]=4 2915 B10R1.1 CCOc1ccc(cc1)N Amb1235495 [1,1,0,0,0,0|2,0,0]=4 2916 B10R1.1 CCOc1ccc(cc1)O Amb1808385 [1,1,0,0,0,0|2,0,0]=4 2917 B10R1.1 CCSc1ccc(F)cc1 Amb24621814 [1,1,0,0,0,0|2,0,0]=4 2918 B10R1.1 CCSc1ccc(cc1)N Amb13949222 [1,1,0,0,0,0|2,0,0]=4 2919 B10R1.1 CCSc1ccc(cc1)N Amb2099645 [1,1,0,0,0,0|2,0,0]=4 2920 B10R1.1 CCSc1ccc(cc1)O Amb17202382 [1,1,0,0,0,0|2,0,0]=4 2921 B10R1.1 CNC=C1C=CC(=O)C=C1 Amb24459841 [1,1,0,0,0,0|1,0,1]=4 2922 B10R1.1 CNCc1ccc(Br)[n]c1 Amb21861666 [1,1,0,0,0,0|2,0,0]=4 2923 B10R1.1 CNCc1ccc(Br)[n]c1 Amb22271476 [1,1,0,0,0,0|2,0,0]=4 2924 B10R1.1 CNCc1ccc(Br)cc1 Amb17739893 [1,1,0,0,0,0|1,0,0]=3 2925 B10R1.1 CNCc1ccc(Cl)[n]c1 Amb19893050 [1,1,0,0,0,0|2,0,0]=4 2926 B10R1.1 CNCc1ccc(Cl)[n]c1 Amb22293911 [1,1,0,0,0,0|2,0,0]=4 2927 B10R1.1 CNCc1ccc(Cl)c[n]1 Amb22500681 [1,1,0,0,0,0|2,0,0]=4 2928 B10R1.1 CNCc1ccc(Cl)cc1 Amb17935917 [1,1,0,0,0,0|1,0,0]=3 2929 B10R1.1 CNCc1ccc(F)[n]c1 Amb24062505 [1,1,0,0,0,0|2,0,0]=4 2930 B10R1.1 CNCc1ccc(F)c[n]1 Amb25294948 [1,1,0,0,0,0|2,0,0]=4 2931 B10R1.1 CNCc1ccc(I)[n]c1 Amb23446986 [1,1,0,0,0,0|2,0,0]=4 2932 B10R1.1 CNCc1ccc(I)cc1 Amb23569028 [1,1,0,0,0,0|1,0,0]=3 2933 B10R1.1 CNCc1ccc(N)[n]c1 Amb23446332 [1,1,0,0,0,0|2,0,0]=4 2934 B10R1.1 CNCc1ccc(O)[n]c1 Amb23446663 [1,1,0,0,0,0|2,0,0]=4 2935 B10R1.1 CNCc1ccc(S)[n]c1 Amb23446730 [1,1,0,0,0,0|2,0,0]=4 2936 B10R1.1 CNCc1ccc(cc1)Br Amb1209641 [1,1,0,0,0,0|1,0,0]=3 2937 B10R1.1 CNCc1ccc(cc1)C Amb1241142 [1,1,0,0,0,0|1,0,0]=3 2938 B10R1.1 CNCc1ccc(cc1)Cl Amb1648458 [1,1,0,0,0,0|1,0,0]=3 2939 B10R1.1 CNCc1ccc(cc1)F Amb1105922 [1,1,0,0,0,0|1,0,0]=3 2940 B10R1.1 CNCc1ccc(cc1)O Amb1116278 [1,1,0,0,0,0|1,0,0]=3 2941 B10R1.1 COCc1ccc(Br)cc1 Amb18320178 [1,1,0,0,0,0|2,0,0]=4 2942 B10R1.1 COCc1ccc(Cl)cc1 Amb22497336 [1,1,0,0,0,0|2,0,0]=4 2943 B10R1.1 COCc1ccc(F)cc1 Amb24064703 [1,1,0,0,0,0|2,0,0]=4 2944 B10R1.1 COCc1ccc(I)cc1 Amb22234050 [1,1,0,0,0,0|2,0,0]=4 2945 B10R1.1 COCc1ccc(S)cc1 Amb19149369 [1,1,0,0,0,0|2,0,0]=4 2946 B10R1.1 COCc1ccc(cc1)N Amb1137167 [1,1,0,0,0,0|2,0,0]=4 2947 B10R1.1 CSCc1ccc(Br)cc1 Amb19373540 [1,1,0,0,0,0|2,0,0]=4 2948 B10R1.1 CSCc1ccc(I)cc1 Amb25799869 [1,1,0,0,0,0|2,0,0]=4 2949 B10R1.1 CSCc1ccc(N)cc1 Amb18544980 [1,1,0,0,0,0|2,0,0]=4 2950 B10R1.1 CSCc1ccc(O)cc1 Amb18644673 [1,1,0,0,0,0|2,0,0]=4 2951 B10R1.1 CSCc1ccc(cc1)C Amb16185125 [1,1,0,0,0,0|2,0,0]=4 2952 B10R1.1 Cc1[n]cc(CCN)c[n]1 Amb18964129 [1,1,0,0,0,0|2,0,0]=4 2953 B10R1.1 Cc1c[n]c(CCN)[n]c1 Amb22059219 [1,1,0,0,0,0|2,0,0]=4 2954 B10R1.1 Cc1c[n]c(CCN)[n]c1 Amb22886488 [1,1,0,0,0,0|2,0,0]=4 2955 B10R1.1 Cc1c[n]c(CCN)c[n]1 Amb18832323 [1,1,0,0,0,0|2,0,0]=4 2956 B10R1.1 Cc1cc[n+](CC[O-])cc1 Amb24509510 [1,1,0,0,0,0|2,0,0]=4 2957 B10R1.1 Cc1ccc(CCBr)c[n]1 Amb24066233 [1,1,0,0,0,0|2,0,0]=4 2958 B10R1.1 Cc1ccc(CCC)cc1 Amb22227992 [1,1,0,0,0,0|1,0,0]=3 2959 B10R1.1 Cc1ccc(CCCl)[n]c1 Amb24479231 [1,1,0,0,0,0|2,0,0]=4 2960 B10R1.1 Cc1ccc(CCCl)c[n]1 Amb24658933 [1,1,0,0,0,0|2,0,0]=4 2961 B10R1.1 Cc1ccc(CCF)cc1 Amb24659769 [1,1,0,0,0,0|1,0,0]=3 2962 B10R1.1 Cc1ccc(CCI)cc1 Amb25096362 [1,1,0,0,0,0|1,0,0]=3 2963 B10R1.1 Cc1ccc(CCN)[n][n]1 Amb18832324 [1,1,0,0,0,0|2,0,0]=4 2964 B10R1.1 Cc1ccc(CCN)[n]c1 Amb24065042 [1,1,0,0,0,0|1,0,0]=3 2965 B10R1.1 Cc1ccc(CCN)cc1 Amb19261118 [1,1,0,0,0,0|0,0,0]=2 2966 B10R1.1 Cc1ccc(CCS)c[n]1 Amb24583128 [1,1,0,0,0,0|2,0,0]=4 2967 B10R1.1 Cc1ccc(CNC)[n]c1 Amb25280564 [1,1,0,0,0,0|2,0,0]=4 2968 B10R1.1 Cc1ccc(CNN)[n][n]1 Amb24610592 [1,1,0,0,0,0|2,0,0]=4 2969 B10R1.1 Cc1ccc(CNN)cc1 Amb19890079 [1,1,0,0,0,0|0,0,0]=2 2970 B10R1.1 Cc1ccc(CNN)cc1 Amb21954052 [1,1,0,0,0,0|0,0,0]=2 2971 B10R1.1 Cc1ccc(CNO)[n]c1 Amb25145636 [1,1,0,0,0,0|2,0,0]=4 2972 B10R1.1 Cc1ccc(CNO)c[n]1 Amb25305252 [1,1,0,0,0,0|2,0,0]=4 2973 B10R1.1 Cc1ccc(CNO)cc1 Amb25798742 [1,1,0,0,0,0|1,0,0]=3 2974 B10R1.1 Cc1ccc(CON)[n]c1 Amb24383486 [1,1,0,0,0,0|2,0,0]=4 2975 B10R1.1 Cc1ccc(CON)cc1 Amb21929103 [1,1,0,0,0,0|1,0,0]=3 2976 B10R1.1 Cc1ccc(C[Mg]Cl)cc1 Amb19928780 [1,1,0,0,0,0|2,0,0]=4 2977 B10R1.1 Cc1ccc(C[Zn]Cl)cc1 Amb22000457 [1,1,0,0,0,0|2,0,0]=4 2978 B10R1.1 Cc1ccc(cc1)C[N+]#[C-] Amb1981066 [1,1,0,0,0,0|1,0,1]=4 2979 B10R1.1 Cc1ccc(cc1)NCO Amb24745213 [1,1,0,0,0,0|2,0,0]=4 2980 B10R1.1 Cc1ccc(cc1)OCCl Amb24620445 [1,1,0,0,0,0|2,0,0]=4 2981 B10R1.1 Cc1ccc(cc1)PCCl Amb24538070 [1,1,0,0,0,0|2,0,0]=4 2982 B10R1.1 ClCSc1ccc(Br)cc1 Amb25237152 [1,1,0,0,0,0|2,0,0]=4 2983 B10R1.1 Clc1ccc(CCBr)c[n]1 Amb24741687 [1,1,0,0,0,0|2,0,0]=4 2984 B10R1.1 Clc1ccc(CCCl)c[n]1 Amb25144552 [1,1,0,0,0,0|2,0,0]=4 2985 B10R1.1 Clc1ccc(CCI)cc1 Amb25363991 [1,1,0,0,0,0|1,0,0]=3 2986 B10R1.1 Clc1ccc(C[Zn]Cl)cc1 Amb22000429 [1,1,0,0,0,0|2,0,0]=4 2987 B10R1.1 Clc1ccc(cc1)C[N+]#[C-] Amb2235910 [1,1,0,0,0,0|1,0,1]=4 2988 B10R1.1 Clc1ccc(cc1)SCBr Amb24658657 [1,1,0,0,0,0|2,0,0]=4 2989 B10R1.1 Clc1ccc(cc1)SCCl Amb22351380 [1,1,0,0,0,0|2,0,0]=4 2990 B10R1.1 FCCc1ccc(Br)cc1 Amb25047426 [1,1,0,0,0,0|1,0,0]=3 2991 B10R1.1 Fc1ccc(C[Mg]Cl)cc1 Amb17938181 [1,1,0,0,0,0|2,0,0]=4 2992 B10R1.1 Fc1ccc(C[Zn]Cl)cc1 Amb17938179 [1,1,0,0,0,0|2,0,0]=4 2993 B10R1.1 Fc1ccc(cc1)C[N+]#[C-] Amb1981065 [1,1,0,0,0,0|1,0,1]=4 2994 B10R1.1 Fc1ccc(cc1)OCCl Amb24538040 [1,1,0,0,0,0|2,0,0]=4 2995 B10R1.1 N#CCc1ccc(S)cc1 Amb24509708 [1,1,0,0,0,0|0,0,2]=4 2996 B10R1.1 N#CCc1ccc(cc1)Br Amb1130758 [1,1,0,0,0,0|0,0,2]=4 2997 B10R1.1 N#CCc1ccc(cc1)Cl Amb1883007 [1,1,0,0,0,0|0,0,2]=4 2998 B10R1.1 N#CCc1ccc(cc1)F Amb1154069 [1,1,0,0,0,0|0,0,2]=4 2999 B10R1.1 N#CCc1ccc(cc1)N Amb1215260 [1,1,0,0,0,0|0,0,2]=4 3000 B10R1.1 N#CCc1ccc(cc1)O Amb1154109 [1,1,0,0,0,0|0,0,2]=4 3001 B10R1.1 NCCC1=CNC(=O)N=C1 Amb25325243 [1,1,0,0,0,0|2,0,0]=4 3002 B10R1.1 NCCC=1C=CC(=O)NC1 Amb18908312 [1,1,0,0,0,0|1,0,0]=3 3003 B10R1.1 NCCN1C=CC(=O)C=C1 Amb18534867 [1,1,0,0,0,0|1,0,0]=3 3004 B10R1.1 NCCN1C=NC(=O)C=C1 Amb18832092 [1,1,0,0,0,0|2,0,0]=4 3005 B10R1.1 NCCc1[n]cc(Br)c[n]1 Amb23399907 [1,1,0,0,0,0|2,0,0]=4 3006 B10R1.1 NCCc1[n]cc(F)c[n]1 Amb25146443 [1,1,0,0,0,0|2,0,0]=4 3007 B10R1.1 NCCc1[n]cc(I)c[n]1 Amb25283540 [1,1,0,0,0,0|2,0,0]=4 3008 B10R1.1 NCCc1[n]cc(O)c[n]1 Amb25174656 [1,1,0,0,0,0|2,0,0]=4 3009 B10R1.1 NCCc1c[n]c(Cl)[n]c1 Amb25278668 [1,1,0,0,0,0|2,0,0]=4 3010 B10R1.1 NCCc1c[n]c(F)[n]c1 Amb18202739 [1,1,0,0,0,0|2,0,0]=4 3011 B10R1.1 NCCc1c[n]c(O)c[n]1 Amb24477157 [1,1,0,0,0,0|2,0,0]=4 3012 B10R1.1 NCCc1cc[n+]([O-])cc1 Amb24471141 [1,1,0,0,0,0|1,0,0]=3 3013 B10R1.1 NCCc1ccc(Br)[n]c1 Amb22233813 [1,1,0,0,0,0|1,0,0]=3 3014 B10R1.1 NCCc1ccc(Br)c[n]1 Amb22751436 [1,1,0,0,0,0|1,0,0]=3 3015 B10R1.1 NCCc1ccc(Cl)[n][n]1 Amb24477095 [1,1,0,0,0,0|2,0,0]=4 3016 B10R1.1 NCCc1ccc(Cl)[n]c1 Amb19516101 [1,1,0,0,0,0|1,0,0]=3 3017 B10R1.1 NCCc1ccc(Cl)c[n]1 Amb22751421 [1,1,0,0,0,0|1,0,0]=3 3018 B10R1.1 NCCc1ccc(Cl)c[n]1 Amb22899099 [1,1,0,0,0,0|1,0,0]=3 3019 B10R1.1 NCCc1ccc(Cl)c[n]1 Amb22899100 [1,1,0,0,0,0|1,0,0]=3 3020 B10R1.1 NCCc1ccc(Cl)cc1 Amb22497649 [1,1,0,0,0,0|0,0,0]=2 3021 B10R1.1 NCCc1ccc(F)[n]c1 Amb25678845 [1,1,0,0,0,0|1,0,0]=3 3022 B10R1.1 NCCc1ccc(F)c[n]1 Amb22899431 [1,1,0,0,0,0|1,0,0]=3 3023 B10R1.1 NCCc1ccc(I)cc1 Amb19516023 [1,1,0,0,0,0|0,0,0]=2 3024 B10R1.1 NCCc1ccc(N)cc1 Amb17772211 [1,1,0,0,0,0|0,0,0]=2 3025 B10R1.1 NCCc1ccc(O)[n][n]1 Amb25699288 [1,1,0,0,0,0|2,0,0]=4 3026 B10R1.1 NCCc1ccc(O)cc1 Amb17778990 [1,1,0,0,0,0|0,0,0]=2 3027 B10R1.1 NCCc1ccc(S)cc1 Amb25700837 [1,1,0,0,0,0|0,0,0]=2 3028 B10R1.1 NCCc1ccc(cc1)Br Amb10808111 [1,1,0,0,0,0|0,0,0]=2 3029 B10R1.1 NCCc1ccc(cc1)C Amb1129454 [1,1,0,0,0,0|0,0,0]=2 3030 B10R1.1 NCCc1ccc(cc1)Cl Amb1212558 [1,1,0,0,0,0|0,0,0]=2 3031 B10R1.1 NCCc1ccc(cc1)F Amb1215262 [1,1,0,0,0,0|0,0,0]=2 3032 B10R1.1 NCCc1ccc(nc1)C Amb10610554 [1,1,0,0,0,0|1,0,0]=3 3033 B10R1.1 NCNc1ccc(cc1)C Amb17117016 [1,1,0,0,0,0|1,0,0]=3 3034 B10R1.1 NNCc1[n]cc(Cl)c[n]1 Amb24677949 [1,1,0,0,0,0|2,0,0]=4 3035 B10R1.1 NNCc1ccc(Br)cc1 Amb19893264 [1,1,0,0,0,0|0,0,0]=2 3036 B10R1.1 NNCc1ccc(Br)cc1 Amb23439145 [1,1,0,0,0,0|0,0,0]=2 3037 B10R1.1 NNCc1ccc(Cl)[n]c1 Amb19944640 [1,1,0,0,0,0|1,0,0]=3 3038 B10R1.1 NNCc1ccc(Cl)cc1 Amb19890158 [1,1,0,0,0,0|0,0,0]=2 3039 B10R1.1 NNCc1ccc(Cl)cc1 Amb20668069 [1,1,0,0,0,0|0,0,0]=2 3040 B10R1.1 NNCc1ccc(Cl)cc1 Amb21954056 [1,1,0,0,0,0|0,0,0]=2 3041 B10R1.1 NNCc1ccc(F)cc1 Amb19893258 [1,1,0,0,0,0|0,0,0]=2 3042 B10R1.1 NNCc1ccc(I)cc1 Amb25794991 [1,1,0,0,0,0|0,0,0]=2 3043 B10R1.1 NNCc1ccc(cc1)Br Amb1114984 [1,1,0,0,0,0|0,0,0]=2 3044 B10R1.1 NNCc1ccc(cc1)C Amb1112560 [1,1,0,0,0,0|0,0,0]=2 3045 B10R1.1 NNCc1ccc(cc1)Cl Amb1121233 [1,1,0,0,0,0|0,0,0]=2 3046 B10R1.1 NNCc1ccc(cc1)F Amb10841872 [1,1,0,0,0,0|0,0,0]=2 3047 B10R1.1 NNCc1ccc(cc1)F Amb1112880 [1,1,0,0,0,0|0,0,0]=2 3048 B10R1.1 NOCc1ccc(Br)cc1 Amb22234858 [1,1,0,0,0,0|1,0,0]=3 3049 B10R1.1 NOCc1ccc(Cl)[n]c1 Amb25128181 [1,1,0,0,0,0|2,0,0]=4 3050 B10R1.1 NOCc1ccc(Cl)cc1 Amb19889791 [1,1,0,0,0,0|1,0,0]=3 3051 B10R1.1 NOCc1ccc(F)c[n]1 Amb24752377 [1,1,0,0,0,0|2,0,0]=4 3052 B10R1.1 NOCc1ccc(F)cc1 Amb19883929 [1,1,0,0,0,0|1,0,0]=3 3053 B10R1.1 NOCc1ccc(cc1)C Amb1946246 [1,1,0,0,0,0|1,0,0]=3 3054 B10R1.1 NOCc1ccc(cc1)Cl Amb10607411 [1,1,0,0,0,0|1,0,0]=3 3055 B10R1.1 NOCc1ccc(cc1)F Amb17091427 [1,1,0,0,0,0|1,0,0]=3 3056 B10R1.1 N\C=C\c1ccc(Cl)cc1 Amb24418167 [1,1,0,0,0,0|0,0,2]=4 3057 B10R1.1 Nc1ccc(CC=O)cc1 Amb22831156 [1,1,0,0,0,0|1,0,1]=4 3058 B10R1.1 Nc1ccc(CCBr)cc1 Amb24066884 [1,1,0,0,0,0|1,0,0]=3 3059 B10R1.1 Nc1ccc(CCCl)cc1 Amb18125908 [1,1,0,0,0,0|1,0,0]=3 3060 B10R1.1 Nc1ccc(CCF)cc1 Amb24655949 [1,1,0,0,0,0|1,0,0]=3 3061 B10R1.1 Nc1ccc(CCO)[n]c1 Amb24593512 [1,1,0,0,0,0|2,0,0]=4 3062 B10R1.1 Nc1ccc(CCO)c[n]1 Amb23446333 [1,1,0,0,0,0|2,0,0]=4 3063 B10R1.1 Nc1ccc(CNO)cc1 Amb25835653 [1,1,0,0,0,0|1,0,0]=3 3064 B10R1.1 Nc1ccc(C[PH2]=O)cc1 Amb25118632 [1,1,0,0,0,0|1,1,0]=4 3065 B10R1.1 Nc1ccc(cc1)SCCl Amb25281595 [1,1,0,0,0,0|2,0,0]=4 3066 B10R1.1 O=C1C=CC(CCCl)=CN1 Amb25060213 [1,1,0,0,0,0|2,0,0]=4 3067 B10R1.1 O=C1C=CN(CCCl)C=C1 Amb18177573 [1,1,0,0,0,0|2,0,0]=4 3068 B10R1.1 O=C1C=CN(CCF)C=C1 Amb25713562 [1,1,0,0,0,0|2,0,0]=4 3069 B10R1.1 O=CCc1ccc(I)cc1 Amb24079622 [1,1,0,0,0,0|1,0,1]=4 3070 B10R1.1 O=CCc1ccc(cc1)Br Amb16230450 [1,1,0,0,0,0|1,0,1]=4 3071 B10R1.1 O=CCc1ccc(cc1)Cl Amb10603161 [1,1,0,0,0,0|1,0,1]=4 3072 B10R1.1 O=CCc1ccc(cc1)F Amb16230451 [1,1,0,0,0,0|1,0,1]=4 3073 B10R1.1 OCCN1C=CC(=O)C=C1 Amb18041230 [1,1,0,0,0,0|2,0,0]=4 3074 B10R1.1 OCCN1C=CC(=S)C=C1 Amb25739794 [1,1,0,0,0,0|2,0,0]=4 3075 B10R1.1 OCCc1ccc(Br)[n]c1 Amb23569407 [1,1,0,0,0,0|2,0,0]=4 3076 B10R1.1 OCCc1ccc(Br)c[n]1 Amb21858814 [1,1,0,0,0,0|2,0,0]=4 3077 B10R1.1 OCCc1ccc(Cl)[n]c1 Amb22752853 [1,1,0,0,0,0|2,0,0]=4 3078 B10R1.1 OCCc1ccc(F)[n]c1 Amb25063775 [1,1,0,0,0,0|2,0,0]=4 3079 B10R1.1 OCCc1ccc(F)c[n]1 Amb24426849 [1,1,0,0,0,0|2,0,0]=4 3080 B10R1.1 OCCc1ccc(I)[n]c1 Amb23446988 [1,1,0,0,0,0|2,0,0]=4 3081 B10R1.1 OCCc1ccc(I)cc1 Amb19668873 [1,1,0,0,0,0|1,0,0]=3 3082 B10R1.1 OCCc1ccc(S)[n]c1 Amb23446733 [1,1,0,0,0,0|2,0,0]=4 3083 B10R1.1 OCCc1ccc(S)cc1 Amb24379931 [1,1,0,0,0,0|1,0,0]=3 3084 B10R1.1 OCCc1ccc(nc1)C Amb10603991 [1,1,0,0,0,0|2,0,0]=4 3085 B10R1.1 OCNc1ccc(Cl)cc1 Amb24702524 [1,1,0,0,0,0|2,0,0]=4 3086 B10R1.1 ONCc1ccc(Br)cc1 Amb23449447 [1,1,0,0,0,0|1,0,0]=3 3087 B10R1.1 ONCc1ccc(Cl)cc1 Amb25145635 [1,1,0,0,0,0|1,0,0]=3 3088 B10R1.1 ONCc1ccc(F)cc1 Amb22157298 [1,1,0,0,0,0|1,0,0]=3 3089 B10R1.1 ONCc1ccc(I)cc1 Amb24529167 [1,1,0,0,0,0|1,0,0]=3 3090 B10R1.1 Oc1ccc(CCCl)cc1 Amb25709371 [1,1,0,0,0,0|1,0,0]=3 3091 B10R1.1 Oc1ccc(CCF)cc1 Amb25735077 [1,1,0,0,0,0|1,0,0]=3 3092 B10R1.1 Oc1ccc(CCI)cc1 Amb24094233 [1,1,0,0,0,0|1,0,0]=3 3093 B10R1.1 Oc1ccc(CCO)c[n]1 Amb23446664 [1,1,0,0,0,0|2,0,0]=4 3094 B10R1.1 Oc1ccc(CCS)cc1 Amb25767004 [1,1,0,0,0,0|1,0,0]=3 3095 B10R1.1 Oc1ccc(CNO)cc1 Amb23449449 [1,1,0,0,0,0|1,0,0]=3 3096 B10R1.1 Oc1ccc(cc1)SCO Amb24631003 [1,1,0,0,0,0|2,0,0]=4 3097 B10R1.1 SCCc1ccc(cc1)Br Amb17404679 [1,1,0,0,0,0|1,0,0]=3 3098 B10R1.1 SCCc1ccc(cc1)C Amb16183304 [1,1,0,0,0,0|1,0,0]=3 3099 B10R1.1 SCCc1ccc(cc1)Cl Amb17400376 [1,1,0,0,0,0|1,0,0]=3 3100 B10R1.1 SCCc1ccc(cc1)F Amb17400005 [1,1,0,0,0,0|1,0,0]=3 3101 B10R1.1 Sc1ccc(CCBr)cc1 Amb24428628 [1,1,0,0,0,0|1,0,0]=3 3102 B10R1.1 Sc1ccc(CCCl)cc1 Amb24482361 [1,1,0,0,0,0|1,0,0]=3 3103 B10R1.1 [NH3+]OCc1ccc(cc1)Cl Amb2427236 [1,1,0,0,0,0|1,0,1]=4 3104 B10R1.1 [NH3+]OCc1ccc(cc1)F Amb2420803 [1,1,0,0,0,0|1,0,1]=4 3105 B10R1.1 [O-][n+]1ccc(CCO)cc1 Amb25236037 [1,1,0,0,0,0|2,0,0]=4 3106 B10R1.4 Bc1ccccc1CCN Amb24629754 [1,1,0,0,0,0|0,0,0]=2 3107 B10R1.4 BrCCc1ccccc1I Amb25742518 [1,1,0,0,0,0|1,0,0]=3 3108 B10R1.4 Brc1ccccc1CCBr Amb19515770 [1,1,0,0,0,0|1,0,0]=3 3109 B10R1.4 Brc1ccccc1CCI Amb25255595 [1,1,0,0,0,0|1,0,0]=3 3110 B10R1.4 Brc1ccccc1C[Mg]Br Amb22000538 [1,1,0,0,0,0|2,0,0]=4 3111 B10R1.4 Brc1ccccc1C[Zn]Br Amb22000430 [1,1,0,0,0,0|2,0,0]=4 3112 B10R1.4 C#CCc1ccccc1O Amb24478360 [1,1,0,0,0,0|1,0,1]=4 3113 B10R1.4 C=CCc1ccccc1N Amb18642928 [1,1,0,0,0,0|1,0,1]=4 3114 B10R1.4 C=CCc1ccccc1O Amb1971446 [1,1,0,0,0,0|1,0,1]=4 3115 B10R1.4 CCCN1C=CC=CC1=O Amb22730334 [1,1,0,0,0,0|2,0,0]=4 3116 B10R1.4 CCCN1C=CC=CC1=S Amb24480486 [1,1,0,0,0,0|2,0,0]=4 3117 B10R1.4 CCC[n+]1ccccc1C Amb25326000 [1,1,0,0,0,0|2,0,0]=4 3118 B10R1.4 CCCc1[n]cccc1Br Amb24320669 [1,1,0,0,0,0|2,0,0]=4 3119 B10R1.4 CCCc1[n]cccc1F Amb25716946 [1,1,0,0,0,0|2,0,0]=4 3120 B10R1.4 CCCc1[n]cccc1N Amb18832434 [1,1,0,0,0,0|2,0,0]=4 3121 B10R1.4 CCCc1[n]cccc1O Amb24320670 [1,1,0,0,0,0|2,0,0]=4 3122 B10R1.4 CCCc1c[n]ccc1Br Amb20617515 [1,1,0,0,0,0|2,0,0]=4 3123 B10R1.4 CCCc1c[n]ccc1N Amb22522169 [1,1,0,0,0,0|2,0,0]=4 3124 B10R1.4 CCCc1cc[n]cc1Br Amb24320559 [1,1,0,0,0,0|2,0,0]=4 3125 B10R1.4 CCCc1cc[n]cc1N Amb18203088 [1,1,0,0,0,0|2,0,0]=4 3126 B10R1.4 CCCc1cc[n]cc1O Amb24398292 [1,1,0,0,0,0|2,0,0]=4 3127 B10R1.4 CCCc1ccc[n]c1Br Amb24319271 [1,1,0,0,0,0|2,0,0]=4 3128 B10R1.4 CCCc1ccc[n]c1Cl Amb24319272 [1,1,0,0,0,0|2,0,0]=4 3129 B10R1.4 CCCc1ccc[n]c1F Amb25054844 [1,1,0,0,0,0|2,0,0]=4 3130 B10R1.4 CCCc1ccc[n]c1O Amb24319273 [1,1,0,0,0,0|2,0,0]=4 3131 B10R1.4 CCCc1ccccc1I Amb20622716 [1,1,0,0,0,0|1,0,0]=3 3132 B10R1.4 CCNc1ccccc1O Amb18643152 [1,1,0,0,0,0|2,0,0]=4 3133 B10R1.4 CCNc1ccccc1P Amb24563425 [1,1,0,0,0,0|2,0,0]=4 3134 B10R1.4 CCNc1ccccc1S Amb24382138 [1,1,0,0,0,0|2,0,0]=4 3135 B10R1.4 CCOc1ccccc1I Amb19888234 [1,1,0,0,0,0|2,0,0]=4 3136 B10R1.4 CCOc1ccccc1N Amb22733118 [1,1,0,0,0,0|2,0,0]=4 3137 B10R1.4 CCOc1ccccc1S Amb20242711 [1,1,0,0,0,0|2,0,0]=4 3138 B10R1.4 CCSc1ccccc1Br Amb20242712 [1,1,0,0,0,0|2,0,0]=4 3139 B10R1.4 CCSc1ccccc1F Amb24480376 [1,1,0,0,0,0|2,0,0]=4 3140 B10R1.4 CCSc1ccccc1N Amb10609429 [1,1,0,0,0,0|2,0,0]=4 3141 B10R1.4 CNCC1=CC=CNC1=O Amb18260767 [1,1,0,0,0,0|2,0,0]=4 3142 B10R1.4 CNCC1=CNC=CC1=O Amb25343315 [1,1,0,0,0,0|2,0,0]=4 3143 B10R1.4 CNCc1cc[n]cc1Br Amb23412258 [1,1,0,0,0,0|2,0,0]=4 3144 B10R1.4 CNCc1cc[n]cc1F Amb24398098 [1,1,0,0,0,0|2,0,0]=4 3145 B10R1.4 CNCc1cc[n]cc1N Amb22751232 [1,1,0,0,0,0|2,0,0]=4 3146 B10R1.4 CNCc1ccc[n]c1Br Amb25747185 [1,1,0,0,0,0|2,0,0]=4 3147 B10R1.4 CNCc1ccc[n]c1Cl Amb21967911 [1,1,0,0,0,0|2,0,0]=4 3148 B10R1.4 CNCc1ccccc1Br Amb1210073 [1,1,0,0,0,0|1,0,0]=3 3149 B10R1.4 CNCc1ccccc1C Amb1648007 [1,1,0,0,0,0|1,0,0]=3 3150 B10R1.4 CNCc1ccccc1Cl Amb1694838 [1,1,0,0,0,0|1,0,0]=3 3151 B10R1.4 CNCc1ccccc1F Amb10609411 [1,1,0,0,0,0|1,0,0]=3 3152 B10R1.4 CNCc1ccccc1F Amb1675335 [1,1,0,0,0,0|1,0,0]=3 3153 B10R1.4 CNCc1ccccc1I Amb21861741 [1,1,0,0,0,0|1,0,0]=3 3154 B10R1.4 CNCc1ccccc1O Amb1113119 [1,1,0,0,0,0|1,0,0]=3 3155 B10R1.4 CNCc1ccccc1O Amb19930187 [1,1,0,0,0,0|1,0,0]=3 3156 B10R1.4 CNCc1cccnc1Cl Amb10975541 [1,1,0,0,0,0|2,0,0]=4 3157 B10R1.4 CNCc1ccncc1C Amb10607510 [1,1,0,0,0,0|2,0,0]=4 3158 B10R1.4 CNNc1ccccc1Cl Amb22469809 [1,1,0,0,0,0|2,0,0]=4 3159 B10R1.4 CNNc1ccccc1N Amb24654786 [1,1,0,0,0,0|2,0,0]=4 3160 B10R1.4 CN\C=C/1\C=CC=CC1=N Amb24392543 [1,1,0,0,0,0|1,0,1]=4 3161 B10R1.4 COCc1ccccc1I Amb19373361 [1,1,0,0,0,0|2,0,0]=4 3162 B10R1.4 COCc1ccccc1O Amb22751673 [1,1,0,0,0,0|2,0,0]=4 3163 B10R1.4 CSCc1ccccc1N Amb18951025 [1,1,0,0,0,0|2,0,0]=4 3164 B10R1.4 CSCc1ccccc1O Amb18125792 [1,1,0,0,0,0|2,0,0]=4 3165 B10R1.4 C[n+]1ccccc1CCF Amb24667673 [1,1,0,0,0,0|2,0,0]=4 3166 B10R1.4 Cc1[n]c[n]cc1CCN Amb18832325 [1,1,0,0,0,0|2,0,0]=4 3167 B10R1.4 Cc1[n]cc[n]c1CCN Amb18832320 [1,1,0,0,0,0|2,0,0]=4 3168 B10R1.4 Cc1[n]cccc1CCC Amb24724101 [1,1,0,0,0,0|2,0,0]=4 3169 B10R1.4 Cc1[n]cccc1CCCl Amb24085167 [1,1,0,0,0,0|2,0,0]=4 3170 B10R1.4 Cc1[n]cccc1CCCl Amb25087825 [1,1,0,0,0,0|2,0,0]=4 3171 B10R1.4 Cc1[n]cccc1CCN Amb18203091 [1,1,0,0,0,0|1,0,0]=3 3172 B10R1.4 Cc1[n]cccc1CCO Amb24061576 [1,1,0,0,0,0|2,0,0]=4 3173 B10R1.4 Cc1[n]cccc1CNC Amb18216945 [1,1,0,0,0,0|2,0,0]=4 3174 B10R1.4 Cc1[n]cccc1CNN Amb24596259 [1,1,0,0,0,0|1,0,0]=3 3175 B10R1.4 Cc1c[n]ccc1CCBr Amb24548352 [1,1,0,0,0,0|2,0,0]=4 3176 B10R1.4 Cc1c[n]ccc1CCI Amb24560492 [1,1,0,0,0,0|2,0,0]=4 3177 B10R1.4 Cc1c[n]ccc1CCN Amb22059435 [1,1,0,0,0,0|1,0,0]=3 3178 B10R1.4 Cc1c[n]ccc1CCS Amb25197336 [1,1,0,0,0,0|2,0,0]=4 3179 B10R1.4 Cc1cc[n]cc1CCBr Amb24693233 [1,1,0,0,0,0|2,0,0]=4 3180 B10R1.4 Cc1cc[n]cc1CCN Amb18832435 [1,1,0,0,0,0|1,0,0]=3 3181 B10R1.4 Cc1cc[n]cc1CNN Amb25132682 [1,1,0,0,0,0|1,0,0]=3 3182 B10R1.4 Cc1cc[n]cc1CNO Amb25135601 [1,1,0,0,0,0|2,0,0]=4 3183 B10R1.4 Cc1ccc[n]c1CCBr Amb24641164 [1,1,0,0,0,0|2,0,0]=4 3184 B10R1.4 Cc1ccc[n]c1CON Amb25684335 [1,1,0,0,0,0|2,0,0]=4 3185 B10R1.4 Cc1cccc[n+]1CCF Amb25048247 [1,1,0,0,0,0|2,0,0]=4 3186 B10R1.4 Cc1ccccc1CCC Amb22227985 [1,1,0,0,0,0|1,0,0]=3 3187 B10R1.4 Cc1ccccc1CCN Amb20622598 [1,1,0,0,0,0|0,0,0]=2 3188 B10R1.4 Cc1ccccc1CNN Amb21954057 [1,1,0,0,0,0|0,0,0]=2 3189 B10R1.4 Cc1ccccc1CNO Amb25343987 [1,1,0,0,0,0|1,0,0]=3 3190 B10R1.4 Cc1ccccc1CSC Amb24370548 [1,1,0,0,0,0|2,0,0]=4 3191 B10R1.4 Cc1ccccc1C[Mg]Cl Amb22000539 [1,1,0,0,0,0|2,0,0]=4 3192 B10R1.4 Cc1ccccc1C[Zn]Cl Amb22000455 [1,1,0,0,0,0|2,0,0]=4 3193 B10R1.4 Cc1ccccc1\C=N\N Amb24533187 [1,1,0,0,0,0|0,0,2]=4 3194 B10R1.4 ClCCc1ccccc1Br Amb24644893 [1,1,0,0,0,0|1,0,0]=3 3195 B10R1.4 ClCCc1ccccc1I Amb24742826 [1,1,0,0,0,0|1,0,0]=3 3196 B10R1.4 Clc1c[n]ccc1CCBr Amb25076266 [1,1,0,0,0,0|2,0,0]=4 3197 B10R1.4 Clc1ccccc1CCI Amb25048390 [1,1,0,0,0,0|1,0,0]=3 3198 B10R1.4 Clc1ccccc1C[Mg]Cl Amb19928783 [1,1,0,0,0,0|2,0,0]=4 3199 B10R1.4 Clc1ccccc1C[Zn]Cl Amb22000427 [1,1,0,0,0,0|2,0,0]=4 3200 B10R1.4 Clc1ccccc1OCCl Amb22227923 [1,1,0,0,0,0|2,0,0]=4 3201 B10R1.4 FCCc1ccccc1Br Amb24754179 [1,1,0,0,0,0|1,0,0]=3 3202 B10R1.4 FCCc1ccccc1I Amb22739042 [1,1,0,0,0,0|1,0,0]=3 3203 B10R1.4 Fc1c[n]ccc1CCBr Amb25172854 [1,1,0,0,0,0|2,0,0]=4 3204 B10R1.4 Fc1ccccc1C[Zn]Cl Amb17672035 [1,1,0,0,0,0|2,0,0]=4 3205 B10R1.4 Fc1ccccc1OCCl Amb25356820 [1,1,0,0,0,0|2,0,0]=4 3206 B10R1.4 N#CCc1ccccc1Br Amb1140623 [1,1,0,0,0,0|0,0,2]=4 3207 B10R1.4 N#CCc1ccccc1C Amb1651450 [1,1,0,0,0,0|0,0,2]=4 3208 B10R1.4 N#CCc1ccccc1Cl Amb1644930 [1,1,0,0,0,0|0,0,2]=4 3209 B10R1.4 N#CCc1ccccc1N Amb17607888 [1,1,0,0,0,0|0,0,2]=4 3210 B10R1.4 N#CCc1ccccc1O Amb18642921 [1,1,0,0,0,0|0,0,2]=4 3211 B10R1.4 N=C1C=CC=CN1CCO Amb18548415 [1,1,0,0,0,0|2,0,0]=4 3212 B10R1.4 NCCC1=CC=CCC1=S Amb24664855 [1,1,0,0,0,0|0,0,1]=3 3213 B10R1.4 NCCN1C=CC=CC1=O Amb18535437 [1,1,0,0,0,0|1,0,0]=3 3214 B10R1.4 NCCN1C=CC=CC1=O Amb19514535 [1,1,0,0,0,0|1,0,0]=3 3215 B10R1.4 NCCN1C=CC=CC1=O Amb20668789 [1,1,0,0,0,0|1,0,0]=3 3216 B10R1.4 NCCN1C=CC=NC1=O Amb18956968 [1,1,0,0,0,0|2,0,0]=4 3217 B10R1.4 NCCN1N=CC=CC1=O Amb18965094 [1,1,0,0,0,0|2,0,0]=4 3218 B10R1.4 NCCc1[n]c[n]cc1I Amb25378509 [1,1,0,0,0,0|2,0,0]=4 3219 B10R1.4 NCCc1[n]cccc1Br Amb24183541 [1,1,0,0,0,0|1,0,0]=3 3220 B10R1.4 NCCc1[n]cccc1Cl Amb18200051 [1,1,0,0,0,0|1,0,0]=3 3221 B10R1.4 NCCc1c[n]c[n]c1Cl Amb18830516 [1,1,0,0,0,0|2,0,0]=4 3222 B10R1.4 NCCc1c[n]c[n]c1O Amb18832090 [1,1,0,0,0,0|2,0,0]=4 3223 B10R1.4 NCCc1c[n]ccc1F Amb25721852 [1,1,0,0,0,0|1,0,0]=3 3224 B10R1.4 NCCc1cc[n]cc1Cl Amb23596506 [1,1,0,0,0,0|1,0,0]=3 3225 B10R1.4 NCCc1cc[n]cc1F Amb24383725 [1,1,0,0,0,0|1,0,0]=3 3226 B10R1.4 NCCc1cc[n]cc1O Amb24357020 [1,1,0,0,0,0|1,0,0]=3 3227 B10R1.4 NCCc1ccc[n]c1Br Amb25190186 [1,1,0,0,0,0|1,0,0]=3 3228 B10R1.4 NCCc1ccc[n]c1Cl Amb24551153 [1,1,0,0,0,0|1,0,0]=3 3229 B10R1.4 NCCc1ccc[n]c1F Amb24062493 [1,1,0,0,0,0|1,0,0]=3 3230 B10R1.4 NCCc1ccccc1Br Amb22395128 [1,1,0,0,0,0|0,0,0]=2 3231 B10R1.4 NCCc1ccccc1C Amb1212557 [1,1,0,0,0,0|0,0,0]=2 3232 B10R1.4 NCCc1ccccc1Cl Amb22490604 [1,1,0,0,0,0|0,0,0]=2 3233 B10R1.4 NCCc1ccccc1F Amb22039505 [1,1,0,0,0,0|0,0,0]=2 3234 B10R1.4 NCCc1ccccc1O Amb10609215 [1,1,0,0,0,0|0,0,0]=2 3235 B10R1.4 NCCc1ccccc1S Amb25831177 [1,1,0,0,0,0|0,0,0]=2 3236 B10R1.4 NCCc1ncccc1C Amb1995200 [1,1,0,0,0,0|1,0,0]=3 3237 B10R1.4 NCOc1ccccc1O Amb24502152 [1,1,0,0,0,0|1,0,0]=3 3238 B10R1.4 NNCC1=CNC=CC1=O Amb24684523 [1,1,0,0,0,0|1,0,0]=3 3239 B10R1.4 NNCc1[n]cccc1F Amb24572209 [1,1,0,0,0,0|1,0,0]=3 3240 B10R1.4 NNCc1cc[n]cc1Br Amb25274178 [1,1,0,0,0,0|1,0,0]=3 3241 B10R1.4 NNCc1ccc[n]c1Cl Amb19664695 [1,1,0,0,0,0|1,0,0]=3 3242 B10R1.4 NNCc1ccc[n]c1F Amb25243144 [1,1,0,0,0,0|1,0,0]=3 3243 B10R1.4 NNCc1ccccc1Br Amb1116234 [1,1,0,0,0,0|0,0,0]=2 3244 B10R1.4 NNCc1ccccc1Br Amb19893262 [1,1,0,0,0,0|0,0,0]=2 3245 B10R1.4 NNCc1ccccc1C Amb1118964 [1,1,0,0,0,0|0,0,0]=2 3246 B10R1.4 NNCc1ccccc1Cl Amb21959997 [1,1,0,0,0,0|0,0,0]=2 3247 B10R1.4 NNCc1ccccc1F Amb19893256 [1,1,0,0,0,0|0,0,0]=2 3248 B10R1.4 NNCc1ccccc1O Amb24681968 [1,1,0,0,0,0|0,0,0]=2 3249 B10R1.4 NOCc1cc[n]cc1Cl Amb25764086 [1,1,0,0,0,0|2,0,0]=4 3250 B10R1.4 NOCc1ccc[n]c1Cl Amb22396129 [1,1,0,0,0,0|2,0,0]=4 3251 B10R1.4 NOCc1ccccc1Br Amb17091454 [1,1,0,0,0,0|1,0,0]=3 3252 B10R1.4 NOCc1ccccc1Br Amb21929112 [1,1,0,0,0,0|1,0,0]=3 3253 B10R1.4 NOCc1ccccc1C Amb17091424 [1,1,0,0,0,0|1,0,0]=3 3254 B10R1.4 NOCc1ccccc1Cl Amb19889789 [1,1,0,0,0,0|1,0,0]=3 3255 B10R1.4 NOCc1ccccc1F Amb19894376 [1,1,0,0,0,0|1,0,0]=3 3256 B10R1.4 NOCc1ccccc1I Amb22235087 [1,1,0,0,0,0|1,0,0]=3 3257 B10R1.4 NOCc1ccccc1O Amb24502260 [1,1,0,0,0,0|1,0,0]=3 3258 B10R1.4 N\C=N\c1ccccc1O Amb18643068 [1,1,0,0,0,0|1,0,1]=4 3259 B10R1.4 N\N=C\c1ccccc1F Amb25225811 [1,1,0,0,0,0|0,0,2]=4 3260 B10R1.4 N\N=C\c1ccccc1I Amb25048234 [1,1,0,0,0,0|0,0,2]=4 3261 B10R1.4 Nc1[n]c[n]cc1CCN Amb18832166 [1,1,0,0,0,0|2,0,0]=4 3262 B10R1.4 Nc1[n]cccc1CCN Amb25714008 [1,1,0,0,0,0|1,0,0]=3 3263 B10R1.4 Nc1[n]cccc1CCO Amb21858404 [1,1,0,0,0,0|2,0,0]=4 3264 B10R1.4 Nc1[n]cccc1CNN Amb19664694 [1,1,0,0,0,0|1,0,0]=3 3265 B10R1.4 Nc1c[n]ccc1CCN Amb22491934 [1,1,0,0,0,0|1,0,0]=3 3266 B10R1.4 Nc1c[n]ccc1CCO Amb25291562 [1,1,0,0,0,0|2,0,0]=4 3267 B10R1.4 Nc1cc[n]cc1CCCl Amb25027844 [1,1,0,0,0,0|2,0,0]=4 3268 B10R1.4 Nc1cc[n]cc1CCN Amb25063861 [1,1,0,0,0,0|1,0,0]=3 3269 B10R1.4 Nc1cc[n]cc1CCO Amb24062498 [1,1,0,0,0,0|2,0,0]=4 3270 B10R1.4 Nc1cc[n]cc1CNN Amb25071894 [1,1,0,0,0,0|1,0,0]=3 3271 B10R1.4 Nc1ccccc1CCBr Amb24079731 [1,1,0,0,0,0|1,0,0]=3 3272 B10R1.4 Nc1ccccc1CCBr Amb24573051 [1,1,0,0,0,0|1,0,0]=3 3273 B10R1.4 Nc1ccccc1CCF Amb24554505 [1,1,0,0,0,0|1,0,0]=3 3274 B10R1.4 Nc1ccccc1CCN Amb20670599 [1,1,0,0,0,0|0,0,0]=2 3275 B10R1.4 Nc1ccccc1CCP Amb25808564 [1,1,0,0,0,0|0,1,0]=3 3276 B10R1.4 Nc1ccccc1CCS Amb25114690 [1,1,0,0,0,0|1,0,0]=3 3277 B10R1.4 Nc1ccccc1CNN Amb25294794 [1,1,0,0,0,0|0,0,0]=2 3278 B10R1.4 Nc1ccccc1CNO Amb25345206 [1,1,0,0,0,0|1,0,0]=3 3279 B10R1.4 Nc1ccccc1OCF Amb25112317 [1,1,0,0,0,0|2,0,0]=4 3280 B10R1.4 Nc1ccccc1SCCl Amb25720293 [1,1,0,0,0,0|2,0,0]=4 3281 B10R1.4 Nc1ccccc1\C=N\N Amb24602310 [1,1,0,0,0,0|0,0,2]=4 3282 B10R1.4 O=C/1C=CC=C\C1=C\NCl Amb24737402 [1,1,0,0,0,0|1,0,1]=4 3283 B10R1.4 O=C/1C=CC=C\C1=C\NF Amb24737383 [1,1,0,0,0,0|1,0,1]=4 3284 B10R1.4 O=C1C=CC=CN1CCBr Amb19514604 [1,1,0,0,0,0|2,0,0]=4 3285 B10R1.4 O=C1C=CC=CN1CCCl Amb18787739 [1,1,0,0,0,0|2,0,0]=4 3286 B10R1.4 O=CCc1ccccc1Br Amb18634182 [1,1,0,0,0,0|1,0,1]=4 3287 B10R1.4 O=CCc1ccccc1C Amb10844840 [1,1,0,0,0,0|1,0,1]=4 3288 B10R1.4 O=CCc1ccccc1Cl Amb16230448 [1,1,0,0,0,0|1,0,1]=4 3289 B10R1.4 O=CCc1ccccc1F Amb10844839 [1,1,0,0,0,0|1,0,1]=4 3290 B10R1.4 O=CCc1ccccc1I Amb25377055 [1,1,0,0,0,0|1,0,1]=4 3291 B10R1.4 O=c1cccc[n]1CCCl Amb22274576 [1,1,0,0,0,0|2,0,0]=4 3292 B10R1.4 OCCN1C=CC=CC1=O Amb18041231 [1,1,0,0,0,0|2,0,0]=4 3293 B10R1.4 OCCN1C=CC=CC1=S Amb25065240 [1,1,0,0,0,0|2,0,0]=4 3294 B10R1.4 OCCc1[n]cccc1Br Amb22896751 [1,1,0,0,0,0|2,0,0]=4 3295 B10R1.4 OCCc1c[n]ccc1Cl Amb24364650 [1,1,0,0,0,0|2,0,0]=4 3296 B10R1.4 OCCc1cc[n]cc1Br Amb24482101 [1,1,0,0,0,0|2,0,0]=4 3297 B10R1.4 OCCc1cc[n]cc1F Amb25776747 [1,1,0,0,0,0|2,0,0]=4 3298 B10R1.4 OCCc1ccc[n]c1F Amb24513826 [1,1,0,0,0,0|2,0,0]=4 3299 B10R1.4 OCCc1ccccc1I Amb22753529 [1,1,0,0,0,0|1,0,0]=3 3300 B10R1.4 OCCc1ccccc1S Amb24672563 [1,1,0,0,0,0|1,0,0]=3 3301 B10R1.4 ONCc1ccc[n]c1Cl Amb21847006 [1,1,0,0,0,0|2,0,0]=4 3302 B10R1.4 ONCc1ccccc1Br Amb23449448 [1,1,0,0,0,0|1,0,0]=3 3303 B10R1.4 ONCc1ccccc1Cl Amb25729506 [1,1,0,0,0,0|1,0,0]=3 3304 B10R1.4 Oc1ccc[n]c1CCO Amb24062095 [1,1,0,0,0,0|2,0,0]=4 3305 B10R1.4 Oc1ccccc1CCBr Amb18130684 [1,1,0,0,0,0|1,0,0]=3 3306 B10R1.4 Oc1ccccc1CCCl Amb25790019 [1,1,0,0,0,0|1,0,0]=3 3307 B10R1.4 Oc1ccccc1CCF Amb25768394 [1,1,0,0,0,0|1,0,0]=3 3308 B10R1.4 Oc1ccccc1CCI Amb25208761 [1,1,0,0,0,0|1,0,0]=3 3309 B10R1.4 Oc1ccccc1CCS Amb24362789 [1,1,0,0,0,0|1,0,0]=3 3310 B10R1.4 Oc1ccccc1CNO Amb25128279 [1,1,0,0,0,0|1,0,0]=3 3311 B10R1.4 Oc1ccccc1OCS Amb25070463 [1,1,0,0,0,0|2,0,0]=4 3312 B10R1.4 SCCc1ccccc1Br Amb25851259 [1,1,0,0,0,0|1,0,0]=3 3313 B10R1.4 SCCc1ccccc1C Amb17399938 [1,1,0,0,0,0|1,0,0]=3 3314 B10R1.4 SCCc1ccccc1Cl Amb17400374 [1,1,0,0,0,0|1,0,0]=3 3315 B10R1.4 SCCc1ccccc1F Amb17400004 [1,1,0,0,0,0|1,0,0]=3 3316 B10R1.4 SCCc1ccccc1I Amb24089655 [1,1,0,0,0,0|1,0,0]=3 3317 B10R1.4 [NH3+]OCc1ccccc1Br Amb2414824 [1,1,0,0,0,0|1,0,1]=4 3318 B10R1.4 [NH3+]OCc1ccccc1Cl Amb2437206 [1,1,0,0,0,0|1,0,1]=4 3319 B10R1.10 BrCCc1cc(I)ccc1 Amb25137377 [1,1,0,0,0,0|1,0,0]=3 3320 B10R1.10 Br[Zn]Cc1cccc(I)c1 Amb22000468 [1,1,0,0,0,0|2,0,0]=4 3321 B10R1.10 Brc1c[n]cc(CCBr)c1 Amb25147780 [1,1,0,0,0,0|2,0,0]=4 3322 B10R1.10 Brc1cccc(CCBr)c1 Amb18048758 [1,1,0,0,0,0|1,0,0]=3 3323 B10R1.10 Brc1cccc(C[Mg]Br)c1 Amb22000537 [1,1,0,0,0,0|2,0,0]=4 3324 B10R1.10 Brc1cccc(C[Zn]Br)c1 Amb22000431 [1,1,0,0,0,0|2,0,0]=4 3325 B10R1.10 C=CCc1cccc(N)c1 Amb25147344 [1,1,0,0,0,0|1,0,1]=4 3326 B10R1.10 C=CCc1cccc(O)c1 Amb22735821 [1,1,0,0,0,0|1,0,1]=4 3327 B10R1.10 CCCC1=CC(=O)C=CO1 Amb25262571 [1,1,0,0,0,0|2,0,0]=4 3328 B10R1.10 CCCC1=CC=CC(=S)N1 Amb25081453 [1,1,0,0,0,0|2,0,0]=4 3329 B10R1.10 CCC[n+]1cc(C)ccc1 Amb24451271 [1,1,0,0,0,0|2,0,0]=4 3330 B10R1.10 CCC[n+]1cc(O)ccc1 Amb25134204 [1,1,0,0,0,0|2,0,0]=4 3331 B10R1.10 CCCc1cc(Br)c[n]c1 Amb20617637 [1,1,0,0,0,0|2,0,0]=4 3332 B10R1.10 CCCc1cc(Br)ccc1 Amb25736130 [1,1,0,0,0,0|1,0,0]=3 3333 B10R1.10 CCCc1cc(Br)ccn1 Amb10599773 [1,1,0,0,0,0|2,0,0]=4 3334 B10R1.10 CCCc1cc(Cl)c[n]c1 Amb20620848 [1,1,0,0,0,0|2,0,0]=4 3335 B10R1.10 CCCc1cc(Cl)cc[n]1 Amb22756169 [1,1,0,0,0,0|2,0,0]=4 3336 B10R1.10 CCCc1cc(F)cc[n]1 Amb24318797 [1,1,0,0,0,0|2,0,0]=4 3337 B10R1.10 CCCc1cc(F)ccc1 Amb22235098 [1,1,0,0,0,0|1,0,0]=3 3338 B10R1.10 CCCc1cc(N)[n]cc1 Amb22491555 [1,1,0,0,0,0|2,0,0]=4 3339 B10R1.10 CCCc1cc(N)c[n]c1 Amb18832432 [1,1,0,0,0,0|2,0,0]=4 3340 B10R1.10 CCCc1cc(N)ccc1 Amb18643014 [1,1,0,0,0,0|1,0,0]=3 3341 B10R1.10 CCCc1cc(N)ccn1 Amb10599774 [1,1,0,0,0,0|2,0,0]=4 3342 B10R1.10 CCCc1cc(O)c[n]c1 Amb20617709 [1,1,0,0,0,0|2,0,0]=4 3343 B10R1.10 CCCc1cc(O)ccn1 Amb10599775 [1,1,0,0,0,0|2,0,0]=4 3344 B10R1.10 CCCc1cccc(F)[n]1 Amb24319133 [1,1,0,0,0,0|2,0,0]=4 3345 B10R1.10 CCCc1cccc(n1)Br Amb10600122 [1,1,0,0,0,0|2,0,0]=4 3346 B10R1.10 CCCc1cccc(n1)O Amb10600153 [1,1,0,0,0,0|2,0,0]=4 3347 B10R1.10 CCCc1ccnc(c1)Br Amb10599856 [1,1,0,0,0,0|2,0,0]=4 3348 B10R1.10 CCCc1ccnc(c1)O Amb10599858 [1,1,0,0,0,0|2,0,0]=4 3349 B10R1.10 CCNc1cc(O)ccc1 Amb22168804 [1,1,0,0,0,0|2,0,0]=4 3350 B10R1.10 CCNc1cccc(c1)F Amb10609458 [1,1,0,0,0,0|2,0,0]=4 3351 B10R1.10 CCOc1cccc(Cl)c1 Amb20242486 [1,1,0,0,0,0|2,0,0]=4 3352 B10R1.10 CCOc1cccc(I)c1 Amb19196001 [1,1,0,0,0,0|2,0,0]=4 3353 B10R1.10 CCOc1cccc(c1)N Amb1124598 [1,1,0,0,0,0|2,0,0]=4 3354 B10R1.10 CCOc1cccc(c1)S Amb10070967 [1,1,0,0,0,0|2,0,0]=4 3355 B10R1.10 CCSc1cccc(F)c1 Amb25063729 [1,1,0,0,0,0|2,0,0]=4 3356 B10R1.10 CCSc1cccc(I)c1 Amb25162722 [1,1,0,0,0,0|2,0,0]=4 3357 B10R1.10 CCSc1cccc(N)c1 Amb18950176 [1,1,0,0,0,0|2,0,0]=4 3358 B10R1.10 CCSc1cccc(O)c1 Amb18644674 [1,1,0,0,0,0|2,0,0]=4 3359 B10R1.10 CCSc1cccc(c1)Br Amb10067418 [1,1,0,0,0,0|2,0,0]=4 3360 B10R1.10 CNCC=1C=CNC(=O)C1 Amb24480892 [1,1,0,0,0,0|2,0,0]=4 3361 B10R1.10 CNCc1c[n]cc(Cl)c1 Amb25794074 [1,1,0,0,0,0|2,0,0]=4 3362 B10R1.10 CNCc1c[n]cc(F)c1 Amb25146397 [1,1,0,0,0,0|2,0,0]=4 3363 B10R1.10 CNCc1cc(Br)cc[n]1 Amb22388571 [1,1,0,0,0,0|2,0,0]=4 3364 B10R1.10 CNCc1cc(Cl)cc[n]1 Amb22728627 [1,1,0,0,0,0|2,0,0]=4 3365 B10R1.10 CNCc1cc(F)cc[n]1 Amb25749043 [1,1,0,0,0,0|2,0,0]=4 3366 B10R1.10 CNCc1cc(N)cc[n]1 Amb25062940 [1,1,0,0,0,0|2,0,0]=4 3367 B10R1.10 CNCc1cc[n]c(Br)c1 Amb21861694 [1,1,0,0,0,0|2,0,0]=4 3368 B10R1.10 CNCc1cc[n]c(Br)c1 Amb22293882 [1,1,0,0,0,0|2,0,0]=4 3369 B10R1.10 CNCc1cc[n]c(N)c1 Amb24099580 [1,1,0,0,0,0|2,0,0]=4 3370 B10R1.10 CNCc1cccc(Br)c1 Amb17935918 [1,1,0,0,0,0|1,0,0]=3 3371 B10R1.10 CNCc1cccc(Cl)[n]1 Amb24340482 [1,1,0,0,0,0|2,0,0]=4 3372 B10R1.10 CNCc1cccc(Cl)c1 Amb19958745 [1,1,0,0,0,0|1,0,0]=3 3373 B10R1.10 CNCc1cccc(I)c1 Amb23569027 [1,1,0,0,0,0|1,0,0]=3 3374 B10R1.10 CNCc1cccc(O)c1 Amb19115406 [1,1,0,0,0,0|1,0,0]=3 3375 B10R1.10 CNCc1cccc(c1)Br Amb1114712 [1,1,0,0,0,0|1,0,0]=3 3376 B10R1.10 CNCc1cccc(c1)C Amb1116082 [1,1,0,0,0,0|1,0,0]=3 3377 B10R1.10 CNCc1cccc(c1)Cl Amb1648830 [1,1,0,0,0,0|1,0,0]=3 3378 B10R1.10 CNCc1cccc(c1)F Amb1647905 [1,1,0,0,0,0|1,0,0]=3 3379 B10R1.10 CNCc1cccc(c1)O Amb1131158 [1,1,0,0,0,0|1,0,0]=3 3380 B10R1.10 CNCc1ccnc(c1)C Amb10607835 [1,1,0,0,0,0|2,0,0]=4 3381 B10R1.10 CNCc1nccc(c1)C Amb16230499 [1,1,0,0,0,0|2,0,0]=4 3382 B10R1.10 COCc1cccc(Br)c1 Amb18320155 [1,1,0,0,0,0|2,0,0]=4 3383 B10R1.10 COCc1cccc(Cl)c1 Amb24092696 [1,1,0,0,0,0|2,0,0]=4 3384 B10R1.10 COCc1cccc(F)c1 Amb20241023 [1,1,0,0,0,0|2,0,0]=4 3385 B10R1.10 COCc1cccc(I)c1 Amb24478076 [1,1,0,0,0,0|2,0,0]=4 3386 B10R1.10 COCc1cccc(O)c1 Amb19301751 [1,1,0,0,0,0|2,0,0]=4 3387 B10R1.10 CSCc1cccc(Br)c1 Amb22058705 [1,1,0,0,0,0|2,0,0]=4 3388 B10R1.10 CSCc1cccc(N)c1 Amb18951026 [1,1,0,0,0,0|2,0,0]=4 3389 B10R1.10 CSCc1cccc(O)c1 Amb23443323 [1,1,0,0,0,0|2,0,0]=4 3390 B10R1.10 C[n+]1cc(CCF)ccc1 Amb24759041 [1,1,0,0,0,0|2,0,0]=4 3391 B10R1.10 Cc1[n]c(CCN)cc[n]1 Amb18287239 [1,1,0,0,0,0|2,0,0]=4 3392 B10R1.10 Cc1[n]c(CNN)cc[n]1 Amb23586398 [1,1,0,0,0,0|2,0,0]=4 3393 B10R1.10 Cc1c[n+](CCF)ccc1 Amb25762734 [1,1,0,0,0,0|2,0,0]=4 3394 B10R1.10 Cc1c[n]cc(CNC)c1 Amb24353440 [1,1,0,0,0,0|2,0,0]=4 3395 B10R1.10 Cc1cc(CCBr)c[n]c1 Amb24562207 [1,1,0,0,0,0|2,0,0]=4 3396 B10R1.10 Cc1cc(CCCl)[n]cc1 Amb24098630 [1,1,0,0,0,0|2,0,0]=4 3397 B10R1.10 Cc1cc(CCCl)c[n]c1 Amb25032253 [1,1,0,0,0,0|2,0,0]=4 3398 B10R1.10 Cc1cc(CCCl)ccc1 Amb18181942 [1,1,0,0,0,0|1,0,0]=3 3399 B10R1.10 Cc1cc(CCN)[n]cc1 Amb22899172 [1,1,0,0,0,0|1,0,0]=3 3400 B10R1.10 Cc1cc(CCN)c[n]c1 Amb18203095 [1,1,0,0,0,0|1,0,0]=3 3401 B10R1.10 Cc1cc(CCN)cc[n]1 Amb18203094 [1,1,0,0,0,0|1,0,0]=3 3402 B10R1.10 Cc1cc(CCN)ncc1 Amb1995201 [1,1,0,0,0,0|1,0,0]=3 3403 B10R1.10 Cc1cc(CCN)ncn1 Amb17072912 [1,1,0,0,0,0|2,0,0]=4 3404 B10R1.10 Cc1cc(CCO)[n]cc1 Amb25679639 [1,1,0,0,0,0|2,0,0]=4 3405 B10R1.10 Cc1cc(CCO)cc[n]1 Amb24568116 [1,1,0,0,0,0|2,0,0]=4 3406 B10R1.10 Cc1cc(CNN)c[n]c1 Amb25047084 [1,1,0,0,0,0|1,0,0]=3 3407 B10R1.10 Cc1cc(CNN)ccc1 Amb19890111 [1,1,0,0,0,0|0,0,0]=2 3408 B10R1.10 Cc1cc(CNO)ccc1 Amb25784359 [1,1,0,0,0,0|1,0,0]=3 3409 B10R1.10 Cc1cc(CON)c[n]c1 Amb24626236 [1,1,0,0,0,0|2,0,0]=4 3410 B10R1.10 Cc1cc(C[Zn]Cl)ccc1 Amb22000456 [1,1,0,0,0,0|2,0,0]=4 3411 B10R1.10 Cc1cc(\C=N\N)ccc1 Amb25369227 [1,1,0,0,0,0|0,0,2]=4 3412 B10R1.10 Cc1cc(ccc1)SCCl Amb24423887 [1,1,0,0,0,0|2,0,0]=4 3413 B10R1.10 Cc1cc[n]c(CCC)c1 Amb25844521 [1,1,0,0,0,0|2,0,0]=4 3414 B10R1.10 Cc1cccc(CCC)[n]1 Amb24065788 [1,1,0,0,0,0|2,0,0]=4 3415 B10R1.10 Cc1cccc(CCC)c1 Amb22232362 [1,1,0,0,0,0|1,0,0]=3 3416 B10R1.10 Cc1cccc(CCCl)[n]1 Amb24090268 [1,1,0,0,0,0|2,0,0]=4 3417 B10R1.10 Cc1cccc(CCCl)[n]1 Amb24480495 [1,1,0,0,0,0|2,0,0]=4 3418 B10R1.10 Cc1cccc(CCS)[n]1 Amb24388552 [1,1,0,0,0,0|2,0,0]=4 3419 B10R1.10 Cc1cccc(CNC)[n]1 Amb19374864 [1,1,0,0,0,0|2,0,0]=4 3420 B10R1.10 Cc1cccc(CON)[n]1 Amb24538057 [1,1,0,0,0,0|2,0,0]=4 3421 B10R1.10 Cc1cccc(CSC)c1 Amb24416576 [1,1,0,0,0,0|2,0,0]=4 3422 B10R1.10 Cc1cccc(c1)SCC Amb25328608 [1,1,0,0,0,0|2,0,0]=4 3423 B10R1.10 Cc1cccc(n1)CCN Amb1995202 [1,1,0,0,0,0|1,0,0]=3 3424 B10R1.10 ClCCc1cc(Br)ccc1 Amb24502263 [1,1,0,0,0,0|1,0,0]=3 3425 B10R1.10 ClCOc1cccc(I)c1 Amb25272062 [1,1,0,0,0,0|2,0,0]=4 3426 B10R1.10 ClCSc1cccc(Br)c1 Amb24479383 [1,1,0,0,0,0|2,0,0]=4 3427 B10R1.10 Clc1cccc(CCCl)c1 Amb18185798 [1,1,0,0,0,0|1,0,0]=3 3428 B10R1.10 Clc1cccc(C[Mg]Cl)c1 Amb19928782 [1,1,0,0,0,0|2,0,0]=4 3429 B10R1.10 Clc1cccc(C[Zn]Cl)c1 Amb22000428 [1,1,0,0,0,0|2,0,0]=4 3430 B10R1.10 Clc1cccc(c1)OCCl Amb24482267 [1,1,0,0,0,0|2,0,0]=4 3431 B10R1.10 FCCc1cccc(Br)[n]1 Amb25228145 [1,1,0,0,0,0|2,0,0]=4 3432 B10R1.10 Fc1cc(CCBr)c[n]c1 Amb25210409 [1,1,0,0,0,0|2,0,0]=4 3433 B10R1.10 Fc1cc(CCCl)c[n]c1 Amb18797759 [1,1,0,0,0,0|2,0,0]=4 3434 B10R1.10 Fc1cc(CCI)ccc1 Amb25766475 [1,1,0,0,0,0|1,0,0]=3 3435 B10R1.10 Fc1cc(ccc1)OCCl Amb24401502 [1,1,0,0,0,0|2,0,0]=4 3436 B10R1.10 Fc1cccc(C[Mg]Cl)c1 Amb17672020 [1,1,0,0,0,0|2,0,0]=4 3437 B10R1.10 Fc1cccc(C[Zn]Cl)c1 Amb17938200 [1,1,0,0,0,0|2,0,0]=4 3438 B10R1.10 N#CCc1cccc(c1)Br Amb1138679 [1,1,0,0,0,0|0,0,2]=4 3439 B10R1.10 N#CCc1cccc(c1)Cl Amb1651451 [1,1,0,0,0,0|0,0,2]=4 3440 B10R1.10 N#CCc1cccc(c1)N Amb1215231 [1,1,0,0,0,0|0,0,2]=4 3441 B10R1.10 NCCC1=CC(=O)NC=C1 Amb22277083 [1,1,0,0,0,0|1,0,0]=3 3442 B10R1.10 NCCC1=CC(=O)NC=C1 Amb22490205 [1,1,0,0,0,0|1,0,0]=3 3443 B10R1.10 NCCC1=CC(=O)NC=C1 Amb22899249 [1,1,0,0,0,0|1,0,0]=3 3444 B10R1.10 NCCC1=CC=CC(=O)N1 Amb22492307 [1,1,0,0,0,0|1,0,0]=3 3445 B10R1.10 NCCC1=CC=CC(=O)N1 Amb22587551 [1,1,0,0,0,0|1,0,0]=3 3446 B10R1.10 NCC[n+]1cc(O)ccc1 Amb24427344 [1,1,0,0,0,0|1,0,0]=3 3447 B10R1.10 NCCc1[n]c(Cl)cc[n]1 Amb20076005 [1,1,0,0,0,0|2,0,0]=4 3448 B10R1.10 NCCc1[n]c(O)cc[n]1 Amb18223319 [1,1,0,0,0,0|2,0,0]=4 3449 B10R1.10 NCCc1c[n](=O)ccc1 Amb20621202 [1,1,0,0,0,0|1,0,0]=3 3450 B10R1.10 NCCc1c[n]cc(Cl)[n]1 Amb24465186 [1,1,0,0,0,0|2,0,0]=4 3451 B10R1.10 NCCc1cc(Br)cc[n]1 Amb25839315 [1,1,0,0,0,0|1,0,0]=3 3452 B10R1.10 NCCc1cc(Br)ccc1 Amb22900947 [1,1,0,0,0,0|0,0,0]=2 3453 B10R1.10 NCCc1cc(Cl)[n]c[n]1 Amb22411589 [1,1,0,0,0,0|2,0,0]=4 3454 B10R1.10 NCCc1cc(Cl)[n]cc1 Amb22751657 [1,1,0,0,0,0|1,0,0]=3 3455 B10R1.10 NCCc1cc(Cl)ccc1 Amb22490605 [1,1,0,0,0,0|0,0,0]=2 3456 B10R1.10 NCCc1cc(F)c[n]c1 Amb18286591 [1,1,0,0,0,0|1,0,0]=3 3457 B10R1.10 NCCc1cc(I)ccc1 Amb25096322 [1,1,0,0,0,0|0,0,0]=2 3458 B10R1.10 NCCc1cc(O)[n]c[n]1 Amb18223356 [1,1,0,0,0,0|2,0,0]=4 3459 B10R1.10 NCCc1cc(O)c[n]c1 Amb25744014 [1,1,0,0,0,0|1,0,0]=3 3460 B10R1.10 NCCc1cc(O)cc[n]1 Amb24479633 [1,1,0,0,0,0|1,0,0]=3 3461 B10R1.10 NCCc1cc[n]c(Cl)[n]1 Amb22388553 [1,1,0,0,0,0|2,0,0]=4 3462 B10R1.10 NCCc1cc[n]c(O)[n]1 Amb25377264 [1,1,0,0,0,0|2,0,0]=4 3463 B10R1.10 NCCc1cccc(Br)[n]1 Amb21856983 [1,1,0,0,0,0|1,0,0]=3 3464 B10R1.10 NCCc1cccc(Br)[n]1 Amb21857736 [1,1,0,0,0,0|1,0,0]=3 3465 B10R1.10 NCCc1cccc(Cl)[n]1 Amb21857720 [1,1,0,0,0,0|1,0,0]=3 3466 B10R1.10 NCCc1cccc(Cl)[n]1 Amb21857735 [1,1,0,0,0,0|1,0,0]=3 3467 B10R1.10 NCCc1cccc(F)[n]1 Amb20669134 [1,1,0,0,0,0|1,0,0]=3 3468 B10R1.10 NCCc1cccc(c1)C Amb1126573 [1,1,0,0,0,0|0,0,0]=2 3469 B10R1.10 NCCc1cccc(c1)C Amb13952645 [1,1,0,0,0,0|0,0,0]=2 3470 B10R1.10 NCCc1cccc(c1)Cl Amb1212556 [1,1,0,0,0,0|0,0,0]=2 3471 B10R1.10 NCCc1cccc(c1)F Amb1216921 [1,1,0,0,0,0|0,0,0]=2 3472 B10R1.10 NCCc1cccc(n1)N Amb1100181 [1,1,0,0,0,0|1,0,0]=3 3473 B10R1.10 NCCc1ccnc(c1)O Amb10576299 [1,1,0,0,0,0|1,0,0]=3 3474 B10R1.10 NCCc1nccc(n1)C Amb17074352 [1,1,0,0,0,0|2,0,0]=4 3475 B10R1.10 NNCC=1C=CNC(=O)C1 Amb25775281 [1,1,0,0,0,0|1,0,0]=3 3476 B10R1.10 NNCc1c[n]cc(Cl)c1 Amb25114868 [1,1,0,0,0,0|1,0,0]=3 3477 B10R1.10 NNCc1cccc(Br)c1 Amb19893263 [1,1,0,0,0,0|0,0,0]=2 3478 B10R1.10 NNCc1cccc(Br)c1 Amb20667747 [1,1,0,0,0,0|0,0,0]=2 3479 B10R1.10 NNCc1cccc(F)c1 Amb19893257 [1,1,0,0,0,0|0,0,0]=2 3480 B10R1.10 NNCc1cccc(F)c1 Amb20669586 [1,1,0,0,0,0|0,0,0]=2 3481 B10R1.10 NNCc1cccc(I)c1 Amb25355316 [1,1,0,0,0,0|0,0,0]=2 3482 B10R1.10 NNCc1cccc(c1)Br Amb1119246 [1,1,0,0,0,0|0,0,0]=2 3483 B10R1.10 NNCc1cccc(c1)C Amb1116333 [1,1,0,0,0,0|0,0,0]=2 3484 B10R1.10 NNCc1cccc(c1)Cl Amb1111798 [1,1,0,0,0,0|0,0,0]=2 3485 B10R1.10 NNCc1cccc(c1)Cl Amb13949121 [1,1,0,0,0,0|0,0,0]=2 3486 B10R1.10 NNCc1cccc(c1)F Amb1121411 [1,1,0,0,0,0|0,0,0]=2 3487 B10R1.10 NNCc1ccnc(c1)C Amb13883480 [1,1,0,0,0,0|1,0,0]=3 3488 B10R1.10 NOCc1c[n]cc(Br)c1 Amb25788255 [1,1,0,0,0,0|2,0,0]=4 3489 B10R1.10 NOCc1cc[n]c(Cl)c1 Amb22396234 [1,1,0,0,0,0|2,0,0]=4 3490 B10R1.10 NOCc1cccc(Br)c1 Amb22231355 [1,1,0,0,0,0|1,0,0]=3 3491 B10R1.10 NOCc1cccc(Cl)[n]1 Amb24640482 [1,1,0,0,0,0|2,0,0]=4 3492 B10R1.10 NOCc1cccc(Cl)c1 Amb19889790 [1,1,0,0,0,0|1,0,0]=3 3493 B10R1.10 NOCc1cccc(F)[n]1 Amb24646721 [1,1,0,0,0,0|2,0,0]=4 3494 B10R1.10 NOCc1cccc(F)c1 Amb19883930 [1,1,0,0,0,0|1,0,0]=3 3495 B10R1.10 NOCc1cccc(c1)Br Amb17091429 [1,1,0,0,0,0|1,0,0]=3 3496 B10R1.10 NOCc1cccc(c1)C Amb17091425 [1,1,0,0,0,0|1,0,0]=3 3497 B10R1.10 NOCc1cccc(c1)Cl Amb17091428 [1,1,0,0,0,0|1,0,0]=3 3498 B10R1.10 NOCc1cccc(c1)F Amb17091426 [1,1,0,0,0,0|1,0,0]=3 3499 B10R1.10 N\N=C\c1cccc(Br)c1 Amb25119700 [1,1,0,0,0,0|0,0,2]=4 3500 B10R1.10 Nc1[n]c(CCN)cc[n]1 Amb18203035 [1,1,0,0,0,0|2,0,0]=4 3501 B10R1.10 Nc1c[n+](CCS)ccc1 Amb24695154 [1,1,0,0,0,0|2,0,0]=4 3502 B10R1.10 Nc1cc(CC#N)ccc1 Amb21857787 [1,1,0,0,0,0|0,0,2]=4 3503 B10R1.10 Nc1cc(CC=O)ccc1 Amb25147333 [1,1,0,0,0,0|1,0,1]=4 3504 B10R1.10 Nc1cc(CCCl)ccc1 Amb24748802 [1,1,0,0,0,0|1,0,0]=3 3505 B10R1.10 Nc1cc(CCN)cc[n]1 Amb25146265 [1,1,0,0,0,0|1,0,0]=3 3506 B10R1.10 Nc1cc(CCO)[n]cc1 Amb25027828 [1,1,0,0,0,0|2,0,0]=4 3507 B10R1.10 Nc1cc(CCO)cc[n]1 Amb25146377 [1,1,0,0,0,0|2,0,0]=4 3508 B10R1.10 Nc1cc(CCO)ccc1 Amb21857105 [1,1,0,0,0,0|1,0,0]=3 3509 B10R1.10 Nc1cc(CCS)ccc1 Amb22728749 [1,1,0,0,0,0|1,0,0]=3 3510 B10R1.10 Nc1cc(CON)cc[n]1 Amb25375152 [1,1,0,0,0,0|2,0,0]=4 3511 B10R1.10 Nc1cc[n]c(CCN)[n]1 Amb18203023 [1,1,0,0,0,0|2,0,0]=4 3512 B10R1.10 Nc1cccc(CCN)[n]1 Amb21959697 [1,1,0,0,0,0|1,0,0]=3 3513 B10R1.10 Nc1cccc(CCN)c1 Amb22733355 [1,1,0,0,0,0|0,0,0]=2 3514 B10R1.10 Nc1cccc(CCO)[n]1 Amb24401500 [1,1,0,0,0,0|2,0,0]=4 3515 B10R1.10 Nc1cccc(CCS)[n]1 Amb25835198 [1,1,0,0,0,0|2,0,0]=4 3516 B10R1.10 Nc1cccc(c1)\C=N\N Amb25239736 [1,1,0,0,0,0|0,0,2]=4 3517 B10R1.10 O=C1C=C(CCCl)C=CN1 Amb25097138 [1,1,0,0,0,0|2,0,0]=4 3518 B10R1.10 O=C1C=C(CCCl)C=CO1 Amb25060579 [1,1,0,0,0,0|2,0,0]=4 3519 B10R1.10 O=CCc1cccc(F)c1 Amb19929928 [1,1,0,0,0,0|1,0,1]=4 3520 B10R1.10 O=CCc1cccc(c1)Br Amb16230449 [1,1,0,0,0,0|1,0,1]=4 3521 B10R1.10 O=CCc1cccc(c1)C Amb16230453 [1,1,0,0,0,0|1,0,1]=4 3522 B10R1.10 O=CCc1cccc(c1)Cl Amb10844835 [1,1,0,0,0,0|1,0,1]=4 3523 B10R1.10 O=CCc1cccc(c1)O Amb17089543 [1,1,0,0,0,0|1,0,1]=4 3524 B10R1.10 OCC[n+]1cc(S)ccc1 Amb25831912 [1,1,0,0,0,0|2,0,0]=4 3525 B10R1.10 OCC[n+]1cccc(c1)C Amb10553046 [1,1,0,0,0,0|2,0,0]=4 3526 B10R1.10 OCCc1cc(Br)[n]cc1 Amb25773220 [1,1,0,0,0,0|2,0,0]=4 3527 B10R1.10 OCCc1cc(Br)c[n]c1 Amb25114229 [1,1,0,0,0,0|2,0,0]=4 3528 B10R1.10 OCCc1cc(Br)cc[n]1 Amb24065849 [1,1,0,0,0,0|2,0,0]=4 3529 B10R1.10 OCCc1cc(Cl)[n]cc1 Amb22754705 [1,1,0,0,0,0|2,0,0]=4 3530 B10R1.10 OCCc1cc(F)cc[n]1 Amb25032462 [1,1,0,0,0,0|2,0,0]=4 3531 B10R1.10 OCCc1cc(I)ccc1 Amb24524319 [1,1,0,0,0,0|1,0,0]=3 3532 B10R1.10 OCCc1cccc(F)[n]1 Amb25076783 [1,1,0,0,0,0|2,0,0]=4 3533 B10R1.10 OCCc1cccc(n1)Br Amb13883481 [1,1,0,0,0,0|2,0,0]=4 3534 B10R1.10 OCNc1cccc(Cl)c1 Amb25804223 [1,1,0,0,0,0|2,0,0]=4 3535 B10R1.10 ONCc1cccc(Br)[n]1 Amb24647347 [1,1,0,0,0,0|2,0,0]=4 3536 B10R1.10 ONCc1cccc(Br)c1 Amb23449439 [1,1,0,0,0,0|1,0,0]=3 3537 B10R1.10 ONCc1cccc(Cl)c1 Amb25210787 [1,1,0,0,0,0|1,0,0]=3 3538 B10R1.10 Oc1c[n]cc(CCO)c1 Amb24757058 [1,1,0,0,0,0|2,0,0]=4 3539 B10R1.10 Oc1cc(CCBr)ccc1 Amb18130690 [1,1,0,0,0,0|1,0,0]=3 3540 B10R1.10 Oc1cc(ccc1)OCBr Amb24099888 [1,1,0,0,0,0|2,0,0]=4 3541 B10R1.10 Oc1cc(ccc1)SCCl Amb24368844 [1,1,0,0,0,0|2,0,0]=4 3542 B10R1.10 Oc1cc[n]c(CCO)c1 Amb24544455 [1,1,0,0,0,0|2,0,0]=4 3543 B10R1.10 Oc1cccc(CNO)c1 Amb24524626 [1,1,0,0,0,0|1,0,0]=3 3544 B10R1.10 Oc1cccc(c1)OCO Amb25712897 [1,1,0,0,0,0|2,0,0]=4 3545 B10R1.10 SCCc1cccc(c1)Br Amb17404678 [1,1,0,0,0,0|1,0,0]=3 3546 B10R1.10 SCCc1cccc(c1)C Amb17399939 [1,1,0,0,0,0|1,0,0]=3 3547 B10R1.10 SCCc1cccc(c1)Cl Amb17400375 [1,1,0,0,0,0|1,0,0]=3 3548 B10R1.10 SCCc1cccc(c1)F Amb17400006 [1,1,0,0,0,0|1,0,0]=3 3549 B10R1.10 Sc1cc(CCCl)ccc1 Amb24627571 [1,1,0,0,0,0|1,0,0]=3 3550 B10R1.10 [NH3+]OCc1cccc(c1)Br Amb2444298 [1,1,0,0,0,0|1,0,1]=4 3551 B10R1.10 [NH3+]OCc1cccc(c1)Cl Amb2405661 [1,1,0,0,0,0|1,0,1]=4 3552 B10R1.10 [NH3+]OCc1cccc(c1)F Amb2424153 [1,1,0,0,0,0|1,0,1]=4 3553 B10R1.10 [O-]c1c[n+](CCO)ccc1 Amb24464239 [1,1,0,0,0,0|2,0,0]=4 3554 B10R1.15 BrCC(=O)c1ccccc1 Amb1102084 [1,1,0,0,0,0|1,0,1]=4 3555 B10R1.15 BrCC(c1ccccc1)O Amb17206105 [1,1,0,0,0,0|1,0,0]=3 3556 B10R1.15 Br[13CH2]C(Br)c1ccccc1 Amb22367266 [1,1,0,0,0,0|1,0,0]=3 3557 B10R1.15 C#CC(N)c1ccccc1 Amb23504019 [1,1,0,0,0,0|1,0,1]=4 3558 B10R1.15 C#C[C@@H](Cl)c1ccccc1 Amb25114793 [1,1,0,0,0,0|1,0,1]=4 3559 B10R1.15 C#C[C@H](N)c1ccccc1 Amb25757944 [1,1,0,0,0,0|1,0,1]=4 3560 B10R1.15 C#C[C@H](O)c1ccccc1 Amb22360907 [1,1,0,0,0,0|1,0,1]=4 3561 B10R1.15 C=CC(N)c1ccccc1 Amb18642931 [1,1,0,0,0,0|1,0,1]=4 3562 B10R1.15 C=CC(N)c1ccccc1 Amb22584092 [1,1,0,0,0,0|1,0,1]=4 3563 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [1,1,0,0,0,0|1,0,1]=4 3564 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [1,1,0,0,0,0|1,0,1]=4 3565 B10R1.15 C=C[C@H](O)c1ccccc1 Amb22348430 [1,1,0,0,0,0|1,0,1]=4 3566 B10R1.15 CC(C#C)c1ccccc1 Amb24106607 [1,1,0,0,0,0|1,0,1]=4 3567 B10R1.15 CC(CCl)c1c[n]ccc1 Amb24085112 [1,1,0,0,0,0|2,0,0]=4 3568 B10R1.15 CC(CCl)c1cccc[n]1 Amb25791960 [1,1,0,0,0,0|2,0,0]=4 3569 B10R1.15 CC(CN)c1c[n]c[n]c1 Amb18251160 [1,1,0,0,0,0|2,0,0]=4 3570 B10R1.15 CC(CN)c1c[n]cc[n]1 Amb18832279 [1,1,0,0,0,0|2,0,0]=4 3571 B10R1.15 CC(CN)c1ccccc1 Amb19958781 [1,1,0,0,0,0|0,0,0]=2 3572 B10R1.15 CC(CO)c1cc[n]cc1 Amb24480432 [1,1,0,0,0,0|2,0,0]=4 3573 B10R1.15 CC(CO)c1cccc[n]1 Amb22896757 [1,1,0,0,0,0|2,0,0]=4 3574 B10R1.15 CC(NN)c1[n]ccc[n]1 Amb25315935 [1,1,0,0,0,0|2,0,0]=4 3575 B10R1.15 CC(NN)c1c[n]cc[n]1 Amb24615634 [1,1,0,0,0,0|2,0,0]=4 3576 B10R1.15 CC(NN)c1c[n]ccc1 Amb21961486 [1,1,0,0,0,0|1,0,0]=3 3577 B10R1.15 CC(NN)c1cc[n]c[n]1 Amb25088979 [1,1,0,0,0,0|2,0,0]=4 3578 B10R1.15 CC(NN)c1cc[n]cc1 Amb21961485 [1,1,0,0,0,0|1,0,0]=3 3579 B10R1.15 CC(NN)c1cccc[n]1 Amb21961484 [1,1,0,0,0,0|1,0,0]=3 3580 B10R1.15 CC(ON)c1cc[n]cc1 Amb22397090 [1,1,0,0,0,0|2,0,0]=4 3581 B10R1.15 CC(ON)c1cccc[n]1 Amb22397048 [1,1,0,0,0,0|2,0,0]=4 3582 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [1,1,0,0,0,0|1,0,0]=3 3583 B10R1.15 CC([Zn]Br)c1ccccc1 Amb22000433 [1,1,0,0,0,0|2,0,0]=4 3584 B10R1.15 CC([Zn]Cl)c1ccccc1 Amb22052836 [1,1,0,0,0,0|2,0,0]=4 3585 B10R1.15 CC(c1ccccc1)C#N Amb2387010 [1,1,0,0,0,0|0,0,2]=4 3586 B10R1.15 CCB(N)c1ccccc1 Amb25269618 [1,1,0,0,0,0|2,0,0]=4 3587 B10R1.15 CCB(O)c1ccccc1 Amb25174287 [1,1,0,0,0,0|2,0,0]=4 3588 B10R1.15 CCC(=C)c1ccccc1 Amb22234837 [1,1,0,0,0,0|1,0,1]=4 3589 B10R1.15 CCC(Br)c1c[n]ccc1 Amb24556035 [1,1,0,0,0,0|2,0,0]=4 3590 B10R1.15 CCC(C)c1c[n]ccc1 Amb24690132 [1,1,0,0,0,0|2,0,0]=4 3591 B10R1.15 CCC(Cl)[n+]1ccccc1 Amb24365361 [1,1,0,0,0,0|2,0,0]=4 3592 B10R1.15 CCC(Cl)c1c[n]ccc1 Amb25708334 [1,1,0,0,0,0|2,0,0]=4 3593 B10R1.15 CCC(N)c1cccc[n]1 Amb22587075 [1,1,0,0,0,0|2,0,0]=4 3594 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [1,1,0,0,0,0|1,0,0]=3 3595 B10R1.15 CCC(c1ccccc1)N Amb1108026 [1,1,0,0,0,0|1,0,0]=3 3596 B10R1.15 CCC(c1ccccn1)N Amb10607917 [1,1,0,0,0,0|2,0,0]=4 3597 B10R1.15 CCC(c1cccnc1)N Amb10607957 [1,1,0,0,0,0|2,0,0]=4 3598 B10R1.15 CCC(c1cccnc1)O Amb17231904 [1,1,0,0,0,0|2,0,0]=4 3599 B10R1.15 CCC(c1ccncc1)O Amb16233288 [1,1,0,0,0,0|2,0,0]=4 3600 B10R1.15 CCN(O)c1ccccc1 Amb25223262 [1,1,0,0,0,0|2,0,0]=4 3601 B10R1.15 CCS(=O)c1ccccc1 Amb22234834 [1,1,0,0,0,0|2,0,0]=4 3602 B10R1.15 CCS(=O)c1ccccc1 Amb22500370 [1,1,0,0,0,0|2,0,0]=4 3603 B10R1.15 CC[C@@H](N)c1c[n]ccc1 Amb23401519 [1,1,0,0,0,0|2,0,0]=4 3604 B10R1.15 CC[C@@H](N)c1c[n]ccc1 Amb25805543 [1,1,0,0,0,0|2,0,0]=4 3605 B10R1.15 CC[C@@H](N)c1cc[n]cc1 Amb23401520 [1,1,0,0,0,0|2,0,0]=4 3606 B10R1.15 CC[C@@H](N)c1cc[n]cc1 Amb24744408 [1,1,0,0,0,0|2,0,0]=4 3607 B10R1.15 CC[C@@H](N)c1cccc[n]1 Amb23440390 [1,1,0,0,0,0|2,0,0]=4 3608 B10R1.15 CC[C@@H](N)c1cccc[n]1 Amb25797820 [1,1,0,0,0,0|2,0,0]=4 3609 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [1,1,0,0,0,0|1,0,0]=3 3610 B10R1.15 CC[C@@H](O)c1cccc[n]1 Amb25717055 [1,1,0,0,0,0|2,0,0]=4 3611 B10R1.15 CC[C@H](C)c1cc[n]cc1 Amb24599884 [1,1,0,0,0,0|2,0,0]=4 3612 B10R1.15 CC[C@H](Cl)c1ccccc1 Amb24429104 [1,1,0,0,0,0|1,0,0]=3 3613 B10R1.15 CC[C@H](N)c1c[n]ccc1 Amb25277011 [1,1,0,0,0,0|2,0,0]=4 3614 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [1,1,0,0,0,0|1,0,0]=3 3615 B10R1.15 CC[C@H](O)c1c[n]ccc1 Amb24432697 [1,1,0,0,0,0|2,0,0]=4 3616 B10R1.15 CC[S@@](=O)c1ccccc1 Amb22747460 [1,1,0,0,0,0|2,0,0]=4 3617 B10R1.15 CN(CCl)c1ccccc1 Amb24479224 [1,1,0,0,0,0|2,0,0]=4 3618 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [1,1,0,0,0,0|1,0,1]=4 3619 B10R1.15 CNC(=O)c1ccccc1 Amb1793916 [1,1,0,0,0,0|1,0,1]=4 3620 B10R1.15 CNC(=S)c1ccccc1 Amb10552988 [1,1,0,0,0,0|1,0,1]=4 3621 B10R1.15 CNC(C)c1c[n]ccc1 Amb22587688 [1,1,0,0,0,0|2,0,0]=4 3622 B10R1.15 CNC(C)c1cc[n]cc1 Amb22492289 [1,1,0,0,0,0|2,0,0]=4 3623 B10R1.15 CNC(C)c1cc[n]cc1 Amb22587687 [1,1,0,0,0,0|2,0,0]=4 3624 B10R1.15 CNC(C)c1cccc[n]1 Amb22274428 [1,1,0,0,0,0|2,0,0]=4 3625 B10R1.15 CNC(C)c1cccc[n]1 Amb22587689 [1,1,0,0,0,0|2,0,0]=4 3626 B10R1.15 CNC(c1ccccc1)C Amb1215689 [1,1,0,0,0,0|1,0,0]=3 3627 B10R1.15 CNC(c1ccccn1)C Amb10189608 [1,1,0,0,0,0|2,0,0]=4 3628 B10R1.15 CNC(c1ccccn1)C Amb1115311 [1,1,0,0,0,0|2,0,0]=4 3629 B10R1.15 CNC(c1cccnc1)C Amb10189690 [1,1,0,0,0,0|2,0,0]=4 3630 B10R1.15 CNC(c1cccnc1)C Amb1121577 [1,1,0,0,0,0|2,0,0]=4 3631 B10R1.15 CNC(c1ccncc1)C Amb10189609 [1,1,0,0,0,0|2,0,0]=4 3632 B10R1.15 CNC(c1ccncc1)C Amb1119143 [1,1,0,0,0,0|2,0,0]=4 3633 B10R1.15 CNS(=O)c1ccccc1 Amb24606698 [1,1,0,0,0,0|2,0,0]=4 3634 B10R1.15 CN[C@@H](C)c1cccc[n]1 Amb24744532 [1,1,0,0,0,0|2,0,0]=4 3635 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [1,1,0,0,0,0|1,0,0]=3 3636 B10R1.15 CN[C@@H](C)c1ccccc1 Amb22899444 [1,1,0,0,0,0|1,0,0]=3 3637 B10R1.15 CN[C@@H](c1ccccc1)C Amb10844610 [1,1,0,0,0,0|1,0,0]=3 3638 B10R1.15 CN[C@H](C)c1c[n]ccc1 Amb25084519 [1,1,0,0,0,0|2,0,0]=4 3639 B10R1.15 CN[C@H](C)c1cc[n]cc1 Amb25114028 [1,1,0,0,0,0|2,0,0]=4 3640 B10R1.15 COC(C)c1ccccc1 Amb23568513 [1,1,0,0,0,0|2,0,0]=4 3641 B10R1.15 COC(Cl)c1ccccc1 Amb17940179 [1,1,0,0,0,0|2,0,0]=4 3642 B10R1.15 COC(O)c1ccccc1 Amb25225981 [1,1,0,0,0,0|2,0,0]=4 3643 B10R1.15 CO[C@@H](Cl)c1ccccc1 Amb25108131 [1,1,0,0,0,0|2,0,0]=4 3644 B10R1.15 CPC(O)c1ccccc1 Amb25144461 [1,1,0,0,0,0|1,1,0]=4 3645 B10R1.15 C[C@@H](C=O)c1ccccc1 Amb24399258 [1,1,0,0,0,0|1,0,1]=4 3646 B10R1.15 C[C@@H](CBr)c1ccccc1 Amb25786304 [1,1,0,0,0,0|1,0,0]=3 3647 B10R1.15 C[C@@H](CCl)c1ccccc1 Amb24632311 [1,1,0,0,0,0|1,0,0]=3 3648 B10R1.15 C[C@@H](NN)c1ccccc1 Amb25824988 [1,1,0,0,0,0|0,0,0]=2 3649 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [1,1,0,0,0,0|1,0,0]=3 3650 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [1,1,0,0,0,0|1,0,0]=3 3651 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [1,1,0,0,0,0|1,0,0]=3 3652 B10R1.15 C[C@H](C=O)c1ccccc1 Amb24476962 [1,1,0,0,0,0|1,0,1]=4 3653 B10R1.15 C[C@H](CCl)c1ccccc1 Amb24658260 [1,1,0,0,0,0|1,0,0]=3 3654 B10R1.15 C[C@H](NO)c1cc[n]cc1 Amb24630448 [1,1,0,0,0,0|2,0,0]=4 3655 B10R1.15 C[C@H](NO)c1ccccc1 Amb20670900 [1,1,0,0,0,0|1,0,0]=3 3656 B10R1.15 C[C@H](NO)c1ccccc1 Amb22736688 [1,1,0,0,0,0|1,0,0]=3 3657 B10R1.15 C[SiH](CCl)c1ccccc1 Amb25053449 [1,1,0,0,0,0|1,1,0]=4 3658 B10R1.15 C\C(=C\N)\c1ccccc1 Amb24674165 [1,1,0,0,0,0|0,0,2]=4 3659 B10R1.15 ClC(C#C)c1ccccc1 Amb17670636 [1,1,0,0,0,0|1,0,1]=4 3660 B10R1.15 ClC(C=C)c1ccccc1 Amb17943120 [1,1,0,0,0,0|1,0,1]=4 3661 B10R1.15 ClC(CBr)c1ccccc1 Amb24079929 [1,1,0,0,0,0|1,0,0]=3 3662 B10R1.15 ClCC(Cl)c1cccc[n]1 Amb24652322 [1,1,0,0,0,0|2,0,0]=4 3663 B10R1.15 ClCC(c1ccccc1)C Amb17232147 [1,1,0,0,0,0|1,0,0]=3 3664 B10R1.15 ClCP(Cl)c1ccccc1 Amb25725059 [1,1,0,0,0,0|2,0,0]=4 3665 B10R1.15 ClC[C@@H](c1ccccc1)O Amb16231709 [1,1,0,0,0,0|1,0,0]=3 3666 B10R1.15 ClC[C@@H](c1cccnc1)O Amb16231938 [1,1,0,0,0,0|2,0,0]=4 3667 B10R1.15 ClC[C@H](Cl)c1ccccc1 Amb25131628 [1,1,0,0,0,0|1,0,0]=3 3668 B10R1.15 ClC[SiH](Cl)c1ccccc1 Amb25061252 [1,1,0,0,0,0|1,1,0]=4 3669 B10R1.15 FC(CBr)c1ccccc1 Amb20075900 [1,1,0,0,0,0|1,0,0]=3 3670 B10R1.15 FCC(=O)c1ccccc1 Amb10603600 [1,1,0,0,0,0|1,0,1]=4 3671 B10R1.15 FCC(Br)c1ccccc1 Amb25366148 [1,1,0,0,0,0|1,0,0]=3 3672 B10R1.15 FCC(Cl)c1ccccc1 Amb25361037 [1,1,0,0,0,0|1,0,0]=3 3673 B10R1.15 FCC(c1ccccc1)N Amb2372575 [1,1,0,0,0,0|1,0,0]=3 3674 B10R1.15 N#CC(Cl)c1ccccc1 Amb18787437 [1,1,0,0,0,0|0,0,2]=4 3675 B10R1.15 N#CC(F)c1ccccc1 Amb22747439 [1,1,0,0,0,0|0,0,2]=4 3676 B10R1.15 N#C[C@@H](Br)c1ccccc1 Amb24479015 [1,1,0,0,0,0|0,0,2]=4 3677 B10R1.15 N#C[C@@H](O)c1ccccc1 Amb22744732 [1,1,0,0,0,0|0,0,2]=4 3678 B10R1.15 N#C[C@H](O)c1ccccc1 Amb21618705 [1,1,0,0,0,0|0,0,2]=4 3679 B10R1.15 NC(=NN)c1ccccc1 Amb22488579 [1,1,0,0,0,0|0,0,2]=4 3680 B10R1.15 NC(CBr)c1ccccc1 Amb25690830 [1,1,0,0,0,0|1,0,0]=3 3681 B10R1.15 NC(CI)c1ccccc1 Amb24404731 [1,1,0,0,0,0|1,0,0]=3 3682 B10R1.15 NC(CO)c1c[n]ccc1 Amb22756404 [1,1,0,0,0,0|2,0,0]=4 3683 B10R1.15 NC(CO)c1cc[n]cc1 Amb18561776 [1,1,0,0,0,0|2,0,0]=4 3684 B10R1.15 NC(CO)c1cccc[n]1 Amb18560041 [1,1,0,0,0,0|2,0,0]=4 3685 B10R1.15 NC(CO)c1ccccn1 Amb17935880 [1,1,0,0,0,0|2,0,0]=4 3686 B10R1.15 NC(CO)c1ccncc1 Amb17935881 [1,1,0,0,0,0|2,0,0]=4 3687 B10R1.15 NC(CS)c1ccccc1 Amb25061358 [1,1,0,0,0,0|1,0,0]=3 3688 B10R1.15 NCC(=C)c1ccccc1 Amb10609068 [1,1,0,0,0,0|0,0,1]=3 3689 B10R1.15 NCC(=O)c1cc[n]cc1 Amb18832471 [1,1,0,0,0,0|1,0,1]=4 3690 B10R1.15 NCC(=O)c1cc[n]cc1 Amb22002046 [1,1,0,0,0,0|1,0,1]=4 3691 B10R1.15 NCC(=O)c1ccc[n]c1 Amb22277079 [1,1,0,0,0,0|1,0,1]=4 3692 B10R1.15 NCC(=O)c1ccc[n]c1 Amb22754018 [1,1,0,0,0,0|1,0,1]=4 3693 B10R1.15 NCC(=O)c1cccc[n]1 Amb18832469 [1,1,0,0,0,0|1,0,1]=4 3694 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [1,1,0,0,0,0|0,0,1]=3 3695 B10R1.15 NCC(=O)c1ccccn1 Amb10601921 [1,1,0,0,0,0|1,0,1]=4 3696 B10R1.15 NCC(=O)c1cccnc1 Amb17607867 [1,1,0,0,0,0|1,0,1]=4 3697 B10R1.15 NCC(Br)c1ccccc1 Amb19516007 [1,1,0,0,0,0|0,0,0]=2 3698 B10R1.15 NCC(F)c1c[n]cc[n]1 Amb25756644 [1,1,0,0,0,0|2,0,0]=4 3699 B10R1.15 NCC(F)c1cccc[n]1 Amb24473175 [1,1,0,0,0,0|1,0,0]=3 3700 B10R1.15 NCC(F)c1ccccc1 Amb23454844 [1,1,0,0,0,0|0,0,0]=2 3701 B10R1.15 NCC(N)c1c[n]c[n]c1 Amb25245254 [1,1,0,0,0,0|2,0,0]=4 3702 B10R1.15 NCC(N)c1c[n]cc[n]1 Amb25113386 [1,1,0,0,0,0|2,0,0]=4 3703 B10R1.15 NCC(N)c1cc[n]cc1 Amb18063802 [1,1,0,0,0,0|1,0,0]=3 3704 B10R1.15 NCC(N)c1ccccc1 Amb21857142 [1,1,0,0,0,0|0,0,0]=2 3705 B10R1.15 NCC(O)c1c[n]c[n]c1 Amb25731161 [1,1,0,0,0,0|2,0,0]=4 3706 B10R1.15 NCC(O)c1cc[n]c[n]1 Amb24434504 [1,1,0,0,0,0|2,0,0]=4 3707 B10R1.15 NCC(O)c1cc[n]cc1 Amb22755845 [1,1,0,0,0,0|1,0,0]=3 3708 B10R1.15 NCC(O)c1cccc[n]1 Amb20622942 [1,1,0,0,0,0|1,0,0]=3 3709 B10R1.15 NCC(O)c1ccccc1 Amb21961704 [1,1,0,0,0,0|0,0,0]=2 3710 B10R1.15 NCC(S)c1ccccc1 Amb18125608 [1,1,0,0,0,0|0,0,0]=2 3711 B10R1.15 NCC(S)c1ccccc1 Amb24106048 [1,1,0,0,0,0|0,0,0]=2 3712 B10R1.15 NCC(c1ccccc1)C Amb1085937 [1,1,0,0,0,0|0,0,0]=2 3713 B10R1.15 NCC(c1ccccc1)O Amb2383121 [1,1,0,0,0,0|0,0,0]=2 3714 B10R1.15 NCC(c1ccccn1)O Amb1109027 [1,1,0,0,0,0|1,0,0]=3 3715 B10R1.15 NCC(c1cccnc1)O Amb10068830 [1,1,0,0,0,0|1,0,0]=3 3716 B10R1.15 NCC(c1cccnc1)O Amb1108854 [1,1,0,0,0,0|1,0,0]=3 3717 B10R1.15 NCC(c1ccncc1)O Amb1108372 [1,1,0,0,0,0|1,0,0]=3 3718 B10R1.15 NC[C@@H](Cl)c1ccccc1 Amb24717355 [1,1,0,0,0,0|0,0,0]=2 3719 B10R1.15 NC[C@@H](F)c1ccccc1 Amb25279947 [1,1,0,0,0,0|0,0,0]=2 3720 B10R1.15 NC[C@@H](N)c1c[n]cc[n]1 Amb24674098 [1,1,0,0,0,0|2,0,0]=4 3721 B10R1.15 NC[C@@H](N)c1cccc[n]1 Amb25104764 [1,1,0,0,0,0|1,0,0]=3 3722 B10R1.15 NC[C@@H](O)c1c[n]cc[n]1 Amb25370172 [1,1,0,0,0,0|2,0,0]=4 3723 B10R1.15 NC[C@@H](O)c1c[n]ccc1 Amb22744742 [1,1,0,0,0,0|1,0,0]=3 3724 B10R1.15 NC[C@@H](O)c1c[n]ccc1 Amb22748405 [1,1,0,0,0,0|1,0,0]=3 3725 B10R1.15 NC[C@@H](O)c1cc[n]c[n]1 Amb24546069 [1,1,0,0,0,0|2,0,0]=4 3726 B10R1.15 NC[C@@H](O)c1cc[n]cc1 Amb24479579 [1,1,0,0,0,0|1,0,0]=3 3727 B10R1.15 NC[C@@H](O)c1cccc[n]1 Amb25052826 [1,1,0,0,0,0|1,0,0]=3 3728 B10R1.15 NC[C@@H](O)c1ccccc1 Amb24107154 [1,1,0,0,0,0|0,0,0]=2 3729 B10R1.15 NC[C@@H](c1ccccc1)O Amb10070626 [1,1,0,0,0,0|0,0,0]=2 3730 B10R1.15 NC[C@H](F)c1ccccc1 Amb25044881 [1,1,0,0,0,0|0,0,0]=2 3731 B10R1.15 NC[C@H](N)c1c[n]cc[n]1 Amb25146250 [1,1,0,0,0,0|2,0,0]=4 3732 B10R1.15 NC[C@H](N)c1c[n]ccc1 Amb24426861 [1,1,0,0,0,0|1,0,0]=3 3733 B10R1.15 NC[C@H](N)c1ccccc1 Amb25757101 [1,1,0,0,0,0|0,0,0]=2 3734 B10R1.15 NC[C@H](O)c1c[n]ccc1 Amb23385336 [1,1,0,0,0,0|1,0,0]=3 3735 B10R1.15 NC[C@H](O)c1c[n]ccc1 Amb25127978 [1,1,0,0,0,0|1,0,0]=3 3736 B10R1.15 NC[C@H](O)c1cccc[n]1 Amb24569794 [1,1,0,0,0,0|1,0,0]=3 3737 B10R1.15 NC[C@H](c1ccccc1)C Amb10070369 [1,1,0,0,0,0|0,0,0]=2 3738 B10R1.15 NNC(=N)c1ccc[n]c1 Amb19514929 [1,1,0,0,0,0|1,0,1]=4 3739 B10R1.15 NNC(=N)c1cccc[n]1 Amb22499914 [1,1,0,0,0,0|1,0,1]=4 3740 B10R1.15 NNC(=N)c1ccccc1 Amb22234855 [1,1,0,0,0,0|0,0,1]=3 3741 B10R1.15 NNC(=N)c1ccccc1 Amb22481319 [1,1,0,0,0,0|0,0,1]=3 3742 B10R1.15 NNC(=N)c1ccccc1 Amb22756451 [1,1,0,0,0,0|0,0,1]=3 3743 B10R1.15 NNC(=N)c1cccnc1 Amb10576591 [1,1,0,0,0,0|1,0,1]=4 3744 B10R1.15 NNC(=N)c1ccncc1 Amb10576592 [1,1,0,0,0,0|1,0,1]=4 3745 B10R1.15 NNC(=O)c1ccccc1 Amb1208583 [1,1,0,0,0,0|0,0,1]=3 3746 B10R1.15 NNC(=O)c1ccccn1 Amb1208395 [1,1,0,0,0,0|1,0,1]=4 3747 B10R1.15 NNC(=O)c1cccnc1 Amb1786962 [1,1,0,0,0,0|1,0,1]=4 3748 B10R1.15 NNC(=S)c1cc[n]cc1 Amb25290304 [1,1,0,0,0,0|1,0,1]=4 3749 B10R1.15 NNC(=S)c1cccc[n]1 Amb24671266 [1,1,0,0,0,0|1,0,1]=4 3750 B10R1.15 NNC(=S)c1ccccc1 Amb23513674 [1,1,0,0,0,0|0,0,1]=3 3751 B10R1.15 NNC(O)c1cc[n]cc1 Amb25215180 [1,1,0,0,0,0|1,0,0]=3 3752 B10R1.15 NNC(O)c1ccccc1 Amb25306494 [1,1,0,0,0,0|0,0,0]=2 3753 B10R1.15 NNC(c1ccccc1)C Amb10610271 [1,1,0,0,0,0|0,0,0]=2 3754 B10R1.15 NOC(=O)c1ccccc1 Amb22054026 [1,1,0,0,0,0|1,0,1]=4 3755 B10R1.15 NOC(c1ccccc1)C Amb17089185 [1,1,0,0,0,0|1,0,0]=3 3756 B10R1.15 N[C@@H](C#N)c1ccccc1 Amb18039831 [1,1,0,0,0,0|0,0,2]=4 3757 B10R1.15 N[C@@H](C#N)c1ccccc1 Amb22746711 [1,1,0,0,0,0|0,0,2]=4 3758 B10R1.15 N[C@@H](CF)c1cc[n]cc1 Amb24403138 [1,1,0,0,0,0|2,0,0]=4 3759 B10R1.15 N[C@@H](CF)c1cccc[n]1 Amb25353862 [1,1,0,0,0,0|2,0,0]=4 3760 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887019 [1,1,0,0,0,0|1,0,0]=3 3761 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887020 [1,1,0,0,0,0|1,0,0]=3 3762 B10R1.15 N[C@@H](CO)c1c[n]ccc1 Amb25146409 [1,1,0,0,0,0|2,0,0]=4 3763 B10R1.15 N[C@@H](CO)c1cc[n]cc1 Amb25146410 [1,1,0,0,0,0|2,0,0]=4 3764 B10R1.15 N[C@@H](CO)c1cccc[n]1 Amb22756435 [1,1,0,0,0,0|2,0,0]=4 3765 B10R1.15 N[C@@H](CS)c1ccccc1 Amb25689822 [1,1,0,0,0,0|1,0,0]=3 3766 B10R1.15 N[C@@H](c1ccccc1)C#N Amb17399826 [1,1,0,0,0,0|0,0,2]=4 3767 B10R1.15 N[C@H](CBr)c1ccccc1 Amb24391587 [1,1,0,0,0,0|1,0,0]=3 3768 B10R1.15 N[C@H](CF)c1c[n]ccc1 Amb24509342 [1,1,0,0,0,0|2,0,0]=4 3769 B10R1.15 N[C@H](CF)c1cc[n]cc1 Amb25677477 [1,1,0,0,0,0|2,0,0]=4 3770 B10R1.15 N[C@H](CF)c1cccc[n]1 Amb25840493 [1,1,0,0,0,0|2,0,0]=4 3771 B10R1.15 N[C@H](CO)c1c[n]ccc1 Amb24712243 [1,1,0,0,0,0|2,0,0]=4 3772 B10R1.15 N[C@H](CO)c1cc[n]cc1 Amb24714739 [1,1,0,0,0,0|2,0,0]=4 3773 B10R1.15 N[C@H](CS)c1ccccc1 Amb25111122 [1,1,0,0,0,0|1,0,0]=3 3774 B10R1.15 N\C(=C\N)\c1ccccc1 Amb25147590 [1,1,0,0,0,0|0,0,2]=4 3775 B10R1.15 N\C(=N/N)\c1ccccc1 Amb20407822 [1,1,0,0,0,0|0,0,2]=4 3776 B10R1.15 N\N=C(\c1ccccc1)/N Amb10608779 [1,1,0,0,0,0|0,0,2]=4 3777 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [1,1,0,0,0,0|1,0,1]=4 3778 B10R1.15 O=C(NCl)c1ccccc1 Amb25277317 [1,1,0,0,0,0|1,0,1]=4 3779 B10R1.15 O=CC(Br)c1ccccc1 Amb18130512 [1,1,0,0,0,0|1,0,1]=4 3780 B10R1.15 O=CC(Cl)c1ccccc1 Amb18644699 [1,1,0,0,0,0|1,0,1]=4 3781 B10R1.15 O=CC(F)c1ccccc1 Amb24117053 [1,1,0,0,0,0|1,0,1]=4 3782 B10R1.15 O=CC(c1ccccc1)O Amb17593446 [1,1,0,0,0,0|1,0,1]=4 3783 B10R1.15 O=C[C@@H](F)c1ccccc1 Amb24564571 [1,1,0,0,0,0|1,0,1]=4 3784 B10R1.15 O=P(CCl)c1ccccc1 Amb25053604 [1,1,0,0,0,0|2,0,0]=4 3785 B10R1.15 O=S(CF)c1ccccc1 Amb22723398 [1,1,0,0,0,0|2,0,0]=4 3786 B10R1.15 OC(CBr)c1c[n]ccc1 Amb24641581 [1,1,0,0,0,0|2,0,0]=4 3787 B10R1.15 OC(CBr)c1cc[n]cc1 Amb24099591 [1,1,0,0,0,0|2,0,0]=4 3788 B10R1.15 OC(CF)c1cccc[n]1 Amb25136249 [1,1,0,0,0,0|2,0,0]=4 3789 B10R1.15 OC(CF)c1ccccc1 Amb22731897 [1,1,0,0,0,0|1,0,0]=3 3790 B10R1.15 OCC(F)c1cccc[n]1 Amb24518945 [1,1,0,0,0,0|2,0,0]=4 3791 B10R1.15 OCC(F)c1ccccc1 Amb24105399 [1,1,0,0,0,0|1,0,0]=3 3792 B10R1.15 OCC(O)c1c[n]ccc1 Amb23538717 [1,1,0,0,0,0|2,0,0]=4 3793 B10R1.15 OCC(O)c1cc[n]cc1 Amb23538718 [1,1,0,0,0,0|2,0,0]=4 3794 B10R1.15 OCC(S)c1ccccc1 Amb25333535 [1,1,0,0,0,0|1,0,0]=3 3795 B10R1.15 OC[C@@H](Br)c1ccccc1 Amb25770108 [1,1,0,0,0,0|1,0,0]=3 3796 B10R1.15 OC[C@@H](Cl)c1ccccc1 Amb24417788 [1,1,0,0,0,0|1,0,0]=3 3797 B10R1.15 OC[C@@H](F)c1ccccc1 Amb25320636 [1,1,0,0,0,0|1,0,0]=3 3798 B10R1.15 OC[C@@H](S)c1ccccc1 Amb24504991 [1,1,0,0,0,0|1,0,0]=3 3799 B10R1.15 OC[C@H](O)c1c[n]ccc1 Amb24433399 [1,1,0,0,0,0|2,0,0]=4 3800 B10R1.15 OC[C@H](O)c1cc[n]cc1 Amb25831641 [1,1,0,0,0,0|2,0,0]=4 3801 B10R1.15 ONC(=N)c1ccccc1 Amb17231893 [1,1,0,0,0,0|1,0,1]=4 3802 B10R1.15 ONC(=O)c1ccccc1 Amb1645521 [1,1,0,0,0,0|1,0,1]=4 3803 B10R1.15 ONC(c1ccccc1)C Amb10605006 [1,1,0,0,0,0|1,0,0]=3 3804 B10R1.15 ONC(c1ccccn1)C Amb10605008 [1,1,0,0,0,0|2,0,0]=4 3805 B10R1.15 ONC(c1cccnc1)C Amb10605009 [1,1,0,0,0,0|2,0,0]=4 3806 B10R1.15 ONC(c1ccncc1)C Amb10605014 [1,1,0,0,0,0|2,0,0]=4 3807 B10R1.15 O[C@@H](CBr)c1cc[n]cc1 Amb24479572 [1,1,0,0,0,0|2,0,0]=4 3808 B10R1.15 O[C@@H](CBr)c1ccccc1 Amb19929326 [1,1,0,0,0,0|1,0,0]=3 3809 B10R1.15 O[C@@H](CCl)c1cc[n]cc1 Amb24479576 [1,1,0,0,0,0|2,0,0]=4 3810 B10R1.15 O[C@@H](CF)c1ccccc1 Amb24389146 [1,1,0,0,0,0|1,0,0]=3 3811 B10R1.15 O[C@@H](CI)c1ccccc1 Amb25738089 [1,1,0,0,0,0|1,0,0]=3 3812 B10R1.15 O[C@@H](c1ccccc1)C#C Amb10844978 [1,1,0,0,0,0|1,0,1]=4 3813 B10R1.15 O[C@H](CBr)c1c[n]ccc1 Amb24419839 [1,1,0,0,0,0|2,0,0]=4 3814 B10R1.15 O[C@H](CBr)c1cc[n]cc1 Amb24467759 [1,1,0,0,0,0|2,0,0]=4 3815 B10R1.15 O[C@H](CBr)c1ccccc1 Amb19929329 [1,1,0,0,0,0|1,0,0]=3 3816 B10R1.15 O[C@H](CCl)c1cccc[n]1 Amb24462750 [1,1,0,0,0,0|2,0,0]=4 3817 B10R1.15 O[C@H](CF)c1ccccc1 Amb24437736 [1,1,0,0,0,0|1,0,0]=3 3818 B10R1.15 SCC(=O)c1ccccc1 Amb16192503 [1,1,0,0,0,0|1,0,1]=4 3819 B10R1.15 SCC(c1ccccc1)O Amb10608997 [1,1,0,0,0,0|1,0,0]=3 3820 B10R1.15 [O-]NC(=O)c1ccccc1 Amb18800075 [1,1,0,0,0,0|1,0,1]=4 3821 B10R1.15 [O-]NC(=O)c1ccccc1 Amb22527267 [1,1,0,0,0,0|1,0,1]=4 3822 B10R1.18 BrC(Br)[Hg]c1ccccc1 Amb22345487 [1,1,0,0,0,0|2,0,0]=4 3823 B10R1.18 C=[N+]([O-])Cc1ccccc1 Amb24708106 [1,1,0,0,0,0|1,0,1]=4 3824 B10R1.18 CC(Br)Cc1cc[n]cc1 Amb25208255 [1,1,0,0,0,0|2,0,0]=4 3825 B10R1.18 CC(C)Cc1c[n]ccc1 Amb22043313 [1,1,0,0,0,0|2,0,0]=4 3826 B10R1.18 CC(C)Cc1cc[n]cc1 Amb22353758 [1,1,0,0,0,0|2,0,0]=4 3827 B10R1.18 CC(Cc1ccccc1)N Amb17608372 [1,1,0,0,0,0|0,0,0]=2 3828 B10R1.18 CC(Cc1ccccn1)C Amb15691003 [1,1,0,0,0,0|2,0,0]=4 3829 B10R1.18 CC(Cc1ccccn1)Cl Amb17477796 [1,1,0,0,0,0|2,0,0]=4 3830 B10R1.18 CC(Cc1ccccn1)N Amb1995149 [1,1,0,0,0,0|1,0,0]=3 3831 B10R1.18 CC(Cc1ccccn1)O Amb1995148 [1,1,0,0,0,0|2,0,0]=4 3832 B10R1.18 CC(Cc1cccnc1)Cl Amb17477798 [1,1,0,0,0,0|2,0,0]=4 3833 B10R1.18 CC(Cc1cccnc1)O Amb17477790 [1,1,0,0,0,0|2,0,0]=4 3834 B10R1.18 CC(Cc1ccncc1)Cl Amb17477797 [1,1,0,0,0,0|2,0,0]=4 3835 B10R1.18 CC(Cc1ccncc1)O Amb17477789 [1,1,0,0,0,0|2,0,0]=4 3836 B10R1.18 CC(Cc1cnccn1)N Amb1995174 [1,1,0,0,0,0|2,0,0]=4 3837 B10R1.18 CC(Cc1nccnc1)N Amb10609115 [1,1,0,0,0,0|2,0,0]=4 3838 B10R1.18 CC(Cc1nccnc1)N Amb10609131 [1,1,0,0,0,0|2,0,0]=4 3839 B10R1.18 CC(Cl)Cc1ccccc1 Amb18787554 [1,1,0,0,0,0|1,0,0]=3 3840 B10R1.18 CC(Cl)Oc1ccccc1 Amb17689404 [1,1,0,0,0,0|2,0,0]=4 3841 B10R1.18 CC(Cl)Sc1ccccc1 Amb17673697 [1,1,0,0,0,0|2,0,0]=4 3842 B10R1.18 CC(I)Cc1ccccc1 Amb24616287 [1,1,0,0,0,0|1,0,0]=3 3843 B10R1.18 CC(N)=Pc1ccccc1 Amb25351589 [1,1,0,0,0,0|1,0,1]=4 3844 B10R1.18 CC(N)CC=1C=CCCC1 Amb21962869 [1,1,0,0,0,0|0,0,2]=4 3845 B10R1.18 CC(N)Cc1[n]ccc[n]1 Amb18064016 [1,1,0,0,0,0|2,0,0]=4 3846 B10R1.18 CC(N)Cc1c[n]ccc1 Amb21972219 [1,1,0,0,0,0|1,0,0]=3 3847 B10R1.18 CC(N)Cc1cc[n]c[n]1 Amb18285236 [1,1,0,0,0,0|2,0,0]=4 3848 B10R1.18 CC(N)Cc1cc[n]cc1 Amb21972220 [1,1,0,0,0,0|1,0,0]=3 3849 B10R1.18 CC(N)Cc1ccccc1 Amb22346639 [1,1,0,0,0,0|0,0,0]=2 3850 B10R1.18 CC(N)Cc1ccccc1 Amb22352196 [1,1,0,0,0,0|0,0,0]=2 3851 B10R1.18 CC(N)Oc1ccccc1 Amb25830517 [1,1,0,0,0,0|1,0,0]=3 3852 B10R1.18 CC(O)Sc1ccccc1 Amb25045636 [1,1,0,0,0,0|2,0,0]=4 3853 B10R1.18 CC(S)Cc1ccccc1 Amb18177239 [1,1,0,0,0,0|1,0,0]=3 3854 B10R1.18 CN(C)Cc1cc[n]cc1 Amb20247602 [1,1,0,0,0,0|2,0,0]=4 3855 B10R1.18 CN(C)Cc1ccccc1 Amb22359464 [1,1,0,0,0,0|1,0,0]=3 3856 B10R1.18 CN(C)Nc1ccccc1 Amb25810299 [1,1,0,0,0,0|2,0,0]=4 3857 B10R1.18 CN(N)Cc1cc[n]c[n]1 Amb25248031 [1,1,0,0,0,0|2,0,0]=4 3858 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [1,1,0,0,0,0|2,0,0]=4 3859 B10R1.18 C[C@@H](Cc1ccccc1)O Amb10068519 [1,1,0,0,0,0|1,0,0]=3 3860 B10R1.18 C[C@@H](N)Cc1c[n]cc[n]1 Amb25127231 [1,1,0,0,0,0|2,0,0]=4 3861 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb19130510 [1,1,0,0,0,0|0,0,0]=2 3862 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb22745694 [1,1,0,0,0,0|0,0,0]=2 3863 B10R1.18 C[C@@H](O)Cc1c[n]ccc1 Amb22896922 [1,1,0,0,0,0|2,0,0]=4 3864 B10R1.18 C[C@@H](O)Cc1ccccc1 Amb17938083 [1,1,0,0,0,0|1,0,0]=3 3865 B10R1.18 C[C@H](Cc1ccccc1)N Amb17608368 [1,1,0,0,0,0|0,0,0]=2 3866 B10R1.18 C[C@H](N)Cc1c[n]cc[n]1 Amb24360532 [1,1,0,0,0,0|2,0,0]=4 3867 B10R1.18 C[C@H](N)Cc1cccc[n]1 Amb24451425 [1,1,0,0,0,0|1,0,0]=3 3868 B10R1.18 C[SiH](C)Cc1ccccc1 Amb19893554 [1,1,0,0,0,0|1,1,0]=4 3869 B10R1.18 C[Si](C)Cc1ccccc1 Amb24527863 [1,1,0,0,0,0|1,1,0]=4 3870 B10R1.18 ClB(Cl)Cc1ccccc1 Amb25832795 [1,1,0,0,0,0|2,0,0]=4 3871 B10R1.18 ClC(Cl)Cc1ccccc1 Amb25783924 [1,1,0,0,0,0|1,0,0]=3 3872 B10R1.18 ClC(Cl)Sc1ccccc1 Amb24389589 [1,1,0,0,0,0|2,0,0]=4 3873 B10R1.18 ClC(Cl)[SiH2]c1ccccc1 Amb22167700 [1,1,0,0,0,0|1,1,0]=4 3874 B10R1.18 ClP(Cl)Cc1ccccc1 Amb25838123 [1,1,0,0,0,0|1,1,0]=4 3875 B10R1.18 FC(F)Cc1ccccc1 Amb19894546 [1,1,0,0,0,0|1,0,0]=3 3876 B10R1.18 FC(Sc1ccccc1)F Amb17232315 [1,1,0,0,0,0|2,0,0]=4 3877 B10R1.18 NC(=N)Cc1cc[n]cc1 Amb22499359 [1,1,0,0,0,0|1,0,1]=4 3878 B10R1.18 NC(=N)Cc1ccc[n]c1 Amb19890175 [1,1,0,0,0,0|1,0,1]=4 3879 B10R1.18 NC(=N)Nc1ccccc1 Amb20249360 [1,1,0,0,0,0|1,0,1]=4 3880 B10R1.18 NC(=N)Nc1ccccc1 Amb22732584 [1,1,0,0,0,0|1,0,1]=4 3881 B10R1.18 NC(=N)Oc1ccccc1 Amb24432258 [1,1,0,0,0,0|1,0,1]=4 3882 B10R1.18 NC(=O)Cc1ccc[n]c1 Amb21856113 [1,1,0,0,0,0|1,0,1]=4 3883 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [1,1,0,0,0,0|0,0,1]=3 3884 B10R1.18 NC(=O)Nc1ccccc1 Amb2373965 [1,1,0,0,0,0|1,0,1]=4 3885 B10R1.18 NC(=S)C[n+]1ccccc1 Amb17119656 [1,1,0,0,0,0|1,0,1]=4 3886 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [1,1,0,0,0,0|0,0,1]=3 3887 B10R1.18 NC(=[NH2+])Nc1ccccc1 Amb22734963 [1,1,0,0,0,0|1,0,1]=4 3888 B10R1.18 NC(O)Cc1ccccc1 Amb25348475 [1,1,0,0,0,0|0,0,0]=2 3889 B10R1.18 NS(=N)Cc1ccccc1 Amb25258845 [1,1,0,0,0,0|1,0,0]=3 3890 B10R1.18 N[C@@H](O)Cc1ccccc1 Amb25790547 [1,1,0,0,0,0|0,0,0]=2 3891 B10R1.18 N[C@H](O)Cc1ccccc1 Amb24444592 [1,1,0,0,0,0|0,0,0]=2 3892 B10R1.18 OB(Cc1ccccc1)O Amb10071580 [1,1,0,0,0,0|2,0,0]=4 3893 B10R1.18 OC(=O)C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22353637 [1,1,0,0,0,0|1,0,1]=4 3894 B10R1.18 OC(=O)[13CH2]c1ccccc1 Amb22351854 [1,1,0,0,0,0|1,0,1]=4 3895 B10R1.18 OC(=S)Cc1ccccc1 Amb22262974 [1,1,0,0,0,0|1,0,1]=4 3896 B10R1.18 OC(F)Cc1ccccc1 Amb25147731 [1,1,0,0,0,0|1,0,0]=3 3897 B10R1.18 OC(O)C[n+]1ccccc1 Amb25149726 [1,1,0,0,0,0|2,0,0]=4 3898 B10R1.18 OC(O)Cc1ccccc1 Amb24639712 [1,1,0,0,0,0|1,0,0]=3 3899 B10R1.18 OP(=O)Cc1ccccc1 Amb24617740 [1,1,0,0,0,0|1,1,0]=4 3900 B10R1.18 O[13C](=O)Cc1ccccc1 Amb22363120 [1,1,0,0,0,0|1,0,1]=4 3901 B10R1.18 O[13C](=O)[13CH2]c1ccccc1 Amb22351754 [1,1,0,0,0,0|1,0,1]=4 3902 B10R1.18 O[14C](=O)Cc1ccccc1 Amb22337596 [1,1,0,0,0,0|1,0,1]=4 3903 B10R1.18 SC(=O)Cc1ccccc1 Amb10561701 [1,1,0,0,0,0|1,0,1]=4 3904 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20240609 [1,1,0,0,0,0|1,0,1]=4 3905 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20246797 [1,1,0,0,0,0|1,0,1]=4 3906 B10R1.18 [O-][N+](=O)Cc1ccccc1 Amb10606416 [1,1,0,0,0,0|1,0,1]=4 3907 B10R1.11 CC(CCN)[n]1cccc1 Amb18985726 [0,1,0,0,1,0|2,0,0]=4 3908 B10R1.11 CC(CCN)c1c[nH]cc1 Amb18893407 [0,1,0,0,1,0|2,0,0]=4 3909 B10R1.11 CNCC(C)C=1CC=CC1 Amb24478978 [0,1,0,0,1,0|1,0,1]=4 3910 B10R1.11 CNCC(O)c1c[nH]cc1 Amb18563135 [0,1,0,0,1,0|2,0,0]=4 3911 B10R1.11 CNCC(O)c1c[s]cc1 Amb18997460 [0,1,0,0,1,0|2,0,0]=4 3912 B10R1.11 CNCC(c1cccs1)C Amb17232163 [0,1,0,0,1,0|2,0,0]=4 3913 B10R1.11 CNC[C@@H](O)c1c[s]cc1 Amb25322154 [0,1,0,0,1,0|2,0,0]=4 3914 B10R1.11 CNC[C@H](O)c1ccc[s]1 Amb25065288 [0,1,0,0,1,0|2,0,0]=4 3915 B10R1.11 CNC[C@H](O)c1ccco1 Amb24409577 [0,1,0,0,1,0|2,0,0]=4 3916 B10R1.11 NCCC(F)c1c[s]cc1 Amb25786606 [0,1,0,0,1,0|2,0,0]=4 3917 B10R1.11 NCCC(F)c1ccc[nH]1 Amb25118038 [0,1,0,0,1,0|2,0,0]=4 3918 B10R1.11 NCCC(F)c1ccc[s]1 Amb25050095 [0,1,0,0,1,0|2,0,0]=4 3919 B10R1.11 NCCC(F)c1cocc1 Amb25721824 [0,1,0,0,1,0|2,0,0]=4 3920 B10R1.11 NCCC(N)c1cocc1 Amb24562958 [0,1,0,0,1,0|2,0,0]=4 3921 B10R1.11 NCCC(O)c1c[nH]cc1 Amb18563185 [0,1,0,0,1,0|2,0,0]=4 3922 B10R1.11 NCCC(O)c1c[s]cc1 Amb18251534 [0,1,0,0,1,0|2,0,0]=4 3923 B10R1.11 NCCC(O)c1cocc1 Amb22642024 [0,1,0,0,1,0|2,0,0]=4 3924 B10R1.11 NCCC(c1ccco1)C Amb17226683 [0,1,0,0,1,0|2,0,0]=4 3925 B10R1.11 NCCC(c1ccco1)O Amb17079150 [0,1,0,0,1,0|2,0,0]=4 3926 B10R1.11 NCCC(c1cccs1)O Amb17079131 [0,1,0,0,1,0|2,0,0]=4 3927 B10R1.11 NCC[C@@H](N)c1c[s]cc1 Amb24561706 [0,1,0,0,1,0|2,0,0]=4 3928 B10R1.11 NCC[C@@H](N)c1cocc1 Amb25201751 [0,1,0,0,1,0|2,0,0]=4 3929 B10R1.11 NCC[C@H](N)c1ccco1 Amb24655060 [0,1,0,0,1,0|2,0,0]=4 3930 B10R1.11 NNCC(O)c1c[nH]cc1 Amb18563436 [0,1,0,0,1,0|1,0,0]=3 3931 B10R1.11 NNCC(c1ccco1)O Amb17231941 [0,1,0,0,1,0|1,0,0]=3 3932 B10R1.11 NNCC(c1cccs1)O Amb17232256 [0,1,0,0,1,0|1,0,0]=3 3933 B10R1.11 NOCC(c1cccs1)O Amb17334463 [0,1,0,0,1,0|2,0,0]=4 3934 B10R1.11 ONCC(c1ccco1)O Amb17334210 [0,1,0,0,1,0|2,0,0]=4 3935 B10R1.11 ONCC(c1cccs1)O Amb17334462 [0,1,0,0,1,0|2,0,0]=4 3936 B10R1.16 CNCCc1c[n](C)cc1 Amb18562095 [0,1,0,0,1,0|2,0,0]=4 3937 B10R1.16 CNCCc1cc(Br)c[s]1 Amb18993053 [0,1,0,0,1,0|2,0,0]=4 3938 B10R1.16 CNCCc1ccc(s1)Br Amb17405437 [0,1,0,0,1,0|2,0,0]=4 3939 B10R1.16 CNCCc1ccc(s1)Cl Amb17400534 [0,1,0,0,1,0|2,0,0]=4 3940 B10R1.16 C[n]1cc(CCCN)cc1 Amb18562123 [0,1,0,0,1,0|2,0,0]=4 3941 B10R1.16 Cc1[n]c(CCNN)c[s]1 Amb24360132 [0,1,0,0,1,0|2,0,0]=4 3942 B10R1.16 Cc1c[n][n](CCNN)c1 Amb24357415 [0,1,0,0,1,0|2,0,0]=4 3943 B10R1.16 Cc1cc(CCCN)[s]c1 Amb18830842 [0,1,0,0,1,0|2,0,0]=4 3944 B10R1.16 Cc1cc(CCCN)c[nH]1 Amb18202991 [0,1,0,0,1,0|2,0,0]=4 3945 B10R1.16 Cc1cc(CCCN)c[s]1 Amb24367192 [0,1,0,0,1,0|2,0,0]=4 3946 B10R1.16 Cc1cc(CCCN)co1 Amb18832018 [0,1,0,0,1,0|2,0,0]=4 3947 B10R1.16 Cc1ccc(CCCN)[s]1 Amb18830839 [0,1,0,0,1,0|2,0,0]=4 3948 B10R1.16 Cc1ccc(CCNC)o1 Amb25130668 [0,1,0,0,1,0|2,0,0]=4 3949 B10R1.16 Cc1ccc(o1)CCCN Amb17477776 [0,1,0,0,1,0|2,0,0]=4 3950 B10R1.16 NCCCc1c[s]c(Cl)c1 Amb25707183 [0,1,0,0,1,0|2,0,0]=4 3951 B10R1.16 NCCCc1cc(Br)c[s]1 Amb18991742 [0,1,0,0,1,0|2,0,0]=4 3952 B10R1.16 NCCCc1ccc(Cl)o1 Amb24744527 [0,1,0,0,1,0|2,0,0]=4 3953 B10R1.16 NCCCc1ccc(I)o1 Amb25706348 [0,1,0,0,1,0|2,0,0]=4 3954 B10R1.16 NCCCc1coc(Br)c1 Amb25370396 [0,1,0,0,1,0|2,0,0]=4 3955 B10R1.16 NNCC[n]1cc(Cl)c[n]1 Amb25290847 [0,1,0,0,1,0|2,0,0]=4 3956 B10R1.16 NNCCc1ccc(Br)o1 Amb25093580 [0,1,0,0,1,0|1,0,0]=3 3957 B10R1.16 NNCCc1ccc(s1)Br Amb17405679 [0,1,0,0,1,0|1,0,0]=3 3958 B10R1.16 NNCCc1ccc(s1)Cl Amb17400585 [0,1,0,0,1,0|1,0,0]=3 3959 B10R1.16 NNCCc1coc(Br)c1 Amb25371369 [0,1,0,0,1,0|1,0,0]=3 3960 B10R1.21 CCNCC[n]1cccc1 Amb18313349 [0,1,0,0,1,0|2,0,0]=4 3961 B10R1.21 CCNCCc1c[nH]cc1 Amb18893405 [0,1,0,0,1,0|2,0,0]=4 3962 B10R1.21 CNCCCC1C=CC=C1 Amb25791562 [0,1,0,0,1,0|1,0,1]=4 3963 B10R1.21 CNCCCC=1C=CCC1 Amb24478907 [0,1,0,0,1,0|1,0,1]=4 3964 B10R1.21 CNCCC[n]1cccc1 Amb18306565 [0,1,0,0,1,0|2,0,0]=4 3965 B10R1.21 CNCCCc1c[nH]cc1 Amb18064240 [0,1,0,0,1,0|2,0,0]=4 3966 B10R1.21 CNCCCc1c[s]cc1 Amb19025786 [0,1,0,0,1,0|2,0,0]=4 3967 B10R1.21 CNCCCc1cccs1 Amb17104498 [0,1,0,0,1,0|2,0,0]=4 3968 B10R1.21 CNCCSc1ccc[s]1 Amb19024667 [0,1,0,0,1,0|2,0,0]=4 3969 B10R1.21 N#CNCC[n]1cccc1 Amb24397949 [0,1,0,0,1,0|1,0,1]=4 3970 B10R1.21 N#CNCCc1c[s]cc1 Amb18799424 [0,1,0,0,1,0|1,0,1]=4 3971 B10R1.21 N#CNCCc1ccc[s]1 Amb18799422 [0,1,0,0,1,0|1,0,1]=4 3972 B10R1.21 NCCCCc1c[nH]cc1 Amb18562443 [0,1,0,0,1,0|2,0,0]=4 3973 B10R1.21 NCCCCc1c[s]cc1 Amb25765310 [0,1,0,0,1,0|2,0,0]=4 3974 B10R1.21 NCCCN[n]1cccc1 Amb25682202 [0,1,0,0,1,0|2,0,0]=4 3975 B10R1.21 NCCCNc1ccc[s]1 Amb18312077 [0,1,0,0,1,0|2,0,0]=4 3976 B10R1.21 NCCNCc1c[s]cc1 Amb18307074 [0,1,0,0,1,0|2,0,0]=4 3977 B10R1.21 NCCNCc1ccc[nH]1 Amb19021350 [0,1,0,0,1,0|2,0,0]=4 3978 B10R1.21 NCCNCc1ccc[s]1 Amb18523821 [0,1,0,0,1,0|2,0,0]=4 3979 B10R1.21 NCCNCc1ccco1 Amb17091023 [0,1,0,0,1,0|2,0,0]=4 3980 B10R1.21 NCCNCc1cocc1 Amb18310661 [0,1,0,0,1,0|2,0,0]=4 3981 B10R1.21 NCCOCc1c[s]cc1 Amb19020781 [0,1,0,0,1,0|2,0,0]=4 3982 B10R1.21 NCCOCc1ccc[s]1 Amb19033621 [0,1,0,0,1,0|2,0,0]=4 3983 B10R1.21 NCCOCc1ccco1 Amb1138811 [0,1,0,0,1,0|2,0,0]=4 3984 B10R1.21 NCCOCc1cocc1 Amb24381340 [0,1,0,0,1,0|2,0,0]=4 3985 B10R1.21 NCCSCc1cocc1 Amb25102901 [0,1,0,0,1,0|2,0,0]=4 3986 B10R1.21 NCCSCc1cscc1 Amb2371320 [0,1,0,0,1,0|2,0,0]=4 3987 B10R1.21 NNCCCc1ccc[s]1 Amb24385929 [0,1,0,0,1,0|1,0,0]=3 3988 B10R1.21 NOCCCc1ccco1 Amb17089544 [0,1,0,0,1,0|2,0,0]=4 3989 B10R1.21 NOCCCc1cccs1 Amb17089545 [0,1,0,0,1,0|2,0,0]=4 3990 B10R1.21 NOCCSc1ccc[s]1 Amb25176001 [0,1,0,0,1,0|2,0,0]=4 3991 B10R1.21 O=CNCCc1c[s]cc1 Amb25107058 [0,1,0,0,1,0|2,0,0]=4 3992 B10R1.21 O=CNCCc1ccc[nH]1 Amb25127273 [0,1,0,0,1,0|2,0,0]=4 3993 B10R1.27 CC(CN)C[n]1cccc1 Amb18299860 [0,1,0,0,1,0|2,0,0]=4 3994 B10R1.27 CC(CN)Cc1c[s]cc1 Amb18992229 [0,1,0,0,1,0|2,0,0]=4 3995 B10R1.27 CC(CN)Cc1cocc1 Amb25730383 [0,1,0,0,1,0|2,0,0]=4 3996 B10R1.27 CC(Cc1ccc[s]1)NO Amb24756454 [0,1,0,0,1,0|2,0,0]=4 3997 B10R1.27 CC(Cc1ccco1)NN Amb25795773 [0,1,0,0,1,0|1,0,0]=3 3998 B10R1.27 CC(Cc1ccco1)NO Amb24615522 [0,1,0,0,1,0|2,0,0]=4 3999 B10R1.27 CNC(C)Cc1c[s]cc1 Amb18292049 [0,1,0,0,1,0|2,0,0]=4 4000 B10R1.27 CNC(C)Cc1c[s]cc1 Amb20623806 [0,1,0,0,1,0|2,0,0]=4 4001 B10R1.27 CNC(C)Cc1ccc[s]1 Amb20623809 [0,1,0,0,1,0|2,0,0]=4 4002 B10R1.27 NCC(Cc1ccco1)O Amb17231928 [0,1,0,0,1,0|2,0,0]=4 4003 B10R1.27 NCC(Cc1cccs1)O Amb17232229 [0,1,0,0,1,0|2,0,0]=4 4004 B10R1.27 NCC(F)C[n]1cccc1 Amb25292870 [0,1,0,0,1,0|2,0,0]=4 4005 B10R1.27 NCC(F)Cc1c[s]cc1 Amb25708968 [0,1,0,0,1,0|2,0,0]=4 4006 B10R1.27 NCC(F)Cc1ccco1 Amb24617369 [0,1,0,0,1,0|2,0,0]=4 4007 B10R1.27 NCC(N)Cc1ccc[s]1 Amb25072784 [0,1,0,0,1,0|2,0,0]=4 4008 B10R1.27 NNC(=O)Cc1ccc[nH]1 Amb25092731 [0,1,0,0,1,0|1,0,1]=4 4009 B10R1.27 NNC(=O)Cc1ccco1 Amb25143818 [0,1,0,0,1,0|1,0,1]=4 4010 B10R1.27 NNC(=O)Cc1cccs1 Amb1153785 [0,1,0,0,1,0|1,0,1]=4 4011 B10R1.27 NNC(=S)Cc1ccco1 Amb24479074 [0,1,0,0,1,0|1,0,1]=4 4012 B10R1.29 CNCCc1[s]ccc1Br Amb18293202 [0,1,0,0,1,0|2,0,0]=4 4013 B10R1.29 CNCCc1[s]ccc1Cl Amb24401866 [0,1,0,0,1,0|2,0,0]=4 4014 B10R1.29 CNCCc1cc[s]c1Br Amb24649214 [0,1,0,0,1,0|2,0,0]=4 4015 B10R1.29 CNCCc1occc1Br Amb25374569 [0,1,0,0,1,0|2,0,0]=4 4016 B10R1.29 C[n]1cc[n]c1CCNN Amb24384959 [0,1,0,0,1,0|2,0,0]=4 4017 B10R1.29 C[n]1cccc1CCCN Amb18202993 [0,1,0,0,1,0|2,0,0]=4 4018 B10R1.29 Cc1[s]ccc1CCCN Amb18830831 [0,1,0,0,1,0|2,0,0]=4 4019 B10R1.29 Cc1[s]ccc1CCNC Amb24649724 [0,1,0,0,1,0|2,0,0]=4 4020 B10R1.29 Cc1c[s]cc1CCCN Amb24558433 [0,1,0,0,1,0|2,0,0]=4 4021 B10R1.29 Cc1cc[s]c1CCNC Amb25767110 [0,1,0,0,1,0|2,0,0]=4 4022 B10R1.29 Cc1ccoc1CCNC Amb24608196 [0,1,0,0,1,0|2,0,0]=4 4023 B10R1.29 Cc1cocc1CCNC Amb24567392 [0,1,0,0,1,0|2,0,0]=4 4024 B10R1.29 Cc1occc1CCCN Amb18832013 [0,1,0,0,1,0|2,0,0]=4 4025 B10R1.29 NCCCC1=CC=CC1[Na] Amb24712533 [0,1,0,0,1,0|1,0,1]=4 4026 B10R1.29 NCCCc1[s]ccc1Br Amb18301839 [0,1,0,0,1,0|2,0,0]=4 4027 B10R1.29 NCCCc1occc1Br Amb24365636 [0,1,0,0,1,0|2,0,0]=4 4028 B10R1.29 NCCCc1sccc1C Amb17477777 [0,1,0,0,1,0|2,0,0]=4 4029 B10R1.29 NNCCc1[s]ccc1Cl Amb24357785 [0,1,0,0,1,0|1,0,0]=3 4030 B10R1.29 NNCCc1cc[s]c1Br Amb25374318 [0,1,0,0,1,0|1,0,0]=3 4031 B10R1.66 CC(CCc1ccco1)N Amb1080929 [0,1,0,0,1,0|2,0,0]=4 4032 B10R1.66 CC(N)CC[n]1cccc1 Amb24476813 [0,1,0,0,1,0|2,0,0]=4 4033 B10R1.66 CC(N)CCc1c[nH]cc1 Amb18223143 [0,1,0,0,1,0|2,0,0]=4 4034 B10R1.66 CN(C)CCc1ccc[s]1 Amb24554364 [0,1,0,0,1,0|2,0,0]=4 4035 B10R1.66 NC(=N)CCc1ccc[s]1 Amb18065430 [0,1,0,0,1,0|2,0,0]=4 4036 B10R1.66 NC(=N)CCc1ccco1 Amb18063862 [0,1,0,0,1,0|2,0,0]=4 4037 B10R1.66 NC(=O)CCc1ccoc1 Amb24722346 [0,1,0,0,1,0|2,0,0]=4 4038 B10R1.66 NC(=S)CCc1cc[s]c1 Amb25850668 [0,1,0,0,1,0|2,0,0]=4 4039 B10R1.66 NC(=S)CCc1ccco1 Amb17232155 [0,1,0,0,1,0|2,0,0]=4 4040 B10R1.66 NC(=S)CCc1cccs1 Amb17232842 [0,1,0,0,1,0|2,0,0]=4 4041 B12R1.18 O=C1C=CC=CC=C1CCCCl Amb25151144 [0,1,0,0,0,1|2,0,0]=4 4042 B12R1.348 CCCCC=1C=CC(=O)C=CC1 Amb25767136 [0,1,0,0,0,1|2,0,0]=4 4043 B12R1.1748 CC(CC1C=CC=CC=C1)NC Amb24696440 [0,1,0,0,0,1|1,0,1]=4 4044 B12R1.1748 NNC(=N)CC1C=CC=CC=N1 Amb25128041 [0,1,0,0,0,1|0,0,2]=4 4045 B12R1.1 BrCCCOc1ccc(cc1)Cl Amb1154145 [0,2,0,0,0,0|2,0,0]=4 4046 B12R1.1 BrCCCOc1ccc(cc1)N Amb16230364 [0,2,0,0,0,0|2,0,0]=4 4047 B12R1.1 C#CCCCc1ccc(O)cc1 Amb25370648 [0,2,0,0,0,0|2,0,0]=4 4048 B12R1.1 C#CCCNc1ccc(Cl)cc1 Amb25137648 [0,2,0,0,0,0|2,0,0]=4 4049 B12R1.1 C#CCCNc1ccc(I)cc1 Amb24483374 [0,2,0,0,0,0|2,0,0]=4 4050 B12R1.1 C#CCCOc1ccc(F)cc1 Amb24354706 [0,2,0,0,0,0|2,0,0]=4 4051 B12R1.1 C#CCCOc1ccc(N)cc1 Amb18290034 [0,2,0,0,0,0|2,0,0]=4 4052 B12R1.1 C#CCCSc1ccc(Cl)cc1 Amb25148456 [0,2,0,0,0,0|2,0,0]=4 4053 B12R1.1 C#CCCSc1ccc(F)cc1 Amb25757679 [0,2,0,0,0,0|2,0,0]=4 4054 B12R1.1 C#CCCSc1ccc(O)cc1 Amb18180838 [0,2,0,0,0,0|2,0,0]=4 4055 B12R1.1 C#CCNCc1ccc(Br)cc1 Amb21969141 [0,2,0,0,0,0|2,0,0]=4 4056 B12R1.1 C#CCNCc1ccc(Cl)cc1 Amb21979448 [0,2,0,0,0,0|2,0,0]=4 4057 B12R1.1 C#CCNCc1ccc(cc1)F Amb13951349 [0,2,0,0,0,0|2,0,0]=4 4058 B12R1.1 C#CCOCc1ccc(N)cc1 Amb18298742 [0,2,0,0,0,0|2,0,0]=4 4059 B12R1.1 C#CCOCc1ccc(O)cc1 Amb25092905 [0,2,0,0,0,0|2,0,0]=4 4060 B12R1.1 C#CCSCc1ccc(cc1)N Amb17499003 [0,2,0,0,0,0|2,0,0]=4 4061 B12R1.1 C=CCCCc1ccc(cc1)C Amb13890670 [0,2,0,0,0,0|2,0,0]=4 4062 B12R1.1 C=CCCCc1ccc(cc1)Cl Amb13890658 [0,2,0,0,0,0|2,0,0]=4 4063 B12R1.1 C=CCCCc1ccc(cc1)F Amb13890682 [0,2,0,0,0,0|2,0,0]=4 4064 B12R1.1 C=CCCNc1ccc(Br)cc1 Amb24364913 [0,2,0,0,0,0|2,0,0]=4 4065 B12R1.1 C=CCCNc1ccc(F)cc1 Amb25152653 [0,2,0,0,0,0|2,0,0]=4 4066 B12R1.1 C=CCCNc1ccc(I)cc1 Amb25087539 [0,2,0,0,0,0|2,0,0]=4 4067 B12R1.1 C=CCCNc1ccc(N)cc1 Amb24620212 [0,2,0,0,0,0|2,0,0]=4 4068 B12R1.1 C=CCCNc1ccc(cc1)C Amb10559134 [0,2,0,0,0,0|2,0,0]=4 4069 B12R1.1 C=CCCOc1ccc(N)cc1 Amb24102791 [0,2,0,0,0,0|2,0,0]=4 4070 B12R1.1 C=CCNCc1ccc(O)cc1 Amb19890782 [0,2,0,0,0,0|2,0,0]=4 4071 B12R1.1 C=CCNCc1ccc(cc1)Br Amb1923349 [0,2,0,0,0,0|2,0,0]=4 4072 B12R1.1 C=CCNCc1ccc(cc1)Cl Amb1923348 [0,2,0,0,0,0|2,0,0]=4 4073 B12R1.1 C=CCSCc1ccc(cc1)N Amb17498006 [0,2,0,0,0,0|2,0,0]=4 4074 B12R1.1 CCCCCc1ccc(cc1)Br Amb2413171 [0,2,0,0,0,0|2,0,0]=4 4075 B12R1.1 CCCCOc1ccc(I)cc1 Amb19929171 [0,2,0,0,0,0|2,0,0]=4 4076 B12R1.1 CCCCOc1ccc(S)cc1 Amb19887938 [0,2,0,0,0,0|2,0,0]=4 4077 B12R1.1 CCCCOc1ccc(cc1)N Amb1127017 [0,2,0,0,0,0|2,0,0]=4 4078 B12R1.1 CCCCSc1ccc(Br)cc1 Amb22227904 [0,2,0,0,0,0|2,0,0]=4 4079 B12R1.1 CCCNCc1ccc(Br)cc1 Amb19890387 [0,2,0,0,0,0|2,0,0]=4 4080 B12R1.1 CCCNCc1ccc(cc1)C Amb1215690 [0,2,0,0,0,0|2,0,0]=4 4081 B12R1.1 CCCNCc1ccc(cc1)Cl Amb10782093 [0,2,0,0,0,0|2,0,0]=4 4082 B12R1.1 CCCNCc1ccc(cc1)O Amb2445168 [0,2,0,0,0,0|2,0,0]=4 4083 B12R1.1 CCNCCc1ccc(cc1)O Amb15694900 [0,2,0,0,0,0|1,0,0]=3 4084 B12R1.1 CCOCCc1ccc(Br)cc1 Amb23443758 [0,2,0,0,0,0|2,0,0]=4 4085 B12R1.1 CNCC#Cc1ccc(F)cc1 Amb25114647 [0,2,0,0,0,0|1,0,1]=4 4086 B12R1.1 CNCCCc1ccc(cc1)Br Amb17104523 [0,2,0,0,0,0|1,0,0]=3 4087 B12R1.1 CNCCCc1ccc(cc1)C Amb17104501 [0,2,0,0,0,0|1,0,0]=3 4088 B12R1.1 CNCCCc1ccc(cc1)Cl Amb17104509 [0,2,0,0,0,0|1,0,0]=3 4089 B12R1.1 CNCCCc1ccc(cc1)F Amb17104503 [0,2,0,0,0,0|1,0,0]=3 4090 B12R1.1 CNCCNc1ccc(Br)c[n]1 Amb18313330 [0,2,0,0,0,0|2,0,0]=4 4091 B12R1.1 CNCCNc1ccc(Br)cc1 Amb19025288 [0,2,0,0,0,0|1,0,0]=3 4092 B12R1.1 CNCCNc1ccc(Cl)c[n]1 Amb18313329 [0,2,0,0,0,0|2,0,0]=4 4093 B12R1.1 CNCCNc1ccc(Cl)cc1 Amb19025281 [0,2,0,0,0,0|1,0,0]=3 4094 B12R1.1 CNCCNc1ccc(F)c[n]1 Amb18313342 [0,2,0,0,0,0|2,0,0]=4 4095 B12R1.1 CNCCNc1ccc(F)cc1 Amb18312613 [0,2,0,0,0,0|1,0,0]=3 4096 B12R1.1 CNCCOc1ccc(O)cc1 Amb19507657 [0,2,0,0,0,0|1,0,0]=3 4097 B12R1.1 CNCCOc1ccc(cc1)Br Amb22166 [0,2,0,0,0,0|1,0,0]=3 4098 B12R1.1 CNCCOc1ccc(cc1)C Amb1670236 [0,2,0,0,0,0|1,0,0]=3 4099 B12R1.1 CNCCOc1ccc(cc1)C Amb2140580 [0,2,0,0,0,0|1,0,0]=3 4100 B12R1.1 CNCCOc1ccc(cc1)F Amb1156338 [0,2,0,0,0,0|1,0,0]=3 4101 B12R1.1 CNCCOc1ccc(cc1)F Amb2094492 [0,2,0,0,0,0|1,0,0]=3 4102 B12R1.1 CNCCOc1ccc(cc1)N Amb17232615 [0,2,0,0,0,0|1,0,0]=3 4103 B12R1.1 CNCCSc1ccc(Cl)cc1 Amb19024601 [0,2,0,0,0,0|1,0,0]=3 4104 B12R1.1 CNCCSc1ccc(cc1)C Amb10608765 [0,2,0,0,0,0|1,0,0]=3 4105 B12R1.1 CNC\C=C\c1ccc(Br)cc1 Amb23555646 [0,2,0,0,0,0|1,0,1]=4 4106 B12R1.1 CNC\C=C\c1ccc(Cl)cc1 Amb23555634 [0,2,0,0,0,0|1,0,1]=4 4107 B12R1.1 CNC\C=C\c1ccc(F)cc1 Amb23442932 [0,2,0,0,0,0|1,0,1]=4 4108 B12R1.1 COCCNc1ccc(cc1)N Amb10610074 [0,2,0,0,0,0|2,0,0]=4 4109 B12R1.1 COCCOc1ccc(cc1)N Amb1995318 [0,2,0,0,0,0|2,0,0]=4 4110 B12R1.1 COCCOc1ccc(cc1)N Amb2189147 [0,2,0,0,0,0|2,0,0]=4 4111 B12R1.1 COCSCc1ccc(cc1)N Amb17498310 [0,2,0,0,0,0|2,0,0]=4 4112 B12R1.1 CSCCNc1ccc(Br)cc1 Amb25725440 [0,2,0,0,0,0|2,0,0]=4 4113 B12R1.1 CSCCNc1ccc(F)cc1 Amb18312643 [0,2,0,0,0,0|2,0,0]=4 4114 B12R1.1 CSCCNc1ccc(cc1)C Amb17307505 [0,2,0,0,0,0|2,0,0]=4 4115 B12R1.1 CSCCOc1ccc(cc1)N Amb17504112 [0,2,0,0,0,0|2,0,0]=4 4116 B12R1.1 Cc1ccc(CCCCN)c[n]1 Amb18828702 [0,2,0,0,0,0|2,0,0]=4 4117 B12R1.1 Cc1ccc(CCNCC)c[n]1 Amb24066811 [0,2,0,0,0,0|2,0,0]=4 4118 B12R1.1 Cc1ccc(CNCCC)cc1 Amb19890384 [0,2,0,0,0,0|2,0,0]=4 4119 B12R1.1 Cc1ccc(COCC#C)cc1 Amb25092109 [0,2,0,0,0,0|2,0,0]=4 4120 B12R1.1 Cc1ccc(COCC#N)cc1 Amb25201451 [0,2,0,0,0,0|1,0,1]=4 4121 B12R1.1 Cc1ccc(CSCC#C)cc1 Amb25734271 [0,2,0,0,0,0|2,0,0]=4 4122 B12R1.1 Cc1ccc(CSCCCl)cc1 Amb21988400 [0,2,0,0,0,0|2,0,0]=4 4123 B12R1.1 Cc1ccc(NCCNC)[n]c1 Amb19027478 [0,2,0,0,0,0|2,0,0]=4 4124 B12R1.1 Cc1ccc(\C=C\CNC)cc1 Amb23442830 [0,2,0,0,0,0|1,0,1]=4 4125 B12R1.1 Cc1ccc(c[n]1)NCCCN Amb24402648 [0,2,0,0,0,0|2,0,0]=4 4126 B12R1.1 Cc1ccc(cc1)C#CCCN Amb25722543 [0,2,0,0,0,0|1,0,1]=4 4127 B12R1.1 Cc1ccc(cc1)NCCCCl Amb24443028 [0,2,0,0,0,0|2,0,0]=4 4128 B12R1.1 Cc1ccc(cc1)NCCNC Amb19025280 [0,2,0,0,0,0|1,0,0]=3 4129 B12R1.1 Cc1ccc(cc1)SCCC#C Amb25378502 [0,2,0,0,0,0|2,0,0]=4 4130 B12R1.1 Cc1ccc(cc1)SCCCN Amb21984206 [0,2,0,0,0,0|1,0,0]=3 4131 B12R1.1 Cc1ccc(cc1)SCCNC Amb19892872 [0,2,0,0,0,0|1,0,0]=3 4132 B12R1.1 ClCCCCc1ccc(cc1)Br Amb17160233 [0,2,0,0,0,0|2,0,0]=4 4133 B12R1.1 ClCCCCc1ccc(cc1)C Amb17139047 [0,2,0,0,0,0|2,0,0]=4 4134 B12R1.1 ClCCCCc1ccc(cc1)Cl Amb17139904 [0,2,0,0,0,0|2,0,0]=4 4135 B12R1.1 ClCCCCc1ccc(cc1)F Amb17139159 [0,2,0,0,0,0|2,0,0]=4 4136 B12R1.1 ClCCCOc1ccc(cc1)Br Amb1127124 [0,2,0,0,0,0|2,0,0]=4 4137 B12R1.1 ClCCCOc1ccc(cc1)Cl Amb1138390 [0,2,0,0,0,0|2,0,0]=4 4138 B12R1.1 ClCCCOc1ccc(cc1)F Amb1152973 [0,2,0,0,0,0|2,0,0]=4 4139 B12R1.1 ClCCNCc1ccc(cc1)C Amb17335658 [0,2,0,0,0,0|2,0,0]=4 4140 B12R1.1 ClCCOCc1ccc(cc1)Cl Amb2421038 [0,2,0,0,0,0|2,0,0]=4 4141 B12R1.1 ClCNCNc1ccc(cc1)I Amb16224771 [0,2,0,0,0,0|2,0,0]=4 4142 B12R1.1 Clc1ccc(CCC[Mg]Cl)cc1 Amb22897276 [0,2,0,0,0,0|2,0,0]=4 4143 B12R1.1 Clc1ccc(CCC[Zn]Cl)cc1 Amb22897731 [0,2,0,0,0,0|2,0,0]=4 4144 B12R1.1 Clc1ccc(CSCCCl)cc1 Amb22346452 [0,2,0,0,0,0|2,0,0]=4 4145 B12R1.1 Clc1ccc(cc1)NCCCCl Amb25780138 [0,2,0,0,0,0|2,0,0]=4 4146 B12R1.1 FCCCNc1ccc(Cl)cc1 Amb24452998 [0,2,0,0,0,0|2,0,0]=4 4147 B12R1.1 FCCCNc1ccc(I)cc1 Amb25705819 [0,2,0,0,0,0|2,0,0]=4 4148 B12R1.1 FCCCOc1ccc(Br)cc1 Amb22008308 [0,2,0,0,0,0|2,0,0]=4 4149 B12R1.1 Fc1ccc(CCCCBr)cc1 Amb20671699 [0,2,0,0,0,0|2,0,0]=4 4150 B12R1.1 Fc1ccc(CSCCCl)cc1 Amb21988508 [0,2,0,0,0,0|2,0,0]=4 4151 B12R1.1 Fc1ccc(cc1)NCCCF Amb24669915 [0,2,0,0,0,0|2,0,0]=4 4152 B12R1.1 N#CCCCc1ccc(O)cc1 Amb18645494 [0,2,0,0,0,0|1,0,1]=4 4153 B12R1.1 N#CCCCc1ccc(cc1)Br Amb17246438 [0,2,0,0,0,0|1,0,1]=4 4154 B12R1.1 N#CCCCc1ccc(cc1)C Amb17232302 [0,2,0,0,0,0|1,0,1]=4 4155 B12R1.1 N#CCCCc1ccc(cc1)Cl Amb17233649 [0,2,0,0,0,0|1,0,1]=4 4156 B12R1.1 N#CCCCc1ccc(cc1)F Amb17232424 [0,2,0,0,0,0|1,0,1]=4 4157 B12R1.1 N#CCCNc1ccc(cc1)Br Amb1149927 [0,2,0,0,0,0|1,0,1]=4 4158 B12R1.1 N#CCCNc1ccc(cc1)C Amb1643630 [0,2,0,0,0,0|1,0,1]=4 4159 B12R1.1 N#CCCNc1ccc(cc1)Cl Amb1647287 [0,2,0,0,0,0|1,0,1]=4 4160 B12R1.1 N#CCCNc1ccc(cc1)F Amb1103894 [0,2,0,0,0,0|1,0,1]=4 4161 B12R1.1 N#CCCNc1ccc(cc1)O Amb17142901 [0,2,0,0,0,0|1,0,1]=4 4162 B12R1.1 N#CCCOc1ccc(O)cc1 Amb25735175 [0,2,0,0,0,0|1,0,1]=4 4163 B12R1.1 N#CCCSc1ccc(cc1)C Amb1634502 [0,2,0,0,0,0|1,0,1]=4 4164 B12R1.1 N#CCNCc1ccc(Br)cc1 Amb18977451 [0,2,0,0,0,0|1,0,1]=4 4165 B12R1.1 N#CCNCc1ccc(O)cc1 Amb25154257 [0,2,0,0,0,0|1,0,1]=4 4166 B12R1.1 N#CCNCc1ccc(cc1)F Amb2416263 [0,2,0,0,0,0|1,0,1]=4 4167 B12R1.1 N#CCOCc1ccc(Br)cc1 Amb24649568 [0,2,0,0,0,0|1,0,1]=4 4168 B12R1.1 N#CCSCc1ccc(cc1)Br Amb17501726 [0,2,0,0,0,0|1,0,1]=4 4169 B12R1.1 N#CCSCc1ccc(cc1)C Amb17501722 [0,2,0,0,0,0|1,0,1]=4 4170 B12R1.1 N#CCSCc1ccc(cc1)F Amb17501725 [0,2,0,0,0,0|1,0,1]=4 4171 B12R1.1 N#CCSCc1ccc(cc1)N Amb17498135 [0,2,0,0,0,0|1,0,1]=4 4172 B12R1.1 N#CNCCc1ccc(Cl)cc1 Amb18809456 [0,2,0,0,0,0|0,0,1]=3 4173 B12R1.1 N#CNCCc1ccc(F)cc1 Amb18800778 [0,2,0,0,0,0|0,0,1]=3 4174 B12R1.1 NCCCCN1C=CC(=O)C=C1 Amb18534870 [0,2,0,0,0,0|2,0,0]=4 4175 B12R1.1 NCCCCc1ccc(Cl)cc1 Amb18015291 [0,2,0,0,0,0|1,0,0]=3 4176 B12R1.1 NCCCCc1ccc(O)cc1 Amb18828233 [0,2,0,0,0,0|1,0,0]=3 4177 B12R1.1 NCCCCc1ccc(O)cc1 Amb24117946 [0,2,0,0,0,0|1,0,0]=3 4178 B12R1.1 NCCCCc1ccc(cc1)Br Amb17195656 [0,2,0,0,0,0|1,0,0]=3 4179 B12R1.1 NCCCNc1ccc(Cl)[n]c1 Amb25336512 [0,2,0,0,0,0|2,0,0]=4 4180 B12R1.1 NCCCNc1ccc(F)c[n]1 Amb18306367 [0,2,0,0,0,0|2,0,0]=4 4181 B12R1.1 NCCCNc1ccc(cc1)Br Amb17057730 [0,2,0,0,0,0|1,0,0]=3 4182 B12R1.1 NCCCNc1ccc(cc1)C Amb17057723 [0,2,0,0,0,0|1,0,0]=3 4183 B12R1.1 NCCCNc1ccc(cc1)Cl Amb17057729 [0,2,0,0,0,0|1,0,0]=3 4184 B12R1.1 NCCCNc1ccc(cc1)F Amb17057726 [0,2,0,0,0,0|1,0,0]=3 4185 B12R1.1 NCCCNc1ccc(cn1)C Amb13949182 [0,2,0,0,0,0|2,0,0]=4 4186 B12R1.1 NCCCNc1ccc(cn1)N Amb17305771 [0,2,0,0,0,0|2,0,0]=4 4187 B12R1.1 NCCCNc1ccc(nc1)N Amb17305770 [0,2,0,0,0,0|2,0,0]=4 4188 B12R1.1 NCCCOc1ccc(cc1)C Amb1108458 [0,2,0,0,0,0|1,0,0]=3 4189 B12R1.1 NCCCOc1ccc(cc1)F Amb1108272 [0,2,0,0,0,0|1,0,0]=3 4190 B12R1.1 NCCCSc1ccc(Cl)cc1 Amb21984207 [0,2,0,0,0,0|1,0,0]=3 4191 B12R1.1 NCCCSc1ccc(cc1)F Amb162071 [0,2,0,0,0,0|1,0,0]=3 4192 B12R1.1 NCCCSc1ccc(cc1)F Amb2370740 [0,2,0,0,0,0|1,0,0]=3 4193 B12R1.1 NCCNCc1ccc(Br)cc1 Amb19012729 [0,2,0,0,0,0|1,0,0]=3 4194 B12R1.1 NCCNCc1ccc(Cl)[n]c1 Amb18129568 [0,2,0,0,0,0|2,0,0]=4 4195 B12R1.1 NCCNCc1ccc(cc1)Cl Amb10075508 [0,2,0,0,0,0|1,0,0]=3 4196 B12R1.1 NCCNCc1ccc(cc1)F Amb10075507 [0,2,0,0,0,0|1,0,0]=3 4197 B12R1.1 NCCOCc1ccc(cc1)Br Amb17061822 [0,2,0,0,0,0|1,0,0]=3 4198 B12R1.1 NCCOCc1ccc(cc1)C Amb17061816 [0,2,0,0,0,0|1,0,0]=3 4199 B12R1.1 NCCOCc1ccc(cc1)F Amb17061819 [0,2,0,0,0,0|1,0,0]=3 4200 B12R1.1 NCCSCc1ccc(cc1)Cl Amb1214895 [0,2,0,0,0,0|1,0,0]=3 4201 B12R1.1 NCC\C=C\c1ccc(I)cc1 Amb24493312 [0,2,0,0,0,0|1,0,1]=4 4202 B12R1.1 NCC\C=C\c1ccc(cc1)Br Amb17142136 [0,2,0,0,0,0|1,0,1]=4 4203 B12R1.1 NCC\C=C\c1ccc(cc1)C Amb17138533 [0,2,0,0,0,0|1,0,1]=4 4204 B12R1.1 NCC\C=C\c1ccc(cc1)Cl Amb17139018 [0,2,0,0,0,0|1,0,1]=4 4205 B12R1.1 NCC\C=C\c1ccc(cc1)F Amb17138587 [0,2,0,0,0,0|1,0,1]=4 4206 B12R1.1 NCC\N=C\c1ccc(Cl)cc1 Amb25238653 [0,2,0,0,0,0|1,0,1]=4 4207 B12R1.1 NNCCOc1ccc(cc1)Br Amb17407555 [0,2,0,0,0,0|0,0,0]=2 4208 B12R1.1 NNCCOc1ccc(cc1)C Amb1117290 [0,2,0,0,0,0|0,0,0]=2 4209 B12R1.1 NNCCOc1ccc(cc1)Cl Amb2282443 [0,2,0,0,0,0|0,0,0]=2 4210 B12R1.1 NNCCOc1ccc(cc1)Cl Amb2370789 [0,2,0,0,0,0|0,0,0]=2 4211 B12R1.1 NNCCOc1ccc(cc1)F Amb17400323 [0,2,0,0,0,0|0,0,0]=2 4212 B12R1.1 NNC\C=C\c1ccc(Cl)cc1 Amb18648722 [0,2,0,0,0,0|0,0,1]=3 4213 B12R1.1 NOCC#Cc1ccc(F)cc1 Amb24661686 [0,2,0,0,0,0|1,0,1]=4 4214 B12R1.1 NOCCCc1ccc(cc1)Br Amb17089579 [0,2,0,0,0,0|1,0,0]=3 4215 B12R1.1 NOCCCc1ccc(cc1)C Amb17089551 [0,2,0,0,0,0|1,0,0]=3 4216 B12R1.1 NOCCCc1ccc(cc1)Cl Amb17089560 [0,2,0,0,0,0|1,0,0]=3 4217 B12R1.1 NOCCCc1ccc(cc1)F Amb17089553 [0,2,0,0,0,0|1,0,0]=3 4218 B12R1.1 NOCCCc1ccc(cc1)O Amb17089576 [0,2,0,0,0,0|1,0,0]=3 4219 B12R1.1 NOCCOc1ccc(cc1)Br Amb17088299 [0,2,0,0,0,0|1,0,0]=3 4220 B12R1.1 NOCCOc1ccc(cc1)C Amb17088290 [0,2,0,0,0,0|1,0,0]=3 4221 B12R1.1 NOCCOc1ccc(cc1)Cl Amb17088296 [0,2,0,0,0,0|1,0,0]=3 4222 B12R1.1 NOCCOc1ccc(cc1)F Amb17088293 [0,2,0,0,0,0|1,0,0]=3 4223 B12R1.1 N\N=C\CCc1ccc(F)cc1 Amb25854847 [0,2,0,0,0,0|0,0,1]=3 4224 B12R1.1 Nc1ccc(CCCC#N)cc1 Amb18645390 [0,2,0,0,0,0|1,0,1]=4 4225 B12R1.1 Nc1ccc(CCCCO)cc1 Amb18828232 [0,2,0,0,0,0|2,0,0]=4 4226 B12R1.1 Nc1ccc(cc1)OCCC#N Amb18290036 [0,2,0,0,0,0|1,0,1]=4 4227 B12R1.1 Nc1ccc(cc1)OCCCF Amb22008519 [0,2,0,0,0,0|2,0,0]=4 4228 B12R1.1 Nc1ccc(cc1)SCCC#N Amb25151005 [0,2,0,0,0,0|1,0,1]=4 4229 B12R1.1 O=C=NCCc1ccc(cc1)Br Amb17089357 [0,2,0,0,0,0|1,0,1]=4 4230 B12R1.1 O=C=NCCc1ccc(cc1)C Amb17089349 [0,2,0,0,0,0|1,0,1]=4 4231 B12R1.1 O=C=NCCc1ccc(cc1)F Amb17089356 [0,2,0,0,0,0|1,0,1]=4 4232 B12R1.1 O=CCCCc1ccc(cc1)Br Amb17089176 [0,2,0,0,0,0|2,0,0]=4 4233 B12R1.1 O=CCCCc1ccc(cc1)C Amb17089167 [0,2,0,0,0,0|2,0,0]=4 4234 B12R1.1 O=CCCCc1ccc(cc1)Cl Amb17089175 [0,2,0,0,0,0|2,0,0]=4 4235 B12R1.1 O=CCCCc1ccc(cc1)F Amb17089174 [0,2,0,0,0,0|2,0,0]=4 4236 B12R1.1 O=CCCSc1ccc(cc1)Br Amb17082947 [0,2,0,0,0,0|2,0,0]=4 4237 B12R1.1 O=CCCSc1ccc(cc1)C Amb17082944 [0,2,0,0,0,0|2,0,0]=4 4238 B12R1.1 O=CCCSc1ccc(cc1)Cl Amb17082946 [0,2,0,0,0,0|2,0,0]=4 4239 B12R1.1 O=CCCSc1ccc(cc1)F Amb17082945 [0,2,0,0,0,0|2,0,0]=4 4240 B12R1.1 O=CNCCc1ccc(I)cc1 Amb25736857 [0,2,0,0,0,0|1,0,0]=3 4241 B12R1.1 O=CNCSc1ccc(Cl)cc1 Amb24495505 [0,2,0,0,0,0|2,0,0]=4 4242 B12R1.1 OCCCCc1ccc(cc1)Br Amb17089159 [0,2,0,0,0,0|2,0,0]=4 4243 B12R1.1 OCCCCc1ccc(cc1)C Amb16183285 [0,2,0,0,0,0|2,0,0]=4 4244 B12R1.1 OCCCCc1ccc(cc1)Cl Amb17089158 [0,2,0,0,0,0|2,0,0]=4 4245 B12R1.1 OCCCCc1ccc(cc1)F Amb17089157 [0,2,0,0,0,0|2,0,0]=4 4246 B12R1.1 OCCCNc1ccc(cc1)Br Amb17306798 [0,2,0,0,0,0|2,0,0]=4 4247 B12R1.1 OCCCNc1ccc(cc1)C Amb17306885 [0,2,0,0,0,0|2,0,0]=4 4248 B12R1.1 OCCCNc1ccc(cc1)Cl Amb17307252 [0,2,0,0,0,0|2,0,0]=4 4249 B12R1.1 OCCCNc1ccc(cc1)F Amb17306196 [0,2,0,0,0,0|2,0,0]=4 4250 B12R1.1 OCCCNc1ccc(cc1)I Amb17306250 [0,2,0,0,0,0|2,0,0]=4 4251 B12R1.1 OCCCOc1ccc(cc1)F Amb1109753 [0,2,0,0,0,0|2,0,0]=4 4252 B12R1.1 OCCOCc1ccc(cc1)Cl Amb2421036 [0,2,0,0,0,0|2,0,0]=4 4253 B12R1.1 ONCCOc1ccc(cc1)Br Amb17088425 [0,2,0,0,0,0|1,0,0]=3 4254 B12R1.1 ONCCOc1ccc(cc1)C Amb17088416 [0,2,0,0,0,0|1,0,0]=3 4255 B12R1.1 ONCCOc1ccc(cc1)Cl Amb17088422 [0,2,0,0,0,0|1,0,0]=3 4256 B12R1.1 ONCCOc1ccc(cc1)F Amb17088419 [0,2,0,0,0,0|1,0,0]=3 4257 B12R1.1 Oc1ccc(CCN=C=O)cc1 Amb25376148 [0,2,0,0,0,0|1,0,1]=4 4258 B12R1.1 Oc1ccc(CC\C=N\O)cc1 Amb24598916 [0,2,0,0,0,0|1,0,1]=4 4259 B12R1.1 Oc1ccc(cc1)NCCCF Amb22008518 [0,2,0,0,0,0|2,0,0]=4 4260 B12R1.1 Oc1ccc(cc1)OCCCBr Amb18135328 [0,2,0,0,0,0|2,0,0]=4 4261 B12R1.1 Oc1ccc(cc1)OCCCF Amb22008282 [0,2,0,0,0,0|2,0,0]=4 4262 B12R1.1 S=C=NCCc1ccc(cc1)Br Amb17255961 [0,2,0,0,0,0|1,0,1]=4 4263 B12R1.1 S=CNCCc1ccc(Cl)cc1 Amb24558852 [0,2,0,0,0,0|1,0,0]=3 4264 B12R1.1 SCCCCc1ccc(cc1)Br Amb17411242 [0,2,0,0,0,0|2,0,0]=4 4265 B12R1.1 SCCCCc1ccc(cc1)C Amb17400847 [0,2,0,0,0,0|2,0,0]=4 4266 B12R1.1 SCCCCc1ccc(cc1)Cl Amb17402392 [0,2,0,0,0,0|2,0,0]=4 4267 B12R1.1 SCCCCc1ccc(cc1)F Amb17401040 [0,2,0,0,0,0|2,0,0]=4 4268 B12R1.1 SCCCOc1ccc(cc1)Br Amb17258959 [0,2,0,0,0,0|2,0,0]=4 4269 B12R1.1 SCCCOc1ccc(cc1)C Amb10813402 [0,2,0,0,0,0|2,0,0]=4 4270 B12R1.1 SCCCOc1ccc(cc1)N Amb17504082 [0,2,0,0,0,0|2,0,0]=4 4271 B12R1.1 [C-]#[N+]CCCc1ccc(C)cc1 Amb24610675 [0,2,0,0,0,0|1,0,1]=4 4272 B12R1.1 [C-]#[N+]CCOc1ccc(O)cc1 Amb25178460 [0,2,0,0,0,0|1,0,1]=4 4273 B12R1.1 [C-]#[N+]CCSc1ccc(C)cc1 Amb24686207 [0,2,0,0,0,0|1,0,1]=4 4274 B12R1.1 [N-]=[N+]=NCCc1ccc(F)cc1 Amb25780260 [0,2,0,0,0,0|0,0,2]=4 4275 B12R1.1 [N-]=[N+]=NCCc1ccc(N)cc1 Amb24419918 [0,2,0,0,0,0|0,0,2]=4 4276 B12R1.16 BrCCC(c1ccc(cc1)Br)C Amb17290540 [0,2,0,0,0,0|2,0,0]=4 4277 B12R1.16 BrCCC(c1ccc(cc1)Cl)C Amb17259616 [0,2,0,0,0,0|2,0,0]=4 4278 B12R1.16 BrCCC(c1ccc(cc1)F)C Amb17249285 [0,2,0,0,0,0|2,0,0]=4 4279 B12R1.16 Brc1ccc(cc1)C(Br)CCBr Amb21864681 [0,2,0,0,0,0|2,0,0]=4 4280 B12R1.16 C#CCC(N)c1ccc(Cl)cc1 Amb18809277 [0,2,0,0,0,0|2,0,0]=4 4281 B12R1.16 C#CCC(N)c1ccc(F)cc1 Amb18959767 [0,2,0,0,0,0|2,0,0]=4 4282 B12R1.16 C#CCC(O)c1ccc(Cl)cc1 Amb18186756 [0,2,0,0,0,0|2,0,0]=4 4283 B12R1.16 C#CCC(O)c1ccc(F)cc1 Amb18800772 [0,2,0,0,0,0|2,0,0]=4 4284 B12R1.16 C#CCC(O)c1ccc(O)cc1 Amb18117920 [0,2,0,0,0,0|2,0,0]=4 4285 B12R1.16 C#CC[C@@H](O)c1ccc(F)cc1 Amb24100212 [0,2,0,0,0,0|2,0,0]=4 4286 B12R1.16 C#CC[C@H](N)c1ccc(Br)cc1 Amb24688092 [0,2,0,0,0,0|2,0,0]=4 4287 B12R1.16 C#CC[C@H](N)c1ccc(F)cc1 Amb24388527 [0,2,0,0,0,0|2,0,0]=4 4288 B12R1.16 C#CC[C@H](O)c1ccc(Cl)cc1 Amb24705595 [0,2,0,0,0,0|2,0,0]=4 4289 B12R1.16 C#CC[C@H](O)c1ccc(F)cc1 Amb25136315 [0,2,0,0,0,0|2,0,0]=4 4290 B12R1.16 C=CCC(Cl)c1ccc(Cl)cc1 Amb25039265 [0,2,0,0,0,0|2,0,0]=4 4291 B12R1.16 C=CCC(N)c1ccc(Br)cc1 Amb18977585 [0,2,0,0,0,0|2,0,0]=4 4292 B12R1.16 C=CCC(N)c1ccc(F)cc1 Amb18977583 [0,2,0,0,0,0|2,0,0]=4 4293 B12R1.16 C=CCC(N)c1ccc(F)cc1 Amb19889920 [0,2,0,0,0,0|2,0,0]=4 4294 B12R1.16 C=CCC(N)c1ccc(S)cc1 Amb24744499 [0,2,0,0,0,0|2,0,0]=4 4295 B12R1.16 C=CCC(O)c1ccc(F)cc1 Amb18788452 [0,2,0,0,0,0|2,0,0]=4 4296 B12R1.16 C=CCC(O)c1ccc(I)cc1 Amb24384870 [0,2,0,0,0,0|2,0,0]=4 4297 B12R1.16 C=CCC(O)c1ccc(O)cc1 Amb18646044 [0,2,0,0,0,0|2,0,0]=4 4298 B12R1.16 C=CCC(c1ccc(cc1)Cl)N Amb17226689 [0,2,0,0,0,0|2,0,0]=4 4299 B12R1.16 C=CC[C@@H](N)c1ccc(Br)cc1 Amb22831742 [0,2,0,0,0,0|2,0,0]=4 4300 B12R1.16 C=CC[C@@H](N)c1ccc(Cl)cc1 Amb22831187 [0,2,0,0,0,0|2,0,0]=4 4301 B12R1.16 C=CC[C@@H](N)c1ccc(F)cc1 Amb22831777 [0,2,0,0,0,0|2,0,0]=4 4302 B12R1.16 C=CC[C@@H](N)c1ccc(F)cc1 Amb23440406 [0,2,0,0,0,0|2,0,0]=4 4303 B12R1.16 C=CC[C@@H](N)c1ccc(O)cc1 Amb25113869 [0,2,0,0,0,0|2,0,0]=4 4304 B12R1.16 C=CC[C@@H](N)c1ccc(S)cc1 Amb25127949 [0,2,0,0,0,0|2,0,0]=4 4305 B12R1.16 C=CC[C@H](N)c1ccc(Br)cc1 Amb24682606 [0,2,0,0,0,0|2,0,0]=4 4306 B12R1.16 C=CC[C@H](N)c1ccc(Cl)cc1 Amb25698455 [0,2,0,0,0,0|2,0,0]=4 4307 B12R1.16 C=CC[C@H](N)c1ccc(O)cc1 Amb25737463 [0,2,0,0,0,0|2,0,0]=4 4308 B12R1.16 C=CC[C@H](O)c1ccc(Cl)cc1 Amb25114679 [0,2,0,0,0,0|2,0,0]=4 4309 B12R1.16 C=CC[C@H](O)c1ccc(O)cc1 Amb24532744 [0,2,0,0,0,0|2,0,0]=4 4310 B12R1.16 CC(CC#N)c1ccc(Br)cc1 Amb25794629 [0,2,0,0,0,0|1,0,1]=4 4311 B12R1.16 CC(CCN)c1ccc(Cl)cc1 Amb22034632 [0,2,0,0,0,0|1,0,0]=3 4312 B12R1.16 CC(CCN)c1ccc(N)cc1 Amb25856793 [0,2,0,0,0,0|1,0,0]=3 4313 B12R1.16 CC(CCO)c1ccc(N)cc1 Amb24553218 [0,2,0,0,0,0|2,0,0]=4 4314 B12R1.16 CC(CCS)c1ccc(N)cc1 Amb24442941 [0,2,0,0,0,0|2,0,0]=4 4315 B12R1.16 CCCC(Br)c1ccc(Cl)cc1 Amb25281165 [0,2,0,0,0,0|2,0,0]=4 4316 B12R1.16 CCCC(C)c1ccc(N)cc1 Amb18126395 [0,2,0,0,0,0|2,0,0]=4 4317 B12R1.16 CCCC(N)c1ccc(Cl)cc1 Amb20626143 [0,2,0,0,0,0|2,0,0]=4 4318 B12R1.16 CCCC(N)c1ccc(I)cc1 Amb25118824 [0,2,0,0,0,0|2,0,0]=4 4319 B12R1.16 CCCC(N)c1ccc(O)cc1 Amb18939625 [0,2,0,0,0,0|2,0,0]=4 4320 B12R1.16 CCCC(O)c1ccc(N)cc1 Amb24619836 [0,2,0,0,0,0|2,0,0]=4 4321 B12R1.16 CCCC(c1ccc(cc1)Br)Cl Amb17160235 [0,2,0,0,0,0|2,0,0]=4 4322 B12R1.16 CCCC(c1ccc(cc1)C)Cl Amb17139051 [0,2,0,0,0,0|2,0,0]=4 4323 B12R1.16 CCCC(c1ccc(cc1)Cl)Cl Amb17139906 [0,2,0,0,0,0|2,0,0]=4 4324 B12R1.16 CCCC(c1ccc(cc1)F)Cl Amb17139162 [0,2,0,0,0,0|2,0,0]=4 4325 B12R1.16 CCCC(c1ccc(cc1)O)C Amb17594074 [0,2,0,0,0,0|2,0,0]=4 4326 B12R1.16 CCC[C@@H](N)c1ccc(Br)cc1 Amb24729386 [0,2,0,0,0,0|2,0,0]=4 4327 B12R1.16 CCC[C@@H](N)c1ccc(Cl)cc1 Amb25043269 [0,2,0,0,0,0|2,0,0]=4 4328 B12R1.16 CCC[C@@H](N)c1ccc(F)cc1 Amb22298535 [0,2,0,0,0,0|2,0,0]=4 4329 B12R1.16 CCC[C@@H](N)c1ccc(F)cc1 Amb22744980 [0,2,0,0,0,0|2,0,0]=4 4330 B12R1.16 CCC[C@@H](N)c1ccc(I)cc1 Amb25195840 [0,2,0,0,0,0|2,0,0]=4 4331 B12R1.16 CCC[C@@H](N)c1ccc(N)cc1 Amb22288661 [0,2,0,0,0,0|2,0,0]=4 4332 B12R1.16 CCC[C@@H](N)c1ccc(N)cc1 Amb25149895 [0,2,0,0,0,0|2,0,0]=4 4333 B12R1.16 CCC[C@@H](N)c1ccc(O)cc1 Amb22288662 [0,2,0,0,0,0|2,0,0]=4 4334 B12R1.16 CCC[C@@H](N)c1ccc(O)cc1 Amb25063010 [0,2,0,0,0,0|2,0,0]=4 4335 B12R1.16 CCC[C@@H](O)c1ccc(Br)cc1 Amb25069849 [0,2,0,0,0,0|2,0,0]=4 4336 B12R1.16 CCC[C@@H](O)c1ccc(F)cc1 Amb24404009 [0,2,0,0,0,0|2,0,0]=4 4337 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb22298578 [0,2,0,0,0,0|2,0,0]=4 4338 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb24700451 [0,2,0,0,0,0|2,0,0]=4 4339 B12R1.16 CCC[C@H](N)c1ccc(I)cc1 Amb25337897 [0,2,0,0,0,0|2,0,0]=4 4340 B12R1.16 CCC[C@H](N)c1ccc(N)cc1 Amb22288706 [0,2,0,0,0,0|2,0,0]=4 4341 B12R1.16 CCC[C@H](N)c1ccc(O)cc1 Amb22288707 [0,2,0,0,0,0|2,0,0]=4 4342 B12R1.16 CCC[C@H](N)c1ccc(S)cc1 Amb24341710 [0,2,0,0,0,0|2,0,0]=4 4343 B12R1.16 CCC[C@H](O)c1ccc(Cl)cc1 Amb24483363 [0,2,0,0,0,0|2,0,0]=4 4344 B12R1.16 CCC[C@H](O)c1ccc(F)cc1 Amb24576719 [0,2,0,0,0,0|2,0,0]=4 4345 B12R1.16 CN(CCN)c1ccc(N)cc1 Amb18251776 [0,2,0,0,0,0|2,0,0]=4 4346 B12R1.16 CN(CCN)c1ccc(O)cc1 Amb18251791 [0,2,0,0,0,0|2,0,0]=4 4347 B12R1.16 CNCC(=C)c1ccc(O)cc1 Amb24727996 [0,2,0,0,0,0|1,0,1]=4 4348 B12R1.16 CNCC(=O)c1ccc(F)cc1 Amb24121219 [0,2,0,0,0,0|1,0,1]=4 4349 B12R1.16 CNCC(=O)c1ccc(N)cc1 Amb18550919 [0,2,0,0,0,0|1,0,1]=4 4350 B12R1.16 CNCC(=O)c1ccc(cc1)Br Amb17248090 [0,2,0,0,0,0|1,0,1]=4 4351 B12R1.16 CNCC(=O)c1ccc(cc1)C Amb17232427 [0,2,0,0,0,0|1,0,1]=4 4352 B12R1.16 CNCC(=O)c1ccc(cc1)F Amb17232631 [0,2,0,0,0,0|1,0,1]=4 4353 B12R1.16 CNCC(=O)c1ccc(cc1)O Amb1075808 [0,2,0,0,0,0|1,0,1]=4 4354 B12R1.16 CNCC(C)c1ccc(N)cc1 Amb24355889 [0,2,0,0,0,0|1,0,0]=3 4355 B12R1.16 CNCC(O)c1ccc(Br)c[n]1 Amb23586103 [0,2,0,0,0,0|2,0,0]=4 4356 B12R1.16 CNCC(O)c1ccc(F)cc1 Amb19373245 [0,2,0,0,0,0|1,0,0]=3 4357 B12R1.16 CNCC(O)c1ccc(I)cc1 Amb25742345 [0,2,0,0,0,0|1,0,0]=3 4358 B12R1.16 CNCC(O)c1ccc(N)cc1 Amb19888327 [0,2,0,0,0,0|1,0,0]=3 4359 B12R1.16 CNCC(O)c1ccc(O)cc1 Amb22166782 [0,2,0,0,0,0|1,0,0]=3 4360 B12R1.16 CNCC(O)c1ccc(O)cc1 Amb22346160 [0,2,0,0,0,0|1,0,0]=3 4361 B12R1.16 CNCC(c1ccc(cc1)Br)C Amb17248095 [0,2,0,0,0,0|1,0,0]=3 4362 B12R1.16 CNCC(c1ccc(cc1)Br)O Amb17142608 [0,2,0,0,0,0|1,0,0]=3 4363 B12R1.16 CNCC(c1ccc(cc1)C)C Amb17232442 [0,2,0,0,0,0|1,0,0]=3 4364 B12R1.16 CNCC(c1ccc(cc1)Cl)C Amb17234045 [0,2,0,0,0,0|1,0,0]=3 4365 B12R1.16 CNCC(c1ccc(cc1)F)C Amb17232642 [0,2,0,0,0,0|1,0,0]=3 4366 B12R1.16 CNC[C@@H](N)c1ccc(Cl)cc1 Amb25693381 [0,2,0,0,0,0|1,0,0]=3 4367 B12R1.16 CNC[C@@H](O)c1ccc(Cl)cc1 Amb25152551 [0,2,0,0,0,0|1,0,0]=3 4368 B12R1.16 CNC[C@@H](O)c1ccc(O)cc1 Amb25764531 [0,2,0,0,0,0|1,0,0]=3 4369 B12R1.16 CNC[C@H](O)c1ccc(Br)cc1 Amb25845203 [0,2,0,0,0,0|1,0,0]=3 4370 B12R1.16 CNC[C@H](O)c1ccc(Cl)cc1 Amb24423892 [0,2,0,0,0,0|1,0,0]=3 4371 B12R1.16 CNC[C@H](O)c1ccc(F)c[n]1 Amb25300377 [0,2,0,0,0,0|2,0,0]=4 4372 B12R1.16 COCC(C)c1ccc(N)cc1 Amb25362017 [0,2,0,0,0,0|2,0,0]=4 4373 B12R1.16 COCC(F)c1ccc(O)cc1 Amb25845176 [0,2,0,0,0,0|2,0,0]=4 4374 B12R1.16 COCC(N)c1ccc(Br)cc1 Amb18070171 [0,2,0,0,0,0|2,0,0]=4 4375 B12R1.16 COCC(N)c1ccc(Cl)cc1 Amb18979034 [0,2,0,0,0,0|2,0,0]=4 4376 B12R1.16 COCC(N)c1ccc(F)cc1 Amb19375549 [0,2,0,0,0,0|2,0,0]=4 4377 B12R1.16 COCC(N)c1ccc(I)cc1 Amb24648633 [0,2,0,0,0,0|2,0,0]=4 4378 B12R1.16 COCC(N)c1ccc(O)cc1 Amb24581245 [0,2,0,0,0,0|2,0,0]=4 4379 B12R1.16 COCC(N)c1ccc(S)cc1 Amb24393366 [0,2,0,0,0,0|2,0,0]=4 4380 B12R1.16 COCC(O)c1ccc(Cl)cc1 Amb19058986 [0,2,0,0,0,0|2,0,0]=4 4381 B12R1.16 COCC(O)c1ccc(F)cc1 Amb18793595 [0,2,0,0,0,0|2,0,0]=4 4382 B12R1.16 COCC(O)c1ccc(I)cc1 Amb25680763 [0,2,0,0,0,0|2,0,0]=4 4383 B12R1.16 COCC(O)c1ccc(N)cc1 Amb18987938 [0,2,0,0,0,0|2,0,0]=4 4384 B12R1.16 COCC(c1ccc(cc1)C)N Amb1127416 [0,2,0,0,0,0|2,0,0]=4 4385 B12R1.16 COCC(c1ccc(cc1)F)N Amb1139881 [0,2,0,0,0,0|2,0,0]=4 4386 B12R1.16 COC[C@@H](N)c1ccc(Cl)cc1 Amb25709133 [0,2,0,0,0,0|2,0,0]=4 4387 B12R1.16 COC[C@@H](N)c1ccc(N)cc1 Amb24585135 [0,2,0,0,0,0|2,0,0]=4 4388 B12R1.16 COC[C@@H](N)c1ccc(S)cc1 Amb25340455 [0,2,0,0,0,0|2,0,0]=4 4389 B12R1.16 COC[C@H](N)c1ccc(Cl)cc1 Amb25128001 [0,2,0,0,0,0|2,0,0]=4 4390 B12R1.16 COC[C@H](N)c1ccc(N)cc1 Amb25756886 [0,2,0,0,0,0|2,0,0]=4 4391 B12R1.16 COC[C@H](N)c1ccc(O)cc1 Amb24452863 [0,2,0,0,0,0|2,0,0]=4 4392 B12R1.16 COC[C@H](O)c1ccc(Cl)cc1 Amb25158166 [0,2,0,0,0,0|2,0,0]=4 4393 B12R1.16 CSCC(N)c1ccc(Cl)cc1 Amb18995345 [0,2,0,0,0,0|2,0,0]=4 4394 B12R1.16 CSCC(N)c1ccc(F)cc1 Amb18300300 [0,2,0,0,0,0|2,0,0]=4 4395 B12R1.16 CSCC(O)c1ccc(Cl)cc1 Amb24488689 [0,2,0,0,0,0|2,0,0]=4 4396 B12R1.16 CSCC(O)c1ccc(F)cc1 Amb19070006 [0,2,0,0,0,0|2,0,0]=4 4397 B12R1.16 CSCC(O)c1ccc(N)cc1 Amb18987939 [0,2,0,0,0,0|2,0,0]=4 4398 B12R1.16 C[15NH][13CH2][13CH](c1ccc(cc1)O)O Amb17620274 [0,2,0,0,0,0|1,0,0]=3 4399 B12R1.16 C[C@@H](CCBr)c1ccc(Cl)cc1 Amb24667919 [0,2,0,0,0,0|2,0,0]=4 4400 B12R1.16 C[C@@H](CCO)c1ccc(Cl)cc1 Amb25832765 [0,2,0,0,0,0|2,0,0]=4 4401 B12R1.16 C[C@@H](CCO)c1ccc(F)cc1 Amb25317656 [0,2,0,0,0,0|2,0,0]=4 4402 B12R1.16 C[C@H](CC=O)c1ccc(Cl)cc1 Amb25039267 [0,2,0,0,0,0|2,0,0]=4 4403 B12R1.16 Cc1ccc([n]c1)C(O)CNC Amb24380693 [0,2,0,0,0,0|2,0,0]=4 4404 B12R1.16 Cc1ccc(c[n]1)C(C)CCN Amb24525060 [0,2,0,0,0,0|2,0,0]=4 4405 B12R1.16 Cc1ccc(cc1)C(=O)CNO Amb25140702 [0,2,0,0,0,0|1,0,1]=4 4406 B12R1.16 Cc1ccc(cc1)C(=O)CON Amb25777089 [0,2,0,0,0,0|1,0,1]=4 4407 B12R1.16 Cc1ccc(cc1)C(Br)CCBr Amb23456168 [0,2,0,0,0,0|2,0,0]=4 4408 B12R1.16 Cc1ccc(cc1)C(Br)CCCl Amb24544004 [0,2,0,0,0,0|2,0,0]=4 4409 B12R1.16 Cc1ccc(cc1)C(C)CC=C Amb24556400 [0,2,0,0,0,0|2,0,0]=4 4410 B12R1.16 Cc1ccc(cc1)C(C)CC=O Amb18645706 [0,2,0,0,0,0|2,0,0]=4 4411 B12R1.16 Cc1ccc(cc1)C(Cl)CC=C Amb25772787 [0,2,0,0,0,0|2,0,0]=4 4412 B12R1.16 Cc1ccc(cc1)C(Cl)CCO Amb24552889 [0,2,0,0,0,0|2,0,0]=4 4413 B12R1.16 Cc1ccc(cc1)C(Cl)CSC Amb25805205 [0,2,0,0,0,0|2,0,0]=4 4414 B12R1.16 Cc1ccc(cc1)C(N)CC#C Amb18800158 [0,2,0,0,0,0|2,0,0]=4 4415 B12R1.16 Cc1ccc(cc1)C(N)CC#N Amb18563500 [0,2,0,0,0,0|1,0,1]=4 4416 B12R1.16 Cc1ccc(cc1)C(N)CC=C Amb18977589 [0,2,0,0,0,0|2,0,0]=4 4417 B12R1.16 Cc1ccc(cc1)C(N)CCN Amb18646152 [0,2,0,0,0,0|1,0,0]=3 4418 B12R1.16 Cc1ccc(cc1)C(N)CSC Amb18995350 [0,2,0,0,0,0|2,0,0]=4 4419 B12R1.16 Cc1ccc(cc1)C(O)CC#C Amb18800361 [0,2,0,0,0,0|2,0,0]=4 4420 B12R1.16 Cc1ccc(cc1)C(O)CC=C Amb18177785 [0,2,0,0,0,0|2,0,0]=4 4421 B12R1.16 Cc1ccc(cc1)C(O)CC=O Amb24391927 [0,2,0,0,0,0|2,0,0]=4 4422 B12R1.16 Cc1ccc(cc1)C(O)CCO Amb18563722 [0,2,0,0,0,0|2,0,0]=4 4423 B12R1.16 Cc1ccc(cc1)C(O)COC Amb18792767 [0,2,0,0,0,0|2,0,0]=4 4424 B12R1.16 Cc1ccc(cc1)C(O)CSC Amb19061295 [0,2,0,0,0,0|2,0,0]=4 4425 B12R1.16 Cc1ccc(cc1)C(S)CCN Amb25112044 [0,2,0,0,0,0|1,0,0]=3 4426 B12R1.16 Cc1ccc(cc1)S(=O)CCN Amb18290917 [0,2,0,0,0,0|2,0,0]=4 4427 B12R1.16 Cc1ccc(cc1)[C@@H](C)CCO Amb25058547 [0,2,0,0,0,0|2,0,0]=4 4428 B12R1.16 Cc1ccc(cc1)[C@@H](N)CC=C Amb22831227 [0,2,0,0,0,0|2,0,0]=4 4429 B12R1.16 Cc1ccc(cc1)[C@@H](N)CCC Amb22298580 [0,2,0,0,0,0|2,0,0]=4 4430 B12R1.16 Cc1ccc(cc1)[C@@H](N)CCO Amb19888370 [0,2,0,0,0,0|2,0,0]=4 4431 B12R1.16 Cc1ccc(cc1)[C@@H](N)CCO Amb23399704 [0,2,0,0,0,0|2,0,0]=4 4432 B12R1.16 Cc1ccc(cc1)[C@@H](O)CC#C Amb25706066 [0,2,0,0,0,0|2,0,0]=4 4433 B12R1.16 Cc1ccc(cc1)[C@@H](O)CC#N Amb24706705 [0,2,0,0,0,0|1,0,1]=4 4434 B12R1.16 Cc1ccc(cc1)[C@@H](O)CCC Amb24364768 [0,2,0,0,0,0|2,0,0]=4 4435 B12R1.16 Cc1ccc(cc1)[C@H](C)CC=O Amb24697433 [0,2,0,0,0,0|2,0,0]=4 4436 B12R1.16 Cc1ccc(cc1)[C@H](C)CCO Amb24671505 [0,2,0,0,0,0|2,0,0]=4 4437 B12R1.16 Cc1ccc(cc1)[C@H](N)CCC Amb22298537 [0,2,0,0,0,0|2,0,0]=4 4438 B12R1.16 Cc1ccc(cc1)[C@H](N)CCO Amb19887704 [0,2,0,0,0,0|2,0,0]=4 4439 B12R1.16 Cc1ccc(cc1)[C@H](N)COC Amb24734357 [0,2,0,0,0,0|2,0,0]=4 4440 B12R1.16 Cc1ccc(cc1)[C@H](O)CCC Amb24709228 [0,2,0,0,0,0|2,0,0]=4 4441 B12R1.16 Cc1ccc(cc1)[C@H](O)CCCl Amb25361013 [0,2,0,0,0,0|2,0,0]=4 4442 B12R1.16 ClC(CCBr)c1ccc(Br)cc1 Amb21864682 [0,2,0,0,0,0|2,0,0]=4 4443 B12R1.16 ClCCC(c1ccc(cc1)Br)C Amb17259618 [0,2,0,0,0,0|2,0,0]=4 4444 B12R1.16 ClCCC(c1ccc(cc1)Br)O Amb17196599 [0,2,0,0,0,0|2,0,0]=4 4445 B12R1.16 ClCCC(c1ccc(cc1)C)C Amb17233970 [0,2,0,0,0,0|2,0,0]=4 4446 B12R1.16 ClCCC(c1ccc(cc1)C)O Amb17194565 [0,2,0,0,0,0|2,0,0]=4 4447 B12R1.16 ClCCC(c1ccc(cc1)Cl)C Amb17237597 [0,2,0,0,0,0|2,0,0]=4 4448 B12R1.16 ClCCC(c1ccc(cc1)Cl)O Amb17194897 [0,2,0,0,0,0|2,0,0]=4 4449 B12R1.16 ClCCC(c1ccc(cc1)F)C Amb17234366 [0,2,0,0,0,0|2,0,0]=4 4450 B12R1.16 ClCCC(c1ccc(cc1)F)O Amb17194592 [0,2,0,0,0,0|2,0,0]=4 4451 B12R1.16 Clc1ccc(cc1)C(Br)CCBr Amb22001093 [0,2,0,0,0,0|2,0,0]=4 4452 B12R1.16 Clc1ccc(cc1)C(Br)CCCl Amb25089461 [0,2,0,0,0,0|2,0,0]=4 4453 B12R1.16 Fc1ccc(cc1)C(Br)CCCl Amb24741485 [0,2,0,0,0,0|2,0,0]=4 4454 B12R1.16 ICC[C@@H](c1ccc(cc1)F)O Amb16233257 [0,2,0,0,0,0|2,0,0]=4 4455 B12R1.16 N#CCC(O)c1ccc(Br)cc1 Amb18134741 [0,2,0,0,0,0|1,0,1]=4 4456 B12R1.16 N#CC[C@H](O)c1ccc(F)cc1 Amb24683357 [0,2,0,0,0,0|1,0,1]=4 4457 B12R1.16 NC(CC#N)c1ccc(Br)cc1 Amb18069916 [0,2,0,0,0,0|1,0,1]=4 4458 B12R1.16 NC(CC#N)c1ccc(Cl)cc1 Amb18564160 [0,2,0,0,0,0|1,0,1]=4 4459 B12R1.16 NC(CC#N)c1ccc(F)cc1 Amb18563605 [0,2,0,0,0,0|1,0,1]=4 4460 B12R1.16 NC(CCO)c1ccc(Cl)cc1 Amb19888463 [0,2,0,0,0,0|2,0,0]=4 4461 B12R1.16 NC(CCO)c1ccc(F)cc1 Amb22490662 [0,2,0,0,0,0|2,0,0]=4 4462 B12R1.16 NCCC(=O)c1ccc(cc1)Br Amb17195655 [0,2,0,0,0,0|1,0,1]=4 4463 B12R1.16 NCCC(=O)c1ccc(cc1)C Amb17194471 [0,2,0,0,0,0|1,0,1]=4 4464 B12R1.16 NCCC(=O)c1ccc(cc1)Cl Amb17194559 [0,2,0,0,0,0|1,0,1]=4 4465 B12R1.16 NCCC(=O)c1ccc(cc1)F Amb17108934 [0,2,0,0,0,0|1,0,1]=4 4466 B12R1.16 NCCC(F)c1ccc(Br)cc1 Amb25255565 [0,2,0,0,0,0|1,0,0]=3 4467 B12R1.16 NCCC(N)c1ccc(Br)cc1 Amb24655128 [0,2,0,0,0,0|1,0,0]=3 4468 B12R1.16 NCCC(N)c1ccc(F)cc1 Amb18646990 [0,2,0,0,0,0|1,0,0]=3 4469 B12R1.16 NCCC(N)c1ccc(I)cc1 Amb25339716 [0,2,0,0,0,0|1,0,0]=3 4470 B12R1.16 NCCC(O)c1ccc(Cl)cc1 Amb21984559 [0,2,0,0,0,0|1,0,0]=3 4471 B12R1.16 NCCC(O)c1ccc(F)c[n]1 Amb24536213 [0,2,0,0,0,0|2,0,0]=4 4472 B12R1.16 NCCC(O)c1ccc(F)cc1 Amb21984558 [0,2,0,0,0,0|1,0,0]=3 4473 B12R1.16 NCCC(c1ccc(cc1)Br)O Amb17079141 [0,2,0,0,0,0|1,0,0]=3 4474 B12R1.16 NCCC(c1ccc(cc1)C)O Amb17079132 [0,2,0,0,0,0|1,0,0]=3 4475 B12R1.16 NCCC(c1ccc(cc1)Cl)O Amb17079140 [0,2,0,0,0,0|1,0,0]=3 4476 B12R1.16 NCCC(c1ccc(cc1)F)O Amb17079139 [0,2,0,0,0,0|1,0,0]=3 4477 B12R1.16 NCCN(c1ccc(cc1)Br)C Amb17059648 [0,2,0,0,0,0|2,0,0]=4 4478 B12R1.16 NCCN(c1ccc(cc1)C)C Amb13893182 [0,2,0,0,0,0|2,0,0]=4 4479 B12R1.16 NCCN(c1ccc(cc1)Cl)C Amb17059647 [0,2,0,0,0,0|2,0,0]=4 4480 B12R1.16 NCCN(c1ccc(cc1)F)C Amb17059644 [0,2,0,0,0,0|2,0,0]=4 4481 B12R1.16 NCCS(=O)c1ccc(Br)cc1 Amb18290919 [0,2,0,0,0,0|2,0,0]=4 4482 B12R1.16 NCCS(=O)c1ccc(Cl)cc1 Amb18974515 [0,2,0,0,0,0|2,0,0]=4 4483 B12R1.16 NCCS(=O)c1ccc(F)cc1 Amb18974517 [0,2,0,0,0,0|2,0,0]=4 4484 B12R1.16 NCCS(=O)c1ccc(I)cc1 Amb25315872 [0,2,0,0,0,0|2,0,0]=4 4485 B12R1.16 NCC[C@@H](N)c1ccc(Br)[n]c1 Amb24610157 [0,2,0,0,0,0|2,0,0]=4 4486 B12R1.16 NCC[C@@H](N)c1ccc(Br)cc1 Amb24655137 [0,2,0,0,0,0|1,0,0]=3 4487 B12R1.16 NCC[C@@H](N)c1ccc(F)cc1 Amb24549962 [0,2,0,0,0,0|1,0,0]=3 4488 B12R1.16 NCC[C@@H](O)c1ccc(F)cc1 Amb25148762 [0,2,0,0,0,0|1,0,0]=3 4489 B12R1.16 NCC[C@H](N)c1ccc(Br)cc1 Amb24617766 [0,2,0,0,0,0|1,0,0]=3 4490 B12R1.16 NCC[C@H](N)c1ccc(F)cc1 Amb25314561 [0,2,0,0,0,0|1,0,0]=3 4491 B12R1.16 NCC[C@H](O)c1ccc(Cl)cc1 Amb24727053 [0,2,0,0,0,0|1,0,0]=3 4492 B12R1.16 NCC[C@H](O)c1ccc(F)cc1 Amb25148765 [0,2,0,0,0,0|1,0,0]=3 4493 B12R1.16 NNCC(c1ccc(cc1)Br)O Amb17249280 [0,2,0,0,0,0|0,0,0]=2 4494 B12R1.16 NNCC(c1ccc(cc1)C)O Amb17232610 [0,2,0,0,0,0|0,0,0]=2 4495 B12R1.16 NNCC(c1ccc(cc1)Cl)O Amb17234362 [0,2,0,0,0,0|0,0,0]=2 4496 B12R1.16 NNCC(c1ccc(cc1)F)O Amb17232743 [0,2,0,0,0,0|0,0,0]=2 4497 B12R1.16 NOCC(=O)c1ccc(Br)cc1 Amb25159956 [0,2,0,0,0,0|1,0,1]=4 4498 B12R1.16 NOCC(c1ccc(cc1)Br)O Amb17345008 [0,2,0,0,0,0|1,0,0]=3 4499 B12R1.16 NOCC(c1ccc(cc1)C)O Amb17334705 [0,2,0,0,0,0|1,0,0]=3 4500 B12R1.16 NOCC(c1ccc(cc1)Cl)O Amb17335950 [0,2,0,0,0,0|1,0,0]=3 4501 B12R1.16 NOCC(c1ccc(cc1)F)O Amb17334839 [0,2,0,0,0,0|1,0,0]=3 4502 B12R1.16 N[C@@H](CC#N)c1ccc(Cl)cc1 Amb25679689 [0,2,0,0,0,0|1,0,1]=4 4503 B12R1.16 N[C@@H](CC#N)c1ccc(F)cc1 Amb24458202 [0,2,0,0,0,0|1,0,1]=4 4504 B12R1.16 N[C@@H](CC#N)c1ccc(O)cc1 Amb25107906 [0,2,0,0,0,0|1,0,1]=4 4505 B12R1.16 N[C@@H](CC#N)c1ccc(S)cc1 Amb25359865 [0,2,0,0,0,0|1,0,1]=4 4506 B12R1.16 N[C@@H](CCO)c1ccc(Cl)cc1 Amb19888405 [0,2,0,0,0,0|2,0,0]=4 4507 B12R1.16 N[C@@H](CCO)c1ccc(Cl)cc1 Amb22747365 [0,2,0,0,0,0|2,0,0]=4 4508 B12R1.16 N[C@@H](CCO)c1ccc(F)cc1 Amb19888378 [0,2,0,0,0,0|2,0,0]=4 4509 B12R1.16 N[C@@H](CCO)c1ccc(O)cc1 Amb24446583 [0,2,0,0,0,0|2,0,0]=4 4510 B12R1.16 N[C@H](CC#N)c1ccc(Cl)cc1 Amb25149820 [0,2,0,0,0,0|1,0,1]=4 4511 B12R1.16 N[C@H](CC#N)c1ccc(F)cc1 Amb25092307 [0,2,0,0,0,0|1,0,1]=4 4512 B12R1.16 N[C@H](CC#N)c1ccc(S)cc1 Amb24485695 [0,2,0,0,0,0|1,0,1]=4 4513 B12R1.16 N[C@H](CCO)c1ccc(Br)cc1 Amb19887638 [0,2,0,0,0,0|2,0,0]=4 4514 B12R1.16 N[C@H](CCO)c1ccc(Cl)cc1 Amb19887657 [0,2,0,0,0,0|2,0,0]=4 4515 B12R1.16 N[C@H](CCO)c1ccc(F)cc1 Amb19887667 [0,2,0,0,0,0|2,0,0]=4 4516 B12R1.16 N[C@H](CCO)c1ccc(O)cc1 Amb25339383 [0,2,0,0,0,0|2,0,0]=4 4517 B12R1.16 N[C@H](CCO)c1ccc(S)cc1 Amb25824151 [0,2,0,0,0,0|2,0,0]=4 4518 B12R1.16 Nc1ccc(cc1)C(=O)CCN Amb24550545 [0,2,0,0,0,0|1,0,1]=4 4519 B12R1.16 Nc1ccc(cc1)C(N)CCO Amb19887602 [0,2,0,0,0,0|2,0,0]=4 4520 B12R1.16 Nc1ccc(cc1)[C@@H](N)CC#N Amb24703347 [0,2,0,0,0,0|1,0,1]=4 4521 B12R1.16 Nc1ccc(cc1)[C@H](N)CCO Amb19887604 [0,2,0,0,0,0|2,0,0]=4 4522 B12R1.16 OC(CC=O)c1ccc(Cl)cc1 Amb25094341 [0,2,0,0,0,0|2,0,0]=4 4523 B12R1.16 OC(CC=O)c1ccc(F)cc1 Amb25053144 [0,2,0,0,0,0|2,0,0]=4 4524 B12R1.16 OC(CCI)c1ccc(F)cc1 Amb24537939 [0,2,0,0,0,0|2,0,0]=4 4525 B12R1.16 OC(c1ccc(cc1)C)CC#N Amb17232362 [0,2,0,0,0,0|1,0,1]=4 4526 B12R1.16 OC(c1ccc(cc1)F)CC#N Amb17232518 [0,2,0,0,0,0|1,0,1]=4 4527 B12R1.16 OCCC(Cl)c1ccc(Cl)cc1 Amb24752170 [0,2,0,0,0,0|2,0,0]=4 4528 B12R1.16 OCCC(F)c1ccc(F)cc1 Amb25158049 [0,2,0,0,0,0|2,0,0]=4 4529 B12R1.16 OCCC(O)c1ccc(Br)cc1 Amb18070318 [0,2,0,0,0,0|2,0,0]=4 4530 B12R1.16 OCCC(O)c1ccc(Cl)cc1 Amb18066186 [0,2,0,0,0,0|2,0,0]=4 4531 B12R1.16 OCCC(O)c1ccc(F)cc1 Amb18563926 [0,2,0,0,0,0|2,0,0]=4 4532 B12R1.16 OCCC(c1ccc(cc1)Br)C Amb17248426 [0,2,0,0,0,0|2,0,0]=4 4533 B12R1.16 OCCC(c1ccc(cc1)C)C Amb17232490 [0,2,0,0,0,0|2,0,0]=4 4534 B12R1.16 OCCC(c1ccc(cc1)C)N Amb17103955 [0,2,0,0,0,0|2,0,0]=4 4535 B12R1.16 OCCC(c1ccc(cc1)Cl)C Amb17234157 [0,2,0,0,0,0|2,0,0]=4 4536 B12R1.16 OCCC(c1ccc(cc1)Cl)N Amb1993959 [0,2,0,0,0,0|2,0,0]=4 4537 B12R1.16 OCCC(c1ccc(cc1)F)C Amb17232668 [0,2,0,0,0,0|2,0,0]=4 4538 B12R1.16 OCC[C@@H](O)c1ccc(Cl)cc1 Amb24749568 [0,2,0,0,0,0|2,0,0]=4 4539 B12R1.16 OCC[C@@H](O)c1ccc(F)cc1 Amb25070596 [0,2,0,0,0,0|2,0,0]=4 4540 B12R1.16 OCC[C@H](O)c1ccc(Cl)cc1 Amb25129763 [0,2,0,0,0,0|2,0,0]=4 4541 B12R1.16 OCC[C@H](O)c1ccc(F)cc1 Amb24601023 [0,2,0,0,0,0|2,0,0]=4 4542 B12R1.16 ONCC(c1ccc(cc1)Br)O Amb17345007 [0,2,0,0,0,0|1,0,0]=3 4543 B12R1.16 ONCC(c1ccc(cc1)C)O Amb17334704 [0,2,0,0,0,0|1,0,0]=3 4544 B12R1.16 ONCC(c1ccc(cc1)Cl)O Amb17335949 [0,2,0,0,0,0|1,0,0]=3 4545 B12R1.16 ONCC(c1ccc(cc1)F)O Amb17334838 [0,2,0,0,0,0|1,0,0]=3 4546 B12R1.16 ONCC(c1ccc(cc1)O)O Amb17334758 [0,2,0,0,0,0|1,0,0]=3 4547 B12R1.16 O[C@@H](CCCl)c1ccc(F)cc1 Amb25073942 [0,2,0,0,0,0|2,0,0]=4 4548 B12R1.16 O[C@H](CCCl)c1ccc(F)cc1 Amb24711502 [0,2,0,0,0,0|2,0,0]=4 4549 B12R1.16 [C-]#[N+]CC(Cl)c1ccc(Cl)cc1 Amb25086191 [0,2,0,0,0,0|1,0,1]=4 4550 B12R1.21 CC(Br)CCc1ccc(Br)cc1 Amb25803938 [0,2,0,0,0,0|2,0,0]=4 4551 B12R1.21 CC(Br)CCc1ccc(O)cc1 Amb24532811 [0,2,0,0,0,0|2,0,0]=4 4552 B12R1.21 CC(C)CCc1ccc(S)cc1 Amb19888153 [0,2,0,0,0,0|2,0,0]=4 4553 B12R1.21 CC(CCc1ccc(cc1)Br)C Amb2226924 [0,2,0,0,0,0|2,0,0]=4 4554 B12R1.21 CC(CCc1ccc(cc1)Cl)O Amb17507284 [0,2,0,0,0,0|2,0,0]=4 4555 B12R1.21 CC(CCc1ccc(cc1)F)O Amb17507285 [0,2,0,0,0,0|2,0,0]=4 4556 B12R1.21 CC(CCc1ccc(cc1)O)O Amb1110722 [0,2,0,0,0,0|2,0,0]=4 4557 B12R1.21 CC(COc1ccc(cc1)Cl)N Amb17224217 [0,2,0,0,0,0|2,0,0]=4 4558 B12R1.21 CC(COc1ccc(cc1)F)N Amb10609780 [0,2,0,0,0,0|2,0,0]=4 4559 B12R1.21 CC(COc1ccc(cc1)F)N Amb1140862 [0,2,0,0,0,0|2,0,0]=4 4560 B12R1.21 CC(Cl)CCc1ccc(Br)cc1 Amb25796648 [0,2,0,0,0,0|2,0,0]=4 4561 B12R1.21 CC(Cl)CCc1ccc(Cl)cc1 Amb24488696 [0,2,0,0,0,0|2,0,0]=4 4562 B12R1.21 CC(Cl)CCc1ccc(F)cc1 Amb19076402 [0,2,0,0,0,0|2,0,0]=4 4563 B12R1.21 CC(Cl)CCc1ccc(O)cc1 Amb25715798 [0,2,0,0,0,0|2,0,0]=4 4564 B12R1.21 CC(F)CCc1ccc(N)cc1 Amb24511306 [0,2,0,0,0,0|2,0,0]=4 4565 B12R1.21 CC(N)CCc1ccc(Br)c[n]1 Amb25204452 [0,2,0,0,0,0|2,0,0]=4 4566 B12R1.21 CC(N)CCc1ccc(Br)cc1 Amb17991263 [0,2,0,0,0,0|1,0,0]=3 4567 B12R1.21 CC(N)CCc1ccc(Cl)cc1 Amb22461482 [0,2,0,0,0,0|1,0,0]=3 4568 B12R1.21 CC(N)CNc1ccc(F)cc1 Amb25237265 [0,2,0,0,0,0|2,0,0]=4 4569 B12R1.21 CC(N)COc1ccc(I)cc1 Amb25249613 [0,2,0,0,0,0|2,0,0]=4 4570 B12R1.21 CC(N)COc1ccc(O)cc1 Amb22446609 [0,2,0,0,0,0|2,0,0]=4 4571 B12R1.21 CC(N)CSc1ccc(Br)cc1 Amb18576934 [0,2,0,0,0,0|2,0,0]=4 4572 B12R1.21 CC(N)CSc1ccc(Cl)cc1 Amb18066330 [0,2,0,0,0,0|2,0,0]=4 4573 B12R1.21 CC(N)CSc1ccc(Cl)cc1 Amb21988434 [0,2,0,0,0,0|2,0,0]=4 4574 B12R1.21 CC(N)CSc1ccc(F)cc1 Amb18564329 [0,2,0,0,0,0|2,0,0]=4 4575 B12R1.21 CC(N)CSc1ccc(O)cc1 Amb25350095 [0,2,0,0,0,0|2,0,0]=4 4576 B12R1.21 CC(O)CCc1ccc(Br)cc1 Amb24056590 [0,2,0,0,0,0|2,0,0]=4 4577 B12R1.21 CN(C)CCc1ccc(Br)[n]c1 Amb24749844 [0,2,0,0,0,0|2,0,0]=4 4578 B12R1.21 CN(C)CCc1ccc(Br)cc1 Amb21858668 [0,2,0,0,0,0|1,0,0]=3 4579 B12R1.21 CN(C)CCc1ccc(N)cc1 Amb22756010 [0,2,0,0,0,0|1,0,0]=3 4580 B12R1.21 CN(C)NCc1ccc(Br)cc1 Amb25156646 [0,2,0,0,0,0|2,0,0]=4 4581 B12R1.21 CN(C)NCc1ccc(Cl)cc1 Amb24359510 [0,2,0,0,0,0|2,0,0]=4 4582 B12R1.21 CN(C)NCc1ccc(F)cc1 Amb25744432 [0,2,0,0,0,0|2,0,0]=4 4583 B12R1.21 CN(C)NCc1ccc(N)cc1 Amb24634168 [0,2,0,0,0,0|2,0,0]=4 4584 B12R1.21 CN(C)NCc1ccc(O)cc1 Amb24493145 [0,2,0,0,0,0|2,0,0]=4 4585 B12R1.21 CN(N)CCc1ccc(Br)cc1 Amb18070402 [0,2,0,0,0,0|0,0,0]=2 4586 B12R1.21 CN(N)CCc1ccc(Cl)cc1 Amb18564318 [0,2,0,0,0,0|0,0,0]=2 4587 B12R1.21 CN(N)CCc1ccc(F)cc1 Amb18563851 [0,2,0,0,0,0|0,0,0]=2 4588 B12R1.21 CS(=O)CCc1ccc(N)cc1 Amb18974603 [0,2,0,0,0,0|2,0,0]=4 4589 B12R1.21 CS(=O)CCc1ccc(cc1)C Amb16185126 [0,2,0,0,0,0|2,0,0]=4 4590 B12R1.21 C[C@@H](COc1ccc(cc1)Br)N Amb17248852 [0,2,0,0,0,0|2,0,0]=4 4591 B12R1.21 C[C@@H](COc1ccc(cc1)C)N Amb17232559 [0,2,0,0,0,0|2,0,0]=4 4592 B12R1.21 C[C@@H](COc1ccc(cc1)Cl)N Amb17234272 [0,2,0,0,0,0|2,0,0]=4 4593 B12R1.21 C[C@@H](COc1ccc(cc1)F)N Amb17232708 [0,2,0,0,0,0|2,0,0]=4 4594 B12R1.21 C[C@@H](N)COc1ccc(Br)cc1 Amb18036080 [0,2,0,0,0,0|2,0,0]=4 4595 B12R1.21 C[C@@H](N)COc1ccc(Cl)cc1 Amb18538520 [0,2,0,0,0,0|2,0,0]=4 4596 B12R1.21 C[C@@H](N)CSc1ccc(Cl)cc1 Amb25073658 [0,2,0,0,0,0|2,0,0]=4 4597 B12R1.21 C[C@@H](N)CSc1ccc(F)cc1 Amb25715002 [0,2,0,0,0,0|2,0,0]=4 4598 B12R1.21 C[C@@H](O)CCc1ccc(O)cc1 Amb23604212 [0,2,0,0,0,0|2,0,0]=4 4599 B12R1.21 C[C@H](N)CCc1ccc(Cl)cc1 Amb24702508 [0,2,0,0,0,0|1,0,0]=3 4600 B12R1.21 C[C@H](N)CCc1ccc(F)cc1 Amb24624091 [0,2,0,0,0,0|1,0,0]=3 4601 B12R1.21 Cc1ccc(CCC(C)Cl)cc1 Amb19074261 [0,2,0,0,0,0|2,0,0]=4 4602 B12R1.21 Cc1ccc(CCC(C)N)[n]c1 Amb25751617 [0,2,0,0,0,0|2,0,0]=4 4603 B12R1.21 Cc1ccc(CCC(C)O)cc1 Amb18800837 [0,2,0,0,0,0|2,0,0]=4 4604 B12R1.21 Cc1ccc(CCC(N)=N)cc1 Amb18065466 [0,2,0,0,0,0|1,0,0]=3 4605 B12R1.21 Cc1ccc(CCC(N)=S)[n]c1 Amb24544853 [0,2,0,0,0,0|2,0,0]=4 4606 B12R1.21 Cc1ccc(CCN(C)N)cc1 Amb18563653 [0,2,0,0,0,0|0,0,0]=2 4607 B12R1.21 Cc1ccc(CNC(N)=N)cc1 Amb22093607 [0,2,0,0,0,0|2,0,0]=4 4608 B12R1.21 Cc1ccc(CNN(C)C)cc1 Amb24492984 [0,2,0,0,0,0|2,0,0]=4 4609 B12R1.21 Cc1ccc(CSC(N)=N)cc1 Amb20675974 [0,2,0,0,0,0|2,0,0]=4 4610 B12R1.21 Cc1ccc(cc1)CC[N+](=O)[O-] Amb17400178 [0,2,0,0,0,0|1,0,1]=4 4611 B12R1.21 Cc1ccc(cc1)NCC(C)N Amb22410806 [0,2,0,0,0,0|2,0,0]=4 4612 B12R1.21 Cc1ccc(cc1)OC[C@@H](C)N Amb18538493 [0,2,0,0,0,0|2,0,0]=4 4613 B12R1.21 Cc1ccc(cc1)SCC(C)N Amb18564186 [0,2,0,0,0,0|2,0,0]=4 4614 B12R1.21 Cc1ccc(cc1)SCC(C)N Amb21988435 [0,2,0,0,0,0|2,0,0]=4 4615 B12R1.21 Cc1ccc(cc1)SCC(N)=S Amb24552332 [0,2,0,0,0,0|2,0,0]=4 4616 B12R1.21 ClC(=O)CCc1ccc(cc1)C Amb17142993 [0,2,0,0,0,0|2,0,0]=4 4617 B12R1.21 ClC(=O)CCc1ccc(cc1)Cl Amb17143273 [0,2,0,0,0,0|2,0,0]=4 4618 B12R1.21 NC(=N)CCc1ccc(Br)cc1 Amb18571448 [0,2,0,0,0,0|1,0,0]=3 4619 B12R1.21 NC(=N)CCc1ccc(Cl)cc1 Amb18564231 [0,2,0,0,0,0|1,0,0]=3 4620 B12R1.21 NC(=N)CCc1ccc(F)cc1 Amb18563719 [0,2,0,0,0,0|1,0,0]=3 4621 B12R1.21 NC(=N)CCc1ccc(cc1)O Amb13883011 [0,2,0,0,0,0|1,0,0]=3 4622 B12R1.21 NC(=N)COc1ccc(F)cc1 Amb19894602 [0,2,0,0,0,0|2,0,0]=4 4623 B12R1.21 NC(=N)NCc1ccc(Br)cc1 Amb24369104 [0,2,0,0,0,0|2,0,0]=4 4624 B12R1.21 NC(=N)NCc1ccc(Cl)cc1 Amb19068642 [0,2,0,0,0,0|2,0,0]=4 4625 B12R1.21 NC(=N)NCc1ccc(F)cc1 Amb19886684 [0,2,0,0,0,0|2,0,0]=4 4626 B12R1.21 NC(=N)NCc1ccc(O)cc1 Amb25046511 [0,2,0,0,0,0|2,0,0]=4 4627 B12R1.21 NC(=N)NCc1ccc(cc1)C Amb13995591 [0,2,0,0,0,0|2,0,0]=4 4628 B12R1.21 NC(=N)SCc1ccc(Cl)cc1 Amb20675979 [0,2,0,0,0,0|2,0,0]=4 4629 B12R1.21 NC(=N)SCc1ccc(F)cc1 Amb20675982 [0,2,0,0,0,0|2,0,0]=4 4630 B12R1.21 NC(=N)SCc1ccc(I)cc1 Amb20675972 [0,2,0,0,0,0|2,0,0]=4 4631 B12R1.21 NC(=N)SCc1ccc(cc1)Br Amb1819103 [0,2,0,0,0,0|2,0,0]=4 4632 B12R1.21 NC(=N)SCc1ccc(cc1)C Amb11227395 [0,2,0,0,0,0|2,0,0]=4 4633 B12R1.21 NC(=O)CCN1C=CC(=O)C=C1 Amb18788434 [0,2,0,0,0,0|2,0,0]=4 4634 B12R1.21 NC(=O)CCc1cc[n+](cc1)C Amb10553742 [0,2,0,0,0,0|2,0,0]=4 4635 B12R1.21 NC(=O)CCc1cc[n+](cc1)[O-] Amb10553010 [0,2,0,0,0,0|2,0,0]=4 4636 B12R1.21 NC(=O)CCc1ccc(cc1)Br Amb17407065 [0,2,0,0,0,0|1,0,0]=3 4637 B12R1.21 NC(=O)CCc1ccc(cc1)Cl Amb17142998 [0,2,0,0,0,0|1,0,0]=3 4638 B12R1.21 NC(=O)COc1ccc(cc1)F Amb2456996 [0,2,0,0,0,0|2,0,0]=4 4639 B12R1.21 NC(=O)COc1ccc(cc1)I Amb173371 [0,2,0,0,0,0|2,0,0]=4 4640 B12R1.21 NC(=O)CSc1ccc(O)cc1 Amb19057102 [0,2,0,0,0,0|2,0,0]=4 4641 B12R1.21 NC(=O)CSc1ccc(cc1)Br Amb1218433 [0,2,0,0,0,0|2,0,0]=4 4642 B12R1.21 NC(=O)CSc1ccc(cc1)Cl Amb1530887 [0,2,0,0,0,0|2,0,0]=4 4643 B12R1.21 NC(=O)CSc1ccc(cc1)F Amb1646201 [0,2,0,0,0,0|2,0,0]=4 4644 B12R1.21 NC(=O)NCc1ccc(cc1)Br Amb1139295 [0,2,0,0,0,0|2,0,0]=4 4645 B12R1.21 NC(=O)NCc1ccc(cc1)C Amb1134976 [0,2,0,0,0,0|2,0,0]=4 4646 B12R1.21 NC(=O)NCc1ccc(cc1)Cl Amb2435054 [0,2,0,0,0,0|2,0,0]=4 4647 B12R1.21 NC(=O)NCc1ccc(cc1)F Amb1128118 [0,2,0,0,0,0|2,0,0]=4 4648 B12R1.21 NC(=O)OCc1ccc(Cl)cc1 Amb25737813 [0,2,0,0,0,0|2,0,0]=4 4649 B12R1.21 NC(=S)CCN1C=CC(=O)C=C1 Amb18543667 [0,2,0,0,0,0|2,0,0]=4 4650 B12R1.21 NC(=S)CCc1ccc(Cl)[n]c1 Amb24679485 [0,2,0,0,0,0|2,0,0]=4 4651 B12R1.21 NC(=S)CCc1ccc(cc1)Cl Amb17237061 [0,2,0,0,0,0|1,0,0]=3 4652 B12R1.21 NC(=S)CNc1ccc(cc1)C Amb17233761 [0,2,0,0,0,0|2,0,0]=4 4653 B12R1.21 NC(=S)COc1ccc(cc1)F Amb1106123 [0,2,0,0,0,0|2,0,0]=4 4654 B12R1.21 NC(=S)CSc1ccc(F)cc1 Amb25112981 [0,2,0,0,0,0|2,0,0]=4 4655 B12R1.21 NC(=S)NCc1ccc(I)cc1 Amb25256040 [0,2,0,0,0,0|2,0,0]=4 4656 B12R1.21 NC(=S)NCc1ccc(cc1)F Amb1663430 [0,2,0,0,0,0|2,0,0]=4 4657 B12R1.21 NC(=[NH2+])SCc1ccc(Br)cc1 Amb22469212 [0,2,0,0,0,0|2,0,0]=4 4658 B12R1.21 NC(=[NH2+])SCc1ccc(Cl)cc1 Amb22445970 [0,2,0,0,0,0|2,0,0]=4 4659 B12R1.21 NC(=[NH2+])SCc1ccc(Cl)cc1 Amb22468389 [0,2,0,0,0,0|2,0,0]=4 4660 B12R1.21 NC(=[NH2+])SCc1ccc(cc1)C Amb2407330 [0,2,0,0,0,0|2,0,0]=4 4661 B12R1.21 NC(=[NH2+])SCc1ccc(cc1)F Amb2407314 [0,2,0,0,0,0|2,0,0]=4 4662 B12R1.21 NC(=[S+]Cc1ccc(cc1)Cl)N Amb10844822 [0,2,0,0,0,0|2,0,0]=4 4663 B12R1.21 Nc1ccc(CC[N+]([O-])=O)cc1 Amb24406773 [0,2,0,0,0,0|1,0,1]=4 4664 B12R1.21 Nc1ccc(cc1)OCC(N)=S Amb25821999 [0,2,0,0,0,0|2,0,0]=4 4665 B12R1.21 O=C(Cl)CCc1ccc(F)cc1 Amb23440824 [0,2,0,0,0,0|2,0,0]=4 4666 B12R1.21 OB(O)CCc1ccc(Cl)cc1 Amb25667152 [0,2,0,0,0,0|2,0,0]=4 4667 B12R1.21 OB(O)CCc1ccc(F)cc1 Amb25149900 [0,2,0,0,0,0|2,0,0]=4 4668 B12R1.21 OC(=O)CCc1ccc(cc1)Br Amb1220330 [0,2,0,0,0,0|2,0,0]=4 4669 B12R1.21 OC(=O)CCc1ccc(cc1)C Amb1225383 [0,2,0,0,0,0|2,0,0]=4 4670 B12R1.21 OC(=O)CCc1ccc(cc1)Cl Amb1093991 [0,2,0,0,0,0|2,0,0]=4 4671 B12R1.21 OC(=O)CCc1ccc(cc1)F Amb1214879 [0,2,0,0,0,0|2,0,0]=4 4672 B12R1.21 Oc1ccc(CCC(F)F)cc1 Amb25247374 [0,2,0,0,0,0|2,0,0]=4 4673 B12R1.21 Oc1ccc(CCN(F)F)cc1 Amb25674238 [0,2,0,0,0,0|1,0,0]=3 4674 B12R1.21 [O-][N+](=O)CCc1ccc(F)cc1 Amb18542361 [0,2,0,0,0,0|1,0,1]=4 4675 B12R1.49 BrC(Cc1ccc(cc1)Br)C#N Amb17376787 [0,2,0,0,0,0|1,0,1]=4 4676 B12R1.49 BrC(Cc1ccc(cc1)C)C#N Amb1655469 [0,2,0,0,0,0|1,0,1]=4 4677 B12R1.49 BrC(Cc1ccc(cc1)Cl)C#N Amb17349965 [0,2,0,0,0,0|1,0,1]=4 4678 B12R1.49 BrC(Cc1ccc(cc1)F)C#N Amb17344012 [0,2,0,0,0,0|1,0,1]=4 4679 B12R1.49 C#CC(N)Cc1ccc(Br)cc1 Amb25141816 [0,2,0,0,0,0|2,0,0]=4 4680 B12R1.49 C#CC(N)Cc1ccc(F)cc1 Amb25715124 [0,2,0,0,0,0|2,0,0]=4 4681 B12R1.49 C#CC(O)Cc1ccc(Br)cc1 Amb25756870 [0,2,0,0,0,0|2,0,0]=4 4682 B12R1.49 C#CC(O)Cc1ccc(Cl)cc1 Amb25756868 [0,2,0,0,0,0|2,0,0]=4 4683 B12R1.49 C=CC(Cl)Cc1ccc(Cl)cc1 Amb25318302 [0,2,0,0,0,0|2,0,0]=4 4684 B12R1.49 C=CC(N)Cc1ccc(Br)cc1 Amb25126467 [0,2,0,0,0,0|2,0,0]=4 4685 B12R1.49 C=CC(N)Cc1ccc(Cl)cc1 Amb25148723 [0,2,0,0,0,0|2,0,0]=4 4686 B12R1.49 C=CC(N)Cc1ccc(F)cc1 Amb24695153 [0,2,0,0,0,0|2,0,0]=4 4687 B12R1.49 C=CC(O)Cc1ccc(Br)cc1 Amb24474552 [0,2,0,0,0,0|2,0,0]=4 4688 B12R1.49 C=CC(O)Cc1ccc(Cl)cc1 Amb25686541 [0,2,0,0,0,0|2,0,0]=4 4689 B12R1.49 C=CC(O)Cc1ccc(F)cc1 Amb25832059 [0,2,0,0,0,0|2,0,0]=4 4690 B12R1.49 C=CC(O)Cc1ccc(O)cc1 Amb25735226 [0,2,0,0,0,0|2,0,0]=4 4691 B12R1.49 CC(CN)CN1C=CC(=O)C=C1 Amb18999144 [0,2,0,0,0,0|2,0,0]=4 4692 B12R1.49 CC(CN)Cc1ccc(Br)cc1 Amb18992228 [0,2,0,0,0,0|1,0,0]=3 4693 B12R1.49 CC(CN)Cc1ccc(I)cc1 Amb25054279 [0,2,0,0,0,0|1,0,0]=3 4694 B12R1.49 CC(CN)Cc1ccc(O)cc1 Amb25738797 [0,2,0,0,0,0|1,0,0]=3 4695 B12R1.49 CC(CN)Nc1ccc(Cl)cc1 Amb18909433 [0,2,0,0,0,0|2,0,0]=4 4696 B12R1.49 CC(CN)Nc1ccc(F)cc1 Amb18908738 [0,2,0,0,0,0|2,0,0]=4 4697 B12R1.49 CC(CN)Oc1ccc(I)cc1 Amb25035111 [0,2,0,0,0,0|2,0,0]=4 4698 B12R1.49 CC(CN)Oc1ccc(O)cc1 Amb24664519 [0,2,0,0,0,0|2,0,0]=4 4699 B12R1.49 CC(CN)Sc1ccc(Br)cc1 Amb18992812 [0,2,0,0,0,0|2,0,0]=4 4700 B12R1.49 CC(CN)Sc1ccc(Br)cc1 Amb19350751 [0,2,0,0,0,0|2,0,0]=4 4701 B12R1.49 CC(CN)Sc1ccc(F)cc1 Amb18992823 [0,2,0,0,0,0|2,0,0]=4 4702 B12R1.49 CC(CN)Sc1ccc(N)cc1 Amb18909305 [0,2,0,0,0,0|2,0,0]=4 4703 B12R1.49 CC(CN)Sc1ccc(O)cc1 Amb18909348 [0,2,0,0,0,0|2,0,0]=4 4704 B12R1.49 CC(CO)Cc1ccc(I)cc1 Amb25711706 [0,2,0,0,0,0|2,0,0]=4 4705 B12R1.49 CC(Cc1ccc(Br)c[n]1)NN Amb24586238 [0,2,0,0,0,0|1,0,0]=3 4706 B12R1.49 CC(Cc1ccc(Br)cc1)C#N Amb24540446 [0,2,0,0,0,0|1,0,1]=4 4707 B12R1.49 CC(Cc1ccc(Br)cc1)C=O Amb25060263 [0,2,0,0,0,0|2,0,0]=4 4708 B12R1.49 CC(Cc1ccc(Br)cc1)CBr Amb25366059 [0,2,0,0,0,0|2,0,0]=4 4709 B12R1.49 CC(Cc1ccc(Cl)cc1)C=O Amb18648716 [0,2,0,0,0,0|2,0,0]=4 4710 B12R1.49 CC(Cc1ccc(Cl)cc1)NN Amb25152282 [0,2,0,0,0,0|0,0,0]=2 4711 B12R1.49 CC(Cc1ccc(F)cc1)C#N Amb25050633 [0,2,0,0,0,0|1,0,1]=4 4712 B12R1.49 CC(Cc1ccc(F)cc1)CBr Amb25115291 [0,2,0,0,0,0|2,0,0]=4 4713 B12R1.49 CC(Cc1ccc(F)cc1)NN Amb25709190 [0,2,0,0,0,0|0,0,0]=2 4714 B12R1.49 CC(Cc1ccc(I)cc1)NN Amb24716530 [0,2,0,0,0,0|0,0,0]=2 4715 B12R1.49 CC(Cc1ccc(O)cc1)C=O Amb18646060 [0,2,0,0,0,0|2,0,0]=4 4716 B12R1.49 CC(Cc1ccc(O)cc1)CO Amb25770294 [0,2,0,0,0,0|2,0,0]=4 4717 B12R1.49 CC(Cc1ccc(O)cc1)NN Amb25189495 [0,2,0,0,0,0|0,0,0]=2 4718 B12R1.49 CCC(Br)Cc1ccc(Br)cc1 Amb18049412 [0,2,0,0,0,0|2,0,0]=4 4719 B12R1.49 CCC(C)Cc1ccc(N)cc1 Amb25798952 [0,2,0,0,0,0|2,0,0]=4 4720 B12R1.49 CCC(Cc1ccc(cc1)Br)Cl Amb17477596 [0,2,0,0,0,0|2,0,0]=4 4721 B12R1.49 CCC(Cc1ccc(cc1)Br)O Amb17477579 [0,2,0,0,0,0|2,0,0]=4 4722 B12R1.49 CCC(Cc1ccc(cc1)C)Cl Amb17477426 [0,2,0,0,0,0|2,0,0]=4 4723 B12R1.49 CCC(Cc1ccc(cc1)C)O Amb17138583 [0,2,0,0,0,0|2,0,0]=4 4724 B12R1.49 CCC(Cc1ccc(cc1)Cl)Cl Amb17477604 [0,2,0,0,0,0|2,0,0]=4 4725 B12R1.49 CCC(Cc1ccc(cc1)Cl)O Amb17139103 [0,2,0,0,0,0|2,0,0]=4 4726 B12R1.49 CCC(Cc1ccc(cc1)F)Cl Amb17477606 [0,2,0,0,0,0|2,0,0]=4 4727 B12R1.49 CCC(Cc1ccc(cc1)F)O Amb17138637 [0,2,0,0,0,0|2,0,0]=4 4728 B12R1.49 CCC(Cl)Cc1ccc(I)cc1 Amb25157799 [0,2,0,0,0,0|2,0,0]=4 4729 B12R1.49 CCC(N)Cc1ccc(Cl)cc1 Amb19374189 [0,2,0,0,0,0|2,0,0]=4 4730 B12R1.49 CCC(N)Cc1ccc(I)cc1 Amb24711014 [0,2,0,0,0,0|2,0,0]=4 4731 B12R1.49 CCC(N)Cc1ccc(N)cc1 Amb24738382 [0,2,0,0,0,0|2,0,0]=4 4732 B12R1.49 CC[C@@H](N)Cc1ccc(Cl)cc1 Amb24357569 [0,2,0,0,0,0|2,0,0]=4 4733 B12R1.49 CC[C@H](N)Cc1ccc(Cl)cc1 Amb25313710 [0,2,0,0,0,0|2,0,0]=4 4734 B12R1.49 CNC(=O)Cc1ccc(I)cc1 Amb25680399 [0,2,0,0,0,0|1,0,1]=4 4735 B12R1.49 CNC(=O)Cc1ccc(O)cc1 Amb18646280 [0,2,0,0,0,0|1,0,1]=4 4736 B12R1.49 CNC(=O)Cc1ccc(S)cc1 Amb24346465 [0,2,0,0,0,0|1,0,1]=4 4737 B12R1.49 CNC(=O)Cc1ccc(cc1)C Amb1795465 [0,2,0,0,0,0|1,0,1]=4 4738 B12R1.49 CNC(=O)Cc1ccc(cc1)N Amb1117771 [0,2,0,0,0,0|1,0,1]=4 4739 B12R1.49 CNC(=O)Cc1ccc(cc1)N Amb15740907 [0,2,0,0,0,0|1,0,1]=4 4740 B12R1.49 CNC(C)CN1C=CC(=O)C=C1 Amb18999201 [0,2,0,0,0,0|2,0,0]=4 4741 B12R1.49 CNC(C)Cc1ccc(Br)c[n]1 Amb24483572 [0,2,0,0,0,0|2,0,0]=4 4742 B12R1.49 CNC(C)Cc1ccc(F)[n]c1 Amb24485445 [0,2,0,0,0,0|2,0,0]=4 4743 B12R1.49 CNC(C)Cc1ccc(F)cc1 Amb22055302 [0,2,0,0,0,0|1,0,0]=3 4744 B12R1.49 CNC(C)Cc1ccc(N)cc1 Amb18050449 [0,2,0,0,0,0|1,0,0]=3 4745 B12R1.49 CNC(Cc1ccc(cc1)O)C Amb17619384 [0,2,0,0,0,0|1,0,0]=3 4746 B12R1.49 CN[C@@H](C)Cc1ccc(Cl)cc1 Amb25123418 [0,2,0,0,0,0|1,0,0]=3 4747 B12R1.49 CN[C@@H](C)Cc1ccc(N)cc1 Amb24710324 [0,2,0,0,0,0|1,0,0]=3 4748 B12R1.49 CN[C@@H](C)Cc1ccc(O)cc1 Amb24451652 [0,2,0,0,0,0|1,0,0]=3 4749 B12R1.49 C[C@@H](CN)Oc1ccc(Cl)cc1 Amb24701895 [0,2,0,0,0,0|2,0,0]=4 4750 B12R1.49 C[C@@H](CO)Cc1ccc(Cl)cc1 Amb25847856 [0,2,0,0,0,0|2,0,0]=4 4751 B12R1.49 C[C@@H](Cc1ccc(O)cc1)CO Amb24647774 [0,2,0,0,0,0|2,0,0]=4 4752 B12R1.49 C[C@H](CN)Oc1ccc(Cl)cc1 Amb25697013 [0,2,0,0,0,0|2,0,0]=4 4753 B12R1.49 C[C@H](CO)Cc1ccc(F)cc1 Amb24387764 [0,2,0,0,0,0|2,0,0]=4 4754 B12R1.49 C[C@H](Cc1ccc(O)cc1)CO Amb25371827 [0,2,0,0,0,0|2,0,0]=4 4755 B12R1.49 C\C(\Cc1ccc(F)cc1)=N\N Amb25310183 [0,2,0,0,0,0|0,0,2]=4 4756 B12R1.49 Cc1ccc(CC(=N)NC)cc1 Amb25187482 [0,2,0,0,0,0|1,0,1]=4 4757 B12R1.49 Cc1ccc(CC(=O)CN)cc1 Amb18829243 [0,2,0,0,0,0|1,0,1]=4 4758 B12R1.49 Cc1ccc(CC(=O)NN)[n]c1 Amb25375047 [0,2,0,0,0,0|1,0,1]=4 4759 B12R1.49 Cc1ccc(CC(Br)CC)cc1 Amb24399086 [0,2,0,0,0,0|2,0,0]=4 4760 B12R1.49 Cc1ccc(CC(C)C=O)cc1 Amb18645702 [0,2,0,0,0,0|2,0,0]=4 4761 B12R1.49 Cc1ccc(CC(C)CBr)cc1 Amb25152481 [0,2,0,0,0,0|2,0,0]=4 4762 B12R1.49 Cc1ccc(CC(C)CC)cc1 Amb25241788 [0,2,0,0,0,0|2,0,0]=4 4763 B12R1.49 Cc1ccc(CC(C)CCl)cc1 Amb24390124 [0,2,0,0,0,0|2,0,0]=4 4764 B12R1.49 Cc1ccc(CC(C)CO)cc1 Amb24354502 [0,2,0,0,0,0|2,0,0]=4 4765 B12R1.49 Cc1ccc(CC(Cl)CCl)cc1 Amb24459787 [0,2,0,0,0,0|2,0,0]=4 4766 B12R1.49 Cc1ccc(CC(Cl)CN)cc1 Amb24443143 [0,2,0,0,0,0|1,0,0]=3 4767 B12R1.49 Cc1ccc(CC(F)C=O)cc1 Amb24715586 [0,2,0,0,0,0|2,0,0]=4 4768 B12R1.49 Cc1ccc(CC(N)=NN)cc1 Amb18788209 [0,2,0,0,0,0|0,0,2]=4 4769 B12R1.49 Cc1ccc(CC(N)C#C)cc1 Amb25742290 [0,2,0,0,0,0|2,0,0]=4 4770 B12R1.49 Cc1ccc(CC(N)CF)cc1 Amb24564243 [0,2,0,0,0,0|2,0,0]=4 4771 B12R1.49 Cc1ccc(CC(O)C=C)cc1 Amb25845662 [0,2,0,0,0,0|2,0,0]=4 4772 B12R1.49 Cc1ccc(CC(O)C=O)cc1 Amb24466339 [0,2,0,0,0,0|2,0,0]=4 4773 B12R1.49 Cc1ccc(C[C@@H](C)CO)cc1 Amb25687834 [0,2,0,0,0,0|2,0,0]=4 4774 B12R1.49 Cc1ccc(C[C@@H](C)NC)cc1 Amb25233407 [0,2,0,0,0,0|1,0,0]=3 4775 B12R1.49 Cc1ccc(C[C@H](C)CO)cc1 Amb25221031 [0,2,0,0,0,0|2,0,0]=4 4776 B12R1.49 Cc1ccc(C[C@H](N)CO)cc1 Amb25257357 [0,2,0,0,0,0|2,0,0]=4 4777 B12R1.49 Cc1ccc(cc1)NC(C)CN Amb18646166 [0,2,0,0,0,0|2,0,0]=4 4778 B12R1.49 Cc1ccc(cc1)NC(S)NN Amb24351216 [0,2,0,0,0,0|1,0,0]=3 4779 B12R1.49 ClC(Cc1ccc(cc1)Br)C#N Amb17204670 [0,2,0,0,0,0|1,0,1]=4 4780 B12R1.49 ClC(Cc1ccc(cc1)C)C#N Amb17204321 [0,2,0,0,0,0|1,0,1]=4 4781 B12R1.49 ClC(Cc1ccc(cc1)Cl)C#N Amb17204383 [0,2,0,0,0,0|1,0,1]=4 4782 B12R1.49 ClC(Cc1ccc(cc1)F)C#N Amb17204331 [0,2,0,0,0,0|1,0,1]=4 4783 B12R1.49 N#CC(O)Cc1ccc(Cl)cc1 Amb25817268 [0,2,0,0,0,0|1,0,1]=4 4784 B12R1.49 N=C(Cc1ccc(O)cc1)NO Amb22494626 [0,2,0,0,0,0|1,0,1]=4 4785 B12R1.49 NC(CF)Cc1ccc(Cl)cc1 Amb24080995 [0,2,0,0,0,0|2,0,0]=4 4786 B12R1.49 NC(CO)Cc1ccc(I)cc1 Amb25140389 [0,2,0,0,0,0|2,0,0]=4 4787 B12R1.49 NC(Cc1ccc(Br)cc1)C#N Amb23590819 [0,2,0,0,0,0|1,0,1]=4 4788 B12R1.49 NC(Cc1ccc(Cl)cc1)C#N Amb23557156 [0,2,0,0,0,0|1,0,1]=4 4789 B12R1.49 NC(Cc1ccc(O)cc1)C#N Amb24400599 [0,2,0,0,0,0|1,0,1]=4 4790 B12R1.49 NC(Cc1ccc(O)cc1)CF Amb25276877 [0,2,0,0,0,0|2,0,0]=4 4791 B12R1.49 NCC(=O)Cc1ccc(Br)cc1 Amb18160380 [0,2,0,0,0,0|1,0,1]=4 4792 B12R1.49 NCC(=O)Cc1ccc(Cl)cc1 Amb18823029 [0,2,0,0,0,0|1,0,1]=4 4793 B12R1.49 NCC(=O)Cc1ccc(F)cc1 Amb18827238 [0,2,0,0,0,0|1,0,1]=4 4794 B12R1.49 NCC(=O)Cc1ccc(O)cc1 Amb25369044 [0,2,0,0,0,0|1,0,1]=4 4795 B12R1.49 NCC(Cc1ccc(cc1)Br)O Amb17248849 [0,2,0,0,0,0|1,0,0]=3 4796 B12R1.49 NCC(Cc1ccc(cc1)C)O Amb17232550 [0,2,0,0,0,0|1,0,0]=3 4797 B12R1.49 NCC(Cc1ccc(cc1)Cl)O Amb17234269 [0,2,0,0,0,0|1,0,0]=3 4798 B12R1.49 NCC(Cc1ccc(cc1)F)O Amb17232703 [0,2,0,0,0,0|1,0,0]=3 4799 B12R1.49 NCC(N)Cc1ccc(Br)cc1 Amb25280308 [0,2,0,0,0,0|1,0,0]=3 4800 B12R1.49 NCC(N)Cc1ccc(Cl)cc1 Amb18649050 [0,2,0,0,0,0|1,0,0]=3 4801 B12R1.49 NCC(N)Cc1ccc(F)cc1 Amb25245193 [0,2,0,0,0,0|1,0,0]=3 4802 B12R1.49 NCC(Nc1ccc(cc1)Br)C Amb17226676 [0,2,0,0,0,0|2,0,0]=4 4803 B12R1.49 NCC(O)CN1C=CC(=O)C=C1 Amb18301811 [0,2,0,0,0,0|2,0,0]=4 4804 B12R1.49 NCC(O)Cc1ccc(Br)c[n]1 Amb24353881 [0,2,0,0,0,0|2,0,0]=4 4805 B12R1.49 NCC(Oc1ccc(cc1)F)C Amb2089060 [0,2,0,0,0,0|2,0,0]=4 4806 B12R1.49 NCC(Sc1ccc(cc1)C)C Amb17485974 [0,2,0,0,0,0|2,0,0]=4 4807 B12R1.49 NCC(Sc1ccc(cc1)Cl)C Amb17485977 [0,2,0,0,0,0|2,0,0]=4 4808 B12R1.49 NC[C@H](N)Cc1ccc(F)cc1 Amb25686081 [0,2,0,0,0,0|1,0,0]=3 4809 B12R1.49 NNC(=N)Nc1ccc(Cl)cc1 Amb22448055 [0,2,0,0,0,0|1,0,1]=4 4810 B12R1.49 NNC(=O)CN1C=CC(=O)C=C1 Amb24427264 [0,2,0,0,0,0|1,0,1]=4 4811 B12R1.49 NNC(=O)Cc1cc[n+]([O-])cc1 Amb25202196 [0,2,0,0,0,0|1,0,1]=4 4812 B12R1.49 NNC(=O)Cc1ccc(Cl)[n]c1 Amb22898935 [0,2,0,0,0,0|1,0,1]=4 4813 B12R1.49 NNC(=O)Cc1ccc(cc1)C Amb1921793 [0,2,0,0,0,0|0,0,1]=3 4814 B12R1.49 NNC(=O)Nc1ccc(cc1)Cl Amb2411255 [0,2,0,0,0,0|1,0,1]=4 4815 B12R1.49 NNC(=O)Nc1ccc(cc1)F Amb10839092 [0,2,0,0,0,0|1,0,1]=4 4816 B12R1.49 NNC(=O)Oc1ccc(Cl)cc1 Amb25299876 [0,2,0,0,0,0|1,0,1]=4 4817 B12R1.49 NNC(=O)Oc1ccc(O)cc1 Amb24633295 [0,2,0,0,0,0|1,0,1]=4 4818 B12R1.49 NNC(=S)Nc1ccc(cc1)C Amb1488424 [0,2,0,0,0,0|1,0,1]=4 4819 B12R1.49 NNC(=S)Nc1ccc(cc1)F Amb1149110 [0,2,0,0,0,0|1,0,1]=4 4820 B12R1.49 NNC(=S)Nc1ccc(cc1)O Amb2575284 [0,2,0,0,0,0|1,0,1]=4 4821 B12R1.49 NNC(=S)Oc1ccc(F)cc1 Amb22472817 [0,2,0,0,0,0|1,0,1]=4 4822 B12R1.49 NNC(S)Nc1ccc(Cl)cc1 Amb25292409 [0,2,0,0,0,0|1,0,0]=3 4823 B12R1.49 N[C@@H](CO)Cc1ccc(Cl)cc1 Amb22225388 [0,2,0,0,0,0|2,0,0]=4 4824 B12R1.49 N[C@@H](CO)Cc1ccc(Cl)cc1 Amb22747948 [0,2,0,0,0,0|2,0,0]=4 4825 B12R1.49 N[C@@H](CO)Cc1ccc(F)cc1 Amb22746377 [0,2,0,0,0,0|2,0,0]=4 4826 B12R1.49 N[C@@H](CO)Cc1ccc(I)cc1 Amb20242327 [0,2,0,0,0,0|2,0,0]=4 4827 B12R1.49 N[C@@H](Cc1ccc(F)cc1)C#N Amb24585720 [0,2,0,0,0,0|1,0,1]=4 4828 B12R1.49 N[C@@H](Cc1ccc(I)cc1)C#N Amb22899093 [0,2,0,0,0,0|1,0,1]=4 4829 B12R1.49 N[C@@H](Cc1ccc(O)cc1)C#N Amb24435350 [0,2,0,0,0,0|1,0,1]=4 4830 B12R1.49 N[C@@H](Cc1ccc(O)cc1)C=O Amb24106989 [0,2,0,0,0,0|2,0,0]=4 4831 B12R1.49 N[C@H](CO)Cc1ccc(Br)cc1 Amb24453435 [0,2,0,0,0,0|2,0,0]=4 4832 B12R1.49 N[C@H](CO)Cc1ccc(Cl)cc1 Amb19943950 [0,2,0,0,0,0|2,0,0]=4 4833 B12R1.49 N[C@H](CO)Cc1ccc(Cl)cc1 Amb22233150 [0,2,0,0,0,0|2,0,0]=4 4834 B12R1.49 N[C@H](CO)Cc1ccc(F)cc1 Amb22233151 [0,2,0,0,0,0|2,0,0]=4 4835 B12R1.49 N[C@H](CO)Cc1ccc(I)cc1 Amb25200273 [0,2,0,0,0,0|2,0,0]=4 4836 B12R1.49 N[C@H](Cc1ccc(O)cc1)C#N Amb24357641 [0,2,0,0,0,0|1,0,1]=4 4837 B12R1.49 N\C(\Cc1ccc(Br)cc1)=N\N Amb25056234 [0,2,0,0,0,0|0,0,2]=4 4838 B12R1.49 N\C(\Cc1ccc(Cl)cc1)=N\N Amb19045347 [0,2,0,0,0,0|0,0,2]=4 4839 B12R1.49 N\C(\Cc1ccc(F)cc1)=N\N Amb18788561 [0,2,0,0,0,0|0,0,2]=4 4840 B12R1.49 Nc1ccc(CC(=O)NN)cc1 Amb23247868 [0,2,0,0,0,0|0,0,1]=3 4841 B12R1.49 Nc1ccc(CC(=O)NO)cc1 Amb25222304 [0,2,0,0,0,0|1,0,1]=4 4842 B12R1.49 Nc1ccc(CC(F)C=O)cc1 Amb25148624 [0,2,0,0,0,0|2,0,0]=4 4843 B12R1.49 Nc1ccc(CC(N)C=O)cc1 Amb24416655 [0,2,0,0,0,0|2,0,0]=4 4844 B12R1.49 Nc1ccc(C[C@H](N)CO)cc1 Amb22233152 [0,2,0,0,0,0|2,0,0]=4 4845 B12R1.49 Nc1ccc(cc1)NC(=O)NN Amb24483837 [0,2,0,0,0,0|1,0,1]=4 4846 B12R1.49 O=CC(Cc1ccc(cc1)Br)Cl Amb17204706 [0,2,0,0,0,0|2,0,0]=4 4847 B12R1.49 O=CC(Cc1ccc(cc1)C)Cl Amb17204328 [0,2,0,0,0,0|2,0,0]=4 4848 B12R1.49 O=CC(Cc1ccc(cc1)Cl)Cl Amb17204403 [0,2,0,0,0,0|2,0,0]=4 4849 B12R1.49 O=CC(Cc1ccc(cc1)F)Cl Amb17204342 [0,2,0,0,0,0|2,0,0]=4 4850 B12R1.49 O=CC(F)Cc1ccc(Cl)cc1 Amb25369013 [0,2,0,0,0,0|2,0,0]=4 4851 B12R1.49 OC(Cc1ccc(Br)cc1)C=O Amb25856500 [0,2,0,0,0,0|2,0,0]=4 4852 B12R1.49 OC(Cc1ccc(Cl)cc1)C=O Amb25205198 [0,2,0,0,0,0|2,0,0]=4 4853 B12R1.49 OC(Cc1ccc(F)cc1)C=O Amb25731164 [0,2,0,0,0,0|2,0,0]=4 4854 B12R1.49 OC(Cc1ccc(F)cc1)CCl Amb24410753 [0,2,0,0,0,0|2,0,0]=4 4855 B12R1.49 OCC(Cc1ccc(cc1)Br)N Amb17062713 [0,2,0,0,0,0|2,0,0]=4 4856 B12R1.49 OCC(Cc1ccc(cc1)C)N Amb17062687 [0,2,0,0,0,0|2,0,0]=4 4857 B12R1.49 OCC(Cc1ccc(cc1)F)N Amb17062689 [0,2,0,0,0,0|2,0,0]=4 4858 B12R1.49 OCC(Cc1ccc(cc1)O)N Amb17062710 [0,2,0,0,0,0|2,0,0]=4 4859 B12R1.49 OCC(F)Cc1ccc(Cl)cc1 Amb25741479 [0,2,0,0,0,0|2,0,0]=4 4860 B12R1.49 OC[C@H](Cc1ccc(cc1)O)N Amb1157858 [0,2,0,0,0,0|2,0,0]=4 4861 B12R1.49 OC[C@H](F)Cc1ccc(F)cc1 Amb24749775 [0,2,0,0,0,0|2,0,0]=4 4862 B12R1.49 ONC(=O)Cc1ccc(I)cc1 Amb25119664 [0,2,0,0,0,0|1,0,1]=4 4863 B12R1.49 Oc1ccc(CC(=O)NO)cc1 Amb24686463 [0,2,0,0,0,0|1,0,1]=4 4864 B12R1.49 Oc1ccc(CC(F)C=O)cc1 Amb24341525 [0,2,0,0,0,0|2,0,0]=4 4865 B12R1.49 Oc1ccc(CC(O)CO)cc1 Amb25092907 [0,2,0,0,0,0|2,0,0]=4 4866 B12R1.49 Oc1ccc(C[C@H](O)CO)cc1 Amb24497177 [0,2,0,0,0,0|2,0,0]=4 4867 B12R1.69 Brc1ccc(CCCBr)c(I)c1 Amb25248923 [0,2,0,0,0,0|2,0,0]=4 4868 B12R1.69 C#CCCc1ccc(Cl)cc1Cl Amb18634789 [0,2,0,0,0,0|2,0,0]=4 4869 B12R1.69 C=CCCc1ccc(Br)cc1Cl Amb24692580 [0,2,0,0,0,0|2,0,0]=4 4870 B12R1.69 C=CCCc1ccc(F)cc1Br Amb25766317 [0,2,0,0,0,0|2,0,0]=4 4871 B12R1.69 CC1=CC(=O)N(CCCN)C=C1 Amb18010722 [0,2,0,0,0,0|2,0,0]=4 4872 B12R1.69 CC=1C=CN(CCNC)C(=O)C1 Amb18302433 [0,2,0,0,0,0|2,0,0]=4 4873 B12R1.69 CCCCc1ccc(Br)cc1N Amb25688839 [0,2,0,0,0,0|2,0,0]=4 4874 B12R1.69 CCCCc1ccc(Cl)cc1N Amb25212906 [0,2,0,0,0,0|2,0,0]=4 4875 B12R1.69 CCCCc1ccc(F)cc1N Amb25697644 [0,2,0,0,0,0|2,0,0]=4 4876 B12R1.69 CCCCc1ccc(N)cc1Br Amb25766211 [0,2,0,0,0,0|2,0,0]=4 4877 B12R1.69 CCCCc1ccc(N)cc1Cl Amb25858096 [0,2,0,0,0,0|2,0,0]=4 4878 B12R1.69 CCCCc1ccc(N)cc1I Amb25265964 [0,2,0,0,0,0|2,0,0]=4 4879 B12R1.69 CNCCc1[n]cc(Br)cc1Br Amb24513783 [0,2,0,0,0,0|2,0,0]=4 4880 B12R1.69 CNCCc1ccc(Br)cc1Cl Amb24415809 [0,2,0,0,0,0|1,0,0]=3 4881 B12R1.69 CNCCc1ccc(Cl)cc1Br Amb24364955 [0,2,0,0,0,0|1,0,0]=3 4882 B12R1.69 CNCCc1ccc(F)cc1Br Amb18299496 [0,2,0,0,0,0|1,0,0]=3 4883 B12R1.69 CNCCc1ccc(F)cc1Cl Amb18993044 [0,2,0,0,0,0|1,0,0]=3 4884 B12R1.69 CNCCc1ccc(F)cc1F Amb18299524 [0,2,0,0,0,0|1,0,0]=3 4885 B12R1.69 CNCCc1ccc(F)cc1O Amb24554759 [0,2,0,0,0,0|1,0,0]=3 4886 B12R1.69 CNCCc1ccc(O)cc1F Amb24376021 [0,2,0,0,0,0|1,0,0]=3 4887 B12R1.69 CNCCc1ccc(O)cc1O Amb18273699 [0,2,0,0,0,0|1,0,0]=3 4888 B12R1.69 CNCCc1ccc(cc1C)C Amb17400139 [0,2,0,0,0,0|1,0,0]=3 4889 B12R1.69 CNCCc1ccc(cc1F)Br Amb16230489 [0,2,0,0,0,0|1,0,0]=3 4890 B12R1.69 Cc1c[n]c(CCCN)c(Cl)c1 Amb24402264 [0,2,0,0,0,0|2,0,0]=4 4891 B12R1.69 Cc1c[n]c(CCCN)c(F)c1 Amb24360515 [0,2,0,0,0,0|2,0,0]=4 4892 B12R1.69 Cc1cc(Br)ccc1CCC=O Amb18070232 [0,2,0,0,0,0|2,0,0]=4 4893 B12R1.69 Cc1cc(Br)ccc1CCCC Amb24341759 [0,2,0,0,0,0|2,0,0]=4 4894 B12R1.69 Cc1cc(Br)ccc1CCCO Amb23537809 [0,2,0,0,0,0|2,0,0]=4 4895 B12R1.69 Cc1cc(Br)ccc1CCNC Amb25135302 [0,2,0,0,0,0|1,0,0]=3 4896 B12R1.69 Cc1cc(C)c(CCC=O)cc1 Amb18563553 [0,2,0,0,0,0|2,0,0]=4 4897 B12R1.69 Cc1cc(C)c(CCCS)cc1 Amb24497542 [0,2,0,0,0,0|2,0,0]=4 4898 B12R1.69 Cc1cc(Cl)c(cc1)NCCN Amb18909434 [0,2,0,0,0,0|2,0,0]=4 4899 B12R1.69 Cc1cc(Cl)c(cc1)OCCN Amb18994687 [0,2,0,0,0,0|2,0,0]=4 4900 B12R1.69 Cc1cc(Cl)c[n]c1CCCN Amb25849993 [0,2,0,0,0,0|2,0,0]=4 4901 B12R1.69 Cc1cc(Cl)ccc1CCC=O Amb18564228 [0,2,0,0,0,0|2,0,0]=4 4902 B12R1.69 Cc1cc(Cl)ccc1CCNC Amb25722327 [0,2,0,0,0,0|1,0,0]=3 4903 B12R1.69 Cc1cc(F)c(cc1)NCCN Amb18908740 [0,2,0,0,0,0|2,0,0]=4 4904 B12R1.69 Cc1cc(F)ccc1CCC=O Amb25691957 [0,2,0,0,0,0|2,0,0]=4 4905 B12R1.69 Cc1cc(F)ccc1CCCCl Amb25840107 [0,2,0,0,0,0|2,0,0]=4 4906 B12R1.69 Cc1cc(F)ccc1CCCN Amb18295693 [0,2,0,0,0,0|1,0,0]=3 4907 B12R1.69 Cc1cc(F)ccc1CCCO Amb25148633 [0,2,0,0,0,0|2,0,0]=4 4908 B12R1.69 Cc1cc(F)ccc1CCNC Amb18301295 [0,2,0,0,0,0|1,0,0]=3 4909 B12R1.69 Cc1cc(F)ccc1NCCN Amb18992220 [0,2,0,0,0,0|2,0,0]=4 4910 B12R1.69 Cc1cc(I)ccc1CCC#N Amb25238008 [0,2,0,0,0,0|1,0,1]=4 4911 B12R1.69 Cc1cc(I)ccc1CCC=O Amb24696627 [0,2,0,0,0,0|2,0,0]=4 4912 B12R1.69 Cc1cc(I)ccc1NCCN Amb25820325 [0,2,0,0,0,0|2,0,0]=4 4913 B12R1.69 Cc1cc(N)c(cc1)NCCN Amb18298682 [0,2,0,0,0,0|2,0,0]=4 4914 B12R1.69 Cc1cc(N)c(cc1)SCCN Amb18291316 [0,2,0,0,0,0|2,0,0]=4 4915 B12R1.69 Cc1cc(N)ccc1CCCCl Amb24695776 [0,2,0,0,0,0|2,0,0]=4 4916 B12R1.69 Cc1cc(N)ccc1NCCN Amb18991506 [0,2,0,0,0,0|2,0,0]=4 4917 B12R1.69 Cc1cc(N)ccc1SCCN Amb18975710 [0,2,0,0,0,0|2,0,0]=4 4918 B12R1.69 Cc1cc(O)ccc1CCC#N Amb24708081 [0,2,0,0,0,0|1,0,1]=4 4919 B12R1.69 Cc1cc(O)ccc1CCCBr Amb24559420 [0,2,0,0,0,0|2,0,0]=4 4920 B12R1.69 Cc1cc(O)ccc1CCCC Amb24722982 [0,2,0,0,0,0|2,0,0]=4 4921 B12R1.69 Cc1cc(O)ccc1CCCN Amb18554106 [0,2,0,0,0,0|1,0,0]=3 4922 B12R1.69 Cc1cc(O)ccc1CCNC Amb24497392 [0,2,0,0,0,0|1,0,0]=3 4923 B12R1.69 Cc1cc(S)ccc1CCCCl Amb24541029 [0,2,0,0,0,0|2,0,0]=4 4924 B12R1.69 Cc1ccc(CCC=O)c(Br)c1 Amb18070227 [0,2,0,0,0,0|2,0,0]=4 4925 B12R1.69 Cc1ccc(CCC=O)c(Cl)c1 Amb24484219 [0,2,0,0,0,0|2,0,0]=4 4926 B12R1.69 Cc1ccc(CCC=O)c(F)c1 Amb25773961 [0,2,0,0,0,0|2,0,0]=4 4927 B12R1.69 Cc1ccc(CCC=O)c(I)c1 Amb24594357 [0,2,0,0,0,0|2,0,0]=4 4928 B12R1.69 Cc1ccc(CCC=O)c(N)c1 Amb25376377 [0,2,0,0,0,0|2,0,0]=4 4929 B12R1.69 Cc1ccc(CCC=O)c(O)c1 Amb25253209 [0,2,0,0,0,0|2,0,0]=4 4930 B12R1.69 Cc1ccc(CCCBr)c(Cl)c1 Amb25798590 [0,2,0,0,0,0|2,0,0]=4 4931 B12R1.69 Cc1ccc(CCCBr)c(N)c1 Amb24743622 [0,2,0,0,0,0|2,0,0]=4 4932 B12R1.69 Cc1ccc(CCCBr)c(O)c1 Amb25194824 [0,2,0,0,0,0|2,0,0]=4 4933 B12R1.69 Cc1ccc(CCCC)c(N)c1 Amb24524870 [0,2,0,0,0,0|2,0,0]=4 4934 B12R1.69 Cc1ccc(CCCC)c(O)c1 Amb24557617 [0,2,0,0,0,0|2,0,0]=4 4935 B12R1.69 Cc1ccc(CCCCl)c(N)c1 Amb24638069 [0,2,0,0,0,0|2,0,0]=4 4936 B12R1.69 Cc1ccc(CCCN)c(Cl)c1 Amb25159902 [0,2,0,0,0,0|1,0,0]=3 4937 B12R1.69 Cc1ccc(CCCN)c(F)c1 Amb25677595 [0,2,0,0,0,0|1,0,0]=3 4938 B12R1.69 Cc1ccc(CCCN)c(O)c1 Amb25776876 [0,2,0,0,0,0|1,0,0]=3 4939 B12R1.69 Cc1ccc(CCCO)c(Br)c1 Amb23537990 [0,2,0,0,0,0|2,0,0]=4 4940 B12R1.69 Cc1ccc(CCCO)c(Cl)c1 Amb25820255 [0,2,0,0,0,0|2,0,0]=4 4941 B12R1.69 Cc1ccc(CCCO)c(F)c1 Amb25135641 [0,2,0,0,0,0|2,0,0]=4 4942 B12R1.69 Cc1ccc(CCCO)c(N)c1 Amb22233216 [0,2,0,0,0,0|2,0,0]=4 4943 B12R1.69 Cc1ccc(CCNC)c(Br)c1 Amb25235798 [0,2,0,0,0,0|1,0,0]=3 4944 B12R1.69 Cc1ccc(CCNC)c(Cl)c1 Amb25850179 [0,2,0,0,0,0|1,0,0]=3 4945 B12R1.69 Cc1ccc(CCNC)c(O)c1 Amb25777142 [0,2,0,0,0,0|1,0,0]=3 4946 B12R1.69 ClCCCc1ccc(Br)cc1Br Amb24756782 [0,2,0,0,0,0|2,0,0]=4 4947 B12R1.69 ClCCCc1ccc(cc1Cl)Cl Amb17477748 [0,2,0,0,0,0|2,0,0]=4 4948 B12R1.69 Clc1cc(Cl)c(CCCBr)cc1 Amb24064155 [0,2,0,0,0,0|2,0,0]=4 4949 B12R1.69 Clc1cc(I)ccc1CCCBr Amb25247642 [0,2,0,0,0,0|2,0,0]=4 4950 B12R1.69 Fc1cc(Br)c(CCCBr)cc1 Amb24448383 [0,2,0,0,0,0|2,0,0]=4 4951 B12R1.69 Fc1cc(Br)ccc1CCCBr Amb20075851 [0,2,0,0,0,0|2,0,0]=4 4952 B12R1.69 Fc1cc(Br)ccc1CCCCl Amb25770333 [0,2,0,0,0,0|2,0,0]=4 4953 B12R1.69 Fc1cc(F)c(CCCCl)cc1 Amb19073200 [0,2,0,0,0,0|2,0,0]=4 4954 B12R1.69 Fc1cc(F)c(CCCS)cc1 Amb25159701 [0,2,0,0,0,0|2,0,0]=4 4955 B12R1.69 Fc1cc(I)ccc1CCCBr Amb25209319 [0,2,0,0,0,0|2,0,0]=4 4956 B12R1.69 Fc1cc(S)ccc1CCCCl Amb25278657 [0,2,0,0,0,0|2,0,0]=4 4957 B12R1.69 Fc1ccc(CCCBr)c(S)c1 Amb25254870 [0,2,0,0,0,0|2,0,0]=4 4958 B12R1.69 N#CCCc1ccc(Br)cc1F Amb24737736 [0,2,0,0,0,0|1,0,1]=4 4959 B12R1.69 N#CCCc1ccc(Br)cc1I Amb24679374 [0,2,0,0,0,0|1,0,1]=4 4960 B12R1.69 N#CCCc1ccc(F)cc1Cl Amb19045344 [0,2,0,0,0,0|1,0,1]=4 4961 B12R1.69 N#CCCc1ccc(I)cc1F Amb25207266 [0,2,0,0,0,0|1,0,1]=4 4962 B12R1.69 N#CCCc1ccc(I)cc1S Amb25230150 [0,2,0,0,0,0|1,0,1]=4 4963 B12R1.69 N#CCCc1ccc(O)cc1O Amb24742016 [0,2,0,0,0,0|1,0,1]=4 4964 B12R1.69 N#CCCc1ccc(cc1Br)C Amb17204517 [0,2,0,0,0,0|1,0,1]=4 4965 B12R1.69 N#CCCc1ccc(cc1C)Br Amb17204518 [0,2,0,0,0,0|1,0,1]=4 4966 B12R1.69 N#CCCc1ccc(cc1C)C Amb17204300 [0,2,0,0,0,0|1,0,1]=4 4967 B12R1.69 N#CCCc1ccc(cc1C)Cl Amb17204324 [0,2,0,0,0,0|1,0,1]=4 4968 B12R1.69 N#CCCc1ccc(cc1Cl)Cl Amb17204385 [0,2,0,0,0,0|1,0,1]=4 4969 B12R1.69 N#CCCc1ccc(cc1F)F Amb16193191 [0,2,0,0,0,0|1,0,1]=4 4970 B12R1.69 NCCCc1[n]cc(Cl)cc1F Amb25353752 [0,2,0,0,0,0|2,0,0]=4 4971 B12R1.69 NCCCc1c[n]c(F)cc1Cl Amb24683884 [0,2,0,0,0,0|2,0,0]=4 4972 B12R1.69 NCCCc1ccc(Cl)cc1F Amb23315399 [0,2,0,0,0,0|1,0,0]=3 4973 B12R1.69 NCCCc1ccc(Cl)cc1O Amb25084560 [0,2,0,0,0,0|1,0,0]=3 4974 B12R1.69 NCCCc1ccc(F)cc1O Amb25757889 [0,2,0,0,0,0|1,0,0]=3 4975 B12R1.69 NCCCc1ccc(O)cc1Cl Amb18556149 [0,2,0,0,0,0|1,0,0]=3 4976 B12R1.69 NCCCc1ccc(O)cc1O Amb18054814 [0,2,0,0,0,0|1,0,0]=3 4977 B12R1.69 NCCCc1ccc(cc1Br)C Amb17204537 [0,2,0,0,0,0|1,0,0]=3 4978 B12R1.69 NCCCc1ccc(cc1C)Br Amb17204538 [0,2,0,0,0,0|1,0,0]=3 4979 B12R1.69 NCCCc1ccc(cc1C)C Amb1215673 [0,2,0,0,0,0|1,0,0]=3 4980 B12R1.69 NCCCc1ccc(cc1C)Cl Amb17204337 [0,2,0,0,0,0|1,0,0]=3 4981 B12R1.69 NCCCc1ccc(cc1F)F Amb17204313 [0,2,0,0,0,0|1,0,0]=3 4982 B12R1.69 NCCNc1ccc(Br)cc1Cl Amb25062245 [0,2,0,0,0,0|2,0,0]=4 4983 B12R1.69 NCCNc1ccc(Cl)cc1F Amb18909785 [0,2,0,0,0,0|2,0,0]=4 4984 B12R1.69 NCCNc1ccc(F)cc1Cl Amb18909783 [0,2,0,0,0,0|2,0,0]=4 4985 B12R1.69 NCCNc1ccc(I)cc1Cl Amb25109686 [0,2,0,0,0,0|2,0,0]=4 4986 B12R1.69 NCCNc1ccc(cc1Br)C Amb17091075 [0,2,0,0,0,0|2,0,0]=4 4987 B12R1.69 NCCNc1ccc(cc1C)Br Amb17091076 [0,2,0,0,0,0|2,0,0]=4 4988 B12R1.69 NCCNc1ccc(cc1C)C Amb17057764 [0,2,0,0,0,0|2,0,0]=4 4989 B12R1.69 NCCNc1ccc(cc1C)Cl Amb17091059 [0,2,0,0,0,0|2,0,0]=4 4990 B12R1.69 NCCNc1ccc(cc1Cl)Cl Amb17091081 [0,2,0,0,0,0|2,0,0]=4 4991 B12R1.69 NCCNc1ccc(cc1F)F Amb17057761 [0,2,0,0,0,0|2,0,0]=4 4992 B12R1.69 NCCOc1ccc(Cl)cc1F Amb25192665 [0,2,0,0,0,0|2,0,0]=4 4993 B12R1.69 NCCOc1ccc(F)cc1F Amb19426831 [0,2,0,0,0,0|2,0,0]=4 4994 B12R1.69 NCCOc1ccc(cc1Br)Br Amb17381668 [0,2,0,0,0,0|2,0,0]=4 4995 B12R1.69 NCCOc1ccc(cc1C)C Amb1072012 [0,2,0,0,0,0|2,0,0]=4 4996 B12R1.69 NCCOc1ccc(cc1C)C Amb1215328 [0,2,0,0,0,0|2,0,0]=4 4997 B12R1.69 NCCOc1ccc(cc1Cl)F Amb2150774 [0,2,0,0,0,0|2,0,0]=4 4998 B12R1.69 NCCOc1ccc(cc1F)F Amb1139149 [0,2,0,0,0,0|2,0,0]=4 4999 B12R1.69 NCCSc1ccc(Cl)cc1Cl Amb21861547 [0,2,0,0,0,0|2,0,0]=4 5000 B12R1.69 NCCSc1ccc(cc1C)F Amb17083029 [0,2,0,0,0,0|2,0,0]=4 5001 B12R1.69 NNCCc1ccc(Br)cc1F Amb24525673 [0,2,0,0,0,0|0,0,0]=2 5002 B12R1.69 NNCCc1ccc(Cl)cc1Cl Amb19887737 [0,2,0,0,0,0|0,0,0]=2 5003 B12R1.69 NNCCc1ccc(Cl)cc1F Amb25188114 [0,2,0,0,0,0|0,0,0]=2 5004 B12R1.69 NNCCc1ccc(F)cc1Br Amb24470995 [0,2,0,0,0,0|0,0,0]=2 5005 B12R1.69 NNCCc1ccc(cc1C)C Amb17400165 [0,2,0,0,0,0|0,0,0]=2 5006 B12R1.69 NNCCc1ccc(cc1Cl)Cl Amb17402983 [0,2,0,0,0,0|0,0,0]=2 5007 B12R1.69 N\N=C\Cc1ccc(F)cc1Cl Amb24686050 [0,2,0,0,0,0|0,0,2]=4 5008 B12R1.69 Nc1cc(Br)c(CCCBr)cc1 Amb25243524 [0,2,0,0,0,0|2,0,0]=4 5009 B12R1.69 Nc1cc(Br)ccc1CCC=O Amb24501344 [0,2,0,0,0,0|2,0,0]=4 5010 B12R1.69 Nc1cc(Br)ccc1CCCN Amb24452129 [0,2,0,0,0,0|1,0,0]=3 5011 B12R1.69 Nc1cc(Br)ccc1NCCN Amb18999459 [0,2,0,0,0,0|2,0,0]=4 5012 B12R1.69 Nc1cc(Br)ccc1SCCN Amb18291323 [0,2,0,0,0,0|2,0,0]=4 5013 B12R1.69 Nc1cc(Cl)ccc1CCC#N Amb24656774 [0,2,0,0,0,0|1,0,1]=4 5014 B12R1.69 Nc1cc(Cl)ccc1CCCCl Amb24574272 [0,2,0,0,0,0|2,0,0]=4 5015 B12R1.69 Nc1cc(Cl)ccc1NCCN Amb18298634 [0,2,0,0,0,0|2,0,0]=4 5016 B12R1.69 Nc1cc(Cl)ccc1SCCN Amb18291311 [0,2,0,0,0,0|2,0,0]=4 5017 B12R1.69 Nc1cc(F)ccc1NCCN Amb18991501 [0,2,0,0,0,0|2,0,0]=4 5018 B12R1.69 Nc1cc(F)ccc1SCCN Amb18291317 [0,2,0,0,0,0|2,0,0]=4 5019 B12R1.69 Nc1cc(I)ccc1CCC=O Amb25311724 [0,2,0,0,0,0|2,0,0]=4 5020 B12R1.69 Nc1cc(I)ccc1CCCCl Amb25312276 [0,2,0,0,0,0|2,0,0]=4 5021 B12R1.69 Nc1cc(N)c(CCC=O)cc1 Amb25268463 [0,2,0,0,0,0|2,0,0]=4 5022 B12R1.69 Nc1cc(N)c(CCCCl)cc1 Amb24537154 [0,2,0,0,0,0|2,0,0]=4 5023 B12R1.69 Nc1cc(O)ccc1CCC=O Amb24536883 [0,2,0,0,0,0|2,0,0]=4 5024 B12R1.69 Nc1cc(S)ccc1CCC=O Amb24724099 [0,2,0,0,0,0|2,0,0]=4 5025 B12R1.69 Nc1cc(S)ccc1CCCBr Amb24695628 [0,2,0,0,0,0|2,0,0]=4 5026 B12R1.69 Nc1cc(S)ccc1CCCCl Amb24628043 [0,2,0,0,0,0|2,0,0]=4 5027 B12R1.69 Nc1ccc(CCC#N)c(Cl)c1 Amb25700092 [0,2,0,0,0,0|1,0,1]=4 5028 B12R1.69 Nc1ccc(CCC#N)c(F)c1 Amb25280190 [0,2,0,0,0,0|1,0,1]=4 5029 B12R1.69 Nc1ccc(CCC#N)c(I)c1 Amb24615894 [0,2,0,0,0,0|1,0,1]=4 5030 B12R1.69 Nc1ccc(CCCBr)c(O)c1 Amb24759204 [0,2,0,0,0,0|2,0,0]=4 5031 B12R1.69 Nc1ccc(CCCCl)c(O)c1 Amb25208686 [0,2,0,0,0,0|2,0,0]=4 5032 B12R1.69 Nc1ccc(NCCN)c(Br)c1 Amb18991524 [0,2,0,0,0,0|2,0,0]=4 5033 B12R1.69 Nc1ccc(NCCN)c(Cl)c1 Amb18298651 [0,2,0,0,0,0|2,0,0]=4 5034 B12R1.69 Nc1ccc(NCCN)c(F)c1 Amb18991505 [0,2,0,0,0,0|2,0,0]=4 5035 B12R1.69 Nc1ccc(SCCN)c(Cl)c1 Amb18975709 [0,2,0,0,0,0|2,0,0]=4 5036 B12R1.69 Nc1ccc(SCCN)c(F)c1 Amb18975707 [0,2,0,0,0,0|2,0,0]=4 5037 B12R1.69 O=CCCc1ccc(Br)cc1Cl Amb24455343 [0,2,0,0,0,0|2,0,0]=4 5038 B12R1.69 O=CCCc1ccc(Br)cc1F Amb24078525 [0,2,0,0,0,0|2,0,0]=4 5039 B12R1.69 O=CCCc1ccc(Cl)cc1Br Amb24483728 [0,2,0,0,0,0|2,0,0]=4 5040 B12R1.69 O=CCCc1ccc(Cl)cc1F Amb25149928 [0,2,0,0,0,0|2,0,0]=4 5041 B12R1.69 O=CCCc1ccc(Cl)cc1S Amb25270416 [0,2,0,0,0,0|2,0,0]=4 5042 B12R1.69 O=CCCc1ccc(F)cc1Br Amb25189497 [0,2,0,0,0,0|2,0,0]=4 5043 B12R1.69 O=CCCc1ccc(F)cc1Cl Amb19070647 [0,2,0,0,0,0|2,0,0]=4 5044 B12R1.69 O=CCCc1ccc(F)cc1F Amb18801723 [0,2,0,0,0,0|2,0,0]=4 5045 B12R1.69 O=CCCc1ccc(F)cc1I Amb25305164 [0,2,0,0,0,0|2,0,0]=4 5046 B12R1.69 O=CCCc1ccc(I)cc1F Amb24728158 [0,2,0,0,0,0|2,0,0]=4 5047 B12R1.69 O=CCCc1ccc(I)cc1I Amb25242662 [0,2,0,0,0,0|2,0,0]=4 5048 B12R1.69 O=CCCc1ccc(S)cc1S Amb24696708 [0,2,0,0,0,0|2,0,0]=4 5049 B12R1.69 O=CCCc1ccc(cc1Cl)Cl Amb17612588 [0,2,0,0,0,0|2,0,0]=4 5050 B12R1.69 OCCCc1ccc(Br)cc1F Amb20171344 [0,2,0,0,0,0|2,0,0]=4 5051 B12R1.69 OCCCc1ccc(Cl)cc1F Amb25720643 [0,2,0,0,0,0|2,0,0]=4 5052 B12R1.69 OCCCc1ccc(F)cc1Br Amb24090111 [0,2,0,0,0,0|2,0,0]=4 5053 B12R1.69 OCCCc1ccc(F)cc1Cl Amb19072148 [0,2,0,0,0,0|2,0,0]=4 5054 B12R1.69 OCCCc1ccc(O)cc1O Amb18646882 [0,2,0,0,0,0|2,0,0]=4 5055 B12R1.69 OCCCc1ccc(cc1C)C Amb17400157 [0,2,0,0,0,0|2,0,0]=4 5056 B12R1.69 OCCCc1ccc(cc1Cl)Cl Amb17402981 [0,2,0,0,0,0|2,0,0]=4 5057 B12R1.69 OCCCc1ccc(cc1F)F Amb17605787 [0,2,0,0,0,0|2,0,0]=4 5058 B12R1.69 Oc1cc(Cl)ccc1CCCBr Amb24743949 [0,2,0,0,0,0|2,0,0]=4 5059 B12R1.69 Oc1cc(F)ccc1CCCO Amb25106077 [0,2,0,0,0,0|2,0,0]=4 5060 B12R1.69 Oc1ccc(CCC=O)c(Br)c1 Amb25040158 [0,2,0,0,0,0|2,0,0]=4 5061 B12R1.69 Oc1ccc(CCCBr)c(I)c1 Amb24527855 [0,2,0,0,0,0|2,0,0]=4 5062 B12R1.69 Oc1ccc(CCCBr)c(S)c1 Amb25351802 [0,2,0,0,0,0|2,0,0]=4 5063 B12R1.69 Oc1ccc(CCCCl)c(S)c1 Amb25253243 [0,2,0,0,0,0|2,0,0]=4 5064 B12R1.69 Oc1ccc(CCCO)c(Cl)c1 Amb25690683 [0,2,0,0,0,0|2,0,0]=4 5065 B12R1.69 Oc1ccc(CCCO)c(F)c1 Amb25281830 [0,2,0,0,0,0|2,0,0]=4 5066 B12R1.69 Sc1ccc(CCCBr)c(I)c1 Amb24696766 [0,2,0,0,0,0|2,0,0]=4 5067 B12R1.71 BrCCCc1ccc(cc1)CC Amb17104557 [0,2,0,0,0,0|2,0,0]=4 5068 B12R1.71 BrCCCc1ccc(cc1)OC Amb17104559 [0,2,0,0,0,0|2,0,0]=4 5069 B12R1.71 BrCc1ccc(CCCBr)cc1 Amb23590681 [0,2,0,0,0,0|2,0,0]=4 5070 B12R1.71 C#CCCc1ccc(CO)cc1 Amb25137369 [0,2,0,0,0,0|2,0,0]=4 5071 B12R1.71 C#CCCc1ccc(cc1)C#N Amb18114977 [0,2,0,0,0,0|2,0,0]=4 5072 B12R1.71 C=CCCc1ccc(C=O)cc1 Amb24102789 [0,2,0,0,0,0|2,0,0]=4 5073 B12R1.71 C=Cc1ccc(CCCBr)cc1 Amb22831998 [0,2,0,0,0,0|2,0,0]=4 5074 B12R1.71 CCCCc1ccc(CBr)cc1 Amb24065906 [0,2,0,0,0,0|2,0,0]=4 5075 B12R1.71 CCCCc1ccc(NN)cc1 Amb17949643 [0,2,0,0,0,0|2,0,0]=4 5076 B12R1.71 CCCCc1ccc(cc1)NC Amb20623748 [0,2,0,0,0,0|2,0,0]=4 5077 B12R1.71 CCCCc1ccc(cc1)NN Amb2234491 [0,2,0,0,0,0|2,0,0]=4 5078 B12R1.71 CCCCc1ccc(cc1)NO Amb24091344 [0,2,0,0,0,0|2,0,0]=4 5079 B12R1.71 CCCCc1ccc(cc1)[Mg]Br Amb22000527 [0,2,0,0,0,0|2,0,0]=4 5080 B12R1.71 CCCCc1ccc(cc1)[Zn]Br Amb22898139 [0,2,0,0,0,0|2,0,0]=4 5081 B12R1.71 CCc1ccc(cc1)CCC#N Amb17204305 [0,2,0,0,0,0|1,0,1]=4 5082 B12R1.71 CCc1ccc(cc1)CCC=O Amb17081676 [0,2,0,0,0,0|2,0,0]=4 5083 B12R1.71 CCc1ccc(cc1)CCNN Amb17400163 [0,2,0,0,0,0|0,0,0]=2 5084 B12R1.71 CNCCc1ccc(C#N)[n]c1 Amb24579087 [0,2,0,0,0,0|2,0,0]=4 5085 B12R1.71 CNCCc1ccc(cc1)CC Amb17400138 [0,2,0,0,0,0|1,0,0]=3 5086 B12R1.71 CNCCc1ccc(cc1)OC Amb22831233 [0,2,0,0,0,0|1,0,0]=3 5087 B12R1.71 CNCCc1ccc(cc1)SC Amb18243817 [0,2,0,0,0,0|1,0,0]=3 5088 B12R1.71 CNc1ccc(cc1)OCCN Amb23400492 [0,2,0,0,0,0|2,0,0]=4 5089 B12R1.71 COc1ccc(CCC#C)cc1 Amb18115927 [0,2,0,0,0,0|2,0,0]=4 5090 B12R1.71 COc1ccc(CCNN)cc1 Amb19515647 [0,2,0,0,0,0|0,0,0]=2 5091 B12R1.71 COc1ccc(CCNN)cc1 Amb19889396 [0,2,0,0,0,0|0,0,0]=2 5092 B12R1.71 COc1ccc(CCOC)cc1 Amb24064722 [0,2,0,0,0,0|2,0,0]=4 5093 B12R1.71 COc1ccc(CC[Mg]Cl)cc1 Amb22000545 [0,2,0,0,0,0|2,0,0]=4 5094 B12R1.71 COc1ccc(cc1)SCCN Amb22051707 [0,2,0,0,0,0|2,0,0]=4 5095 B12R1.71 CSc1ccc(CCC#N)cc1 Amb18862922 [0,2,0,0,0,0|1,0,1]=4 5096 B12R1.71 CSc1ccc(CCC=O)cc1 Amb24093033 [0,2,0,0,0,0|2,0,0]=4 5097 B12R1.71 CSc1ccc(CCCN)cc1 Amb18055313 [0,2,0,0,0,0|1,0,0]=3 5098 B12R1.71 CSc1ccc(CCCO)cc1 Amb18863034 [0,2,0,0,0,0|2,0,0]=4 5099 B12R1.71 CSc1ccc(cc1)NCCN Amb18243831 [0,2,0,0,0,0|2,0,0]=4 5100 B12R1.71 ClCCCc1ccc(cc1)CC Amb17104530 [0,2,0,0,0,0|2,0,0]=4 5101 B12R1.71 N#CCCc1ccc(CBr)cc1 Amb24637117 [0,2,0,0,0,0|1,0,1]=4 5102 B12R1.71 N#CCCc1ccc(CCl)cc1 Amb25248725 [0,2,0,0,0,0|1,0,1]=4 5103 B12R1.71 N#Cc1ccc(CCC#N)cc1 Amb18644805 [0,2,0,0,0,0|1,0,1]=4 5104 B12R1.71 N#Cc1ccc(CCC=O)cc1 Amb24093122 [0,2,0,0,0,0|2,0,0]=4 5105 B12R1.71 N#Cc1ccc(CCCBr)cc1 Amb25851402 [0,2,0,0,0,0|2,0,0]=4 5106 B12R1.71 NCCCc1ccc(c[n]1)C#N Amb24413297 [0,2,0,0,0,0|2,0,0]=4 5107 B12R1.71 NCCCc1ccc(cc1)C#N Amb25708502 [0,2,0,0,0,0|1,0,0]=3 5108 B12R1.71 NCCCc1ccc(cc1)CO Amb17477572 [0,2,0,0,0,0|1,0,0]=3 5109 B12R1.71 NCCCc1ccc(cc1)OC Amb1092530 [0,2,0,0,0,0|1,0,0]=3 5110 B12R1.71 NCCCc1ccc(cc1)OC Amb13949143 [0,2,0,0,0,0|1,0,0]=3 5111 B12R1.71 NCCNc1ccc(CO)cc1 Amb25719187 [0,2,0,0,0,0|2,0,0]=4 5112 B12R1.71 NCCNc1ccc(cc1)CC Amb17057758 [0,2,0,0,0,0|2,0,0]=4 5113 B12R1.71 NCCNc1ccc(cc1)OC Amb10604015 [0,2,0,0,0,0|2,0,0]=4 5114 B12R1.71 NCCOc1ccc(cc1)C#N Amb17562028 [0,2,0,0,0,0|2,0,0]=4 5115 B12R1.71 NCCOc1ccc(cc1)C#N Amb19374943 [0,2,0,0,0,0|2,0,0]=4 5116 B12R1.71 NCCOc1ccc(cc1)CC Amb1138492 [0,2,0,0,0,0|2,0,0]=4 5117 B12R1.71 NCCOc1ccc(cc1)OC Amb1063468 [0,2,0,0,0,0|2,0,0]=4 5118 B12R1.71 NCCOc1ccc(cc1)SC Amb10243213 [0,2,0,0,0,0|2,0,0]=4 5119 B12R1.71 NCCSc1ccc(cc1)C#N Amb18909077 [0,2,0,0,0,0|2,0,0]=4 5120 B12R1.71 NCCSc1ccc(cc1)CC Amb17083025 [0,2,0,0,0,0|2,0,0]=4 5121 B12R1.71 NCc1ccc(CCCN)cc1 Amb22395124 [0,2,0,0,0,0|1,0,0]=3 5122 B12R1.71 NCc1ccc(CCCO)cc1 Amb23441994 [0,2,0,0,0,0|2,0,0]=4 5123 B12R1.71 NOCCc1ccc(cc1)OC Amb17232637 [0,2,0,0,0,0|1,0,0]=3 5124 B12R1.71 O=Cc1ccc(CCC=O)cc1 Amb18645655 [0,2,0,0,0,0|2,0,0]=4 5125 B12R1.71 OCCCc1ccc(C=O)cc1 Amb18646079 [0,2,0,0,0,0|2,0,0]=4 5126 B12R1.71 OCCCc1ccc(cc1)C#N Amb13883607 [0,2,0,0,0,0|2,0,0]=4 5127 B12R1.71 OCCCc1ccc(cc1)CC Amb17089498 [0,2,0,0,0,0|2,0,0]=4 5128 B12R1.71 SCCCc1ccc(cc1)CC Amb17400844 [0,2,0,0,0,0|2,0,0]=4 5129 B12R1.71 SCCCc1ccc(cc1)OC Amb17400951 [0,2,0,0,0,0|2,0,0]=4 5130 B12R1.385 BrCCCc1cc(Br)c(Br)cc1 Amb24579120 [0,2,0,0,0,0|2,0,0]=4 5131 B12R1.385 Brc1ccc(CCCBr)cc1I Amb24651202 [0,2,0,0,0,0|2,0,0]=4 5132 B12R1.385 C#CCCc1cc(Cl)c(Cl)cc1 Amb18636113 [0,2,0,0,0,0|2,0,0]=4 5133 B12R1.385 C=CCCc1ccc(F)c(Br)c1 Amb25375534 [0,2,0,0,0,0|2,0,0]=4 5134 B12R1.385 CC1=CN(CCCN)C=CC1=O Amb24412346 [0,2,0,0,0,0|2,0,0]=4 5135 B12R1.385 CCCCc1cc(Br)c(Br)cc1 Amb19944055 [0,2,0,0,0,0|2,0,0]=4 5136 B12R1.385 CCCCc1cc(N)c(N)cc1 Amb18646137 [0,2,0,0,0,0|2,0,0]=4 5137 B12R1.385 CCCCc1cc(N)c(N)cc1 Amb20247546 [0,2,0,0,0,0|2,0,0]=4 5138 B12R1.385 CCCCc1cc(O)c(O)cc1 Amb22167996 [0,2,0,0,0,0|2,0,0]=4 5139 B12R1.385 CCCCc1ccc(Cl)c(Br)c1 Amb19944056 [0,2,0,0,0,0|2,0,0]=4 5140 B12R1.385 CCCCc1ccc(I)c(Br)c1 Amb19944054 [0,2,0,0,0,0|2,0,0]=4 5141 B12R1.385 CCCCc1ccc(N)c(Br)c1 Amb19944049 [0,2,0,0,0,0|2,0,0]=4 5142 B12R1.385 CCCCc1ccc(N)c(Br)c1 Amb23517949 [0,2,0,0,0,0|2,0,0]=4 5143 B12R1.385 CCCCc1ccc(N)c(F)c1 Amb25351578 [0,2,0,0,0,0|2,0,0]=4 5144 B12R1.385 CCCCc1ccc(N)c(S)c1 Amb18939301 [0,2,0,0,0,0|2,0,0]=4 5145 B12R1.385 CCCCc1ccc(O)c(Br)c1 Amb20620414 [0,2,0,0,0,0|2,0,0]=4 5146 B12R1.385 CCCCc1ccc(O)c(F)c1 Amb24091337 [0,2,0,0,0,0|2,0,0]=4 5147 B12R1.385 CCCCc1ccc(O)c(N)c1 Amb24331679 [0,2,0,0,0,0|2,0,0]=4 5148 B12R1.385 CN1C=C(CCCN)C=CC1=O Amb18862670 [0,2,0,0,0,0|2,0,0]=4 5149 B12R1.385 CNCCc1cc(Br)c(Br)cc1 Amb25790141 [0,2,0,0,0,0|1,0,0]=3 5150 B12R1.385 CNCCc1cc(F)c(F)cc1 Amb18301397 [0,2,0,0,0,0|1,0,0]=3 5151 B12R1.385 CNCCc1ccc(F)c(Br)c1 Amb18299502 [0,2,0,0,0,0|1,0,0]=3 5152 B12R1.385 CNCCc1ccc(F)c(Cl)c1 Amb18893772 [0,2,0,0,0,0|1,0,0]=3 5153 B12R1.385 CNCCc1ccc(O)c(N)c1 Amb24537731 [0,2,0,0,0,0|1,0,0]=3 5154 B12R1.385 CNCCc1ccc(c(c1)C)C Amb17085511 [0,2,0,0,0,0|1,0,0]=3 5155 B12R1.385 CNCCc1ccc(c(c1)C)F Amb17400235 [0,2,0,0,0,0|1,0,0]=3 5156 B12R1.385 CNCCc1ccc(c(c1)Cl)Cl Amb17193869 [0,2,0,0,0,0|1,0,0]=3 5157 B12R1.385 CNCCc1ccc(c(c1)O)O Amb10844789 [0,2,0,0,0,0|1,0,0]=3 5158 B12R1.385 COCCc1ccc(O)c(Br)c1 Amb25767182 [0,2,0,0,0,0|2,0,0]=4 5159 B12R1.385 COCCc1ccc(O)c(I)c1 Amb25372254 [0,2,0,0,0,0|2,0,0]=4 5160 B12R1.385 COCCc1ccc(O)c(N)c1 Amb18989727 [0,2,0,0,0,0|2,0,0]=4 5161 B12R1.385 CSCCc1cc(F)c(F)cc1 Amb24476373 [0,2,0,0,0,0|2,0,0]=4 5162 B12R1.385 CSCCc1cc(O)c(O)cc1 Amb18648967 [0,2,0,0,0,0|2,0,0]=4 5163 B12R1.385 CSCCc1ccc(Br)c(F)c1 Amb24525633 [0,2,0,0,0,0|2,0,0]=4 5164 B12R1.385 Cc1[n]cc(CCCN)cc1Cl Amb25715361 [0,2,0,0,0,0|2,0,0]=4 5165 B12R1.385 Cc1c[n]c(CCCN)cc1Cl Amb25303923 [0,2,0,0,0,0|2,0,0]=4 5166 B12R1.385 Cc1cc(CCC#N)ccc1Cl Amb24353066 [0,2,0,0,0,0|1,0,1]=4 5167 B12R1.385 Cc1cc(CCC#N)ccc1F Amb18862582 [0,2,0,0,0,0|1,0,1]=4 5168 B12R1.385 Cc1cc(CCC#N)ccc1N Amb25217806 [0,2,0,0,0,0|1,0,1]=4 5169 B12R1.385 Cc1cc(CCC#N)ccc1O Amb20621623 [0,2,0,0,0,0|1,0,1]=4 5170 B12R1.385 Cc1cc(CCC=C)ccc1F Amb25064356 [0,2,0,0,0,0|2,0,0]=4 5171 B12R1.385 Cc1cc(CCC=O)ccc1Br Amb18070236 [0,2,0,0,0,0|2,0,0]=4 5172 B12R1.385 Cc1cc(CCC=O)ccc1C Amb18798124 [0,2,0,0,0,0|2,0,0]=4 5173 B12R1.385 Cc1cc(CCC=O)ccc1F Amb25682112 [0,2,0,0,0,0|2,0,0]=4 5174 B12R1.385 Cc1cc(CCC=O)ccc1I Amb24603486 [0,2,0,0,0,0|2,0,0]=4 5175 B12R1.385 Cc1cc(CCC=O)ccc1O Amb25838807 [0,2,0,0,0,0|2,0,0]=4 5176 B12R1.385 Cc1cc(CCCBr)ccc1C Amb24488677 [0,2,0,0,0,0|2,0,0]=4 5177 B12R1.385 Cc1cc(CCCBr)ccc1O Amb24527963 [0,2,0,0,0,0|2,0,0]=4 5178 B12R1.385 Cc1cc(CCCC)ccc1O Amb24403254 [0,2,0,0,0,0|2,0,0]=4 5179 B12R1.385 Cc1cc(CCCCl)ccc1Br Amb24566578 [0,2,0,0,0,0|2,0,0]=4 5180 B12R1.385 Cc1cc(CCCCl)ccc1C Amb18325208 [0,2,0,0,0,0|2,0,0]=4 5181 B12R1.385 Cc1cc(CCCCl)ccc1F Amb25841123 [0,2,0,0,0,0|2,0,0]=4 5182 B12R1.385 Cc1cc(CCCCl)ccc1I Amb24605295 [0,2,0,0,0,0|2,0,0]=4 5183 B12R1.385 Cc1cc(CCCCl)ccc1O Amb24637062 [0,2,0,0,0,0|2,0,0]=4 5184 B12R1.385 Cc1cc(CCCCl)ccc1S Amb25217669 [0,2,0,0,0,0|2,0,0]=4 5185 B12R1.385 Cc1cc(CCCN)c[n]c1C Amb25100359 [0,2,0,0,0,0|2,0,0]=4 5186 B12R1.385 Cc1cc(CCCN)c[n]c1Cl Amb24520597 [0,2,0,0,0,0|2,0,0]=4 5187 B12R1.385 Cc1cc(CCCN)c[n]c1F Amb24404985 [0,2,0,0,0,0|2,0,0]=4 5188 B12R1.385 Cc1cc(CCCN)ccc1Cl Amb18554358 [0,2,0,0,0,0|1,0,0]=3 5189 B12R1.385 Cc1cc(CCCO)ccc1Cl Amb24465130 [0,2,0,0,0,0|2,0,0]=4 5190 B12R1.385 Cc1cc(CCCO)ccc1F Amb18862775 [0,2,0,0,0,0|2,0,0]=4 5191 B12R1.385 Cc1cc(CCCO)ccc1O Amb24624666 [0,2,0,0,0,0|2,0,0]=4 5192 B12R1.385 Cc1cc(CCCS)ccc1C Amb25198296 [0,2,0,0,0,0|2,0,0]=4 5193 B12R1.385 Cc1cc(CCNC)ccc1Br Amb18942021 [0,2,0,0,0,0|1,0,0]=3 5194 B12R1.385 Cc1cc(CCNC)ccc1Cl Amb18552721 [0,2,0,0,0,0|1,0,0]=3 5195 B12R1.385 Cc1cc(CCNC)ccc1O Amb24385303 [0,2,0,0,0,0|1,0,0]=3 5196 B12R1.385 Cc1cc(ccc1Br)SCCN Amb24354309 [0,2,0,0,0,0|2,0,0]=4 5197 B12R1.385 Cc1cc(ccc1F)NCCN Amb18299162 [0,2,0,0,0,0|2,0,0]=4 5198 B12R1.385 Cc1cc(ccc1F)OCCN Amb18893580 [0,2,0,0,0,0|2,0,0]=4 5199 B12R1.385 Cc1cc(ccc1N)NCCN Amb18298683 [0,2,0,0,0,0|2,0,0]=4 5200 B12R1.385 Cc1cc(ccc1N)OCCN Amb18908681 [0,2,0,0,0,0|2,0,0]=4 5201 B12R1.385 Cc1cc(ccc1N)SCCN Amb24627532 [0,2,0,0,0,0|2,0,0]=4 5202 B12R1.385 Cc1ccc(CCC#N)cc1N Amb25675571 [0,2,0,0,0,0|1,0,1]=4 5203 B12R1.385 Cc1ccc(CCC#N)cc1S Amb25247589 [0,2,0,0,0,0|1,0,1]=4 5204 B12R1.385 Cc1ccc(CCC=C)cc1Cl Amb24426879 [0,2,0,0,0,0|2,0,0]=4 5205 B12R1.385 Cc1ccc(CCC=C)cc1F Amb25113932 [0,2,0,0,0,0|2,0,0]=4 5206 B12R1.385 Cc1ccc(CCC=O)cc1Br Amb18069967 [0,2,0,0,0,0|2,0,0]=4 5207 B12R1.385 Cc1ccc(CCC=O)cc1Cl Amb18564229 [0,2,0,0,0,0|2,0,0]=4 5208 B12R1.385 Cc1ccc(CCC=O)cc1F Amb24093026 [0,2,0,0,0,0|2,0,0]=4 5209 B12R1.385 Cc1ccc(CCC=O)cc1I Amb25118646 [0,2,0,0,0,0|2,0,0]=4 5210 B12R1.385 Cc1ccc(CCCBr)cc1Br Amb24339560 [0,2,0,0,0,0|2,0,0]=4 5211 B12R1.385 Cc1ccc(CCCBr)cc1Cl Amb25130714 [0,2,0,0,0,0|2,0,0]=4 5212 B12R1.385 Cc1ccc(CCCBr)cc1I Amb25207303 [0,2,0,0,0,0|2,0,0]=4 5213 B12R1.385 Cc1ccc(CCCC)cc1N Amb24071080 [0,2,0,0,0,0|2,0,0]=4 5214 B12R1.385 Cc1ccc(CCCCl)cc1Cl Amb24720204 [0,2,0,0,0,0|2,0,0]=4 5215 B12R1.385 Cc1ccc(CCCCl)cc1F Amb25152290 [0,2,0,0,0,0|2,0,0]=4 5216 B12R1.385 Cc1ccc(CCCN)[n]c1Cl Amb24623106 [0,2,0,0,0,0|2,0,0]=4 5217 B12R1.385 Cc1ccc(CCCN)cc1F Amb22395115 [0,2,0,0,0,0|1,0,0]=3 5218 B12R1.385 Cc1ccc(CCCN)cc1N Amb25269801 [0,2,0,0,0,0|1,0,0]=3 5219 B12R1.385 Cc1ccc(CCCN)cc1O Amb25159897 [0,2,0,0,0,0|1,0,0]=3 5220 B12R1.385 Cc1ccc(CCCO)cc1Br Amb24664258 [0,2,0,0,0,0|2,0,0]=4 5221 B12R1.385 Cc1ccc(CCCO)cc1F Amb25265576 [0,2,0,0,0,0|2,0,0]=4 5222 B12R1.385 Cc1ccc(CCNC)cc1F Amb25721680 [0,2,0,0,0,0|1,0,0]=3 5223 B12R1.385 Cc1ccc(CCNN)cc1Br Amb25755790 [0,2,0,0,0,0|0,0,0]=2 5224 B12R1.385 Cc1ccc(cc1Cl)OCCN Amb23441775 [0,2,0,0,0,0|2,0,0]=4 5225 B12R1.385 Cc1ccc(cc1F)NCCN Amb18251976 [0,2,0,0,0,0|2,0,0]=4 5226 B12R1.385 Cc1ccc(cc1F)OCCN Amb24341985 [0,2,0,0,0,0|2,0,0]=4 5227 B12R1.385 Cc1ccc(cc1I)NCCN Amb25757086 [0,2,0,0,0,0|2,0,0]=4 5228 B12R1.385 Cc1ccc(cc1N)NCCN Amb18999842 [0,2,0,0,0,0|2,0,0]=4 5229 B12R1.385 Cc1ccc(cc1O)NCCN Amb25755404 [0,2,0,0,0,0|2,0,0]=4 5230 B12R1.385 ClCCCc1ccc(Br)c(I)c1 Amb24651203 [0,2,0,0,0,0|2,0,0]=4 5231 B12R1.385 ClCCCc1ccc(c(c1)Cl)Cl Amb17477749 [0,2,0,0,0,0|2,0,0]=4 5232 B12R1.385 ClCCCc1ccc(c(c1)N)Cl Amb17477718 [0,2,0,0,0,0|2,0,0]=4 5233 B12R1.385 ClCCCc1ccc(c(c1)N)O Amb17477706 [0,2,0,0,0,0|2,0,0]=4 5234 B12R1.385 Clc1cc(CCCCl)ccc1I Amb24591038 [0,2,0,0,0,0|2,0,0]=4 5235 B12R1.385 Clc1ccc(CCCBr)cc1I Amb25376283 [0,2,0,0,0,0|2,0,0]=4 5236 B12R1.385 Clc1ccc(CC[Mg]Br)cc1Cl Amb22000599 [0,2,0,0,0,0|2,0,0]=4 5237 B12R1.385 Clc1ccc(CC[Zn]Br)cc1Cl Amb22000519 [0,2,0,0,0,0|2,0,0]=4 5238 B12R1.385 Fc1cc(CCCBr)ccc1Cl Amb25046816 [0,2,0,0,0,0|2,0,0]=4 5239 B12R1.385 Fc1cc(CCCCl)ccc1Br Amb25351929 [0,2,0,0,0,0|2,0,0]=4 5240 B12R1.385 Fc1cc(CCCCl)ccc1Cl Amb24468477 [0,2,0,0,0,0|2,0,0]=4 5241 B12R1.385 Fc1cc(CCCCl)ccc1I Amb24598653 [0,2,0,0,0,0|2,0,0]=4 5242 B12R1.385 Fc1ccc(CCCBr)cc1Br Amb25699797 [0,2,0,0,0,0|2,0,0]=4 5243 B12R1.385 Fc1ccc(CCCBr)cc1Cl Amb24638891 [0,2,0,0,0,0|2,0,0]=4 5244 B12R1.385 Fc1ccc(CCCBr)cc1S Amb25209552 [0,2,0,0,0,0|2,0,0]=4 5245 B12R1.385 Fc1ccc(CCCCl)cc1Br Amb24389703 [0,2,0,0,0,0|2,0,0]=4 5246 B12R1.385 Fc1ccc(CCCCl)cc1S Amb24640781 [0,2,0,0,0,0|2,0,0]=4 5247 B12R1.385 N#CCCc1cc(I)c(I)cc1 Amb25253155 [0,2,0,0,0,0|1,0,1]=4 5248 B12R1.385 N#CCCc1cc(O)c(O)cc1 Amb25824607 [0,2,0,0,0,0|1,0,1]=4 5249 B12R1.385 N#CCCc1ccc(Br)c(Cl)c1 Amb24656440 [0,2,0,0,0,0|1,0,1]=4 5250 B12R1.385 N#CCCc1ccc(Cl)c(O)c1 Amb25363528 [0,2,0,0,0,0|1,0,1]=4 5251 B12R1.385 N#CCCc1ccc(Cl)c(S)c1 Amb24578939 [0,2,0,0,0,0|1,0,1]=4 5252 B12R1.385 N#CCCc1ccc(F)c(I)c1 Amb24611581 [0,2,0,0,0,0|1,0,1]=4 5253 B12R1.385 N#CCCc1ccc(I)c(F)c1 Amb24572856 [0,2,0,0,0,0|1,0,1]=4 5254 B12R1.385 N#CCCc1ccc(O)c(F)c1 Amb24656436 [0,2,0,0,0,0|1,0,1]=4 5255 B12R1.385 N#CCCc1ccc(S)c(F)c1 Amb25230141 [0,2,0,0,0,0|1,0,1]=4 5256 B12R1.385 N#CCCc1ccc(c(c1)Br)C Amb17204516 [0,2,0,0,0,0|1,0,1]=4 5257 B12R1.385 N#CCCc1ccc(c(c1)C)Br Amb17204519 [0,2,0,0,0,0|1,0,1]=4 5258 B12R1.385 N#CCCc1ccc(c(c1)C)C Amb17204302 [0,2,0,0,0,0|1,0,1]=4 5259 B12R1.385 N#CCCc1ccc(c(c1)Cl)C Amb17204325 [0,2,0,0,0,0|1,0,1]=4 5260 B12R1.385 N#CCCc1ccc(c(c1)Cl)Cl Amb17204384 [0,2,0,0,0,0|1,0,1]=4 5261 B12R1.385 N#CCCc1ccc(c(c1)Cl)F Amb17204333 [0,2,0,0,0,0|1,0,1]=4 5262 B12R1.385 N#CCCc1ccc(c(c1)Cl)O Amb17509041 [0,2,0,0,0,0|1,0,1]=4 5263 B12R1.385 N#CCCc1ccc(c(c1)F)F Amb17204311 [0,2,0,0,0,0|1,0,1]=4 5264 B12R1.385 NCCCC1=CC(=O)C(O)=CO1 Amb24485638 [0,2,0,0,0,0|2,0,0]=4 5265 B12R1.385 NCCCc1c[n]c(Cl)c(F)c1 Amb24367908 [0,2,0,0,0,0|2,0,0]=4 5266 B12R1.385 NCCCc1c[n]c(Cl)c(O)c1 Amb24493081 [0,2,0,0,0,0|2,0,0]=4 5267 B12R1.385 NCCCc1c[n]c(F)c(Cl)c1 Amb24493022 [0,2,0,0,0,0|2,0,0]=4 5268 B12R1.385 NCCCc1c[n]c(O)c(Cl)c1 Amb24405013 [0,2,0,0,0,0|2,0,0]=4 5269 B12R1.385 NCCCc1cc(Cl)c(F)c[n]1 Amb24367666 [0,2,0,0,0,0|2,0,0]=4 5270 B12R1.385 NCCCc1cc(Cl)c(O)c[n]1 Amb25251778 [0,2,0,0,0,0|2,0,0]=4 5271 B12R1.385 NCCCc1cc(O)c(O)cc1 Amb18827195 [0,2,0,0,0,0|1,0,0]=3 5272 B12R1.385 NCCCc1cc(O)c(O)cc1 Amb19516002 [0,2,0,0,0,0|1,0,0]=3 5273 B12R1.385 NCCCc1ccc(Br)c(Cl)c1 Amb25127779 [0,2,0,0,0,0|1,0,0]=3 5274 B12R1.385 NCCCc1ccc(Cl)c(Br)c1 Amb25331909 [0,2,0,0,0,0|1,0,0]=3 5275 B12R1.385 NCCCc1ccc(Cl)c(F)[n]1 Amb25347571 [0,2,0,0,0,0|2,0,0]=4 5276 B12R1.385 NCCCc1ccc(Cl)c(F)c1 Amb18821280 [0,2,0,0,0,0|1,0,0]=3 5277 B12R1.385 NCCCc1ccc(O)c(Br)c1 Amb24483621 [0,2,0,0,0,0|1,0,0]=3 5278 B12R1.385 NCCCc1ccc(c(c1)Br)C Amb17204536 [0,2,0,0,0,0|1,0,0]=3 5279 B12R1.385 NCCCc1ccc(c(c1)C)Br Amb17204539 [0,2,0,0,0,0|1,0,0]=3 5280 B12R1.385 NCCCc1ccc(c(c1)C)F Amb17232643 [0,2,0,0,0,0|1,0,0]=3 5281 B12R1.385 NCCCc1ccc(c(c1)Cl)C Amb17204338 [0,2,0,0,0,0|1,0,0]=3 5282 B12R1.385 NCCCc1ccc(c(c1)Cl)F Amb17204345 [0,2,0,0,0,0|1,0,0]=3 5283 B12R1.385 NCCCc1ccc(c(c1)Cl)O Amb17509068 [0,2,0,0,0,0|1,0,0]=3 5284 B12R1.385 NCCCc1ccc(c(c1)F)F Amb17204314 [0,2,0,0,0,0|1,0,0]=3 5285 B12R1.385 NCCCc1ccc(c(c1)N)Cl Amb17477697 [0,2,0,0,0,0|1,0,0]=3 5286 B12R1.385 NCCCc1ccc(c(c1)N)O Amb17477692 [0,2,0,0,0,0|1,0,0]=3 5287 B12R1.385 NCCNc1cc(Br)c(Cl)cc1 Amb24414229 [0,2,0,0,0,0|2,0,0]=4 5288 B12R1.385 NCCNc1cc(Br)c(F)cc1 Amb25327051 [0,2,0,0,0,0|2,0,0]=4 5289 B12R1.385 NCCNc1cc(Cl)c(Br)cc1 Amb24416528 [0,2,0,0,0,0|2,0,0]=4 5290 B12R1.385 NCCNc1cc(Cl)c(O)cc1 Amb25094658 [0,2,0,0,0,0|2,0,0]=4 5291 B12R1.385 NCCNc1cc(F)c(Cl)cc1 Amb18909784 [0,2,0,0,0,0|2,0,0]=4 5292 B12R1.385 NCCNc1cc(F)c(O)cc1 Amb25793339 [0,2,0,0,0,0|2,0,0]=4 5293 B12R1.385 NCCNc1cc(I)c(Br)cc1 Amb24408786 [0,2,0,0,0,0|2,0,0]=4 5294 B12R1.385 NCCNc1cc(N)c(N)cc1 Amb24543629 [0,2,0,0,0,0|2,0,0]=4 5295 B12R1.385 NCCNc1ccc(c(c1)Br)C Amb17091063 [0,2,0,0,0,0|2,0,0]=4 5296 B12R1.385 NCCNc1ccc(c(c1)C)Br Amb17091077 [0,2,0,0,0,0|2,0,0]=4 5297 B12R1.385 NCCNc1ccc(c(c1)C)C Amb17091052 [0,2,0,0,0,0|2,0,0]=4 5298 B12R1.385 NCCNc1ccc(c(c1)Cl)C Amb17091060 [0,2,0,0,0,0|2,0,0]=4 5299 B12R1.385 NCCNc1ccc(c(c1)Cl)Cl Amb17091080 [0,2,0,0,0,0|2,0,0]=4 5300 B12R1.385 NCCNc1ccc(c(c1)Cl)F Amb17057760 [0,2,0,0,0,0|2,0,0]=4 5301 B12R1.385 NCCNc1ccc(c(c1)F)F Amb17057762 [0,2,0,0,0,0|2,0,0]=4 5302 B12R1.385 NCCOc1cc(Br)c(Cl)cc1 Amb25251177 [0,2,0,0,0,0|2,0,0]=4 5303 B12R1.385 NCCOc1cc(Br)c(F)cc1 Amb24385803 [0,2,0,0,0,0|2,0,0]=4 5304 B12R1.385 NCCOc1cc(Cl)c(Cl)cc1 Amb21959595 [0,2,0,0,0,0|2,0,0]=4 5305 B12R1.385 NCCOc1cc(F)c(Cl)cc1 Amb25327059 [0,2,0,0,0,0|2,0,0]=4 5306 B12R1.385 NCCOc1cc(F)c(F)cc1 Amb19345444 [0,2,0,0,0,0|2,0,0]=4 5307 B12R1.385 NCCOc1cc(O)c(Cl)cc1 Amb25101621 [0,2,0,0,0,0|2,0,0]=4 5308 B12R1.385 NCCOc1ccc(c(c1)C)Cl Amb1090468 [0,2,0,0,0,0|2,0,0]=4 5309 B12R1.385 NCCOc1ccc(c(c1)Cl)F Amb2198114 [0,2,0,0,0,0|2,0,0]=4 5310 B12R1.385 NCCSc1ccc(c(c1)C)C Amb1105388 [0,2,0,0,0,0|2,0,0]=4 5311 B12R1.385 NCCSc1ccc(c(c1)C)Cl Amb17083044 [0,2,0,0,0,0|2,0,0]=4 5312 B12R1.385 NCCSc1ccc(c(c1)C)F Amb17083028 [0,2,0,0,0,0|2,0,0]=4 5313 B12R1.385 NCCSc1ccc(c(c1)Cl)Cl Amb17083030 [0,2,0,0,0,0|2,0,0]=4 5314 B12R1.385 NNCCc1cc(Cl)c(Cl)cc1 Amb19887584 [0,2,0,0,0,0|0,0,0]=2 5315 B12R1.385 NNCCc1ccc(F)c(Br)c1 Amb24555901 [0,2,0,0,0,0|0,0,0]=2 5316 B12R1.385 NNCCc1ccc(F)c(Cl)c1 Amb25062951 [0,2,0,0,0,0|0,0,0]=2 5317 B12R1.385 NNCCc1ccc(c(c1)C)C Amb17400166 [0,2,0,0,0,0|0,0,0]=2 5318 B12R1.385 NNCCc1ccc(c(c1)C)F Amb17400254 [0,2,0,0,0,0|0,0,0]=2 5319 B12R1.385 NNCCc1ccc(c(c1)Cl)Cl Amb17402984 [0,2,0,0,0,0|0,0,0]=2 5320 B12R1.385 NNCCc1ccc(c(c1)F)F Amb17400364 [0,2,0,0,0,0|0,0,0]=2 5321 B12R1.385 NOCCc1cc(Cl)c(Cl)cc1 Amb24733703 [0,2,0,0,0,0|1,0,0]=3 5322 B12R1.385 NOCCc1cc(F)c(F)cc1 Amb24497429 [0,2,0,0,0,0|1,0,0]=3 5323 B12R1.385 Nc1cc(CCC#N)ccc1Cl Amb25848481 [0,2,0,0,0,0|1,0,1]=4 5324 B12R1.385 Nc1cc(CCC#N)ccc1F Amb24747181 [0,2,0,0,0,0|1,0,1]=4 5325 B12R1.385 Nc1cc(CCC=O)ccc1Cl Amb24759207 [0,2,0,0,0,0|2,0,0]=4 5326 B12R1.385 Nc1cc(CCCBr)ccc1N Amb24537158 [0,2,0,0,0,0|2,0,0]=4 5327 B12R1.385 Nc1cc(CCCBr)ccc1O Amb25208684 [0,2,0,0,0,0|2,0,0]=4 5328 B12R1.385 Nc1cc(CCCCl)ccc1S Amb24707954 [0,2,0,0,0,0|2,0,0]=4 5329 B12R1.385 Nc1ccc(CCC=O)cc1O Amb24536884 [0,2,0,0,0,0|2,0,0]=4 5330 B12R1.385 Nc1ccc(CCCBr)cc1F Amb24549379 [0,2,0,0,0,0|2,0,0]=4 5331 B12R1.385 Nc1ccc(CCCBr)cc1S Amb25217656 [0,2,0,0,0,0|2,0,0]=4 5332 B12R1.385 Nc1ccc(CCCCl)cc1Cl Amb24697078 [0,2,0,0,0,0|2,0,0]=4 5333 B12R1.385 Nc1ccc(CCCCl)cc1S Amb25275606 [0,2,0,0,0,0|2,0,0]=4 5334 B12R1.385 Nc1ccc(cc1Cl)SCCN Amb25303044 [0,2,0,0,0,0|2,0,0]=4 5335 B12R1.385 Nc1ccc(cc1F)SCCN Amb24356894 [0,2,0,0,0,0|2,0,0]=4 5336 B12R1.385 O=CCCc1cc(Br)c(Br)cc1 Amb25301219 [0,2,0,0,0,0|2,0,0]=4 5337 B12R1.385 O=CCCc1cc(Cl)c(Cl)cc1 Amb24093018 [0,2,0,0,0,0|2,0,0]=4 5338 B12R1.385 O=CCCc1cc(F)c(F)cc1 Amb18563918 [0,2,0,0,0,0|2,0,0]=4 5339 B12R1.385 O=CCCc1ccc(Br)c(F)c1 Amb25733243 [0,2,0,0,0,0|2,0,0]=4 5340 B12R1.385 O=CCCc1ccc(Br)c(I)c1 Amb25301482 [0,2,0,0,0,0|2,0,0]=4 5341 B12R1.385 O=CCCc1ccc(Cl)c(Br)c1 Amb24382161 [0,2,0,0,0,0|2,0,0]=4 5342 B12R1.385 O=CCCc1ccc(Cl)c(F)c1 Amb25836345 [0,2,0,0,0,0|2,0,0]=4 5343 B12R1.385 O=CCCc1ccc(Cl)c(I)c1 Amb25690980 [0,2,0,0,0,0|2,0,0]=4 5344 B12R1.385 O=CCCc1ccc(F)c(Br)c1 Amb24093021 [0,2,0,0,0,0|2,0,0]=4 5345 B12R1.385 O=CCCc1ccc(F)c(Cl)c1 Amb18564403 [0,2,0,0,0,0|2,0,0]=4 5346 B12R1.385 O=CCCc1ccc(I)c(Cl)c1 Amb25268272 [0,2,0,0,0,0|2,0,0]=4 5347 B12R1.385 O=CCCc1ccc(I)c(S)c1 Amb24541086 [0,2,0,0,0,0|2,0,0]=4 5348 B12R1.385 O=CCCc1ccc(S)c(F)c1 Amb24603942 [0,2,0,0,0,0|2,0,0]=4 5349 B12R1.385 OCCCc1cc(F)c(F)cc1 Amb18224422 [0,2,0,0,0,0|2,0,0]=4 5350 B12R1.385 OCCCc1ccc(Cl)c(Br)c1 Amb23560508 [0,2,0,0,0,0|2,0,0]=4 5351 B12R1.385 OCCCc1ccc(F)c(Cl)c1 Amb18863384 [0,2,0,0,0,0|2,0,0]=4 5352 B12R1.385 OCCCc1ccc(c(c1)C)C Amb17605788 [0,2,0,0,0,0|2,0,0]=4 5353 B12R1.385 OCCCc1ccc(c(c1)Cl)Cl Amb17402982 [0,2,0,0,0,0|2,0,0]=4 5354 B12R1.385 OCCCc1ccc(c(c1)N)Cl Amb17477707 [0,2,0,0,0,0|2,0,0]=4 5355 B12R1.385 OCCCc1ccc(c(c1)N)O Amb17477699 [0,2,0,0,0,0|2,0,0]=4 5356 B12R1.385 Oc1cc(CCC=O)ccc1Br Amb24341987 [0,2,0,0,0,0|2,0,0]=4 5357 B12R1.385 Oc1cc(CCC=O)ccc1Cl Amb25806089 [0,2,0,0,0,0|2,0,0]=4 5358 B12R1.385 Oc1cc(CCC=O)ccc1F Amb25360910 [0,2,0,0,0,0|2,0,0]=4 5359 B12R1.385 Oc1cc(CCCBr)ccc1F Amb24640779 [0,2,0,0,0,0|2,0,0]=4 5360 B12R1.385 Oc1cc(CCCBr)ccc1O Amb25323902 [0,2,0,0,0,0|2,0,0]=4 5361 B12R1.385 Oc1cc(CCCCl)ccc1F Amb25209551 [0,2,0,0,0,0|2,0,0]=4 5362 B12R1.385 Oc1cc(CCCCl)ccc1I Amb24527864 [0,2,0,0,0,0|2,0,0]=4 5363 B12R1.385 Oc1ccc(CCC=O)cc1Cl Amb25150852 [0,2,0,0,0,0|2,0,0]=4 5364 B12R1.385 Oc1ccc(CCC=O)cc1I Amb24758933 [0,2,0,0,0,0|2,0,0]=4 5365 B12R1.385 Oc1ccc(CCCBr)cc1I Amb24598660 [0,2,0,0,0,0|2,0,0]=4 5366 B12R1.385 Oc1ccc(CCCBr)cc1S Amb25351801 [0,2,0,0,0,0|2,0,0]=4 5367 B12R1.385 Oc1ccc(CCCCl)cc1Cl Amb24638403 [0,2,0,0,0,0|2,0,0]=4 5368 B12R1.385 Oc1ccc(CCCO)cc1F Amb24378042 [0,2,0,0,0,0|2,0,0]=4 5369 B12R1.385 Sc1cc(CCCCl)ccc1Cl Amb24610892 [0,2,0,0,0,0|2,0,0]=4 5370 B12R1.385 Sc1cc(CCCCl)ccc1S Amb25223374 [0,2,0,0,0,0|2,0,0]=4 5371 B12R1.385 Sc1ccc(CCCCl)cc1Cl Amb24591066 [0,2,0,0,0,0|2,0,0]=4 5372 B12R1.3 C#CC(CCO)c1ccccc1 Amb25369422 [0,2,0,0,0,0|2,0,0]=4 5373 B12R1.3 C#CC(c1ccccc1)CC#C Amb10072781 [0,2,0,0,0,0|2,0,0]=4 5374 B12R1.3 C#CCC(C=O)c1ccccc1 Amb24741811 [0,2,0,0,0,0|2,0,0]=4 5375 B12R1.3 C=CCC(c1ccccc1)C#N Amb17593937 [0,2,0,0,0,0|2,0,0]=4 5376 B12R1.3 CCCC(CN)c1ccccc1 Amb22052580 [0,2,0,0,0,0|2,0,0]=4 5377 B12R1.3 CCCC(c1ccccc1)C=O Amb17594046 [0,2,0,0,0,0|2,0,0]=4 5378 B12R1.3 CCCC(c1ccccc1)CBr Amb17247626 [0,2,0,0,0,0|2,0,0]=4 5379 B12R1.3 CCCC(c1ccccc1)CCl Amb17233968 [0,2,0,0,0,0|2,0,0]=4 5380 B12R1.3 CCCC(c1ccccc1)CO Amb17232487 [0,2,0,0,0,0|2,0,0]=4 5381 B12R1.3 CCCC(c1ccccc1)NO Amb10605018 [0,2,0,0,0,0|2,0,0]=4 5382 B12R1.3 CNC(CC#C)c1ccccc1 Amb18800161 [0,2,0,0,0,0|2,0,0]=4 5383 B12R1.3 CNC(CC#C)c1ccccc1 Amb19514703 [0,2,0,0,0,0|2,0,0]=4 5384 B12R1.3 CNC(CC#N)c1ccccc1 Amb18997456 [0,2,0,0,0,0|1,0,1]=4 5385 B12R1.3 CNC(CCO)c1ccccc1 Amb18563697 [0,2,0,0,0,0|2,0,0]=4 5386 B12R1.3 CNCC(c1ccccc1)OC Amb17605856 [0,2,0,0,0,0|1,0,0]=3 5387 B12R1.3 COC(CC#N)c1ccccc1 Amb18797978 [0,2,0,0,0,0|1,0,1]=4 5388 B12R1.3 COCC(C#N)c1ccccc1 Amb25728276 [0,2,0,0,0,0|2,0,0]=4 5389 B12R1.3 CSC(CC#N)c1ccccc1 Amb18804687 [0,2,0,0,0,0|1,0,1]=4 5390 B12R1.3 C\C=C(\CCN)/c1ccccc1 Amb25349495 [0,2,0,0,0,0|1,0,1]=4 5391 B12R1.3 N#CC(CCCl)c1ccccc1 Amb18648314 [0,2,0,0,0,0|2,0,0]=4 5392 B12R1.3 NCCC(c1ccccc1)CN Amb1111605 [0,2,0,0,0,0|1,0,0]=3 5393 B12R1.3 NCCC(c1ccccc1)OC Amb17334641 [0,2,0,0,0,0|1,0,0]=3 5394 B12R1.3 NCCC(c1cccnc1)CN Amb17232561 [0,2,0,0,0,0|2,0,0]=4 5395 B12R1.3 NCCN(c1ccccc1)CC Amb1136918 [0,2,0,0,0,0|2,0,0]=4 5396 B12R1.3 NCC\C(=N\N)\c1ccccc1 Amb24427544 [0,2,0,0,0,0|1,0,1]=4 5397 B12R1.3 OCCC(c1ccccc1)C#N Amb17334526 [0,2,0,0,0,0|2,0,0]=4 5398 B12R1.3 OCCC(c1ccccc1)CC Amb17232488 [0,2,0,0,0,0|2,0,0]=4 5399 B12R1.3 [C-]#[N+]C(CCO)c1ccccc1 Amb24431832 [0,2,0,0,0,0|2,0,0]=4 5400 B12R1.17 C#CCC(N)c1cccc(Br)c1 Amb24387869 [0,2,0,0,0,0|2,0,0]=4 5401 B12R1.17 C#CCC(N)c1cccc(Cl)c1 Amb18809278 [0,2,0,0,0,0|2,0,0]=4 5402 B12R1.17 C#CCC(N)c1cccc(F)c1 Amb18959768 [0,2,0,0,0,0|2,0,0]=4 5403 B12R1.17 C#CCC(O)c1cc(O)ccc1 Amb18117926 [0,2,0,0,0,0|2,0,0]=4 5404 B12R1.17 C#CCC(O)c1cccc(Cl)c1 Amb18186757 [0,2,0,0,0,0|2,0,0]=4 5405 B12R1.17 C#CCC(O)c1cccc(F)c1 Amb18800773 [0,2,0,0,0,0|2,0,0]=4 5406 B12R1.17 C#CCC(O)c1cccc(N)c1 Amb24650876 [0,2,0,0,0,0|2,0,0]=4 5407 B12R1.17 C#CC[C@H](O)c1cc(O)ccc1 Amb25767097 [0,2,0,0,0,0|2,0,0]=4 5408 B12R1.17 C#CC[C@H](O)c1cccc(Cl)c1 Amb25788894 [0,2,0,0,0,0|2,0,0]=4 5409 B12R1.17 C=CCC(N)c1cc(N)ccc1 Amb24417276 [0,2,0,0,0,0|2,0,0]=4 5410 B12R1.17 C=CCC(N)c1cccc(Br)c1 Amb18292095 [0,2,0,0,0,0|2,0,0]=4 5411 B12R1.17 C=CCC(N)c1cccc(Cl)c1 Amb18292091 [0,2,0,0,0,0|2,0,0]=4 5412 B12R1.17 C=CCC(N)c1cccc(F)c1 Amb18977587 [0,2,0,0,0,0|2,0,0]=4 5413 B12R1.17 C=CCC(O)c1cc(O)ccc1 Amb18646052 [0,2,0,0,0,0|2,0,0]=4 5414 B12R1.17 C=CCC(O)c1cccc(F)c1 Amb18177817 [0,2,0,0,0,0|2,0,0]=4 5415 B12R1.17 C=CCC(O)c1cccc(N)c1 Amb25674950 [0,2,0,0,0,0|2,0,0]=4 5416 B12R1.17 C=CC[C@@H](N)c1cccc(Br)c1 Amb19929879 [0,2,0,0,0,0|2,0,0]=4 5417 B12R1.17 C=CC[C@@H](N)c1cccc(Br)c1 Amb22831442 [0,2,0,0,0,0|2,0,0]=4 5418 B12R1.17 C=CC[C@@H](N)c1cccc(Cl)c1 Amb22831578 [0,2,0,0,0,0|2,0,0]=4 5419 B12R1.17 C=CC[C@@H](O)c1cc(O)ccc1 Amb25352493 [0,2,0,0,0,0|2,0,0]=4 5420 B12R1.17 C=CC[C@@H](O)c1cccc(Br)c1 Amb24637865 [0,2,0,0,0,0|2,0,0]=4 5421 B12R1.17 C=CC[C@@H](O)c1cccc(S)c1 Amb25706098 [0,2,0,0,0,0|2,0,0]=4 5422 B12R1.17 C=CC[C@H](N)c1cccc(Br)c1 Amb19929880 [0,2,0,0,0,0|2,0,0]=4 5423 B12R1.17 C=CC[C@H](N)c1cccc(Br)c1 Amb25221639 [0,2,0,0,0,0|2,0,0]=4 5424 B12R1.17 C=CC[C@H](N)c1cccc(Cl)c1 Amb25775422 [0,2,0,0,0,0|2,0,0]=4 5425 B12R1.17 C=CC[C@H](N)c1cccc(I)c1 Amb25784765 [0,2,0,0,0,0|2,0,0]=4 5426 B12R1.17 C=CC[C@H](N)c1cccc(O)c1 Amb24487270 [0,2,0,0,0,0|2,0,0]=4 5427 B12R1.17 C=CC[C@H](O)c1cc(O)ccc1 Amb24525136 [0,2,0,0,0,0|2,0,0]=4 5428 B12R1.17 C=CC[C@H](O)c1cccc(Cl)c1 Amb25241128 [0,2,0,0,0,0|2,0,0]=4 5429 B12R1.17 C=CC[C@H](O)c1cccc(F)c1 Amb24524776 [0,2,0,0,0,0|2,0,0]=4 5430 B12R1.17 CC(CC#N)c1cccc(Br)c1 Amb24645330 [0,2,0,0,0,0|1,0,1]=4 5431 B12R1.17 CC(CC#N)c1cccc(F)c1 Amb24732112 [0,2,0,0,0,0|1,0,1]=4 5432 B12R1.17 CC(CC=O)c1cccc(O)c1 Amb25195457 [0,2,0,0,0,0|2,0,0]=4 5433 B12R1.17 CC(CCBr)c1cccc(Cl)c1 Amb25751472 [0,2,0,0,0,0|2,0,0]=4 5434 B12R1.17 CC(CCN)c1c[n]cc(F)c1 Amb25068199 [0,2,0,0,0,0|2,0,0]=4 5435 B12R1.17 CC(\C=N\N)c1cccc(Br)c1 Amb24473846 [0,2,0,0,0,0|0,0,2]=4 5436 B12R1.17 CC(\C=N\N)c1cccc(Cl)c1 Amb25285373 [0,2,0,0,0,0|0,0,2]=4 5437 B12R1.17 CCCC(C)c1cccc(Br)c1 Amb25281341 [0,2,0,0,0,0|2,0,0]=4 5438 B12R1.17 CCCC(N)c1cc(O)ccc1 Amb24379131 [0,2,0,0,0,0|2,0,0]=4 5439 B12R1.17 CCCC(O)c1cc(I)ccc1 Amb25310854 [0,2,0,0,0,0|2,0,0]=4 5440 B12R1.17 CCCC(O)c1cc(N)ccc1 Amb25087129 [0,2,0,0,0,0|2,0,0]=4 5441 B12R1.17 CCCC(O)c1cc(O)ccc1 Amb24706852 [0,2,0,0,0,0|2,0,0]=4 5442 B12R1.17 CCCC(c1cccc(c1)Br)O Amb17248424 [0,2,0,0,0,0|2,0,0]=4 5443 B12R1.17 CCCC(c1cccc(c1)C)N Amb17232449 [0,2,0,0,0,0|2,0,0]=4 5444 B12R1.17 CCCC(c1cccc(c1)C)O Amb17232484 [0,2,0,0,0,0|2,0,0]=4 5445 B12R1.17 CCCC(c1cccc(c1)Cl)N Amb17234050 [0,2,0,0,0,0|2,0,0]=4 5446 B12R1.17 CCCC(c1cccc(c1)Cl)O Amb17234155 [0,2,0,0,0,0|2,0,0]=4 5447 B12R1.17 CCCC(c1cccc(c1)F)N Amb17232649 [0,2,0,0,0,0|2,0,0]=4 5448 B12R1.17 CCCC(c1cccc(c1)F)O Amb17232673 [0,2,0,0,0,0|2,0,0]=4 5449 B12R1.17 CCC[C@@H](N)c1cc(Br)ccc1 Amb25301508 [0,2,0,0,0,0|2,0,0]=4 5450 B12R1.17 CCC[C@@H](N)c1cc(Cl)ccc1 Amb24426769 [0,2,0,0,0,0|2,0,0]=4 5451 B12R1.17 CCC[C@@H](N)c1cc(F)ccc1 Amb25709212 [0,2,0,0,0,0|2,0,0]=4 5452 B12R1.17 CCC[C@@H](N)c1cc(O)ccc1 Amb25328595 [0,2,0,0,0,0|2,0,0]=4 5453 B12R1.17 CCC[C@@H](O)c1cc(Cl)ccc1 Amb25069848 [0,2,0,0,0,0|2,0,0]=4 5454 B12R1.17 CCC[C@H](N)c1cc(Br)ccc1 Amb24400381 [0,2,0,0,0,0|2,0,0]=4 5455 B12R1.17 CCC[C@H](O)c1cc(Br)ccc1 Amb25762439 [0,2,0,0,0,0|2,0,0]=4 5456 B12R1.17 CN(CCN)c1cc(Br)ccc1 Amb24525334 [0,2,0,0,0,0|2,0,0]=4 5457 B12R1.17 CN(CCN)c1cc(O)ccc1 Amb25804629 [0,2,0,0,0,0|2,0,0]=4 5458 B12R1.17 CNCC(=O)c1cccc(Cl)c1 Amb18863066 [0,2,0,0,0,0|1,0,1]=4 5459 B12R1.17 CNCC(=O)c1cccc(F)c1 Amb18862706 [0,2,0,0,0,0|1,0,1]=4 5460 B12R1.17 CNCC(=O)c1cccc(N)c1 Amb18051532 [0,2,0,0,0,0|1,0,1]=4 5461 B12R1.17 CNCC(=O)c1cccc(O)c1 Amb18646278 [0,2,0,0,0,0|1,0,1]=4 5462 B12R1.17 CNCC(=O)c1cccc(c1)Br Amb17315041 [0,2,0,0,0,0|1,0,1]=4 5463 B12R1.17 CNCC(=O)c1cccc(c1)O Amb16231895 [0,2,0,0,0,0|1,0,1]=4 5464 B12R1.17 CNCC(=O)c1cccc(c1)O Amb17619313 [0,2,0,0,0,0|1,0,1]=4 5465 B12R1.17 CNCC(C)c1cccc(O)c1 Amb25804026 [0,2,0,0,0,0|1,0,0]=3 5466 B12R1.17 CNCC(Cl)c1cccc(F)c1 Amb24635680 [0,2,0,0,0,0|1,0,0]=3 5467 B12R1.17 CNCC(O)c1c[n]cc(Br)c1 Amb23586082 [0,2,0,0,0,0|2,0,0]=4 5468 B12R1.17 CNCC(O)c1c[n]cc(F)c1 Amb25787544 [0,2,0,0,0,0|2,0,0]=4 5469 B12R1.17 CNCC(O)c1cccc(F)c1 Amb18289718 [0,2,0,0,0,0|1,0,0]=3 5470 B12R1.17 CNCC(O)c1cccc(I)c1 Amb25121468 [0,2,0,0,0,0|1,0,0]=3 5471 B12R1.17 CNCC(c1cccc(c1)Br)O Amb17142607 [0,2,0,0,0,0|1,0,0]=3 5472 B12R1.17 CNCC(c1cccc(c1)N)O Amb17594135 [0,2,0,0,0,0|1,0,0]=3 5473 B12R1.17 CNC[C@@H](O)c1cc(O)ccc1 Amb19133645 [0,2,0,0,0,0|1,0,0]=3 5474 B12R1.17 CNC[C@@H](O)c1cc(O)ccc1 Amb22799790 [0,2,0,0,0,0|1,0,0]=3 5475 B12R1.17 CNC[C@H](C)c1cccc(O)c1 Amb25774924 [0,2,0,0,0,0|1,0,0]=3 5476 B12R1.17 CNC[C@H](O)c1cc(O)ccc1 Amb22168059 [0,2,0,0,0,0|1,0,0]=3 5477 B12R1.17 CNC[C@H](c1cccc(c1)O)O Amb16231685 [0,2,0,0,0,0|1,0,0]=3 5478 B12R1.17 COCC(F)c1cccc(O)c1 Amb25283248 [0,2,0,0,0,0|2,0,0]=4 5479 B12R1.17 COCC(N)c1cccc(Cl)c1 Amb18983032 [0,2,0,0,0,0|2,0,0]=4 5480 B12R1.17 COCC(N)c1cccc(I)c1 Amb25034579 [0,2,0,0,0,0|2,0,0]=4 5481 B12R1.17 COCC(N)c1cccc(O)c1 Amb24378072 [0,2,0,0,0,0|2,0,0]=4 5482 B12R1.17 COCC(N)c1cccc(S)c1 Amb24428810 [0,2,0,0,0,0|2,0,0]=4 5483 B12R1.17 COCC(O)c1cccc(Cl)c1 Amb19076385 [0,2,0,0,0,0|2,0,0]=4 5484 B12R1.17 COCC(O)c1cccc(F)c1 Amb18793594 [0,2,0,0,0,0|2,0,0]=4 5485 B12R1.17 COCC(c1cccc(c1)N)O Amb13952267 [0,2,0,0,0,0|2,0,0]=4 5486 B12R1.17 COC[C@@H](N)c1cc(N)ccc1 Amb25132108 [0,2,0,0,0,0|2,0,0]=4 5487 B12R1.17 COC[C@@H](N)c1cccc(Br)c1 Amb25669519 [0,2,0,0,0,0|2,0,0]=4 5488 B12R1.17 COC[C@@H](N)c1cccc(Cl)c1 Amb24670292 [0,2,0,0,0,0|2,0,0]=4 5489 B12R1.17 COC[C@@H](N)c1cccc(F)c1 Amb25794807 [0,2,0,0,0,0|2,0,0]=4 5490 B12R1.17 COC[C@@H](N)c1cccc(O)c1 Amb25809467 [0,2,0,0,0,0|2,0,0]=4 5491 B12R1.17 COC[C@H](N)c1cc(N)ccc1 Amb24360714 [0,2,0,0,0,0|2,0,0]=4 5492 B12R1.17 COC[C@H](N)c1cccc(I)c1 Amb25691760 [0,2,0,0,0,0|2,0,0]=4 5493 B12R1.17 CSCC(C)c1cccc(Cl)c1 Amb24525351 [0,2,0,0,0,0|2,0,0]=4 5494 B12R1.17 CSCC(N)c1cccc(Cl)c1 Amb18995356 [0,2,0,0,0,0|2,0,0]=4 5495 B12R1.17 CSCC(N)c1cccc(F)c1 Amb18995351 [0,2,0,0,0,0|2,0,0]=4 5496 B12R1.17 CSCC(O)c1cccc(F)c1 Amb19070007 [0,2,0,0,0,0|2,0,0]=4 5497 B12R1.17 CSCC(O)c1cccc(N)c1 Amb18296181 [0,2,0,0,0,0|2,0,0]=4 5498 B12R1.17 C[C@H](CC=O)c1cccc(Cl)c1 Amb24640335 [0,2,0,0,0,0|2,0,0]=4 5499 B12R1.17 Cc1cc([n]cc1)C(O)CCN Amb24584095 [0,2,0,0,0,0|2,0,0]=4 5500 B12R1.17 Cc1cc(ccc1)C(=O)CCN Amb24700399 [0,2,0,0,0,0|1,0,1]=4 5501 B12R1.17 Cc1cc(ccc1)C(=O)CNC Amb18862586 [0,2,0,0,0,0|1,0,1]=4 5502 B12R1.17 Cc1cc(ccc1)C(Cl)CCO Amb24355343 [0,2,0,0,0,0|2,0,0]=4 5503 B12R1.17 Cc1cc(ccc1)C(F)CCN Amb25043004 [0,2,0,0,0,0|1,0,0]=3 5504 B12R1.17 Cc1cc(ccc1)C(N)CC#C Amb18800160 [0,2,0,0,0,0|2,0,0]=4 5505 B12R1.17 Cc1cc(ccc1)C(N)CC#N Amb18563499 [0,2,0,0,0,0|1,0,1]=4 5506 B12R1.17 Cc1cc(ccc1)C(N)CC=C Amb18977591 [0,2,0,0,0,0|2,0,0]=4 5507 B12R1.17 Cc1cc(ccc1)C(O)CC#C Amb18800364 [0,2,0,0,0,0|2,0,0]=4 5508 B12R1.17 Cc1cc(ccc1)C(O)CC=C Amb18177788 [0,2,0,0,0,0|2,0,0]=4 5509 B12R1.17 Cc1cc(ccc1)C(O)CC=O Amb24366566 [0,2,0,0,0,0|2,0,0]=4 5510 B12R1.17 Cc1cc(ccc1)C(O)CCCl Amb25725000 [0,2,0,0,0,0|2,0,0]=4 5511 B12R1.17 Cc1cc(ccc1)S(=O)CCN Amb18974528 [0,2,0,0,0,0|2,0,0]=4 5512 B12R1.17 Cc1cc(ccc1)[C@@H](N)CC=C Amb25681927 [0,2,0,0,0,0|2,0,0]=4 5513 B12R1.17 Cc1cc(ccc1)[C@@H](N)CCO Amb19888371 [0,2,0,0,0,0|2,0,0]=4 5514 B12R1.17 Cc1cc(ccc1)[C@@H](O)CC#N Amb25092023 [0,2,0,0,0,0|1,0,1]=4 5515 B12R1.17 Cc1cc(ccc1)[C@H](N)CC=C Amb24392927 [0,2,0,0,0,0|2,0,0]=4 5516 B12R1.17 Cc1cc(ccc1)[C@H](N)CCN Amb24612216 [0,2,0,0,0,0|1,0,0]=3 5517 B12R1.17 Cc1cc(ccc1)[C@H](N)CCO Amb19887706 [0,2,0,0,0,0|2,0,0]=4 5518 B12R1.17 Cc1cc(ccc1)[C@H](O)CC#C Amb25157924 [0,2,0,0,0,0|2,0,0]=4 5519 B12R1.17 Cc1cccc(c1)C(C)CNC Amb25069401 [0,2,0,0,0,0|1,0,0]=3 5520 B12R1.17 Cc1cccc(c1)C(N)COC Amb18975558 [0,2,0,0,0,0|2,0,0]=4 5521 B12R1.17 Cc1cccc(c1)C(N)CSC Amb18995349 [0,2,0,0,0,0|2,0,0]=4 5522 B12R1.17 Cc1cccc(c1)C(O)COC Amb18792769 [0,2,0,0,0,0|2,0,0]=4 5523 B12R1.17 Cc1cccc(c1)C(O)CSC Amb19061294 [0,2,0,0,0,0|2,0,0]=4 5524 B12R1.17 Cc1cccc(c1)[C@@H](C)CCO Amb25155793 [0,2,0,0,0,0|2,0,0]=4 5525 B12R1.17 Cc1cccc(c1)[C@@H](N)CCC Amb22746897 [0,2,0,0,0,0|2,0,0]=4 5526 B12R1.17 Cc1cccc(c1)[C@H](N)CCC Amb22298528 [0,2,0,0,0,0|2,0,0]=4 5527 B12R1.17 Cc1cccc(c1)[C@H](N)CCC Amb25328596 [0,2,0,0,0,0|2,0,0]=4 5528 B12R1.17 N#CCC(O)c1cc(O)ccc1 Amb25674244 [0,2,0,0,0,0|1,0,1]=4 5529 B12R1.17 N#CCC(O)c1cccc(Br)c1 Amb25139301 [0,2,0,0,0,0|1,0,1]=4 5530 B12R1.17 N#CCC(c1cccc(c1)C)O Amb1111387 [0,2,0,0,0,0|1,0,1]=4 5531 B12R1.17 N#CCC(c1cccc(c1)Cl)O Amb17233865 [0,2,0,0,0,0|1,0,1]=4 5532 B12R1.17 N#CCC(c1cccc(c1)F)O Amb17232517 [0,2,0,0,0,0|1,0,1]=4 5533 B12R1.17 N#CC[C@@H](O)c1cc(O)ccc1 Amb24492822 [0,2,0,0,0,0|1,0,1]=4 5534 B12R1.17 N#CC[C@@H](O)c1cccc(Cl)c1 Amb24360505 [0,2,0,0,0,0|1,0,1]=4 5535 B12R1.17 N#CC[C@@H](O)c1cccc(F)c1 Amb25721001 [0,2,0,0,0,0|1,0,1]=4 5536 B12R1.17 N#CC[C@H](O)c1cccc(F)c1 Amb25699065 [0,2,0,0,0,0|1,0,1]=4 5537 B12R1.17 NC(CC#N)c1cccc(Br)c1 Amb18068031 [0,2,0,0,0,0|1,0,1]=4 5538 B12R1.17 NC(CC#N)c1cccc(Cl)c1 Amb18564159 [0,2,0,0,0,0|1,0,1]=4 5539 B12R1.17 NC(CC#N)c1cccc(F)c1 Amb18563606 [0,2,0,0,0,0|1,0,1]=4 5540 B12R1.17 NC(CC#N)c1cccc(O)c1 Amb25760250 [0,2,0,0,0,0|1,0,1]=4 5541 B12R1.17 NC(CCO)c1cc(Br)ccc1 Amb18990231 [0,2,0,0,0,0|2,0,0]=4 5542 B12R1.17 NC(CCO)c1cc(O)ccc1 Amb19887678 [0,2,0,0,0,0|2,0,0]=4 5543 B12R1.17 NC(CCO)c1cc(S)ccc1 Amb24655390 [0,2,0,0,0,0|2,0,0]=4 5544 B12R1.17 NCCC(=O)c1cc(Br)ccc1 Amb18121501 [0,2,0,0,0,0|1,0,1]=4 5545 B12R1.17 NCCC(N)c1cc[n]c(Br)c1 Amb24697935 [0,2,0,0,0,0|2,0,0]=4 5546 B12R1.17 NCCC(O)c1cc(Br)ccc1 Amb18121493 [0,2,0,0,0,0|1,0,0]=3 5547 B12R1.17 NCCC(O)c1cc(I)ccc1 Amb24493265 [0,2,0,0,0,0|1,0,0]=3 5548 B12R1.17 NCCC(O)c1cc(O)ccc1 Amb18251885 [0,2,0,0,0,0|1,0,0]=3 5549 B12R1.17 NCCC(c1cccc(c1)C)C Amb17232450 [0,2,0,0,0,0|1,0,0]=3 5550 B12R1.17 NCCC(c1cccc(c1)C)O Amb17232540 [0,2,0,0,0,0|1,0,0]=3 5551 B12R1.17 NCCC(c1cccc(c1)Cl)C Amb17234051 [0,2,0,0,0,0|1,0,0]=3 5552 B12R1.17 NCCC(c1cccc(c1)Cl)O Amb17234260 [0,2,0,0,0,0|1,0,0]=3 5553 B12R1.17 NCCC(c1cccc(c1)F)C Amb17232650 [0,2,0,0,0,0|1,0,0]=3 5554 B12R1.17 NCCC(c1cccc(c1)F)O Amb17232697 [0,2,0,0,0,0|1,0,0]=3 5555 B12R1.17 NCCN(c1cccc(c1)Br)C Amb17059773 [0,2,0,0,0,0|2,0,0]=4 5556 B12R1.17 NCCN(c1cccc(c1)C)C Amb17059641 [0,2,0,0,0,0|2,0,0]=4 5557 B12R1.17 NCCN(c1cccc(c1)Cl)C Amb17059646 [0,2,0,0,0,0|2,0,0]=4 5558 B12R1.17 NCCN(c1cccc(c1)F)C Amb17059643 [0,2,0,0,0,0|2,0,0]=4 5559 B12R1.17 NCCS(=O)c1cc(Br)ccc1 Amb18301434 [0,2,0,0,0,0|2,0,0]=4 5560 B12R1.17 NCCS(=O)c1cc(Cl)ccc1 Amb18299921 [0,2,0,0,0,0|2,0,0]=4 5561 B12R1.17 NCCS(=O)c1cc(F)ccc1 Amb24487393 [0,2,0,0,0,0|2,0,0]=4 5562 B12R1.17 NCC[C@@H](N)c1cccc(Br)c1 Amb25314552 [0,2,0,0,0,0|1,0,0]=3 5563 B12R1.17 NCC[C@@H](N)c1cccc(Cl)c1 Amb25850090 [0,2,0,0,0,0|1,0,0]=3 5564 B12R1.17 NCC[C@@H](N)c1cccc(F)c1 Amb24610239 [0,2,0,0,0,0|1,0,0]=3 5565 B12R1.17 NCC[C@@H](O)c1cc(Cl)ccc1 Amb25105024 [0,2,0,0,0,0|1,0,0]=3 5566 B12R1.17 NCC[C@H](N)c1cccc(Br)[n]1 Amb25302317 [0,2,0,0,0,0|2,0,0]=4 5567 B12R1.17 NCC[C@H](N)c1cccc(F)c1 Amb25230671 [0,2,0,0,0,0|1,0,0]=3 5568 B12R1.17 NNCC(O)c1cccc(F)c1 Amb18563928 [0,2,0,0,0,0|0,0,0]=2 5569 B12R1.17 NNCC(c1cccc(c1)Br)O Amb17249279 [0,2,0,0,0,0|0,0,0]=2 5570 B12R1.17 NNCC(c1cccc(c1)C)O Amb17232609 [0,2,0,0,0,0|0,0,0]=2 5571 B12R1.17 NNCC(c1cccc(c1)Cl)O Amb17234361 [0,2,0,0,0,0|0,0,0]=2 5572 B12R1.17 N[C@@H](CC#N)c1cccc(Cl)c1 Amb24351211 [0,2,0,0,0,0|1,0,1]=4 5573 B12R1.17 N[C@@H](CC#N)c1cccc(O)c1 Amb25820726 [0,2,0,0,0,0|1,0,1]=4 5574 B12R1.17 N[C@@H](CCO)c1cc(Cl)ccc1 Amb19888404 [0,2,0,0,0,0|2,0,0]=4 5575 B12R1.17 N[C@@H](CCO)c1cc(F)ccc1 Amb19888379 [0,2,0,0,0,0|2,0,0]=4 5576 B12R1.17 N[C@@H](CCO)c1cc(O)ccc1 Amb19888375 [0,2,0,0,0,0|2,0,0]=4 5577 B12R1.17 N[C@@H](CCO)c1cc(O)ccc1 Amb19929578 [0,2,0,0,0,0|2,0,0]=4 5578 B12R1.17 N[C@@H](CCO)c1cc(S)ccc1 Amb24745621 [0,2,0,0,0,0|2,0,0]=4 5579 B12R1.17 N[C@H](CC#N)c1cccc(Cl)c1 Amb24573692 [0,2,0,0,0,0|1,0,1]=4 5580 B12R1.17 N[C@H](CC#N)c1cccc(F)c1 Amb24674109 [0,2,0,0,0,0|1,0,1]=4 5581 B12R1.17 N[C@H](CC#N)c1cccc(S)c1 Amb24364680 [0,2,0,0,0,0|1,0,1]=4 5582 B12R1.17 N[C@H](CCO)c1cc(Br)ccc1 Amb19887619 [0,2,0,0,0,0|2,0,0]=4 5583 B12R1.17 N[C@H](CCO)c1cc(Br)ccc1 Amb19943918 [0,2,0,0,0,0|2,0,0]=4 5584 B12R1.17 N[C@H](CCO)c1cc(Cl)ccc1 Amb19887652 [0,2,0,0,0,0|2,0,0]=4 5585 B12R1.17 N[C@H](CCO)c1cc(F)ccc1 Amb19887668 [0,2,0,0,0,0|2,0,0]=4 5586 B12R1.17 N[C@H](CCO)c1cc(F)ccc1 Amb19888995 [0,2,0,0,0,0|2,0,0]=4 5587 B12R1.17 N[C@H](CCO)c1cc(O)ccc1 Amb19887679 [0,2,0,0,0,0|2,0,0]=4 5588 B12R1.17 Nc1cccc(c1)C(N)CCO Amb19929590 [0,2,0,0,0,0|2,0,0]=4 5589 B12R1.17 Nc1cccc(c1)C(N)CCO Amb22235814 [0,2,0,0,0,0|2,0,0]=4 5590 B12R1.17 Nc1cccc(c1)[C@@H](N)CC#N Amb25707936 [0,2,0,0,0,0|1,0,1]=4 5591 B12R1.17 Nc1cccc(c1)[C@H](N)CC#N Amb25360884 [0,2,0,0,0,0|1,0,1]=4 5592 B12R1.17 Nc1cccc(c1)[C@H](N)CCO Amb19887593 [0,2,0,0,0,0|2,0,0]=4 5593 B12R1.17 OC(CC=O)c1cccc(Br)c1 Amb25258748 [0,2,0,0,0,0|2,0,0]=4 5594 B12R1.17 OCCC(Cl)c1cc(F)ccc1 Amb24444966 [0,2,0,0,0,0|2,0,0]=4 5595 B12R1.17 OCCC(O)c1cccc(Br)c1 Amb24513513 [0,2,0,0,0,0|2,0,0]=4 5596 B12R1.17 OCCC(O)c1cccc(F)c1 Amb24406026 [0,2,0,0,0,0|2,0,0]=4 5597 B12R1.17 OCCC(c1cccc(c1)C)C Amb17232501 [0,2,0,0,0,0|2,0,0]=4 5598 B12R1.17 OCCC(c1cccc(c1)C)N Amb17103954 [0,2,0,0,0,0|2,0,0]=4 5599 B12R1.17 OCCC(c1cccc(c1)Cl)C Amb17234166 [0,2,0,0,0,0|2,0,0]=4 5600 B12R1.17 OCCC(c1cccc(c1)Cl)N Amb2417047 [0,2,0,0,0,0|2,0,0]=4 5601 B12R1.17 OCCC(c1cccc(c1)F)C Amb17232674 [0,2,0,0,0,0|2,0,0]=4 5602 B12R1.17 OCC[C@@H](O)c1cccc(Cl)c1 Amb25049479 [0,2,0,0,0,0|2,0,0]=4 5603 B12R1.17 OCC[C@@H](O)c1cccc(F)c1 Amb24405405 [0,2,0,0,0,0|2,0,0]=4 5604 B12R1.17 ONCC(c1cccc(c1)Br)O Amb17345006 [0,2,0,0,0,0|1,0,0]=3 5605 B12R1.17 ONCC(c1cccc(c1)C)O Amb17334703 [0,2,0,0,0,0|1,0,0]=3 5606 B12R1.17 ONCC(c1cccc(c1)Cl)O Amb17335948 [0,2,0,0,0,0|1,0,0]=3 5607 B12R1.17 ONCC(c1cccc(c1)O)O Amb17334759 [0,2,0,0,0,0|1,0,0]=3 5608 B12R1.17 O[C@@H](CCCl)c1cc(Cl)ccc1 Amb24655785 [0,2,0,0,0,0|2,0,0]=4 5609 B12R1.17 Oc1cccc(c1)C(O)CCO Amb24430894 [0,2,0,0,0,0|2,0,0]=4 5610 B12R1.17 Oc1cccc(c1)[C@@H](O)CCO Amb24686857 [0,2,0,0,0,0|2,0,0]=4 5611 B12R1.17 Oc1cccc(c1)[C@H](O)CCO Amb25797566 [0,2,0,0,0,0|2,0,0]=4 5612 B12R1.30 BrCCCC(=O)c1ccccc1 Amb17247624 [0,2,0,0,0,0|2,0,0]=4 5613 B12R1.30 C#CCCC(Cl)c1ccccc1 Amb25756186 [0,2,0,0,0,0|2,0,0]=4 5614 B12R1.30 C#CCCC(O)c1ccccc1 Amb18800360 [0,2,0,0,0,0|2,0,0]=4 5615 B12R1.30 C=C(CNC=S)c1ccccc1 Amb25742952 [0,2,0,0,0,0|1,0,1]=4 5616 B12R1.30 C=C=CCC(Cl)c1ccccc1 Amb25700989 [0,2,0,0,0,0|2,0,0]=4 5617 B12R1.30 C=CCCC(N)c1ccccc1 Amb18126305 [0,2,0,0,0,0|2,0,0]=4 5618 B12R1.30 C=CCCN(c1ccccc1)C Amb10559130 [0,2,0,0,0,0|2,0,0]=4 5619 B12R1.30 CC#CCC(N)c1ccccc1 Amb18988278 [0,2,0,0,0,0|2,0,0]=4 5620 B12R1.30 CC#CCC(O)c1ccccc1 Amb18797803 [0,2,0,0,0,0|2,0,0]=4 5621 B12R1.30 CC#CC[C@H](N)c1ccccc1 Amb25055199 [0,2,0,0,0,0|2,0,0]=4 5622 B12R1.30 CC(CCC=C)c1ccccc1 Amb24062989 [0,2,0,0,0,0|2,0,0]=4 5623 B12R1.30 CC(CCCN)c1ccccc1 Amb18563593 [0,2,0,0,0,0|1,0,0]=3 5624 B12R1.30 CC(CN=C=S)c1ccccc1 Amb25102676 [0,2,0,0,0,0|1,0,1]=4 5625 B12R1.30 CC(CNC#N)c1ccccc1 Amb24419584 [0,2,0,0,0,0|0,0,1]=3 5626 B12R1.30 CC(C\C=N\N)c1ccccc1 Amb24685554 [0,2,0,0,0,0|0,0,1]=3 5627 B12R1.30 CC(OCCO)c1ccccc1 Amb24103429 [0,2,0,0,0,0|2,0,0]=4 5628 B12R1.30 CC(SCC#C)c1ccccc1 Amb25763673 [0,2,0,0,0,0|2,0,0]=4 5629 B12R1.30 CC(\C=C\CN)c1ccccc1 Amb24702766 [0,2,0,0,0,0|1,0,1]=4 5630 B12R1.30 CC(c1ccccc1)SCC#N Amb17501742 [0,2,0,0,0,0|1,0,1]=4 5631 B12R1.30 CC=CCC(C)c1ccccc1 Amb24062990 [0,2,0,0,0,0|2,0,0]=4 5632 B12R1.30 CCCCN(c1ccccc1)N Amb17226670 [0,2,0,0,0,0|2,0,0]=4 5633 B12R1.30 CCCNC(c1ccccc1)C Amb1833463 [0,2,0,0,0,0|2,0,0]=4 5634 B12R1.30 CCNCC(N)c1ccccc1 Amb19009737 [0,2,0,0,0,0|1,0,0]=3 5635 B12R1.30 CCNCC(O)c1ccccc1 Amb22491734 [0,2,0,0,0,0|1,0,0]=3 5636 B12R1.30 CCNCC(c1ccccc1)C Amb2119469 [0,2,0,0,0,0|1,0,0]=3 5637 B12R1.30 CCNCC(c1ccccn1)O Amb17138608 [0,2,0,0,0,0|2,0,0]=4 5638 B12R1.30 CCNCC(c1cccnc1)O Amb17138609 [0,2,0,0,0,0|2,0,0]=4 5639 B12R1.30 CCNCC(c1ccncc1)O Amb17138610 [0,2,0,0,0,0|2,0,0]=4 5640 B12R1.30 CCOC[C@H](c1ccccc1)N Amb17061646 [0,2,0,0,0,0|2,0,0]=4 5641 B12R1.30 CN(c1ccccc1)CCC#C Amb10559135 [0,2,0,0,0,0|2,0,0]=4 5642 B12R1.30 CNCCC(=O)c1ccccc1 Amb11032366 [0,2,0,0,0,0|1,0,0]=3 5643 B12R1.30 CNCC[C@@H](O)c1ccccc1 Amb20240620 [0,2,0,0,0,0|1,0,0]=3 5644 B12R1.30 CNCC[C@@H](O)c1ccccc1 Amb22747753 [0,2,0,0,0,0|1,0,0]=3 5645 B12R1.30 CN\N=C\C(C)c1ccccc1 Amb24476432 [0,2,0,0,0,0|0,0,2]=4 5646 B12R1.30 COCCC(=O)c1ccccc1 Amb10602329 [0,2,0,0,0,0|2,0,0]=4 5647 B12R1.30 COCCC(O)c1ccccc1 Amb18788453 [0,2,0,0,0,0|2,0,0]=4 5648 B12R1.30 C[C@@H](CN=C=S)c1ccccc1 Amb19892937 [0,2,0,0,0,0|1,0,1]=4 5649 B12R1.30 C[C@@H](OCC=O)c1ccccc1 Amb22896802 [0,2,0,0,0,0|2,0,0]=4 5650 B12R1.30 C[C@H](CN=C=S)c1ccccc1 Amb19892936 [0,2,0,0,0,0|1,0,1]=4 5651 B12R1.30 C[C@H]([NH2+]CCCl)c1ccccc1 Amb17773001 [0,2,0,0,0,0|2,0,0]=4 5652 B12R1.30 C\C(=C/CNC)\c1ccccc1 Amb23555664 [0,2,0,0,0,0|1,0,1]=4 5653 B12R1.30 C\C=N\CC(O)c1ccccc1 Amb25256333 [0,2,0,0,0,0|1,0,1]=4 5654 B12R1.30 ClCCCC(=O)c1ccccc1 Amb1229841 [0,2,0,0,0,0|2,0,0]=4 5655 B12R1.30 ClCCCC(c1ccccc1)O Amb17194564 [0,2,0,0,0,0|2,0,0]=4 5656 B12R1.30 ClCCCN(c1ccccc1)C Amb17335669 [0,2,0,0,0,0|2,0,0]=4 5657 B12R1.30 ClCCNC(c1ccccc1)C Amb10069614 [0,2,0,0,0,0|2,0,0]=4 5658 B12R1.30 ClCCNC(c1ccccc1)C Amb17335659 [0,2,0,0,0,0|2,0,0]=4 5659 B12R1.30 N#CCCC(=O)c1ccccc1 Amb1672449 [0,2,0,0,0,0|1,0,1]=4 5660 B12R1.30 N#CCCC(Cl)c1ccccc1 Amb18648313 [0,2,0,0,0,0|1,0,1]=4 5661 B12R1.30 N#CCCS(=O)c1ccccc1 Amb18648265 [0,2,0,0,0,0|1,0,1]=4 5662 B12R1.30 N#CCC[C@H](O)c1ccccc1 Amb24466214 [0,2,0,0,0,0|1,0,1]=4 5663 B12R1.30 N#CNCC(O)c1ccccc1 Amb18800628 [0,2,0,0,0,0|0,0,1]=3 5664 B12R1.30 NCCCC(=O)c1ccc[n]c1 Amb18120064 [0,2,0,0,0,0|2,0,0]=4 5665 B12R1.30 NCCCC(=O)c1ccc[n]c1 Amb22831532 [0,2,0,0,0,0|2,0,0]=4 5666 B12R1.30 NCCCC(=O)c1ccccc1 Amb18623671 [0,2,0,0,0,0|1,0,0]=3 5667 B12R1.30 NCCCC(=O)c1cccnc1 Amb10602572 [0,2,0,0,0,0|2,0,0]=4 5668 B12R1.30 NCCCC(=O)c1cccnc1 Amb17608288 [0,2,0,0,0,0|2,0,0]=4 5669 B12R1.30 NCCCC(O)c1cc[n]cc1 Amb18563731 [0,2,0,0,0,0|2,0,0]=4 5670 B12R1.30 NCCCC(O)c1cccc[n]1 Amb18563728 [0,2,0,0,0,0|2,0,0]=4 5671 B12R1.30 NCCCC(O)c1ccccc1 Amb21984517 [0,2,0,0,0,0|1,0,0]=3 5672 B12R1.30 NCCCC(c1ccccc1)O Amb17079154 [0,2,0,0,0,0|1,0,0]=3 5673 B12R1.30 NCCCC(c1ccccn1)N Amb10070102 [0,2,0,0,0,0|2,0,0]=4 5674 B12R1.30 NCCCC(c1cccnc1)N Amb10070101 [0,2,0,0,0,0|2,0,0]=4 5675 B12R1.30 NCCCC(c1cccnc1)O Amb17232606 [0,2,0,0,0,0|2,0,0]=4 5676 B12R1.30 NCCCC(c1ccncc1)N Amb10070100 [0,2,0,0,0,0|2,0,0]=4 5677 B12R1.30 NCCNC(c1ccccc1)C Amb17091024 [0,2,0,0,0,0|1,0,0]=3 5678 B12R1.30 NCCOC(=O)c1ccccc1 Amb10807731 [0,2,0,0,0,0|1,0,1]=4 5679 B12R1.30 NCCSC(=O)c1ccccc1 Amb21618899 [0,2,0,0,0,0|1,0,1]=4 5680 B12R1.30 NCCSC(c1ccccc1)C Amb17500453 [0,2,0,0,0,0|1,0,0]=3 5681 B12R1.30 NCC\C=C(\c1ccccc1)/C Amb17232384 [0,2,0,0,0,0|1,0,1]=4 5682 B12R1.30 NOCCN(c1ccccc1)C Amb17104857 [0,2,0,0,0,0|1,0,0]=3 5683 B12R1.30 N[C@@H](CCCO)c1ccccc1 Amb23440411 [0,2,0,0,0,0|2,0,0]=4 5684 B12R1.30 O=C(CNC=O)c1ccccc1 Amb20075907 [0,2,0,0,0,0|1,0,1]=4 5685 B12R1.30 O=C=NCC(Cl)c1ccccc1 Amb24692969 [0,2,0,0,0,0|1,0,1]=4 5686 B12R1.30 OC(CNC=O)c1ccccc1 Amb18792635 [0,2,0,0,0,0|1,0,0]=3 5687 B12R1.30 OC(C\C=C/Cl)c1ccccc1 Amb25109311 [0,2,0,0,0,0|2,0,0]=4 5688 B12R1.30 OC(c1ccccc1)CCC#N Amb17232364 [0,2,0,0,0,0|1,0,1]=4 5689 B12R1.30 OCCCC(=O)c1ccccc1 Amb17334609 [0,2,0,0,0,0|2,0,0]=4 5690 B12R1.30 OCCCC(c1ccccc1)O Amb17334675 [0,2,0,0,0,0|2,0,0]=4 5691 B12R1.30 OCCNC(c1ccccc1)C Amb2092663 [0,2,0,0,0,0|2,0,0]=4 5692 B12R1.30 O[C@H](C\C=C/Cl)c1ccccc1 Amb25751194 [0,2,0,0,0,0|2,0,0]=4 5693 B12R1.30 O\N=C\CC(O)c1ccccc1 Amb25156836 [0,2,0,0,0,0|1,0,1]=4 5694 B12R1.30 [C-]#[N+]CCC(F)c1ccccc1 Amb25217234 [0,2,0,0,0,0|1,0,1]=4 5695 B12R1.30 [N-]=[N+]=NCC(Cl)c1ccccc1 Amb25276328 [0,2,0,0,0,0|0,0,2]=4 5696 B12R1.30 [N-]=[N+]=NCC(N)c1ccccc1 Amb25694755 [0,2,0,0,0,0|0,0,2]=4 5697 B12R1.30 [N-]=[N+]=NCC(O)c1ccccc1 Amb18792465 [0,2,0,0,0,0|0,0,2]=4 5698 B12R1.30 [N-]=[N+]=NC[C@@H](N)c1ccccc1 Amb24398753 [0,2,0,0,0,0|0,0,2]=4 5699 B12R1.30 [N-]=[N+]=NC[C@H](O)c1ccccc1 Amb25102649 [0,2,0,0,0,0|0,0,2]=4 5700 B12R1.34 BrCC(Br)C(Br)c1ccccc1 Amb25114235 [0,2,0,0,0,0|2,0,0]=4 5701 B12R1.34 C#CC(F)C(O)c1ccccc1 Amb25129675 [0,2,0,0,0,0|2,0,0]=4 5702 B12R1.34 C#C[C@@H](O)[C@@H](O)c1ccccc1 Amb25138509 [0,2,0,0,0,0|2,0,0]=4 5703 B12R1.34 C#C[C@H](F)[C@@H](O)c1ccccc1 Amb24733476 [0,2,0,0,0,0|2,0,0]=4 5704 B12R1.34 C#C[C@H](O)[C@@H](O)c1ccccc1 Amb24748425 [0,2,0,0,0,0|2,0,0]=4 5705 B12R1.34 C=CC(C(c1ccccc1)O)C Amb10567365 [0,2,0,0,0,0|2,0,0]=4 5706 B12R1.34 C=CC(Cl)C(O)c1ccccc1 Amb24374608 [0,2,0,0,0,0|2,0,0]=4 5707 B12R1.34 C=CC(N)C(O)c1ccccc1 Amb24106047 [0,2,0,0,0,0|2,0,0]=4 5708 B12R1.34 C=CC(O)C(N)c1ccccc1 Amb22831164 [0,2,0,0,0,0|2,0,0]=4 5709 B12R1.34 C=CC(O)C(O)c1ccccc1 Amb24704468 [0,2,0,0,0,0|2,0,0]=4 5710 B12R1.34 C=CC(O)[C@H](N)c1ccccc1 Amb24468873 [0,2,0,0,0,0|2,0,0]=4 5711 B12R1.34 C=C[C@@H](N)[C@H](O)c1ccccc1 Amb24386492 [0,2,0,0,0,0|2,0,0]=4 5712 B12R1.34 C=C[C@@H](O)[C@@H](N)c1ccccc1 Amb25375938 [0,2,0,0,0,0|2,0,0]=4 5713 B12R1.34 C=C[C@@H](O)[C@@H](O)c1ccccc1 Amb25279737 [0,2,0,0,0,0|2,0,0]=4 5714 B12R1.34 C=C[C@H](Cl)[C@@H](O)c1ccccc1 Amb25241929 [0,2,0,0,0,0|2,0,0]=4 5715 B12R1.34 C=C[C@H](N)[C@@H](N)c1ccccc1 Amb25758971 [0,2,0,0,0,0|2,0,0]=4 5716 B12R1.34 C=C[C@H](O)[C@@H](O)c1ccccc1 Amb25859224 [0,2,0,0,0,0|2,0,0]=4 5717 B12R1.34 C=C[C@H](O)[C@H](O)c1ccccc1 Amb25058473 [0,2,0,0,0,0|2,0,0]=4 5718 B12R1.34 CC(C#C)C(O)c1ccccc1 Amb25145323 [0,2,0,0,0,0|2,0,0]=4 5719 B12R1.34 CC(C(=O)CN)c1ccccc1 Amb24535411 [0,2,0,0,0,0|1,0,1]=4 5720 B12R1.34 CC(C(=O)NN)c1ccc[n]c1 Amb25163409 [0,2,0,0,0,0|1,0,1]=4 5721 B12R1.34 CC(C(=O)NN)c1cccc[n]1 Amb25045003 [0,2,0,0,0,0|1,0,1]=4 5722 B12R1.34 CC(C(=O)NO)c1ccccc1 Amb25800798 [0,2,0,0,0,0|1,0,1]=4 5723 B12R1.34 CC(C(Br)CC)c1ccccc1 Amb25805104 [0,2,0,0,0,0|2,0,0]=4 5724 B12R1.34 CC(C(C)C=O)c1ccccc1 Amb24065337 [0,2,0,0,0,0|2,0,0]=4 5725 B12R1.34 CC(C(C)CN)c1c[n]ccc1 Amb18828712 [0,2,0,0,0,0|2,0,0]=4 5726 B12R1.34 CC(C(C)CN)c1ccccc1 Amb18829124 [0,2,0,0,0,0|1,0,0]=3 5727 B12R1.34 CC(C(C)NN)c1ccccc1 Amb24488638 [0,2,0,0,0,0|0,0,0]=2 5728 B12R1.34 CC(C(Cl)C#N)c1ccccc1 Amb18791080 [0,2,0,0,0,0|1,0,1]=4 5729 B12R1.34 CC(C(Cl)C=O)c1ccccc1 Amb18648719 [0,2,0,0,0,0|2,0,0]=4 5730 B12R1.34 CC(C(F)CO)c1ccccc1 Amb25316277 [0,2,0,0,0,0|2,0,0]=4 5731 B12R1.34 CC(C(N)C#C)c1ccccc1 Amb25159878 [0,2,0,0,0,0|2,0,0]=4 5732 B12R1.34 CC(C(N)C#N)c1ccccc1 Amb18953074 [0,2,0,0,0,0|1,0,1]=4 5733 B12R1.34 CC(C(N)CC)c1ccccc1 Amb18829127 [0,2,0,0,0,0|2,0,0]=4 5734 B12R1.34 CC(C(N)CC)c1ccccc1 Amb20623710 [0,2,0,0,0,0|2,0,0]=4 5735 B12R1.34 CC(C(N)CN)c1ccccc1 Amb18972125 [0,2,0,0,0,0|1,0,0]=3 5736 B12R1.34 CC(C(N)CO)c1ccccc1 Amb18975503 [0,2,0,0,0,0|2,0,0]=4 5737 B12R1.34 CC(C(N)CO)c1ccccc1 Amb19349648 [0,2,0,0,0,0|2,0,0]=4 5738 B12R1.34 CC(C(O)C#C)c1ccccc1 Amb25700248 [0,2,0,0,0,0|2,0,0]=4 5739 B12R1.34 CC(C(O)C#N)c1ccccc1 Amb18788076 [0,2,0,0,0,0|1,0,1]=4 5740 B12R1.34 CC(C(O)C=C)c1ccccc1 Amb25310831 [0,2,0,0,0,0|2,0,0]=4 5741 B12R1.34 CC(CC)C(Br)c1ccccc1 Amb24618999 [0,2,0,0,0,0|2,0,0]=4 5742 B12R1.34 CC(CC)C(Cl)c1ccccc1 Amb19057046 [0,2,0,0,0,0|2,0,0]=4 5743 B12R1.34 CC(CC)C(O)c1ccccc1 Amb18792585 [0,2,0,0,0,0|2,0,0]=4 5744 B12R1.34 CC(CC)[C@@H](N)c1ccccc1 Amb23438852 [0,2,0,0,0,0|2,0,0]=4 5745 B12R1.34 CC(CC)[C@@H](O)c1ccccc1 Amb25158043 [0,2,0,0,0,0|2,0,0]=4 5746 B12R1.34 CC(CN)C(=O)c1ccccc1 Amb18829249 [0,2,0,0,0,0|1,0,1]=4 5747 B12R1.34 CC(CN)C(O)c1ccc[n]c1 Amb25762523 [0,2,0,0,0,0|2,0,0]=4 5748 B12R1.34 CC(CN)C(O)c1cccc[n]1 Amb25380785 [0,2,0,0,0,0|2,0,0]=4 5749 B12R1.34 CC(CN)C(O)c1ccccc1 Amb18646366 [0,2,0,0,0,0|1,0,0]=3 5750 B12R1.34 CC(CN)S(=O)c1ccccc1 Amb24469474 [0,2,0,0,0,0|2,0,0]=4 5751 B12R1.34 CC(CO)C(N)c1ccccc1 Amb18646383 [0,2,0,0,0,0|2,0,0]=4 5752 B12R1.34 CC(CO)C(O)c1ccccc1 Amb25220934 [0,2,0,0,0,0|2,0,0]=4 5753 B12R1.34 CC(CO)[C@@H](O)c1ccccc1 Amb25832639 [0,2,0,0,0,0|2,0,0]=4 5754 B12R1.34 CC(NC)C(N)c1ccccc1 Amb24652517 [0,2,0,0,0,0|1,0,0]=3 5755 B12R1.34 CC(NC)C(O)c1c[n]ccc1 Amb24728174 [0,2,0,0,0,0|2,0,0]=4 5756 B12R1.34 CC(NC)C(O)c1ccccc1 Amb20246611 [0,2,0,0,0,0|1,0,0]=3 5757 B12R1.34 CC(NC)C(O)c1ccccc1 Amb22489693 [0,2,0,0,0,0|1,0,0]=3 5758 B12R1.34 CC(NC)C(O)c1ccccc1 Amb22729748 [0,2,0,0,0,0|1,0,0]=3 5759 B12R1.34 CC(NO)C(=O)c1ccccc1 Amb25130640 [0,2,0,0,0,0|1,0,1]=4 5760 B12R1.34 CC(OC)C(Cl)c1ccccc1 Amb24391584 [0,2,0,0,0,0|2,0,0]=4 5761 B12R1.34 CC(OC)C(O)c1ccccc1 Amb18801037 [0,2,0,0,0,0|2,0,0]=4 5762 B12R1.34 CC(SC)C(N)c1ccccc1 Amb18648548 [0,2,0,0,0,0|2,0,0]=4 5763 B12R1.34 CC(SC)[C@H](O)c1ccccc1 Amb24648340 [0,2,0,0,0,0|2,0,0]=4 5764 B12R1.34 CC([NH2+]C)C(O)c1ccccc1 Amb22334155 [0,2,0,0,0,0|1,0,1]=4 5765 B12R1.34 CC(c1ccccc1)\C(\N)=N\N Amb25159879 [0,2,0,0,0,0|0,0,2]=4 5766 B12R1.34 CCC(Cl)C(Cl)c1ccccc1 Amb25039087 [0,2,0,0,0,0|2,0,0]=4 5767 B12R1.34 CCC(F)C(O)c1ccccc1 Amb25158096 [0,2,0,0,0,0|2,0,0]=4 5768 B12R1.34 CCC(N)C(N)c1ccccc1 Amb25765179 [0,2,0,0,0,0|2,0,0]=4 5769 B12R1.34 CCC(N)C(O)c1ccccc1 Amb19373101 [0,2,0,0,0,0|2,0,0]=4 5770 B12R1.34 CC[C@@H](N)[C@@H](N)c1ccccc1 Amb25151083 [0,2,0,0,0,0|2,0,0]=4 5771 B12R1.34 CC[C@@H](N)[C@H](O)c1ccccc1 Amb25793544 [0,2,0,0,0,0|2,0,0]=4 5772 B12R1.34 CC[C@@H](O)[C@@H](N)c1ccccc1 Amb25760697 [0,2,0,0,0,0|2,0,0]=4 5773 B12R1.34 CC[C@@H](O)[C@H](N)c1ccccc1 Amb25301206 [0,2,0,0,0,0|2,0,0]=4 5774 B12R1.34 CC[C@H](N)[C@@H](O)c1ccccc1 Amb24677748 [0,2,0,0,0,0|2,0,0]=4 5775 B12R1.34 CC[C@H](O)[C@@H](O)c1ccccc1 Amb25280169 [0,2,0,0,0,0|2,0,0]=4 5776 B12R1.34 CN(C(=S)NN)c1ccccc1 Amb18564176 [0,2,0,0,0,0|1,0,1]=4 5777 B12R1.34 CNC(=O)C(c1ccccc1)N Amb10609276 [0,2,0,0,0,0|1,0,1]=4 5778 B12R1.34 CNC(=O)C(c1ccccc1)O Amb17400179 [0,2,0,0,0,0|1,0,1]=4 5779 B12R1.34 CNC(=O)[C@@H](C)c1ccccc1 Amb24682080 [0,2,0,0,0,0|1,0,1]=4 5780 B12R1.34 CNC(=O)[C@H](C)c1ccccc1 Amb25277288 [0,2,0,0,0,0|1,0,1]=4 5781 B12R1.34 CNC(=O)[C@H](N)c1ccccc1 Amb24678684 [0,2,0,0,0,0|1,0,1]=4 5782 B12R1.34 CNC(=O)[C@H](O)c1ccccc1 Amb25792321 [0,2,0,0,0,0|1,0,1]=4 5783 B12R1.34 CNC(=O)[C@H](c1ccccc1)N Amb17232478 [0,2,0,0,0,0|1,0,1]=4 5784 B12R1.34 CNC(=S)C(C)c1ccccc1 Amb24756688 [0,2,0,0,0,0|1,0,1]=4 5785 B12R1.34 CNC(=S)[C@@H](C)c1ccccc1 Amb24383001 [0,2,0,0,0,0|1,0,1]=4 5786 B12R1.34 CNC(C(=O)c1ccccc1)C Amb17616803 [0,2,0,0,0,0|1,0,1]=4 5787 B12R1.34 CNC(C(c1ccccc1)Cl)C Amb17594731 [0,2,0,0,0,0|1,0,0]=3 5788 B12R1.34 CNC(C)C(C)c1cc[n]cc1 Amb24366596 [0,2,0,0,0,0|2,0,0]=4 5789 B12R1.34 CNC(C)C(C)c1cccc[n]1 Amb25751315 [0,2,0,0,0,0|2,0,0]=4 5790 B12R1.34 CNC(C)C(C)c1ccccc1 Amb18645936 [0,2,0,0,0,0|1,0,0]=3 5791 B12R1.34 CN[C@@H](C)C(=C)c1ccccc1 Amb24758988 [0,2,0,0,0,0|1,0,1]=4 5792 B12R1.34 CN[C@@H](C)C(=O)c1ccccc1 Amb25312230 [0,2,0,0,0,0|1,0,1]=4 5793 B12R1.34 CN[C@@H](C)[C@@H](C)c1ccccc1 Amb25674163 [0,2,0,0,0,0|1,0,0]=3 5794 B12R1.34 CN[C@@H]([C@H](c1ccccc1)O)C Amb17613676 [0,2,0,0,0,0|1,0,0]=3 5795 B12R1.34 CN[C@H](C)C(=C)c1ccccc1 Amb24697574 [0,2,0,0,0,0|1,0,1]=4 5796 B12R1.34 CN[C@H](C)[C@@H](C)c1ccccc1 Amb24373827 [0,2,0,0,0,0|1,0,0]=3 5797 B12R1.34 COC(C(c1ccccc1)N)C Amb1139088 [0,2,0,0,0,0|2,0,0]=4 5798 B12R1.34 COC(Cl)C(Cl)c1ccccc1 Amb24539299 [0,2,0,0,0,0|2,0,0]=4 5799 B12R1.34 COC(O)C(N)c1ccccc1 Amb24599253 [0,2,0,0,0,0|2,0,0]=4 5800 B12R1.34 CO[C@H](N)[C@@H](O)c1ccccc1 Amb25322160 [0,2,0,0,0,0|2,0,0]=4 5801 B12R1.34 C[C@@H](C(=O)NN)c1ccccc1 Amb25361548 [0,2,0,0,0,0|0,0,1]=3 5802 B12R1.34 C[C@@H](C(=O)NO)c1ccccc1 Amb24722255 [0,2,0,0,0,0|1,0,1]=4 5803 B12R1.34 C[C@@H](C=C)[C@@H](N)c1ccccc1 Amb25837307 [0,2,0,0,0,0|2,0,0]=4 5804 B12R1.34 C[C@@H](C=C)[C@@H](O)c1ccccc1 Amb25071531 [0,2,0,0,0,0|2,0,0]=4 5805 B12R1.34 C[C@@H](C=C)[C@H](N)c1ccccc1 Amb25053412 [0,2,0,0,0,0|2,0,0]=4 5806 B12R1.34 C[C@@H](C=C)[C@H](O)c1ccccc1 Amb25347648 [0,2,0,0,0,0|2,0,0]=4 5807 B12R1.34 C[C@@H](C=O)C(O)c1ccccc1 Amb24341884 [0,2,0,0,0,0|2,0,0]=4 5808 B12R1.34 C[C@@H](C=O)[C@H](O)c1ccccc1 Amb25780663 [0,2,0,0,0,0|2,0,0]=4 5809 B12R1.34 C[C@@H](CN)[C@@H](N)c1ccccc1 Amb25738664 [0,2,0,0,0,0|1,0,0]=3 5810 B12R1.34 C[C@@H](CN)[C@@H](O)c1ccccc1 Amb24711275 [0,2,0,0,0,0|1,0,0]=3 5811 B12R1.34 C[C@@H](CO)C(O)c1ccccc1 Amb25769383 [0,2,0,0,0,0|2,0,0]=4 5812 B12R1.34 C[C@@H](CO)[C@@H](N)c1ccccc1 Amb25152441 [0,2,0,0,0,0|2,0,0]=4 5813 B12R1.34 C[C@@H](CO)[C@@H](O)c1ccccc1 Amb24497744 [0,2,0,0,0,0|2,0,0]=4 5814 B12R1.34 C[C@@H](CO)[C@H](N)c1ccccc1 Amb25320937 [0,2,0,0,0,0|2,0,0]=4 5815 B12R1.34 C[C@@H](CO)[C@H](O)c1ccccc1 Amb24412993 [0,2,0,0,0,0|2,0,0]=4 5816 B12R1.34 C[C@@H](NC)C(Cl)c1ccccc1 Amb25366190 [0,2,0,0,0,0|1,0,0]=3 5817 B12R1.34 C[C@@H](NC)C(O)c1ccccc1 Amb25095866 [0,2,0,0,0,0|1,0,0]=3 5818 B12R1.34 C[C@@H](NC)[C@@H](O)c1ccccc1 Amb22366967 [0,2,0,0,0,0|1,0,0]=3 5819 B12R1.34 C[C@@H](NC)[C@@H](S)c1ccccc1 Amb25302304 [0,2,0,0,0,0|1,0,0]=3 5820 B12R1.34 C[C@@H](NC)[C@H](F)c1ccccc1 Amb24367049 [0,2,0,0,0,0|1,0,0]=3 5821 B12R1.34 C[C@@H](NC)[C@H](O)c1ccccc1 Amb19133732 [0,2,0,0,0,0|1,0,0]=3 5822 B12R1.34 C[C@@H](OC)[C@@H](Cl)c1ccccc1 Amb25751354 [0,2,0,0,0,0|2,0,0]=4 5823 B12R1.34 C[C@@H](OC)[C@@H](O)c1ccccc1 Amb24464720 [0,2,0,0,0,0|2,0,0]=4 5824 B12R1.34 C[C@@H](SC)[C@@H](O)c1ccccc1 Amb25106008 [0,2,0,0,0,0|2,0,0]=4 5825 B12R1.34 C[C@@H]([C@@H](Cl)C=O)c1ccccc1 Amb24634357 [0,2,0,0,0,0|2,0,0]=4 5826 B12R1.34 C[C@@H]([C@@H](F)CO)c1ccccc1 Amb24362837 [0,2,0,0,0,0|2,0,0]=4 5827 B12R1.34 C[C@@H]([C@@H](O)C#N)c1ccccc1 Amb25099408 [0,2,0,0,0,0|1,0,1]=4 5828 B12R1.34 C[C@@H]([C@@H](O)CF)c1ccccc1 Amb24372036 [0,2,0,0,0,0|2,0,0]=4 5829 B12R1.34 C[C@@H]([C@@H](O)CO)c1ccccc1 Amb24662545 [0,2,0,0,0,0|2,0,0]=4 5830 B12R1.34 C[C@@H]([C@H](Cl)C=O)c1ccccc1 Amb25322070 [0,2,0,0,0,0|2,0,0]=4 5831 B12R1.34 C[C@@H]([C@H](O)CC)c1ccccc1 Amb25317557 [0,2,0,0,0,0|2,0,0]=4 5832 B12R1.34 C[C@H](C(=O)NO)c1ccccc1 Amb24459061 [0,2,0,0,0,0|1,0,1]=4 5833 B12R1.34 C[C@H](C(Cl)C=O)c1ccccc1 Amb24358040 [0,2,0,0,0,0|2,0,0]=4 5834 B12R1.34 C[C@H](C=C)[C@H](O)c1ccccc1 Amb25246183 [0,2,0,0,0,0|2,0,0]=4 5835 B12R1.34 C[C@H](C=O)[C@@H](O)c1ccccc1 Amb25255331 [0,2,0,0,0,0|2,0,0]=4 5836 B12R1.34 C[C@H](CC)C(O)c1ccccc1 Amb24735208 [0,2,0,0,0,0|2,0,0]=4 5837 B12R1.34 C[C@H](CC)[C@@H](O)c1ccccc1 Amb25047673 [0,2,0,0,0,0|2,0,0]=4 5838 B12R1.34 C[C@H](CN)[C@@H](N)c1ccccc1 Amb25669594 [0,2,0,0,0,0|1,0,0]=3 5839 B12R1.34 C[C@H](CN)[C@@H](O)c1ccccc1 Amb24710137 [0,2,0,0,0,0|1,0,0]=3 5840 B12R1.34 C[C@H](CO)[C@@H](N)c1ccccc1 Amb24373854 [0,2,0,0,0,0|2,0,0]=4 5841 B12R1.34 C[C@H](CO)[C@@H](O)c1ccccc1 Amb25687837 [0,2,0,0,0,0|2,0,0]=4 5842 B12R1.34 C[C@H](CO)[C@H](O)c1ccccc1 Amb24448086 [0,2,0,0,0,0|2,0,0]=4 5843 B12R1.34 C[C@H](NC)[C@@H](Cl)c1ccccc1 Amb24692816 [0,2,0,0,0,0|1,0,0]=3 5844 B12R1.34 C[C@H](NC)[C@@H](S)c1ccccc1 Amb24453442 [0,2,0,0,0,0|1,0,0]=3 5845 B12R1.34 C[C@H](NC)[C@H](N)c1ccccc1 Amb24739761 [0,2,0,0,0,0|1,0,0]=3 5846 B12R1.34 C[C@H](NC)[C@H](O)c1ccccc1 Amb22351362 [0,2,0,0,0,0|1,0,0]=3 5847 B12R1.34 C[C@H](NC)[C@H](S)c1ccccc1 Amb24727185 [0,2,0,0,0,0|1,0,0]=3 5848 B12R1.34 C[C@H](NN)[C@H](O)c1ccccc1 Amb25346319 [0,2,0,0,0,0|0,0,0]=2 5849 B12R1.34 C[C@H](NO)[C@H](O)c1ccccc1 Amb24475112 [0,2,0,0,0,0|1,0,0]=3 5850 B12R1.34 C[C@H](OC)[C@@H](Cl)c1ccccc1 Amb25274934 [0,2,0,0,0,0|2,0,0]=4 5851 B12R1.34 C[C@H](OC)[C@H](O)c1ccccc1 Amb25106038 [0,2,0,0,0,0|2,0,0]=4 5852 B12R1.34 C[C@H]([C@@H](O)NC)c1ccccc1 Amb25803440 [0,2,0,0,0,0|1,0,0]=3 5853 B12R1.34 C[C@H]([C@H](N)CC)c1ccccc1 Amb25800098 [0,2,0,0,0,0|2,0,0]=4 5854 B12R1.34 C[C@H]([C@H](N)CO)c1ccccc1 Amb24427355 [0,2,0,0,0,0|2,0,0]=4 5855 B12R1.34 C[C@H]([C@H](O)C=C)c1ccccc1 Amb25097849 [0,2,0,0,0,0|2,0,0]=4 5856 B12R1.34 C[C@H]([C@H](O)CO)c1ccccc1 Amb24735213 [0,2,0,0,0,0|2,0,0]=4 5857 B12R1.34 C\C(=N/N)\C(C)c1ccccc1 Amb25271286 [0,2,0,0,0,0|0,0,2]=4 5858 B12R1.34 N#CC(Cl)C(Cl)c1ccccc1 Amb18130480 [0,2,0,0,0,0|1,0,1]=4 5859 B12R1.34 N#CC(O)C(F)c1ccccc1 Amb25320704 [0,2,0,0,0,0|1,0,1]=4 5860 B12R1.34 N#CC(O)[C@@H](O)c1ccccc1 Amb24353058 [0,2,0,0,0,0|1,0,1]=4 5861 B12R1.34 N#C[C@@H](F)[C@@H](O)c1ccccc1 Amb24386850 [0,2,0,0,0,0|1,0,1]=4 5862 B12R1.34 N#C[C@@H](O)[C@H](O)c1ccccc1 Amb25157844 [0,2,0,0,0,0|1,0,1]=4 5863 B12R1.34 N#C[C@H](O)[C@@H](F)c1ccccc1 Amb25157415 [0,2,0,0,0,0|1,0,1]=4 5864 B12R1.34 N#C[C@H](O)[C@@H](O)c1ccccc1 Amb24705594 [0,2,0,0,0,0|1,0,1]=4 5865 B12R1.34 N#C[C@H](O)[C@H](O)c1ccccc1 Amb25285601 [0,2,0,0,0,0|1,0,1]=4 5866 B12R1.34 NC(C#N)C(F)c1ccccc1 Amb25335487 [0,2,0,0,0,0|1,0,1]=4 5867 B12R1.34 NC(C(N)C#N)c1ccccc1 Amb25121131 [0,2,0,0,0,0|1,0,1]=4 5868 B12R1.34 NC(C(O)C#N)c1ccccc1 Amb24713669 [0,2,0,0,0,0|1,0,1]=4 5869 B12R1.34 NC(C(O)CO)c1ccccc1 Amb18646773 [0,2,0,0,0,0|2,0,0]=4 5870 B12R1.34 NC(CF)C(O)c1ccccc1 Amb25101573 [0,2,0,0,0,0|2,0,0]=4 5871 B12R1.34 NC(CN)C(O)c1ccccc1 Amb25150994 [0,2,0,0,0,0|1,0,0]=3 5872 B12R1.34 NC(CO)C(Cl)c1ccccc1 Amb25159303 [0,2,0,0,0,0|2,0,0]=4 5873 B12R1.34 NC(CO)C(F)c1ccccc1 Amb25299166 [0,2,0,0,0,0|2,0,0]=4 5874 B12R1.34 NC(CO)[C@H](O)c1ccccc1 Amb25247266 [0,2,0,0,0,0|2,0,0]=4 5875 B12R1.34 NCC(Br)C(=O)c1ccccc1 Amb25188302 [0,2,0,0,0,0|1,0,1]=4 5876 B12R1.34 NCC(C(=O)c1ccccc1)N Amb10843426 [0,2,0,0,0,0|1,0,1]=4 5877 B12R1.34 NCC(C(c1ccccc1)C)O Amb17232553 [0,2,0,0,0,0|1,0,0]=3 5878 B12R1.34 NCC(F)C(F)c1ccccc1 Amb25851560 [0,2,0,0,0,0|1,0,0]=3 5879 B12R1.34 NCC(N(c1ccccc1)C)C Amb1128364 [0,2,0,0,0,0|2,0,0]=4 5880 B12R1.34 NCC(N(c1ccccc1)C)C Amb13949221 [0,2,0,0,0,0|2,0,0]=4 5881 B12R1.34 NCC(O)C(O)c1ccccc1 Amb19148004 [0,2,0,0,0,0|1,0,0]=3 5882 B12R1.34 NC[C@@H](O)[C@H](O)c1ccccc1 Amb24401596 [0,2,0,0,0,0|1,0,0]=3 5883 B12R1.34 NC[C@H](O)[C@@H](F)c1ccccc1 Amb24678302 [0,2,0,0,0,0|1,0,0]=3 5884 B12R1.34 NC[C@H](O)[C@@H](O)c1ccccc1 Amb24461599 [0,2,0,0,0,0|1,0,0]=3 5885 B12R1.34 NC[C@H](O)[C@H](O)c1ccccc1 Amb24695219 [0,2,0,0,0,0|1,0,0]=3 5886 B12R1.34 NNC(=O)C(F)c1ccccc1 Amb25799083 [0,2,0,0,0,0|0,0,1]=3 5887 B12R1.34 NNC(=O)C(N)c1ccccc1 Amb18061964 [0,2,0,0,0,0|0,0,1]=3 5888 B12R1.34 NNC(=O)C(S)c1ccccc1 Amb24716717 [0,2,0,0,0,0|0,0,1]=3 5889 B12R1.34 NNC(=O)C(c1ccccc1)O Amb1786264 [0,2,0,0,0,0|0,0,1]=3 5890 B12R1.34 NNC(=O)[C@@H](O)c1ccccc1 Amb22587557 [0,2,0,0,0,0|0,0,1]=3 5891 B12R1.34 NNC(=O)[C@H](O)c1ccccc1 Amb25121730 [0,2,0,0,0,0|0,0,1]=3 5892 B12R1.34 NNC(=S)N(O)c1ccccc1 Amb24401970 [0,2,0,0,0,0|1,0,1]=4 5893 B12R1.34 N[C@@H](C(=O)NO)c1ccccc1 Amb25061821 [0,2,0,0,0,0|1,0,1]=4 5894 B12R1.34 N[C@@H](CO)C(O)c1ccccc1 Amb24739572 [0,2,0,0,0,0|2,0,0]=4 5895 B12R1.34 N[C@@H](CO)[C@H](O)c1ccccc1 Amb24487235 [0,2,0,0,0,0|2,0,0]=4 5896 B12R1.34 N[C@H](CO)[C@@H](O)c1ccccc1 Amb25789451 [0,2,0,0,0,0|2,0,0]=4 5897 B12R1.34 N[C@H]([C@@H](N)C#N)c1ccccc1 Amb25084618 [0,2,0,0,0,0|1,0,1]=4 5898 B12R1.34 N[C@H]([C@H](N)CO)c1ccccc1 Amb24558772 [0,2,0,0,0,0|2,0,0]=4 5899 B12R1.34 O=CC(C(c1ccccc1)Br)Br Amb16233220 [0,2,0,0,0,0|2,0,0]=4 5900 B12R1.34 O=CC(Cl)C(Cl)c1ccccc1 Amb25123958 [0,2,0,0,0,0|2,0,0]=4 5901 B12R1.34 O=C[C@H](Cl)[C@@H](Cl)c1ccccc1 Amb25119234 [0,2,0,0,0,0|2,0,0]=4 5902 B12R1.34 OC(C(O)C=O)c1ccccc1 Amb25309597 [0,2,0,0,0,0|2,0,0]=4 5903 B12R1.34 OC(CCl)C(Cl)c1ccccc1 Amb25803612 [0,2,0,0,0,0|2,0,0]=4 5904 B12R1.34 OC(CO)C(F)c1ccccc1 Amb25792385 [0,2,0,0,0,0|2,0,0]=4 5905 B12R1.34 OCC(C(c1ccccc1)O)Br Amb17596330 [0,2,0,0,0,0|2,0,0]=4 5906 B12R1.34 OCC(C(c1ccccc1)O)Cl Amb17594842 [0,2,0,0,0,0|2,0,0]=4 5907 B12R1.34 OCC(Cl)C(Cl)c1ccccc1 Amb25759065 [0,2,0,0,0,0|2,0,0]=4 5908 B12R1.34 OC[C@@H](O)C(O)c1ccccc1 Amb25332503 [0,2,0,0,0,0|2,0,0]=4 5909 B12R1.34 OC[C@@H](O)[C@H](O)c1ccccc1 Amb24496901 [0,2,0,0,0,0|2,0,0]=4 5910 B12R1.34 OC[C@H](Cl)[C@H](Cl)c1ccccc1 Amb25678650 [0,2,0,0,0,0|2,0,0]=4 5911 B12R1.34 OC[C@H](O)[C@@H](O)c1ccccc1 Amb25816355 [0,2,0,0,0,0|2,0,0]=4 5912 B12R1.34 OC[C@H](O)[C@H](O)c1ccccc1 Amb24735337 [0,2,0,0,0,0|2,0,0]=4 5913 B12R1.34 ONC(=O)C(Cl)c1ccccc1 Amb25361902 [0,2,0,0,0,0|1,0,1]=4 5914 B12R1.34 ONC(=O)C(F)c1ccccc1 Amb25777677 [0,2,0,0,0,0|1,0,1]=4 5915 B12R1.34 ONC(=O)C(c1ccccc1)N Amb2430893 [0,2,0,0,0,0|1,0,1]=4 5916 B12R1.34 ONC(=O)[C@@H](O)c1ccccc1 Amb25071532 [0,2,0,0,0,0|1,0,1]=4 5917 B12R1.34 ONC(=O)[C@H](O)c1ccccc1 Amb25787201 [0,2,0,0,0,0|1,0,1]=4 5918 B12R1.34 O[C@@H](CO)[C@@H](F)c1ccccc1 Amb25206688 [0,2,0,0,0,0|2,0,0]=4 5919 B12R1.34 O[C@@H](CO)[C@H](F)c1ccccc1 Amb25157359 [0,2,0,0,0,0|2,0,0]=4 5920 B12R1.34 O[C@@H]([C@@H](Cl)CO)c1ccccc1 Amb25321935 [0,2,0,0,0,0|2,0,0]=4 5921 B12R1.34 O[C@H]([C@@H](O)C=O)c1ccccc1 Amb25785152 [0,2,0,0,0,0|2,0,0]=4 5922 B12R1.39 CC(C)(CC#N)c1ccccc1 Amb18645224 [0,2,0,0,0,0|1,0,1]=4 5923 B12R1.39 CC(C)(CC=C)c1ccccc1 Amb25674101 [0,2,0,0,0,0|2,0,0]=4 5924 B12R1.39 CC(C)(CC=O)c1ccccc1 Amb18645712 [0,2,0,0,0,0|2,0,0]=4 5925 B12R1.39 CC(C)(CCBr)c1ccccc1 Amb25726868 [0,2,0,0,0,0|2,0,0]=4 5926 B12R1.39 CC(C)(CCN)c1ccccc1 Amb22755963 [0,2,0,0,0,0|1,0,0]=3 5927 B12R1.39 CC(C)(CCO)c1ccccc1 Amb23440831 [0,2,0,0,0,0|2,0,0]=4 5928 B12R1.39 CC(C)(C[Hg]Cl)c1ccccc1 Amb22347662 [0,2,0,0,0,0|2,0,0]=4 5929 B12R1.39 CC(C)(C[Mg]Cl)c1ccccc1 Amb22336292 [0,2,0,0,0,0|2,0,0]=4 5930 B12R1.39 CC(C)(C[Zn]Cl)c1ccccc1 Amb22897847 [0,2,0,0,0,0|2,0,0]=4 5931 B12R1.39 CC(F)(CC#N)c1ccccc1 Amb24702719 [0,2,0,0,0,0|1,0,1]=4 5932 B12R1.39 CC(N)(CCO)c1ccccc1 Amb18862633 [0,2,0,0,0,0|2,0,0]=4 5933 B12R1.39 CC(O)(CC=O)c1ccccc1 Amb18646085 [0,2,0,0,0,0|2,0,0]=4 5934 B12R1.39 CC(O)(CCCl)c1ccccc1 Amb25114796 [0,2,0,0,0,0|2,0,0]=4 5935 B12R1.39 CC(O)(CCN)c1c[n]ccc1 Amb18827674 [0,2,0,0,0,0|2,0,0]=4 5936 B12R1.39 CC(O)(CCN)c1cc[n]cc1 Amb18827672 [0,2,0,0,0,0|2,0,0]=4 5937 B12R1.39 CC(O)(CCN)c1cccc[n]1 Amb18827673 [0,2,0,0,0,0|2,0,0]=4 5938 B12R1.39 CC(O)(CCO)c1ccccc1 Amb25716950 [0,2,0,0,0,0|2,0,0]=4 5939 B12R1.39 CC(S)(CCO)c1ccccc1 Amb24630816 [0,2,0,0,0,0|2,0,0]=4 5940 B12R1.39 CCCC(F)(F)c1ccccc1 Amb19894549 [0,2,0,0,0,0|2,0,0]=4 5941 B12R1.39 CNCC(C)(N)c1ccccc1 Amb18298752 [0,2,0,0,0,0|1,0,0]=3 5942 B12R1.39 CNCC(C)(O)c1c[n]ccc1 Amb18062824 [0,2,0,0,0,0|2,0,0]=4 5943 B12R1.39 CNCC(C)(O)c1cc[n]cc1 Amb18562953 [0,2,0,0,0,0|2,0,0]=4 5944 B12R1.39 CNCC(C)(O)c1cccc[n]1 Amb18064992 [0,2,0,0,0,0|2,0,0]=4 5945 B12R1.39 CNCC(F)(F)c1c[n]ccc1 Amb25062659 [0,2,0,0,0,0|2,0,0]=4 5946 B12R1.39 COCC(C)(N)c1ccccc1 Amb18992592 [0,2,0,0,0,0|2,0,0]=4 5947 B12R1.39 COCC(C)(O)c1ccccc1 Amb18801043 [0,2,0,0,0,0|2,0,0]=4 5948 B12R1.39 COC[C@@](C)(N)c1ccccc1 Amb25856946 [0,2,0,0,0,0|2,0,0]=4 5949 B12R1.39 CSCC(C)(O)c1ccccc1 Amb19061286 [0,2,0,0,0,0|2,0,0]=4 5950 B12R1.39 C[C@@](N)(CC#N)c1ccccc1 Amb25059074 [0,2,0,0,0,0|1,0,1]=4 5951 B12R1.39 C[C@@](N)(CC=C)c1ccccc1 Amb25111215 [0,2,0,0,0,0|2,0,0]=4 5952 B12R1.39 C[C@@](N)(CCO)c1ccccc1 Amb25097043 [0,2,0,0,0,0|2,0,0]=4 5953 B12R1.39 C[C@@](O)(CCCl)c1ccccc1 Amb25361033 [0,2,0,0,0,0|2,0,0]=4 5954 B12R1.39 C[C@](N)(CC#N)c1ccccc1 Amb24559923 [0,2,0,0,0,0|1,0,1]=4 5955 B12R1.39 C[C@](O)(CCCl)c1ccccc1 Amb25667166 [0,2,0,0,0,0|2,0,0]=4 5956 B12R1.39 C[C@](S)(CCO)c1ccccc1 Amb25120134 [0,2,0,0,0,0|2,0,0]=4 5957 B12R1.39 N#CCC(F)(F)c1ccccc1 Amb25070879 [0,2,0,0,0,0|1,0,1]=4 5958 B12R1.39 NC(O)(CCO)c1ccccc1 Amb24431011 [0,2,0,0,0,0|2,0,0]=4 5959 B12R1.39 NCCC(F)(F)c1c[n]ccc1 Amb24554774 [0,2,0,0,0,0|2,0,0]=4 5960 B12R1.39 NCCC(F)(F)c1cccc[n]1 Amb25159830 [0,2,0,0,0,0|2,0,0]=4 5961 B12R1.39 NCCC(c1ccccc1)(O)C Amb17594116 [0,2,0,0,0,0|1,0,0]=3 5962 B12R1.39 NCC[S+](=O)(c1ccccc1)[O-] Amb10230992 [0,2,0,0,0,0|2,0,0]=4 5963 B12R1.39 NNCC(F)(F)c1ccccc1 Amb25692683 [0,2,0,0,0,0|0,0,0]=2 5964 B12R1.39 NNCC(c1ccccc1)(O)C Amb17232616 [0,2,0,0,0,0|0,0,0]=2 5965 B12R1.39 NOCC(F)(F)c1ccccc1 Amb25842068 [0,2,0,0,0,0|1,0,0]=3 5966 B12R1.39 N[C@](O)(CCO)c1ccccc1 Amb25356322 [0,2,0,0,0,0|2,0,0]=4 5967 B12R1.39 [C-]#[N+]CC(F)(F)c1ccccc1 Amb25249868 [0,2,0,0,0,0|1,0,1]=4 5968 B12R1.107 BrC(c1ccccc1)CN(C)C Amb10563751 [0,2,0,0,0,0|1,0,0]=3 5969 B12R1.107 C=C(CC(N)=O)c1ccccc1 Amb25798918 [0,2,0,0,0,0|1,0,1]=4 5970 B12R1.107 C=C(Cl)CC(O)c1ccccc1 Amb25359026 [0,2,0,0,0,0|2,0,0]=4 5971 B12R1.107 C=C(Cl)C[C@H](O)c1ccccc1 Amb25362960 [0,2,0,0,0,0|2,0,0]=4 5972 B12R1.107 C=C(F)CC(O)c1ccccc1 Amb25158203 [0,2,0,0,0,0|2,0,0]=4 5973 B12R1.107 CC(=C)CC(N)c1ccccc1 Amb24423888 [0,2,0,0,0,0|2,0,0]=4 5974 B12R1.107 CC(=C)C[C@H](N)c1ccccc1 Amb25124122 [0,2,0,0,0,0|2,0,0]=4 5975 B12R1.107 CC(=C)C[C@H](O)c1ccccc1 Amb24497632 [0,2,0,0,0,0|2,0,0]=4 5976 B12R1.107 CC(C)C[C@@H](Cl)c1ccccc1 Amb25667428 [0,2,0,0,0,0|2,0,0]=4 5977 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb22288660 [0,2,0,0,0,0|2,0,0]=4 5978 B12R1.107 CC(C)C[C@@H](O)c1ccccc1 Amb25816173 [0,2,0,0,0,0|2,0,0]=4 5979 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb22288705 [0,2,0,0,0,0|2,0,0]=4 5980 B12R1.107 CC(C)C[C@H](O)c1ccccc1 Amb24344678 [0,2,0,0,0,0|2,0,0]=4 5981 B12R1.107 CC(CB(O)O)c1ccccc1 Amb24725059 [0,2,0,0,0,0|2,0,0]=4 5982 B12R1.107 CC(CC(C)Br)c1ccccc1 Amb25273655 [0,2,0,0,0,0|2,0,0]=4 5983 B12R1.107 CC(CC(N)=O)c1cc[n]cc1 Amb25724402 [0,2,0,0,0,0|2,0,0]=4 5984 B12R1.107 CC(CC(N)=S)c1ccccc1 Amb24583414 [0,2,0,0,0,0|1,0,0]=3 5985 B12R1.107 CC(CC(N)N)c1ccccc1 Amb24670721 [0,2,0,0,0,0|1,0,0]=3 5986 B12R1.107 CC(CC(O)O)c1ccccc1 Amb25092014 [0,2,0,0,0,0|2,0,0]=4 5987 B12R1.107 CC(CN(C)C)c1ccccc1 Amb22491726 [0,2,0,0,0,0|1,0,0]=3 5988 B12R1.107 CC(CN(C)C)c1ccccc1 Amb25848155 [0,2,0,0,0,0|1,0,0]=3 5989 B12R1.107 CC(CN(C)N)c1ccccc1 Amb24379493 [0,2,0,0,0,0|0,0,0]=2 5990 B12R1.107 CC(CN(c1ccccc1)C)N Amb10610213 [0,2,0,0,0,0|2,0,0]=4 5991 B12R1.107 CC(CN(c1ccccc1)C)N Amb1137929 [0,2,0,0,0,0|2,0,0]=4 5992 B12R1.107 CC(CS(C)=O)c1ccccc1 Amb24673234 [0,2,0,0,0,0|2,0,0]=4 5993 B12R1.107 CC(CS(O)=O)c1ccccc1 Amb24557264 [0,2,0,0,0,0|2,0,0]=4 5994 B12R1.107 CC(CS([O-])=O)c1ccccc1 Amb24385785 [0,2,0,0,0,0|2,0,0]=4 5995 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb20668879 [0,2,0,0,0,0|1,0,1]=4 5996 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb22059727 [0,2,0,0,0,0|1,0,1]=4 5997 B12R1.107 CC(N)CC(O)c1ccc[n]c1 Amb25798886 [0,2,0,0,0,0|2,0,0]=4 5998 B12R1.107 CC(N)CC(O)c1ccccc1 Amb18646365 [0,2,0,0,0,0|1,0,0]=3 5999 B12R1.107 CC(N)C[C@@H](O)c1ccccc1 Amb25719473 [0,2,0,0,0,0|1,0,0]=3 6000 B12R1.107 CC(NC(N)=N)c1ccccc1 Amb22284229 [0,2,0,0,0,0|2,0,0]=4 6001 B12R1.107 CC(NN(C)C)c1ccccc1 Amb24608774 [0,2,0,0,0,0|2,0,0]=4 6002 B12R1.107 CC(O)CC(N)c1ccccc1 Amb18646382 [0,2,0,0,0,0|2,0,0]=4 6003 B12R1.107 CC(O)CC(P)c1ccccc1 Amb25157842 [0,2,0,0,0,0|2,0,0]=4 6004 B12R1.107 CC(O)CC(S)c1ccccc1 Amb24525704 [0,2,0,0,0,0|2,0,0]=4 6005 B12R1.107 CC(O)C[C@H](O)c1ccccc1 Amb24355251 [0,2,0,0,0,0|2,0,0]=4 6006 B12R1.107 CC(c1ccccc1)CC(=O)O Amb1207393 [0,2,0,0,0,0|2,0,0]=4 6007 B12R1.107 CC(c1ccccc1)NC(=N)N Amb10669498 [0,2,0,0,0,0|2,0,0]=4 6008 B12R1.107 CC(c1ccccc1)NC(=O)N Amb1135151 [0,2,0,0,0,0|2,0,0]=4 6009 B12R1.107 CC(c1ccccc1)NC(=S)N Amb1645582 [0,2,0,0,0,0|2,0,0]=4 6010 B12R1.107 CN(C)CC(=O)c1ccccc1 Amb22264767 [0,2,0,0,0,0|1,0,1]=4 6011 B12R1.107 CN(C)CC(Br)c1ccccc1 Amb25055256 [0,2,0,0,0,0|1,0,0]=3 6012 B12R1.107 CN(C)CC(F)c1ccccc1 Amb24623425 [0,2,0,0,0,0|1,0,0]=3 6013 B12R1.107 CN(C)CC(N)c1cc[n]cc1 Amb25315967 [0,2,0,0,0,0|2,0,0]=4 6014 B12R1.107 CN(C)CC(N)c1cccc[n]1 Amb24543991 [0,2,0,0,0,0|2,0,0]=4 6015 B12R1.107 CN(C)CC(N)c1ccccc1 Amb22042488 [0,2,0,0,0,0|1,0,0]=3 6016 B12R1.107 CN(C)C[C@@H](N)c1ccccc1 Amb22745082 [0,2,0,0,0,0|1,0,0]=3 6017 B12R1.107 CN(C)C[C@@H](O)c1ccccc1 Amb22226504 [0,2,0,0,0,0|1,0,0]=3 6018 B12R1.107 CN(C)C[C@H](O)c1ccccc1 Amb24707113 [0,2,0,0,0,0|1,0,0]=3 6019 B12R1.107 CN(CC(c1ccccn1)O)C Amb17550347 [0,2,0,0,0,0|2,0,0]=4 6020 B12R1.107 CN(CC(c1cccnc1)O)C Amb17550203 [0,2,0,0,0,0|2,0,0]=4 6021 B12R1.107 CS(=O)CC(N)c1ccccc1 Amb18648795 [0,2,0,0,0,0|2,0,0]=4 6022 B12R1.107 CS(=O)CC(O)c1ccccc1 Amb25781686 [0,2,0,0,0,0|2,0,0]=4 6023 B12R1.107 C[C@@H](N)CN(C)c1ccccc1 Amb25058714 [0,2,0,0,0,0|2,0,0]=4 6024 B12R1.107 C[C@@H](N)CS(=O)c1ccccc1 Amb24381565 [0,2,0,0,0,0|2,0,0]=4 6025 B12R1.107 C[C@@H](N)C[C@@H]([O-])c1ccccc1 Amb25825094 [0,2,0,0,0,0|1,0,0]=3 6026 B12R1.107 C[C@@H](NC(N)=O)c1ccccc1 Amb22232053 [0,2,0,0,0,0|2,0,0]=4 6027 B12R1.107 C[C@@H](O)C[C@@H](N)c1ccccc1 Amb24634311 [0,2,0,0,0,0|2,0,0]=4 6028 B12R1.107 C[C@@H](O)C[C@H](N)c1ccccc1 Amb24711221 [0,2,0,0,0,0|2,0,0]=4 6029 B12R1.107 C[C@@H](SC(N)=N)c1ccccc1 Amb25807975 [0,2,0,0,0,0|2,0,0]=4 6030 B12R1.107 C[C@@H](c1ccccc1)CC(=O)O Amb10844340 [0,2,0,0,0,0|2,0,0]=4 6031 B12R1.107 C[C@H](C[C@H](C)O)c1ccccc1 Amb25741359 [0,2,0,0,0,0|2,0,0]=4 6032 B12R1.107 C[C@H](Cl)C[C@@H](Cl)c1ccccc1 Amb25119306 [0,2,0,0,0,0|2,0,0]=4 6033 B12R1.107 C[C@H](N)C[C@@H](O)c1ccccc1 Amb25362221 [0,2,0,0,0,0|1,0,0]=3 6034 B12R1.107 C[C@H](N)C[C@H]([O-])c1ccccc1 Amb25180739 [0,2,0,0,0,0|1,0,0]=3 6035 B12R1.107 C[C@H](NC(N)=O)c1ccccc1 Amb22232024 [0,2,0,0,0,0|2,0,0]=4 6036 B12R1.107 C[C@H](O)CC(N)c1ccccc1 Amb24608910 [0,2,0,0,0,0|2,0,0]=4 6037 B12R1.107 C[C@H](O)CC(O)c1ccccc1 Amb25846972 [0,2,0,0,0,0|2,0,0]=4 6038 B12R1.107 C[C@H](O)C[C@@H](N)c1ccccc1 Amb25152440 [0,2,0,0,0,0|2,0,0]=4 6039 B12R1.107 C[C@H](O)C[C@@H](O)c1ccccc1 Amb24431811 [0,2,0,0,0,0|2,0,0]=4 6040 B12R1.107 C[C@H](O)C[C@H](S)c1ccccc1 Amb24398074 [0,2,0,0,0,0|2,0,0]=4 6041 B12R1.107 C[C@H](c1ccccc1)CC(=O)O Amb10844379 [0,2,0,0,0,0|2,0,0]=4 6042 B12R1.107 ClC(c1ccccc1)CN(C)C Amb10563749 [0,2,0,0,0,0|1,0,0]=3 6043 B12R1.107 ClC(c1ccccc1)CN(C)C Amb17546791 [0,2,0,0,0,0|1,0,0]=3 6044 B12R1.107 NC(=N)CC(=S)c1ccccc1 Amb24692832 [0,2,0,0,0,0|1,0,1]=4 6045 B12R1.107 NC(=O)CN(N)c1ccccc1 Amb25150990 [0,2,0,0,0,0|2,0,0]=4 6046 B12R1.107 NC(=O)C[C@@H](N)c1c[n]ccc1 Amb18792646 [0,2,0,0,0,0|2,0,0]=4 6047 B12R1.107 NC(=O)C[C@@H](N)c1ccccc1 Amb18792562 [0,2,0,0,0,0|1,0,0]=3 6048 B12R1.107 NC(=O)C[C@@H](O)c1ccccc1 Amb25751170 [0,2,0,0,0,0|1,0,0]=3 6049 B12R1.107 NC(=O)C[C@H](N)c1c[n]ccc1 Amb25137393 [0,2,0,0,0,0|2,0,0]=4 6050 B12R1.107 NC(=O)C[C@H](N)c1cccc[n]1 Amb25049883 [0,2,0,0,0,0|2,0,0]=4 6051 B12R1.107 NC(=O)C[C@H](O)c1ccccc1 Amb25150965 [0,2,0,0,0,0|1,0,0]=3 6052 B12R1.107 NC(=O)C[P](=S)c1ccccc1 Amb24375519 [0,2,0,0,0,0|2,0,0]=4 6053 B12R1.107 NC(=S)CC(=N)c1ccccc1 Amb25337793 [0,2,0,0,0,0|1,0,1]=4 6054 B12R1.107 NC(=S)CC(O)c1ccccc1 Amb18805332 [0,2,0,0,0,0|1,0,0]=3 6055 B12R1.107 NC(CB(O)O)c1ccccc1 Amb24658322 [0,2,0,0,0,0|2,0,0]=4 6056 B12R1.107 NC(CC(Cl)Cl)c1ccccc1 Amb25324519 [0,2,0,0,0,0|2,0,0]=4 6057 B12R1.107 NC(CC(F)F)c1ccccc1 Amb18802187 [0,2,0,0,0,0|2,0,0]=4 6058 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609847 [0,2,0,0,0,0|1,0,0]=3 6059 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609952 [0,2,0,0,0,0|1,0,0]=3 6060 B12R1.107 NC(c1ccccc1)CC(=O)O Amb1048120 [0,2,0,0,0,0|2,0,0]=4 6061 B12R1.107 NC(c1ccccc1)CC(C)C Amb1107536 [0,2,0,0,0,0|2,0,0]=4 6062 B12R1.107 NC(c1ccccc1)CN(C)C Amb1218288 [0,2,0,0,0,0|1,0,0]=3 6063 B12R1.107 OC(=O)CC(Cl)c1ccccc1 Amb18120400 [0,2,0,0,0,0|2,0,0]=4 6064 B12R1.107 OC(=O)CC(F)c1ccccc1 Amb24554792 [0,2,0,0,0,0|2,0,0]=4 6065 B12R1.107 OC(=O)CC(S)c1ccccc1 Amb18303085 [0,2,0,0,0,0|2,0,0]=4 6066 B12R1.107 OC(CC(F)F)c1ccccc1 Amb24433354 [0,2,0,0,0,0|2,0,0]=4 6067 B12R1.107 OC(CC(S)=S)c1ccccc1 Amb25145313 [0,2,0,0,0,0|2,0,0]=4 6068 B12R1.107 OC(c1ccccc1)CC(C)C Amb1110402 [0,2,0,0,0,0|2,0,0]=4 6069 B12R1.107 OC(c1ccccc1)CC(O)C Amb1110547 [0,2,0,0,0,0|2,0,0]=4 6070 B12R1.107 OC(c1ccccc1)CN(C)C Amb10563753 [0,2,0,0,0,0|1,0,0]=3 6071 B12R1.107 OC(c1ccccc1)CN(C)C Amb17104281 [0,2,0,0,0,0|1,0,0]=3 6072 B12R1.107 OC(c1ccccc1)C[N+](=O)[O-] Amb1048142 [0,2,0,0,0,0|1,0,1]=4 6073 B12R1.107 OC(c1ccncc1)CN(C)C Amb17550252 [0,2,0,0,0,0|2,0,0]=4 6074 B12R1.308 C#CCC(N)c1ccccc1Cl Amb18809279 [0,2,0,0,0,0|2,0,0]=4 6075 B12R1.308 C#CCC(N)c1ccccc1F Amb18967422 [0,2,0,0,0,0|2,0,0]=4 6076 B12R1.308 C#CCC(O)c1ccccc1Cl Amb18186758 [0,2,0,0,0,0|2,0,0]=4 6077 B12R1.308 C#CCC(O)c1ccccc1F Amb18788274 [0,2,0,0,0,0|2,0,0]=4 6078 B12R1.308 C#CC[C@@H](O)c1ccccc1F Amb24100209 [0,2,0,0,0,0|2,0,0]=4 6079 B12R1.308 C#CC[C@H](O)c1ccccc1Cl Amb25158196 [0,2,0,0,0,0|2,0,0]=4 6080 B12R1.308 C=CCC(N)c1ccccc1Br Amb18293502 [0,2,0,0,0,0|2,0,0]=4 6081 B12R1.308 C=CCC(N)c1ccccc1Cl Amb18986268 [0,2,0,0,0,0|2,0,0]=4 6082 B12R1.308 C=CCC(N)c1ccccc1F Amb19002611 [0,2,0,0,0,0|2,0,0]=4 6083 B12R1.308 C=CCC(N)c1ccccc1I Amb25377094 [0,2,0,0,0,0|2,0,0]=4 6084 B12R1.308 C=CCC(N)c1ccccc1O Amb25261429 [0,2,0,0,0,0|2,0,0]=4 6085 B12R1.308 C=CCC(O)c1ccccc1Br Amb24671319 [0,2,0,0,0,0|2,0,0]=4 6086 B12R1.308 C=CCC(O)c1ccccc1Cl Amb19074253 [0,2,0,0,0,0|2,0,0]=4 6087 B12R1.308 C=CCC(O)c1ccccc1F Amb18177819 [0,2,0,0,0,0|2,0,0]=4 6088 B12R1.308 C=CCC(O)c1ccccc1I Amb25775871 [0,2,0,0,0,0|2,0,0]=4 6089 B12R1.308 C=CCC(O)c1ccccc1O Amb18646046 [0,2,0,0,0,0|2,0,0]=4 6090 B12R1.308 C=CC[C@@H](N)c1ccccc1Cl Amb19889592 [0,2,0,0,0,0|2,0,0]=4 6091 B12R1.308 C=CC[C@@H](N)c1ccccc1Cl Amb22831179 [0,2,0,0,0,0|2,0,0]=4 6092 B12R1.308 C=CC[C@@H](N)c1ccccc1F Amb22831408 [0,2,0,0,0,0|2,0,0]=4 6093 B12R1.308 C=CC[C@@H](N)c1ccccc1N Amb25368389 [0,2,0,0,0,0|2,0,0]=4 6094 B12R1.308 C=CC[C@@H](O)c1ccccc1Cl Amb24372071 [0,2,0,0,0,0|2,0,0]=4 6095 B12R1.308 C=CC[C@H](N)c1ccccc1Cl Amb19889591 [0,2,0,0,0,0|2,0,0]=4 6096 B12R1.308 C=CC[C@H](N)c1ccccc1N Amb25138190 [0,2,0,0,0,0|2,0,0]=4 6097 B12R1.308 C=CC[C@H](N)c1ccccc1S Amb24460315 [0,2,0,0,0,0|2,0,0]=4 6098 B12R1.308 C=CC[C@H](O)c1ccccc1Cl Amb24534332 [0,2,0,0,0,0|2,0,0]=4 6099 B12R1.308 C=CC[C@H](O)c1ccccc1O Amb24497366 [0,2,0,0,0,0|2,0,0]=4 6100 B12R1.308 C=CC[C@H](O)c1ccccc1S Amb24608088 [0,2,0,0,0,0|2,0,0]=4 6101 B12R1.308 CC(CC#N)c1ccccc1Cl Amb25083306 [0,2,0,0,0,0|1,0,1]=4 6102 B12R1.308 CC(CC#N)c1ccccc1O Amb18645498 [0,2,0,0,0,0|1,0,1]=4 6103 B12R1.308 CC(CC=O)c1ccccc1Cl Amb18648717 [0,2,0,0,0,0|2,0,0]=4 6104 B12R1.308 CC(CC=O)c1ccccc1F Amb25253611 [0,2,0,0,0,0|2,0,0]=4 6105 B12R1.308 CC(CCN)c1cc[n]cc1F Amb25378379 [0,2,0,0,0,0|2,0,0]=4 6106 B12R1.308 CC(CCN)c1ccccc1O Amb24643805 [0,2,0,0,0,0|1,0,0]=3 6107 B12R1.308 CCCC(C)c1ccccc1N Amb24729496 [0,2,0,0,0,0|2,0,0]=4 6108 B12R1.308 CCCC(Cl)c1ccccc1F Amb25127215 [0,2,0,0,0,0|2,0,0]=4 6109 B12R1.308 CCCC(N)c1ccccc1N Amb25119381 [0,2,0,0,0,0|2,0,0]=4 6110 B12R1.308 CCCC(N)c1ccccc1S Amb24488673 [0,2,0,0,0,0|2,0,0]=4 6111 B12R1.308 CCCC(O)c1ccccc1I Amb24623046 [0,2,0,0,0,0|2,0,0]=4 6112 B12R1.308 CCCC(O)c1ccccc1N Amb24473035 [0,2,0,0,0,0|2,0,0]=4 6113 B12R1.308 CCCC(O)c1ccccc1O Amb18646532 [0,2,0,0,0,0|2,0,0]=4 6114 B12R1.308 CCCC(c1ccccc1C)N Amb17232446 [0,2,0,0,0,0|2,0,0]=4 6115 B12R1.308 CCCC(c1ccccc1C)O Amb17232483 [0,2,0,0,0,0|2,0,0]=4 6116 B12R1.308 CCCC(c1ccccc1Cl)N Amb17234047 [0,2,0,0,0,0|2,0,0]=4 6117 B12R1.308 CCCC(c1ccccc1Cl)O Amb17234154 [0,2,0,0,0,0|2,0,0]=4 6118 B12R1.308 CCCC(c1ccccc1F)N Amb17232645 [0,2,0,0,0,0|2,0,0]=4 6119 B12R1.308 CCCC(c1ccccc1F)O Amb17232666 [0,2,0,0,0,0|2,0,0]=4 6120 B12R1.308 CCC[C@@H](N)c1ccccc1I Amb24443865 [0,2,0,0,0,0|2,0,0]=4 6121 B12R1.308 CCC[C@@H](O)c1ccccc1Br Amb24705993 [0,2,0,0,0,0|2,0,0]=4 6122 B12R1.308 CCC[C@@H](O)c1ccccc1Cl Amb25043992 [0,2,0,0,0,0|2,0,0]=4 6123 B12R1.308 CCC[C@H](N)c1ccccc1Br Amb25096337 [0,2,0,0,0,0|2,0,0]=4 6124 B12R1.308 CCC[C@H](N)c1ccccc1N Amb25088274 [0,2,0,0,0,0|2,0,0]=4 6125 B12R1.308 CNCC(=O)c1ccccc1Br Amb18160384 [0,2,0,0,0,0|1,0,1]=4 6126 B12R1.308 CNCC(=O)c1ccccc1Cl Amb18863065 [0,2,0,0,0,0|1,0,1]=4 6127 B12R1.308 CNCC(=O)c1ccccc1F Amb18862705 [0,2,0,0,0,0|1,0,1]=4 6128 B12R1.308 CNCC(C)c1ccccc1Br Amb25035170 [0,2,0,0,0,0|1,0,0]=3 6129 B12R1.308 CNCC(C)c1ccccc1F Amb25827937 [0,2,0,0,0,0|1,0,0]=3 6130 B12R1.308 CNCC(O)c1[n]cccc1Br Amb23586111 [0,2,0,0,0,0|2,0,0]=4 6131 B12R1.308 CNCC(O)c1cc[n]cc1F Amb25259123 [0,2,0,0,0,0|2,0,0]=4 6132 B12R1.308 CNCC(O)c1cc[n]cc1O Amb25195080 [0,2,0,0,0,0|2,0,0]=4 6133 B12R1.308 CNCC(O)c1ccccc1Br Amb18301236 [0,2,0,0,0,0|1,0,0]=3 6134 B12R1.308 CNCC(O)c1ccccc1O Amb24739803 [0,2,0,0,0,0|1,0,0]=3 6135 B12R1.308 CNC[C@@H](O)c1ccccc1O Amb24427596 [0,2,0,0,0,0|1,0,0]=3 6136 B12R1.308 COCC(N)c1ccccc1Cl Amb18979037 [0,2,0,0,0,0|2,0,0]=4 6137 B12R1.308 COCC(N)c1ccccc1N Amb25709589 [0,2,0,0,0,0|2,0,0]=4 6138 B12R1.308 COCC(N)c1ccccc1S Amb25790028 [0,2,0,0,0,0|2,0,0]=4 6139 B12R1.308 COCC(O)c1ccccc1Br Amb24641135 [0,2,0,0,0,0|2,0,0]=4 6140 B12R1.308 COCC(O)c1ccccc1Cl Amb19058987 [0,2,0,0,0,0|2,0,0]=4 6141 B12R1.308 COCC(O)c1ccccc1F Amb18806459 [0,2,0,0,0,0|2,0,0]=4 6142 B12R1.308 COCC(O)c1ccccc1N Amb18987946 [0,2,0,0,0,0|2,0,0]=4 6143 B12R1.308 COCC(c1ccccc1C)N Amb1129629 [0,2,0,0,0,0|2,0,0]=4 6144 B12R1.308 COCC(c1ccccc1F)N Amb1139580 [0,2,0,0,0,0|2,0,0]=4 6145 B12R1.308 COC[C@@H](N)c1ccccc1Cl Amb24670291 [0,2,0,0,0,0|2,0,0]=4 6146 B12R1.308 COC[C@@H](N)c1ccccc1F Amb25852206 [0,2,0,0,0,0|2,0,0]=4 6147 B12R1.308 COC[C@H](N)c1ccccc1Br Amb25225784 [0,2,0,0,0,0|2,0,0]=4 6148 B12R1.308 COC[C@H](N)c1ccccc1Cl Amb25118021 [0,2,0,0,0,0|2,0,0]=4 6149 B12R1.308 COC[C@H](N)c1ccccc1I Amb24483885 [0,2,0,0,0,0|2,0,0]=4 6150 B12R1.308 COC[C@H](N)c1ccccc1S Amb25063716 [0,2,0,0,0,0|2,0,0]=4 6151 B12R1.308 CSCC(N)c1ccccc1Cl Amb18300371 [0,2,0,0,0,0|2,0,0]=4 6152 B12R1.308 CSCC(N)c1ccccc1F Amb18995354 [0,2,0,0,0,0|2,0,0]=4 6153 B12R1.308 CSCC(O)c1ccccc1Cl Amb25789089 [0,2,0,0,0,0|2,0,0]=4 6154 B12R1.308 CSCC(O)c1ccccc1F Amb19070008 [0,2,0,0,0,0|2,0,0]=4 6155 B12R1.308 CSCC(O)c1ccccc1N Amb18987947 [0,2,0,0,0,0|2,0,0]=4 6156 B12R1.308 C[C@H](CC=O)c1ccccc1Cl Amb24537615 [0,2,0,0,0,0|2,0,0]=4 6157 B12R1.308 C[C@H](CCO)c1ccccc1O Amb24686462 [0,2,0,0,0,0|2,0,0]=4 6158 B12R1.308 Cc1cc[n]cc1C(C)CCN Amb24566086 [0,2,0,0,0,0|2,0,0]=4 6159 B12R1.308 Cc1ccc[n]c1C(O)CNC Amb24711552 [0,2,0,0,0,0|2,0,0]=4 6160 B12R1.308 Cc1ccccc1C(=O)CCN Amb25062867 [0,2,0,0,0,0|1,0,1]=4 6161 B12R1.308 Cc1ccccc1C(=O)CNC Amb18862585 [0,2,0,0,0,0|1,0,1]=4 6162 B12R1.308 Cc1ccccc1C(C)CNC Amb25255160 [0,2,0,0,0,0|1,0,0]=3 6163 B12R1.308 Cc1ccccc1C(C)CNN Amb24365526 [0,2,0,0,0,0|0,0,0]=2 6164 B12R1.308 Cc1ccccc1C(Cl)CC=C Amb25044767 [0,2,0,0,0,0|2,0,0]=4 6165 B12R1.308 Cc1ccccc1C(Cl)CCC Amb25157873 [0,2,0,0,0,0|2,0,0]=4 6166 B12R1.308 Cc1ccccc1C(Cl)CCO Amb24692648 [0,2,0,0,0,0|2,0,0]=4 6167 B12R1.308 Cc1ccccc1C(N)CC#C Amb18800159 [0,2,0,0,0,0|2,0,0]=4 6168 B12R1.308 Cc1ccccc1C(N)CC#N Amb18563498 [0,2,0,0,0,0|1,0,1]=4 6169 B12R1.308 Cc1ccccc1C(N)CC=C Amb18292097 [0,2,0,0,0,0|2,0,0]=4 6170 B12R1.308 Cc1ccccc1C(N)CCCl Amb24739582 [0,2,0,0,0,0|2,0,0]=4 6171 B12R1.308 Cc1ccccc1C(N)CSC Amb18995352 [0,2,0,0,0,0|2,0,0]=4 6172 B12R1.308 Cc1ccccc1C(O)CC#C Amb18800363 [0,2,0,0,0,0|2,0,0]=4 6173 B12R1.308 Cc1ccccc1C(O)CC=C Amb18177787 [0,2,0,0,0,0|2,0,0]=4 6174 B12R1.308 Cc1ccccc1C(O)COC Amb18792768 [0,2,0,0,0,0|2,0,0]=4 6175 B12R1.308 Cc1ccccc1C(O)CSC Amb19061296 [0,2,0,0,0,0|2,0,0]=4 6176 B12R1.308 Cc1ccccc1S(=O)CCN Amb18974524 [0,2,0,0,0,0|2,0,0]=4 6177 B12R1.308 Cc1ccccc1[C@@H](N)CC#N Amb25113376 [0,2,0,0,0,0|1,0,1]=4 6178 B12R1.308 Cc1ccccc1[C@@H](N)CCC Amb22298562 [0,2,0,0,0,0|2,0,0]=4 6179 B12R1.308 Cc1ccccc1[C@@H](N)CCN Amb24567843 [0,2,0,0,0,0|1,0,0]=3 6180 B12R1.308 Cc1ccccc1[C@@H](N)CCO Amb24393358 [0,2,0,0,0,0|2,0,0]=4 6181 B12R1.308 Cc1ccccc1[C@@H](N)COC Amb24447174 [0,2,0,0,0,0|2,0,0]=4 6182 B12R1.308 Cc1ccccc1[C@H](N)CCC Amb22298519 [0,2,0,0,0,0|2,0,0]=4 6183 B12R1.308 Cc1ccccc1[C@H](N)CCN Amb24580760 [0,2,0,0,0,0|1,0,0]=3 6184 B12R1.308 Cc1ccccc1[C@H](O)CNC Amb24398599 [0,2,0,0,0,0|1,0,0]=3 6185 B12R1.308 N#CCC(F)c1ccccc1F Amb24439552 [0,2,0,0,0,0|1,0,1]=4 6186 B12R1.308 N#CCC(c1ccccc1C)O Amb1111330 [0,2,0,0,0,0|1,0,1]=4 6187 B12R1.308 N#CCC(c1ccccc1F)O Amb17232516 [0,2,0,0,0,0|1,0,1]=4 6188 B12R1.308 N#CC[C@@H](O)c1ccccc1Br Amb25070680 [0,2,0,0,0,0|1,0,1]=4 6189 B12R1.308 N#CC[C@@H](O)c1ccccc1Cl Amb25058529 [0,2,0,0,0,0|1,0,1]=4 6190 B12R1.308 N#CC[C@H](O)c1ccccc1Cl Amb25215874 [0,2,0,0,0,0|1,0,1]=4 6191 B12R1.308 N#CC[C@H](O)c1ccccc1F Amb25354676 [0,2,0,0,0,0|1,0,1]=4 6192 B12R1.308 NC(CC#N)c1ccccc1Br Amb18066761 [0,2,0,0,0,0|1,0,1]=4 6193 B12R1.308 NC(CC#N)c1ccccc1Cl Amb18564158 [0,2,0,0,0,0|1,0,1]=4 6194 B12R1.308 NC(CC#N)c1ccccc1F Amb18563603 [0,2,0,0,0,0|1,0,1]=4 6195 B12R1.308 NC(CCCl)c1ccccc1Cl Amb25667414 [0,2,0,0,0,0|2,0,0]=4 6196 B12R1.308 NC(CCO)c1ccccc1Br Amb18297962 [0,2,0,0,0,0|2,0,0]=4 6197 B12R1.308 NC(CCO)c1ccccc1Cl Amb19888406 [0,2,0,0,0,0|2,0,0]=4 6198 B12R1.308 NC(CCO)c1ccccc1I Amb25729935 [0,2,0,0,0,0|2,0,0]=4 6199 B12R1.308 NC(CCO)c1ccccc1O Amb24487329 [0,2,0,0,0,0|2,0,0]=4 6200 B12R1.308 NC(CCO)c1ccccc1S Amb24488674 [0,2,0,0,0,0|2,0,0]=4 6201 B12R1.308 NCCC(=O)c1ccccc1Cl Amb25709180 [0,2,0,0,0,0|1,0,1]=4 6202 B12R1.308 NCCC(=O)c1ccccc1O Amb24346596 [0,2,0,0,0,0|1,0,1]=4 6203 B12R1.308 NCCC(F)c1cc[n]cc1F Amb24543855 [0,2,0,0,0,0|2,0,0]=4 6204 B12R1.308 NCCC(F)c1ccccc1Cl Amb25083769 [0,2,0,0,0,0|1,0,0]=3 6205 B12R1.308 NCCC(F)c1ccccc1O Amb24742701 [0,2,0,0,0,0|1,0,0]=3 6206 B12R1.308 NCCC(N)c1ccccc1Br Amb25339731 [0,2,0,0,0,0|1,0,0]=3 6207 B12R1.308 NCCC(O)c1[n]cccc1F Amb24536231 [0,2,0,0,0,0|2,0,0]=4 6208 B12R1.308 NCCC(O)c1cc[n]cc1F Amb25076891 [0,2,0,0,0,0|2,0,0]=4 6209 B12R1.308 NCCC(O)c1cc[n]cc1O Amb24596511 [0,2,0,0,0,0|2,0,0]=4 6210 B12R1.308 NCCC(O)c1ccccc1Br Amb18747006 [0,2,0,0,0,0|1,0,0]=3 6211 B12R1.308 NCCC(O)c1ccccc1O Amb24718394 [0,2,0,0,0,0|1,0,0]=3 6212 B12R1.308 NCCC(c1ccccc1C)C Amb17232447 [0,2,0,0,0,0|1,0,0]=3 6213 B12R1.308 NCCC(c1ccccc1C)O Amb17232539 [0,2,0,0,0,0|1,0,0]=3 6214 B12R1.308 NCCC(c1ccccc1Cl)C Amb17234048 [0,2,0,0,0,0|1,0,0]=3 6215 B12R1.308 NCCC(c1ccccc1Cl)O Amb17234259 [0,2,0,0,0,0|1,0,0]=3 6216 B12R1.308 NCCC(c1ccccc1F)C Amb17232646 [0,2,0,0,0,0|1,0,0]=3 6217 B12R1.308 NCCC(c1ccccc1F)O Amb17232696 [0,2,0,0,0,0|1,0,0]=3 6218 B12R1.308 NCCN(c1ccccc1Br)C Amb17059772 [0,2,0,0,0,0|2,0,0]=4 6219 B12R1.308 NCCN(c1ccccc1C)C Amb17059640 [0,2,0,0,0,0|2,0,0]=4 6220 B12R1.308 NCCN(c1ccccc1Cl)C Amb17059645 [0,2,0,0,0,0|2,0,0]=4 6221 B12R1.308 NCCN(c1ccccc1F)C Amb17059642 [0,2,0,0,0,0|2,0,0]=4 6222 B12R1.308 NCCS(=O)c1ccccc1Br Amb18290922 [0,2,0,0,0,0|2,0,0]=4 6223 B12R1.308 NCCS(=O)c1ccccc1Cl Amb18290916 [0,2,0,0,0,0|2,0,0]=4 6224 B12R1.308 NCCS(=O)c1ccccc1F Amb18974522 [0,2,0,0,0,0|2,0,0]=4 6225 B12R1.308 NCCS(=O)c1ccccc1F Amb19373859 [0,2,0,0,0,0|2,0,0]=4 6226 B12R1.308 NCC[C@@H](N)c1ccc[n]c1Cl Amb24656060 [0,2,0,0,0,0|2,0,0]=4 6227 B12R1.308 NCC[C@@H](N)c1ccccc1Br Amb24580692 [0,2,0,0,0,0|1,0,0]=3 6228 B12R1.308 NCC[C@@H](N)c1ccccc1F Amb24744679 [0,2,0,0,0,0|1,0,0]=3 6229 B12R1.308 NCC[C@@H](N)c1ccccc1O Amb24568021 [0,2,0,0,0,0|1,0,0]=3 6230 B12R1.308 NCC[C@H](N)c1cc[n]cc1Cl Amb25366616 [0,2,0,0,0,0|2,0,0]=4 6231 B12R1.308 NCC[C@H](N)c1ccccc1F Amb25339749 [0,2,0,0,0,0|1,0,0]=3 6232 B12R1.308 NNCC(O)c1ccccc1Br Amb18070085 [0,2,0,0,0,0|0,0,0]=2 6233 B12R1.308 NNCC(c1ccccc1C)O Amb17232608 [0,2,0,0,0,0|0,0,0]=2 6234 B12R1.308 NNCC(c1ccccc1Cl)O Amb17234360 [0,2,0,0,0,0|0,0,0]=2 6235 B12R1.308 NNCC(c1ccccc1F)O Amb17232742 [0,2,0,0,0,0|0,0,0]=2 6236 B12R1.308 N[C@@H](CC#N)c1ccccc1Cl Amb24580663 [0,2,0,0,0,0|1,0,1]=4 6237 B12R1.308 N[C@@H](CC#N)c1ccccc1S Amb24417746 [0,2,0,0,0,0|1,0,1]=4 6238 B12R1.308 N[C@@H](CCO)c1ccccc1Br Amb25140602 [0,2,0,0,0,0|2,0,0]=4 6239 B12R1.308 N[C@@H](CCO)c1ccccc1Cl Amb19888408 [0,2,0,0,0,0|2,0,0]=4 6240 B12R1.308 N[C@@H](CCO)c1ccccc1S Amb25791527 [0,2,0,0,0,0|2,0,0]=4 6241 B12R1.308 N[C@H](CC#N)c1ccccc1Br Amb24727021 [0,2,0,0,0,0|1,0,1]=4 6242 B12R1.308 N[C@H](CC#N)c1ccccc1I Amb25778122 [0,2,0,0,0,0|1,0,1]=4 6243 B12R1.308 N[C@H](CC#N)c1ccccc1O Amb24588659 [0,2,0,0,0,0|1,0,1]=4 6244 B12R1.308 N[C@H](CC#N)c1ccccc1S Amb24465056 [0,2,0,0,0,0|1,0,1]=4 6245 B12R1.308 N[C@H](CCO)c1ccccc1Br Amb25301240 [0,2,0,0,0,0|2,0,0]=4 6246 B12R1.308 N[C@H](CCO)c1ccccc1Cl Amb19887650 [0,2,0,0,0,0|2,0,0]=4 6247 B12R1.308 N[C@H](CCO)c1ccccc1S Amb25694372 [0,2,0,0,0,0|2,0,0]=4 6248 B12R1.308 Nc1[n]cccc1C(O)CCN Amb24525118 [0,2,0,0,0,0|2,0,0]=4 6249 B12R1.308 Nc1ccccc1C(=O)CCN Amb21855941 [0,2,0,0,0,0|1,0,1]=4 6250 B12R1.308 Nc1ccccc1C(=O)CCN Amb22350218 [0,2,0,0,0,0|1,0,1]=4 6251 B12R1.308 Nc1ccccc1C(N)CCO Amb22235813 [0,2,0,0,0,0|2,0,0]=4 6252 B12R1.308 Nc1ccccc1[C@H](N)CC#N Amb25714152 [0,2,0,0,0,0|1,0,1]=4 6253 B12R1.308 Nc1ccccc1[C@H](N)CCO Amb19887576 [0,2,0,0,0,0|2,0,0]=4 6254 B12R1.308 OC(CCCl)c1ccccc1Cl Amb25159575 [0,2,0,0,0,0|2,0,0]=4 6255 B12R1.308 OCCC(O)c1ccccc1Br Amb24668754 [0,2,0,0,0,0|2,0,0]=4 6256 B12R1.308 OCCC(O)c1ccccc1Cl Amb25275717 [0,2,0,0,0,0|2,0,0]=4 6257 B12R1.308 OCCC(O)c1ccccc1F Amb24649873 [0,2,0,0,0,0|2,0,0]=4 6258 B12R1.308 OCCC(c1ccccc1C)C Amb17232499 [0,2,0,0,0,0|2,0,0]=4 6259 B12R1.308 OCCC(c1ccccc1C)N Amb17103953 [0,2,0,0,0,0|2,0,0]=4 6260 B12R1.308 OCCC(c1ccccc1Cl)C Amb17234164 [0,2,0,0,0,0|2,0,0]=4 6261 B12R1.308 OCCC(c1ccccc1Cl)N Amb1993960 [0,2,0,0,0,0|2,0,0]=4 6262 B12R1.308 OCCC(c1ccccc1F)C Amb17232671 [0,2,0,0,0,0|2,0,0]=4 6263 B12R1.308 OCCC(c1ccccc1F)N Amb2408130 [0,2,0,0,0,0|2,0,0]=4 6264 B12R1.308 OCC[C@@H](O)c1ccccc1F Amb25308216 [0,2,0,0,0,0|2,0,0]=4 6265 B12R1.308 OCC[C@H](O)c1ccccc1Br Amb24385097 [0,2,0,0,0,0|2,0,0]=4 6266 B12R1.308 OCC[C@H](O)c1ccccc1Cl Amb24748463 [0,2,0,0,0,0|2,0,0]=4 6267 B12R1.308 OCC[C@H](O)c1ccccc1F Amb25353877 [0,2,0,0,0,0|2,0,0]=4 6268 B12R1.308 ONCC(c1ccccc1C)O Amb17334702 [0,2,0,0,0,0|1,0,0]=3 6269 B12R1.308 ONCC(c1ccccc1Cl)O Amb17335947 [0,2,0,0,0,0|1,0,0]=3 6270 B12R1.308 ONCC(c1ccccc1F)O Amb17334837 [0,2,0,0,0,0|1,0,0]=3 6271 B12R1.308 [C-]#[N+]CC(F)c1ccccc1Br Amb24743648 [0,2,0,0,0,0|1,0,1]=4 6272 B12R1.308 [C-]#[N+]CC(F)c1ccccc1Cl Amb25217280 [0,2,0,0,0,0|1,0,1]=4 6273 B12R1.308 [C-]#[N+]CC(F)c1ccccc1O Amb24654120 [0,2,0,0,0,0|1,0,1]=4 6274 B12R1.25 C=CCCc1cccc(Cl)c1Cl Amb25363988 [0,2,0,0,0,0|2,0,0]=4 6275 B12R1.25 C=CCCc1cccc(Cl)c1F Amb24411459 [0,2,0,0,0,0|2,0,0]=4 6276 B12R1.25 C=CCCc1cccc(F)c1F Amb24663845 [0,2,0,0,0,0|2,0,0]=4 6277 B12R1.25 CC1=CC=CN(CCCN)C1=O Amb18535491 [0,2,0,0,0,0|2,0,0]=4 6278 B12R1.25 CCCCc1cccc(Cl)c1O Amb24584452 [0,2,0,0,0,0|2,0,0]=4 6279 B12R1.25 CCCCc1cccc(F)c1N Amb25842564 [0,2,0,0,0,0|2,0,0]=4 6280 B12R1.25 CCCCc1cccc(N)c1Cl Amb22229240 [0,2,0,0,0,0|2,0,0]=4 6281 B12R1.25 CNCCc1cc[n]c(C)c1C Amb25217117 [0,2,0,0,0,0|2,0,0]=4 6282 B12R1.25 CNCCc1cccc(Br)c1F Amb25159686 [0,2,0,0,0,0|1,0,0]=3 6283 B12R1.25 CNCCc1cccc(Cl)c1Cl Amb24460400 [0,2,0,0,0,0|1,0,0]=3 6284 B12R1.25 CNCCc1cccc(Cl)c1F Amb24407330 [0,2,0,0,0,0|1,0,0]=3 6285 B12R1.25 CNCCc1cccc(F)c1Br Amb25291460 [0,2,0,0,0,0|1,0,0]=3 6286 B12R1.25 CNCCc1cccc(F)c1F Amb18993051 [0,2,0,0,0,0|1,0,0]=3 6287 B12R1.25 CNCCc1cccc(O)c1Br Amb25331885 [0,2,0,0,0,0|1,0,0]=3 6288 B12R1.25 CNCCc1cccc(O)c1Cl Amb24497424 [0,2,0,0,0,0|1,0,0]=3 6289 B12R1.25 CNCCc1cccc(O)c1F Amb25080086 [0,2,0,0,0,0|1,0,0]=3 6290 B12R1.25 CNCCc1cccc(O)c1O Amb24664300 [0,2,0,0,0,0|1,0,0]=3 6291 B12R1.25 CSCCc1cccc(Cl)c1Cl Amb24632980 [0,2,0,0,0,0|2,0,0]=4 6292 B12R1.25 Cc1c(Br)cccc1CCCCl Amb24579173 [0,2,0,0,0,0|2,0,0]=4 6293 B12R1.25 Cc1c(CCC#N)cccc1C Amb17204304 [0,2,0,0,0,0|1,0,1]=4 6294 B12R1.25 Cc1c(CCC#N)cccc1Cl Amb17204322 [0,2,0,0,0,0|1,0,1]=4 6295 B12R1.25 Cc1c(CCCN)cccc1C Amb17204309 [0,2,0,0,0,0|1,0,0]=3 6296 B12R1.25 Cc1c(CCCN)cccc1Cl Amb17204335 [0,2,0,0,0,0|1,0,0]=3 6297 B12R1.25 Cc1c(CCNN)cccc1C Amb17400169 [0,2,0,0,0,0|0,0,0]=2 6298 B12R1.25 Cc1c(Cl)c[n]cc1CCCN Amb24438422 [0,2,0,0,0,0|2,0,0]=4 6299 B12R1.25 Cc1c(Cl)cc[n]c1CCCN Amb25842554 [0,2,0,0,0,0|2,0,0]=4 6300 B12R1.25 Cc1c(Cl)cccc1CCC=O Amb18564226 [0,2,0,0,0,0|2,0,0]=4 6301 B12R1.25 Cc1c(Cl)cccc1CCCO Amb23537657 [0,2,0,0,0,0|2,0,0]=4 6302 B12R1.25 Cc1c(F)cccc1CCC#N Amb25224723 [0,2,0,0,0,0|1,0,1]=4 6303 B12R1.25 Cc1c(F)cccc1CCC=O Amb25299267 [0,2,0,0,0,0|2,0,0]=4 6304 B12R1.25 Cc1c(F)cccc1CCCN Amb23442800 [0,2,0,0,0,0|1,0,0]=3 6305 B12R1.25 Cc1c(F)cccc1CCCO Amb23590885 [0,2,0,0,0,0|2,0,0]=4 6306 B12R1.25 Cc1c(NCCN)cccc1C Amb17091054 [0,2,0,0,0,0|2,0,0]=4 6307 B12R1.25 Cc1c(NCCN)cccc1Cl Amb17091057 [0,2,0,0,0,0|2,0,0]=4 6308 B12R1.25 Cc1c(O)cccc1CCC#N Amb24527961 [0,2,0,0,0,0|1,0,1]=4 6309 B12R1.25 Cc1c(OCCN)cccc1C Amb1138513 [0,2,0,0,0,0|2,0,0]=4 6310 B12R1.25 Cc1c(OCCN)cccc1C Amb2091065 [0,2,0,0,0,0|2,0,0]=4 6311 B12R1.25 Cc1c(cccc1Br)NCCN Amb24654407 [0,2,0,0,0,0|2,0,0]=4 6312 B12R1.25 Cc1c(cccc1Br)OCCN Amb24395348 [0,2,0,0,0,0|2,0,0]=4 6313 B12R1.25 Cc1c(cccc1Cl)OCCN Amb24454848 [0,2,0,0,0,0|2,0,0]=4 6314 B12R1.25 Cc1c(cccc1F)NCCN Amb18251978 [0,2,0,0,0,0|2,0,0]=4 6315 B12R1.25 Cc1c(cccc1N)NCCN Amb19002501 [0,2,0,0,0,0|2,0,0]=4 6316 B12R1.25 Cc1c[n]cc(CCCN)c1C Amb24682311 [0,2,0,0,0,0|2,0,0]=4 6317 B12R1.25 Cc1c[n]cc(CCCN)c1F Amb25797431 [0,2,0,0,0,0|2,0,0]=4 6318 B12R1.25 Cc1cccc(CCC=O)c1Br Amb24532658 [0,2,0,0,0,0|2,0,0]=4 6319 B12R1.25 Cc1cccc(CCC=O)c1C Amb18563554 [0,2,0,0,0,0|2,0,0]=4 6320 B12R1.25 Cc1cccc(CCC=O)c1F Amb24093002 [0,2,0,0,0,0|2,0,0]=4 6321 B12R1.25 Cc1cccc(CCCBr)c1Br Amb25248971 [0,2,0,0,0,0|2,0,0]=4 6322 B12R1.25 Cc1cccc(CCCBr)c1O Amb25269813 [0,2,0,0,0,0|2,0,0]=4 6323 B12R1.25 Cc1cccc(CCCBr)c1S Amb25195138 [0,2,0,0,0,0|2,0,0]=4 6324 B12R1.25 Cc1cccc(CCCC)c1N Amb24104100 [0,2,0,0,0,0|2,0,0]=4 6325 B12R1.25 Cc1cccc(CCCC)c1O Amb25669631 [0,2,0,0,0,0|2,0,0]=4 6326 B12R1.25 Cc1cccc(CCCCl)c1Cl Amb24656579 [0,2,0,0,0,0|2,0,0]=4 6327 B12R1.25 Cc1cccc(CCCCl)c1O Amb25139391 [0,2,0,0,0,0|2,0,0]=4 6328 B12R1.25 Cc1cccc(CCCN)c1Cl Amb25677548 [0,2,0,0,0,0|1,0,0]=3 6329 B12R1.25 Cc1cccc(CCCN)c1F Amb25135172 [0,2,0,0,0,0|1,0,0]=3 6330 B12R1.25 Cc1cccc(CCCO)c1Br Amb25159971 [0,2,0,0,0,0|2,0,0]=4 6331 B12R1.25 Cc1cccc(CCCO)c1C Amb23537989 [0,2,0,0,0,0|2,0,0]=4 6332 B12R1.25 Cc1cccc(CCCO)c1O Amb24671286 [0,2,0,0,0,0|2,0,0]=4 6333 B12R1.25 Cc1cccc(CCNC)c1C Amb18993611 [0,2,0,0,0,0|1,0,0]=3 6334 B12R1.25 Cc1cccc(CCNC)c1F Amb25069543 [0,2,0,0,0,0|1,0,0]=3 6335 B12R1.25 Cc1cccc(NCCN)c1F Amb25684079 [0,2,0,0,0,0|2,0,0]=4 6336 B12R1.25 Cc1cccc(OCCN)c1Cl Amb24447813 [0,2,0,0,0,0|2,0,0]=4 6337 B12R1.25 Cc1cccc(SCCN)c1N Amb25133561 [0,2,0,0,0,0|2,0,0]=4 6338 B12R1.25 ClCCCc1cccc(Cl)c1Cl Amb24367464 [0,2,0,0,0,0|2,0,0]=4 6339 B12R1.25 ClCCCc1cccc(I)c1Br Amb25208583 [0,2,0,0,0,0|2,0,0]=4 6340 B12R1.25 ClCCCc1cccc(I)c1I Amb25249930 [0,2,0,0,0,0|2,0,0]=4 6341 B12R1.25 Clc1c(CCC#N)cccc1Cl Amb17204388 [0,2,0,0,0,0|1,0,1]=4 6342 B12R1.25 Clc1c(I)cccc1CCCBr Amb24656429 [0,2,0,0,0,0|2,0,0]=4 6343 B12R1.25 Clc1cccc(CCCBr)c1Cl Amb24730274 [0,2,0,0,0,0|2,0,0]=4 6344 B12R1.25 Fc1cccc(CCCBr)c1Br Amb25039114 [0,2,0,0,0,0|2,0,0]=4 6345 B12R1.25 Fc1cccc(CCCBr)c1F Amb22001598 [0,2,0,0,0,0|2,0,0]=4 6346 B12R1.25 Fc1cccc(CCCCl)c1Br Amb24566065 [0,2,0,0,0,0|2,0,0]=4 6347 B12R1.25 Fc1cccc(CCCCl)c1F Amb19073202 [0,2,0,0,0,0|2,0,0]=4 6348 B12R1.25 Fc1cccc(CCCCl)c1S Amb24712667 [0,2,0,0,0,0|2,0,0]=4 6349 B12R1.25 N#CCCc1cccc(Br)c1I Amb24656655 [0,2,0,0,0,0|1,0,1]=4 6350 B12R1.25 N#CCCc1cccc(Br)c1O Amb24586533 [0,2,0,0,0,0|1,0,1]=4 6351 B12R1.25 N#CCCc1cccc(F)c1Br Amb25258746 [0,2,0,0,0,0|1,0,1]=4 6352 B12R1.25 N#CCCc1cccc(F)c1Cl Amb24751316 [0,2,0,0,0,0|1,0,1]=4 6353 B12R1.25 N#CCCc1cccc(O)c1O Amb24497134 [0,2,0,0,0,0|1,0,1]=4 6354 B12R1.25 N#CCCc1cccc(S)c1F Amb25254634 [0,2,0,0,0,0|1,0,1]=4 6355 B12R1.25 N#CCCc1cccc(S)c1I Amb24567236 [0,2,0,0,0,0|1,0,1]=4 6356 B12R1.25 N=CCCc1cccc(O)c1O Amb25713589 [0,2,0,0,0,0|1,0,1]=4 6357 B12R1.25 NCCCN1C=CC=C(Br)C1=O Amb18040597 [0,2,0,0,0,0|2,0,0]=4 6358 B12R1.25 NCCCc1c[n]cc(Cl)c1F Amb24679665 [0,2,0,0,0,0|2,0,0]=4 6359 B12R1.25 NCCCc1c[n]cc(Cl)c1O Amb24367850 [0,2,0,0,0,0|2,0,0]=4 6360 B12R1.25 NCCCc1c[n]cc(F)c1Cl Amb24454653 [0,2,0,0,0,0|2,0,0]=4 6361 B12R1.25 NCCCc1c[n]cc(O)c1Cl Amb24403092 [0,2,0,0,0,0|2,0,0]=4 6362 B12R1.25 NCCCc1cccc(Br)c1O Amb25738591 [0,2,0,0,0,0|1,0,0]=3 6363 B12R1.25 NCCCc1cccc(Cl)c1Br Amb25320523 [0,2,0,0,0,0|1,0,0]=3 6364 B12R1.25 NCCCc1cccc(F)c1Br Amb25683566 [0,2,0,0,0,0|1,0,0]=3 6365 B12R1.25 NCCCc1cccc(O)c1O Amb24426748 [0,2,0,0,0,0|1,0,0]=3 6366 B12R1.25 NCCCc1cccc(c1Cl)Cl Amb17204407 [0,2,0,0,0,0|1,0,0]=3 6367 B12R1.25 NCCNc1cccc(Cl)c1F Amb18909782 [0,2,0,0,0,0|2,0,0]=4 6368 B12R1.25 NCCNc1cccc(F)c1F Amb18908891 [0,2,0,0,0,0|2,0,0]=4 6369 B12R1.25 NCCNc1cccc(F)c1I Amb25723571 [0,2,0,0,0,0|2,0,0]=4 6370 B12R1.25 NCCNc1cccc(c1Cl)Cl Amb17091084 [0,2,0,0,0,0|2,0,0]=4 6371 B12R1.25 NCCOc1cccc(Br)c1F Amb25841484 [0,2,0,0,0,0|2,0,0]=4 6372 B12R1.25 NCCOc1cccc(Cl)c1Br Amb24686813 [0,2,0,0,0,0|2,0,0]=4 6373 B12R1.25 NCCOc1cccc(Cl)c1F Amb25330890 [0,2,0,0,0,0|2,0,0]=4 6374 B12R1.25 NCCOc1cccc(F)c1F Amb19002179 [0,2,0,0,0,0|2,0,0]=4 6375 B12R1.25 NCCOc1cccc(c1Cl)Cl Amb10609908 [0,2,0,0,0,0|2,0,0]=4 6376 B12R1.25 NNCCc1cccc(Cl)c1Cl Amb24751331 [0,2,0,0,0,0|0,0,0]=2 6377 B12R1.25 NNCCc1cccc(Cl)c1F Amb24655836 [0,2,0,0,0,0|0,0,0]=2 6378 B12R1.25 NNCCc1cccc(F)c1Cl Amb25342054 [0,2,0,0,0,0|0,0,0]=2 6379 B12R1.25 NOCCc1cccc(F)c1F Amb24497503 [0,2,0,0,0,0|1,0,0]=3 6380 B12R1.25 Nc1c(Br)cccc1NCCN Amb25071760 [0,2,0,0,0,0|2,0,0]=4 6381 B12R1.25 Nc1c(CCCBr)cccc1Br Amb25270390 [0,2,0,0,0,0|2,0,0]=4 6382 B12R1.25 Nc1c(Cl)cccc1CCC=O Amb24743856 [0,2,0,0,0,0|2,0,0]=4 6383 B12R1.25 Nc1c(Cl)cccc1CCCBr Amb25208690 [0,2,0,0,0,0|2,0,0]=4 6384 B12R1.25 Nc1c(Cl)cccc1NCCN Amb24671070 [0,2,0,0,0,0|2,0,0]=4 6385 B12R1.25 Nc1c(F)cccc1NCCN Amb18991513 [0,2,0,0,0,0|2,0,0]=4 6386 B12R1.25 Nc1c(F)cccc1OCCN Amb24685005 [0,2,0,0,0,0|2,0,0]=4 6387 B12R1.25 Nc1c(I)cccc1CCC=O Amb25249914 [0,2,0,0,0,0|2,0,0]=4 6388 B12R1.25 Nc1c(O)cccc1CCC#N Amb25239491 [0,2,0,0,0,0|1,0,1]=4 6389 B12R1.25 Nc1c(O)cccc1CCCCl Amb25208685 [0,2,0,0,0,0|2,0,0]=4 6390 B12R1.25 Nc1c(S)cccc1CCC=O Amb25242712 [0,2,0,0,0,0|2,0,0]=4 6391 B12R1.25 Nc1cccc(CCC#N)c1N Amb25312576 [0,2,0,0,0,0|1,0,1]=4 6392 B12R1.25 Nc1cccc(CCC#N)c1O Amb24579221 [0,2,0,0,0,0|1,0,1]=4 6393 B12R1.25 Nc1cccc(CCCBr)c1Cl Amb24574270 [0,2,0,0,0,0|2,0,0]=4 6394 B12R1.25 Nc1cccc(CCCBr)c1O Amb25195517 [0,2,0,0,0,0|2,0,0]=4 6395 B12R1.25 Nc1cccc(CCCCl)c1N Amb24695907 [0,2,0,0,0,0|2,0,0]=4 6396 B12R1.25 Nc1cccc(CCCCl)c1O Amb25253604 [0,2,0,0,0,0|2,0,0]=4 6397 B12R1.25 O=CCCc1cccc(Br)c1Cl Amb24483778 [0,2,0,0,0,0|2,0,0]=4 6398 B12R1.25 O=CCCc1cccc(Br)c1F Amb25739079 [0,2,0,0,0,0|2,0,0]=4 6399 B12R1.25 O=CCCc1cccc(Br)c1S Amb25270364 [0,2,0,0,0,0|2,0,0]=4 6400 B12R1.25 O=CCCc1cccc(Cl)c1Br Amb25856957 [0,2,0,0,0,0|2,0,0]=4 6401 B12R1.25 O=CCCc1cccc(Cl)c1Cl Amb18066576 [0,2,0,0,0,0|2,0,0]=4 6402 B12R1.25 O=CCCc1cccc(F)c1F Amb18801722 [0,2,0,0,0,0|2,0,0]=4 6403 B12R1.25 O=CCCc1cccc(I)c1F Amb25148788 [0,2,0,0,0,0|2,0,0]=4 6404 B12R1.25 OCCCc1cccc(Cl)c1F Amb24402092 [0,2,0,0,0,0|2,0,0]=4 6405 B12R1.25 OCCCc1cccc(F)c1Br Amb25834826 [0,2,0,0,0,0|2,0,0]=4 6406 B12R1.25 OCCCc1cccc(F)c1Cl Amb25136399 [0,2,0,0,0,0|2,0,0]=4 6407 B12R1.25 OCCCc1cccc(F)c1F Amb18802844 [0,2,0,0,0,0|2,0,0]=4 6408 B12R1.25 OCCCc1cccc(O)c1O Amb25063876 [0,2,0,0,0,0|2,0,0]=4 6409 B12R1.25 OCCCc1cccc(c1Cl)Cl Amb17605780 [0,2,0,0,0,0|2,0,0]=4 6410 B12R1.25 Oc1c(Br)cccc1CCC=O Amb24728306 [0,2,0,0,0,0|2,0,0]=4 6411 B12R1.25 Oc1c(Br)cccc1CCCCl Amb25364541 [0,2,0,0,0,0|2,0,0]=4 6412 B12R1.25 Oc1c(Cl)cccc1CCCBr Amb24759296 [0,2,0,0,0,0|2,0,0]=4 6413 B12R1.25 Oc1c(Cl)cccc1CCCO Amb25098650 [0,2,0,0,0,0|2,0,0]=4 6414 B12R1.25 Oc1c(F)cccc1CCCO Amb24551042 [0,2,0,0,0,0|2,0,0]=4 6415 B12R1.25 Oc1c(I)cccc1CCCBr Amb24527854 [0,2,0,0,0,0|2,0,0]=4 6416 B12R1.25 Oc1c(S)cccc1CCCBr Amb24696726 [0,2,0,0,0,0|2,0,0]=4 6417 B12R1.25 Oc1c(S)cccc1CCCCl Amb24628082 [0,2,0,0,0,0|2,0,0]=4 6418 B12R1.25 Oc1cccc(CCC=O)c1F Amb25831101 [0,2,0,0,0,0|2,0,0]=4 6419 B12R1.25 Oc1cccc(CCCBr)c1Br Amb25325193 [0,2,0,0,0,0|2,0,0]=4 6420 B12R1.25 Oc1cccc(CCCBr)c1F Amb24679117 [0,2,0,0,0,0|2,0,0]=4 6421 B12R1.25 Oc1cccc(CCCBr)c1I Amb24527846 [0,2,0,0,0,0|2,0,0]=4 6422 B12R1.25 Oc1cccc(CCCCl)c1Br Amb24638371 [0,2,0,0,0,0|2,0,0]=4 6423 B12R1.25 Sc1c(I)cccc1CCCBr Amb24758199 [0,2,0,0,0,0|2,0,0]=4 6424 B12R1.25 Sc1cccc(CCCBr)c1S Amb25351784 [0,2,0,0,0,0|2,0,0]=4 6425 B12R1.121 C#CCCc1ccccc1C#N Amb18118066 [0,2,0,0,0,0|2,0,0]=4 6426 B12R1.121 C#CCCc1ccccc1CO Amb24069017 [0,2,0,0,0,0|2,0,0]=4 6427 B12R1.121 C#Cc1ccccc1CCC=O Amb24422382 [0,2,0,0,0,0|2,0,0]=4 6428 B12R1.121 C=CCCc1ccccc1CO Amb24069012 [0,2,0,0,0,0|2,0,0]=4 6429 B12R1.121 CCc1ccccc1NCCN Amb24513622 [0,2,0,0,0,0|2,0,0]=4 6430 B12R1.121 CNc1cc[n]cc1CCCN Amb25207863 [0,2,0,0,0,0|2,0,0]=4 6431 B12R1.121 CNc1ccccc1CCOC Amb24448428 [0,2,0,0,0,0|2,0,0]=4 6432 B12R1.121 COCCc1ccccc1CO Amb24069010 [0,2,0,0,0,0|2,0,0]=4 6433 B12R1.121 COCCc1ccccc1NN Amb24676071 [0,2,0,0,0,0|2,0,0]=4 6434 B12R1.121 COCCc1ccccc1[N+]#N Amb25118976 [0,2,0,0,0,0|2,0,0]=4 6435 B12R1.121 COc1ccccc1CCC#C Amb18636005 [0,2,0,0,0,0|2,0,0]=4 6436 B12R1.121 COc1ccccc1CCON Amb22896636 [0,2,0,0,0,0|1,0,0]=3 6437 B12R1.121 COc1ccccc1OCCN Amb20241252 [0,2,0,0,0,0|2,0,0]=4 6438 B12R1.121 COc1ccccc1SCCN Amb19024665 [0,2,0,0,0,0|2,0,0]=4 6439 B12R1.121 CSc1ccccc1CCC#N Amb25239192 [0,2,0,0,0,0|1,0,1]=4 6440 B12R1.121 CSc1ccccc1OCCN Amb22523348 [0,2,0,0,0,0|2,0,0]=4 6441 B12R1.121 ClCCCc1ccccc1OC Amb17104531 [0,2,0,0,0,0|2,0,0]=4 6442 B12R1.121 N#CCCc1ccccc1C#N Amb17593908 [0,2,0,0,0,0|1,0,1]=4 6443 B12R1.121 N#CCCc1ccccc1CO Amb24591065 [0,2,0,0,0,0|1,0,1]=4 6444 B12R1.121 N#CCCc1ccccc1OC Amb17508974 [0,2,0,0,0,0|1,0,1]=4 6445 B12R1.121 N#Cc1ccccc1CCC=O Amb25685434 [0,2,0,0,0,0|2,0,0]=4 6446 B12R1.121 NCCCc1ccccc1C#N Amb18251586 [0,2,0,0,0,0|1,0,0]=3 6447 B12R1.121 NCCNc1ccccc1C#N Amb17933166 [0,2,0,0,0,0|2,0,0]=4 6448 B12R1.121 NCCNc1ccccc1C#N Amb18289758 [0,2,0,0,0,0|2,0,0]=4 6449 B12R1.121 NCCNc1ccccc1OC Amb17057753 [0,2,0,0,0,0|2,0,0]=4 6450 B12R1.121 NCCOc1ccccc1C#N Amb17740016 [0,2,0,0,0,0|2,0,0]=4 6451 B12R1.121 NCCOc1ccccc1OC Amb1210085 [0,2,0,0,0,0|2,0,0]=4 6452 B12R1.121 NCCSc1ccccc1C#N Amb18909080 [0,2,0,0,0,0|2,0,0]=4 6453 B12R1.121 NCc1ccccc1CCCBr Amb24099890 [0,2,0,0,0,0|2,0,0]=4 6454 B12R1.121 O=CCCc1ccccc1CCl Amb24092985 [0,2,0,0,0,0|2,0,0]=4 6455 B12R1.121 O=CCCc1ccccc1OC Amb17081677 [0,2,0,0,0,0|2,0,0]=4 6456 B12R1.121 SCCCc1ccccc1OC Amb17400949 [0,2,0,0,0,0|2,0,0]=4 6457 B12R1.125 CC(=O)CCc1ccccc1O Amb17507153 [0,2,0,0,0,0|2,0,0]=4 6458 B12R1.125 CC(Br)CCc1ccccc1Br Amb24488694 [0,2,0,0,0,0|2,0,0]=4 6459 B12R1.125 CC(CCc1ccccc1N)C Amb13951566 [0,2,0,0,0,0|2,0,0]=4 6460 B12R1.125 CC(CCc1ccccc1O)N Amb17507315 [0,2,0,0,0,0|1,0,0]=3 6461 B12R1.125 CC(CCc1ccccc1O)O Amb17507249 [0,2,0,0,0,0|2,0,0]=4 6462 B12R1.125 CC(COc1ccccc1Br)N Amb17062516 [0,2,0,0,0,0|2,0,0]=4 6463 B12R1.125 CC(COc1ccccc1C)N Amb1124829 [0,2,0,0,0,0|2,0,0]=4 6464 B12R1.125 CC(COc1ccccc1F)N Amb1134402 [0,2,0,0,0,0|2,0,0]=4 6465 B12R1.125 CC(Cl)CCc1ccccc1Br Amb24488697 [0,2,0,0,0,0|2,0,0]=4 6466 B12R1.125 CC(Cl)CCc1ccccc1F Amb19076400 [0,2,0,0,0,0|2,0,0]=4 6467 B12R1.125 CC(F)CCc1ccccc1N Amb25212968 [0,2,0,0,0,0|2,0,0]=4 6468 B12R1.125 CC(N)CCc1[n]cccc1Br Amb24462438 [0,2,0,0,0,0|2,0,0]=4 6469 B12R1.125 CC(N)CCc1c[n]ccc1N Amb25669485 [0,2,0,0,0,0|2,0,0]=4 6470 B12R1.125 CC(N)CCc1ccc[n]c1N Amb24399078 [0,2,0,0,0,0|2,0,0]=4 6471 B12R1.125 CC(N)CCc1ccccc1N Amb18646140 [0,2,0,0,0,0|1,0,0]=3 6472 B12R1.125 CC(N)COc1ccccc1I Amb25095421 [0,2,0,0,0,0|2,0,0]=4 6473 B12R1.125 CC(N)CSc1ccccc1Cl Amb25696792 [0,2,0,0,0,0|2,0,0]=4 6474 B12R1.125 CC(N)CSc1ccccc1F Amb24597976 [0,2,0,0,0,0|2,0,0]=4 6475 B12R1.125 CC(N)CSc1ccccc1N Amb18648678 [0,2,0,0,0,0|2,0,0]=4 6476 B12R1.125 CC(N)CSc1ccccc1O Amb25816545 [0,2,0,0,0,0|2,0,0]=4 6477 B12R1.125 CC(O)CCc1ccccc1Br Amb25763352 [0,2,0,0,0,0|2,0,0]=4 6478 B12R1.125 CC(O)CCc1ccccc1Cl Amb19075162 [0,2,0,0,0,0|2,0,0]=4 6479 B12R1.125 CC(O)CCc1ccccc1F Amb18805845 [0,2,0,0,0,0|2,0,0]=4 6480 B12R1.125 CC(O)CCc1ccccc1N Amb24485690 [0,2,0,0,0,0|2,0,0]=4 6481 B12R1.125 CN(C)CCc1[n]cccc1N Amb24579243 [0,2,0,0,0,0|2,0,0]=4 6482 B12R1.125 CN(C)CCc1[n]cccc1O Amb24062583 [0,2,0,0,0,0|2,0,0]=4 6483 B12R1.125 CN(C)CCc1c[n]ccc1Br Amb25148756 [0,2,0,0,0,0|2,0,0]=4 6484 B12R1.125 CN(C)CCc1ccccc1Br Amb25795341 [0,2,0,0,0,0|1,0,0]=3 6485 B12R1.125 CN(C)CCc1ccccc1O Amb25066330 [0,2,0,0,0,0|1,0,0]=3 6486 B12R1.125 CN(C)NCc1ccccc1Br Amb25817248 [0,2,0,0,0,0|2,0,0]=4 6487 B12R1.125 CN(C)NCc1ccccc1Cl Amb24493089 [0,2,0,0,0,0|2,0,0]=4 6488 B12R1.125 CN(C)NCc1ccccc1N Amb18646396 [0,2,0,0,0,0|2,0,0]=4 6489 B12R1.125 CN(N)CCc1ccccc1Cl Amb18564316 [0,2,0,0,0,0|0,0,0]=2 6490 B12R1.125 CN(N)CCc1ccccc1F Amb18563850 [0,2,0,0,0,0|0,0,0]=2 6491 B12R1.125 CS(=O)CCc1ccccc1N Amb18299124 [0,2,0,0,0,0|2,0,0]=4 6492 B12R1.125 C[C@@H](COc1ccccc1Br)N Amb17248850 [0,2,0,0,0,0|2,0,0]=4 6493 B12R1.125 C[C@@H](COc1ccccc1C)N Amb17232557 [0,2,0,0,0,0|2,0,0]=4 6494 B12R1.125 C[C@@H](COc1ccccc1Cl)N Amb17234270 [0,2,0,0,0,0|2,0,0]=4 6495 B12R1.125 C[C@@H](COc1ccccc1F)N Amb17232706 [0,2,0,0,0,0|2,0,0]=4 6496 B12R1.125 C[C@@H](N)CCc1ccccc1Cl Amb24117939 [0,2,0,0,0,0|1,0,0]=3 6497 B12R1.125 C[C@@H](N)COc1ccccc1Br Amb18036081 [0,2,0,0,0,0|2,0,0]=4 6498 B12R1.125 C[C@@H](N)COc1ccccc1Cl Amb18538518 [0,2,0,0,0,0|2,0,0]=4 6499 B12R1.125 C[C@@H](N)COc1ccccc1F Amb18538499 [0,2,0,0,0,0|2,0,0]=4 6500 B12R1.125 C[C@H](N)CCc1ccccc1Cl Amb24470862 [0,2,0,0,0,0|1,0,0]=3 6501 B12R1.125 C[C@H](N)CCc1ccccc1O Amb25149919 [0,2,0,0,0,0|1,0,0]=3 6502 B12R1.125 C[C@H](N)CSc1ccccc1Br Amb24608778 [0,2,0,0,0,0|2,0,0]=4 6503 B12R1.125 C[C@H](N)CSc1ccccc1Cl Amb25825016 [0,2,0,0,0,0|2,0,0]=4 6504 B12R1.125 C\C(\N)=N\Cc1ccccc1O Amb24734749 [0,2,0,0,0,0|2,0,0]=4 6505 B12R1.125 Cc1ccccc1CCC(=O)Cl Amb19066206 [0,2,0,0,0,0|2,0,0]=4 6506 B12R1.125 Cc1ccccc1CCC(C)Cl Amb19074258 [0,2,0,0,0,0|2,0,0]=4 6507 B12R1.125 Cc1ccccc1CCC(C)O Amb18800836 [0,2,0,0,0,0|2,0,0]=4 6508 B12R1.125 Cc1ccccc1CCC(N)=N Amb18065464 [0,2,0,0,0,0|1,0,0]=3 6509 B12R1.125 Cc1ccccc1CCN(C)N Amb18563651 [0,2,0,0,0,0|0,0,0]=2 6510 B12R1.125 Cc1ccccc1CNC(N)=N Amb18798204 [0,2,0,0,0,0|2,0,0]=4 6511 B12R1.125 Cc1ccccc1CNC(N)=O Amb18800799 [0,2,0,0,0,0|2,0,0]=4 6512 B12R1.125 Cc1ccccc1CNC(N)=S Amb18796346 [0,2,0,0,0,0|2,0,0]=4 6513 B12R1.125 Cc1ccccc1COC(N)=O Amb25152446 [0,2,0,0,0,0|2,0,0]=4 6514 B12R1.125 Cc1ccccc1CSC(N)=N Amb20676054 [0,2,0,0,0,0|2,0,0]=4 6515 B12R1.125 Cc1ccccc1CSC(N)=N Amb22269917 [0,2,0,0,0,0|2,0,0]=4 6516 B12R1.125 Cc1ccccc1CSC(N)=N Amb25319198 [0,2,0,0,0,0|2,0,0]=4 6517 B12R1.125 Cc1ccccc1OC[C@@H](C)N Amb18538491 [0,2,0,0,0,0|2,0,0]=4 6518 B12R1.125 Cc1ccccc1SCC(N)=N Amb18181218 [0,2,0,0,0,0|2,0,0]=4 6519 B12R1.125 ClC(=O)CCc1ccccc1F Amb10838958 [0,2,0,0,0,0|2,0,0]=4 6520 B12R1.125 NC(=N)CCc1ccccc1Br Amb18070244 [0,2,0,0,0,0|1,0,0]=3 6521 B12R1.125 NC(=N)CCc1ccccc1Cl Amb10844871 [0,2,0,0,0,0|1,0,0]=3 6522 B12R1.125 NC(=N)CCc1ccccc1F Amb18563718 [0,2,0,0,0,0|1,0,0]=3 6523 B12R1.125 NC(=N)COc1ccccc1C Amb10610301 [0,2,0,0,0,0|2,0,0]=4 6524 B12R1.125 NC(=N)COc1ccccc1O Amb25326714 [0,2,0,0,0,0|2,0,0]=4 6525 B12R1.125 NC(=N)NCc1ccccc1F Amb18798757 [0,2,0,0,0,0|2,0,0]=4 6526 B12R1.125 NC(=N)NCc1ccccc1F Amb22828135 [0,2,0,0,0,0|2,0,0]=4 6527 B12R1.125 NC(=N)SCc1ccccc1Br Amb20676051 [0,2,0,0,0,0|2,0,0]=4 6528 B12R1.125 NC(=N)SCc1ccccc1Cl Amb20676043 [0,2,0,0,0,0|2,0,0]=4 6529 B12R1.125 NC(=N)SCc1ccccc1F Amb20675985 [0,2,0,0,0,0|2,0,0]=4 6530 B12R1.125 NC(=O)CCc1[n]cccc1O Amb25760722 [0,2,0,0,0,0|2,0,0]=4 6531 B12R1.125 NC(=O)CCc1ccccc1Br Amb11468216 [0,2,0,0,0,0|1,0,0]=3 6532 B12R1.125 NC(=O)CCc1ccccc1C Amb17400134 [0,2,0,0,0,0|1,0,0]=3 6533 B12R1.125 NC(=O)CCc1ccccc1Cl Amb2142514 [0,2,0,0,0,0|1,0,0]=3 6534 B12R1.125 NC(=O)CNc1ccccc1I Amb142128 [0,2,0,0,0,0|2,0,0]=4 6535 B12R1.125 NC(=O)COc1ccccc1Br Amb1174441 [0,2,0,0,0,0|2,0,0]=4 6536 B12R1.125 NC(=O)COc1ccccc1I Amb15712041 [0,2,0,0,0,0|2,0,0]=4 6537 B12R1.125 NC(=O)CSc1ccccc1Br Amb10189178 [0,2,0,0,0,0|2,0,0]=4 6538 B12R1.125 NC(=O)CSc1ccccc1N Amb1215630 [0,2,0,0,0,0|2,0,0]=4 6539 B12R1.125 NC(=O)CSc1ccccc1O Amb19045199 [0,2,0,0,0,0|2,0,0]=4 6540 B12R1.125 NC(=O)NCc1ccccc1Cl Amb2435051 [0,2,0,0,0,0|2,0,0]=4 6541 B12R1.125 NC(=O)NCc1ccccc1F Amb1141051 [0,2,0,0,0,0|2,0,0]=4 6542 B12R1.125 NC(=S)CCN1C=CC=CC1=O Amb18543668 [0,2,0,0,0,0|2,0,0]=4 6543 B12R1.125 NC(=S)CCc1ccccc1F Amb17234010 [0,2,0,0,0,0|1,0,0]=3 6544 B12R1.125 NC(=S)COc1ccccc1O Amb24663202 [0,2,0,0,0,0|2,0,0]=4 6545 B12R1.125 NC(=S)NCc1ccccc1Br Amb24451272 [0,2,0,0,0,0|2,0,0]=4 6546 B12R1.125 Nc1ccccc1CCC(O)=O Amb24118035 [0,2,0,0,0,0|2,0,0]=4 6547 B12R1.125 Nc1ccccc1CNC(N)=O Amb18957838 [0,2,0,0,0,0|2,0,0]=4 6548 B12R1.125 Nc1ccccc1OCC(N)=S Amb25329428 [0,2,0,0,0,0|2,0,0]=4 6549 B12R1.125 O=C(Cl)CCc1ccccc1Br Amb19888630 [0,2,0,0,0,0|2,0,0]=4 6550 B12R1.125 O=C(Cl)CCc1ccccc1Cl Amb25061965 [0,2,0,0,0,0|2,0,0]=4 6551 B12R1.125 OC(=O)CCc1ccccc1Cl Amb1209214 [0,2,0,0,0,0|2,0,0]=4 6552 B12R1.125 OC(=O)CCc1ccccc1I Amb10071543 [0,2,0,0,0,0|2,0,0]=4 6553 B12R1.125 OC(=O)CCc1ccccc1N Amb17477727 [0,2,0,0,0,0|2,0,0]=4 6554 B12R1.125 OC(=O)CCc1ccccc1O Amb1211927 [0,2,0,0,0,0|2,0,0]=4 6555 B12R1.125 OC(=O)CCc1ccccc1S Amb18648646 [0,2,0,0,0,0|2,0,0]=4 6556 B12R1.125 Oc1ccccc1CCC(=O)Cl Amb25808033 [0,2,0,0,0,0|2,0,0]=4 6557 B12R1.125 [O-][N+](=O)CCc1ccccc1C Amb17400176 [0,2,0,0,0,0|1,0,1]=4 6558 B12R1.125 [O-][N+](=O)CCc1ccccc1Cl Amb17401072 [0,2,0,0,0,0|1,0,1]=4 6559 B12R1.125 [O-][N+](=O)CCc1ccccc1F Amb17400297 [0,2,0,0,0,0|1,0,1]=4 6560 B12R1.267 C#CCCNc1ccccc1Cl Amb25118560 [0,2,0,0,0,0|2,0,0]=4 6561 B12R1.267 C#CCCNc1ccccc1F Amb25047099 [0,2,0,0,0,0|2,0,0]=4 6562 B12R1.267 C#CCCOc1ccccc1Cl Amb25748470 [0,2,0,0,0,0|2,0,0]=4 6563 B12R1.267 C#CCCOc1ccccc1F Amb24732557 [0,2,0,0,0,0|2,0,0]=4 6564 B12R1.267 C#CCCOc1ccccc1N Amb18290041 [0,2,0,0,0,0|2,0,0]=4 6565 B12R1.267 C#CCCSc1ccccc1Br Amb25727396 [0,2,0,0,0,0|2,0,0]=4 6566 B12R1.267 C#CCCSc1ccccc1Cl Amb25727168 [0,2,0,0,0,0|2,0,0]=4 6567 B12R1.267 C#CCCSc1ccccc1F Amb25225107 [0,2,0,0,0,0|2,0,0]=4 6568 B12R1.267 C#CCCSc1ccccc1O Amb18790975 [0,2,0,0,0,0|2,0,0]=4 6569 B12R1.267 C#CCNCc1ccccc1Cl Amb1925447 [0,2,0,0,0,0|2,0,0]=4 6570 B12R1.267 C#CCNCc1ccccc1F Amb21979501 [0,2,0,0,0,0|2,0,0]=4 6571 B12R1.267 C#CCOCc1ccccc1Br Amb25107682 [0,2,0,0,0,0|2,0,0]=4 6572 B12R1.267 C#CCSCc1ccccc1Br Amb25383350 [0,2,0,0,0,0|2,0,0]=4 6573 B12R1.267 C=CCCCc1ccccc1C Amb13890662 [0,2,0,0,0,0|2,0,0]=4 6574 B12R1.267 C=CCCNc1ccccc1Cl Amb25373616 [0,2,0,0,0,0|2,0,0]=4 6575 B12R1.267 C=CCCNc1ccccc1I Amb24364914 [0,2,0,0,0,0|2,0,0]=4 6576 B12R1.267 C=CCCOc1ccccc1Br Amb22232193 [0,2,0,0,0,0|2,0,0]=4 6577 B12R1.267 C=CCNCc1ccccc1Br Amb20673595 [0,2,0,0,0,0|2,0,0]=4 6578 B12R1.267 C=CCNCc1ccccc1F Amb10609764 [0,2,0,0,0,0|2,0,0]=4 6579 B12R1.267 C=CCNCc1ccccc1F Amb22279672 [0,2,0,0,0,0|2,0,0]=4 6580 B12R1.267 C=CCNCc1ccccc1O Amb19890804 [0,2,0,0,0,0|2,0,0]=4 6581 B12R1.267 C=CCOCc1ccccc1Br Amb22360706 [0,2,0,0,0,0|2,0,0]=4 6582 B12R1.267 C=CCOCc1ccccc1F Amb22227646 [0,2,0,0,0,0|2,0,0]=4 6583 B12R1.267 C=CCOCc1ccccc1N Amb22503744 [0,2,0,0,0,0|2,0,0]=4 6584 B12R1.267 CCCCNc1ccccc1O Amb18646353 [0,2,0,0,0,0|2,0,0]=4 6585 B12R1.267 CCCCNc1ccccc1S Amb25805362 [0,2,0,0,0,0|2,0,0]=4 6586 B12R1.267 CCCCOc1ccccc1N Amb1033054 [0,2,0,0,0,0|2,0,0]=4 6587 B12R1.267 CCCNCc1ccccc1Br Amb19892805 [0,2,0,0,0,0|2,0,0]=4 6588 B12R1.267 CCCNCc1ccccc1O Amb20673481 [0,2,0,0,0,0|2,0,0]=4 6589 B12R1.267 CCCSCc1ccccc1Br Amb22228182 [0,2,0,0,0,0|2,0,0]=4 6590 B12R1.267 CNCCCc1ccccc1Br Amb17605546 [0,2,0,0,0,0|1,0,0]=3 6591 B12R1.267 CNCCCc1ccccc1C Amb17104499 [0,2,0,0,0,0|1,0,0]=3 6592 B12R1.267 CNCCCc1ccccc1Cl Amb17104507 [0,2,0,0,0,0|1,0,0]=3 6593 B12R1.267 CNCCCc1ccccc1F Amb17104502 [0,2,0,0,0,0|1,0,0]=3 6594 B12R1.267 CNCCNc1[n]cccc1Br Amb19027465 [0,2,0,0,0,0|2,0,0]=4 6595 B12R1.267 CNCCNc1[n]cccc1Cl Amb19027480 [0,2,0,0,0,0|2,0,0]=4 6596 B12R1.267 CNCCNc1[n]cccc1F Amb18314045 [0,2,0,0,0,0|2,0,0]=4 6597 B12R1.267 CNCCNc1cc[n]cc1Br Amb24768506 [0,2,0,0,0,0|2,0,0]=4 6598 B12R1.267 CNCCNc1cc[n]cc1Cl Amb25113091 [0,2,0,0,0,0|2,0,0]=4 6599 B12R1.267 CNCCNc1ccccc1Br Amb18312614 [0,2,0,0,0,0|1,0,0]=3 6600 B12R1.267 CNCCNc1ccccc1C Amb15772130 [0,2,0,0,0,0|1,0,0]=3 6601 B12R1.267 CNCCNc1ccccc1Cl Amb19025278 [0,2,0,0,0,0|1,0,0]=3 6602 B12R1.267 CNCCNc1ccccc1F Amb19025282 [0,2,0,0,0,0|1,0,0]=3 6603 B12R1.267 CNCCOc1ccccc1C Amb1222745 [0,2,0,0,0,0|1,0,0]=3 6604 B12R1.267 CNCCOc1ccccc1C Amb2140560 [0,2,0,0,0,0|1,0,0]=3 6605 B12R1.267 CNCCOc1ccccc1Cl Amb1669286 [0,2,0,0,0,0|1,0,0]=3 6606 B12R1.267 CNCCOc1ccccc1F Amb1669285 [0,2,0,0,0,0|1,0,0]=3 6607 B12R1.267 CNCCOc1ccccc1F Amb2132299 [0,2,0,0,0,0|1,0,0]=3 6608 B12R1.267 CNCCOc1ccccc1N Amb17232613 [0,2,0,0,0,0|1,0,0]=3 6609 B12R1.267 CNC\C=C\c1ccccc1Br Amb25088168 [0,2,0,0,0,0|1,0,1]=4 6610 B12R1.267 CNC\C=C\c1ccccc1Cl Amb23442848 [0,2,0,0,0,0|1,0,1]=4 6611 B12R1.267 CNC\C=C\c1ccccc1F Amb23442841 [0,2,0,0,0,0|1,0,1]=4 6612 B12R1.267 COCCOc1ccccc1N Amb22492333 [0,2,0,0,0,0|2,0,0]=4 6613 B12R1.267 COCOCc1ccccc1Br Amb21964629 [0,2,0,0,0,0|2,0,0]=4 6614 B12R1.267 CSCCNc1ccccc1Cl Amb24451973 [0,2,0,0,0,0|2,0,0]=4 6615 B12R1.267 CSCCNc1ccccc1F Amb19025512 [0,2,0,0,0,0|2,0,0]=4 6616 B12R1.267 C\C=C\CCc1ccccc1N Amb25233153 [0,2,0,0,0,0|2,0,0]=4 6617 B12R1.267 C\C=C\CCc1ccccc1O Amb24676835 [0,2,0,0,0,0|2,0,0]=4 6618 B12R1.267 Cc1cc[n]cc1CCCCN Amb18828701 [0,2,0,0,0,0|2,0,0]=4 6619 B12R1.267 Cc1cc[n]cc1CC\C=N\N Amb25323420 [0,2,0,0,0,0|1,0,1]=4 6620 B12R1.267 Cc1ccc[n]c1NCCCN Amb18800959 [0,2,0,0,0,0|2,0,0]=4 6621 B12R1.267 Cc1ccc[n]c1NCCNC Amb18313338 [0,2,0,0,0,0|2,0,0]=4 6622 B12R1.267 Cc1ccccc1C#CCCN Amb25153987 [0,2,0,0,0,0|1,0,1]=4 6623 B12R1.267 Cc1ccccc1CCC=CC Amb22347883 [0,2,0,0,0,0|2,0,0]=4 6624 B12R1.267 Cc1ccccc1CCCC#N Amb24502058 [0,2,0,0,0,0|1,0,1]=4 6625 B12R1.267 Cc1ccccc1CCCCN Amb17991254 [0,2,0,0,0,0|1,0,0]=3 6626 B12R1.267 Cc1ccccc1CCCCS Amb18564154 [0,2,0,0,0,0|2,0,0]=4 6627 B12R1.267 Cc1ccccc1CCNC=O Amb24637730 [0,2,0,0,0,0|1,0,0]=3 6628 B12R1.267 Cc1ccccc1CNCC#C Amb21979502 [0,2,0,0,0,0|2,0,0]=4 6629 B12R1.267 Cc1ccccc1COCC#C Amb24493349 [0,2,0,0,0,0|2,0,0]=4 6630 B12R1.267 Cc1ccccc1CSCC#C Amb18808916 [0,2,0,0,0,0|2,0,0]=4 6631 B12R1.267 Cc1ccccc1NCCC#C Amb24444032 [0,2,0,0,0,0|2,0,0]=4 6632 B12R1.267 Cc1ccccc1NCCC=C Amb25073730 [0,2,0,0,0,0|2,0,0]=4 6633 B12R1.267 Cc1ccccc1NCCN=C Amb24406582 [0,2,0,0,0,0|1,0,1]=4 6634 B12R1.267 Cc1ccccc1NCCNC Amb21959972 [0,2,0,0,0,0|1,0,0]=3 6635 B12R1.267 Cc1ccccc1NCCSC Amb19025516 [0,2,0,0,0,0|2,0,0]=4 6636 B12R1.267 Cc1ccccc1SCCC#C Amb25849161 [0,2,0,0,0,0|2,0,0]=4 6637 B12R1.267 Cc1ccccc1SCCC#N Amb17740947 [0,2,0,0,0,0|1,0,1]=4 6638 B12R1.267 Cc1ccccc1\C=C\CNC Amb23442941 [0,2,0,0,0,0|1,0,1]=4 6639 B12R1.267 ClCCCOc1ccccc1C Amb1141955 [0,2,0,0,0,0|2,0,0]=4 6640 B12R1.267 ClCCCOc1ccccc1Cl Amb1135755 [0,2,0,0,0,0|2,0,0]=4 6641 B12R1.267 ClCCCOc1ccccc1F Amb1131839 [0,2,0,0,0,0|2,0,0]=4 6642 B12R1.267 FCCCNc1ccccc1Cl Amb24426496 [0,2,0,0,0,0|2,0,0]=4 6643 B12R1.267 FCCCNc1ccccc1I Amb25847224 [0,2,0,0,0,0|2,0,0]=4 6644 B12R1.267 FCCCOc1ccccc1Br Amb22008306 [0,2,0,0,0,0|2,0,0]=4 6645 B12R1.267 Fc1ccccc1CCCCS Amb18066143 [0,2,0,0,0,0|2,0,0]=4 6646 B12R1.267 Fc1ccccc1NCCCF Amb24460043 [0,2,0,0,0,0|2,0,0]=4 6647 B12R1.267 N#CCCCc1ccccc1Br Amb25732390 [0,2,0,0,0,0|1,0,1]=4 6648 B12R1.267 N#CCCCc1ccccc1O Amb24679850 [0,2,0,0,0,0|1,0,1]=4 6649 B12R1.267 N#CCCNc1ccccc1F Amb1103848 [0,2,0,0,0,0|1,0,1]=4 6650 B12R1.267 N#CCCOc1ccccc1C Amb1635755 [0,2,0,0,0,0|1,0,1]=4 6651 B12R1.267 N#CCCOc1ccccc1F Amb1148995 [0,2,0,0,0,0|1,0,1]=4 6652 B12R1.267 N#CCCOc1ccccc1O Amb25735836 [0,2,0,0,0,0|1,0,1]=4 6653 B12R1.267 N#CCCSc1ccccc1O Amb25093813 [0,2,0,0,0,0|1,0,1]=4 6654 B12R1.267 N#CCNCc1ccccc1Br Amb18977750 [0,2,0,0,0,0|1,0,1]=4 6655 B12R1.267 N#CCNCc1ccccc1C Amb17400074 [0,2,0,0,0,0|1,0,1]=4 6656 B12R1.267 N#CCNCc1ccccc1O Amb24433925 [0,2,0,0,0,0|1,0,1]=4 6657 B12R1.267 N#CCOCc1ccccc1Br Amb25088050 [0,2,0,0,0,0|1,0,1]=4 6658 B12R1.267 N#CCSCc1ccccc1Br Amb24720310 [0,2,0,0,0,0|1,0,1]=4 6659 B12R1.267 N#CCSCc1ccccc1C Amb17501732 [0,2,0,0,0,0|1,0,1]=4 6660 B12R1.267 N#CCSCc1ccccc1Cl Amb17501723 [0,2,0,0,0,0|1,0,1]=4 6661 B12R1.267 N#CCSCc1ccccc1F Amb17501731 [0,2,0,0,0,0|1,0,1]=4 6662 B12R1.267 N#CNCCc1ccccc1F Amb18800779 [0,2,0,0,0,0|0,0,1]=3 6663 B12R1.267 NCCC#Cc1ccccc1Cl Amb24439812 [0,2,0,0,0,0|1,0,1]=4 6664 B12R1.267 NCCCCN1C=CC=CC1=O Amb18535494 [0,2,0,0,0,0|2,0,0]=4 6665 B12R1.267 NCCCCc1ccccc1Br Amb18069064 [0,2,0,0,0,0|1,0,0]=3 6666 B12R1.267 NCCCCc1ccccc1Cl Amb22904185 [0,2,0,0,0,0|1,0,0]=3 6667 B12R1.267 NCCCCc1ccccc1F Amb18524598 [0,2,0,0,0,0|1,0,0]=3 6668 B12R1.267 NCCCCc1ccccc1O Amb18828230 [0,2,0,0,0,0|1,0,0]=3 6669 B12R1.267 NCCCNc1[n]cccc1Br Amb19015764 [0,2,0,0,0,0|2,0,0]=4 6670 B12R1.267 NCCCNc1[n]cccc1F Amb18314044 [0,2,0,0,0,0|2,0,0]=4 6671 B12R1.267 NCCCNc1c[n]ccc1Cl Amb24493036 [0,2,0,0,0,0|2,0,0]=4 6672 B12R1.267 NCCCNc1cc[n]cc1Cl Amb25034570 [0,2,0,0,0,0|2,0,0]=4 6673 B12R1.267 NCCCNc1ccccc1C Amb17057721 [0,2,0,0,0,0|1,0,0]=3 6674 B12R1.267 NCCCNc1ccccc1Cl Amb17057727 [0,2,0,0,0,0|1,0,0]=3 6675 B12R1.267 NCCCNc1ccccc1F Amb17057724 [0,2,0,0,0,0|1,0,0]=3 6676 B12R1.267 NCCCNc1ccccc1O Amb25214340 [0,2,0,0,0,0|1,0,0]=3 6677 B12R1.267 NCCCOc1ccccc1C Amb1136099 [0,2,0,0,0,0|1,0,0]=3 6678 B12R1.267 NCCCOc1ccccc1F Amb1107911 [0,2,0,0,0,0|1,0,0]=3 6679 B12R1.267 NCCCOc1ccccc1F Amb1221365 [0,2,0,0,0,0|1,0,0]=3 6680 B12R1.267 NCCNCc1ccccc1Br Amb18306264 [0,2,0,0,0,0|1,0,0]=3 6681 B12R1.267 NCCNCc1ccccc1Cl Amb10075510 [0,2,0,0,0,0|1,0,0]=3 6682 B12R1.267 NCCNCc1ccccc1F Amb10075506 [0,2,0,0,0,0|1,0,0]=3 6683 B12R1.267 NCCNCc1ccccc1O Amb19005483 [0,2,0,0,0,0|1,0,0]=3 6684 B12R1.267 NCCOCc1ccccc1Br Amb19020774 [0,2,0,0,0,0|1,0,0]=3 6685 B12R1.267 NCCOCc1ccccc1C Amb17061814 [0,2,0,0,0,0|1,0,0]=3 6686 B12R1.267 NCCOCc1ccccc1F Amb17061817 [0,2,0,0,0,0|1,0,0]=3 6687 B12R1.267 NCC\C=C\c1ccccc1Br Amb25129350 [0,2,0,0,0,0|1,0,1]=4 6688 B12R1.267 NCC\C=C\c1ccccc1C Amb17232386 [0,2,0,0,0,0|1,0,1]=4 6689 B12R1.267 NCC\C=C\c1ccccc1Cl Amb17233874 [0,2,0,0,0,0|1,0,1]=4 6690 B12R1.267 NCC\C=C\c1ccccc1F Amb17232531 [0,2,0,0,0,0|1,0,1]=4 6691 B12R1.267 NCC\N=C\c1ccccc1[O-] Amb24585164 [0,2,0,0,0,0|1,0,1]=4 6692 B12R1.267 NNCCOc1ccccc1Br Amb17407554 [0,2,0,0,0,0|0,0,0]=2 6693 B12R1.267 NNCCOc1ccccc1C Amb2282444 [0,2,0,0,0,0|0,0,0]=2 6694 B12R1.267 NNCCOc1ccccc1C Amb2370790 [0,2,0,0,0,0|0,0,0]=2 6695 B12R1.267 NNCCOc1ccccc1Cl Amb1114795 [0,2,0,0,0,0|0,0,0]=2 6696 B12R1.267 NNCCOc1ccccc1F Amb17400321 [0,2,0,0,0,0|0,0,0]=2 6697 B12R1.267 NNC\C=C\c1ccccc1Cl Amb18648720 [0,2,0,0,0,0|0,0,1]=3 6698 B12R1.267 NOCC#Cc1ccccc1F Amb25773644 [0,2,0,0,0,0|1,0,1]=4 6699 B12R1.267 NOCCCc1ccccc1C Amb17089549 [0,2,0,0,0,0|1,0,0]=3 6700 B12R1.267 NOCCCc1ccccc1Cl Amb17089558 [0,2,0,0,0,0|1,0,0]=3 6701 B12R1.267 NOCCCc1ccccc1F Amb17089552 [0,2,0,0,0,0|1,0,0]=3 6702 B12R1.267 NOCCOc1ccccc1Br Amb17088297 [0,2,0,0,0,0|1,0,0]=3 6703 B12R1.267 NOCCOc1ccccc1C Amb17088288 [0,2,0,0,0,0|1,0,0]=3 6704 B12R1.267 NOCCOc1ccccc1Cl Amb17088294 [0,2,0,0,0,0|1,0,0]=3 6705 B12R1.267 NOCCOc1ccccc1F Amb17088291 [0,2,0,0,0,0|1,0,0]=3 6706 B12R1.267 NON\N=C\c1ccccc1O Amb24580686 [0,2,0,0,0,0|1,0,1]=4 6707 B12R1.267 Nc1ccc[n]c1NCCCN Amb20673110 [0,2,0,0,0,0|2,0,0]=4 6708 B12R1.267 Nc1ccccc1CCCC#N Amb25253484 [0,2,0,0,0,0|1,0,1]=4 6709 B12R1.267 Nc1ccccc1NCCCN Amb24367240 [0,2,0,0,0,0|1,0,0]=3 6710 B12R1.267 Nc1ccccc1OCCC#N Amb18971549 [0,2,0,0,0,0|1,0,1]=4 6711 B12R1.267 Nc1ccccc1OCCCF Amb23539407 [0,2,0,0,0,0|2,0,0]=4 6712 B12R1.267 Nc1ccccc1\C=C\CCN Amb25805143 [0,2,0,0,0,0|1,0,1]=4 6713 B12R1.267 O=C=NCCc1ccccc1C Amb17232365 [0,2,0,0,0,0|1,0,1]=4 6714 B12R1.267 O=C=NCCc1ccccc1Cl Amb17233866 [0,2,0,0,0,0|1,0,1]=4 6715 B12R1.267 O=CCCOc1ccccc1Br Amb17099971 [0,2,0,0,0,0|2,0,0]=4 6716 B12R1.267 O=CNCCc1ccccc1Cl Amb25101673 [0,2,0,0,0,0|1,0,0]=3 6717 B12R1.267 O=CNCCc1ccccc1F Amb24399686 [0,2,0,0,0,0|1,0,0]=3 6718 B12R1.267 OCCCNc1ccccc1Br Amb17306220 [0,2,0,0,0,0|2,0,0]=4 6719 B12R1.267 OCCCNc1ccccc1C Amb17306598 [0,2,0,0,0,0|2,0,0]=4 6720 B12R1.267 OCCCNc1ccccc1Cl Amb17306039 [0,2,0,0,0,0|2,0,0]=4 6721 B12R1.267 OCCCNc1ccccc1F Amb17306155 [0,2,0,0,0,0|2,0,0]=4 6722 B12R1.267 OCCNCc1ccccc1Cl Amb13949019 [0,2,0,0,0,0|2,0,0]=4 6723 B12R1.267 OCCNCc1ccccc1I Amb21861540 [0,2,0,0,0,0|2,0,0]=4 6724 B12R1.267 ONCCOc1ccccc1Br Amb17088423 [0,2,0,0,0,0|1,0,0]=3 6725 B12R1.267 ONCCOc1ccccc1C Amb17088414 [0,2,0,0,0,0|1,0,0]=3 6726 B12R1.267 ONCCOc1ccccc1Cl Amb17088420 [0,2,0,0,0,0|1,0,0]=3 6727 B12R1.267 ONCCOc1ccccc1F Amb17088417 [0,2,0,0,0,0|1,0,0]=3 6728 B12R1.267 Oc1ccccc1CCN=C=O Amb25267891 [0,2,0,0,0,0|1,0,1]=4 6729 B12R1.267 Oc1ccccc1OCCCF Amb23449023 [0,2,0,0,0,0|2,0,0]=4 6730 B12R1.267 S=C=NCCc1ccccc1C Amb17233308 [0,2,0,0,0,0|1,0,1]=4 6731 B12R1.267 S=C=NCCc1ccccc1Cl Amb17236675 [0,2,0,0,0,0|1,0,1]=4 6732 B12R1.267 SCCCCc1ccccc1Br Amb18576923 [0,2,0,0,0,0|2,0,0]=4 6733 B12R1.267 SCCCCc1ccccc1Cl Amb18066299 [0,2,0,0,0,0|2,0,0]=4 6734 B12R1.267 SCCCOc1ccccc1Br Amb17258957 [0,2,0,0,0,0|2,0,0]=4 6735 B12R1.267 SCCCOc1ccccc1C Amb17233940 [0,2,0,0,0,0|2,0,0]=4 6736 B12R1.267 SCCCOc1ccccc1Cl Amb17237588 [0,2,0,0,0,0|2,0,0]=4 6737 B12R1.267 SCCCOc1ccccc1F Amb17234296 [0,2,0,0,0,0|2,0,0]=4 6738 B12R1.267 [C-]#[N+]CCCc1ccccc1Br Amb25364511 [0,2,0,0,0,0|1,0,1]=4 6739 B12R1.267 [C-]#[N+]CCCc1ccccc1F Amb24754342 [0,2,0,0,0,0|1,0,1]=4 6740 B12R1.267 [C-]#[N+]CCCc1ccccc1O Amb25202328 [0,2,0,0,0,0|1,0,1]=4 6741 B12R1.267 [C-]#[N+]CCOc1ccccc1Br Amb25196036 [0,2,0,0,0,0|1,0,1]=4 6742 B12R1.267 [C-]#[N+]CCSc1ccccc1Br Amb25762926 [0,2,0,0,0,0|1,0,1]=4 6743 B12R1.267 [C-]#[N+]CCSc1ccccc1C Amb25697577 [0,2,0,0,0,0|1,0,1]=4 6744 B12R1.371 C=CC(Cl)Cc1ccccc1Cl Amb25123891 [0,2,0,0,0,0|2,0,0]=4 6745 B12R1.371 C=CC(N)Cc1ccccc1F Amb24471242 [0,2,0,0,0,0|2,0,0]=4 6746 B12R1.371 C=CC(O)Cc1ccccc1Br Amb24523932 [0,2,0,0,0,0|2,0,0]=4 6747 B12R1.371 CC(CN)CN1C=CC=CC1=O Amb19002925 [0,2,0,0,0,0|2,0,0]=4 6748 B12R1.371 CC(CN)Cc1cc[n]cc1Cl Amb24537709 [0,2,0,0,0,0|2,0,0]=4 6749 B12R1.371 CC(CN)Cc1ccccc1Br Amb18992226 [0,2,0,0,0,0|1,0,0]=3 6750 B12R1.371 CC(CN)Nc1ccccc1Cl Amb18909432 [0,2,0,0,0,0|2,0,0]=4 6751 B12R1.371 CC(CN)Nc1ccccc1F Amb18908737 [0,2,0,0,0,0|2,0,0]=4 6752 B12R1.371 CC(CN)Nc1ccccc1I Amb24551694 [0,2,0,0,0,0|2,0,0]=4 6753 B12R1.371 CC(CN)Oc1ccccc1Cl Amb19148877 [0,2,0,0,0,0|2,0,0]=4 6754 B12R1.371 CC(CN)Oc1ccccc1F Amb18299438 [0,2,0,0,0,0|2,0,0]=4 6755 B12R1.371 CC(CN)Sc1ccccc1Br Amb18992815 [0,2,0,0,0,0|2,0,0]=4 6756 B12R1.371 CC(CN)Sc1ccccc1Cl Amb18992821 [0,2,0,0,0,0|2,0,0]=4 6757 B12R1.371 CC(CN)Sc1ccccc1F Amb18992820 [0,2,0,0,0,0|2,0,0]=4 6758 B12R1.371 CC(CN)Sc1ccccc1N Amb18909296 [0,2,0,0,0,0|2,0,0]=4 6759 B12R1.371 CC(CN)Sc1ccccc1O Amb18909347 [0,2,0,0,0,0|2,0,0]=4 6760 B12R1.371 CC(CO)Cc1ccccc1Br Amb25208316 [0,2,0,0,0,0|2,0,0]=4 6761 B12R1.371 CC(CO)Cc1ccccc1Cl Amb25039912 [0,2,0,0,0,0|2,0,0]=4 6762 B12R1.371 CC(Cc1c[n]ccc1N)NN Amb24681844 [0,2,0,0,0,0|1,0,0]=3 6763 B12R1.371 CC(Cc1ccc[n]c1N)NN Amb25121417 [0,2,0,0,0,0|1,0,0]=3 6764 B12R1.371 CC(Cc1ccccc1Br)C=O Amb25324057 [0,2,0,0,0,0|2,0,0]=4 6765 B12R1.371 CC(Cc1ccccc1Br)CBr Amb25040689 [0,2,0,0,0,0|2,0,0]=4 6766 B12R1.371 CC(Cc1ccccc1Cl)C#N Amb25717018 [0,2,0,0,0,0|1,0,1]=4 6767 B12R1.371 CC(Cc1ccccc1F)C=O Amb24429443 [0,2,0,0,0,0|2,0,0]=4 6768 B12R1.371 CC(Cc1ccccc1F)CBr Amb25741700 [0,2,0,0,0,0|2,0,0]=4 6769 B12R1.371 CC(Cc1ccccc1F)CCl Amb25349982 [0,2,0,0,0,0|2,0,0]=4 6770 B12R1.371 CC(Cc1ccccc1I)C=O Amb24437612 [0,2,0,0,0,0|2,0,0]=4 6771 B12R1.371 CC(Cc1ccccc1O)C=O Amb25313067 [0,2,0,0,0,0|2,0,0]=4 6772 B12R1.371 CCC(Br)Cc1ccccc1Cl Amb24675424 [0,2,0,0,0,0|2,0,0]=4 6773 B12R1.371 CCC(C)Cc1ccccc1N Amb25034567 [0,2,0,0,0,0|2,0,0]=4 6774 B12R1.371 CCC(Cc1ccccc1C)Cl Amb17477425 [0,2,0,0,0,0|2,0,0]=4 6775 B12R1.371 CCC(Cc1ccccc1C)O Amb17138581 [0,2,0,0,0,0|2,0,0]=4 6776 B12R1.371 CCC(Cc1ccccc1Cl)Cl Amb17477603 [0,2,0,0,0,0|2,0,0]=4 6777 B12R1.371 CCC(Cc1ccccc1Cl)O Amb17139101 [0,2,0,0,0,0|2,0,0]=4 6778 B12R1.371 CCC(Cc1ccccc1F)O Amb17138635 [0,2,0,0,0,0|2,0,0]=4 6779 B12R1.371 CCC(Cl)Cc1ccccc1F Amb19046368 [0,2,0,0,0,0|2,0,0]=4 6780 B12R1.371 CCC(N)Cc1ccccc1Br Amb20627508 [0,2,0,0,0,0|2,0,0]=4 6781 B12R1.371 CCC(O)Cc1ccccc1Br Amb24465632 [0,2,0,0,0,0|2,0,0]=4 6782 B12R1.371 CCC(O)Cc1ccccc1N Amb25335274 [0,2,0,0,0,0|2,0,0]=4 6783 B12R1.371 CNC(=N)Cc1ccccc1F Amb24483570 [0,2,0,0,0,0|1,0,1]=4 6784 B12R1.371 CNC(=O)Cc1ccccc1Br Amb22001453 [0,2,0,0,0,0|1,0,1]=4 6785 B12R1.371 CNC(=O)Cc1ccccc1C Amb2106609 [0,2,0,0,0,0|1,0,1]=4 6786 B12R1.371 CNC(=O)Cc1ccccc1Cl Amb23014080 [0,2,0,0,0,0|1,0,1]=4 6787 B12R1.371 CNC(=O)Cc1ccccc1F Amb23014294 [0,2,0,0,0,0|1,0,1]=4 6788 B12R1.371 CNC(=O)Cc1ccccc1N Amb1114729 [0,2,0,0,0,0|1,0,1]=4 6789 B12R1.371 CNC(C)CN1C=CC=CC1=O Amb18982094 [0,2,0,0,0,0|2,0,0]=4 6790 B12R1.371 CNC(C)Cc1c[n]ccc1N Amb24763568 [0,2,0,0,0,0|2,0,0]=4 6791 B12R1.371 CNC(C)Cc1cc[n]cc1Cl Amb24379712 [0,2,0,0,0,0|2,0,0]=4 6792 B12R1.371 CNC(C)Cc1ccc[n]c1F Amb24648892 [0,2,0,0,0,0|2,0,0]=4 6793 B12R1.371 CNC(C)Cc1ccc[n]c1N Amb24715833 [0,2,0,0,0,0|2,0,0]=4 6794 B12R1.371 CNC(C)Cc1ccccc1Br Amb25149882 [0,2,0,0,0,0|1,0,0]=3 6795 B12R1.371 CNC(Cc1ncccc1C)C Amb1995153 [0,2,0,0,0,0|2,0,0]=4 6796 B12R1.371 CN[C@@H](C)Cc1ccccc1F Amb25264769 [0,2,0,0,0,0|1,0,0]=3 6797 B12R1.371 COC(C)Cc1ccccc1O Amb18646540 [0,2,0,0,0,0|2,0,0]=4 6798 B12R1.371 C[C@@H](Cc1ccccc1O)CO Amb24633514 [0,2,0,0,0,0|2,0,0]=4 6799 B12R1.371 C[C@H](CO)Cc1ccccc1Cl Amb25157925 [0,2,0,0,0,0|2,0,0]=4 6800 B12R1.371 C[C@H](CO)Cc1ccccc1F Amb25837933 [0,2,0,0,0,0|2,0,0]=4 6801 B12R1.371 C[C@H](Cc1ccccc1O)CO Amb25094364 [0,2,0,0,0,0|2,0,0]=4 6802 B12R1.371 C\C(\Cc1ccccc1Cl)=N\N Amb25106628 [0,2,0,0,0,0|0,0,2]=4 6803 B12R1.371 C\C(\Cc1ccccc1I)=N\N Amb24525431 [0,2,0,0,0,0|0,0,2]=4 6804 B12R1.371 Cc1cc[n]cc1CC(C)CN Amb24734143 [0,2,0,0,0,0|2,0,0]=4 6805 B12R1.371 Cc1ccccc1CC(=O)CN Amb18829246 [0,2,0,0,0,0|1,0,1]=4 6806 B12R1.371 Cc1ccccc1CC(C)C=O Amb18645713 [0,2,0,0,0,0|2,0,0]=4 6807 B12R1.371 Cc1ccccc1CC(C)CBr Amb25733982 [0,2,0,0,0,0|2,0,0]=4 6808 B12R1.371 Cc1ccccc1CC(C)CO Amb25152371 [0,2,0,0,0,0|2,0,0]=4 6809 B12R1.371 Cc1ccccc1CC(C)NC Amb24271197 [0,2,0,0,0,0|1,0,0]=3 6810 B12R1.371 Cc1ccccc1CC(F)CN Amb24745160 [0,2,0,0,0,0|1,0,0]=3 6811 B12R1.371 Cc1ccccc1CC(N)=NN Amb18788207 [0,2,0,0,0,0|0,0,2]=4 6812 B12R1.371 Cc1ccccc1CC(N)C#C Amb25148677 [0,2,0,0,0,0|2,0,0]=4 6813 B12R1.371 Cc1ccccc1CC(O)C#C Amb25764953 [0,2,0,0,0,0|2,0,0]=4 6814 B12R1.371 Cc1ccccc1CC(O)C=O Amb25789140 [0,2,0,0,0,0|2,0,0]=4 6815 B12R1.371 Cc1ccccc1CC(O)CCl Amb25258048 [0,2,0,0,0,0|2,0,0]=4 6816 B12R1.371 Cc1ccccc1CC(O)CO Amb24615514 [0,2,0,0,0,0|2,0,0]=4 6817 B12R1.371 Cc1ccccc1C[C@@H](N)CC Amb24410901 [0,2,0,0,0,0|2,0,0]=4 6818 B12R1.371 Cc1ccccc1C[C@H](O)CC Amb25157887 [0,2,0,0,0,0|2,0,0]=4 6819 B12R1.371 Cc1ccccc1C\C(\C)=N/N Amb24458307 [0,2,0,0,0,0|0,0,2]=4 6820 B12R1.371 Cc1ccccc1NC(C)CN Amb18251701 [0,2,0,0,0,0|2,0,0]=4 6821 B12R1.371 Cc1ccccc1NC(S)NN Amb25187674 [0,2,0,0,0,0|1,0,0]=3 6822 B12R1.371 Cc1ccccc1SC(C)CN Amb18299446 [0,2,0,0,0,0|2,0,0]=4 6823 B12R1.371 N#CC(Cc1ccccc1Br)Br Amb17376788 [0,2,0,0,0,0|1,0,1]=4 6824 B12R1.371 N#CC(Cc1ccccc1Br)Cl Amb17204671 [0,2,0,0,0,0|1,0,1]=4 6825 B12R1.371 N#CC(Cc1ccccc1C)Br Amb17342951 [0,2,0,0,0,0|1,0,1]=4 6826 B12R1.371 N#CC(Cc1ccccc1C)Cl Amb17204319 [0,2,0,0,0,0|1,0,1]=4 6827 B12R1.371 N#CC(Cc1ccccc1Cl)Br Amb17349963 [0,2,0,0,0,0|1,0,1]=4 6828 B12R1.371 N#CC(Cc1ccccc1Cl)Cl Amb2520868 [0,2,0,0,0,0|1,0,1]=4 6829 B12R1.371 N#CC(Cc1ccccc1F)Br Amb17344011 [0,2,0,0,0,0|1,0,1]=4 6830 B12R1.371 N#CC(Cc1ccccc1F)Cl Amb17204330 [0,2,0,0,0,0|1,0,1]=4 6831 B12R1.371 NC(CF)Cc1ccccc1Cl Amb24596044 [0,2,0,0,0,0|2,0,0]=4 6832 B12R1.371 NC(CO)Cc1ccccc1Br Amb18747032 [0,2,0,0,0,0|2,0,0]=4 6833 B12R1.371 NC(CO)Cc1ccccc1I Amb25200271 [0,2,0,0,0,0|2,0,0]=4 6834 B12R1.371 NC(Cc1ccccc1Cl)=NN Amb19045351 [0,2,0,0,0,0|0,0,2]=4 6835 B12R1.371 NC(Cc1ccccc1Cl)C#N Amb23557157 [0,2,0,0,0,0|1,0,1]=4 6836 B12R1.371 NC(Cc1ccccc1F)CF Amb25255727 [0,2,0,0,0,0|2,0,0]=4 6837 B12R1.371 NC(Cc1ccccc1O)CO Amb18827210 [0,2,0,0,0,0|2,0,0]=4 6838 B12R1.371 NCC(=O)Cc1ccccc1Br Amb25667280 [0,2,0,0,0,0|1,0,1]=4 6839 B12R1.371 NCC(=O)Cc1ccccc1Cl Amb18909368 [0,2,0,0,0,0|1,0,1]=4 6840 B12R1.371 NCC(=O)Cc1ccccc1F Amb18827239 [0,2,0,0,0,0|1,0,1]=4 6841 B12R1.371 NCC(Cc1ccccc1C)O Amb17232545 [0,2,0,0,0,0|1,0,0]=3 6842 B12R1.371 NCC(Cc1ccccc1Cl)O Amb17234263 [0,2,0,0,0,0|1,0,0]=3 6843 B12R1.371 NCC(Cc1ccccc1F)O Amb17232700 [0,2,0,0,0,0|1,0,0]=3 6844 B12R1.371 NCC(O)CN1C=CC=CC1=O Amb18288788 [0,2,0,0,0,0|2,0,0]=4 6845 B12R1.371 NCC(O)Cc1[n]cccc1Br Amb25144691 [0,2,0,0,0,0|2,0,0]=4 6846 B12R1.371 NCC(O)Cc1cc[n]cc1Cl Amb25092324 [0,2,0,0,0,0|2,0,0]=4 6847 B12R1.371 NCC(O)Cc1ccc[n]c1F Amb25762785 [0,2,0,0,0,0|2,0,0]=4 6848 B12R1.371 NCC(O)Cc1ccccc1Br Amb18069447 [0,2,0,0,0,0|1,0,0]=3 6849 B12R1.371 NC[C@@H](O)CN1C=CC=CC1=O Amb25809156 [0,2,0,0,0,0|2,0,0]=4 6850 B12R1.371 NNC(=O)CN1C=CC=CC1=O Amb18028594 [0,2,0,0,0,0|1,0,1]=4 6851 B12R1.371 NNC(=O)Cc1ccc[n]c1Cl Amb25112883 [0,2,0,0,0,0|1,0,1]=4 6852 B12R1.371 NNC(=O)Cc1ccccc1Br Amb22484618 [0,2,0,0,0,0|0,0,1]=3 6853 B12R1.371 NNC(=O)Cc1ccccc1F Amb1126168 [0,2,0,0,0,0|0,0,1]=3 6854 B12R1.371 NNC(=O)Cc1ccccc1I Amb25334643 [0,2,0,0,0,0|0,0,1]=3 6855 B12R1.371 NNC(=O)Nc1ccccc1F Amb2413750 [0,2,0,0,0,0|1,0,1]=4 6856 B12R1.371 NNC(=S)Nc1ccccc1C Amb1634626 [0,2,0,0,0,0|1,0,1]=4 6857 B12R1.371 NNC(=S)Nc1ccccc1Cl Amb1149109 [0,2,0,0,0,0|1,0,1]=4 6858 B12R1.371 NNC(=S)Nc1ccccc1F Amb1150488 [0,2,0,0,0,0|1,0,1]=4 6859 B12R1.371 NNC(=S)Nc1ccccc1O Amb25152277 [0,2,0,0,0,0|1,0,1]=4 6860 B12R1.371 NNC(=S)Nc1ccccc1S Amb1766287 [0,2,0,0,0,0|1,0,1]=4 6861 B12R1.371 NNC(S)Nc1ccccc1Cl Amb24497118 [0,2,0,0,0,0|1,0,0]=3 6862 B12R1.371 N[C@@H](CO)Cc1ccccc1Cl Amb25106847 [0,2,0,0,0,0|2,0,0]=4 6863 B12R1.371 N[C@@H](CO)Cc1ccccc1F Amb25331070 [0,2,0,0,0,0|2,0,0]=4 6864 B12R1.371 N[C@H](CO)Cc1ccccc1Br Amb24424605 [0,2,0,0,0,0|2,0,0]=4 6865 B12R1.371 N[C@H](CO)Cc1ccccc1Cl Amb22233157 [0,2,0,0,0,0|2,0,0]=4 6866 B12R1.371 N[C@H](CO)Cc1ccccc1F Amb25308478 [0,2,0,0,0,0|2,0,0]=4 6867 B12R1.371 N\C(\Cc1ccccc1F)=N\N Amb18788566 [0,2,0,0,0,0|0,0,2]=4 6868 B12R1.371 Nc1[n]cccc1CC(=O)NN Amb24347801 [0,2,0,0,0,0|1,0,1]=4 6869 B12R1.371 Nc1[n]cccc1CC(F)CN Amb24701427 [0,2,0,0,0,0|2,0,0]=4 6870 B12R1.371 Nc1ccccc1CC(=O)NN Amb25072774 [0,2,0,0,0,0|0,0,1]=3 6871 B12R1.371 Nc1ccccc1CC(N)CO Amb25712145 [0,2,0,0,0,0|2,0,0]=4 6872 B12R1.371 Nc1ccccc1C[C@H](N)CO Amb22233158 [0,2,0,0,0,0|2,0,0]=4 6873 B12R1.371 O=CC(Cc1ccccc1Br)Cl Amb17204707 [0,2,0,0,0,0|2,0,0]=4 6874 B12R1.371 O=CC(Cc1ccccc1C)Cl Amb17204326 [0,2,0,0,0,0|2,0,0]=4 6875 B12R1.371 O=CC(Cc1ccccc1Cl)Cl Amb17204401 [0,2,0,0,0,0|2,0,0]=4 6876 B12R1.371 O=CC(Cc1ccccc1F)Cl Amb17204341 [0,2,0,0,0,0|2,0,0]=4 6877 B12R1.371 O=CC(Cl)Cc1ccccc1I Amb25827697 [0,2,0,0,0,0|2,0,0]=4 6878 B12R1.371 O=CC(F)Cc1ccccc1Cl Amb25148636 [0,2,0,0,0,0|2,0,0]=4 6879 B12R1.371 O=CC(F)Cc1ccccc1F Amb24341410 [0,2,0,0,0,0|2,0,0]=4 6880 B12R1.371 OC(Cc1ccccc1F)C=O Amb24554950 [0,2,0,0,0,0|2,0,0]=4 6881 B12R1.371 OC(Cc1ccccc1F)CCl Amb24355863 [0,2,0,0,0,0|2,0,0]=4 6882 B12R1.371 OCC(Cc1ccccc1C)N Amb17062685 [0,2,0,0,0,0|2,0,0]=4 6883 B12R1.371 OCC(Cc1ccccc1Cl)N Amb17062694 [0,2,0,0,0,0|2,0,0]=4 6884 B12R1.371 OCC(Cc1ccccc1F)N Amb17062688 [0,2,0,0,0,0|2,0,0]=4 6885 B12R1.371 Oc1ccccc1CC(F)C=O Amb25148635 [0,2,0,0,0,0|2,0,0]=4 6886 B12R1.374 BrCCCc1cc(Br)ccc1Br Amb24537172 [0,2,0,0,0,0|2,0,0]=4 6887 B12R1.374 C#CCCc1cc(F)ccc1O Amb24100511 [0,2,0,0,0,0|2,0,0]=4 6888 B12R1.374 C=CCCc1cc(Br)ccc1F Amb25804334 [0,2,0,0,0,0|2,0,0]=4 6889 B12R1.374 CC1=CN(CCCN)C(=O)C=C1 Amb18030530 [0,2,0,0,0,0|2,0,0]=4 6890 B12R1.374 CCCCC1=CC(=O)C=CC1=O Amb24065452 [0,2,0,0,0,0|2,0,0]=4 6891 B12R1.374 CCCCc1cc(Cl)ccc1N Amb25691483 [0,2,0,0,0,0|2,0,0]=4 6892 B12R1.374 CCCCc1cc(Cl)ccc1O Amb25273097 [0,2,0,0,0,0|2,0,0]=4 6893 B12R1.374 CCCCc1cc(N)ccc1Cl Amb25843846 [0,2,0,0,0,0|2,0,0]=4 6894 B12R1.374 CCCCc1cc(O)ccc1O Amb24330377 [0,2,0,0,0,0|2,0,0]=4 6895 B12R1.374 CNCCN1C=C(Br)C=CC1=O Amb18992765 [0,2,0,0,0,0|2,0,0]=4 6896 B12R1.374 CNCCc1[n]c(C)ccc1C Amb25241842 [0,2,0,0,0,0|2,0,0]=4 6897 B12R1.374 CNCCc1cc(Br)ccc1Cl Amb25159743 [0,2,0,0,0,0|1,0,0]=3 6898 B12R1.374 CNCCc1cc(Br)ccc1F Amb18299520 [0,2,0,0,0,0|1,0,0]=3 6899 B12R1.374 CNCCc1cc(C)ccc1C Amb17085230 [0,2,0,0,0,0|1,0,0]=3 6900 B12R1.374 CNCCc1cc(Cl)ccc1F Amb18243883 [0,2,0,0,0,0|1,0,0]=3 6901 B12R1.374 CNCCc1cc(Cl)ccc1O Amb18939315 [0,2,0,0,0,0|1,0,0]=3 6902 B12R1.374 CNCCc1cc(F)ccc1Br Amb18299508 [0,2,0,0,0,0|1,0,0]=3 6903 B12R1.374 CNCCc1cc(F)ccc1F Amb18993055 [0,2,0,0,0,0|1,0,0]=3 6904 B12R1.374 CNCCc1cc(F)ccc1O Amb18275939 [0,2,0,0,0,0|1,0,0]=3 6905 B12R1.374 CNCCc1cc(O)ccc1Br Amb25283021 [0,2,0,0,0,0|1,0,0]=3 6906 B12R1.374 CNCCc1cc(O)ccc1Cl Amb24684086 [0,2,0,0,0,0|1,0,0]=3 6907 B12R1.374 CSCCc1cc(Cl)ccc1Cl Amb25323402 [0,2,0,0,0,0|2,0,0]=4 6908 B12R1.374 Cc1c[n]c(C)c(CCCN)c1 Amb25674297 [0,2,0,0,0,0|2,0,0]=4 6909 B12R1.374 Cc1c[n]c(Cl)cc1CCCN Amb24547121 [0,2,0,0,0,0|2,0,0]=4 6910 B12R1.374 Cc1cc(CCC#C)c(C)cc1 Amb18117997 [0,2,0,0,0,0|2,0,0]=4 6911 B12R1.374 Cc1cc(CCC#N)c(Cl)cc1 Amb25376438 [0,2,0,0,0,0|1,0,1]=4 6912 B12R1.374 Cc1cc(CCC#N)c(I)cc1 Amb24605294 [0,2,0,0,0,0|1,0,1]=4 6913 B12R1.374 Cc1cc(CCC#N)c(O)cc1 Amb25773347 [0,2,0,0,0,0|1,0,1]=4 6914 B12R1.374 Cc1cc(CCC=O)c(C)cc1 Amb18798123 [0,2,0,0,0,0|2,0,0]=4 6915 B12R1.374 Cc1cc(CCC=O)c(F)cc1 Amb25775656 [0,2,0,0,0,0|2,0,0]=4 6916 B12R1.374 Cc1cc(CCC=O)c(O)cc1 Amb24527959 [0,2,0,0,0,0|2,0,0]=4 6917 B12R1.374 Cc1cc(CCCBr)c(C)cc1 Amb24593678 [0,2,0,0,0,0|2,0,0]=4 6918 B12R1.374 Cc1cc(CCCBr)c(O)cc1 Amb24558916 [0,2,0,0,0,0|2,0,0]=4 6919 B12R1.374 Cc1cc(CCCCl)c(C)cc1 Amb18325129 [0,2,0,0,0,0|2,0,0]=4 6920 B12R1.374 Cc1cc(CCCCl)c(F)cc1 Amb25250611 [0,2,0,0,0,0|2,0,0]=4 6921 B12R1.374 Cc1cc(CCCCl)c(I)cc1 Amb25230131 [0,2,0,0,0,0|2,0,0]=4 6922 B12R1.374 Cc1cc(CCCN)c(Cl)cc1 Amb18909370 [0,2,0,0,0,0|1,0,0]=3 6923 B12R1.374 Cc1cc(CCCN)c(F)[n]c1 Amb25330759 [0,2,0,0,0,0|2,0,0]=4 6924 B12R1.374 Cc1cc(CCCN)c(O)cc1 Amb18552860 [0,2,0,0,0,0|1,0,0]=3 6925 B12R1.374 Cc1cc(CCCO)c(Cl)cc1 Amb25074743 [0,2,0,0,0,0|2,0,0]=4 6926 B12R1.374 Cc1cc(CCCO)c(F)cc1 Amb25148634 [0,2,0,0,0,0|2,0,0]=4 6927 B12R1.374 Cc1cc(NCCN)c(Br)cc1 Amb25281394 [0,2,0,0,0,0|2,0,0]=4 6928 B12R1.374 Cc1cc(NCCN)c(F)cc1 Amb18299160 [0,2,0,0,0,0|2,0,0]=4 6929 B12R1.374 Cc1cc(OCCN)c(Cl)cc1 Amb21959599 [0,2,0,0,0,0|2,0,0]=4 6930 B12R1.374 Cc1ccc(Br)cc1CCC#N Amb25701944 [0,2,0,0,0,0|1,0,1]=4 6931 B12R1.374 Cc1ccc(Br)cc1CCCS Amb25036393 [0,2,0,0,0,0|2,0,0]=4 6932 B12R1.374 Cc1ccc(Br)cc1CCNN Amb24740195 [0,2,0,0,0,0|0,0,0]=2 6933 B12R1.374 Cc1ccc(Br)cc1OCCN Amb24116411 [0,2,0,0,0,0|2,0,0]=4 6934 B12R1.374 Cc1ccc(C)[n]c1CCCN Amb24493220 [0,2,0,0,0,0|2,0,0]=4 6935 B12R1.374 Cc1ccc(Cl)c(CCCCl)c1 Amb25242993 [0,2,0,0,0,0|2,0,0]=4 6936 B12R1.374 Cc1ccc(Cl)cc1CCC=O Amb18564227 [0,2,0,0,0,0|2,0,0]=4 6937 B12R1.374 Cc1ccc(Cl)cc1CCCBr Amb24615762 [0,2,0,0,0,0|2,0,0]=4 6938 B12R1.374 Cc1ccc(Cl)cc1CCCO Amb25829954 [0,2,0,0,0,0|2,0,0]=4 6939 B12R1.374 Cc1ccc(Cl)cc1OCCN Amb18649214 [0,2,0,0,0,0|2,0,0]=4 6940 B12R1.374 Cc1ccc(F)c(CCNC)c1 Amb18301316 [0,2,0,0,0,0|1,0,0]=3 6941 B12R1.374 Cc1ccc(F)cc1CCC#N Amb25738354 [0,2,0,0,0,0|1,0,1]=4 6942 B12R1.374 Cc1ccc(F)cc1CCC=C Amb25259828 [0,2,0,0,0,0|2,0,0]=4 6943 B12R1.374 Cc1ccc(F)cc1CCNC Amb18301289 [0,2,0,0,0,0|1,0,0]=3 6944 B12R1.374 Cc1ccc(F)cc1NCCN Amb18992218 [0,2,0,0,0,0|2,0,0]=4 6945 B12R1.374 Cc1ccc(F)cc1OCCN Amb24682325 [0,2,0,0,0,0|2,0,0]=4 6946 B12R1.374 Cc1ccc(I)cc1NCCN Amb25359504 [0,2,0,0,0,0|2,0,0]=4 6947 B12R1.374 Cc1ccc(N)c(CCCC)c1 Amb24365184 [0,2,0,0,0,0|2,0,0]=4 6948 B12R1.374 Cc1ccc(N)cc1CCCCl Amb25376376 [0,2,0,0,0,0|2,0,0]=4 6949 B12R1.374 Cc1ccc(N)cc1NCCN Amb18299627 [0,2,0,0,0,0|2,0,0]=4 6950 B12R1.374 Cc1ccc(N)cc1SCCN Amb25834786 [0,2,0,0,0,0|2,0,0]=4 6951 B12R1.374 Cc1ccc(O)c(CCCO)c1 Amb18646539 [0,2,0,0,0,0|2,0,0]=4 6952 B12R1.374 Cc1ccc(O)c(CCNC)c1 Amb18940457 [0,2,0,0,0,0|1,0,0]=3 6953 B12R1.374 Cc1ccc(O)cc1CCC#C Amb25706933 [0,2,0,0,0,0|2,0,0]=4 6954 B12R1.374 Cc1ccc(O)cc1CCC=O Amb24093052 [0,2,0,0,0,0|2,0,0]=4 6955 B12R1.374 Cc1ccc(O)cc1CCCC Amb24527628 [0,2,0,0,0,0|2,0,0]=4 6956 B12R1.374 Cc1ccc(O)cc1CCCN Amb25777725 [0,2,0,0,0,0|1,0,0]=3 6957 B12R1.374 Cc1ccc(O)cc1OCCN Amb24754289 [0,2,0,0,0,0|2,0,0]=4 6958 B12R1.374 Cc1ccc(S)cc1CCCCl Amb24610834 [0,2,0,0,0,0|2,0,0]=4 6959 B12R1.374 Cc1ccc(cc1CCC#N)C Amb17204301 [0,2,0,0,0,0|1,0,1]=4 6960 B12R1.374 Cc1ccc(cc1CCC#N)Cl Amb17204323 [0,2,0,0,0,0|1,0,1]=4 6961 B12R1.374 Cc1ccc(cc1CCCN)C Amb17204307 [0,2,0,0,0,0|1,0,0]=3 6962 B12R1.374 Cc1ccc(cc1CCCN)Cl Amb17204336 [0,2,0,0,0,0|1,0,0]=3 6963 B12R1.374 Cc1ccc(cc1CCCO)C Amb17400156 [0,2,0,0,0,0|2,0,0]=4 6964 B12R1.374 Cc1ccc(cc1CCNN)C Amb17400164 [0,2,0,0,0,0|0,0,0]=2 6965 B12R1.374 Cc1ccc(cc1NCCN)C Amb17091051 [0,2,0,0,0,0|2,0,0]=4 6966 B12R1.374 Cc1ccc(cc1NCCN)Cl Amb17091058 [0,2,0,0,0,0|2,0,0]=4 6967 B12R1.374 Cc1ccc(cc1OCCN)C Amb1101722 [0,2,0,0,0,0|2,0,0]=4 6968 B12R1.374 Clc1ccc(Br)c(CCCCl)c1 Amb25714131 [0,2,0,0,0,0|2,0,0]=4 6969 B12R1.374 Clc1ccc(cc1CCC#N)Cl Amb17204386 [0,2,0,0,0,0|1,0,1]=4 6970 B12R1.374 Clc1ccc(cc1CCC=O)Cl Amb10606178 [0,2,0,0,0,0|2,0,0]=4 6971 B12R1.374 Fc1cc(CCCBr)c(F)cc1 Amb24439123 [0,2,0,0,0,0|2,0,0]=4 6972 B12R1.374 Fc1cc(CCCCl)c(Br)cc1 Amb24341770 [0,2,0,0,0,0|2,0,0]=4 6973 B12R1.374 Fc1cc(CCCCl)c(F)cc1 Amb19073201 [0,2,0,0,0,0|2,0,0]=4 6974 B12R1.374 Fc1ccc(Br)cc1CCCBr Amb25204237 [0,2,0,0,0,0|2,0,0]=4 6975 B12R1.374 Fc1ccc(Br)cc1CCCS Amb25778866 [0,2,0,0,0,0|2,0,0]=4 6976 B12R1.374 Fc1ccc(Cl)c(CCCCl)c1 Amb25796501 [0,2,0,0,0,0|2,0,0]=4 6977 B12R1.374 Fc1ccc(Cl)cc1CCCBr Amb24441885 [0,2,0,0,0,0|2,0,0]=4 6978 B12R1.374 Fc1ccc(I)cc1CCCBr Amb24571927 [0,2,0,0,0,0|2,0,0]=4 6979 B12R1.374 N#CCCc1cc(Br)ccc1Br Amb25248926 [0,2,0,0,0,0|1,0,1]=4 6980 B12R1.374 N#CCCc1cc(Br)ccc1F Amb25286118 [0,2,0,0,0,0|1,0,1]=4 6981 B12R1.374 N#CCCc1cc(Cl)ccc1F Amb18863064 [0,2,0,0,0,0|1,0,1]=4 6982 B12R1.374 N#CCCc1cc(Cl)ccc1O Amb24679559 [0,2,0,0,0,0|1,0,1]=4 6983 B12R1.374 N#CCCc1cc(F)ccc1F Amb18798745 [0,2,0,0,0,0|1,0,1]=4 6984 B12R1.374 N#CCCc1cc(O)ccc1Br Amb24586510 [0,2,0,0,0,0|1,0,1]=4 6985 B12R1.374 N#CCCc1cc(O)ccc1F Amb24541069 [0,2,0,0,0,0|1,0,1]=4 6986 B12R1.374 N#CCCc1cc(O)ccc1I Amb24527853 [0,2,0,0,0,0|1,0,1]=4 6987 B12R1.374 N#CCCc1cc(S)ccc1Cl Amb25191131 [0,2,0,0,0,0|1,0,1]=4 6988 B12R1.374 N#CCCc1cc(S)ccc1O Amb24695669 [0,2,0,0,0,0|1,0,1]=4 6989 B12R1.374 NCCCN1C=C(Br)C=CC1=O Amb18535492 [0,2,0,0,0,0|2,0,0]=4 6990 B12R1.374 NCCCN1C=C(Br)C=CC1=O Amb19514408 [0,2,0,0,0,0|2,0,0]=4 6991 B12R1.374 NCCCN1C=C(Cl)C=CC1=O Amb17992862 [0,2,0,0,0,0|2,0,0]=4 6992 B12R1.374 NCCCN1C=C(Cl)C=CC1=O Amb18368806 [0,2,0,0,0,0|2,0,0]=4 6993 B12R1.374 NCCCN1C=C(F)C=CC1=O Amb18040598 [0,2,0,0,0,0|2,0,0]=4 6994 B12R1.374 NCCCc1[n]c(Cl)ccc1F Amb24642849 [0,2,0,0,0,0|2,0,0]=4 6995 B12R1.374 NCCCc1cc(Br)ccc1Br Amb25309336 [0,2,0,0,0,0|1,0,0]=3 6996 B12R1.374 NCCCc1cc(Br)ccc1Cl Amb25036212 [0,2,0,0,0,0|1,0,0]=3 6997 B12R1.374 NCCCc1cc(Cl)ccc1Br Amb25150112 [0,2,0,0,0,0|1,0,0]=3 6998 B12R1.374 NCCCc1cc(Cl)ccc1Cl Amb17204405 [0,2,0,0,0,0|1,0,0]=3 6999 B12R1.374 NCCCc1cc(Cl)ccc1F Amb18863289 [0,2,0,0,0,0|1,0,0]=3 7000 B12R1.374 NCCCc1cc(Cl)ccc1O Amb18909512 [0,2,0,0,0,0|1,0,0]=3 7001 B12R1.374 NCCCc1cc(F)ccc1Cl Amb18821281 [0,2,0,0,0,0|1,0,0]=3 7002 B12R1.374 NCCCc1cc(F)ccc1F Amb18980797 [0,2,0,0,0,0|1,0,0]=3 7003 B12R1.374 NCCCc1cc(F)ccc1O Amb18556316 [0,2,0,0,0,0|1,0,0]=3 7004 B12R1.374 NCCCc1cc(I)ccc1F Amb24627911 [0,2,0,0,0,0|1,0,0]=3 7005 B12R1.374 NCCCc1cc(I)ccc1O Amb25063089 [0,2,0,0,0,0|1,0,0]=3 7006 B12R1.374 NCCCc1cc(O)ccc1Br Amb24537692 [0,2,0,0,0,0|1,0,0]=3 7007 B12R1.374 NCCCc1cc(O)ccc1Cl Amb25682654 [0,2,0,0,0,0|1,0,0]=3 7008 B12R1.374 NCCNc1cc(Br)ccc1Br Amb25302841 [0,2,0,0,0,0|2,0,0]=4 7009 B12R1.374 NCCNc1cc(Br)ccc1F Amb24732633 [0,2,0,0,0,0|2,0,0]=4 7010 B12R1.374 NCCNc1cc(Br)ccc1I Amb25086988 [0,2,0,0,0,0|2,0,0]=4 7011 B12R1.374 NCCNc1cc(Cl)ccc1Br Amb25268806 [0,2,0,0,0,0|2,0,0]=4 7012 B12R1.374 NCCNc1cc(Cl)ccc1Cl Amb17091082 [0,2,0,0,0,0|2,0,0]=4 7013 B12R1.374 NCCNc1cc(Cl)ccc1F Amb18243910 [0,2,0,0,0,0|2,0,0]=4 7014 B12R1.374 NCCNc1cc(F)ccc1Cl Amb24380239 [0,2,0,0,0,0|2,0,0]=4 7015 B12R1.374 NCCNc1cc(F)ccc1F Amb18997936 [0,2,0,0,0,0|2,0,0]=4 7016 B12R1.374 NCCOc1cc(Cl)ccc1Cl Amb21927638 [0,2,0,0,0,0|2,0,0]=4 7017 B12R1.374 NCCOc1cc(Cl)ccc1Cl Amb2446347 [0,2,0,0,0,0|2,0,0]=4 7018 B12R1.374 NCCOc1cc(Cl)ccc1F Amb18243938 [0,2,0,0,0,0|2,0,0]=4 7019 B12R1.374 NCCOc1cc(F)ccc1Br Amb25106321 [0,2,0,0,0,0|2,0,0]=4 7020 B12R1.374 NCCOc1cc(F)ccc1F Amb18243555 [0,2,0,0,0,0|2,0,0]=4 7021 B12R1.374 NCCOc1cc(O)ccc1Cl Amb25111598 [0,2,0,0,0,0|2,0,0]=4 7022 B12R1.374 NNCCc1cc(Cl)ccc1F Amb24392022 [0,2,0,0,0,0|0,0,0]=2 7023 B12R1.374 NNCOc1cc(Cl)ccc1Cl Amb21837660 [0,2,0,0,0,0|1,0,0]=3 7024 B12R1.374 NOCCN1C=C(Br)C=CC1=O Amb25348253 [0,2,0,0,0,0|2,0,0]=4 7025 B12R1.374 NOCCc1cc(Br)ccc1F Amb25159910 [0,2,0,0,0,0|1,0,0]=3 7026 B12R1.374 Nc1[n]cc(Cl)cc1CCCN Amb25252492 [0,2,0,0,0,0|2,0,0]=4 7027 B12R1.374 Nc1[n]cc(I)cc1CCCN Amb24483673 [0,2,0,0,0,0|2,0,0]=4 7028 B12R1.374 Nc1cc(CCC#N)c(Cl)cc1 Amb18648452 [0,2,0,0,0,0|1,0,1]=4 7029 B12R1.374 Nc1cc(CCC#N)c(I)cc1 Amb25239028 [0,2,0,0,0,0|1,0,1]=4 7030 B12R1.374 Nc1cc(CCC#N)c(S)cc1 Amb25253207 [0,2,0,0,0,0|1,0,1]=4 7031 B12R1.374 Nc1cc(CCC=O)c(Cl)cc1 Amb25352154 [0,2,0,0,0,0|2,0,0]=4 7032 B12R1.374 Nc1cc(CCC=O)c(I)cc1 Amb24695620 [0,2,0,0,0,0|2,0,0]=4 7033 B12R1.374 Nc1cc(CCCBr)c(N)cc1 Amb24665868 [0,2,0,0,0,0|2,0,0]=4 7034 B12R1.374 Nc1cc(CCCCl)c(N)cc1 Amb25239005 [0,2,0,0,0,0|2,0,0]=4 7035 B12R1.374 Nc1ccc(Br)c(CCCBr)c1 Amb24541058 [0,2,0,0,0,0|2,0,0]=4 7036 B12R1.374 Nc1ccc(Br)cc1CCC=O Amb24596596 [0,2,0,0,0,0|2,0,0]=4 7037 B12R1.374 Nc1ccc(Cl)c(c1)OCCN Amb24574085 [0,2,0,0,0,0|2,0,0]=4 7038 B12R1.374 Nc1ccc(Cl)cc1CCC#N Amb24579227 [0,2,0,0,0,0|1,0,1]=4 7039 B12R1.374 Nc1ccc(Cl)cc1CCC=O Amb24756893 [0,2,0,0,0,0|2,0,0]=4 7040 B12R1.374 Nc1ccc(Cl)cc1CCCCl Amb25779328 [0,2,0,0,0,0|2,0,0]=4 7041 B12R1.374 Nc1ccc(Cl)cc1CCCN Amb25177280 [0,2,0,0,0,0|1,0,0]=3 7042 B12R1.374 Nc1ccc(Cl)cc1NCCN Amb25843427 [0,2,0,0,0,0|2,0,0]=4 7043 B12R1.374 Nc1ccc(Cl)cc1SCCN Amb24641295 [0,2,0,0,0,0|2,0,0]=4 7044 B12R1.374 Nc1ccc(F)cc1NCCN Amb18991517 [0,2,0,0,0,0|2,0,0]=4 7045 B12R1.374 Nc1ccc(F)cc1SCCN Amb25732834 [0,2,0,0,0,0|2,0,0]=4 7046 B12R1.374 Nc1ccc(I)cc1CCC#N Amb25248951 [0,2,0,0,0,0|1,0,1]=4 7047 B12R1.374 Nc1ccc(O)c(CCCN)c1 Amb25212967 [0,2,0,0,0,0|1,0,0]=3 7048 B12R1.374 Nc1ccc(O)cc1CCCN Amb24094576 [0,2,0,0,0,0|1,0,0]=3 7049 B12R1.374 O=CCCc1cc(Br)ccc1Cl Amb24093048 [0,2,0,0,0,0|2,0,0]=4 7050 B12R1.374 O=CCCc1cc(Cl)ccc1Br Amb25669683 [0,2,0,0,0,0|2,0,0]=4 7051 B12R1.374 O=CCCc1cc(Cl)ccc1F Amb25336451 [0,2,0,0,0,0|2,0,0]=4 7052 B12R1.374 O=CCCc1cc(F)ccc1Br Amb20669022 [0,2,0,0,0,0|2,0,0]=4 7053 B12R1.374 O=CCCc1cc(F)ccc1F Amb18801724 [0,2,0,0,0,0|2,0,0]=4 7054 B12R1.374 O=CCCc1cc(F)ccc1I Amb25302517 [0,2,0,0,0,0|2,0,0]=4 7055 B12R1.374 OCCCc1cc(Br)ccc1F Amb25669437 [0,2,0,0,0,0|2,0,0]=4 7056 B12R1.374 OCCCc1cc(Cl)ccc1F Amb18863273 [0,2,0,0,0,0|2,0,0]=4 7057 B12R1.374 OCCCc1cc(F)ccc1Cl Amb25271650 [0,2,0,0,0,0|2,0,0]=4 7058 B12R1.374 OCCCc1cc(F)ccc1F Amb17605791 [0,2,0,0,0,0|2,0,0]=4 7059 B12R1.374 Oc1cc(CCC=O)c(Br)cc1 Amb25311997 [0,2,0,0,0,0|2,0,0]=4 7060 B12R1.374 Oc1cc(CCC=O)c(S)cc1 Amb25253244 [0,2,0,0,0,0|2,0,0]=4 7061 B12R1.374 Oc1cc(CCCBr)c(Cl)cc1 Amb24569466 [0,2,0,0,0,0|2,0,0]=4 7062 B12R1.374 Oc1ccc(Cl)c(CCCCl)c1 Amb25208780 [0,2,0,0,0,0|2,0,0]=4 7063 B12R1.374 Oc1ccc(Cl)cc1CCCO Amb25762478 [0,2,0,0,0,0|2,0,0]=4 7064 B12R1.374 Oc1ccc(F)c(CCCO)c1 Amb24588858 [0,2,0,0,0,0|2,0,0]=4 7065 B12R1.374 Oc1ccc(F)cc1CCC=O Amb24432683 [0,2,0,0,0,0|2,0,0]=4 7066 B12R1.374 Oc1ccc(F)cc1CCCO Amb24377655 [0,2,0,0,0,0|2,0,0]=4 7067 B12R1.374 Oc1ccc(I)cc1CCCCl Amb25209323 [0,2,0,0,0,0|2,0,0]=4 7068 B12R1.1631 BrCCCc1c(F)cccc1Cl Amb17104568 [0,2,0,0,0,0|2,0,0]=4 7069 B12R1.1631 C#CCCc1c(Cl)cccc1Cl Amb18115182 [0,2,0,0,0,0|2,0,0]=4 7070 B12R1.1631 C#CCCc1c(F)cccc1Cl Amb18636109 [0,2,0,0,0,0|2,0,0]=4 7071 B12R1.1631 CC1=CC=CC(=O)N1CCCN Amb18535488 [0,2,0,0,0,0|2,0,0]=4 7072 B12R1.1631 CC1=CC=CC(=O)N1CCCN Amb22587371 [0,2,0,0,0,0|2,0,0]=4 7073 B12R1.1631 CC1=CC=CC(=O)N1CCNC Amb18299425 [0,2,0,0,0,0|2,0,0]=4 7074 B12R1.1631 CCCCc1c(N)cccc1Cl Amb25365047 [0,2,0,0,0,0|2,0,0]=4 7075 B12R1.1631 CNCCc1c(C)c[n]cc1C Amb24651320 [0,2,0,0,0,0|2,0,0]=4 7076 B12R1.1631 CNCCc1c(Cl)cccc1Cl Amb17193870 [0,2,0,0,0,0|1,0,0]=3 7077 B12R1.1631 CNCCc1c(F)cccc1Br Amb24603339 [0,2,0,0,0,0|1,0,0]=3 7078 B12R1.1631 CNCCc1c(F)cccc1F Amb25342833 [0,2,0,0,0,0|1,0,0]=3 7079 B12R1.1631 CNCCc1c(O)cccc1F Amb25207994 [0,2,0,0,0,0|1,0,0]=3 7080 B12R1.1631 CNCCc1c(O)cccc1O Amb25270300 [0,2,0,0,0,0|1,0,0]=3 7081 B12R1.1631 CSCCc1c(Br)cccc1I Amb24632614 [0,2,0,0,0,0|2,0,0]=4 7082 B12R1.1631 CSCCc1c(F)cccc1Cl Amb25318344 [0,2,0,0,0,0|2,0,0]=4 7083 B12R1.1631 Cc1[n]ccc(Cl)c1CCCN Amb25049451 [0,2,0,0,0,0|2,0,0]=4 7084 B12R1.1631 Cc1c[n]cc(Cl)c1CCCN Amb25775233 [0,2,0,0,0,0|2,0,0]=4 7085 B12R1.1631 Cc1cc[n]c(F)c1CCCN Amb24682309 [0,2,0,0,0,0|2,0,0]=4 7086 B12R1.1631 Cc1cc[n]c(N)c1CCCN Amb25355269 [0,2,0,0,0,0|2,0,0]=4 7087 B12R1.1631 Cc1cccc(Br)c1CCC=O Amb24341814 [0,2,0,0,0,0|2,0,0]=4 7088 B12R1.1631 Cc1cccc(C)c1CCC#N Amb25156532 [0,2,0,0,0,0|1,0,1]=4 7089 B12R1.1631 Cc1cccc(C)c1CCC=O Amb24092993 [0,2,0,0,0,0|2,0,0]=4 7090 B12R1.1631 Cc1cccc(C)c1CCCN Amb18251668 [0,2,0,0,0,0|1,0,0]=3 7091 B12R1.1631 Cc1cccc(Cl)c1CCCCl Amb25234260 [0,2,0,0,0,0|2,0,0]=4 7092 B12R1.1631 Cc1cccc(Cl)c1CCCO Amb25791304 [0,2,0,0,0,0|2,0,0]=4 7093 B12R1.1631 Cc1cccc(F)c1CCC=O Amb24432818 [0,2,0,0,0,0|2,0,0]=4 7094 B12R1.1631 Cc1cccc(F)c1CCCBr Amb24637088 [0,2,0,0,0,0|2,0,0]=4 7095 B12R1.1631 Cc1cccc(F)c1CCNC Amb25311693 [0,2,0,0,0,0|1,0,0]=3 7096 B12R1.1631 Cc1cccc(F)c1OCCN Amb24367943 [0,2,0,0,0,0|2,0,0]=4 7097 B12R1.1631 Cc1cccc(I)c1CCCCl Amb24561233 [0,2,0,0,0,0|2,0,0]=4 7098 B12R1.1631 Cc1cccc(N)c1CCCBr Amb25223463 [0,2,0,0,0,0|2,0,0]=4 7099 B12R1.1631 Cc1cccc(N)c1CCCCl Amb25253324 [0,2,0,0,0,0|2,0,0]=4 7100 B12R1.1631 Cc1cccc(O)c1CCC#N Amb24527960 [0,2,0,0,0,0|1,0,1]=4 7101 B12R1.1631 ClCCCc1c(Br)cccc1Br Amb25208586 [0,2,0,0,0,0|2,0,0]=4 7102 B12R1.1631 ClCCCc1c(Cl)cccc1Cl Amb24341769 [0,2,0,0,0,0|2,0,0]=4 7103 B12R1.1631 ClCCCc1c(F)cccc1Cl Amb17104540 [0,2,0,0,0,0|2,0,0]=4 7104 B12R1.1631 Clc1cccc(Cl)c1CCCBr Amb24456278 [0,2,0,0,0,0|2,0,0]=4 7105 B12R1.1631 Clc1cccc(I)c1CCCBr Amb24695695 [0,2,0,0,0,0|2,0,0]=4 7106 B12R1.1631 Clc1cccc(I)c1CCCCl Amb25195180 [0,2,0,0,0,0|2,0,0]=4 7107 B12R1.1631 Fc1cccc(Br)c1CCCBr Amb25312282 [0,2,0,0,0,0|2,0,0]=4 7108 B12R1.1631 Fc1cccc(F)c1CCCBr Amb25152621 [0,2,0,0,0,0|2,0,0]=4 7109 B12R1.1631 Fc1cccc(F)c1CCCCl Amb25189588 [0,2,0,0,0,0|2,0,0]=4 7110 B12R1.1631 N#CCCc1c(Cl)cccc1Cl Amb19038886 [0,2,0,0,0,0|1,0,1]=4 7111 B12R1.1631 N#CCCc1c(F)cccc1Br Amb25311739 [0,2,0,0,0,0|1,0,1]=4 7112 B12R1.1631 N#CCCc1c(F)cccc1Cl Amb19057365 [0,2,0,0,0,0|1,0,1]=4 7113 B12R1.1631 N#CCCc1c(F)cccc1I Amb25254633 [0,2,0,0,0,0|1,0,1]=4 7114 B12R1.1631 N#CCCc1c(F)cccc1S Amb25209546 [0,2,0,0,0,0|1,0,1]=4 7115 B12R1.1631 N#CCCc1c(O)cccc1I Amb24527834 [0,2,0,0,0,0|1,0,1]=4 7116 B12R1.1631 N#CCCc1c(O)cccc1O Amb24579256 [0,2,0,0,0,0|1,0,1]=4 7117 B12R1.1631 NCCCN1C(=O)C=CC=C1Br Amb18040601 [0,2,0,0,0,0|2,0,0]=4 7118 B12R1.1631 NCCCc1c(Br)c[n]cc1Br Amb25687067 [0,2,0,0,0,0|2,0,0]=4 7119 B12R1.1631 NCCCc1c(Cl)cccc1Br Amb24447135 [0,2,0,0,0,0|1,0,0]=3 7120 B12R1.1631 NCCCc1c(F)[n]ccc1Cl Amb25682533 [0,2,0,0,0,0|2,0,0]=4 7121 B12R1.1631 NCCCc1c(F)cccc1Cl Amb22548235 [0,2,0,0,0,0|1,0,0]=3 7122 B12R1.1631 NCCCc1c(F)cccc1F Amb18981388 [0,2,0,0,0,0|1,0,0]=3 7123 B12R1.1631 NCCCc1c(O)cccc1F Amb25149830 [0,2,0,0,0,0|1,0,0]=3 7124 B12R1.1631 NCCNc1c(Br)cccc1Br Amb25823941 [0,2,0,0,0,0|2,0,0]=4 7125 B12R1.1631 NCCNc1c(C)cccc1C Amb17091053 [0,2,0,0,0,0|2,0,0]=4 7126 B12R1.1631 NCCNc1c(Cl)cccc1Cl Amb18130950 [0,2,0,0,0,0|2,0,0]=4 7127 B12R1.1631 NCCNc1c(F)cccc1Br Amb24669803 [0,2,0,0,0,0|2,0,0]=4 7128 B12R1.1631 NCCNc1c(F)cccc1F Amb17091087 [0,2,0,0,0,0|2,0,0]=4 7129 B12R1.1631 NCCOc1c(F)cccc1F Amb22396841 [0,2,0,0,0,0|2,0,0]=4 7130 B12R1.1631 NCCSc1c(Cl)cccc1Cl Amb25296115 [0,2,0,0,0,0|2,0,0]=4 7131 B12R1.1631 NNCCc1c(Cl)cccc1Cl Amb19887712 [0,2,0,0,0,0|0,0,0]=2 7132 B12R1.1631 NOCCc1c(F)cccc1F Amb22900926 [0,2,0,0,0,0|1,0,0]=3 7133 B12R1.1631 Nc1cccc(Br)c1CCC=O Amb25217703 [0,2,0,0,0,0|2,0,0]=4 7134 B12R1.1631 Nc1cccc(Br)c1CCCCl Amb24626552 [0,2,0,0,0,0|2,0,0]=4 7135 B12R1.1631 Nc1cccc(Cl)c1CCC=O Amb24727767 [0,2,0,0,0,0|2,0,0]=4 7136 B12R1.1631 Nc1cccc(Cl)c1CCCBr Amb24727766 [0,2,0,0,0,0|2,0,0]=4 7137 B12R1.1631 Nc1cccc(Cl)c1NCCN Amb18991499 [0,2,0,0,0,0|2,0,0]=4 7138 B12R1.1631 Nc1cccc(Cl)c1SCCN Amb18975708 [0,2,0,0,0,0|2,0,0]=4 7139 B12R1.1631 Nc1cccc(F)c1CCC=O Amb24579332 [0,2,0,0,0,0|2,0,0]=4 7140 B12R1.1631 Nc1cccc(F)c1NCCN Amb25089972 [0,2,0,0,0,0|2,0,0]=4 7141 B12R1.1631 Nc1cccc(N)c1CCC=O Amb25195431 [0,2,0,0,0,0|2,0,0]=4 7142 B12R1.1631 Nc1cccc(N)c1CCCBr Amb25312577 [0,2,0,0,0,0|2,0,0]=4 7143 B12R1.1631 Nc1cccc(O)c1CCC=O Amb24756892 [0,2,0,0,0,0|2,0,0]=4 7144 B12R1.1631 O=CCCc1c(Br)cccc1Br Amb24092995 [0,2,0,0,0,0|2,0,0]=4 7145 B12R1.1631 O=CCCc1c(Cl)cccc1Cl Amb24092996 [0,2,0,0,0,0|2,0,0]=4 7146 B12R1.1631 O=CCCc1c(F)cccc1Br Amb25035166 [0,2,0,0,0,0|2,0,0]=4 7147 B12R1.1631 O=CCCc1c(F)cccc1Cl Amb17081684 [0,2,0,0,0,0|2,0,0]=4 7148 B12R1.1631 O=CCCc1c(F)cccc1F Amb25728226 [0,2,0,0,0,0|2,0,0]=4 7149 B12R1.1631 O=CCCc1c(F)cccc1I Amb25055675 [0,2,0,0,0,0|2,0,0]=4 7150 B12R1.1631 OCCCc1c(Cl)cccc1Br Amb25829173 [0,2,0,0,0,0|2,0,0]=4 7151 B12R1.1631 OCCCc1c(Cl)cccc1Cl Amb24356168 [0,2,0,0,0,0|2,0,0]=4 7152 B12R1.1631 OCCCc1c(F)cccc1Cl Amb17089506 [0,2,0,0,0,0|2,0,0]=4 7153 B12R1.1631 OCCCc1c(F)cccc1F Amb24447301 [0,2,0,0,0,0|2,0,0]=4 7154 B12R1.1631 Oc1cccc(Br)c1CCCBr Amb25377434 [0,2,0,0,0,0|2,0,0]=4 7155 B12R1.1631 Oc1cccc(Br)c1CCCCl Amb24638372 [0,2,0,0,0,0|2,0,0]=4 7156 B12R1.1631 Oc1cccc(Cl)c1CCCO Amb24416761 [0,2,0,0,0,0|2,0,0]=4 7157 B12R1.1631 Oc1cccc(F)c1CCC=O Amb25066926 [0,2,0,0,0,0|2,0,0]=4 7158 B12R1.1631 Oc1cccc(I)c1CCC=O Amb25784762 [0,2,0,0,0,0|2,0,0]=4 7159 B12R1.1631 Oc1cccc(I)c1CCCBr Amb24758191 [0,2,0,0,0,0|2,0,0]=4 7160 B12R1.1631 Oc1cccc(O)c1CCC=O Amb25268615 [0,2,0,0,0,0|2,0,0]=4 7161 B12R1.1631 Oc1cccc(O)c1CCCBr Amb24639237 [0,2,0,0,0,0|2,0,0]=4 7162 B12R1.1631 Oc1cccc(O)c1CCCCl Amb25218074 [0,2,0,0,0,0|2,0,0]=4 7163 B12R1.1631 SCCCc1c(F)cccc1Cl Amb17402978 [0,2,0,0,0,0|2,0,0]=4 7164 B12R1.1631 Sc1cccc(Br)c1CCCBr Amb25217975 [0,2,0,0,0,0|2,0,0]=4 7165 B12R1.1631 Sc1cccc(I)c1CCCCl Amb24628126 [0,2,0,0,0,0|2,0,0]=4 7166 B12R1.28 BrCCCOc1cccc(c1)C Amb1675755 [0,2,0,0,0,0|2,0,0]=4 7167 B12R1.28 C#CCCNc1cccc(F)c1 Amb25800317 [0,2,0,0,0,0|2,0,0]=4 7168 B12R1.28 C#CCCOc1cccc(F)c1 Amb24706220 [0,2,0,0,0,0|2,0,0]=4 7169 B12R1.28 C#CCCOc1cccc(I)c1 Amb24646963 [0,2,0,0,0,0|2,0,0]=4 7170 B12R1.28 C#CCCOc1cccc(N)c1 Amb18971498 [0,2,0,0,0,0|2,0,0]=4 7171 B12R1.28 C#CCCSc1cccc(F)c1 Amb24487394 [0,2,0,0,0,0|2,0,0]=4 7172 B12R1.28 C#CCCSc1cccc(N)c1 Amb24418218 [0,2,0,0,0,0|2,0,0]=4 7173 B12R1.28 C#CCNCc1cccc(Br)c1 Amb21979461 [0,2,0,0,0,0|2,0,0]=4 7174 B12R1.28 C#CCNCc1cccc(Cl)c1 Amb21979462 [0,2,0,0,0,0|2,0,0]=4 7175 B12R1.28 C#CCOCc1cccc(Br)c1 Amb23512551 [0,2,0,0,0,0|2,0,0]=4 7176 B12R1.28 C#CCOCc1cccc(N)c1 Amb24116425 [0,2,0,0,0,0|2,0,0]=4 7177 B12R1.28 C#CCSCc1cccc(Br)c1 Amb25204934 [0,2,0,0,0,0|2,0,0]=4 7178 B12R1.28 C#CCSCc1cccc(Cl)c1 Amb25332082 [0,2,0,0,0,0|2,0,0]=4 7179 B12R1.28 C=CCCCc1cccc(c1)C Amb13890666 [0,2,0,0,0,0|2,0,0]=4 7180 B12R1.28 C=CCCCc1cccc(c1)Cl Amb13890654 [0,2,0,0,0,0|2,0,0]=4 7181 B12R1.28 C=CCCCc1cccc(c1)F Amb13890678 [0,2,0,0,0,0|2,0,0]=4 7182 B12R1.28 C=CCCNc1cccc(F)c1 Amb24072145 [0,2,0,0,0,0|2,0,0]=4 7183 B12R1.28 C=CCCOc1cccc(I)c1 Amb22503741 [0,2,0,0,0,0|2,0,0]=4 7184 B12R1.28 C=CCCOc1cccc(N)c1 Amb24271220 [0,2,0,0,0,0|2,0,0]=4 7185 B12R1.28 C=CCNCc1cccc(Cl)c1 Amb19890325 [0,2,0,0,0,0|2,0,0]=4 7186 B12R1.28 C=CCNCc1cccc(F)c1 Amb20673583 [0,2,0,0,0,0|2,0,0]=4 7187 B12R1.28 C=CCNCc1cccc(O)c1 Amb19890781 [0,2,0,0,0,0|2,0,0]=4 7188 B12R1.28 C=CCNCc1cccc(c1)Br Amb1923351 [0,2,0,0,0,0|2,0,0]=4 7189 B12R1.28 C=CCOCc1cccc(I)c1 Amb22503743 [0,2,0,0,0,0|2,0,0]=4 7190 B12R1.28 CCCCCc1cccc(F)c1 Amb22235097 [0,2,0,0,0,0|2,0,0]=4 7191 B12R1.28 CCCCNc1cccc(I)c1 Amb19232035 [0,2,0,0,0,0|2,0,0]=4 7192 B12R1.28 CCCCOc1cccc([NH3+])c1 Amb22483190 [0,2,0,0,0,0|2,0,0]=4 7193 B12R1.28 CCCCOc1cccc(c1)N Amb1132055 [0,2,0,0,0,0|2,0,0]=4 7194 B12R1.28 CCCCOc1cccc(c1)N Amb2140562 [0,2,0,0,0,0|2,0,0]=4 7195 B12R1.28 CCCNCc1cccc(F)c1 Amb20673497 [0,2,0,0,0,0|2,0,0]=4 7196 B12R1.28 CCCNCc1cccc(O)c1 Amb20673478 [0,2,0,0,0,0|2,0,0]=4 7197 B12R1.28 CCCNCc1cccc(c1)Br Amb1922696 [0,2,0,0,0,0|2,0,0]=4 7198 B12R1.28 CCCNCc1cccc(c1)Cl Amb1923473 [0,2,0,0,0,0|2,0,0]=4 7199 B12R1.28 CCNCCc1cccc(N)c1 Amb18550383 [0,2,0,0,0,0|1,0,0]=3 7200 B12R1.28 CCNCCc1cccc(c1)Br Amb17407066 [0,2,0,0,0,0|1,0,0]=3 7201 B12R1.28 CCNCCc1cccc(c1)C Amb17193871 [0,2,0,0,0,0|1,0,0]=3 7202 B12R1.28 CNCCCc1cccc(c1)Br Amb17104522 [0,2,0,0,0,0|1,0,0]=3 7203 B12R1.28 CNCCCc1cccc(c1)C Amb17104500 [0,2,0,0,0,0|1,0,0]=3 7204 B12R1.28 CNCCCc1cccc(c1)Cl Amb17104508 [0,2,0,0,0,0|1,0,0]=3 7205 B12R1.28 CNCCCc1cccc(c1)F Amb17605539 [0,2,0,0,0,0|1,0,0]=3 7206 B12R1.28 CNCCNc1cc(Br)c[n]c1 Amb24768535 [0,2,0,0,0,0|2,0,0]=4 7207 B12R1.28 CNCCNc1cc(Br)ccc1 Amb19025286 [0,2,0,0,0,0|1,0,0]=3 7208 B12R1.28 CNCCNc1cc(Cl)ccc1 Amb19025283 [0,2,0,0,0,0|1,0,0]=3 7209 B12R1.28 CNCCNc1cc(F)ccc1 Amb19025285 [0,2,0,0,0,0|1,0,0]=3 7210 B12R1.28 CNCCNc1cccc(N)[n]1 Amb25060051 [0,2,0,0,0,0|2,0,0]=4 7211 B12R1.28 CNCCOc1c[n]cc(N)c1 Amb24062309 [0,2,0,0,0,0|2,0,0]=4 7212 B12R1.28 CNCCOc1cc(Cl)cc[n]1 Amb22236271 [0,2,0,0,0,0|2,0,0]=4 7213 B12R1.28 CNCCOc1cccc(c1)C Amb1670237 [0,2,0,0,0,0|1,0,0]=3 7214 B12R1.28 CNCCOc1cccc(c1)C Amb2140579 [0,2,0,0,0,0|1,0,0]=3 7215 B12R1.28 CNCCOc1cccc(c1)Cl Amb1106194 [0,2,0,0,0,0|1,0,0]=3 7216 B12R1.28 CNCCOc1cccc(c1)F Amb2132298 [0,2,0,0,0,0|1,0,0]=3 7217 B12R1.28 CNCCOc1cccc(c1)N Amb17232614 [0,2,0,0,0,0|1,0,0]=3 7218 B12R1.28 CNC\C=C\c1cccc(Cl)c1 Amb23442784 [0,2,0,0,0,0|1,0,1]=4 7219 B12R1.28 CNC\C=C\c1cccc(F)c1 Amb23442889 [0,2,0,0,0,0|1,0,1]=4 7220 B12R1.28 CNC\C=C\c1cccc(I)c1 Amb24493313 [0,2,0,0,0,0|1,0,1]=4 7221 B12R1.28 COCCOc1cccc(c1)N Amb1995345 [0,2,0,0,0,0|2,0,0]=4 7222 B12R1.28 COCCOc1cccc(c1)N Amb2189171 [0,2,0,0,0,0|2,0,0]=4 7223 B12R1.28 CSCCNc1cccc(F)c1 Amb19025515 [0,2,0,0,0,0|2,0,0]=4 7224 B12R1.28 CSCCNc1cccc(I)c1 Amb25232446 [0,2,0,0,0,0|2,0,0]=4 7225 B12R1.28 CSCCNc1cccc(c1)C Amb17307508 [0,2,0,0,0,0|2,0,0]=4 7226 B12R1.28 CSCCOc1cccc(c1)N Amb17504021 [0,2,0,0,0,0|2,0,0]=4 7227 B12R1.28 Cc1cc(CCCCN)[n]cc1 Amb18828700 [0,2,0,0,0,0|2,0,0]=4 7228 B12R1.28 Cc1cc(CCCCS)ccc1 Amb18564155 [0,2,0,0,0,0|2,0,0]=4 7229 B12R1.28 Cc1cc(CCNC#N)ccc1 Amb18800415 [0,2,0,0,0,0|0,0,1]=3 7230 B12R1.28 Cc1cc(CCNC=O)ccc1 Amb25758483 [0,2,0,0,0,0|1,0,0]=3 7231 B12R1.28 Cc1cc(CNCC#C)ccc1 Amb21979538 [0,2,0,0,0,0|2,0,0]=4 7232 B12R1.28 Cc1cc(CNCC=C)ccc1 Amb19890661 [0,2,0,0,0,0|2,0,0]=4 7233 B12R1.28 Cc1cc(CSCC#C)ccc1 Amb18184115 [0,2,0,0,0,0|2,0,0]=4 7234 B12R1.28 Cc1cc(CSCC#N)ccc1 Amb18804686 [0,2,0,0,0,0|1,0,1]=4 7235 B12R1.28 Cc1cc(NCCCN)[n]cc1 Amb18798447 [0,2,0,0,0,0|2,0,0]=4 7236 B12R1.28 Cc1cc(\C=C\CNN)ccc1 Amb18645726 [0,2,0,0,0,0|0,0,1]=3 7237 B12R1.28 Cc1cc(cc[n]1)NCCCN Amb25074981 [0,2,0,0,0,0|2,0,0]=4 7238 B12R1.28 Cc1cc(cc[n]1)NCCNC Amb24350200 [0,2,0,0,0,0|2,0,0]=4 7239 B12R1.28 Cc1cc(ccc1)C#CCCN Amb25766570 [0,2,0,0,0,0|1,0,1]=4 7240 B12R1.28 Cc1cc(ccc1)C#CCNC Amb25799352 [0,2,0,0,0,0|1,0,1]=4 7241 B12R1.28 Cc1cc(ccc1)NCCCF Amb25809142 [0,2,0,0,0,0|2,0,0]=4 7242 B12R1.28 Cc1cc(ccc1)OCCC#C Amb24732559 [0,2,0,0,0,0|2,0,0]=4 7243 B12R1.28 Cc1cc(ccc1)SCCC#C Amb25148457 [0,2,0,0,0,0|2,0,0]=4 7244 B12R1.28 Cc1cc(ccc1)SCCC#N Amb18790888 [0,2,0,0,0,0|1,0,1]=4 7245 B12R1.28 Cc1cc(ccc1)SCCCCl Amb18317179 [0,2,0,0,0,0|2,0,0]=4 7246 B12R1.28 Cc1cc[n]c(c1)NCCNC Amb19027466 [0,2,0,0,0,0|2,0,0]=4 7247 B12R1.28 Cc1cccc(CNCCC)c1 Amb20673492 [0,2,0,0,0,0|2,0,0]=4 7248 B12R1.28 Cc1cccc(NCCCN)[n]1 Amb19005111 [0,2,0,0,0,0|2,0,0]=4 7249 B12R1.28 Cc1cccc(NCCNC)[n]1 Amb19027494 [0,2,0,0,0,0|2,0,0]=4 7250 B12R1.28 Cc1cccc(c1)NCCNC Amb19025279 [0,2,0,0,0,0|1,0,0]=3 7251 B12R1.28 Cc1cccc(c1)\C=C\CNC Amb23442961 [0,2,0,0,0,0|1,0,1]=4 7252 B12R1.28 ClCCCOc1cccc(c1)Br Amb1128139 [0,2,0,0,0,0|2,0,0]=4 7253 B12R1.28 ClCCCOc1cccc(c1)C Amb1138744 [0,2,0,0,0,0|2,0,0]=4 7254 B12R1.28 ClCCCOc1cccc(c1)Cl Amb1126449 [0,2,0,0,0,0|2,0,0]=4 7255 B12R1.28 ClCCCOc1cccc(c1)F Amb1129297 [0,2,0,0,0,0|2,0,0]=4 7256 B12R1.28 FCCCNc1cccc(Br)c1 Amb25679781 [0,2,0,0,0,0|2,0,0]=4 7257 B12R1.28 FCCCNc1cccc(Cl)c1 Amb24350967 [0,2,0,0,0,0|2,0,0]=4 7258 B12R1.28 FCCCOc1cccc(Br)c1 Amb22008307 [0,2,0,0,0,0|2,0,0]=4 7259 B12R1.28 Fc1cc(CCCCS)ccc1 Amb18564294 [0,2,0,0,0,0|2,0,0]=4 7260 B12R1.28 Fc1cccc(c1)NCCCF Amb24452997 [0,2,0,0,0,0|2,0,0]=4 7261 B12R1.28 N#CCCNc1cccc(c1)C Amb1647378 [0,2,0,0,0,0|1,0,1]=4 7262 B12R1.28 N#CCCNc1cccc(c1)Cl Amb1647289 [0,2,0,0,0,0|1,0,1]=4 7263 B12R1.28 N#CCCNc1cccc(c1)O Amb17142902 [0,2,0,0,0,0|1,0,1]=4 7264 B12R1.28 N#CCCOc1cccc(c1)O Amb10564583 [0,2,0,0,0,0|1,0,1]=4 7265 B12R1.28 N#CCCSc1cccc(Cl)c1 Amb18325237 [0,2,0,0,0,0|1,0,1]=4 7266 B12R1.28 N#CCNCc1cccc(Br)c1 Amb18977748 [0,2,0,0,0,0|1,0,1]=4 7267 B12R1.28 N#CCNCc1cccc(c1)C Amb17400075 [0,2,0,0,0,0|1,0,1]=4 7268 B12R1.28 N#CCNCc1cccc(c1)Cl Amb2416269 [0,2,0,0,0,0|1,0,1]=4 7269 B12R1.28 N#CCOCc1cccc(Br)c1 Amb25211535 [0,2,0,0,0,0|1,0,1]=4 7270 B12R1.28 N#CCSCc1cccc(c1)Cl Amb17501727 [0,2,0,0,0,0|1,0,1]=4 7271 B12R1.28 N#CCSCc1cccc(c1)F Amb17501763 [0,2,0,0,0,0|1,0,1]=4 7272 B12R1.28 N#CNCCc1cccc(Br)c1 Amb24366281 [0,2,0,0,0,0|0,0,1]=3 7273 B12R1.28 N#CNCCc1cccc(F)c1 Amb18800780 [0,2,0,0,0,0|0,0,1]=3 7274 B12R1.28 NCCC#Cc1cc(Cl)ccc1 Amb25083732 [0,2,0,0,0,0|1,0,1]=4 7275 B12R1.28 NCCCCc1cccc(Br)c1 Amb18549204 [0,2,0,0,0,0|1,0,0]=3 7276 B12R1.28 NCCCCc1cccc(F)c1 Amb18563815 [0,2,0,0,0,0|1,0,0]=3 7277 B12R1.28 NCCCNC1=CC=CC(=O)N1 Amb25051511 [0,2,0,0,0,0|2,0,0]=4 7278 B12R1.28 NCCCNc1c[n]cc(Br)c1 Amb25825867 [0,2,0,0,0,0|2,0,0]=4 7279 B12R1.28 NCCCNc1c[n]cc(F)c1 Amb19017792 [0,2,0,0,0,0|2,0,0]=4 7280 B12R1.28 NCCCNc1cc(Cl)cc[n]1 Amb25675655 [0,2,0,0,0,0|2,0,0]=4 7281 B12R1.28 NCCCNc1cccc(c1)C Amb17057722 [0,2,0,0,0,0|1,0,0]=3 7282 B12R1.28 NCCCNc1cccc(c1)Cl Amb17057728 [0,2,0,0,0,0|1,0,0]=3 7283 B12R1.28 NCCCNc1cccc(c1)F Amb17057725 [0,2,0,0,0,0|1,0,0]=3 7284 B12R1.28 NCCCOc1cc(Br)cc[n]1 Amb22276283 [0,2,0,0,0,0|2,0,0]=4 7285 B12R1.28 NCCCOc1cc(Cl)cc[n]1 Amb22276287 [0,2,0,0,0,0|2,0,0]=4 7286 B12R1.28 NCCCOc1cccc(c1)C Amb1108604 [0,2,0,0,0,0|1,0,0]=3 7287 B12R1.28 NCCCOc1cccc(c1)C Amb1221739 [0,2,0,0,0,0|1,0,0]=3 7288 B12R1.28 NCCCOc1cccc(c1)F Amb1140971 [0,2,0,0,0,0|1,0,0]=3 7289 B12R1.28 NCCCSc1cccc(c1)C Amb17083071 [0,2,0,0,0,0|1,0,0]=3 7290 B12R1.28 NCCCSc1cccc(c1)Cl Amb17083080 [0,2,0,0,0,0|1,0,0]=3 7291 B12R1.28 NCCNCc1cccc(Br)c1 Amb19005476 [0,2,0,0,0,0|1,0,0]=3 7292 B12R1.28 NCCNCc1cccc(O)c1 Amb19005503 [0,2,0,0,0,0|1,0,0]=3 7293 B12R1.28 NCCNCc1cccc(c1)C Amb10075511 [0,2,0,0,0,0|1,0,0]=3 7294 B12R1.28 NCCNCc1cccc(c1)Cl Amb10075509 [0,2,0,0,0,0|1,0,0]=3 7295 B12R1.28 NCCNCc1cccc(c1)F Amb10075489 [0,2,0,0,0,0|1,0,0]=3 7296 B12R1.28 NCCOCc1cccc(c1)Br Amb17061821 [0,2,0,0,0,0|1,0,0]=3 7297 B12R1.28 NCCOCc1cccc(c1)C Amb17061815 [0,2,0,0,0,0|1,0,0]=3 7298 B12R1.28 NCCOCc1cccc(c1)Cl Amb17061820 [0,2,0,0,0,0|1,0,0]=3 7299 B12R1.28 NCCOCc1cccc(c1)F Amb17061818 [0,2,0,0,0,0|1,0,0]=3 7300 B12R1.28 NCCSCc1cc[n]c(Cl)c1 Amb19023098 [0,2,0,0,0,0|2,0,0]=4 7301 B12R1.28 NCC\C=C\c1cc(I)ccc1 Amb24560016 [0,2,0,0,0,0|1,0,1]=4 7302 B12R1.28 NCC\C=C\c1cc(O)ccc1 Amb24519589 [0,2,0,0,0,0|1,0,1]=4 7303 B12R1.28 NCC\C=C\c1cccc(c1)C Amb17232387 [0,2,0,0,0,0|1,0,1]=4 7304 B12R1.28 NCC\C=C\c1cccc(c1)Cl Amb17233875 [0,2,0,0,0,0|1,0,1]=4 7305 B12R1.28 NCC\C=C\c1cccc(c1)F Amb17232532 [0,2,0,0,0,0|1,0,1]=4 7306 B12R1.28 NNCCOc1cccc(c1)Br Amb1116522 [0,2,0,0,0,0|0,0,0]=2 7307 B12R1.28 NNCCOc1cccc(c1)C Amb17400212 [0,2,0,0,0,0|0,0,0]=2 7308 B12R1.28 NNCCOc1cccc(c1)Cl Amb17401092 [0,2,0,0,0,0|0,0,0]=2 7309 B12R1.28 NNCCOc1cccc(c1)F Amb17400322 [0,2,0,0,0,0|0,0,0]=2 7310 B12R1.28 NNC\C=C\c1cccc(Cl)c1 Amb18648721 [0,2,0,0,0,0|0,0,1]=3 7311 B12R1.28 NOCC#Cc1cc(F)ccc1 Amb24689943 [0,2,0,0,0,0|1,0,1]=4 7312 B12R1.28 NOCCCc1cccc(c1)Br Amb17089578 [0,2,0,0,0,0|1,0,0]=3 7313 B12R1.28 NOCCCc1cccc(c1)C Amb17089550 [0,2,0,0,0,0|1,0,0]=3 7314 B12R1.28 NOCCCc1cccc(c1)Cl Amb17089559 [0,2,0,0,0,0|1,0,0]=3 7315 B12R1.28 NOCCCc1cccc(c1)O Amb17089577 [0,2,0,0,0,0|1,0,0]=3 7316 B12R1.28 NOCCOc1cccc(c1)Br Amb17088298 [0,2,0,0,0,0|1,0,0]=3 7317 B12R1.28 NOCCOc1cccc(c1)C Amb17088289 [0,2,0,0,0,0|1,0,0]=3 7318 B12R1.28 NOCCOc1cccc(c1)Cl Amb17088295 [0,2,0,0,0,0|1,0,0]=3 7319 B12R1.28 NOCCOc1cccc(c1)F Amb17088292 [0,2,0,0,0,0|1,0,0]=3 7320 B12R1.28 N\N=C\CCc1c[n]cc(F)c1 Amb25048181 [0,2,0,0,0,0|1,0,1]=4 7321 B12R1.28 Nc1cc(CCCC#N)ccc1 Amb24681109 [0,2,0,0,0,0|1,0,1]=4 7322 B12R1.28 Nc1cc(ccc1)NCCCF Amb25132504 [0,2,0,0,0,0|2,0,0]=4 7323 B12R1.28 Nc1cc(ccc1)OCCC#N Amb18971514 [0,2,0,0,0,0|1,0,1]=4 7324 B12R1.28 Nc1cc(ccc1)OCCCCl Amb22831609 [0,2,0,0,0,0|2,0,0]=4 7325 B12R1.28 Nc1cc(ccc1)OCCCF Amb23539406 [0,2,0,0,0,0|2,0,0]=4 7326 B12R1.28 Nc1cc(ccc1)SCCC#N Amb25707773 [0,2,0,0,0,0|1,0,1]=4 7327 B12R1.28 O=C=NCCc1cccc(F)c1 Amb24392961 [0,2,0,0,0,0|1,0,1]=4 7328 B12R1.28 O=C=NCCc1cccc(c1)Br Amb17247243 [0,2,0,0,0,0|1,0,1]=4 7329 B12R1.28 O=C=NCCc1cccc(c1)C Amb17232366 [0,2,0,0,0,0|1,0,1]=4 7330 B12R1.28 O=CCCCc1cccc(Br)c1 Amb18048776 [0,2,0,0,0,0|2,0,0]=4 7331 B12R1.28 O=CCCSc1cccc(c1)C Amb17082972 [0,2,0,0,0,0|2,0,0]=4 7332 B12R1.28 O=CCCSc1cccc(c1)Cl Amb17082982 [0,2,0,0,0,0|2,0,0]=4 7333 B12R1.28 O=CNCCc1cccc(Br)c1 Amb24694394 [0,2,0,0,0,0|1,0,0]=3 7334 B12R1.28 O=CNCCc1cccc(F)c1 Amb25853482 [0,2,0,0,0,0|1,0,0]=3 7335 B12R1.28 OCCCCc1cccc(Br)c1 Amb20668830 [0,2,0,0,0,0|2,0,0]=4 7336 B12R1.28 OCCCNc1cccc(I)c1 Amb25091300 [0,2,0,0,0,0|2,0,0]=4 7337 B12R1.28 OCCCNc1cccc(c1)Br Amb17306225 [0,2,0,0,0,0|2,0,0]=4 7338 B12R1.28 OCCCNc1cccc(c1)C Amb17306565 [0,2,0,0,0,0|2,0,0]=4 7339 B12R1.28 OCCCNc1cccc(c1)Cl Amb17307144 [0,2,0,0,0,0|2,0,0]=4 7340 B12R1.28 OCCCNc1cccc(c1)F Amb17306246 [0,2,0,0,0,0|2,0,0]=4 7341 B12R1.28 OCCNCc1cccc(Cl)c1 Amb22284257 [0,2,0,0,0,0|2,0,0]=4 7342 B12R1.28 OCCNCc1cccc(F)c1 Amb24271193 [0,2,0,0,0,0|2,0,0]=4 7343 B12R1.28 OCCOCc1cccc(c1)Cl Amb2438435 [0,2,0,0,0,0|2,0,0]=4 7344 B12R1.28 ONCCOc1cccc(c1)Br Amb17088424 [0,2,0,0,0,0|1,0,0]=3 7345 B12R1.28 ONCCOc1cccc(c1)C Amb17088415 [0,2,0,0,0,0|1,0,0]=3 7346 B12R1.28 ONCCOc1cccc(c1)Cl Amb17088421 [0,2,0,0,0,0|1,0,0]=3 7347 B12R1.28 ONCCOc1cccc(c1)F Amb17088418 [0,2,0,0,0,0|1,0,0]=3 7348 B12R1.28 Oc1cc(CCN=C=O)ccc1 Amb24636993 [0,2,0,0,0,0|1,0,1]=4 7349 B12R1.28 Oc1cc(CCNC=O)ccc1 Amb24399967 [0,2,0,0,0,0|1,0,0]=3 7350 B12R1.28 S=C=NCCc1cccc(c1)Br Amb17255960 [0,2,0,0,0,0|1,0,1]=4 7351 B12R1.28 S=C=NCCc1cccc(c1)C Amb17233309 [0,2,0,0,0,0|1,0,1]=4 7352 B12R1.28 SCCCCc1cccc(Br)c1 Amb18072286 [0,2,0,0,0,0|2,0,0]=4 7353 B12R1.28 SCCCCc1cccc(Cl)c1 Amb18565790 [0,2,0,0,0,0|2,0,0]=4 7354 B12R1.28 SCCCOc1cccc(c1)Br Amb17258958 [0,2,0,0,0,0|2,0,0]=4 7355 B12R1.28 SCCCOc1cccc(c1)Cl Amb17237589 [0,2,0,0,0,0|2,0,0]=4 7356 B12R1.28 SCCCOc1cccc(c1)F Amb17234297 [0,2,0,0,0,0|2,0,0]=4 7357 B12R1.28 [C-]#[N+]CCOc1cccc(C)c1 Amb25249438 [0,2,0,0,0,0|1,0,1]=4 7358 B12R1.28 [C-]#[N+]CCOc1cccc(O)c1 Amb25178461 [0,2,0,0,0,0|1,0,1]=4 7359 B12R1.50 C#CC(N)Cc1cccc(Cl)c1 Amb25148721 [0,2,0,0,0,0|2,0,0]=4 7360 B12R1.50 C#CC(O)Cc1cccc(Br)c1 Amb24713259 [0,2,0,0,0,0|2,0,0]=4 7361 B12R1.50 C#CC(O)Cc1cccc(Cl)c1 Amb24362185 [0,2,0,0,0,0|2,0,0]=4 7362 B12R1.50 C#CC(O)Cc1cccc(F)c1 Amb25209915 [0,2,0,0,0,0|2,0,0]=4 7363 B12R1.50 C#C[C@@H](N)Cc1cccc(F)c1 Amb25825141 [0,2,0,0,0,0|2,0,0]=4 7364 B12R1.50 C=CC(N)Cc1cccc(Cl)c1 Amb25126466 [0,2,0,0,0,0|2,0,0]=4 7365 B12R1.50 C=CC(O)Cc1cccc(Cl)c1 Amb25343968 [0,2,0,0,0,0|2,0,0]=4 7366 B12R1.50 CC(CCl)Cc1cc(Br)ccc1 Amb24728303 [0,2,0,0,0,0|2,0,0]=4 7367 B12R1.50 CC(CN)Cc1cc(Br)ccc1 Amb18992227 [0,2,0,0,0,0|1,0,0]=3 7368 B12R1.50 CC(CN)Cc1cc(F)ccc1 Amb18299465 [0,2,0,0,0,0|1,0,0]=3 7369 B12R1.50 CC(CN)Cc1cc(O)ccc1 Amb24537853 [0,2,0,0,0,0|1,0,0]=3 7370 B12R1.50 CC(CN)Nc1cccc(F)c1 Amb18908739 [0,2,0,0,0,0|2,0,0]=4 7371 B12R1.50 CC(CN)Oc1cccc(Cl)c1 Amb18299442 [0,2,0,0,0,0|2,0,0]=4 7372 B12R1.50 CC(CN)Oc1cccc(Cl)c1 Amb19148897 [0,2,0,0,0,0|2,0,0]=4 7373 B12R1.50 CC(CN)Oc1cccc(F)c1 Amb18299439 [0,2,0,0,0,0|2,0,0]=4 7374 B12R1.50 CC(CN)Sc1cccc(Br)c1 Amb18301433 [0,2,0,0,0,0|2,0,0]=4 7375 B12R1.50 CC(CN)Sc1cccc(Cl)c1 Amb18299920 [0,2,0,0,0,0|2,0,0]=4 7376 B12R1.50 CC(CO)Cc1cc(Br)ccc1 Amb25729945 [0,2,0,0,0,0|2,0,0]=4 7377 B12R1.50 CC(CO)Cc1cc(Cl)ccc1 Amb25212222 [0,2,0,0,0,0|2,0,0]=4 7378 B12R1.50 CC(CO)Cc1cc(F)ccc1 Amb25228330 [0,2,0,0,0,0|2,0,0]=4 7379 B12R1.50 CC(Cc1cc(O)ccc1)CO Amb24579423 [0,2,0,0,0,0|2,0,0]=4 7380 B12R1.50 CC(Cc1cccc(Br)c1)C#N Amb25159927 [0,2,0,0,0,0|1,0,1]=4 7381 B12R1.50 CC(Cc1cccc(Br)c1)NN Amb25342052 [0,2,0,0,0,0|0,0,0]=2 7382 B12R1.50 CC(Cc1cccc(Cl)c1)C#N Amb25762801 [0,2,0,0,0,0|1,0,1]=4 7383 B12R1.50 CC(Cc1cccc(Cl)c1)C=O Amb25804355 [0,2,0,0,0,0|2,0,0]=4 7384 B12R1.50 CC(Cc1cccc(Cl)c1)NN Amb24434144 [0,2,0,0,0,0|0,0,0]=2 7385 B12R1.50 CC(Cc1cccc(F)c1)NN Amb25056305 [0,2,0,0,0,0|0,0,0]=2 7386 B12R1.50 CC(Cc1cccc(F)c1)NO Amb25056304 [0,2,0,0,0,0|1,0,0]=3 7387 B12R1.50 CC(Cc1cccc(I)c1)C=O Amb25850018 [0,2,0,0,0,0|2,0,0]=4 7388 B12R1.50 CC(Cc1cccc(N)c1)C=O Amb25251154 [0,2,0,0,0,0|2,0,0]=4 7389 B12R1.50 CC(Cc1cccc(O)c1)CBr Amb24444691 [0,2,0,0,0,0|2,0,0]=4 7390 B12R1.50 CC(Cc1cccc(O)c1)CCl Amb24537852 [0,2,0,0,0,0|2,0,0]=4 7391 B12R1.50 CCC(Br)Cc1cc(Br)ccc1 Amb18049408 [0,2,0,0,0,0|2,0,0]=4 7392 B12R1.50 CCC(Br)Cc1cc(F)ccc1 Amb25039883 [0,2,0,0,0,0|2,0,0]=4 7393 B12R1.50 CCC(Cc1cccc(c1)Br)Cl Amb17477597 [0,2,0,0,0,0|2,0,0]=4 7394 B12R1.50 CCC(Cc1cccc(c1)Br)O Amb17477580 [0,2,0,0,0,0|2,0,0]=4 7395 B12R1.50 CCC(Cc1cccc(c1)C)Cl Amb17477424 [0,2,0,0,0,0|2,0,0]=4 7396 B12R1.50 CCC(Cc1cccc(c1)C)O Amb17138582 [0,2,0,0,0,0|2,0,0]=4 7397 B12R1.50 CCC(Cc1cccc(c1)Cl)Cl Amb17477605 [0,2,0,0,0,0|2,0,0]=4 7398 B12R1.50 CCC(Cc1cccc(c1)Cl)O Amb17139102 [0,2,0,0,0,0|2,0,0]=4 7399 B12R1.50 CCC(Cc1cccc(c1)F)O Amb17138636 [0,2,0,0,0,0|2,0,0]=4 7400 B12R1.50 CCC(Cl)Cc1cc(F)ccc1 Amb19046367 [0,2,0,0,0,0|2,0,0]=4 7401 B12R1.50 CCC(N)Cc1cc(I)ccc1 Amb25800100 [0,2,0,0,0,0|2,0,0]=4 7402 B12R1.50 CC[C@@H](N)Cc1cc(F)ccc1 Amb24535474 [0,2,0,0,0,0|2,0,0]=4 7403 B12R1.50 CC[C@H](N)Cc1cc(Cl)ccc1 Amb24668259 [0,2,0,0,0,0|2,0,0]=4 7404 B12R1.50 CNC(=N)Cc1cccc(Br)c1 Amb25830995 [0,2,0,0,0,0|1,0,1]=4 7405 B12R1.50 CNC(=O)Cc1cccc(Br)c1 Amb23111023 [0,2,0,0,0,0|1,0,1]=4 7406 B12R1.50 CNC(=O)Cc1cccc(Cl)c1 Amb22984156 [0,2,0,0,0,0|1,0,1]=4 7407 B12R1.50 CNC(=O)Cc1cccc(O)c1 Amb18788342 [0,2,0,0,0,0|1,0,1]=4 7408 B12R1.50 CNC(=O)Cc1cccc(c1)C Amb2106610 [0,2,0,0,0,0|1,0,1]=4 7409 B12R1.50 CNC(C)Cc1cc[n]c(N)c1 Amb24604361 [0,2,0,0,0,0|2,0,0]=4 7410 B12R1.50 CNC(C)Cc1cccc(F)c1 Amb18792939 [0,2,0,0,0,0|1,0,0]=3 7411 B12R1.50 CNC(C)Cc1cccc(S)c1 Amb24542790 [0,2,0,0,0,0|1,0,0]=3 7412 B12R1.50 CNC(Cc1cccc(c1)F)C Amb17614425 [0,2,0,0,0,0|1,0,0]=3 7413 B12R1.50 CNC(Cc1cccc(n1)C)C Amb1995163 [0,2,0,0,0,0|2,0,0]=4 7414 B12R1.50 CNC(Cc1nccc(c1)C)C Amb1995160 [0,2,0,0,0,0|2,0,0]=4 7415 B12R1.50 CN[C@@H](C)Cc1cccc(O)c1 Amb25697180 [0,2,0,0,0,0|1,0,0]=3 7416 B12R1.50 C\C(\Cc1cccc(Cl)c1)=N\N Amb24636219 [0,2,0,0,0,0|0,0,2]=4 7417 B12R1.50 C\C(\Cc1cccc(F)c1)=N\N Amb25725343 [0,2,0,0,0,0|0,0,2]=4 7418 B12R1.50 Cc1c[n]cc(CC(C)CN)c1 Amb25702058 [0,2,0,0,0,0|2,0,0]=4 7419 B12R1.50 Cc1cc(CC(=O)CN)ccc1 Amb18829247 [0,2,0,0,0,0|1,0,1]=4 7420 B12R1.50 Cc1cc(CC(=O)NN)[n]cc1 Amb24501374 [0,2,0,0,0,0|1,0,1]=4 7421 B12R1.50 Cc1cc(CC(=O)NN)cc[n]1 Amb24615780 [0,2,0,0,0,0|1,0,1]=4 7422 B12R1.50 Cc1cc(CC(=O)NO)ccc1 Amb18798398 [0,2,0,0,0,0|1,0,1]=4 7423 B12R1.50 Cc1cc(CC(N)=NN)ccc1 Amb18798212 [0,2,0,0,0,0|0,0,2]=4 7424 B12R1.50 Cc1cc(CC(N)C#N)ccc1 Amb24653997 [0,2,0,0,0,0|1,0,1]=4 7425 B12R1.50 Cc1cc(CC(N)CF)ccc1 Amb24708150 [0,2,0,0,0,0|2,0,0]=4 7426 B12R1.50 Cc1cc(CC(O)C#C)ccc1 Amb24457341 [0,2,0,0,0,0|2,0,0]=4 7427 B12R1.50 Cc1cc(CC(O)C=C)ccc1 Amb24431083 [0,2,0,0,0,0|2,0,0]=4 7428 B12R1.50 Cc1cc(CC(O)CCl)ccc1 Amb24711431 [0,2,0,0,0,0|2,0,0]=4 7429 B12R1.50 Cc1cc(CC(O)CO)ccc1 Amb24397224 [0,2,0,0,0,0|2,0,0]=4 7430 B12R1.50 Cc1cc(C[C@@H](N)CO)ccc1 Amb24362986 [0,2,0,0,0,0|2,0,0]=4 7431 B12R1.50 Cc1cc(C[C@@H](O)C=C)ccc1 Amb25155807 [0,2,0,0,0,0|2,0,0]=4 7432 B12R1.50 Cc1cc(C[C@@H](O)CCl)ccc1 Amb24652370 [0,2,0,0,0,0|2,0,0]=4 7433 B12R1.50 Cc1cc(ccc1)NC(S)NN Amb24746678 [0,2,0,0,0,0|1,0,0]=3 7434 B12R1.50 Cc1cccc(CC(=O)NN)[n]1 Amb24501362 [0,2,0,0,0,0|1,0,1]=4 7435 B12R1.50 Cc1cccc(CC(Br)CC)c1 Amb24483315 [0,2,0,0,0,0|2,0,0]=4 7436 B12R1.50 Cc1cccc(CC(C)C=O)c1 Amb25120274 [0,2,0,0,0,0|2,0,0]=4 7437 B12R1.50 Cc1cccc(CC(C)CO)c1 Amb24341616 [0,2,0,0,0,0|2,0,0]=4 7438 B12R1.50 Cc1cccc(c1)NC(C)CN Amb18251702 [0,2,0,0,0,0|2,0,0]=4 7439 B12R1.50 Cc1cccc(c1)SC(C)CN Amb18992832 [0,2,0,0,0,0|2,0,0]=4 7440 B12R1.50 N#CC(Cc1cccc(c1)Br)Br Amb17376789 [0,2,0,0,0,0|1,0,1]=4 7441 B12R1.50 N#CC(Cc1cccc(c1)Br)Cl Amb17204672 [0,2,0,0,0,0|1,0,1]=4 7442 B12R1.50 N#CC(Cc1cccc(c1)C)Br Amb2520871 [0,2,0,0,0,0|1,0,1]=4 7443 B12R1.50 N#CC(Cc1cccc(c1)C)Cl Amb17204320 [0,2,0,0,0,0|1,0,1]=4 7444 B12R1.50 N#CC(Cc1cccc(c1)Cl)Br Amb17349964 [0,2,0,0,0,0|1,0,1]=4 7445 B12R1.50 N#CC(Cc1cccc(c1)Cl)Cl Amb17204382 [0,2,0,0,0,0|1,0,1]=4 7446 B12R1.50 N#CC(Cc1cccc(c1)F)Br Amb17344013 [0,2,0,0,0,0|1,0,1]=4 7447 B12R1.50 N#CC(Cc1cccc(c1)F)Cl Amb17204332 [0,2,0,0,0,0|1,0,1]=4 7448 B12R1.50 N#CC(O)Cc1cccc(F)c1 Amb24372046 [0,2,0,0,0,0|1,0,1]=4 7449 B12R1.50 NC(CO)Cc1cc(F)ccc1 Amb22751648 [0,2,0,0,0,0|2,0,0]=4 7450 B12R1.50 NC(CO)Cc1cc(I)ccc1 Amb24694473 [0,2,0,0,0,0|2,0,0]=4 7451 B12R1.50 NC(Cc1cc(F)ccc1)CF Amb25267761 [0,2,0,0,0,0|2,0,0]=4 7452 B12R1.50 NC(Cc1cccc(F)c1)C#N Amb24596484 [0,2,0,0,0,0|1,0,1]=4 7453 B12R1.50 NCC(=O)Cc1cc(Br)ccc1 Amb18160371 [0,2,0,0,0,0|1,0,1]=4 7454 B12R1.50 NCC(=O)Cc1cc(Cl)ccc1 Amb18823030 [0,2,0,0,0,0|1,0,1]=4 7455 B12R1.50 NCC(=O)Cc1cc(F)ccc1 Amb18199528 [0,2,0,0,0,0|1,0,1]=4 7456 B12R1.50 NCC(=O)Cc1cc(O)ccc1 Amb18251724 [0,2,0,0,0,0|1,0,1]=4 7457 B12R1.50 NCC(Cc1cccc(c1)Br)O Amb17248846 [0,2,0,0,0,0|1,0,0]=3 7458 B12R1.50 NCC(Cc1cccc(c1)C)O Amb17232548 [0,2,0,0,0,0|1,0,0]=3 7459 B12R1.50 NCC(Cc1cccc(c1)Cl)O Amb17234266 [0,2,0,0,0,0|1,0,0]=3 7460 B12R1.50 NCC(F)Cc1cc(Cl)ccc1 Amb25078215 [0,2,0,0,0,0|1,0,0]=3 7461 B12R1.50 NCC(F)Cc1cc(F)ccc1 Amb25667301 [0,2,0,0,0,0|1,0,0]=3 7462 B12R1.50 NCC(N)Cc1cccc(O)c1 Amb25097207 [0,2,0,0,0,0|1,0,0]=3 7463 B12R1.50 NCC(Nc1cccc(c1)Cl)C Amb17226673 [0,2,0,0,0,0|2,0,0]=4 7464 B12R1.50 NCC(O)Cc1cc(Br)c[n]c1 Amb25740056 [0,2,0,0,0,0|2,0,0]=4 7465 B12R1.50 NCC(O)Cc1cc(F)ccc1 Amb18563898 [0,2,0,0,0,0|1,0,0]=3 7466 B12R1.50 NNC(=O)Cc1cc[n]c(Cl)c1 Amb25169036 [0,2,0,0,0,0|1,0,1]=4 7467 B12R1.50 NNC(=O)Cc1cccc(I)c1 Amb25092748 [0,2,0,0,0,0|0,0,1]=3 7468 B12R1.50 NNC(=O)Cc1cccc(O)c1 Amb18788433 [0,2,0,0,0,0|0,0,1]=3 7469 B12R1.50 NNC(=O)Cc1cccc(c1)C Amb10075484 [0,2,0,0,0,0|0,0,1]=3 7470 B12R1.50 NNC(=O)Nc1cc(O)ccc1 Amb25159314 [0,2,0,0,0,0|1,0,1]=4 7471 B12R1.50 NNC(=O)Oc1cccc(Cl)c1 Amb25772432 [0,2,0,0,0,0|1,0,1]=4 7472 B12R1.50 NNC(=S)Nc1cccc(c1)C Amb1637371 [0,2,0,0,0,0|1,0,1]=4 7473 B12R1.50 NNC(=S)Nc1cccc(c1)Cl Amb1150068 [0,2,0,0,0,0|1,0,1]=4 7474 B12R1.50 NNC(=S)Nc1cccc(c1)O Amb2469590 [0,2,0,0,0,0|1,0,1]=4 7475 B12R1.50 N[C@@H](Cc1cc(O)ccc1)CO Amb22233156 [0,2,0,0,0,0|2,0,0]=4 7476 B12R1.50 N[C@H](CO)Cc1cc(Cl)ccc1 Amb22233154 [0,2,0,0,0,0|2,0,0]=4 7477 B12R1.50 N\C(\Cc1cccc(Br)c1)=N\N Amb25149906 [0,2,0,0,0,0|0,0,2]=4 7478 B12R1.50 N\C(\Cc1cccc(Cl)c1)=N\N Amb19045348 [0,2,0,0,0,0|0,0,2]=4 7479 B12R1.50 N\C(\Cc1cccc(F)c1)=N\N Amb18788562 [0,2,0,0,0,0|0,0,2]=4 7480 B12R1.50 Nc1cc(CC(F)CN)cc[n]1 Amb25667302 [0,2,0,0,0,0|2,0,0]=4 7481 B12R1.50 Nc1cc(CC(O)CN)cc[n]1 Amb24720093 [0,2,0,0,0,0|2,0,0]=4 7482 B12R1.50 Nc1cccc(CC(N)CN)c1 Amb24559863 [0,2,0,0,0,0|1,0,0]=3 7483 B12R1.50 Nc1cccc(C[C@H](N)CO)c1 Amb22233155 [0,2,0,0,0,0|2,0,0]=4 7484 B12R1.50 O=CC(Cc1cccc(c1)Br)Cl Amb17204708 [0,2,0,0,0,0|2,0,0]=4 7485 B12R1.50 O=CC(Cc1cccc(c1)C)Cl Amb17204327 [0,2,0,0,0,0|2,0,0]=4 7486 B12R1.50 O=CC(Cc1cccc(c1)Cl)Cl Amb17204402 [0,2,0,0,0,0|2,0,0]=4 7487 B12R1.50 O=CC(Cc1cccc(c1)F)Cl Amb17204343 [0,2,0,0,0,0|2,0,0]=4 7488 B12R1.50 O=CC(F)Cc1cccc(Cl)c1 Amb24341527 [0,2,0,0,0,0|2,0,0]=4 7489 B12R1.50 OC(Cc1cc(Cl)ccc1)CCl Amb25780609 [0,2,0,0,0,0|2,0,0]=4 7490 B12R1.50 OC(Cc1cccc(Br)c1)C=O Amb25802176 [0,2,0,0,0,0|2,0,0]=4 7491 B12R1.50 OC(Cc1cccc(Cl)c1)C=O Amb25107935 [0,2,0,0,0,0|2,0,0]=4 7492 B12R1.50 OC(Cc1cccc(F)c1)C=O Amb25047798 [0,2,0,0,0,0|2,0,0]=4 7493 B12R1.50 OC(Cc1cccc(F)c1)CCl Amb25266882 [0,2,0,0,0,0|2,0,0]=4 7494 B12R1.50 OCC(Cc1cccc(c1)Br)N Amb17062712 [0,2,0,0,0,0|2,0,0]=4 7495 B12R1.50 OCC(Cc1cccc(c1)C)N Amb17062686 [0,2,0,0,0,0|2,0,0]=4 7496 B12R1.50 OCC(Cc1cccc(c1)Cl)N Amb17062695 [0,2,0,0,0,0|2,0,0]=4 7497 B12R1.50 OCC(Cc1cccc(c1)O)N Amb17062711 [0,2,0,0,0,0|2,0,0]=4 7498 B12R1.50 OCC(O)Cc1cccc(Cl)c1 Amb25281635 [0,2,0,0,0,0|2,0,0]=4 7499 B12R1.50 OCC(S)Cc1cc(F)ccc1 Amb25177551 [0,2,0,0,0,0|2,0,0]=4 7500 B12R1.50 ONC(=O)Cc1cccc(Br)c1 Amb25751442 [0,2,0,0,0,0|1,0,1]=4 7501 B12R1.50 ONC(=O)Cc1cccc(Cl)c1 Amb19075673 [0,2,0,0,0,0|1,0,1]=4 7502 B12R1.50 Oc1cc(CC(=O)NO)ccc1 Amb18788532 [0,2,0,0,0,0|1,0,1]=4 7503 B12R1.50 Oc1cc(CC(F)C=O)ccc1 Amb25836660 [0,2,0,0,0,0|2,0,0]=4 7504 B12R1.50 Oc1cccc(CC(O)CO)c1 Amb24497069 [0,2,0,0,0,0|2,0,0]=4 7505 B12R1.100 C#CCCc1cc(O)cc(O)c1 Amb24633549 [0,2,0,0,0,0|2,0,0]=4 7506 B12R1.100 C=CCCc1cc(F)cc(Cl)c1 Amb24615616 [0,2,0,0,0,0|2,0,0]=4 7507 B12R1.100 CCCCc1cc(Br)cc(Br)c1 Amb19944051 [0,2,0,0,0,0|2,0,0]=4 7508 B12R1.100 CCCCc1cc(C)cc(C)c1 Amb20621114 [0,2,0,0,0,0|2,0,0]=4 7509 B12R1.100 CCCCc1cc(F)cc(F)c1 Amb20620632 [0,2,0,0,0,0|2,0,0]=4 7510 B12R1.100 CCCCc1cc(O)cc(O)c1 Amb24331632 [0,2,0,0,0,0|2,0,0]=4 7511 B12R1.100 CNCCc1cc(Br)cc(Br)c1 Amb24536197 [0,2,0,0,0,0|1,0,0]=3 7512 B12R1.100 CNCCc1cc(C)cc(C)c1 Amb18993052 [0,2,0,0,0,0|1,0,0]=3 7513 B12R1.100 CNCCc1cc(Cl)cc(Cl)c1 Amb25821763 [0,2,0,0,0,0|1,0,0]=3 7514 B12R1.100 CNCCc1cc(F)cc(Br)c1 Amb25710136 [0,2,0,0,0,0|1,0,0]=3 7515 B12R1.100 CNCCc1cc(F)cc(F)c1 Amb18993626 [0,2,0,0,0,0|1,0,0]=3 7516 B12R1.100 CNCCc1cc(O)cc(Br)c1 Amb25682658 [0,2,0,0,0,0|1,0,0]=3 7517 B12R1.100 CNCCc1cc(O)cc(Cl)c1 Amb25331884 [0,2,0,0,0,0|1,0,0]=3 7518 B12R1.100 CNCCc1cc(O)cc(F)c1 Amb25226474 [0,2,0,0,0,0|1,0,0]=3 7519 B12R1.100 CSCCc1cc(Cl)cc(Cl)c1 Amb25160476 [0,2,0,0,0,0|2,0,0]=4 7520 B12R1.100 Cc1cc(Br)cc(CCNC)c1 Amb25820241 [0,2,0,0,0,0|1,0,0]=3 7521 B12R1.100 Cc1cc(Br)cc(c1)NCCN Amb25068548 [0,2,0,0,0,0|2,0,0]=4 7522 B12R1.100 Cc1cc(Br)cc(c1)OCCN Amb23590664 [0,2,0,0,0,0|2,0,0]=4 7523 B12R1.100 Cc1cc(CCC#N)cc(Cl)c1 Amb25270535 [0,2,0,0,0,0|1,0,1]=4 7524 B12R1.100 Cc1cc(CCC=O)cc(Br)c1 Amb25141592 [0,2,0,0,0,0|2,0,0]=4 7525 B12R1.100 Cc1cc(CCC=O)cc(C)c1 Amb18798122 [0,2,0,0,0,0|2,0,0]=4 7526 B12R1.100 Cc1cc(CCC=O)cc(F)c1 Amb25839793 [0,2,0,0,0,0|2,0,0]=4 7527 B12R1.100 Cc1cc(CCCBr)cc(F)c1 Amb24453699 [0,2,0,0,0,0|2,0,0]=4 7528 B12R1.100 Cc1cc(CCCBr)cc(I)c1 Amb24605669 [0,2,0,0,0,0|2,0,0]=4 7529 B12R1.100 Cc1cc(CCCCl)cc(C)c1 Amb19068163 [0,2,0,0,0,0|2,0,0]=4 7530 B12R1.100 Cc1cc(CCCCl)cc(O)c1 Amb25217661 [0,2,0,0,0,0|2,0,0]=4 7531 B12R1.100 Cc1cc(CCCN)[n]c(C)c1 Amb25304204 [0,2,0,0,0,0|2,0,0]=4 7532 B12R1.100 Cc1cc(CCCN)cc(Br)c1 Amb25851408 [0,2,0,0,0,0|1,0,0]=3 7533 B12R1.100 Cc1cc(CCCN)cc(Cl)c1 Amb25282299 [0,2,0,0,0,0|1,0,0]=3 7534 B12R1.100 Cc1cc(CCCO)cc(C)c1 Amb18798360 [0,2,0,0,0,0|2,0,0]=4 7535 B12R1.100 Cc1cc(CCNN)cc(F)c1 Amb24439958 [0,2,0,0,0,0|0,0,0]=2 7536 B12R1.100 Cc1cc(Cl)cc(c1)OCCN Amb24410300 [0,2,0,0,0,0|2,0,0]=4 7537 B12R1.100 Cc1cc(F)cc(CCNC)c1 Amb25841993 [0,2,0,0,0,0|1,0,0]=3 7538 B12R1.100 Cc1cc(F)cc(c1)NCCN Amb25034985 [0,2,0,0,0,0|2,0,0]=4 7539 B12R1.100 Cc1cc(N)[n]c(CCCN)c1 Amb24724890 [0,2,0,0,0,0|2,0,0]=4 7540 B12R1.100 Cc1cc(N)cc(CCCC)c1 Amb24457282 [0,2,0,0,0,0|2,0,0]=4 7541 B12R1.100 Cc1cc(N)cc(c1)NCCN Amb25098174 [0,2,0,0,0,0|2,0,0]=4 7542 B12R1.100 Cc1cc(O)cc(CCCC)c1 Amb25102928 [0,2,0,0,0,0|2,0,0]=4 7543 B12R1.100 Cc1cc(cc(C)c1)OCNN Amb25174182 [0,2,0,0,0,0|1,0,0]=3 7544 B12R1.100 Cc1cc(cc(C)c1)SCCN Amb18909241 [0,2,0,0,0,0|2,0,0]=4 7545 B12R1.100 ClCCCc1cc(Cl)cc(Cl)c1 Amb24656658 [0,2,0,0,0,0|2,0,0]=4 7546 B12R1.100 Clc1cc(Br)cc(CCCBr)c1 Amb24424487 [0,2,0,0,0,0|2,0,0]=4 7547 B12R1.100 Clc1cc(I)cc(CCCCl)c1 Amb24596614 [0,2,0,0,0,0|2,0,0]=4 7548 B12R1.100 Fc1cc(Br)cc(CCCBr)c1 Amb25804673 [0,2,0,0,0,0|2,0,0]=4 7549 B12R1.100 Fc1cc(CCCBr)cc(F)c1 Amb25034793 [0,2,0,0,0,0|2,0,0]=4 7550 B12R1.100 Fc1cc(CCCBr)cc(I)c1 Amb24640773 [0,2,0,0,0,0|2,0,0]=4 7551 B12R1.100 Fc1cc(CCCCl)cc(F)c1 Amb25152291 [0,2,0,0,0,0|2,0,0]=4 7552 B12R1.100 Fc1cc(CCCCl)cc(I)c1 Amb24640774 [0,2,0,0,0,0|2,0,0]=4 7553 B12R1.100 Fc1cc(CC[Zn]Br)cc(Cl)c1 Amb22000505 [0,2,0,0,0,0|2,0,0]=4 7554 B12R1.100 N#CCCc1cc(Br)cc(Br)c1 Amb24537171 [0,2,0,0,0,0|1,0,1]=4 7555 B12R1.100 N#CCCc1cc(C)cc(c1)C Amb17204303 [0,2,0,0,0,0|1,0,1]=4 7556 B12R1.100 N#CCCc1cc(Cl)cc(Br)c1 Amb24664557 [0,2,0,0,0,0|1,0,1]=4 7557 B12R1.100 N#CCCc1cc(Cl)cc(I)c1 Amb24610880 [0,2,0,0,0,0|1,0,1]=4 7558 B12R1.100 N#CCCc1cc(Cl)cc(c1)Cl Amb17204387 [0,2,0,0,0,0|1,0,1]=4 7559 B12R1.100 N#CCCc1cc(F)cc(S)c1 Amb25290826 [0,2,0,0,0,0|1,0,1]=4 7560 B12R1.100 N#CCCc1cc(O)cc(Br)c1 Amb25325192 [0,2,0,0,0,0|1,0,1]=4 7561 B12R1.100 N#CCCc1cc(O)cc(F)c1 Amb24541071 [0,2,0,0,0,0|1,0,1]=4 7562 B12R1.100 N#CCCc1cc(O)cc(I)c1 Amb24616441 [0,2,0,0,0,0|1,0,1]=4 7563 B12R1.100 N#CCCc1cc(O)cc(O)c1 Amb24666000 [0,2,0,0,0,0|1,0,1]=4 7564 B12R1.100 N#CCCc1cc(S)cc(Br)c1 Amb25364410 [0,2,0,0,0,0|1,0,1]=4 7565 B12R1.100 N#CCCc1cc(S)cc(Cl)c1 Amb24637165 [0,2,0,0,0,0|1,0,1]=4 7566 B12R1.100 NCCCc1cc(Br)cc(Br)c1 Amb24420259 [0,2,0,0,0,0|1,0,0]=3 7567 B12R1.100 NCCCc1cc(C)cc(c1)C Amb17204308 [0,2,0,0,0,0|1,0,0]=3 7568 B12R1.100 NCCCc1cc(Cl)[n]c(Cl)c1 Amb25323951 [0,2,0,0,0,0|2,0,0]=4 7569 B12R1.100 NCCCc1cc(Cl)cc(F)[n]1 Amb24701320 [0,2,0,0,0,0|2,0,0]=4 7570 B12R1.100 NCCCc1cc(Cl)cc(c1)Cl Amb17204406 [0,2,0,0,0,0|1,0,0]=3 7571 B12R1.100 NCCCc1cc(F)cc(Br)c1 Amb25795729 [0,2,0,0,0,0|1,0,0]=3 7572 B12R1.100 NCCCc1cc(F)cc(Cl)c1 Amb25709208 [0,2,0,0,0,0|1,0,0]=3 7573 B12R1.100 NCCCc1cc(F)cc(F)c1 Amb18126758 [0,2,0,0,0,0|1,0,0]=3 7574 B12R1.100 NCCCc1cc(O)cc(Br)c1 Amb25045372 [0,2,0,0,0,0|1,0,0]=3 7575 B12R1.100 NCCCc1cc(O)cc(Cl)c1 Amb25710883 [0,2,0,0,0,0|1,0,0]=3 7576 B12R1.100 NCCCc1cc(O)cc(O)c1 Amb25113881 [0,2,0,0,0,0|1,0,0]=3 7577 B12R1.100 NCCNc1cc(Br)cc(Cl)c1 Amb24502463 [0,2,0,0,0,0|2,0,0]=4 7578 B12R1.100 NCCNc1cc(C)cc(c1)C Amb17057763 [0,2,0,0,0,0|2,0,0]=4 7579 B12R1.100 NCCNc1cc(Cl)cc(F)c1 Amb25817322 [0,2,0,0,0,0|2,0,0]=4 7580 B12R1.100 NCCNc1cc(Cl)cc(c1)Cl Amb17091083 [0,2,0,0,0,0|2,0,0]=4 7581 B12R1.100 NCCNc1cc(F)cc(F)c1 Amb18299159 [0,2,0,0,0,0|2,0,0]=4 7582 B12R1.100 NCCOc1cc(Br)cc(Cl)c1 Amb25034906 [0,2,0,0,0,0|2,0,0]=4 7583 B12R1.100 NCCOc1cc(Br)cc(F)c1 Amb24389824 [0,2,0,0,0,0|2,0,0]=4 7584 B12R1.100 NCCOc1cc(C)cc(c1)C Amb1065358 [0,2,0,0,0,0|2,0,0]=4 7585 B12R1.100 NCCOc1cc(F)cc(F)c1 Amb18997300 [0,2,0,0,0,0|2,0,0]=4 7586 B12R1.100 NNCCc1cc(C)cc(c1)C Amb17400168 [0,2,0,0,0,0|0,0,0]=2 7587 B12R1.100 NNCCc1cc(F)cc(Br)c1 Amb25100154 [0,2,0,0,0,0|0,0,0]=2 7588 B12R1.100 NNCCc1cc(F)cc(c1)F Amb17400365 [0,2,0,0,0,0|0,0,0]=2 7589 B12R1.100 Nc1cc(CCC#N)cc(F)c1 Amb25292881 [0,2,0,0,0,0|1,0,1]=4 7590 B12R1.100 Nc1cc(CCC#N)cc(N)c1 Amb24574169 [0,2,0,0,0,0|1,0,1]=4 7591 B12R1.100 Nc1cc(CCC=O)cc(O)c1 Amb24566643 [0,2,0,0,0,0|2,0,0]=4 7592 B12R1.100 Nc1cc(F)cc(c1)NCCN Amb18991515 [0,2,0,0,0,0|2,0,0]=4 7593 B12R1.100 O=CCCc1cc(Cl)cc(Cl)c1 Amb18066575 [0,2,0,0,0,0|2,0,0]=4 7594 B12R1.100 O=CCCc1cc(Cl)cc(I)c1 Amb24368144 [0,2,0,0,0,0|2,0,0]=4 7595 B12R1.100 O=CCCc1cc(F)cc(F)c1 Amb25149927 [0,2,0,0,0,0|2,0,0]=4 7596 B12R1.100 O=CCCc1cc(F)cc(I)c1 Amb25104319 [0,2,0,0,0,0|2,0,0]=4 7597 B12R1.100 O=CCCc1cc(F)cc(S)c1 Amb24571930 [0,2,0,0,0,0|2,0,0]=4 7598 B12R1.100 OCCCc1cc(Cl)cc(Br)c1 Amb25150113 [0,2,0,0,0,0|2,0,0]=4 7599 B12R1.100 OCCCc1cc(Cl)cc(c1)Cl Amb17605792 [0,2,0,0,0,0|2,0,0]=4 7600 B12R1.100 OCCCc1cc(F)cc(Br)c1 Amb24453157 [0,2,0,0,0,0|2,0,0]=4 7601 B12R1.100 OCCCc1cc(F)cc(Cl)c1 Amb24673776 [0,2,0,0,0,0|2,0,0]=4 7602 B12R1.100 OCCCc1cc(F)cc(F)c1 Amb24094063 [0,2,0,0,0,0|2,0,0]=4 7603 B12R1.100 OCCCc1cc(O)cc(O)c1 Amb24674121 [0,2,0,0,0,0|2,0,0]=4 7604 B12R1.100 Oc1cc(CCCBr)cc(I)c1 Amb24605307 [0,2,0,0,0,0|2,0,0]=4 7605 B12R1.100 Oc1cc(CCCCl)cc(I)c1 Amb24713686 [0,2,0,0,0,0|2,0,0]=4 7606 B12R1.100 Oc1cc(CCCCl)cc(S)c1 Amb24541060 [0,2,0,0,0,0|2,0,0]=4 7607 B12R1.100 Oc1cc(Cl)cc(CCCCl)c1 Amb25195602 [0,2,0,0,0,0|2,0,0]=4 7608 B12R1.100 Sc1cc(CCCBr)cc(I)c1 Amb24696764 [0,2,0,0,0,0|2,0,0]=4 7609 B12R1.226 CC(=O)CCc1cccc(O)c1 Amb18646057 [0,2,0,0,0,0|2,0,0]=4 7610 B12R1.226 CC(Br)CCc1cc(Br)ccc1 Amb24488695 [0,2,0,0,0,0|2,0,0]=4 7611 B12R1.226 CC(Br)CCc1cccc(F)c1 Amb24366969 [0,2,0,0,0,0|2,0,0]=4 7612 B12R1.226 CC(Br)CCc1cccc(O)c1 Amb25765194 [0,2,0,0,0,0|2,0,0]=4 7613 B12R1.226 CC(CCc1cccc(c1)C)O Amb17507253 [0,2,0,0,0,0|2,0,0]=4 7614 B12R1.226 CC(COc1cccc(c1)Br)N Amb17062517 [0,2,0,0,0,0|2,0,0]=4 7615 B12R1.226 CC(COc1cccc(c1)C)N Amb1127701 [0,2,0,0,0,0|2,0,0]=4 7616 B12R1.226 CC(COc1cccc(c1)F)N Amb1142128 [0,2,0,0,0,0|2,0,0]=4 7617 B12R1.226 CC(Cl)CCc1cccc(F)c1 Amb19076401 [0,2,0,0,0,0|2,0,0]=4 7618 B12R1.226 CC(F)CCc1cccc(N)c1 Amb24610510 [0,2,0,0,0,0|2,0,0]=4 7619 B12R1.226 CC(N)CCc1c[n]cc(F)c1 Amb24513769 [0,2,0,0,0,0|2,0,0]=4 7620 B12R1.226 CC(N)CCc1cc(N)ccc1 Amb24424070 [0,2,0,0,0,0|1,0,0]=3 7621 B12R1.226 CC(N)CCc1cccc(I)c1 Amb25281897 [0,2,0,0,0,0|1,0,0]=3 7622 B12R1.226 CC(N)CCc1cccc(O)c1 Amb18828241 [0,2,0,0,0,0|1,0,0]=3 7623 B12R1.226 CC(N)CNc1cccc(Br)c1 Amb25674799 [0,2,0,0,0,0|2,0,0]=4 7624 B12R1.226 CC(N)COc1cccc(Cl)c1 Amb22642660 [0,2,0,0,0,0|2,0,0]=4 7625 B12R1.226 CC(N)COc1cccc(I)c1 Amb24441736 [0,2,0,0,0,0|2,0,0]=4 7626 B12R1.226 CC(N)CSc1cccc(Cl)c1 Amb18066336 [0,2,0,0,0,0|2,0,0]=4 7627 B12R1.226 CC(N)CSc1cccc(O)c1 Amb25179966 [0,2,0,0,0,0|2,0,0]=4 7628 B12R1.226 CC(O)CCc1cc(O)ccc1 Amb25251886 [0,2,0,0,0,0|2,0,0]=4 7629 B12R1.226 CC(O)CCc1cccc(Cl)c1 Amb19075161 [0,2,0,0,0,0|2,0,0]=4 7630 B12R1.226 CC(O)CCc1cccc(F)c1 Amb18805846 [0,2,0,0,0,0|2,0,0]=4 7631 B12R1.226 CN(C)CCc1cc(N)cc[n]1 Amb25078077 [0,2,0,0,0,0|2,0,0]=4 7632 B12R1.226 CN(C)CCc1cc[n]c(Cl)c1 Amb24429011 [0,2,0,0,0,0|2,0,0]=4 7633 B12R1.226 CN(C)CCc1cccc(Br)[n]1 Amb24678869 [0,2,0,0,0,0|2,0,0]=4 7634 B12R1.226 CN(C)CCc1cccc(O)c1 Amb17942808 [0,2,0,0,0,0|1,0,0]=3 7635 B12R1.226 CN(C)NCc1cccc(O)c1 Amb25690117 [0,2,0,0,0,0|2,0,0]=4 7636 B12R1.226 CN(CCc1cccc(c1)N)C Amb17050647 [0,2,0,0,0,0|1,0,0]=3 7637 B12R1.226 CN(N)CCc1cccc(Br)c1 Amb18571910 [0,2,0,0,0,0|0,0,0]=2 7638 B12R1.226 CN(N)CCc1cccc(Cl)c1 Amb18564317 [0,2,0,0,0,0|0,0,0]=2 7639 B12R1.226 C[C@@H](COc1cccc(c1)Br)N Amb17248851 [0,2,0,0,0,0|2,0,0]=4 7640 B12R1.226 C[C@@H](COc1cccc(c1)C)N Amb17232558 [0,2,0,0,0,0|2,0,0]=4 7641 B12R1.226 C[C@@H](COc1cccc(c1)Cl)N Amb17234271 [0,2,0,0,0,0|2,0,0]=4 7642 B12R1.226 C[C@@H](COc1cccc(c1)F)N Amb17232707 [0,2,0,0,0,0|2,0,0]=4 7643 B12R1.226 C[C@@H](N)COc1cccc(Br)c1 Amb18036076 [0,2,0,0,0,0|2,0,0]=4 7644 B12R1.226 C[C@@H](N)COc1cccc(Cl)c1 Amb18538519 [0,2,0,0,0,0|2,0,0]=4 7645 B12R1.226 C[C@@H](N)COc1cccc(F)c1 Amb18538500 [0,2,0,0,0,0|2,0,0]=4 7646 B12R1.226 C[C@@H](N)CSc1cccc(Cl)c1 Amb25132468 [0,2,0,0,0,0|2,0,0]=4 7647 B12R1.226 C[C@@H](N)CSc1cccc(F)c1 Amb24354913 [0,2,0,0,0,0|2,0,0]=4 7648 B12R1.226 C[C@H](N)CCc1cccc(Br)c1 Amb24683805 [0,2,0,0,0,0|1,0,0]=3 7649 B12R1.226 Cc1cc(CCB(O)O)ccc1 Amb25790748 [0,2,0,0,0,0|2,0,0]=4 7650 B12R1.226 Cc1cc(CCC(=O)Cl)ccc1 Amb18325287 [0,2,0,0,0,0|2,0,0]=4 7651 B12R1.226 Cc1cc(CCC(N)=N)ccc1 Amb18065465 [0,2,0,0,0,0|1,0,0]=3 7652 B12R1.226 Cc1cc(CCC(N)=O)[n]cc1 Amb25858570 [0,2,0,0,0,0|2,0,0]=4 7653 B12R1.226 Cc1cc(CNC(N)=N)ccc1 Amb18798205 [0,2,0,0,0,0|2,0,0]=4 7654 B12R1.226 Cc1cc(CNC(N)=O)ccc1 Amb18798292 [0,2,0,0,0,0|2,0,0]=4 7655 B12R1.226 Cc1cc(CNC(N)=S)ccc1 Amb18796347 [0,2,0,0,0,0|2,0,0]=4 7656 B12R1.226 Cc1cc(CSC(N)=N)ccc1 Amb20676045 [0,2,0,0,0,0|2,0,0]=4 7657 B12R1.226 Cc1cc(CSC(N)=S)ccc1 Amb25113498 [0,2,0,0,0,0|2,0,0]=4 7658 B12R1.226 Cc1cc(ccc1)SCC(N)=N Amb18791179 [0,2,0,0,0,0|2,0,0]=4 7659 B12R1.226 Cc1cc(ccc1)SCC(N)=S Amb25123592 [0,2,0,0,0,0|2,0,0]=4 7660 B12R1.226 Cc1cccc(CCC(C)Br)c1 Amb25723537 [0,2,0,0,0,0|2,0,0]=4 7661 B12R1.226 Cc1cccc(CCC(C)Cl)c1 Amb18321700 [0,2,0,0,0,0|2,0,0]=4 7662 B12R1.226 Cc1cccc(CCC(N)=N)[n]1 Amb25291576 [0,2,0,0,0,0|2,0,0]=4 7663 B12R1.226 Cc1cccc(CCN(C)N)c1 Amb18563652 [0,2,0,0,0,0|0,0,0]=2 7664 B12R1.226 Cc1cccc(CC[C@H](C)N)c1 Amb24682488 [0,2,0,0,0,0|1,0,0]=3 7665 B12R1.226 Cc1cccc(CNN(C)C)c1 Amb25806845 [0,2,0,0,0,0|2,0,0]=4 7666 B12R1.226 Cc1cccc(c1)OC[C@@H](C)N Amb18538492 [0,2,0,0,0,0|2,0,0]=4 7667 B12R1.226 Cc1cccc(c1)SCC(C)N Amb18564187 [0,2,0,0,0,0|2,0,0]=4 7668 B12R1.226 Cc1cccc(c1)SC[C@H](C)N Amb25112431 [0,2,0,0,0,0|2,0,0]=4 7669 B12R1.226 Clc1cccc(c1)CSC(=[NH2+])N Amb2407332 [0,2,0,0,0,0|2,0,0]=4 7670 B12R1.226 NC(=N)CCc1cccc(Br)c1 Amb18571443 [0,2,0,0,0,0|1,0,0]=3 7671 B12R1.226 NC(=N)CCc1cccc(Cl)c1 Amb18564230 [0,2,0,0,0,0|1,0,0]=3 7672 B12R1.226 NC(=N)CCc1cccc(F)c1 Amb18563720 [0,2,0,0,0,0|1,0,0]=3 7673 B12R1.226 NC(=N)CSc1cccc(Br)c1 Amb25773659 [0,2,0,0,0,0|2,0,0]=4 7674 B12R1.226 NC(=N)CSc1cccc(Cl)c1 Amb18331359 [0,2,0,0,0,0|2,0,0]=4 7675 B12R1.226 NC(=N)NCc1cc(I)ccc1 Amb19883917 [0,2,0,0,0,0|2,0,0]=4 7676 B12R1.226 NC(=N)NCc1cccc(Br)c1 Amb19887565 [0,2,0,0,0,0|2,0,0]=4 7677 B12R1.226 NC(=N)NCc1cccc(Br)c1 Amb24488682 [0,2,0,0,0,0|2,0,0]=4 7678 B12R1.226 NC(=N)NCc1cccc(Cl)c1 Amb19068643 [0,2,0,0,0,0|2,0,0]=4 7679 B12R1.226 NC(=N)NCc1cccc(F)c1 Amb18798758 [0,2,0,0,0,0|2,0,0]=4 7680 B12R1.226 NC(=N)NCc1cccc(I)c1 Amb21855943 [0,2,0,0,0,0|2,0,0]=4 7681 B12R1.226 NC(=N)NCc1cccc(O)c1 Amb25176040 [0,2,0,0,0,0|2,0,0]=4 7682 B12R1.226 NC(=N)SCc1cccc(Br)c1 Amb20676039 [0,2,0,0,0,0|2,0,0]=4 7683 B12R1.226 NC(=N)SCc1cccc(Cl)c1 Amb20676057 [0,2,0,0,0,0|2,0,0]=4 7684 B12R1.226 NC(=N)SCc1cccc(F)c1 Amb20676031 [0,2,0,0,0,0|2,0,0]=4 7685 B12R1.226 NC(=N)SCc1cccc(c1)Cl Amb11227411 [0,2,0,0,0,0|2,0,0]=4 7686 B12R1.226 NC(=N)SCc1cccc(c1)F Amb13960324 [0,2,0,0,0,0|2,0,0]=4 7687 B12R1.226 NC(=N)[Se]Cc1cccc(Br)c1 Amb22330411 [0,2,0,0,0,0|2,0,0]=4 7688 B12R1.226 NC(=N)[Se]Cc1cccc(Br)c1 Amb24113414 [0,2,0,0,0,0|2,0,0]=4 7689 B12R1.226 NC(=O)CCc1c[n]cc(F)c1 Amb25821158 [0,2,0,0,0,0|2,0,0]=4 7690 B12R1.226 NC(=O)CCc1c[n]cc(O)c1 Amb25833308 [0,2,0,0,0,0|2,0,0]=4 7691 B12R1.226 NC(=O)CCc1cc(Br)cc[n]1 Amb24671371 [0,2,0,0,0,0|2,0,0]=4 7692 B12R1.226 NC(=O)CCc1cc(Cl)cc[n]1 Amb25046525 [0,2,0,0,0,0|2,0,0]=4 7693 B12R1.226 NC(=O)CCc1cccc(c1)C Amb17400135 [0,2,0,0,0,0|1,0,0]=3 7694 B12R1.226 NC(=O)CCc1cccc(c1)Cl Amb17400995 [0,2,0,0,0,0|1,0,0]=3 7695 B12R1.226 NC(=O)CNc1cccc(c1)Br Amb143565 [0,2,0,0,0,0|2,0,0]=4 7696 B12R1.226 NC(=O)COc1cccc(c1)Br Amb192032 [0,2,0,0,0,0|2,0,0]=4 7697 B12R1.226 NC(=O)COc1cccc(c1)I Amb181273 [0,2,0,0,0,0|2,0,0]=4 7698 B12R1.226 NC(=O)COc1cccc(c1)N Amb1112358 [0,2,0,0,0,0|2,0,0]=4 7699 B12R1.226 NC(=O)CSc1cccc(Br)c1 Amb25726747 [0,2,0,0,0,0|2,0,0]=4 7700 B12R1.226 NC(=O)CSc1cccc(F)c1 Amb25784013 [0,2,0,0,0,0|2,0,0]=4 7701 B12R1.226 NC(=O)CSc1cccc(O)c1 Amb25102367 [0,2,0,0,0,0|2,0,0]=4 7702 B12R1.226 NC(=O)CSc1cccc(c1)C Amb17142988 [0,2,0,0,0,0|2,0,0]=4 7703 B12R1.226 NC(=O)CSc1cccc(c1)Cl Amb17143258 [0,2,0,0,0,0|2,0,0]=4 7704 B12R1.226 NC(=O)NCc1cccc(O)c1 Amb18792735 [0,2,0,0,0,0|2,0,0]=4 7705 B12R1.226 NC(=O)NCc1cccc(c1)Cl Amb2440664 [0,2,0,0,0,0|2,0,0]=4 7706 B12R1.226 NC(=S)COc1cccc(c1)[*] Amb22043508 [0,2,0,0,0,0|2,0,0]=4 7707 B12R1.226 NC(=S)CSc1cccc(F)c1 Amb24623139 [0,2,0,0,0,0|2,0,0]=4 7708 B12R1.226 NC(=S)NCc1cccc(Br)c1 Amb24720945 [0,2,0,0,0,0|2,0,0]=4 7709 B12R1.226 NC(=S)NCc1cccc(Cl)c1 Amb18333166 [0,2,0,0,0,0|2,0,0]=4 7710 B12R1.226 Nc1cc(CCC(F)F)ccc1 Amb25253012 [0,2,0,0,0,0|2,0,0]=4 7711 B12R1.226 Nc1cc(CCC([O-])=O)ccc1 Amb22408735 [0,2,0,0,0,0|2,0,0]=4 7712 B12R1.226 Nc1cc(CCC([O-])=O)ccc1 Amb22757721 [0,2,0,0,0,0|2,0,0]=4 7713 B12R1.226 Nc1cccc(CNC(N)=O)c1 Amb18962222 [0,2,0,0,0,0|2,0,0]=4 7714 B12R1.226 Nc1cccc(CNC(N)=S)c1 Amb25784758 [0,2,0,0,0,0|2,0,0]=4 7715 B12R1.226 Nc1cccc(c1)OCC(N)=S Amb24439144 [0,2,0,0,0,0|2,0,0]=4 7716 B12R1.226 O=C(Cl)CCc1cc(Cl)ccc1 Amb24403345 [0,2,0,0,0,0|2,0,0]=4 7717 B12R1.226 O=C(Cl)CCc1cccc(Br)c1 Amb25150110 [0,2,0,0,0,0|2,0,0]=4 7718 B12R1.226 O=C(Cl)CCc1cccc(F)c1 Amb25129437 [0,2,0,0,0,0|2,0,0]=4 7719 B12R1.226 OB(O)CCc1cccc(F)c1 Amb24392487 [0,2,0,0,0,0|2,0,0]=4 7720 B12R1.226 OC(=O)CCc1cccc(c1)Br Amb1209216 [0,2,0,0,0,0|2,0,0]=4 7721 B12R1.226 OC(=O)CCc1cccc(c1)C Amb1106242 [0,2,0,0,0,0|2,0,0]=4 7722 B12R1.226 OC(=O)CCc1cccc(c1)Cl Amb1672952 [0,2,0,0,0,0|2,0,0]=4 7723 B12R1.226 OC(=O)CCc1cccc(c1)F Amb1091868 [0,2,0,0,0,0|2,0,0]=4 7724 B12R1.226 OC(=O)CCc1cccc(c1)I Amb16232982 [0,2,0,0,0,0|2,0,0]=4 7725 B12R1.226 Oc1cc(CCC(=O)Cl)ccc1 Amb25356247 [0,2,0,0,0,0|2,0,0]=4 7726 B12R1.226 [O-][N+](=O)CCc1cccc(O)c1 Amb25141958 [0,2,0,0,0,0|1,0,1]=4 7727 B12R1.226 [O-][N+](=O)CCc1cccc(c1)C Amb17400177 [0,2,0,0,0,0|1,0,1]=4 7728 B12R1.226 [O-][N+](=O)CCc1cccc(c1)Cl Amb17401073 [0,2,0,0,0,0|1,0,1]=4 7729 B12R1.382 BrCCCc1cccc(c1)OC Amb17104558 [0,2,0,0,0,0|2,0,0]=4 7730 B12R1.382 C#CCCc1cccc(c1)C#N Amb18116227 [0,2,0,0,0,0|2,0,0]=4 7731 B12R1.382 C#Cc1cc(ccc1)NCCN Amb18251584 [0,2,0,0,0,0|2,0,0]=4 7732 B12R1.382 C#Cc1cccc(CCCO)c1 Amb24388502 [0,2,0,0,0,0|2,0,0]=4 7733 B12R1.382 C=CCCc1cccc(C=O)c1 Amb24085224 [0,2,0,0,0,0|2,0,0]=4 7734 B12R1.382 CCCCc1cc(CN)ccc1 Amb22755129 [0,2,0,0,0,0|2,0,0]=4 7735 B12R1.382 CCCCc1cc(ccc1)C#N Amb19893374 [0,2,0,0,0,0|2,0,0]=4 7736 B12R1.382 CCc1cc(CCC#N)ccc1 Amb24537117 [0,2,0,0,0,0|1,0,1]=4 7737 B12R1.382 CCc1cc(CCCN)[n]cc1 Amb18828703 [0,2,0,0,0,0|2,0,0]=4 7738 B12R1.382 CCc1cccc(CCCN)[n]1 Amb18828661 [0,2,0,0,0,0|2,0,0]=4 7739 B12R1.382 CNCCc1cccc(c1)C#N Amb25214234 [0,2,0,0,0,0|1,0,0]=3 7740 B12R1.382 CNc1cccc(CCCN)[n]1 Amb24419904 [0,2,0,0,0,0|2,0,0]=4 7741 B12R1.382 COc1cc(CCC#C)ccc1 Amb18117994 [0,2,0,0,0,0|2,0,0]=4 7742 B12R1.382 COc1cc(CCNN)ccc1 Amb19887556 [0,2,0,0,0,0|0,0,0]=2 7743 B12R1.382 COc1cccc(CCCN)c1 Amb19429208 [0,2,0,0,0,0|1,0,0]=3 7744 B12R1.382 COc1cccc(CCON)c1 Amb22896637 [0,2,0,0,0,0|1,0,0]=3 7745 B12R1.382 ClCCCc1cccc(c1)OC Amb17104532 [0,2,0,0,0,0|2,0,0]=4 7746 B12R1.382 N#CCCc1cccc(CO)c1 Amb25249968 [0,2,0,0,0,0|1,0,1]=4 7747 B12R1.382 N#CCCc1cccc(c1)OC Amb17204306 [0,2,0,0,0,0|1,0,1]=4 7748 B12R1.382 N#Cc1cc(CCC=O)ccc1 Amb18645176 [0,2,0,0,0,0|2,0,0]=4 7749 B12R1.382 N#Cc1cccc(CCCBr)c1 Amb25675608 [0,2,0,0,0,0|2,0,0]=4 7750 B12R1.382 N#Cc1cccc(CCCCl)c1 Amb25270450 [0,2,0,0,0,0|2,0,0]=4 7751 B12R1.382 NCCCc1cc(ccc1)C#N Amb25217817 [0,2,0,0,0,0|1,0,0]=3 7752 B12R1.382 NCCCc1cccc(c1)OC Amb1092531 [0,2,0,0,0,0|1,0,0]=3 7753 B12R1.382 NCCNc1cc(ccc1)C#N Amb18992217 [0,2,0,0,0,0|2,0,0]=4 7754 B12R1.382 NCCNc1cccc(c1)OC Amb17057754 [0,2,0,0,0,0|2,0,0]=4 7755 B12R1.382 NCCOc1cc(CO)ccc1 Amb18182646 [0,2,0,0,0,0|2,0,0]=4 7756 B12R1.382 NCCOc1cccc(c1)C#N Amb17562051 [0,2,0,0,0,0|2,0,0]=4 7757 B12R1.382 NCCOc1cccc(c1)OC Amb1135524 [0,2,0,0,0,0|2,0,0]=4 7758 B12R1.382 OCCCc1cccc(c1)C#N Amb17605790 [0,2,0,0,0,0|2,0,0]=4 7759 B12R1.382 OCCCc1cccc(c1)OC Amb13883640 [0,2,0,0,0,0|2,0,0]=4 7760 B12R1.382 SCCCc1cccc(c1)OC Amb17400950 [0,2,0,0,0,0|2,0,0]=4 7761 B12R1.8 BrCCCNCc1ccccc1 Amb18134994 [0,2,0,0,0,0|2,0,0]=4 7762 B12R1.8 BrCCNCCc1ccncc1 Amb1030873 [0,2,0,0,0,0|2,0,0]=4 7763 B12R1.8 Br[Zn]CCCOc1ccccc1 Amb22000474 [0,2,0,0,0,0|2,0,0]=4 7764 B12R1.8 C#CCNOCc1ccccc1 Amb25282219 [0,2,0,0,0,0|2,0,0]=4 7765 B12R1.8 C#CCONCc1ccccc1 Amb24444637 [0,2,0,0,0,0|2,0,0]=4 7766 B12R1.8 C=C=CCNCc1ccccc1 Amb25775091 [0,2,0,0,0,0|2,0,0]=4 7767 B12R1.8 C=CCCCCc1ccccc1 Amb19930233 [0,2,0,0,0,0|2,0,0]=4 7768 B12R1.8 C=CCNCCc1ccccc1 Amb2119614 [0,2,0,0,0,0|1,0,0]=3 7769 B12R1.8 C=CCONCc1ccccc1 Amb24725564 [0,2,0,0,0,0|2,0,0]=4 7770 B12R1.8 C=C\C=C\CCc1ccccc1 Amb20248567 [0,2,0,0,0,0|2,0,0]=4 7771 B12R1.8 CC#CCNCc1ccccc1 Amb10233665 [0,2,0,0,0,0|2,0,0]=4 7772 B12R1.8 CC#CCSCc1ccccc1 Amb25788750 [0,2,0,0,0,0|2,0,0]=4 7773 B12R1.8 CCCCCOc1ccccc1 Amb1106330 [0,2,0,0,0,0|2,0,0]=4 7774 B12R1.8 CCCC\C=C/c1ccccc1 Amb22546625 [0,2,0,0,0,0|2,0,0]=4 7775 B12R1.8 CCCC\N=C\c1ccccc1 Amb20248424 [0,2,0,0,0,0|2,0,0]=4 7776 B12R1.8 CCCNCCc1ccccc1 Amb2119486 [0,2,0,0,0,0|1,0,0]=3 7777 B12R1.8 CCCONCc1ccccc1 Amb25031180 [0,2,0,0,0,0|2,0,0]=4 7778 B12R1.8 CCC\C=C/Cc1ccccc1 Amb22546636 [0,2,0,0,0,0|2,0,0]=4 7779 B12R1.8 CCC\C=N\Cc1ccccc1 Amb10562392 [0,2,0,0,0,0|2,0,0]=4 7780 B12R1.8 CCNCC#Cc1ccccc1 Amb18800149 [0,2,0,0,0,0|1,0,1]=4 7781 B12R1.8 CCNCCCc1ccccc1 Amb2094490 [0,2,0,0,0,0|1,0,0]=3 7782 B12R1.8 CCNCCNc1ccccc1 Amb18792597 [0,2,0,0,0,0|1,0,0]=3 7783 B12R1.8 CCNCCOc1ccccc1 Amb2099717 [0,2,0,0,0,0|1,0,0]=3 7784 B12R1.8 CCNCCSc1cccc[n]1 Amb19045126 [0,2,0,0,0,0|2,0,0]=4 7785 B12R1.8 CCNCCSc1ccccc1 Amb10608724 [0,2,0,0,0,0|1,0,0]=3 7786 B12R1.8 CCOCCCc1ccccc1 Amb24063530 [0,2,0,0,0,0|2,0,0]=4 7787 B12R1.8 CCSCCNc1ccccc1 Amb17307513 [0,2,0,0,0,0|2,0,0]=4 7788 B12R1.8 CNCC#CCc1cc[n]cc1 Amb25110451 [0,2,0,0,0,0|2,0,0]=4 7789 B12R1.8 CNCCC#Cc1ccccc1 Amb19025186 [0,2,0,0,0,0|1,0,0]=3 7790 B12R1.8 CNCCCCc1ccccc1 Amb10068774 [0,2,0,0,0,0|1,0,0]=3 7791 B12R1.8 CNCCCCc1cccnc1 Amb17617748 [0,2,0,0,0,0|2,0,0]=4 7792 B12R1.8 CNCCCNc1ccccc1 Amb13951704 [0,2,0,0,0,0|1,0,0]=3 7793 B12R1.8 CNCCCSc1ccccc1 Amb10608730 [0,2,0,0,0,0|1,0,0]=3 7794 B12R1.8 CNCCCSc1ccccc1 Amb22588097 [0,2,0,0,0,0|1,0,0]=3 7795 B12R1.8 CNCCNCc1c[n]ccc1 Amb18798457 [0,2,0,0,0,0|2,0,0]=4 7796 B12R1.8 CNCCNCc1cc[n]cc1 Amb20414384 [0,2,0,0,0,0|2,0,0]=4 7797 B12R1.8 CNCCNCc1cccc[n]1 Amb18798456 [0,2,0,0,0,0|2,0,0]=4 7798 B12R1.8 CNCCOCc1ccccc1 Amb20668782 [0,2,0,0,0,0|1,0,0]=3 7799 B12R1.8 CNCCSCc1c[n]ccc1 Amb21984678 [0,2,0,0,0,0|2,0,0]=4 7800 B12R1.8 CNCCSCc1cccc[n]1 Amb21984677 [0,2,0,0,0,0|2,0,0]=4 7801 B12R1.8 CNCCSCc1ccccc1 Amb18809641 [0,2,0,0,0,0|1,0,0]=3 7802 B12R1.8 CNCC\C=C\c1c[n]ccc1 Amb22369962 [0,2,0,0,0,0|2,0,0]=4 7803 B12R1.8 CNCC\C=C\c1cccnc1 Amb17617598 [0,2,0,0,0,0|2,0,0]=4 7804 B12R1.8 COCCCNc1ccccc1 Amb17232551 [0,2,0,0,0,0|2,0,0]=4 7805 B12R1.8 COCCCOc1ccccc1 Amb23450364 [0,2,0,0,0,0|2,0,0]=4 7806 B12R1.8 CONCC#Cc1ccccc1 Amb25139183 [0,2,0,0,0,0|1,0,1]=4 7807 B12R1.8 CSCCNCc1ccccc1 Amb18187025 [0,2,0,0,0,0|2,0,0]=4 7808 B12R1.8 C\C=C\CNCc1ccccc1 Amb18645560 [0,2,0,0,0,0|2,0,0]=4 7809 B12R1.8 ClCCCCCc1ccccc1 Amb10808064 [0,2,0,0,0,0|2,0,0]=4 7810 B12R1.8 ClCCCNCc1ccccc1 Amb10766327 [0,2,0,0,0,0|2,0,0]=4 7811 B12R1.8 Cl[Zn]CCCCc1ccccc1 Amb22897864 [0,2,0,0,0,0|2,0,0]=4 7812 B12R1.8 Cl\C=C/COCc1ccccc1 Amb24711309 [0,2,0,0,0,0|2,0,0]=4 7813 B12R1.8 FCCCSCc1ccccc1 Amb22008717 [0,2,0,0,0,0|2,0,0]=4 7814 B12R1.8 N#CCCNNc1ccccc1 Amb17594020 [0,2,0,0,0,0|1,0,1]=4 7815 B12R1.8 N#CCC\C=C\c1ccccc1 Amb18644947 [0,2,0,0,0,0|1,0,1]=4 7816 B12R1.8 N#CNC\C=C\c1ccccc1 Amb25840311 [0,2,0,0,0,0|0,0,2]=4 7817 B12R1.8 N#C\C=C\CCc1ccccc1 Amb17477529 [0,2,0,0,0,0|1,0,1]=4 7818 B12R1.8 NCCCC#Cc1c[n]ccc1 Amb25048057 [0,2,0,0,0,0|2,0,0]=4 7819 B12R1.8 NCCCC#Cc1cccc[n]1 Amb25048054 [0,2,0,0,0,0|2,0,0]=4 7820 B12R1.8 NCCCC#Cc1ccccc1 Amb25803470 [0,2,0,0,0,0|1,0,0]=3 7821 B12R1.8 NCCCCCc1ccccc1 Amb18034503 [0,2,0,0,0,0|1,0,0]=3 7822 B12R1.8 NCCCCNc1cc[n]cc1 Amb18792687 [0,2,0,0,0,0|2,0,0]=4 7823 B12R1.8 NCCCCNc1ccccn1 Amb13952725 [0,2,0,0,0,0|2,0,0]=4 7824 B12R1.8 NCCCNCc1ccccc1 Amb17720405 [0,2,0,0,0,0|1,0,0]=3 7825 B12R1.8 NCCCNCc1ccccn1 Amb17315287 [0,2,0,0,0,0|2,0,0]=4 7826 B12R1.8 NCCCNCc1cccnc1 Amb17315286 [0,2,0,0,0,0|2,0,0]=4 7827 B12R1.8 NCCCNCc1ccncc1 Amb17315285 [0,2,0,0,0,0|2,0,0]=4 7828 B12R1.8 NCCCOCc1ccccc1 Amb1217769 [0,2,0,0,0,0|1,0,0]=3 7829 B12R1.8 NCCC\C=C\c1ccccc1 Amb18563531 [0,2,0,0,0,0|1,0,0]=3 7830 B12R1.8 NCCNCCc1ccccc1 Amb1086596 [0,2,0,0,0,0|0,0,0]=2 7831 B12R1.8 NCCNCCc1ccccc1 Amb22283881 [0,2,0,0,0,0|0,0,0]=2 7832 B12R1.8 NCCOCCc1ccccc1 Amb19374389 [0,2,0,0,0,0|1,0,0]=3 7833 B12R1.8 NC\C=C\CNc1ccccc1 Amb25046454 [0,2,0,0,0,0|1,0,1]=4 7834 B12R1.8 NNCCCCc1cccc[n]1 Amb22497574 [0,2,0,0,0,0|1,0,0]=3 7835 B12R1.8 NNCCCCc1ccccn1 Amb10844877 [0,2,0,0,0,0|1,0,0]=3 7836 B12R1.8 NNCCCOc1ccccc1 Amb19373220 [0,2,0,0,0,0|0,0,0]=2 7837 B12R1.8 NOCCOCc1ccccc1 Amb22896393 [0,2,0,0,0,0|1,0,0]=3 7838 B12R1.8 NOCC\C=C\c1ccccc1 Amb18563583 [0,2,0,0,0,0|1,0,0]=3 7839 B12R1.8 O=C=NCCOc1ccccc1 Amb13783673 [0,2,0,0,0,0|1,0,1]=4 7840 B12R1.8 O=CC#CCCc1ccccc1 Amb24356095 [0,2,0,0,0,0|2,0,0]=4 7841 B12R1.8 O=CCCCCc1ccccc1 Amb18798121 [0,2,0,0,0,0|2,0,0]=4 7842 B12R1.8 O=CCCCOc1ccccc1 Amb18798283 [0,2,0,0,0,0|2,0,0]=4 7843 B12R1.8 O=CCOCCc1ccccc1 Amb18800786 [0,2,0,0,0,0|2,0,0]=4 7844 B12R1.8 O=CNCNCc1ccccc1 Amb24532665 [0,2,0,0,0,0|1,0,0]=3 7845 B12R1.8 O=CNCOCc1ccccc1 Amb24552397 [0,2,0,0,0,0|1,0,0]=3 7846 B12R1.8 O=CNC\C=C\c1ccccc1 Amb25249766 [0,2,0,0,0,0|1,0,1]=4 7847 B12R1.8 O=COCCCc1ccccc1 Amb22229401 [0,2,0,0,0,0|2,0,0]=4 7848 B12R1.8 OCCCC#Cc1ccccc1 Amb22730795 [0,2,0,0,0,0|2,0,0]=4 7849 B12R1.8 OCCCNCc1ccccc1 Amb2221510 [0,2,0,0,0,0|2,0,0]=4 7850 B12R1.8 OCCNCCc1cc[n]cc1 Amb22282674 [0,2,0,0,0,0|2,0,0]=4 7851 B12R1.8 OCCNCCc1cc[n]cc1 Amb22282814 [0,2,0,0,0,0|2,0,0]=4 7852 B12R1.8 OCCNCCc1ccccc1 Amb2119205 [0,2,0,0,0,0|1,0,0]=3 7853 B12R1.8 OCCNCCc1ccncc1 Amb1028249 [0,2,0,0,0,0|2,0,0]=4 7854 B12R1.8 OCOCOCc1ccccc1 Amb25803238 [0,2,0,0,0,0|2,0,0]=4 7855 B12R1.8 O\C=C\NCCc1ccccc1 Amb24721604 [0,2,0,0,0,0|1,0,0]=3 7856 B12R1.8 S=C=NCCOc1ccccc1 Amb17233560 [0,2,0,0,0,0|1,0,1]=4 7857 B12R1.8 S=C=NCCSc1ccccc1 Amb2371165 [0,2,0,0,0,0|1,0,1]=4 7858 B12R1.8 SCCCNCc1ccccc1 Amb25751336 [0,2,0,0,0,0|2,0,0]=4 7859 B12R1.8 [N-]=[N+]=NCCCc1ccccc1 Amb10572439 [0,2,0,0,0,0|0,0,2]=4 7860 B12R1.27 C#CC(=O)CCc1ccccc1 Amb24483845 [0,2,0,0,0,0|2,0,0]=4 7861 B12R1.27 C#CC(Cl)CCc1ccccc1 Amb25775006 [0,2,0,0,0,0|2,0,0]=4 7862 B12R1.27 C#CC(N)CCc1c[n]ccc1 Amb25197860 [0,2,0,0,0,0|2,0,0]=4 7863 B12R1.27 C#CC(N)CCc1ccccc1 Amb25150966 [0,2,0,0,0,0|1,0,0]=3 7864 B12R1.27 C#CC(N)CSc1ccccc1 Amb24731339 [0,2,0,0,0,0|2,0,0]=4 7865 B12R1.27 C#CC(O)CCc1ccccc1 Amb25024201 [0,2,0,0,0,0|2,0,0]=4 7866 B12R1.27 C#CC(O)COc1ccccc1 Amb25686511 [0,2,0,0,0,0|2,0,0]=4 7867 B12R1.27 C#C[C@@H](O)COc1ccccc1 Amb25205027 [0,2,0,0,0,0|2,0,0]=4 7868 B12R1.27 C#C[C@H](O)CCc1ccccc1 Amb25266374 [0,2,0,0,0,0|2,0,0]=4 7869 B12R1.27 C=CC(=O)CCc1ccccc1 Amb10562280 [0,2,0,0,0,0|2,0,0]=4 7870 B12R1.27 C=CC(O)CSc1ccccc1 Amb24273355 [0,2,0,0,0,0|2,0,0]=4 7871 B12R1.27 CC(C#C)OCc1ccccc1 Amb25208112 [0,2,0,0,0,0|2,0,0]=4 7872 B12R1.27 CC(C#N)NCc1ccccc1 Amb17044860 [0,2,0,0,0,0|1,0,1]=4 7873 B12R1.27 CC(C#N)OCc1ccccc1 Amb18797967 [0,2,0,0,0,0|1,0,1]=4 7874 B12R1.27 CC(C#N)SCc1ccccc1 Amb18808999 [0,2,0,0,0,0|1,0,1]=4 7875 B12R1.27 CC(C=O)OCc1ccccc1 Amb18646071 [0,2,0,0,0,0|2,0,0]=4 7876 B12R1.27 CC(CCc1ccccc1)NN Amb22445317 [0,2,0,0,0,0|0,0,0]=2 7877 B12R1.27 CC(CCl)CNc1ccccc1 Amb22756334 [0,2,0,0,0,0|2,0,0]=4 7878 B12R1.27 CC(CCl)OCc1ccccc1 Amb25257973 [0,2,0,0,0,0|2,0,0]=4 7879 B12R1.27 CC(CF)NCc1ccccc1 Amb24536598 [0,2,0,0,0,0|2,0,0]=4 7880 B12R1.27 CC(CN)CNc1c[n]ccc1 Amb25223001 [0,2,0,0,0,0|2,0,0]=4 7881 B12R1.27 CC(CN)CNc1ccccc1 Amb19027860 [0,2,0,0,0,0|1,0,0]=3 7882 B12R1.27 CC(CN)NCc1ccccc1 Amb18646179 [0,2,0,0,0,0|1,0,0]=3 7883 B12R1.27 CC(CN)OCc1ccccc1 Amb18312421 [0,2,0,0,0,0|1,0,0]=3 7884 B12R1.27 CC(CNc1ccccc1)C=C Amb25080486 [0,2,0,0,0,0|2,0,0]=4 7885 B12R1.27 CC(CNc1ccccc1)NN Amb18646401 [0,2,0,0,0,0|0,0,0]=2 7886 B12R1.27 CC(CO)OCc1ccccc1 Amb25667474 [0,2,0,0,0,0|2,0,0]=4 7887 B12R1.27 CC(COc1ccccc1)NN Amb18563755 [0,2,0,0,0,0|0,0,0]=2 7888 B12R1.27 CCC(CCc1ccccc1)O Amb17138574 [0,2,0,0,0,0|2,0,0]=4 7889 B12R1.27 CCC(CNc1ccccc1)O Amb13952005 [0,2,0,0,0,0|2,0,0]=4 7890 B12R1.27 CCC(CSc1ccccc1)N Amb17485970 [0,2,0,0,0,0|2,0,0]=4 7891 B12R1.27 CCC(N)CNc1ccccc1 Amb19009674 [0,2,0,0,0,0|2,0,0]=4 7892 B12R1.27 CCC(N)COc1ccccc1 Amb19029691 [0,2,0,0,0,0|2,0,0]=4 7893 B12R1.27 CCC(O)OCc1ccccc1 Amb25793622 [0,2,0,0,0,0|2,0,0]=4 7894 B12R1.27 CCN(C)CCc1cc[n]cc1 Amb24099576 [0,2,0,0,0,0|2,0,0]=4 7895 B12R1.27 CC[C@H](C)CNc1ccccc1 Amb25843960 [0,2,0,0,0,0|2,0,0]=4 7896 B12R1.27 CN(CCc1cccc[n]1)C#N Amb24407715 [0,2,0,0,0,0|1,0,1]=4 7897 B12R1.27 CN(CCc1ccccc1)C#N Amb24448226 [0,2,0,0,0,0|0,0,1]=3 7898 B12R1.27 CN(CNc1ccccc1)N=O Amb25690722 [0,2,0,0,0,0|1,0,1]=4 7899 B12R1.27 CNC(=N)COc1ccccc1 Amb25336063 [0,2,0,0,0,0|1,0,1]=4 7900 B12R1.27 CNC(=N)CSc1ccccc1 Amb24485624 [0,2,0,0,0,0|1,0,1]=4 7901 B12R1.27 CNC(=N)NCc1ccccc1 Amb18798221 [0,2,0,0,0,0|1,0,1]=4 7902 B12R1.27 CNC(=O)NCc1ccccc1 Amb2132763 [0,2,0,0,0,0|1,0,1]=4 7903 B12R1.27 CNC(C)CNc1cc[n]cc1 Amb24368269 [0,2,0,0,0,0|2,0,0]=4 7904 B12R1.27 CNC(C)CNc1ccccc1 Amb18312626 [0,2,0,0,0,0|1,0,0]=3 7905 B12R1.27 CNC(C)\C=C\c1ccccc1 Amb18126307 [0,2,0,0,0,0|1,0,1]=4 7906 B12R1.27 CNC(CCc1ccccc1)C Amb1138722 [0,2,0,0,0,0|1,0,0]=3 7907 B12R1.27 CNC(CCc1cccnc1)C Amb17507452 [0,2,0,0,0,0|2,0,0]=4 7908 B12R1.27 COC(C)CNc1ccccc1 Amb19025483 [0,2,0,0,0,0|2,0,0]=4 7909 B12R1.27 CSC(C)CNc1ccccc1 Amb18312645 [0,2,0,0,0,0|2,0,0]=4 7910 B12R1.27 C[C@@H](CCl)OCc1ccccc1 Amb25320908 [0,2,0,0,0,0|2,0,0]=4 7911 B12R1.27 C[C@@H](CN)NCc1ccccc1 Amb24396541 [0,2,0,0,0,0|1,0,0]=3 7912 B12R1.27 C[C@@H](CO)NCc1ccccc1 Amb19301927 [0,2,0,0,0,0|2,0,0]=4 7913 B12R1.27 C[C@H](C=O)OCc1ccccc1 Amb25326165 [0,2,0,0,0,0|2,0,0]=4 7914 B12R1.27 C[C@H](CO)NCc1ccccc1 Amb19375302 [0,2,0,0,0,0|2,0,0]=4 7915 B12R1.27 C[C@H](CO)OCc1ccccc1 Amb25694316 [0,2,0,0,0,0|2,0,0]=4 7916 B12R1.27 C\C(\CCc1ccccc1)=N\O Amb24638706 [0,2,0,0,0,0|1,0,1]=4 7917 B12R1.27 C\C(\CN)=C\Cc1ccccc1 Amb24438874 [0,2,0,0,0,0|1,0,1]=4 7918 B12R1.27 C\N=C(\SCc1ccccc1)/N Amb11238902 [0,2,0,0,0,0|2,0,0]=4 7919 B12R1.27 ClCC(=O)CCc1ccccc1 Amb17139043 [0,2,0,0,0,0|2,0,0]=4 7920 B12R1.27 ClCC(CNc1ccccc1)O Amb10565986 [0,2,0,0,0,0|2,0,0]=4 7921 B12R1.27 ClCC(Cl)OCc1ccccc1 Amb25139547 [0,2,0,0,0,0|2,0,0]=4 7922 B12R1.27 N#CC(=O)CCc1ccccc1 Amb25143496 [0,2,0,0,0,0|1,0,1]=4 7923 B12R1.27 N#CC(Cl)CCc1ccccc1 Amb18791084 [0,2,0,0,0,0|1,0,1]=4 7924 B12R1.27 N#CC(Cl)CNc1ccccc1 Amb18648453 [0,2,0,0,0,0|1,0,1]=4 7925 B12R1.27 N#CC(Cl)CSc1ccccc1 Amb18130442 [0,2,0,0,0,0|1,0,1]=4 7926 B12R1.27 N#CC(O)CCc1ccccc1 Amb18177732 [0,2,0,0,0,0|1,0,1]=4 7927 B12R1.27 N#CC(O)CSc1ccccc1 Amb25051459 [0,2,0,0,0,0|1,0,1]=4 7928 B12R1.27 N#C[C@@H](O)CCc1ccccc1 Amb25073440 [0,2,0,0,0,0|1,0,1]=4 7929 B12R1.27 N#C[C@@H](O)COc1ccccc1 Amb24474239 [0,2,0,0,0,0|1,0,1]=4 7930 B12R1.27 N#C[C@H](O)CCc1ccccc1 Amb24344695 [0,2,0,0,0,0|1,0,1]=4 7931 B12R1.27 NC(C#N)COc1ccccc1 Amb17076555 [0,2,0,0,0,0|1,0,1]=4 7932 B12R1.27 NC(CCc1ccccc1)C#N Amb18999188 [0,2,0,0,0,0|1,0,0]=3 7933 B12R1.27 NC(CO)CCc1c[n]ccc1 Amb18563730 [0,2,0,0,0,0|2,0,0]=4 7934 B12R1.27 NC(CO)CCc1cc[n]cc1 Amb18563732 [0,2,0,0,0,0|2,0,0]=4 7935 B12R1.27 NC(CO)CCc1cccc[n]1 Amb18563729 [0,2,0,0,0,0|2,0,0]=4 7936 B12R1.27 NC(CO)CNc1ccccc1 Amb25674165 [0,2,0,0,0,0|2,0,0]=4 7937 B12R1.27 NC(CO)COc1ccccc1 Amb18563798 [0,2,0,0,0,0|2,0,0]=4 7938 B12R1.27 NC(COc1ccccc1)=NN Amb18788366 [0,2,0,0,0,0|0,0,2]=4 7939 B12R1.27 NC(CSc1ccccc1)C#N Amb18984305 [0,2,0,0,0,0|1,0,1]=4 7940 B12R1.27 NC(NCc1ccccc1)=NO Amb18800915 [0,2,0,0,0,0|2,0,0]=4 7941 B12R1.27 NCC(=O)CCc1ccccc1 Amb18563587 [0,2,0,0,0,0|1,0,0]=3 7942 B12R1.27 NCC(=O)OCc1ccccc1 Amb1207685 [0,2,0,0,0,0|1,0,1]=4 7943 B12R1.27 NCC(=O)OCc1ccccc1 Amb1808695 [0,2,0,0,0,0|1,0,1]=4 7944 B12R1.27 NCC(=O)OCc1ccccc1 Amb2228429 [0,2,0,0,0,0|1,0,1]=4 7945 B12R1.27 NCC(CNc1ccccc1)O Amb17138613 [0,2,0,0,0,0|1,0,0]=3 7946 B12R1.27 NCC(COc1ccccc1)O Amb1139174 [0,2,0,0,0,0|1,0,0]=3 7947 B12R1.27 NCC(F)C#Cc1ccccc1 Amb24470253 [0,2,0,0,0,0|1,0,1]=4 7948 B12R1.27 NCC(N)\C=C\c1ccccc1 Amb24678472 [0,2,0,0,0,0|1,0,1]=4 7949 B12R1.27 NCC(O)C#Cc1ccccc1 Amb24677996 [0,2,0,0,0,0|1,0,1]=4 7950 B12R1.27 NCC(O)CNc1cc[n]cc1 Amb24752893 [0,2,0,0,0,0|2,0,0]=4 7951 B12R1.27 NCC(O)\C=C\c1ccccc1 Amb18126377 [0,2,0,0,0,0|1,0,1]=4 7952 B12R1.27 NC[C@@H](O)COc1ccccc1 Amb22747719 [0,2,0,0,0,0|1,0,0]=3 7953 B12R1.27 NC\C(\F)=C\Cc1ccccc1 Amb24743578 [0,2,0,0,0,0|1,0,1]=4 7954 B12R1.27 NN=C([S-])SCc1ccccc1 Amb22446067 [0,2,0,0,0,0|0,0,2]=4 7955 B12R1.27 NNC(=N)\N=C\c1ccccc1 Amb25709604 [0,2,0,0,0,0|0,0,2]=4 7956 B12R1.27 NNC(=O)C#Cc1ccccc1 Amb25701130 [0,2,0,0,0,0|0,0,2]=4 7957 B12R1.27 NNC(=O)CCc1cccc[n]1 Amb25299317 [0,2,0,0,0,0|1,0,0]=3 7958 B12R1.27 NNC(=O)CCc1ccccc1 Amb1130599 [0,2,0,0,0,0|0,0,0]=2 7959 B12R1.27 NNC(=O)CCc1ccncc1 Amb10553044 [0,2,0,0,0,0|1,0,0]=3 7960 B12R1.27 NNC(=O)CNc1cccc[n]1 Amb25187500 [0,2,0,0,0,0|1,0,1]=4 7961 B12R1.27 NNC(=O)CNc1ccccc1 Amb1104534 [0,2,0,0,0,0|0,0,1]=3 7962 B12R1.27 NNC(=O)CSc1ccccn1 Amb1060961 [0,2,0,0,0,0|1,0,1]=4 7963 B12R1.27 NNC(=O)SCc1ccccc1 Amb24423487 [0,2,0,0,0,0|0,0,1]=3 7964 B12R1.27 NNC(=O)\C=C\c1ccccc1 Amb25838381 [0,2,0,0,0,0|0,0,2]=4 7965 B12R1.27 NNC(=S)NCc1ccccc1 Amb1636204 [0,2,0,0,0,0|0,0,1]=3 7966 B12R1.27 NNC(=S)NCc1cccnc1 Amb1104556 [0,2,0,0,0,0|1,0,1]=4 7967 B12R1.27 NNC(=S)NNc1ccccc1 Amb24502103 [0,2,0,0,0,0|1,0,1]=4 7968 B12R1.27 NNC(=S)SCc1cccc[n]1 Amb24658188 [0,2,0,0,0,0|1,0,1]=4 7969 B12R1.27 N\C(\CCc1c[n]ccc1)=N/O Amb24678911 [0,2,0,0,0,0|2,0,0]=4 7970 B12R1.27 N\C(\CCc1cc[n]cc1)=N/O Amb18792640 [0,2,0,0,0,0|2,0,0]=4 7971 B12R1.27 N\C(\CCc1cccc[n]1)=N/O Amb18792639 [0,2,0,0,0,0|2,0,0]=4 7972 B12R1.27 N\C(\CCc1ccccc1)=N\N Amb18788201 [0,2,0,0,0,0|0,0,1]=3 7973 B12R1.27 N\C(\CCc1ccccc1)=N\O Amb22053006 [0,2,0,0,0,0|1,0,0]=3 7974 B12R1.27 N\C(\CNc1ccccc1)=N\O Amb24614329 [0,2,0,0,0,0|2,0,0]=4 7975 B12R1.27 O=C(CBr)CCc1ccccc1 Amb20171375 [0,2,0,0,0,0|2,0,0]=4 7976 B12R1.27 O=C(NCl)NCc1ccccc1 Amb22735087 [0,2,0,0,0,0|1,0,1]=4 7977 B12R1.27 O=C(NCl)OCc1ccccc1 Amb21948731 [0,2,0,0,0,0|1,0,1]=4 7978 B12R1.27 O=CC(CSc1ccccc1)C Amb17594629 [0,2,0,0,0,0|2,0,0]=4 7979 B12R1.27 O=C[C@@H](OCc1ccccc1)C Amb17609288 [0,2,0,0,0,0|2,0,0]=4 7980 B12R1.27 OCC(=O)CCc1ccccc1 Amb18563609 [0,2,0,0,0,0|2,0,0]=4 7981 B12R1.27 OCC(CNc1ccccc1)O Amb17307124 [0,2,0,0,0,0|2,0,0]=4 7982 B12R1.27 OCC(COc1ccccc1)C Amb17232599 [0,2,0,0,0,0|2,0,0]=4 7983 B12R1.27 OCC(CSc1ccccc1)Cl Amb10553704 [0,2,0,0,0,0|2,0,0]=4 7984 B12R1.27 OC[C@@H](COc1ccccc1)O Amb10982588 [0,2,0,0,0,0|2,0,0]=4 7985 B12R1.27 OC[C@@H](O)CNc1ccccc1 Amb18792912 [0,2,0,0,0,0|2,0,0]=4 7986 B12R1.27 OC[C@@H](OCc1ccccc1)C Amb17609287 [0,2,0,0,0,0|2,0,0]=4 7987 B12R1.27 ONC(=O)CCc1cc[n]cc1 Amb24577197 [0,2,0,0,0,0|2,0,0]=4 7988 B12R1.27 ONC(=O)CCc1ccc[n]c1 Amb24413046 [0,2,0,0,0,0|2,0,0]=4 7989 B12R1.27 ONC(=O)CCc1cccc[n]1 Amb24703542 [0,2,0,0,0,0|2,0,0]=4 7990 B12R1.27 ONC(=O)OCc1ccccc1 Amb2445312 [0,2,0,0,0,0|1,0,1]=4 7991 B12R1.27 ONC(=S)NCc1ccccc1 Amb25823184 [0,2,0,0,0,0|1,0,1]=4 7992 B12R1.27 O[C@H](CCl)CNc1ccccc1 Amb24426200 [0,2,0,0,0,0|2,0,0]=4 7993 B12R1.27 O\N=C(\CCc1ccccc1)/N Amb1115853 [0,2,0,0,0,0|1,0,0]=3 7994 B12R1.27 O\N=C(\COc1ccccc1)/N Amb1154723 [0,2,0,0,0,0|2,0,0]=4 7995 B12R1.32 BrCCC(Br)Cc1ccccc1 Amb23456171 [0,2,0,0,0,0|2,0,0]=4 7996 B12R1.32 C#CCC(=O)Cc1ccccc1 Amb18799925 [0,2,0,0,0,0|2,0,0]=4 7997 B12R1.32 C#CCC(N)Cc1ccccc1 Amb18296094 [0,2,0,0,0,0|2,0,0]=4 7998 B12R1.32 C#CCC(O)Cc1ccccc1 Amb18800362 [0,2,0,0,0,0|2,0,0]=4 7999 B12R1.32 C#CC[C@@H](O)Cc1ccccc1 Amb24497745 [0,2,0,0,0,0|2,0,0]=4 8000 B12R1.32 C=C=CC(O)Cc1ccccc1 Amb24420844 [0,2,0,0,0,0|2,0,0]=4 8001 B12R1.32 C=C=C[C@H](O)Cc1ccccc1 Amb25158000 [0,2,0,0,0,0|2,0,0]=4 8002 B12R1.32 C=CCC(N)Cc1ccccc1 Amb19015820 [0,2,0,0,0,0|2,0,0]=4 8003 B12R1.32 CC#CC(N)Cc1ccccc1 Amb24417700 [0,2,0,0,0,0|2,0,0]=4 8004 B12R1.32 CC(CC#N)Sc1ccccc1 Amb18795942 [0,2,0,0,0,0|1,0,1]=4 8005 B12R1.32 CC(CCN)Nc1cc[n]cc1 Amb25081324 [0,2,0,0,0,0|2,0,0]=4 8006 B12R1.32 CC(CNN)Nc1ccccc1 Amb18646400 [0,2,0,0,0,0|0,0,0]=2 8007 B12R1.32 CC(CNN)Oc1ccccc1 Amb18563756 [0,2,0,0,0,0|0,0,0]=2 8008 B12R1.32 CC(Cc1ccccc1)N=C=O Amb17103991 [0,2,0,0,0,0|1,0,1]=4 8009 B12R1.32 CC(Cc1ccccc1)N=C=S Amb18790890 [0,2,0,0,0,0|1,0,1]=4 8010 B12R1.32 CC(Cc1ccccc1)N=[N+]=[N-] Amb25249262 [0,2,0,0,0,0|0,0,2]=4 8011 B12R1.32 CC(Cc1ccccc1)NC#N Amb18177707 [0,2,0,0,0,0|0,0,1]=3 8012 B12R1.32 CC(Cc1ccccc1)NC=S Amb24635878 [0,2,0,0,0,0|1,0,0]=3 8013 B12R1.32 CC(Nc1ccccc1)CC#N Amb17138511 [0,2,0,0,0,0|1,0,1]=4 8014 B12R1.32 CC(Oc1ccccc1)CC#N Amb17232369 [0,2,0,0,0,0|1,0,1]=4 8015 B12R1.32 CCCC(C)Cc1ccccc1 Amb22224920 [0,2,0,0,0,0|2,0,0]=4 8016 B12R1.32 CCCC(Cc1ccccc1)[NH3+] Amb10560244 [0,2,0,0,0,0|2,0,0]=4 8017 B12R1.32 CCCC(N)Cc1ccccc1 Amb18180073 [0,2,0,0,0,0|2,0,0]=4 8018 B12R1.32 CCNC(=S)Cc1ccccc1 Amb24066800 [0,2,0,0,0,0|1,0,1]=4 8019 B12R1.32 CCNC(C)Cc1ccccc1 Amb18552940 [0,2,0,0,0,0|1,0,0]=3 8020 B12R1.32 CCNC(C)Cc1ccccc1 Amb22055190 [0,2,0,0,0,0|1,0,0]=3 8021 B12R1.32 CCNC(Cc1ccccn1)C Amb1995151 [0,2,0,0,0,0|2,0,0]=4 8022 B12R1.32 CN(CC=O)Cc1ccccc1 Amb18800711 [0,2,0,0,0,0|2,0,0]=4 8023 B12R1.32 CN(CCBr)Cc1ccccc1 Amb24357900 [0,2,0,0,0,0|2,0,0]=4 8024 B12R1.32 CN(CCCl)Cc1ccccc1 Amb19895292 [0,2,0,0,0,0|2,0,0]=4 8025 B12R1.32 CN(CCF)Cc1ccccc1 Amb25318241 [0,2,0,0,0,0|2,0,0]=4 8026 B12R1.32 CN(CCI)Cc1ccccc1 Amb25235494 [0,2,0,0,0,0|2,0,0]=4 8027 B12R1.32 CNCC(C)Oc1ccccc1 Amb19025044 [0,2,0,0,0,0|1,0,0]=3 8028 B12R1.32 CNCC(Cc1ccccc1)O Amb17193901 [0,2,0,0,0,0|1,0,0]=3 8029 B12R1.32 CNCC(Cc1cccnc1)O Amb17232605 [0,2,0,0,0,0|2,0,0]=4 8030 B12R1.32 CNCC(N)Cc1ccccc1 Amb19009730 [0,2,0,0,0,0|1,0,0]=3 8031 B12R1.32 CNC\C(=C\c1ccccc1)\C Amb17100030 [0,2,0,0,0,0|1,0,1]=4 8032 B12R1.32 CNNC(=S)Nc1ccccc1 Amb25119287 [0,2,0,0,0,0|1,0,1]=4 8033 B12R1.32 COCC(C)Nc1ccccc1 Amb19024307 [0,2,0,0,0,0|2,0,0]=4 8034 B12R1.32 COCC(N)Cc1ccccc1 Amb20623561 [0,2,0,0,0,0|2,0,0]=4 8035 B12R1.32 CONC(=O)Cc1ccccc1 Amb16969924 [0,2,0,0,0,0|1,0,1]=4 8036 B12R1.32 CSCC(C)Nc1ccccc1 Amb25674366 [0,2,0,0,0,0|2,0,0]=4 8037 B12R1.32 C[C@@H](CC#N)Nc1ccccc1 Amb25301483 [0,2,0,0,0,0|1,0,1]=4 8038 B12R1.32 C[C@@H](CCO)Nc1ccccc1 Amb25124401 [0,2,0,0,0,0|2,0,0]=4 8039 B12R1.32 C[C@@H](Cc1ccccc1)N=[N+]=[N-] Amb24356215 [0,2,0,0,0,0|0,0,2]=4 8040 B12R1.32 C[C@@H](Cc1ccccc1)NC=O Amb24637855 [0,2,0,0,0,0|1,0,0]=3 8041 B12R1.32 C[C@H](CC#N)Nc1ccccc1 Amb24459585 [0,2,0,0,0,0|1,0,1]=4 8042 B12R1.32 C[C@H](CCO)Nc1ccccc1 Amb25324766 [0,2,0,0,0,0|2,0,0]=4 8043 B12R1.32 C[C@H](Cc1ccccc1)N=[N+]=[N-] Amb25667629 [0,2,0,0,0,0|0,0,2]=4 8044 B12R1.32 C\C(\CCN)=C/c1ccccc1 Amb18063553 [0,2,0,0,0,0|1,0,1]=4 8045 B12R1.32 C\C(\Cc1ccccc1)=C\CN Amb25669583 [0,2,0,0,0,0|1,0,1]=4 8046 B12R1.32 C\C=C\C(N)Cc1ccccc1 Amb25142747 [0,2,0,0,0,0|2,0,0]=4 8047 B12R1.32 C\C=C\[C@@H](O)Cc1ccccc1 Amb25741490 [0,2,0,0,0,0|2,0,0]=4 8048 B12R1.32 C\C=C\[C@H](O)Cc1ccccc1 Amb24353018 [0,2,0,0,0,0|2,0,0]=4 8049 B12R1.32 N#CCC(=O)Cc1ccccc1 Amb17232286 [0,2,0,0,0,0|1,0,1]=4 8050 B12R1.32 N#CCC(Cl)Sc1ccccc1 Amb24373160 [0,2,0,0,0,0|1,0,1]=4 8051 B12R1.32 N#CCC(F)Cc1ccccc1 Amb25079148 [0,2,0,0,0,0|1,0,1]=4 8052 B12R1.32 N#CC[C@H](O)Cc1ccccc1 Amb24386953 [0,2,0,0,0,0|1,0,1]=4 8053 B12R1.32 N#CNC(=O)Cc1ccccc1 Amb25149956 [0,2,0,0,0,0|0,0,2]=4 8054 B12R1.32 N=C(Cc1ccccc1)NC#N Amb25289104 [0,2,0,0,0,0|0,0,2]=4 8055 B12R1.32 NCCC(=O)Nc1ccccc1 Amb1125528 [0,2,0,0,0,0|1,0,1]=4 8056 B12R1.32 NCCC(=O)Nc1ccccc1 Amb15740909 [0,2,0,0,0,0|1,0,1]=4 8057 B12R1.32 NCCC(=O)Oc1ccccc1 Amb17334633 [0,2,0,0,0,0|1,0,1]=4 8058 B12R1.32 NCCC(Cc1ccccc1)C Amb17232439 [0,2,0,0,0,0|1,0,0]=3 8059 B12R1.32 NCCC(Cc1ccccc1)O Amb17232552 [0,2,0,0,0,0|1,0,0]=3 8060 B12R1.32 NCCC(O)Cc1c[n]ccc1 Amb18827678 [0,2,0,0,0,0|2,0,0]=4 8061 B12R1.32 NCCC(O)Cc1cccc[n]1 Amb18827677 [0,2,0,0,0,0|2,0,0]=4 8062 B12R1.32 NCCC(Oc1ccccc1)C Amb17232556 [0,2,0,0,0,0|1,0,0]=3 8063 B12R1.32 NCCS(=O)Cc1ccccc1 Amb18306046 [0,2,0,0,0,0|1,0,0]=3 8064 B12R1.32 NN(CCO)Cc1ccccc1 Amb18646608 [0,2,0,0,0,0|2,0,0]=4 8065 B12R1.32 NOCC(=O)Nc1ccccc1 Amb24596278 [0,2,0,0,0,0|1,0,1]=4 8066 B12R1.32 NOCC(=O)Oc1ccccc1 Amb24096859 [0,2,0,0,0,0|1,0,1]=4 8067 B12R1.32 N[C@@H](CC#N)Cc1ccccc1 Amb24483888 [0,2,0,0,0,0|1,0,1]=4 8068 B12R1.32 N\N=C\C(=O)Cc1ccccc1 Amb25046103 [0,2,0,0,0,0|0,0,2]=4 8069 B12R1.32 OC(CCCl)Nc1ccccc1 Amb24635759 [0,2,0,0,0,0|2,0,0]=4 8070 B12R1.32 OC(Cc1ccccc1)C#CCl Amb25156729 [0,2,0,0,0,0|2,0,0]=4 8071 B12R1.32 OC(Cc1ccccc1)CC#N Amb17232368 [0,2,0,0,0,0|1,0,1]=4 8072 B12R1.32 OCCC(Cc1ccccc1)C Amb17232486 [0,2,0,0,0,0|2,0,0]=4 8073 B12R1.32 OCCC(O)Cc1ccccc1 Amb22491209 [0,2,0,0,0,0|2,0,0]=4 8074 B12R1.32 OCCC(O)Nc1ccccc1 Amb25060097 [0,2,0,0,0,0|2,0,0]=4 8075 B12R1.32 OCCC(Oc1ccccc1)C Amb17232598 [0,2,0,0,0,0|2,0,0]=4 8076 B12R1.32 OCCN(O)Cc1ccccc1 Amb25284514 [0,2,0,0,0,0|2,0,0]=4 8077 B12R1.32 ONCC(=O)Nc1ccccc1 Amb24495972 [0,2,0,0,0,0|1,0,1]=4 8078 B12R1.32 O\N=C\C(O)Cc1ccccc1 Amb25136306 [0,2,0,0,0,0|1,0,1]=4 8079 B12R1.32 SCCN(Cc1ccccc1)C Amb13881720 [0,2,0,0,0,0|2,0,0]=4 8080 B12R1.32 [BH3]N(CCC)Cc1ccccc1 Amb24678772 [0,2,0,0,0,0|2,0,0]=4 8081 B12R1.32 [K]ONC(=O)Cc1ccccc1 Amb10558422 [0,2,0,0,0,0|1,0,1]=4 8082 B12R1.252 BrC(=C)CNCc1ccccc1 Amb1774594 [0,2,0,0,0,0|2,0,0]=4 8083 B12R1.252 C=C(Br)COCc1ccccc1 Amb25305709 [0,2,0,0,0,0|2,0,0]=4 8084 B12R1.252 C=C(Cl)CNCc1ccccc1 Amb19004833 [0,2,0,0,0,0|2,0,0]=4 8085 B12R1.252 C=C(F)CNCc1ccccc1 Amb25060778 [0,2,0,0,0,0|2,0,0]=4 8086 B12R1.252 CC(=C)CCNc1ccccc1 Amb25771824 [0,2,0,0,0,0|2,0,0]=4 8087 B12R1.252 CC(=C)CNCc1ccccc1 Amb10608684 [0,2,0,0,0,0|2,0,0]=4 8088 B12R1.252 CC(=C)CNCc1ccccc1 Amb17622487 [0,2,0,0,0,0|2,0,0]=4 8089 B12R1.252 CC(=N)NCCc1cc[n]cc1 Amb25148471 [0,2,0,0,0,0|1,0,1]=4 8090 B12R1.252 CC(=N)NCCc1ccc[n]c1 Amb25148470 [0,2,0,0,0,0|1,0,1]=4 8091 B12R1.252 CC(=N)NCCc1cccc[n]1 Amb25051604 [0,2,0,0,0,0|1,0,1]=4 8092 B12R1.252 CC(=N)NCCc1ccccc1 Amb25148437 [0,2,0,0,0,0|0,0,1]=3 8093 B12R1.252 CC(=O)NCCc1cccc[n]1 Amb22751848 [0,2,0,0,0,0|2,0,0]=4 8094 B12R1.252 CC(=O)NCCc1ccncc1 Amb1066478 [0,2,0,0,0,0|2,0,0]=4 8095 B12R1.252 CC(=O)NOCc1ccccc1 Amb10571914 [0,2,0,0,0,0|2,0,0]=4 8096 B12R1.252 CC(Br)CCSc1ccccc1 Amb20623511 [0,2,0,0,0,0|2,0,0]=4 8097 B12R1.252 CC(C)=CCCc1ccccc1 Amb17843373 [0,2,0,0,0,0|2,0,0]=4 8098 B12R1.252 CC(C)CCCc1ccccc1 Amb24063684 [0,2,0,0,0,0|2,0,0]=4 8099 B12R1.252 CC(C)CCOc1ccccc1 Amb23450363 [0,2,0,0,0,0|2,0,0]=4 8100 B12R1.252 CC(C)CNCc1ccccc1 Amb22586944 [0,2,0,0,0,0|2,0,0]=4 8101 B12R1.252 CC(C)NCCc1cc[n]cc1 Amb24117837 [0,2,0,0,0,0|2,0,0]=4 8102 B12R1.252 CC(C)NOCc1ccccc1 Amb24407142 [0,2,0,0,0,0|2,0,0]=4 8103 B12R1.252 CC(CCCc1ccccc1)Cl Amb17477428 [0,2,0,0,0,0|2,0,0]=4 8104 B12R1.252 CC(CCCc1ccccc1)O Amb17138575 [0,2,0,0,0,0|2,0,0]=4 8105 B12R1.252 CC(CCCc1cccnc1)N Amb17232504 [0,2,0,0,0,0|2,0,0]=4 8106 B12R1.252 CC(CCSc1ccccc1)N Amb13881552 [0,2,0,0,0,0|1,0,0]=3 8107 B12R1.252 CC(COCc1ccccc1)N Amb1124568 [0,2,0,0,0,0|1,0,0]=3 8108 B12R1.252 CC(Cl)COCc1ccccc1 Amb25059141 [0,2,0,0,0,0|2,0,0]=4 8109 B12R1.252 CC(F)CCCc1ccccc1 Amb22229780 [0,2,0,0,0,0|2,0,0]=4 8110 B12R1.252 CC(F)CNCc1ccccc1 Amb25795376 [0,2,0,0,0,0|2,0,0]=4 8111 B12R1.252 CC(I)CCCc1ccccc1 Amb22274883 [0,2,0,0,0,0|2,0,0]=4 8112 B12R1.252 CC(N)CC#Cc1ccccc1 Amb25081198 [0,2,0,0,0,0|1,0,1]=4 8113 B12R1.252 CC(N)CCNc1ccccc1 Amb19009675 [0,2,0,0,0,0|1,0,0]=3 8114 B12R1.252 CC(N)CNCc1ccccc1 Amb18305296 [0,2,0,0,0,0|1,0,0]=3 8115 B12R1.252 CC(NCCc1ccccc1)C Amb2111109 [0,2,0,0,0,0|1,0,0]=3 8116 B12R1.252 CC(NCCc1cccnc1)C Amb17400162 [0,2,0,0,0,0|2,0,0]=4 8117 B12R1.252 CC(O)CCNc1ccccc1 Amb25376877 [0,2,0,0,0,0|2,0,0]=4 8118 B12R1.252 CC(S)CNCc1ccccc1 Amb18648551 [0,2,0,0,0,0|2,0,0]=4 8119 B12R1.252 CN(C)CCNc1c[n]ccc1 Amb18270356 [0,2,0,0,0,0|2,0,0]=4 8120 B12R1.252 CN(C)CCOc1cccc[n]1 Amb24089708 [0,2,0,0,0,0|2,0,0]=4 8121 B12R1.252 CN(C)CCOc1ccccc1 Amb22499767 [0,2,0,0,0,0|1,0,0]=3 8122 B12R1.252 CN(C)CCSc1cccc[n]1 Amb21977799 [0,2,0,0,0,0|2,0,0]=4 8123 B12R1.252 CN(C)C\C=C\c1ccccc1 Amb24434314 [0,2,0,0,0,0|1,0,1]=4 8124 B12R1.252 CN(C)\C=N\Cc1ccccc1 Amb25686859 [0,2,0,0,0,0|1,0,1]=4 8125 B12R1.252 CN(CCCc1ccccc1)C Amb1085936 [0,2,0,0,0,0|1,0,0]=3 8126 B12R1.252 CN(N)CCNc1ccccc1 Amb18646399 [0,2,0,0,0,0|0,0,0]=2 8127 B12R1.252 CN(N)CCOc1ccccc1 Amb18563757 [0,2,0,0,0,0|0,0,0]=2 8128 B12R1.252 CS(=O)CCNc1ccccc1 Amb24562694 [0,2,0,0,0,0|2,0,0]=4 8129 B12R1.252 CS(=O)NOCc1ccccc1 Amb24620390 [0,2,0,0,0,0|2,0,0]=4 8130 B12R1.252 C[C@@H](COCc1ccccc1)N Amb17061656 [0,2,0,0,0,0|1,0,0]=3 8131 B12R1.252 C[C@@H](N)CCCc1c[n]ccc1 Amb22388607 [0,2,0,0,0,0|2,0,0]=4 8132 B12R1.252 C[C@@H](N)COCc1ccccc1 Amb18529657 [0,2,0,0,0,0|1,0,0]=3 8133 B12R1.252 C[C@@H](O)CNCc1ccccc1 Amb25708513 [0,2,0,0,0,0|2,0,0]=4 8134 B12R1.252 C[C@@H](O)COCc1ccccc1 Amb22169747 [0,2,0,0,0,0|2,0,0]=4 8135 B12R1.252 C[C@H](N)CNCc1ccccc1 Amb25047295 [0,2,0,0,0,0|1,0,0]=3 8136 B12R1.252 C[C@H](O)COCc1ccccc1 Amb22044890 [0,2,0,0,0,0|2,0,0]=4 8137 B12R1.252 C[SiH](C)CCCc1ccccc1 Amb22366558 [0,2,0,0,0,0|2,0,0]=4 8138 B12R1.252 ClC(=O)CCSc1ccccc1 Amb10064363 [0,2,0,0,0,0|2,0,0]=4 8139 B12R1.252 Cl[SiH](Cl)CCCc1ccccc1 Amb22232507 [0,2,0,0,0,0|2,0,0]=4 8140 B12R1.252 FC(CNCc1ccccc1)F Amb16229911 [0,2,0,0,0,0|2,0,0]=4 8141 B12R1.252 FC(F)CSCc1ccccc1 Amb22008716 [0,2,0,0,0,0|2,0,0]=4 8142 B12R1.252 NC(=N)CCCc1cc[n]cc1 Amb24083112 [0,2,0,0,0,0|2,0,0]=4 8143 B12R1.252 NC(=N)CCCc1ccc[n]c1 Amb24062322 [0,2,0,0,0,0|2,0,0]=4 8144 B12R1.252 NC(=N)CCCc1cccc[n]1 Amb21618753 [0,2,0,0,0,0|2,0,0]=4 8145 B12R1.252 NC(=N)CNCc1ccccc1 Amb25031584 [0,2,0,0,0,0|1,0,0]=3 8146 B12R1.252 NC(=N)NCCc1cc[n]cc1 Amb18798340 [0,2,0,0,0,0|1,0,0]=3 8147 B12R1.252 NC(=N)NCCc1ccc[n]c1 Amb18798339 [0,2,0,0,0,0|1,0,0]=3 8148 B12R1.252 NC(=N)NCCc1cccc[n]1 Amb18798342 [0,2,0,0,0,0|1,0,0]=3 8149 B12R1.252 NC(=N)NCCc1ccccc1 Amb22736089 [0,2,0,0,0,0|0,0,0]=2 8150 B12R1.252 NC(=N)NCCc1ccccc1 Amb22736599 [0,2,0,0,0,0|0,0,0]=2 8151 B12R1.252 NC(=N)NNCc1ccccc1 Amb10553070 [0,2,0,0,0,0|1,0,0]=3 8152 B12R1.252 NC(=N)NNCc1ccccc1 Amb18563641 [0,2,0,0,0,0|1,0,0]=3 8153 B12R1.252 NC(=N)NOCc1ccccc1 Amb24651150 [0,2,0,0,0,0|1,0,0]=3 8154 B12R1.252 NC(=N)N\C=N\c1ccccc1 Amb24550657 [0,2,0,0,0,0|1,0,1]=4 8155 B12R1.252 NC(=N)N\N=C\c1ccccc1 Amb10553029 [0,2,0,0,0,0|1,0,1]=4 8156 B12R1.252 NC(=N)N\N=C\c1ccccc1 Amb1147507 [0,2,0,0,0,0|1,0,1]=4 8157 B12R1.252 NC(=N)SCC[n+]1ccccc1 Amb2228345 [0,2,0,0,0,0|2,0,0]=4 8158 B12R1.252 NC(=N)SCCc1ccccc1 Amb20675983 [0,2,0,0,0,0|1,0,0]=3 8159 B12R1.252 NC(=O)CCNc1ccc[n]c1 Amb25241565 [0,2,0,0,0,0|2,0,0]=4 8160 B12R1.252 NC(=O)CNCc1cccnc1 Amb10609111 [0,2,0,0,0,0|2,0,0]=4 8161 B12R1.252 NC(=O)CNCc1cccnc1 Amb1113716 [0,2,0,0,0,0|2,0,0]=4 8162 B12R1.252 NC(=O)CNCc1ccncc1 Amb1116176 [0,2,0,0,0,0|2,0,0]=4 8163 B12R1.252 NC(=O)C\C=C\c1ccccc1 Amb24470049 [0,2,0,0,0,0|1,0,1]=4 8164 B12R1.252 NC(=O)C\N=C\c1ccccc1 Amb24485689 [0,2,0,0,0,0|1,0,1]=4 8165 B12R1.252 NC(=O)NCCc1ccc[n]c1 Amb19515015 [0,2,0,0,0,0|1,0,0]=3 8166 B12R1.252 NC(=O)NCCc1ccccc1 Amb1124980 [0,2,0,0,0,0|0,0,0]=2 8167 B12R1.252 NC(=O)NCCc1ccncc1 Amb10553043 [0,2,0,0,0,0|1,0,0]=3 8168 B12R1.252 NC(=O)NN=Cc1ccccc1 Amb2389840 [0,2,0,0,0,0|1,0,1]=4 8169 B12R1.252 NC(=O)NNCc1ccccc1 Amb24063820 [0,2,0,0,0,0|1,0,0]=3 8170 B12R1.252 NC(=O)NOCc1cccc[n]1 Amb24343576 [0,2,0,0,0,0|2,0,0]=4 8171 B12R1.252 NC(=O)NOCc1ccccc1 Amb1199324 [0,2,0,0,0,0|1,0,0]=3 8172 B12R1.252 NC(=O)N\C=C\c1ccccc1 Amb25362141 [0,2,0,0,0,0|0,0,2]=4 8173 B12R1.252 NC(=O)N\N=N\c1ccccc1 Amb24417714 [0,2,0,0,0,0|2,0,0]=4 8174 B12R1.252 NC(=O)\C=C\Cc1ccccc1 Amb25148586 [0,2,0,0,0,0|1,0,1]=4 8175 B12R1.252 NC(=S)CCNc1ccccc1 Amb17233757 [0,2,0,0,0,0|1,0,0]=3 8176 B12R1.252 NC(=S)CCSc1ccccc1 Amb17307558 [0,2,0,0,0,0|1,0,0]=3 8177 B12R1.252 NC(=S)CNCc1ccccc1 Amb17233758 [0,2,0,0,0,0|1,0,0]=3 8178 B12R1.252 NC(=S)C\C=C\c1ccccc1 Amb25112081 [0,2,0,0,0,0|1,0,1]=4 8179 B12R1.252 NC(=S)NCCc1cc[n]cc1 Amb18796483 [0,2,0,0,0,0|1,0,0]=3 8180 B12R1.252 NC(=S)NCCc1ccc[n]c1 Amb18181422 [0,2,0,0,0,0|1,0,0]=3 8181 B12R1.252 NC(=S)NCCc1ccccc1 Amb1647056 [0,2,0,0,0,0|0,0,0]=2 8182 B12R1.252 NC(=S)NCSc1ccccc1 Amb25725067 [0,2,0,0,0,0|1,0,0]=3 8183 B12R1.252 NC(=S)NNCc1ccccc1 Amb2439185 [0,2,0,0,0,0|1,0,0]=3 8184 B12R1.252 NC(=[NH2+])SCCc1cc[nH+]cc1 Amb10556447 [0,2,0,0,0,0|2,0,0]=4 8185 B12R1.252 N[13C](=O)N\N=C\c1ccccc1 Amb17608784 [0,2,0,0,0,0|1,0,1]=4 8186 B12R1.252 O=C(Cl)CNCc1ccccc1 Amb25040534 [0,2,0,0,0,0|2,0,0]=4 8187 B12R1.252 O=C(Cl)NCCc1ccccc1 Amb24619690 [0,2,0,0,0,0|1,0,0]=3 8188 B12R1.252 OB(O)CCCc1ccccc1 Amb21928056 [0,2,0,0,0,0|2,0,0]=4 8189 B12R1.252 OC(=O)CCC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22056045 [0,2,0,0,0,0|2,0,0]=4 8190 B12R1.252 OC(=O)CCCc1ccccc1 Amb2388283 [0,2,0,0,0,0|2,0,0]=4 8191 B12R1.252 OC(=O)CCNc1ccccc1 Amb1207377 [0,2,0,0,0,0|2,0,0]=4 8192 B12R1.252 OC(=O)CCOc1ccccc1 Amb1206804 [0,2,0,0,0,0|2,0,0]=4 8193 B12R1.252 OC(=O)CCSc1ccccc1 Amb1036581 [0,2,0,0,0,0|2,0,0]=4 8194 B12R1.252 OC(=O)C[NH2+]Cc1ccccc1 Amb24113880 [0,2,0,0,0,0|2,0,0]=4 8195 B12R1.252 [O-]C(=O)CCCc1ccccc1 Amb15690987 [0,2,0,0,0,0|2,0,0]=4 8196 B12R1.252 [O-]C(=O)CC[NH2+]c1ccccc1 Amb22499683 [0,2,0,0,0,0|2,0,0]=4 8197 B12R1.252 [S-]C(=S)NCC[n+]1ccccc1 Amb24470157 [0,2,0,0,0,0|2,0,0]=4 8198 B12R1.43 BrC(C(=O)C)Cc1ccccc1 Amb17507835 [0,2,0,0,0,0|2,0,0]=4 8199 B12R1.43 Br[C@@H](C(=O)O)Cc1ccccc1 Amb17610062 [0,2,0,0,0,0|2,0,0]=4 8200 B12R1.43 Br[C@H](C(=O)O)Cc1ccccc1 Amb17610063 [0,2,0,0,0,0|2,0,0]=4 8201 B12R1.43 C=C(Cc1ccccc1)C(N)=O Amb24634331 [0,2,0,0,0,0|1,0,1]=4 8202 B12R1.43 C=C(Cc1ccccc1)C(N)=S Amb24359154 [0,2,0,0,0,0|1,0,1]=4 8203 B12R1.43 CC(=C)C(Cl)Cc1ccccc1 Amb24635687 [0,2,0,0,0,0|2,0,0]=4 8204 B12R1.43 CC(=C)[C@@H](O)Cc1ccccc1 Amb25077949 [0,2,0,0,0,0|2,0,0]=4 8205 B12R1.43 CC(=O)C(O)Cc1ccccc1 Amb25340966 [0,2,0,0,0,0|2,0,0]=4 8206 B12R1.43 CC(=O)[C@@H](C)Cc1ccccc1 Amb24356281 [0,2,0,0,0,0|2,0,0]=4 8207 B12R1.43 CC(=O)[C@@H](Cl)Cc1ccccc1 Amb24595784 [0,2,0,0,0,0|2,0,0]=4 8208 B12R1.43 CC(=O)[C@@H](O)Cc1ccccc1 Amb24722888 [0,2,0,0,0,0|2,0,0]=4 8209 B12R1.43 CC(=O)[C@H](C)Cc1ccccc1 Amb25233687 [0,2,0,0,0,0|2,0,0]=4 8210 B12R1.43 CC(C(=O)C)Cc1ccccc1 Amb17232407 [0,2,0,0,0,0|2,0,0]=4 8211 B12R1.43 CC(C(=O)N)Sc1ccccc1 Amb10665761 [0,2,0,0,0,0|2,0,0]=4 8212 B12R1.43 CC(C(=S)N)Oc1ccccc1 Amb17233851 [0,2,0,0,0,0|2,0,0]=4 8213 B12R1.43 CC(C(N)C)Cc1ccccc1 Amb17232438 [0,2,0,0,0,0|1,0,0]=3 8214 B12R1.43 CC(C(O)C)Cc1ccccc1 Amb17232485 [0,2,0,0,0,0|2,0,0]=4 8215 B12R1.43 CC(C)C(Br)Cc1ccccc1 Amb25690703 [0,2,0,0,0,0|2,0,0]=4 8216 B12R1.43 CC(C)C(Cl)Cc1ccccc1 Amb19045146 [0,2,0,0,0,0|2,0,0]=4 8217 B12R1.43 CC(Cc1cc[n]cc1)C(C)N Amb18828714 [0,2,0,0,0,0|2,0,0]=4 8218 B12R1.43 CC(Cc1cccc[n]1)C(C)N Amb25277034 [0,2,0,0,0,0|2,0,0]=4 8219 B12R1.43 CC(Cc1cccc[n]1)N(C)C Amb24554569 [0,2,0,0,0,0|2,0,0]=4 8220 B12R1.43 CC(Cc1ccccc1)C(C)Br Amb24751375 [0,2,0,0,0,0|2,0,0]=4 8221 B12R1.43 CC(Cc1ccccc1)C(C)Cl Amb19074260 [0,2,0,0,0,0|2,0,0]=4 8222 B12R1.43 CC(Cc1ccccc1)[N+]([O-])=O Amb17689219 [0,2,0,0,0,0|1,0,1]=4 8223 B12R1.43 CC(N(C)C)Cc1ccccc1 Amb1086747 [0,2,0,0,0,0|1,0,0]=3 8224 B12R1.43 CC(N(C)C)Cc1ccccc1 Amb2099764 [0,2,0,0,0,0|1,0,0]=3 8225 B12R1.43 CC(N)C(=O)Cc1ccccc1 Amb18829240 [0,2,0,0,0,0|1,0,1]=4 8226 B12R1.43 CC(N)C(F)Cc1ccccc1 Amb25850180 [0,2,0,0,0,0|1,0,0]=3 8227 B12R1.43 CC(N)C(F)Sc1ccccc1 Amb24385932 [0,2,0,0,0,0|2,0,0]=4 8228 B12R1.43 CC(N)C(O)Cc1cc[n]cc1 Amb18827650 [0,2,0,0,0,0|2,0,0]=4 8229 B12R1.43 CC(N)C(O)Cc1ccc[n]c1 Amb18827666 [0,2,0,0,0,0|2,0,0]=4 8230 B12R1.43 CC(N)C(O)Cc1ccccc1 Amb18828237 [0,2,0,0,0,0|1,0,0]=3 8231 B12R1.43 CC(N)[C@H](O)Cc1ccccc1 Amb24389484 [0,2,0,0,0,0|1,0,0]=3 8232 B12R1.43 CC(Nc1ccccc1)C(C)N Amb18646160 [0,2,0,0,0,0|2,0,0]=4 8233 B12R1.43 CC(O)C(Cl)Cc1ccccc1 Amb25082706 [0,2,0,0,0,0|2,0,0]=4 8234 B12R1.43 CC(O)C(N)Cc1ccccc1 Amb18646379 [0,2,0,0,0,0|2,0,0]=4 8235 B12R1.43 CC(O)C(O)Cc1ccccc1 Amb25159724 [0,2,0,0,0,0|2,0,0]=4 8236 B12R1.43 CC(O)[C@@H](N)Cc1ccccc1 Amb24682603 [0,2,0,0,0,0|2,0,0]=4 8237 B12R1.43 CC(O)[C@@H](O)Cc1ccccc1 Amb24354395 [0,2,0,0,0,0|2,0,0]=4 8238 B12R1.43 CC(O)[C@H](N)Cc1ccccc1 Amb25730054 [0,2,0,0,0,0|2,0,0]=4 8239 B12R1.43 CC(Oc1ccccc1)C(C)N Amb18291409 [0,2,0,0,0,0|2,0,0]=4 8240 B12R1.43 CC(Oc1ccccc1)C(N)=N Amb18798297 [0,2,0,0,0,0|2,0,0]=4 8241 B12R1.43 CC(Oc1ccccc1)[C@H](C)N Amb25089792 [0,2,0,0,0,0|2,0,0]=4 8242 B12R1.43 CC(Sc1ccccc1)C(C)N Amb18648553 [0,2,0,0,0,0|2,0,0]=4 8243 B12R1.43 CC(Sc1ccccc1)C(N)=N Amb18805146 [0,2,0,0,0,0|2,0,0]=4 8244 B12R1.43 CN(C(=O)Cc1ccccc1)C Amb1803686 [0,2,0,0,0,0|1,0,1]=4 8245 B12R1.43 CN(C(=S)Cc1ccccc1)C Amb1078624 [0,2,0,0,0,0|1,0,1]=4 8246 B12R1.43 CN(C(=S)Nc1ccccc1)N Amb1149646 [0,2,0,0,0,0|1,0,1]=4 8247 B12R1.43 CN(C)C(=N)Cc1ccccc1 Amb23447116 [0,2,0,0,0,0|1,0,1]=4 8248 B12R1.43 CN(Cc1ccccc1)C(N)=N Amb22586446 [0,2,0,0,0,0|2,0,0]=4 8249 B12R1.43 C[C@@H](C(=O)O)Cc1ccccc1 Amb10844541 [0,2,0,0,0,0|2,0,0]=4 8250 B12R1.43 C[C@@H](Cc1ccccc1)C(C)O Amb25769503 [0,2,0,0,0,0|2,0,0]=4 8251 B12R1.43 C[C@@H](Cc1ccccc1)C(N)=O Amb24651128 [0,2,0,0,0,0|1,0,0]=3 8252 B12R1.43 C[C@@H](Cc1ccccc1)N(C)C Amb22747859 [0,2,0,0,0,0|1,0,0]=3 8253 B12R1.43 C[C@@H](Cc1ccccc1)[C@@H](C)O Amb25795494 [0,2,0,0,0,0|2,0,0]=4 8254 B12R1.43 C[C@@H](Cc1ccccc1)[C@H](C)Cl Amb25275062 [0,2,0,0,0,0|2,0,0]=4 8255 B12R1.43 C[C@@H](N)[C@@H](N)Cc1ccccc1 Amb24407278 [0,2,0,0,0,0|1,0,0]=3 8256 B12R1.43 C[C@@H](N)[C@@H](O)Cc1ccccc1 Amb25202137 [0,2,0,0,0,0|1,0,0]=3 8257 B12R1.43 C[C@@H](N)[C@H](O)Cc1ccccc1 Amb25258010 [0,2,0,0,0,0|1,0,0]=3 8258 B12R1.43 C[C@@H](Nc1ccccc1)[C@H](C)N Amb25237533 [0,2,0,0,0,0|2,0,0]=4 8259 B12R1.43 C[C@@H](O)[C@@H](O)Cc1ccccc1 Amb25847064 [0,2,0,0,0,0|2,0,0]=4 8260 B12R1.43 C[C@@H](O)[C@H](Cl)Cc1ccccc1 Amb25823111 [0,2,0,0,0,0|2,0,0]=4 8261 B12R1.43 C[C@@H](O)[C@H](N)Cc1ccccc1 Amb24664138 [0,2,0,0,0,0|2,0,0]=4 8262 B12R1.43 C[C@@H](Oc1ccccc1)[C@H](C)N Amb24407272 [0,2,0,0,0,0|2,0,0]=4 8263 B12R1.43 C[C@@H](Sc1ccccc1)[C@@H](C)N Amb25074048 [0,2,0,0,0,0|2,0,0]=4 8264 B12R1.43 C[C@H](C(=O)O)Cc1ccccc1 Amb10844540 [0,2,0,0,0,0|2,0,0]=4 8265 B12R1.43 C[C@H](Cc1ccccc1)[C@@H](C)O Amb25157972 [0,2,0,0,0,0|2,0,0]=4 8266 B12R1.43 C[C@H](Cc1ccccc1)[C@H](C)O Amb25769397 [0,2,0,0,0,0|2,0,0]=4 8267 B12R1.43 C[C@H](N)[C@@H](N)Cc1ccccc1 Amb25152488 [0,2,0,0,0,0|1,0,0]=3 8268 B12R1.43 C[C@H](O)[C@@H](N)Cc1ccccc1 Amb25690953 [0,2,0,0,0,0|2,0,0]=4 8269 B12R1.43 C[C@H](O)[C@@H](O)Cc1ccccc1 Amb24496614 [0,2,0,0,0,0|2,0,0]=4 8270 B12R1.43 C[C@H](O)[C@H](N)Cc1ccccc1 Amb25375788 [0,2,0,0,0,0|2,0,0]=4 8271 B12R1.43 ClC(C(=O)C)Cc1ccccc1 Amb17204329 [0,2,0,0,0,0|2,0,0]=4 8272 B12R1.43 ClC(C(=O)Cl)Cc1ccccc1 Amb17204400 [0,2,0,0,0,0|2,0,0]=4 8273 B12R1.43 ClC(C(=O)N)Cc1ccccc1 Amb17204334 [0,2,0,0,0,0|1,0,0]=3 8274 B12R1.43 ClC(C(=O)O)Cc1ccccc1 Amb17204339 [0,2,0,0,0,0|2,0,0]=4 8275 B12R1.43 FB(F)C(Cl)Cc1ccccc1 Amb25246443 [0,2,0,0,0,0|2,0,0]=4 8276 B12R1.43 FB(F)[C@H](Cl)Cc1ccccc1 Amb25138719 [0,2,0,0,0,0|2,0,0]=4 8277 B12R1.43 NC(=N)N(N)Cc1ccccc1 Amb25760721 [0,2,0,0,0,0|2,0,0]=4 8278 B12R1.43 NC(=N)N(O)Cc1ccccc1 Amb25291446 [0,2,0,0,0,0|2,0,0]=4 8279 B12R1.43 NC(=O)C(Br)Cc1ccc[n]c1 Amb25741625 [0,2,0,0,0,0|2,0,0]=4 8280 B12R1.43 NC(=O)C(Br)Cc1ccccc1 Amb23533327 [0,2,0,0,0,0|1,0,0]=3 8281 B12R1.43 NC(=O)C(F)Cc1ccccc1 Amb24343162 [0,2,0,0,0,0|1,0,0]=3 8282 B12R1.43 NC(=O)C(N)Cc1ccccc1 Amb20240621 [0,2,0,0,0,0|1,0,0]=3 8283 B12R1.43 NC(=O)C(N)Oc1ccccc1 Amb25696007 [0,2,0,0,0,0|2,0,0]=4 8284 B12R1.43 NC(=O)C(O)Cc1ccccc1 Amb18800896 [0,2,0,0,0,0|1,0,0]=3 8285 B12R1.43 NC(=O)[C@@H](Cl)Cc1ccccc1 Amb25034612 [0,2,0,0,0,0|1,0,0]=3 8286 B12R1.43 NC(=O)[C@H](O)Cc1ccccc1 Amb25359872 [0,2,0,0,0,0|1,0,0]=3 8287 B12R1.43 NC(=S)C(N)Cc1ccccc1 Amb25765717 [0,2,0,0,0,0|1,0,0]=3 8288 B12R1.43 NC(=S)N(Cl)Cc1ccccc1 Amb24681100 [0,2,0,0,0,0|2,0,0]=4 8289 B12R1.43 NC(=S)[C@H](O)Cc1ccccc1 Amb24419006 [0,2,0,0,0,0|1,0,0]=3 8290 B12R1.43 NC(C(=O)C)Cc1ccccc1 Amb1099237 [0,2,0,0,0,0|2,0,0]=4 8291 B12R1.43 NC(C(C)C)Cc1ccccc1 Amb17138565 [0,2,0,0,0,0|2,0,0]=4 8292 B12R1.43 NC(C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22367486 [0,2,0,0,0,0|2,0,0]=4 8293 B12R1.43 NC(Cc1ccccc1)C(=O)Cl Amb24620480 [0,2,0,0,0,0|2,0,0]=4 8294 B12R1.43 NC(Cc1ccccc1)C(=O)S Amb25760658 [0,2,0,0,0,0|2,0,0]=4 8295 B12R1.43 NC(Cc1ccccc1)C(O)=O Amb19958284 [0,2,0,0,0,0|2,0,0]=4 8296 B12R1.43 NC(Cc1ccccc1)P(O)O Amb25227409 [0,2,0,0,0,0|1,1,0]=4 8297 B12R1.43 NC(Cc1ccccc1)[13C](O)=O Amb22363196 [0,2,0,0,0,0|2,0,0]=4 8298 B12R1.43 NC([13CH2]c1ccccc1)C(O)=O Amb22363309 [0,2,0,0,0,0|2,0,0]=4 8299 B12R1.43 N[13C@@H](Cc1ccccc1)C(O)=O Amb22351319 [0,2,0,0,0,0|2,0,0]=4 8300 B12R1.43 N[13CH](Cc1ccccc1)C(O)=O Amb22367538 [0,2,0,0,0,0|2,0,0]=4 8301 B12R1.43 N[14CH]([14CH2]c1ccccc1)[14C](O)=O Amb22352760 [0,2,0,0,0,0|2,0,0]=4 8302 B12R1.43 N[C@@H](C(=O)N)Cc1ccccc1 Amb16183950 [0,2,0,0,0,0|1,0,0]=3 8303 B12R1.43 N[C@@H](C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22353689 [0,2,0,0,0,0|2,0,0]=4 8304 B12R1.43 N[C@@H](Cc1ccccc1)B(O)O Amb25366514 [0,2,0,0,0,0|2,0,0]=4 8305 B12R1.43 N[C@@H](Cc1ccccc1)C(O)=O Amb22351110 [0,2,0,0,0,0|2,0,0]=4 8306 B12R1.43 N[C@@H](Cc1ccccc1)P(O)O Amb25828976 [0,2,0,0,0,0|1,1,0]=4 8307 B12R1.43 N[C@H](Cc1ccccc1)C(=O)Cl Amb25092703 [0,2,0,0,0,0|2,0,0]=4 8308 B12R1.43 N[C@H](Cc1ccccc1)P(O)=O Amb24355910 [0,2,0,0,0,0|1,1,0]=4 8309 B12R1.43 O=C(Cl)C(Br)Cc1ccccc1 Amb21961005 [0,2,0,0,0,0|2,0,0]=4 8310 B12R1.43 OB(O)C(Cl)Cc1ccccc1 Amb24419999 [0,2,0,0,0,0|2,0,0]=4 8311 B12R1.43 OB(O)[C@H](Cl)Cc1ccccc1 Amb25779933 [0,2,0,0,0,0|2,0,0]=4 8312 B12R1.43 OC(=O)C(Cc1ccccc1)Br Amb16210937 [0,2,0,0,0,0|2,0,0]=4 8313 B12R1.43 OC(=O)C(S)Cc1ccccc1 Amb18289035 [0,2,0,0,0,0|2,0,0]=4 8314 B12R1.43 OC(=O)[C@@H](Cl)Cc1ccccc1 Amb24707843 [0,2,0,0,0,0|2,0,0]=4 8315 B12R1.43 OC(=O)[C@@H](S)Cc1ccccc1 Amb25124079 [0,2,0,0,0,0|2,0,0]=4 8316 B12R1.43 OC(=O)[C@H](Cl)Cc1ccccc1 Amb22225171 [0,2,0,0,0,0|2,0,0]=4 8317 B12R1.43 OC(=O)[C@H](F)Cc1ccccc1 Amb25061394 [0,2,0,0,0,0|2,0,0]=4 8318 B12R1.43 OC(=S)C(I)Cc1ccccc1 Amb24061263 [0,2,0,0,0,0|2,0,0]=4 8319 B12R1.43 OC(C(C)C)Cc1ccccc1 Amb17138584 [0,2,0,0,0,0|2,0,0]=4 8320 B12R1.43 OC(Cc1ccccc1)C(F)Cl Amb25288246 [0,2,0,0,0,0|2,0,0]=4 8321 B12R1.43 OC(Cc1ccccc1)C(F)F Amb24665165 [0,2,0,0,0,0|2,0,0]=4 8322 B12R1.43 O[C@@H](Cc1ccccc1)C(F)F Amb24371353 [0,2,0,0,0,0|2,0,0]=4 8323 B12R1.43 O[C@@H](Cc1ccccc1)[C@H](F)Cl Amb24373884 [0,2,0,0,0,0|2,0,0]=4 8324 B12R1.43 O[C@H](Cc1ccccc1)C(F)F Amb25129748 [0,2,0,0,0,0|2,0,0]=4 8325 B12R1.43 [15NH2]C(Cc1ccccc1)C(O)=O Amb22338047 [0,2,0,0,0,0|2,0,0]=4 8326 B12R1.118 C#CC(CO)Cc1ccccc1 Amb25105982 [0,2,0,0,0,0|2,0,0]=4 8327 B12R1.118 C#CC(Cc1cc[n]cc1)NN Amb25728296 [0,2,0,0,0,0|1,0,0]=3 8328 B12R1.118 CCC(CN)Oc1ccccc1 Amb18311092 [0,2,0,0,0,0|2,0,0]=4 8329 B12R1.118 CCC(Cc1ccccc1)CN Amb10778756 [0,2,0,0,0,0|1,0,0]=3 8330 B12R1.118 CCC(Cc1ccccc1)NC Amb18792514 [0,2,0,0,0,0|1,0,0]=3 8331 B12R1.118 CC\C(\Cc1ccccc1)=N\N Amb25057429 [0,2,0,0,0,0|0,0,2]=4 8332 B12R1.118 CNC(Cc1c[n]ccc1)C#C Amb25692745 [0,2,0,0,0,0|2,0,0]=4 8333 B12R1.118 CNC(Cc1cc[n]cc1)C#C Amb25698692 [0,2,0,0,0,0|2,0,0]=4 8334 B12R1.118 CNC(Cc1ccccc1)C#C Amb25797878 [0,2,0,0,0,0|1,0,0]=3 8335 B12R1.118 CN[C@@H](CO)Cc1ccccc1 Amb22745072 [0,2,0,0,0,0|1,0,0]=3 8336 B12R1.118 CN\C(\Cc1ccccc1)=N/N Amb18788196 [0,2,0,0,0,0|0,0,2]=4 8337 B12R1.118 CN\C(\Cc1ccccc1)=N\O Amb25376955 [0,2,0,0,0,0|1,0,1]=4 8338 B12R1.118 COC(CN)Cc1ccccc1 Amb21954040 [0,2,0,0,0,0|1,0,0]=3 8339 B12R1.118 COC(CN)Oc1ccccc1 Amb24061283 [0,2,0,0,0,0|2,0,0]=4 8340 B12R1.118 COC(Cc1ccccc1)C#N Amb25681947 [0,2,0,0,0,0|1,0,1]=4 8341 B12R1.118 CSC(Cc1ccccc1)C#N Amb17594511 [0,2,0,0,0,0|1,0,1]=4 8342 B12R1.118 N#CC(CBr)Cc1ccccc1 Amb25821723 [0,2,0,0,0,0|1,0,1]=4 8343 B12R1.118 N#CC(CCl)Cc1ccccc1 Amb24753458 [0,2,0,0,0,0|1,0,1]=4 8344 B12R1.118 N#CC(CO)Cc1ccccc1 Amb18110109 [0,2,0,0,0,0|1,0,1]=4 8345 B12R1.118 N#CC(Cc1ccccc1)C#N Amb10574574 [0,2,0,0,0,0|1,0,1]=4 8346 B12R1.118 N#CC(Cc1ccccc1)C=O Amb22371309 [0,2,0,0,0,0|1,0,1]=4 8347 B12R1.118 NCC(CO)Cc1ccccc1 Amb22899484 [0,2,0,0,0,0|1,0,0]=3 8348 B12R1.118 NCC(CO)Nc1ccccc1 Amb25776544 [0,2,0,0,0,0|2,0,0]=4 8349 B12R1.118 NCC(Cc1ccccc1)C#N Amb18908588 [0,2,0,0,0,0|1,0,0]=3 8350 B12R1.118 N\C=C(\Cc1ccccc1)/C#N Amb24743507 [0,2,0,0,0,0|1,0,1]=4 8351 B12R1.194 C#CC(Cc1ccccc1)(O)C Amb1083082 [0,2,0,0,0,0|2,0,0]=4 8352 B12R1.194 CC(C)(CN)Cc1c[n]ccc1 Amb24379600 [0,2,0,0,0,0|2,0,0]=4 8353 B12R1.194 CC(C)(CN)Cc1cccc[n]1 Amb24349483 [0,2,0,0,0,0|2,0,0]=4 8354 B12R1.194 CC(C)(CN)Cc1ccccc1 Amb19310600 [0,2,0,0,0,0|1,0,0]=3 8355 B12R1.194 CC(C)(CN)Oc1ccccc1 Amb19515084 [0,2,0,0,0,0|2,0,0]=4 8356 B12R1.194 CC(C)(CN)Sc1ccccc1 Amb18909240 [0,2,0,0,0,0|2,0,0]=4 8357 B12R1.194 CC(C)(Cc1ccccc1)N=O Amb22055953 [0,2,0,0,0,0|1,0,1]=4 8358 B12R1.194 CC(C)(Cc1ccccc1)NC Amb22349936 [0,2,0,0,0,0|1,0,0]=3 8359 B12R1.194 CC(C)(Cc1ccccc1)NN Amb18646155 [0,2,0,0,0,0|0,0,0]=2 8360 B12R1.194 CC(C)(Cc1ccccc1)NO Amb24411489 [0,2,0,0,0,0|1,0,0]=3 8361 B12R1.194 CC(Cl)(CO)Cc1ccccc1 Amb25115909 [0,2,0,0,0,0|2,0,0]=4 8362 B12R1.194 CC(Cl)(Cc1ccccc1)C#N Amb18791085 [0,2,0,0,0,0|1,0,1]=4 8363 B12R1.194 CC(F)(CN)Cc1c[n]ccc1 Amb25825977 [0,2,0,0,0,0|2,0,0]=4 8364 B12R1.194 CC(N)(CO)Cc1ccccc1 Amb19001800 [0,2,0,0,0,0|2,0,0]=4 8365 B12R1.194 CC(N)(Cc1ccccc1)CN Amb19001789 [0,2,0,0,0,0|1,0,0]=3 8366 B12R1.194 CC(O)(Cc1ccccc1)C#N Amb18177733 [0,2,0,0,0,0|1,0,1]=4 8367 B12R1.194 CC(O)(Cc1ccccc1)NN Amb25361538 [0,2,0,0,0,0|0,0,0]=2 8368 B12R1.194 CCC(C)(Cl)Cc1ccccc1 Amb25080041 [0,2,0,0,0,0|2,0,0]=4 8369 B12R1.194 CNC(C)(C)Cc1c[n]ccc1 Amb24544019 [0,2,0,0,0,0|2,0,0]=4 8370 B12R1.194 CNS(=O)(=O)Cc1ccccc1 Amb1125735 [0,2,0,0,0,0|2,0,0]=4 8371 B12R1.194 COC(Cc1ccccc1)(C)C Amb10555866 [0,2,0,0,0,0|2,0,0]=4 8372 B12R1.194 C[C@@](O)(Cc1ccccc1)C=O Amb24539297 [0,2,0,0,0,0|2,0,0]=4 8373 B12R1.194 C[C@@](O)(Cc1ccccc1)CO Amb25817130 [0,2,0,0,0,0|2,0,0]=4 8374 B12R1.194 C[C@](O)(Cc1ccccc1)CO Amb24474165 [0,2,0,0,0,0|2,0,0]=4 8375 B12R1.194 C[Si](C)(CN)Cc1ccccc1 Amb25151035 [0,2,0,0,0,0|1,1,0]=4 8376 B12R1.194 N#CC(Cc1ccccc1)(C)C Amb17333794 [0,2,0,0,0,0|1,0,1]=4 8377 B12R1.194 N#CC(Cc1ccccc1)(N)C Amb17232330 [0,2,0,0,0,0|1,0,1]=4 8378 B12R1.194 NCC(Cc1ccccc1)(C)C Amb17333839 [0,2,0,0,0,0|1,0,0]=3 8379 B12R1.194 NCC(Cc1ccccc1)(O)C Amb17082131 [0,2,0,0,0,0|1,0,0]=3 8380 B12R1.194 NCC(Cc1ccccn1)(O)C Amb17082128 [0,2,0,0,0,0|2,0,0]=4 8381 B12R1.194 NCC(Cc1cccnc1)(O)C Amb17082129 [0,2,0,0,0,0|2,0,0]=4 8382 B12R1.194 NCC(Cc1ccncc1)(O)C Amb17082130 [0,2,0,0,0,0|2,0,0]=4 8383 B12R1.194 NCC(F)(F)Cc1c[n]ccc1 Amb22304221 [0,2,0,0,0,0|2,0,0]=4 8384 B12R1.194 NCC(F)(F)Cc1cccc[n]1 Amb25789459 [0,2,0,0,0,0|2,0,0]=4 8385 B12R1.194 NCC(F)(F)Cc1ccccc1 Amb25103781 [0,2,0,0,0,0|1,0,0]=3 8386 B12R1.194 NCC(Oc1ccccc1)(C)C Amb17074797 [0,2,0,0,0,0|2,0,0]=4 8387 B12R1.194 O=CC(F)(F)Cc1ccccc1 Amb24424443 [0,2,0,0,0,0|2,0,0]=4 8388 B12R1.194 OCC(F)(Cl)Cc1ccccc1 Amb25182929 [0,2,0,0,0,0|2,0,0]=4 8389 B12R1.194 OCC(F)(F)Cc1ccccc1 Amb25847026 [0,2,0,0,0,0|2,0,0]=4 8390 B12R1.194 ONC(Cc1ccccc1)(C)C Amb17615684 [0,2,0,0,0,0|1,0,0]=3 8391 B12R1.891 CC(C)(C)CCc1ccccc1 Amb24470690 [0,2,0,0,0,0|2,0,0]=4 8392 B12R1.891 CC(C)(N)CCc1c[n]ccc1 Amb18563644 [0,2,0,0,0,0|2,0,0]=4 8393 B12R1.891 CC(C)(N)CCc1cc[n]cc1 Amb18563646 [0,2,0,0,0,0|2,0,0]=4 8394 B12R1.891 CC(C)(N)CCc1cccc[n]1 Amb18563642 [0,2,0,0,0,0|2,0,0]=4 8395 B12R1.891 CC(C)(N)CCc1ccccc1 Amb19373033 [0,2,0,0,0,0|1,0,0]=3 8396 B12R1.891 CC(C)(N)CNc1ccccc1 Amb18974263 [0,2,0,0,0,0|2,0,0]=4 8397 B12R1.891 CC(C)(O)CCc1ccccc1 Amb18540684 [0,2,0,0,0,0|2,0,0]=4 8398 B12R1.891 CC(CCc1ccccc1)(N)C Amb17334588 [0,2,0,0,0,0|1,0,0]=3 8399 B12R1.891 CC(COc1ccccc1)(N)C Amb17074732 [0,2,0,0,0,0|2,0,0]=4 8400 B12R1.891 CC(CSc1ccccc1)(N)C Amb17485972 [0,2,0,0,0,0|2,0,0]=4 8401 B12R1.891 CS(=O)(=O)CCc1ccccc1 Amb24454272 [0,2,0,0,0,0|2,0,0]=4 8402 B12R1.891 C[N+](C)(C)CCc1ccccc1 Amb22433133 [0,2,0,0,0,0|1,0,1]=4 8403 B12R1.891 C[N+](C)(C)CCc1ccccc1 Amb22433887 [0,2,0,0,0,0|1,0,1]=4 8404 B12R1.891 C[N+](C)(C)CCc1ccccc1 Amb22483565 [0,2,0,0,0,0|1,0,1]=4 8405 B12R1.891 C[Si](C)(Cl)CCc1ccccc1 Amb19893995 [0,2,0,0,0,0|2,0,0]=4 8406 B12R1.891 ClC(Cl)(Cl)CCc1ccccc1 Amb24418534 [0,2,0,0,0,0|2,0,0]=4 8407 B12R1.891 ClS(=O)(=O)CCc1ccccc1 Amb1130049 [0,2,0,0,0,0|2,0,0]=4 8408 B12R1.891 Cl[Si](Cl)(Cl)CCc1ccccc1 Amb19893996 [0,2,0,0,0,0|2,0,0]=4 8409 B12R1.891 F[B-](CCc1ccccc1)(F)F Amb13890492 [0,2,0,0,0,0|2,0,0]=4 8410 B12R1.891 NP(N)(=S)NCc1ccccc1 Amb19929707 [0,2,0,0,0,0|1,1,0]=4 8411 B12R1.891 NS(=O)(=O)CCc1cc[n]cc1 Amb19069997 [0,2,0,0,0,0|2,0,0]=4 8412 B12R1.891 NS(=O)(=O)CCc1cccc[n]1 Amb19075745 [0,2,0,0,0,0|2,0,0]=4 8413 B12R1.891 O=S(=O)(Br)CCc1ccccc1 Amb23555507 [0,2,0,0,0,0|2,0,0]=4 8414 B12R1.891 O=S(=O)(F)CCc1ccccc1 Amb19375026 [0,2,0,0,0,0|2,0,0]=4 8415 B12R1.891 OS(=O)(=O)CCc1ccccc1 Amb19866568 [0,2,0,0,0,0|2,0,0]=4 8416 B12R1.891 [O-]S(=O)(=O)CCc1ccccc1 Amb22457030 [0,2,0,0,0,0|2,0,0]=4 8417 B10R1.78 C=C1CCCCC=CC=C1 Amb22342435 [0,0,1,1,0,0|2,0,0]=4 8418 B10R1.172 C=Cc1cc(ccc1)NN Amb18642969 [0,0,1,1,0,0|0,0,2]=4 8419 B10R2.6 C1CC1c2c[n]ccc2 Amb22235730 [1,0,0,1,0,0|2,0,0]=4 8420 B10R2.6 C1NC1c2c[n]ccc2 Amb18221862 [1,0,0,1,0,0|1,0,0]=3 8421 B10R2.6 C1NC1c2cc[n]cc2 Amb18221868 [1,0,0,1,0,0|1,0,0]=3 8422 B10R2.6 C1NC1c2cccc[n]2 Amb18860383 [1,0,0,1,0,0|1,0,0]=3 8423 B10R2.6 C1NC1c2ccccc2 Amb25082886 [1,0,0,1,0,0|0,0,0]=2 8424 B10R2.6 C1O[C@@H]1c2c[n]ccc2 Amb25758556 [1,0,0,1,0,0|2,0,0]=4 8425 B10R2.6 C1O[C@@H]1c2cc[n]cc2 Amb24103202 [1,0,0,1,0,0|2,0,0]=4 8426 B10R2.6 C1O[C@@H]1c2cccc[n]2 Amb24481607 [1,0,0,1,0,0|2,0,0]=4 8427 B10R2.6 C1O[C@H]1c2cc[n]cc2 Amb24103149 [1,0,0,1,0,0|2,0,0]=4 8428 B10R2.6 C1O[C@H]1c2cccc[n]2 Amb24101968 [1,0,0,1,0,0|2,0,0]=4 8429 B10R2.6 C1SC1c2ccccc2 Amb17666888 [1,0,0,1,0,0|1,0,0]=3 8430 B10R2.6 C=1NC1c2ccccc2 Amb25848069 [1,0,0,1,0,0|0,0,2]=4 8431 B10R2.6 O1CC1c2ccncc2 Amb17090250 [1,0,0,1,0,0|2,0,0]=4 8432 B10R2.6 c1ccc(cn1)C2CO2 Amb17090249 [1,0,0,1,0,0|2,0,0]=4 8433 B10R2.6 c1ccc(nc1)C2CO2 Amb17090248 [1,0,0,1,0,0|2,0,0]=4 8434 B10R2.7 C1CC[n+]2ccccc21 Amb25852290 [1,0,0,1,0,0|2,0,0]=4 8435 B10R2.7 C1CCc2cc[n]cc21 Amb22233572 [1,0,0,1,0,0|2,0,0]=4 8436 B10R2.7 C1CN2C=CC=CC2=N1 Amb24101571 [1,0,0,1,0,0|1,0,1]=4 8437 B10R2.7 C1CNc2[n][n]ccc21 Amb22235774 [1,0,0,1,0,0|2,0,0]=4 8438 B10R2.7 C1CNc2[n]c[n]cc21 Amb18832998 [1,0,0,1,0,0|2,0,0]=4 8439 B10R2.7 C1CNc2[n]cc[n]c21 Amb18832994 [1,0,0,1,0,0|2,0,0]=4 8440 B10R2.7 C1CNc2c[n]c[n]c21 Amb18832993 [1,0,0,1,0,0|2,0,0]=4 8441 B10R2.7 C1CNc2c[n]ccc21 Amb19516033 [1,0,0,1,0,0|1,0,0]=3 8442 B10R2.7 C1CNc2c[n]ccc21 Amb22495003 [1,0,0,1,0,0|1,0,0]=3 8443 B10R2.7 C1CNc2c[n]ccc21 Amb23412122 [1,0,0,1,0,0|1,0,0]=3 8444 B10R2.7 C1CNc2cc[n]cc21 Amb19515489 [1,0,0,1,0,0|1,0,0]=3 8445 B10R2.7 C1CNc2cc[n]cc21 Amb22372217 [1,0,0,1,0,0|1,0,0]=3 8446 B10R2.7 C1CNc2ccc[n]c21 Amb18833005 [1,0,0,1,0,0|1,0,0]=3 8447 B10R2.7 C1CNc2ccc[n]c21 Amb22494916 [1,0,0,1,0,0|1,0,0]=3 8448 B10R2.7 C1COc2[n]cccc21 Amb25337454 [1,0,0,1,0,0|2,0,0]=4 8449 B10R2.7 C1COc2c[n]ccc21 Amb22372207 [1,0,0,1,0,0|2,0,0]=4 8450 B10R2.7 C1COc2cc[n]cc21 Amb24101562 [1,0,0,1,0,0|2,0,0]=4 8451 B10R2.7 C1COc2ccc[n]c21 Amb23455396 [1,0,0,1,0,0|2,0,0]=4 8452 B10R2.7 C1CPc2ccccc21 Amb24477880 [1,0,0,1,0,0|0,1,0]=3 8453 B10R2.7 C1CSc2c[n]ccc21 Amb24101588 [1,0,0,1,0,0|2,0,0]=4 8454 B10R2.7 C1CSc2ccccc21 Amb24101549 [1,0,0,1,0,0|1,0,0]=3 8455 B10R2.7 C1C[n+]2ccccc2O1 Amb22364467 [1,0,0,1,0,0|2,0,0]=4 8456 B10R2.7 C1N=Cc2ccccc21 Amb20241766 [1,0,0,1,0,0|1,0,1]=4 8457 B10R2.7 C1N=c2ccccc2=N1 Amb24100741 [1,0,0,1,0,0|1,0,1]=4 8458 B10R2.7 C1NC=C2C=CCC=C21 Amb24684921 [1,0,0,1,0,0|1,0,1]=4 8459 B10R2.7 C1NCc2[n]cccc21 Amb20671408 [1,0,0,1,0,0|2,0,0]=4 8460 B10R2.7 C1NCc2[n]cccc21 Amb22489863 [1,0,0,1,0,0|2,0,0]=4 8461 B10R2.7 C1NCc2cc[n]cc21 Amb20242101 [1,0,0,1,0,0|2,0,0]=4 8462 B10R2.7 C1NCc2ccccc12 Amb17739945 [1,0,0,1,0,0|1,0,0]=3 8463 B10R2.7 C1Nc2ccccc2P1 Amb25102824 [1,0,0,1,0,0|1,0,0]=3 8464 B10R2.7 C1OSc2ccccc21 Amb25250664 [1,0,0,1,0,0|2,0,0]=4 8465 B10R2.7 C1Oc2ccccc2S1 Amb21963815 [1,0,0,1,0,0|2,0,0]=4 8466 B10R2.7 C1SCc2ccccc21 Amb21962922 [1,0,0,1,0,0|2,0,0]=4 8467 B10R2.7 c1[nH]c2ccccc2[p]1 Amb24340147 [1,0,0,1,0,0|1,0,1]=4 8468 B10R2.7 c1ccc2[n+](c1)CCN2 Amb10552798 [1,0,0,1,0,0|1,0,0]=3 8469 B10R2.7 c1ccc2[n+](c1)OCC2 Amb10560834 [1,0,0,1,0,0|2,0,0]=4 8470 B10R2.7 c1ccc2c(c1)C=CC2 Amb2383760 [1,0,0,1,0,0|1,0,1]=4 8471 B10R2.7 c1ccc2c(c1)NCC2 Amb1869493 [1,0,0,1,0,0|0,0,0]=2 8472 B10R2.7 c1ccc2c(c1)[nH+]n[nH]2 Amb10553250 [1,0,0,1,0,0|1,0,1]=4 8473 B10R2.7 c1ccc2c(c1)[nH+]n[nH]2 Amb10566511 [1,0,0,1,0,0|1,0,1]=4 8474 B10R2.7 c1ccc2c(c1)[nH+]n[nH]2 Amb10575340 [1,0,0,1,0,0|1,0,1]=4 8475 B10R2.7 c1ccc2c(c1)[nH]nc2 Amb1323321 [1,0,0,1,0,0|0,0,2]=4 8476 B10R2.7 c1ccc2c(c1)[nH]nn2 Amb10553984 [1,0,0,1,0,0|1,0,1]=4 8477 B10R2.7 c1ccc2c(c1)[nH]nn2 Amb1158937 [1,0,0,1,0,0|1,0,1]=4 8478 B10R2.7 c1cccc2NSNc21 Amb24103819 [1,0,0,1,0,0|2,0,0]=4 8479 B10R2.7 c1cccc2SNSc21 Amb25698329 [1,0,0,1,0,0|2,0,0]=4 8480 B10R2.7 c1ncc2c(c1)CNC2 Amb10067652 [1,0,0,1,0,0|2,0,0]=4 8481 B10R2.320 CC1Cc2ccccc12 Amb17778870 [1,0,0,1,0,0|1,0,0]=3 8482 B10R2.320 ClC1Cc2ccccc12 Amb17778800 [1,0,0,1,0,0|1,0,0]=3 8483 B10R2.320 OC1Cc2c[n]ccc21 Amb24478648 [1,0,0,1,0,0|2,0,0]=4 8484 B10R2.320 OC1Cc2ccccc12 Amb17778676 [1,0,0,1,0,0|1,0,0]=3 8485 B10R2.320 O[C@@H]1Cc2ccccc21 Amb25676494 [1,0,0,1,0,0|1,0,0]=3 8486 B10R2.320 O[C@H]1Cc2ccccc21 Amb24704470 [1,0,0,1,0,0|1,0,0]=3 8487 B10R2.320 [NH3+]C1Cc2ccccc12 Amb17778877 [1,0,0,1,0,0|0,0,1]=3 8488 B10R2.5 NC1CC1[n]2cccc2 Amb18278848 [0,0,0,1,1,0|2,0,0]=4 8489 B10R2.5 NC1CC1c2ccoc2 Amb24527705 [0,0,0,1,1,0|2,0,0]=4 8490 B10R2.32 NC1CCc2[s]ccc21 Amb22754584 [0,0,0,1,1,0|2,0,0]=4 8491 B10R2.32 NC1CCc2c[s]cc21 Amb18202935 [0,0,0,1,1,0|2,0,0]=4 8492 B10R2.32 NC1CCc2cc[s]c21 Amb18643462 [0,0,0,1,1,0|2,0,0]=4 8493 B10R2.136 C1CC(N1)c2ccc[s]2 Amb22056242 [0,0,0,1,1,0|2,0,0]=4 8494 B10R2.136 C1C[C@H](N1)c2c[s]cc2 Amb24606181 [0,0,0,1,1,0|2,0,0]=4 8495 B10R2.136 C1C[C@H](N1)c2ccc[nH]2 Amb24477863 [0,0,0,1,1,0|2,0,0]=4 8496 B10R2.136 C1C[C@H](N1)c2ccc[s]2 Amb25202793 [0,0,0,1,1,0|2,0,0]=4 8497 B10R2.136 C1NCC1[n]2cccc2 Amb24329359 [0,0,0,1,1,0|2,0,0]=4 8498 B10R2.136 C1NCC1c2cc[nH]c2 Amb18062628 [0,0,0,1,1,0|2,0,0]=4 8499 B10R2.136 C1NCC1c2ccc[s]2 Amb18065042 [0,0,0,1,1,0|2,0,0]=4 8500 B10R2.136 C1NCC1c2ccco2 Amb25796595 [0,0,0,1,1,0|2,0,0]=4 8501 B10R2.136 C1NCC1c2cocc2 Amb25146766 [0,0,0,1,1,0|2,0,0]=4 8502 B12R2.586 O=C1CCC2=CC=CC=CC21 Amb25150334 [0,0,0,1,0,1|2,0,0]=4 8503 B12R2.586 O=C1CCC=2C=CCC=CC21 Amb24357209 [0,0,0,1,0,1|2,0,0]=4 8504 B12R2.586 O=C1CCC=2CC=CC=CC21 Amb24097416 [0,0,0,1,0,1|2,0,0]=4 8505 B12R2.586 OC1CCC2=CC=CC=CC21 Amb25056856 [0,0,0,1,0,1|2,0,0]=4 8506 B12R2.586 OC1CCC=2CC=CC=CC21 Amb24466334 [0,0,0,1,0,1|2,0,0]=4 8507 B12R2.2017 C1CCCC2=CC=CC=C1N2 Amb25213582 [0,0,0,1,0,1|2,0,0]=4 8508 B12R2.24 BrC1CCc2c(C1)cccc2 Amb13952699 [0,1,0,1,0,0|2,0,0]=4 8509 B12R2.24 BrC=1CCc2ccccc2C1 Amb25726468 [0,1,0,1,0,0|2,0,0]=4 8510 B12R2.24 Brc1cc2CCCNc2[n]c1 Amb19878999 [0,1,0,1,0,0|2,0,0]=4 8511 B12R2.24 Brc1cc2CCCNc2c[n]1 Amb25149050 [0,1,0,1,0,0|2,0,0]=4 8512 B12R2.24 Brc1cc2CCCSc2cc1 Amb18755837 [0,1,0,1,0,0|2,0,0]=4 8513 B12R2.24 Brc1cc2CCNCc2[n]c1 Amb22751260 [0,1,0,1,0,0|2,0,0]=4 8514 B12R2.24 Brc1cc2CCNCc2cc1 Amb19957726 [0,1,0,1,0,0|1,0,0]=3 8515 B12R2.24 Brc1cc2CCOCc2cc1 Amb19958103 [0,1,0,1,0,0|2,0,0]=4 8516 B12R2.24 Brc1cc2CNCCc2[n]c1 Amb22490433 [0,1,0,1,0,0|2,0,0]=4 8517 B12R2.24 Brc1cc2CNCCc2cc1 Amb19957727 [0,1,0,1,0,0|1,0,0]=3 8518 B12R2.24 Brc1cc2CNCCc2nc1 Amb10067651 [0,1,0,1,0,0|2,0,0]=4 8519 B12R2.24 Brc1cc2CNCCc2nc1 Amb10067889 [0,1,0,1,0,0|2,0,0]=4 8520 B12R2.24 Brc1cc2COCCc2cc1 Amb21962440 [0,1,0,1,0,0|2,0,0]=4 8521 B12R2.24 Brc1cc2COCNc2cc1 Amb24564128 [0,1,0,1,0,0|2,0,0]=4 8522 B12R2.24 Brc1cc2NCCNc2cc1 Amb22231980 [0,1,0,1,0,0|2,0,0]=4 8523 B12R2.24 Brc1cc2NCCOc2cc1 Amb21964574 [0,1,0,1,0,0|2,0,0]=4 8524 B12R2.24 Brc1cc2NCCSc2cc1 Amb24487014 [0,1,0,1,0,0|2,0,0]=4 8525 B12R2.24 Brc1cc2OCCNc2cc1 Amb19958005 [0,1,0,1,0,0|2,0,0]=4 8526 B12R2.24 Brc1cc2SCCNc2cc1 Amb25086833 [0,1,0,1,0,0|2,0,0]=4 8527 B12R2.24 Brc1ccc2CCCOc2c1 Amb23440336 [0,1,0,1,0,0|2,0,0]=4 8528 B12R2.24 Brc1ccc2CCCSc2c1 Amb25728354 [0,1,0,1,0,0|2,0,0]=4 8529 B12R2.24 Brc1ccc2CCN=Cc2c1 Amb22490212 [0,1,0,1,0,0|1,0,1]=4 8530 B12R2.24 Brc1ccc2CCNCc2[n]1 Amb25700039 [0,1,0,1,0,0|2,0,0]=4 8531 B12R2.24 Brc1ccc2CNCCc2[n]1 Amb22757522 [0,1,0,1,0,0|2,0,0]=4 8532 B12R2.24 Brc1ccc2c(c1)C=CCC2 Amb2383772 [0,1,0,1,0,0|2,0,0]=4 8533 B12R2.24 Brc1ccc2c(c1)CCCN2 Amb1090469 [0,1,0,1,0,0|1,0,0]=3 8534 B12R2.24 Brc1ccc2c(c1)CCNC2 Amb10602999 [0,1,0,1,0,0|1,0,0]=3 8535 B12R2.24 Brc1ccc2c(c1)CNCC2 Amb2383361 [0,1,0,1,0,0|1,0,0]=3 8536 B12R2.24 Brc1ccc2c(c1)NCCC2 Amb10576260 [0,1,0,1,0,0|1,0,0]=3 8537 B12R2.24 Brc1ccc2c(c1)NCCC2 Amb2383341 [0,1,0,1,0,0|1,0,0]=3 8538 B12R2.24 Brc1ccc2c(c1)NCCO2 Amb2383447 [0,1,0,1,0,0|2,0,0]=4 8539 B12R2.24 Brc1ccc2c(c1)OCCN2 Amb10603903 [0,1,0,1,0,0|2,0,0]=4 8540 B12R2.24 Brc1ccc2c(n1)CCCN2 Amb17621868 [0,1,0,1,0,0|2,0,0]=4 8541 B12R2.24 Brc1ccc2c(n1)CCNC2 Amb10067574 [0,1,0,1,0,0|2,0,0]=4 8542 B12R2.24 C=C1Cc2ccccc2CC1 Amb25151359 [0,1,0,1,0,0|2,0,0]=4 8543 B12R2.24 CC1=Nc2c(CC1)cccc2 Amb10553816 [0,1,0,1,0,0|1,0,1]=4 8544 B12R2.24 CC1CCc2c(N1)cccc2 Amb2525824 [0,1,0,1,0,0|1,0,0]=3 8545 B12R2.24 CC1CCc2ccc[n]c2N1 Amb24715838 [0,1,0,1,0,0|2,0,0]=4 8546 B12R2.24 CC1CCc2ccccc2N1 Amb22499773 [0,1,0,1,0,0|1,0,0]=3 8547 B12R2.24 CC1CCc2ccccc2O1 Amb19515436 [0,1,0,1,0,0|2,0,0]=4 8548 B12R2.24 CC1CCc2ccccc2S1 Amb25706129 [0,1,0,1,0,0|2,0,0]=4 8549 B12R2.24 CC1CNc2c(O1)cccc2 Amb17097653 [0,1,0,1,0,0|2,0,0]=4 8550 B12R2.24 CC1CSc2ccccc2N1 Amb20622496 [0,1,0,1,0,0|2,0,0]=4 8551 B12R2.24 CC1Cc2[n]cccc2CN1 Amb18124940 [0,1,0,1,0,0|2,0,0]=4 8552 B12R2.24 CC1Cc2cc[n]cc2CN1 Amb24685008 [0,1,0,1,0,0|2,0,0]=4 8553 B12R2.24 CC1Cc2ccccc2CN1 Amb22755434 [0,1,0,1,0,0|1,0,0]=3 8554 B12R2.24 CC1Cc2ccccc2N=C1 Amb24682970 [0,1,0,1,0,0|1,0,1]=4 8555 B12R2.24 CC1Cc2ccccc2NC1 Amb22501042 [0,1,0,1,0,0|1,0,0]=3 8556 B12R2.24 CC1Cc2ccccc2OC1 Amb25189640 [0,1,0,1,0,0|2,0,0]=4 8557 B12R2.24 CC1Nc2ccccc2CS1 Amb24373918 [0,1,0,1,0,0|2,0,0]=4 8558 B12R2.24 CN1C=Nc2ccccc2N1 Amb24623403 [0,1,0,1,0,0|1,0,1]=4 8559 B12R2.24 CN1CCc2c(C1)cccc2 Amb2581727 [0,1,0,1,0,0|1,0,0]=3 8560 B12R2.24 CN1Cc2ccccc2CC1 Amb22001820 [0,1,0,1,0,0|1,0,0]=3 8561 B12R2.24 C[C@@H]1CCc2ccccc2N1 Amb22751676 [0,1,0,1,0,0|1,0,0]=3 8562 B12R2.24 C[C@@H]1Cc2ccccc2C=N1 Amb22747779 [0,1,0,1,0,0|1,0,1]=4 8563 B12R2.24 C[C@@H]1Cc2ccccc2CN1 Amb22751934 [0,1,0,1,0,0|1,0,0]=3 8564 B12R2.24 C[C@H]1CCc2ccccc2N1 Amb25138125 [0,1,0,1,0,0|1,0,0]=3 8565 B12R2.24 C[C@H]1CNc2ccccc2N1 Amb25348686 [0,1,0,1,0,0|2,0,0]=4 8566 B12R2.24 C[C@H]1Cc2ccccc2C=N1 Amb25056784 [0,1,0,1,0,0|1,0,1]=4 8567 B12R2.24 C[C@H]1Cc2ccccc2CN1 Amb24087372 [0,1,0,1,0,0|1,0,0]=3 8568 B12R2.24 C[N+]1=Cc2c(CC1)cccc2 Amb10553962 [0,1,0,1,0,0|1,0,1]=4 8569 B12R2.24 Cc1cc2CCCNc2c[n]1 Amb25241977 [0,1,0,1,0,0|2,0,0]=4 8570 B12R2.24 Cc1cc2CCCNc2cc1 Amb22499776 [0,1,0,1,0,0|1,0,0]=3 8571 B12R2.24 Cc1cc2CCCNc2nc1 Amb10879389 [0,1,0,1,0,0|2,0,0]=4 8572 B12R2.24 Cc1cc2CCCSc2cc1 Amb24642871 [0,1,0,1,0,0|2,0,0]=4 8573 B12R2.24 Cc1cc2CCNCc2[n]c1 Amb18202202 [0,1,0,1,0,0|2,0,0]=4 8574 B12R2.24 Cc1cc2CCNCc2c[n]1 Amb24334833 [0,1,0,1,0,0|2,0,0]=4 8575 B12R2.24 Cc1cc2CCNCc2cc1 Amb22500761 [0,1,0,1,0,0|1,0,0]=3 8576 B12R2.24 Cc1cc2CNCCc2[n]c1 Amb18644368 [0,1,0,1,0,0|2,0,0]=4 8577 B12R2.24 Cc1cc2CNCCc2c[n]1 Amb25028072 [0,1,0,1,0,0|2,0,0]=4 8578 B12R2.24 Cc1cc2CNCCc2cc1 Amb19515632 [0,1,0,1,0,0|1,0,0]=3 8579 B12R2.24 Cc1cc2NCCNc2cc1 Amb20080170 [0,1,0,1,0,0|2,0,0]=4 8580 B12R2.24 Cc1cc2NCCOc2cc1 Amb22234866 [0,1,0,1,0,0|2,0,0]=4 8581 B12R2.24 Cc1cc2NCCSc2cc1 Amb22886453 [0,1,0,1,0,0|2,0,0]=4 8582 B12R2.24 Cc1cc2SCCNc2cc1 Amb22498966 [0,1,0,1,0,0|2,0,0]=4 8583 B12R2.24 Cc1ccc2CCCCc2c1 Amb17673387 [0,1,0,1,0,0|2,0,0]=4 8584 B12R2.24 Cc1ccc2CCCNc2c1 Amb22000879 [0,1,0,1,0,0|1,0,0]=3 8585 B12R2.24 Cc1ccc2CCN=Cc2c1 Amb22500760 [0,1,0,1,0,0|1,0,1]=4 8586 B12R2.24 Cc1ccc2CCN=Cc2c1 Amb22500763 [0,1,0,1,0,0|1,0,1]=4 8587 B12R2.24 Cc1ccc2CCNCc2[n]1 Amb18831357 [0,1,0,1,0,0|2,0,0]=4 8588 B12R2.24 Cc1ccc2CNCCc2[n]1 Amb18644369 [0,1,0,1,0,0|2,0,0]=4 8589 B12R2.24 Cc1ccc2NCCCc2[n]1 Amb24460718 [0,1,0,1,0,0|2,0,0]=4 8590 B12R2.24 Cc1ccc2c(c1)CCCO2 Amb13951730 [0,1,0,1,0,0|2,0,0]=4 8591 B12R2.24 Cc1ccc2c(c1)CNCC2 Amb2383365 [0,1,0,1,0,0|1,0,0]=3 8592 B12R2.24 Cc1ccc2c(c1)NCCC2 Amb1089737 [0,1,0,1,0,0|1,0,0]=3 8593 B12R2.24 Cc1ccc2c(c1)NCCC2 Amb2099820 [0,1,0,1,0,0|1,0,0]=3 8594 B12R2.24 Cc1ccc2c(c1)NCCO2 Amb2383451 [0,1,0,1,0,0|2,0,0]=4 8595 B12R2.24 Cc1ccc2c(c1)OCCN2 Amb17496858 [0,1,0,1,0,0|2,0,0]=4 8596 B12R2.24 Cc1ccc2c(n1)NCCC2 Amb10982585 [0,1,0,1,0,0|2,0,0]=4 8597 B12R2.24 ClC1=CCc2c(N1)cccc2 Amb15691607 [0,1,0,1,0,0|1,0,1]=4 8598 B12R2.24 ClC1CCc2ccccc2C1 Amb17672772 [0,1,0,1,0,0|2,0,0]=4 8599 B12R2.24 ClC1CCc2ccccc2O1 Amb24509296 [0,1,0,1,0,0|2,0,0]=4 8600 B12R2.24 ClC1CCc2ccccc2S1 Amb24487897 [0,1,0,1,0,0|2,0,0]=4 8601 B12R2.24 ClC1Cc2c[n]ccc2CN1 Amb24486562 [0,1,0,1,0,0|2,0,0]=4 8602 B12R2.24 ClC1Cc2ccccc2CO1 Amb25152704 [0,1,0,1,0,0|2,0,0]=4 8603 B12R2.24 Clc1c[n]c2CCCNc2c1 Amb25766188 [0,1,0,1,0,0|2,0,0]=4 8604 B12R2.24 Clc1cc2CCCNc2[n]c1 Amb25042644 [0,1,0,1,0,0|2,0,0]=4 8605 B12R2.24 Clc1cc2CCCNc2c[n]1 Amb25152852 [0,1,0,1,0,0|2,0,0]=4 8606 B12R2.24 Clc1cc2CCCOc2cc1 Amb22498254 [0,1,0,1,0,0|2,0,0]=4 8607 B12R2.24 Clc1cc2CCCSc2cc1 Amb25783030 [0,1,0,1,0,0|2,0,0]=4 8608 B12R2.24 Clc1cc2CCN=Cc2cc1 Amb24649802 [0,1,0,1,0,0|1,0,1]=4 8609 B12R2.24 Clc1cc2CCNCc2c[n]1 Amb22001984 [0,1,0,1,0,0|2,0,0]=4 8610 B12R2.24 Clc1cc2CCNCc2c[n]1 Amb22753927 [0,1,0,1,0,0|2,0,0]=4 8611 B12R2.24 Clc1cc2CCNCc2cc1 Amb21864875 [0,1,0,1,0,0|1,0,0]=3 8612 B12R2.24 Clc1cc2CCOCc2cc1 Amb22235175 [0,1,0,1,0,0|2,0,0]=4 8613 B12R2.24 Clc1cc2CNCCc2[n]c1 Amb19959217 [0,1,0,1,0,0|2,0,0]=4 8614 B12R2.24 Clc1cc2CNCCc2[n]c1 Amb22727762 [0,1,0,1,0,0|2,0,0]=4 8615 B12R2.24 Clc1cc2CNCCc2c[n]1 Amb21963585 [0,1,0,1,0,0|2,0,0]=4 8616 B12R2.24 Clc1cc2CNCCc2c[n]1 Amb23399582 [0,1,0,1,0,0|2,0,0]=4 8617 B12R2.24 Clc1cc2CNCCc2cc1 Amb20248082 [0,1,0,1,0,0|1,0,0]=3 8618 B12R2.24 Clc1cc2CNNCc2cc1 Amb25700827 [0,1,0,1,0,0|2,0,0]=4 8619 B12R2.24 Clc1cc2COCNc2cc1 Amb25211398 [0,1,0,1,0,0|2,0,0]=4 8620 B12R2.24 Clc1cc2NCCOc2cc1 Amb22490751 [0,1,0,1,0,0|2,0,0]=4 8621 B12R2.24 Clc1cc2SCCNc2cc1 Amb25151172 [0,1,0,1,0,0|2,0,0]=4 8622 B12R2.24 Clc1ccc2CCCNc2[n]1 Amb22753683 [0,1,0,1,0,0|2,0,0]=4 8623 B12R2.24 Clc1ccc2CCCOc2c1 Amb25103951 [0,1,0,1,0,0|2,0,0]=4 8624 B12R2.24 Clc1ccc2CCNCc2[n]1 Amb24373069 [0,1,0,1,0,0|2,0,0]=4 8625 B12R2.24 Clc1ccc2c(c1)C=CCC2 Amb2383770 [0,1,0,1,0,0|2,0,0]=4 8626 B12R2.24 Clc1ccc2c(c1)CCCN2 Amb1133229 [0,1,0,1,0,0|1,0,0]=3 8627 B12R2.24 Clc1ccc2c(c1)CCNC2 Amb10067199 [0,1,0,1,0,0|1,0,0]=3 8628 B12R2.24 Clc1ccc2c(c1)CNCC2 Amb2383359 [0,1,0,1,0,0|1,0,0]=3 8629 B12R2.24 Clc1ccc2c(c1)NCCC2 Amb10576261 [0,1,0,1,0,0|1,0,0]=3 8630 B12R2.24 Clc1ccc2c(c1)NCCC2 Amb2383339 [0,1,0,1,0,0|1,0,0]=3 8631 B12R2.24 Clc1ccc2c(c1)NCCN2 Amb10605577 [0,1,0,1,0,0|2,0,0]=4 8632 B12R2.24 Clc1ccc2c(c1)NCCO2 Amb2383445 [0,1,0,1,0,0|2,0,0]=4 8633 B12R2.24 Clc1ccc2c(c1)NCCS2 Amb2371893 [0,1,0,1,0,0|2,0,0]=4 8634 B12R2.24 Clc1ccc2c(n1)CCNC2 Amb10067690 [0,1,0,1,0,0|2,0,0]=4 8635 B12R2.24 Clc1ccc2c(n1)CCNC2 Amb10603572 [0,1,0,1,0,0|2,0,0]=4 8636 B12R2.24 FC1CNc2ccccc2O1 Amb25301702 [0,1,0,1,0,0|2,0,0]=4 8637 B12R2.24 FC1Cc2ccccc2NC1 Amb25207965 [0,1,0,1,0,0|1,0,0]=3 8638 B12R2.24 Fc1cc2CCC=Cc2cc1 Amb25320782 [0,1,0,1,0,0|2,0,0]=4 8639 B12R2.24 Fc1cc2CCCOc2cc1 Amb21864763 [0,1,0,1,0,0|2,0,0]=4 8640 B12R2.24 Fc1cc2CCN=Cc2cc1 Amb24091693 [0,1,0,1,0,0|1,0,1]=4 8641 B12R2.24 Fc1cc2CCNCc2c[n]1 Amb24458050 [0,1,0,1,0,0|2,0,0]=4 8642 B12R2.24 Fc1cc2CCNCc2cc1 Amb18560951 [0,1,0,1,0,0|1,0,0]=3 8643 B12R2.24 Fc1cc2CCNCc2cc1 Amb21858227 [0,1,0,1,0,0|1,0,0]=3 8644 B12R2.24 Fc1cc2CNCCc2[n]c1 Amb25799440 [0,1,0,1,0,0|2,0,0]=4 8645 B12R2.24 Fc1cc2CNCCc2cc1 Amb19374000 [0,1,0,1,0,0|1,0,0]=3 8646 B12R2.24 Fc1cc2NCCSc2cc1 Amb25713881 [0,1,0,1,0,0|2,0,0]=4 8647 B12R2.24 Fc1ccc2CCCNc2c1 Amb22586301 [0,1,0,1,0,0|1,0,0]=3 8648 B12R2.24 Fc1ccc2CCCOc2c1 Amb25065166 [0,1,0,1,0,0|2,0,0]=4 8649 B12R2.24 Fc1ccc2CCCSc2c1 Amb25132871 [0,1,0,1,0,0|2,0,0]=4 8650 B12R2.24 Fc1ccc2CCN=Cc2c1 Amb24092083 [0,1,0,1,0,0|1,0,1]=4 8651 B12R2.24 Fc1ccc2c(c1)C=CCC2 Amb2383771 [0,1,0,1,0,0|2,0,0]=4 8652 B12R2.24 Fc1ccc2c(c1)CCCN2 Amb1107937 [0,1,0,1,0,0|1,0,0]=3 8653 B12R2.24 Fc1ccc2c(c1)CNCC2 Amb2383360 [0,1,0,1,0,0|1,0,0]=3 8654 B12R2.24 Fc1ccc2c(c1)NCCC2 Amb2383340 [0,1,0,1,0,0|1,0,0]=3 8655 B12R2.24 Fc1ccc2c(c1)NCCO2 Amb10603189 [0,1,0,1,0,0|2,0,0]=4 8656 B12R2.24 Fc1ccc2c(c1)NCCO2 Amb2383446 [0,1,0,1,0,0|2,0,0]=4 8657 B12R2.24 Fc1ccc2c(c1)OCCN2 Amb10974785 [0,1,0,1,0,0|2,0,0]=4 8658 B12R2.24 IC1Cc2ccccc2CO1 Amb25811321 [0,1,0,1,0,0|2,0,0]=4 8659 B12R2.24 Ic1cc2CCCOc2cc1 Amb22498253 [0,1,0,1,0,0|2,0,0]=4 8660 B12R2.24 Ic1cc2CNCCc2[n]c1 Amb25252969 [0,1,0,1,0,0|2,0,0]=4 8661 B12R2.24 Ic1cc2CNCCc2cc1 Amb22490586 [0,1,0,1,0,0|1,0,0]=3 8662 B12R2.24 Ic1cc2NCCOc2cc1 Amb22586266 [0,1,0,1,0,0|2,0,0]=4 8663 B12R2.24 Ic1ccc2CCCNc2c1 Amb22586311 [0,1,0,1,0,0|1,0,0]=3 8664 B12R2.24 Ic1ccc2c(c1)CNCC2 Amb2383367 [0,1,0,1,0,0|1,0,0]=3 8665 B12R2.24 Ic1ccc2c(c1)NCCC2 Amb2383346 [0,1,0,1,0,0|1,0,0]=3 8666 B12R2.24 Ic1ccc2c(c1)NCCO2 Amb2383453 [0,1,0,1,0,0|2,0,0]=4 8667 B12R2.24 NC1=Nc2c(CC1)cccc2 Amb2373583 [0,1,0,1,0,0|1,0,0]=3 8668 B12R2.24 NC1=Nc2c(SC1)cccc2 Amb19136101 [0,1,0,1,0,0|2,0,0]=4 8669 B12R2.24 NC1=Nc2c(SC1)cccc2 Amb1918677 [0,1,0,1,0,0|2,0,0]=4 8670 B12R2.24 NC1C=Cc2c(C1)cccc2 Amb17470378 [0,1,0,1,0,0|2,0,0]=4 8671 B12R2.24 NC1CCc2c(C1)cccc2 Amb13952050 [0,1,0,1,0,0|1,0,0]=3 8672 B12R2.24 NC1CCc2c(C1)cccc2 Amb2383251 [0,1,0,1,0,0|1,0,0]=3 8673 B12R2.24 NC1CNc2ccccc2O1 Amb24417784 [0,1,0,1,0,0|2,0,0]=4 8674 B12R2.24 NC1COc2c(C1)cccc2 Amb2383393 [0,1,0,1,0,0|2,0,0]=4 8675 B12R2.24 NC1Cc2[n]cccc2CC1 Amb21964047 [0,1,0,1,0,0|2,0,0]=4 8676 B12R2.24 NC1Cc2c[n]ccc2CC1 Amb18202204 [0,1,0,1,0,0|2,0,0]=4 8677 B12R2.24 NC1Cc2ccc[n]c2CC1 Amb19372737 [0,1,0,1,0,0|2,0,0]=4 8678 B12R2.24 NC1Cc2ccccc2CO1 Amb24365192 [0,1,0,1,0,0|2,0,0]=4 8679 B12R2.24 NC1Cc2ccccc2SC1 Amb18646412 [0,1,0,1,0,0|2,0,0]=4 8680 B12R2.24 NC=1CNc2ccccc2C1 Amb25079184 [0,1,0,1,0,0|2,0,0]=4 8681 B12R2.24 NC=1COc2ccccc2N1 Amb18124903 [0,1,0,1,0,0|2,0,0]=4 8682 B12R2.24 NC=1NCc2ccccc2N1 Amb18644339 [0,1,0,1,0,0|2,0,0]=4 8683 B12R2.24 NN1CCc2c(C1)cccc2 Amb17232046 [0,1,0,1,0,0|0,0,0]=2 8684 B12R2.24 NN1Cc2ccccc2CC1 Amb22495461 [0,1,0,1,0,0|0,0,0]=2 8685 B12R2.24 N[C@@H]1Cc2ccccc2OC1 Amb22756584 [0,1,0,1,0,0|2,0,0]=4 8686 B12R2.24 N[C@H]1Cc2ccccc2C=C1 Amb24699393 [0,1,0,1,0,0|2,0,0]=4 8687 B12R2.24 N[C@H]1Cc2ccccc2CC1 Amb25113422 [0,1,0,1,0,0|1,0,0]=3 8688 B12R2.24 N[C@H]1Cc2ccccc2NC1 Amb25224756 [0,1,0,1,0,0|1,0,0]=3 8689 B12R2.24 N[C@H]1Cc2ccccc2OC1 Amb23385337 [0,1,0,1,0,0|2,0,0]=4 8690 B12R2.24 N[C@H]1Cc2ccccc2OC1 Amb24485980 [0,1,0,1,0,0|2,0,0]=4 8691 B12R2.24 Nc1c[n]c2CCCNc2c1 Amb24439439 [0,1,0,1,0,0|2,0,0]=4 8692 B12R2.24 Nc1cc2CCCSc2cc1 Amb18828001 [0,1,0,1,0,0|2,0,0]=4 8693 B12R2.24 Nc1cc2CCOCc2cc1 Amb22497220 [0,1,0,1,0,0|2,0,0]=4 8694 B12R2.24 Nc1cc2CNCCc2[n]c1 Amb20241772 [0,1,0,1,0,0|2,0,0]=4 8695 B12R2.24 Nc1cc2CNCCc2[n]c1 Amb21964506 [0,1,0,1,0,0|2,0,0]=4 8696 B12R2.24 Nc1cc2CNOCc2cc1 Amb25111235 [0,1,0,1,0,0|2,0,0]=4 8697 B12R2.24 Nc1ccc2CCCNc2c1 Amb22494228 [0,1,0,1,0,0|1,0,0]=3 8698 B12R2.24 Nc1ccc2CCCOc2c1 Amb25324386 [0,1,0,1,0,0|2,0,0]=4 8699 B12R2.24 Nc1ccc2CCN=Cc2c1 Amb25145814 [0,1,0,1,0,0|1,0,1]=4 8700 B12R2.24 Nc1ccc2c(c1)CCCC2 Amb1084712 [0,1,0,1,0,0|2,0,0]=4 8701 B12R2.24 Nc1ccc2c(c1)CCCN2 Amb17598307 [0,1,0,1,0,0|1,0,0]=3 8702 B12R2.24 Nc1ccc2c(c1)CCCO2 Amb13952453 [0,1,0,1,0,0|2,0,0]=4 8703 B12R2.24 Nc1ccc2c(c1)NCCC2 Amb17598306 [0,1,0,1,0,0|1,0,0]=3 8704 B12R2.24 Nc1ccc2c(c1)NCCN2 Amb10606637 [0,1,0,1,0,0|2,0,0]=4 8705 B12R2.24 Nc1ccc2c(c1)NCCO2 Amb15695267 [0,1,0,1,0,0|2,0,0]=4 8706 B12R2.24 Nc1ccc2c(c1)NCCS2 Amb13881705 [0,1,0,1,0,0|2,0,0]=4 8707 B12R2.24 O=C1C=CC=2CNCCC2N1 Amb21856469 [0,1,0,1,0,0|2,0,0]=4 8708 B12R2.24 O=C1CCc2[n]cccc2N1 Amb25095800 [0,1,0,1,0,0|2,0,0]=4 8709 B12R2.24 O=C1CCc2c(C1)cccc2 Amb2383557 [0,1,0,1,0,0|2,0,0]=4 8710 B12R2.24 O=C1CCc2c[n]ccc2N1 Amb22899719 [0,1,0,1,0,0|2,0,0]=4 8711 B12R2.24 O=C1CCc2ccc[n]c2N1 Amb21960778 [0,1,0,1,0,0|2,0,0]=4 8712 B12R2.24 O=C1COc2c(N1)cccc2 Amb1011836 [0,1,0,1,0,0|2,0,0]=4 8713 B12R2.24 O=C1CSc2c(N1)cccc2 Amb1007458 [0,1,0,1,0,0|2,0,0]=4 8714 B12R2.24 O=C1Cc2ccccc2NC1 Amb18202302 [0,1,0,1,0,0|1,0,1]=4 8715 B12R2.24 O=C1Cc2ccccc2NN1 Amb24583135 [0,1,0,1,0,0|0,0,1]=3 8716 B12R2.24 O=C1NCc2c(N1)cccc2 Amb10603974 [0,1,0,1,0,0|2,0,0]=4 8717 B12R2.24 O=C1Nc2ccccc2CO1 Amb19516356 [0,1,0,1,0,0|2,0,0]=4 8718 B12R2.24 O=C1Nc2ccccc2CS1 Amb24509578 [0,1,0,1,0,0|2,0,0]=4 8719 B12R2.24 OC1CCc2ccccc2O1 Amb22230405 [0,1,0,1,0,0|2,0,0]=4 8720 B12R2.24 OC1CNc2cccc[n+]2C1 Amb21867773 [0,1,0,1,0,0|2,0,0]=4 8721 B12R2.24 OC1CNc2ccccc2O1 Amb24485948 [0,1,0,1,0,0|2,0,0]=4 8722 B12R2.24 OC1Cc2ccccc2NC1 Amb23590875 [0,1,0,1,0,0|1,0,0]=3 8723 B12R2.24 OC1Cc2ccccc2OC1 Amb22498287 [0,1,0,1,0,0|2,0,0]=4 8724 B12R2.24 OC1Cc2ccccc2SC1 Amb25832476 [0,1,0,1,0,0|2,0,0]=4 8725 B12R2.24 OC1OCc2c(C1)cccc2 Amb17593730 [0,1,0,1,0,0|2,0,0]=4 8726 B12R2.24 ON1Cc2ccccc2CC1 Amb24533074 [0,1,0,1,0,0|1,0,0]=3 8727 B12R2.24 O[C@@H]1Cc2ccccc2CC1 Amb25149682 [0,1,0,1,0,0|2,0,0]=4 8728 B12R2.24 O[C@H]1Cc2ccccc2C=C1 Amb25792328 [0,1,0,1,0,0|2,0,0]=4 8729 B12R2.24 O[C@H]1Cc2ccccc2CC1 Amb25043599 [0,1,0,1,0,0|2,0,0]=4 8730 B12R2.24 O[C@H]1Cc2ccccc2NC1 Amb24426871 [0,1,0,1,0,0|1,0,0]=3 8731 B12R2.24 Oc1cc2CCCNc2[n]c1 Amb23597942 [0,1,0,1,0,0|2,0,0]=4 8732 B12R2.24 Oc1cc2CCCOc2cc1 Amb18243510 [0,1,0,1,0,0|2,0,0]=4 8733 B12R2.24 Oc1cc2CCN=Cc2cc1 Amb25073966 [0,1,0,1,0,0|1,0,1]=4 8734 B12R2.24 Oc1cc2CCOCc2cc1 Amb25044546 [0,1,0,1,0,0|2,0,0]=4 8735 B12R2.24 Oc1cc2CNCCc2cc1 Amb19373281 [0,1,0,1,0,0|1,0,0]=3 8736 B12R2.24 Oc1cc2CNCCc2nc1 Amb10067650 [0,1,0,1,0,0|2,0,0]=4 8737 B12R2.24 Oc1cc2CNCCc2nc1 Amb10602795 [0,1,0,1,0,0|2,0,0]=4 8738 B12R2.24 Oc1cc2COCCc2cc1 Amb25682436 [0,1,0,1,0,0|2,0,0]=4 8739 B12R2.24 Oc1cc2NCCOc2cc1 Amb21953873 [0,1,0,1,0,0|2,0,0]=4 8740 B12R2.24 Oc1cc2NCCOc2cc1 Amb22498359 [0,1,0,1,0,0|2,0,0]=4 8741 B12R2.24 Oc1cc2OCCNc2cc1 Amb22371507 [0,1,0,1,0,0|2,0,0]=4 8742 B12R2.24 Oc1cc2OCCNc2cc1 Amb22495584 [0,1,0,1,0,0|2,0,0]=4 8743 B12R2.24 Oc1ccc2CCCOc2c1 Amb18125116 [0,1,0,1,0,0|2,0,0]=4 8744 B12R2.24 Oc1ccc2CCNCc2c1 Amb17843849 [0,1,0,1,0,0|1,0,0]=3 8745 B12R2.24 Oc1ccc2CNCCc2c1 Amb17755303 [0,1,0,1,0,0|1,0,0]=3 8746 B12R2.24 Oc1ccc2NCCCc2[n]1 Amb24657265 [0,1,0,1,0,0|2,0,0]=4 8747 B12R2.24 Oc1ccc2c(c1)CCNC2 Amb15692387 [0,1,0,1,0,0|1,0,0]=3 8748 B12R2.24 S=C1CCc2ccccc2N1 Amb25700408 [0,1,0,1,0,0|1,0,0]=3 8749 B12R2.24 S=C1CCc2ccccc2O1 Amb24104591 [0,1,0,1,0,0|2,0,0]=4 8750 B12R2.24 S=C1COc2c(N1)cccc2 Amb10070958 [0,1,0,1,0,0|2,0,0]=4 8751 B12R2.24 S=C1CSc2c(N1)cccc2 Amb1147064 [0,1,0,1,0,0|2,0,0]=4 8752 B12R2.24 S=C1Cc2ccccc2CN1 Amb24538124 [0,1,0,1,0,0|1,0,1]=4 8753 B12R2.24 S=C1Nc2ccccc2CS1 Amb19221474 [0,1,0,1,0,0|2,0,0]=4 8754 B12R2.24 S=C1Nc2ccccc2NN1 Amb25081092 [0,1,0,1,0,0|1,0,1]=4 8755 B12R2.24 SC1CCc2ccccc2C1 Amb17672773 [0,1,0,1,0,0|2,0,0]=4 8756 B12R2.24 Sc1cc2CCCOc2cc1 Amb18180108 [0,1,0,1,0,0|2,0,0]=4 8757 B12R2.24 Sc1cc2CCCSc2cc1 Amb24509702 [0,1,0,1,0,0|2,0,0]=4 8758 B12R2.24 Sc1cc2NCCOc2cc1 Amb18664649 [0,1,0,1,0,0|2,0,0]=4 8759 B12R2.79 Br[C@@H]1C[C@H]1c2ccc(I)cc2 Amb25113713 [0,1,0,1,0,0|2,0,0]=4 8760 B12R2.79 Brc1ccc(cc1)C2CC2Br Amb23454932 [0,1,0,1,0,0|2,0,0]=4 8761 B12R2.79 CC1CC1c2ccc(Br)cc2 Amb23247702 [0,1,0,1,0,0|2,0,0]=4 8762 B12R2.79 CC1CC1c2ccc(F)cc2 Amb24662198 [0,1,0,1,0,0|2,0,0]=4 8763 B12R2.79 CC1CC1c2ccc(N)cc2 Amb23247694 [0,1,0,1,0,0|2,0,0]=4 8764 B12R2.79 Cc1ccc(cc1)C2CC2O Amb24527656 [0,1,0,1,0,0|2,0,0]=4 8765 B12R2.79 Cc1ccc(cc1)[C@@H]2C[C@@H]2Cl Amb25179016 [0,1,0,1,0,0|2,0,0]=4 8766 B12R2.79 Cc1ccc(cc1)[C@@H]2C[C@H]2Cl Amb25210810 [0,1,0,1,0,0|2,0,0]=4 8767 B12R2.79 Cc1ccc(cc1)[C@@H]2C[C@H]2N Amb24100233 [0,1,0,1,0,0|1,0,0]=3 8768 B12R2.79 Clc1ccc(cc1)C2CC2Br Amb23454925 [0,1,0,1,0,0|2,0,0]=4 8769 B12R2.79 Fc1ccc(cc1)C2CC2Br Amb23454928 [0,1,0,1,0,0|2,0,0]=4 8770 B12R2.79 NC1CC1c2ccc(Br)cc2 Amb19346488 [0,1,0,1,0,0|1,0,0]=3 8771 B12R2.79 NC1CC1c2ccc(Cl)cc2 Amb19373427 [0,1,0,1,0,0|1,0,0]=3 8772 B12R2.79 NC1CC1c2ccc(F)cc2 Amb19514916 [0,1,0,1,0,0|1,0,0]=3 8773 B12R2.79 NC1CC1c2ccc(cc2)O Amb17568133 [0,1,0,1,0,0|1,0,0]=3 8774 B12R2.79 N[C@@H]1C[C@@H]1c2ccc(Br)cc2 Amb24763920 [0,1,0,1,0,0|1,0,0]=3 8775 B12R2.79 N[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb24655057 [0,1,0,1,0,0|1,0,0]=3 8776 B12R2.79 N[C@@H]1C[C@H]1c2ccc(F)cc2 Amb24100231 [0,1,0,1,0,0|1,0,0]=3 8777 B12R2.79 N[C@H]1CC1c2ccc(Cl)cc2 Amb25690946 [0,1,0,1,0,0|1,0,0]=3 8778 B12R2.79 N[C@H]1C[C@@H]1c2ccc(Cl)cc2 Amb24512288 [0,1,0,1,0,0|1,0,0]=3 8779 B12R2.79 N[C@H]1C[C@@H]1c2ccc(F)cc2 Amb25168877 [0,1,0,1,0,0|1,0,0]=3 8780 B12R2.79 N[C@H]1C[C@H]1c2ccc(Br)cc2 Amb25365231 [0,1,0,1,0,0|1,0,0]=3 8781 B12R2.79 N[C@H]1C[C@H]1c2ccc(Cl)cc2 Amb25326697 [0,1,0,1,0,0|1,0,0]=3 8782 B12R2.79 OC1CC1c2ccc(F)cc2 Amb24639281 [0,1,0,1,0,0|2,0,0]=4 8783 B12R2.132 Brc1ccc2CCC(Br)c2c1 Amb24707166 [0,1,0,1,0,0|2,0,0]=4 8784 B12R2.132 Brc1ccc2c(c1)C(=O)CC2 Amb2383532 [0,1,0,1,0,0|2,0,0]=4 8785 B12R2.132 Brc1ccc2c(c1)C(N)CC2 Amb2383225 [0,1,0,1,0,0|1,0,0]=3 8786 B12R2.132 Brc1ccc2c(c1)C(N)CO2 Amb2383235 [0,1,0,1,0,0|2,0,0]=4 8787 B12R2.132 C=C1CCc2ccc(Br)cc21 Amb24501876 [0,1,0,1,0,0|2,0,0]=4 8788 B12R2.132 CC1CCc2ccc(O)cc21 Amb24099164 [0,1,0,1,0,0|2,0,0]=4 8789 B12R2.132 CN1CCc2[n]cc(N)cc12 Amb25311507 [0,1,0,1,0,0|2,0,0]=4 8790 B12R2.132 CN1CCc2c[n]c(Br)cc12 Amb18769245 [0,1,0,1,0,0|2,0,0]=4 8791 B12R2.132 CN1CCc2c[n]c(N)cc12 Amb18202039 [0,1,0,1,0,0|2,0,0]=4 8792 B12R2.132 CN1CCc2ccc(Br)[n]c12 Amb25076232 [0,1,0,1,0,0|2,0,0]=4 8793 B12R2.132 CN1CCc2ccc(Br)cc12 Amb25087238 [0,1,0,1,0,0|1,0,0]=3 8794 B12R2.132 CN1CCc2ccc(Cl)cc12 Amb24448676 [0,1,0,1,0,0|1,0,0]=3 8795 B12R2.132 CN1CCc2ccc(Cl)cc12 Amb24575788 [0,1,0,1,0,0|1,0,0]=3 8796 B12R2.132 CN1CCc2ccc(N)cc12 Amb22899074 [0,1,0,1,0,0|1,0,0]=3 8797 B12R2.132 CN1CCc2ccc(O)[n]c12 Amb24453149 [0,1,0,1,0,0|2,0,0]=4 8798 B12R2.132 CN1CNc2ccc(Cl)cc12 Amb24464719 [0,1,0,1,0,0|2,0,0]=4 8799 B12R2.132 Cc1cc2C(N)COc2cc1 Amb20626372 [0,1,0,1,0,0|2,0,0]=4 8800 B12R2.132 Cc1cc2[C@@H](N)COc2cc1 Amb25367329 [0,1,0,1,0,0|2,0,0]=4 8801 B12R2.132 Cc1cc2[C@H](N)COc2cc1 Amb25781341 [0,1,0,1,0,0|2,0,0]=4 8802 B12R2.132 Cc1cc2c(CCN2C)c[n]1 Amb24556484 [0,1,0,1,0,0|2,0,0]=4 8803 B12R2.132 Cc1ccc2CCC(=C)c2c1 Amb24359347 [0,1,0,1,0,0|2,0,0]=4 8804 B12R2.132 Cc1ccc2CCC(N)c2c1 Amb19301139 [0,1,0,1,0,0|1,0,0]=3 8805 B12R2.132 Cc1ccc2CCN(C)c2c1 Amb24485108 [0,1,0,1,0,0|1,0,0]=3 8806 B12R2.132 Cc1ccc2CC[C@@H](N)c2c1 Amb25367187 [0,1,0,1,0,0|1,0,0]=3 8807 B12R2.132 Cc1ccc2CC[C@H](N)c2c1 Amb25172752 [0,1,0,1,0,0|1,0,0]=3 8808 B12R2.132 Cc1ccc2CC[C@H](O)c2c1 Amb25337667 [0,1,0,1,0,0|2,0,0]=4 8809 B12R2.132 Cc1ccc2c(c1)C(O)CC2 Amb17087924 [0,1,0,1,0,0|2,0,0]=4 8810 B12R2.132 ClC1CCc2ccc(I)cc21 Amb25293402 [0,1,0,1,0,0|2,0,0]=4 8811 B12R2.132 Clc1ccc2c(c1)C(=O)CC2 Amb2383530 [0,1,0,1,0,0|2,0,0]=4 8812 B12R2.132 Clc1ccc2c(c1)C(N)CC2 Amb2383223 [0,1,0,1,0,0|1,0,0]=3 8813 B12R2.132 Clc1ccc2c(c1)C(N)CO2 Amb2383233 [0,1,0,1,0,0|2,0,0]=4 8814 B12R2.132 Fc1ccc2CCC(Br)c2c1 Amb20623851 [0,1,0,1,0,0|2,0,0]=4 8815 B12R2.132 Fc1ccc2CCC(F)c2c1 Amb24514102 [0,1,0,1,0,0|2,0,0]=4 8816 B12R2.132 Fc1ccc2c(c1)C(=O)CC2 Amb2383531 [0,1,0,1,0,0|2,0,0]=4 8817 B12R2.132 Fc1ccc2c(c1)C(Cl)CC2 Amb17087975 [0,1,0,1,0,0|2,0,0]=4 8818 B12R2.132 Fc1ccc2c(c1)C(N)CC2 Amb2383224 [0,1,0,1,0,0|1,0,0]=3 8819 B12R2.132 Fc1ccc2c(c1)C(N)CO2 Amb2383234 [0,1,0,1,0,0|2,0,0]=4 8820 B12R2.132 Fc1ccc2c(c1)C(O)CC2 Amb17087925 [0,1,0,1,0,0|2,0,0]=4 8821 B12R2.132 Fc1ccc2c(c1)[C@H](N)CC2 Amb16233798 [0,1,0,1,0,0|1,0,0]=3 8822 B12R2.132 Ic1ccc2c(c1)C(=O)CC2 Amb10603865 [0,1,0,1,0,0|2,0,0]=4 8823 B12R2.132 NC1=NCc2ccc(F)cc21 Amb19374948 [0,1,0,1,0,0|2,0,0]=4 8824 B12R2.132 NC1CCc2[n]cc(O)cc21 Amb24660724 [0,1,0,1,0,0|2,0,0]=4 8825 B12R2.132 NC1CCc2ccc(Br)cc21 Amb22277084 [0,1,0,1,0,0|1,0,0]=3 8826 B12R2.132 NC1CCc2ccc(Cl)cc21 Amb21964442 [0,1,0,1,0,0|1,0,0]=3 8827 B12R2.132 NC1CCc2ccc(F)cc21 Amb19373327 [0,1,0,1,0,0|1,0,0]=3 8828 B12R2.132 NC1CCc2ccc(O)cc21 Amb20241032 [0,1,0,1,0,0|1,0,0]=3 8829 B12R2.132 NC1CCc2ccc(S)cc21 Amb24485773 [0,1,0,1,0,0|1,0,0]=3 8830 B12R2.132 NC1CNc2ccc(Cl)cc21 Amb25239513 [0,1,0,1,0,0|2,0,0]=4 8831 B12R2.132 NC1COc2ccc(Br)cc21 Amb22751415 [0,1,0,1,0,0|2,0,0]=4 8832 B12R2.132 NC1COc2ccc(Cl)cc21 Amb20626373 [0,1,0,1,0,0|2,0,0]=4 8833 B12R2.132 NC1COc2ccc(O)cc21 Amb25843807 [0,1,0,1,0,0|2,0,0]=4 8834 B12R2.132 NN1CCc2ccc(F)cc12 Amb18125382 [0,1,0,1,0,0|0,0,0]=2 8835 B12R2.132 N[C@@H]1CCc2ccc(Br)cc21 Amb22899040 [0,1,0,1,0,0|1,0,0]=3 8836 B12R2.132 N[C@@H]1CCc2ccc(Cl)cc21 Amb24523004 [0,1,0,1,0,0|1,0,0]=3 8837 B12R2.132 N[C@@H]1CCc2ccc(F)cc21 Amb22388617 [0,1,0,1,0,0|1,0,0]=3 8838 B12R2.132 N[C@@H]1CCc2ccc(I)cc21 Amb24653732 [0,1,0,1,0,0|1,0,0]=3 8839 B12R2.132 N[C@@H]1COc2ccc(Br)cc21 Amb24756687 [0,1,0,1,0,0|2,0,0]=4 8840 B12R2.132 N[C@@H]1COc2ccc(Cl)cc21 Amb25760690 [0,1,0,1,0,0|2,0,0]=4 8841 B12R2.132 N[C@@H]1COc2ccc(S)cc21 Amb24560332 [0,1,0,1,0,0|2,0,0]=4 8842 B12R2.132 N[C@H]1CCc2ccc(Cl)cc21 Amb24648664 [0,1,0,1,0,0|1,0,0]=3 8843 B12R2.132 N[C@H]1CCc2ccc(F)cc21 Amb22288710 [0,1,0,1,0,0|1,0,0]=3 8844 B12R2.132 N[C@H]1CCc2ccc(O)cc21 Amb19929575 [0,1,0,1,0,0|1,0,0]=3 8845 B12R2.132 N[C@H]1COc2ccc(Cl)cc21 Amb25335375 [0,1,0,1,0,0|2,0,0]=4 8846 B12R2.132 N[C@H]1COc2ccc(I)cc21 Amb24386301 [0,1,0,1,0,0|2,0,0]=4 8847 B12R2.132 N[C@H]1COc2ccc(O)cc21 Amb25829417 [0,1,0,1,0,0|2,0,0]=4 8848 B12R2.132 N[C@H]1COc2ccc(S)cc21 Amb25111596 [0,1,0,1,0,0|2,0,0]=4 8849 B12R2.132 N[n]1[n]cc2ccc(I)cc12 Amb25726467 [0,1,0,1,0,0|1,0,1]=4 8850 B12R2.132 N[n]1[n]cc2ccc(O)cc12 Amb25178875 [0,1,0,1,0,0|1,0,1]=4 8851 B12R2.132 N[n]1c[n]c2ccc(Cl)cc12 Amb25352407 [0,1,0,1,0,0|1,0,1]=4 8852 B12R2.132 N[n]1c[n]c2ccc(F)cc12 Amb25135450 [0,1,0,1,0,0|1,0,1]=4 8853 B12R2.132 N[n]1ccc2ccc(Cl)cc12 Amb18199546 [0,1,0,1,0,0|0,0,2]=4 8854 B12R2.132 N[n]1ccc2ccc(F)cc12 Amb18201961 [0,1,0,1,0,0|0,0,2]=4 8855 B12R2.132 Nc1cc2c(c[n][n]2N)cc1 Amb24067217 [0,1,0,1,0,0|1,0,1]=4 8856 B12R2.132 Nc1cc2c(cc[n]2N)cc1 Amb24089083 [0,1,0,1,0,0|0,0,2]=4 8857 B12R2.132 Nc1ccc2CCC(O)c2c1 Amb22490266 [0,1,0,1,0,0|2,0,0]=4 8858 B12R2.132 Nc1ccc2CCS(=O)c2c1 Amb24358626 [0,1,0,1,0,0|2,0,0]=4 8859 B12R2.132 Nc1ccc2CC[C@@H](N)c2c1 Amb19889681 [0,1,0,1,0,0|1,0,0]=3 8860 B12R2.132 Nc1ccc2CC[C@H](N)c2c1 Amb19889682 [0,1,0,1,0,0|1,0,0]=3 8861 B12R2.132 Nc1ccc2CC[C@H](O)c2c1 Amb24363627 [0,1,0,1,0,0|2,0,0]=4 8862 B12R2.132 Nc1ccc2OC[C@@H](N)c2c1 Amb25073245 [0,1,0,1,0,0|2,0,0]=4 8863 B12R2.132 Nc1ccc2OC[C@H](N)c2c1 Amb25136105 [0,1,0,1,0,0|2,0,0]=4 8864 B12R2.132 Nc1ccc2c(c1)C(=O)CC2 Amb10067747 [0,1,0,1,0,0|2,0,0]=4 8865 B12R2.132 OC1CCc2ccc(Br)cc12 Amb17779324 [0,1,0,1,0,0|2,0,0]=4 8866 B12R2.132 OC1CCc2ccc(I)cc21 Amb25119131 [0,1,0,1,0,0|2,0,0]=4 8867 B12R2.132 O[C@@H]1CCc2ccc(Br)cc21 Amb25147882 [0,1,0,1,0,0|2,0,0]=4 8868 B12R2.132 O[C@H]1CCc2ccc(Br)cc21 Amb25149044 [0,1,0,1,0,0|2,0,0]=4 8869 B12R2.132 O[C@H]1CCc2ccc(Cl)cc21 Amb25169483 [0,1,0,1,0,0|2,0,0]=4 8870 B12R2.132 O[C@H]1CCc2ccc(I)cc21 Amb25084197 [0,1,0,1,0,0|2,0,0]=4 8871 B12R2.132 Oc1ccc2CCC(O)c2c1 Amb25209331 [0,1,0,1,0,0|2,0,0]=4 8872 B12R2.132 Oc1ccc2c(c1)[C@H](N)CC2 Amb10608774 [0,1,0,1,0,0|1,0,0]=3 8873 B12R2.132 SC1CCc2ccc(Br)cc21 Amb25150782 [0,1,0,1,0,0|2,0,0]=4 8874 B12R2.294 Clc1ccc(CC2CC2)cc1 Amb22751349 [0,1,0,1,0,0|2,0,0]=4 8875 B12R2.294 Clc1ccc(CC2CO2)cc1 Amb24712110 [0,1,0,1,0,0|2,0,0]=4 8876 B12R2.294 Fc1ccc(CC2CO2)cc1 Amb24390098 [0,1,0,1,0,0|2,0,0]=4 8877 B12R2.294 Oc1ccc(CC2CO2)cc1 Amb25338853 [0,1,0,1,0,0|2,0,0]=4 8878 B12R2.1728 CO[C@@H]1Cc2ccc(Br)cc21 Amb24363643 [0,1,0,1,0,0|2,0,0]=4 8879 B12R2.1728 CO[C@H]1Cc2ccc(Br)cc21 Amb24733147 [0,1,0,1,0,0|2,0,0]=4 8880 B12R2.1728 N#CC1Cc2ccc(Cl)cc21 Amb24627225 [0,1,0,1,0,0|1,0,1]=4 8881 B12R2.1728 N#CC1Cc2ccc(O)cc21 Amb25169268 [0,1,0,1,0,0|1,0,1]=4 8882 B12R2.1728 NCC1Cc2ccc(O)cc21 Amb25324245 [0,1,0,1,0,0|1,0,0]=3 8883 B12R2.2302 Brc1ccc([n]c1)C2CCN2 Amb25281396 [0,1,0,1,0,0|2,0,0]=4 8884 B12R2.2302 Brc1ccc([n]c1)C2CNC2 Amb25076137 [0,1,0,1,0,0|2,0,0]=4 8885 B12R2.2302 Brc1ccc(c[n]1)C2CNC2 Amb25290385 [0,1,0,1,0,0|2,0,0]=4 8886 B12R2.2302 Brc1ccc(c[n]1)[C@@H]2CCN2 Amb25222622 [0,1,0,1,0,0|2,0,0]=4 8887 B12R2.2302 Brc1ccc(cc1)C2CCC2 Amb20617091 [0,1,0,1,0,0|2,0,0]=4 8888 B12R2.2302 Brc1ccc(cc1)C2CCO2 Amb24414336 [0,1,0,1,0,0|2,0,0]=4 8889 B12R2.2302 Brc1ccc(cc1)C2CNC2 Amb18066312 [0,1,0,1,0,0|1,0,0]=3 8890 B12R2.2302 Brc1ccc(cc1)C2COC2 Amb22737350 [0,1,0,1,0,0|2,0,0]=4 8891 B12R2.2302 Cc1ccc([n]c1)C2CNC2 Amb24727950 [0,1,0,1,0,0|2,0,0]=4 8892 B12R2.2302 Cc1ccc([n]c1)[C@H]2CCN2 Amb25145691 [0,1,0,1,0,0|2,0,0]=4 8893 B12R2.2302 Cc1ccc(cc1)C2CCC2 Amb25381443 [0,1,0,1,0,0|2,0,0]=4 8894 B12R2.2302 Cc1ccc(cc1)C2CNC2 Amb18065276 [0,1,0,1,0,0|1,0,0]=3 8895 B12R2.2302 Clc1ccc([n]c1)[C@@H]2CCN2 Amb24372993 [0,1,0,1,0,0|2,0,0]=4 8896 B12R2.2302 Clc1ccc(c[n]1)[C@H]2CCN2 Amb25128036 [0,1,0,1,0,0|2,0,0]=4 8897 B12R2.2302 Clc1ccc(cc1)C2CCC2 Amb24713440 [0,1,0,1,0,0|2,0,0]=4 8898 B12R2.2302 Clc1ccc(cc1)C2CCN2 Amb19370175 [0,1,0,1,0,0|1,0,0]=3 8899 B12R2.2302 Clc1ccc(cc1)C2CCN2 Amb22059427 [0,1,0,1,0,0|1,0,0]=3 8900 B12R2.2302 Clc1ccc(cc1)C2CCO2 Amb24369540 [0,1,0,1,0,0|2,0,0]=4 8901 B12R2.2302 Clc1ccc(cc1)C2CCS2 Amb24640005 [0,1,0,1,0,0|2,0,0]=4 8902 B12R2.2302 Clc1ccc(cc1)C2CNC2 Amb18563827 [0,1,0,1,0,0|1,0,0]=3 8903 B12R2.2302 Clc1ccc(cc1)[C@@H]2CCN2 Amb24585046 [0,1,0,1,0,0|1,0,0]=3 8904 B12R2.2302 Fc1ccc([n]c1)C2CNC2 Amb22236354 [0,1,0,1,0,0|2,0,0]=4 8905 B12R2.2302 Fc1ccc([n]c1)C2CNC2 Amb25151188 [0,1,0,1,0,0|2,0,0]=4 8906 B12R2.2302 Fc1ccc([n]c1)[C@@H]2CCN2 Amb24460260 [0,1,0,1,0,0|2,0,0]=4 8907 B12R2.2302 Fc1ccc([n]c1)[C@H]2CCN2 Amb25301987 [0,1,0,1,0,0|2,0,0]=4 8908 B12R2.2302 Fc1ccc(c[n]1)C2CCN2 Amb25721330 [0,1,0,1,0,0|2,0,0]=4 8909 B12R2.2302 Fc1ccc(c[n]1)[C@H]2CCN2 Amb25849271 [0,1,0,1,0,0|2,0,0]=4 8910 B12R2.2302 Fc1ccc(cc1)C2CNC2 Amb18065351 [0,1,0,1,0,0|1,0,0]=3 8911 B12R2.2302 Fc1ccc(cc1)C2CNC2 Amb20669054 [0,1,0,1,0,0|1,0,0]=3 8912 B12R2.2302 Fc1ccc(cc1)C2COC2 Amb22738672 [0,1,0,1,0,0|2,0,0]=4 8913 B12R2.2302 Fc1ccc(cc1)[C@H]2CCN2 Amb25757757 [0,1,0,1,0,0|1,0,0]=3 8914 B12R2.2302 Ic1ccc(c[n]1)C2CCN2 Amb25696096 [0,1,0,1,0,0|2,0,0]=4 8915 B12R2.2302 Ic1ccc(c[n]1)C2CNC2 Amb25857513 [0,1,0,1,0,0|2,0,0]=4 8916 B12R2.2302 Ic1ccc(c[n]1)[C@@H]2CCN2 Amb24680001 [0,1,0,1,0,0|2,0,0]=4 8917 B12R2.2302 Ic1ccc(c[n]1)[C@H]2CCN2 Amb25723435 [0,1,0,1,0,0|2,0,0]=4 8918 B12R2.2302 Ic1ccc(cc1)[C@@H]2CCN2 Amb24417322 [0,1,0,1,0,0|1,0,0]=3 8919 B12R2.2302 Nc1ccc([n]c1)C2CCN2 Amb25068406 [0,1,0,1,0,0|2,0,0]=4 8920 B12R2.2302 Nc1ccc(c[n]1)C2CCN2 Amb25680136 [0,1,0,1,0,0|2,0,0]=4 8921 B12R2.2302 Nc1ccc(c[n]1)[C@H]2CCN2 Amb25152746 [0,1,0,1,0,0|2,0,0]=4 8922 B12R2.2302 Nc1ccc(cc1)C2CCC2 Amb20617092 [0,1,0,1,0,0|2,0,0]=4 8923 B12R2.2302 Nc1ccc(cc1)C2CCN2 Amb25843764 [0,1,0,1,0,0|1,0,0]=3 8924 B12R2.2302 Nc1ccc(cc1)C2CCO2 Amb25705796 [0,1,0,1,0,0|2,0,0]=4 8925 B12R2.2302 Nc1ccc(cc1)C2CNC2 Amb25736438 [0,1,0,1,0,0|1,0,0]=3 8926 B12R2.2302 Nc1ccc(cc1)C2COC2 Amb22388448 [0,1,0,1,0,0|2,0,0]=4 8927 B12R2.2302 Nc1ccc(cc1)[C@H]2CCN2 Amb24583496 [0,1,0,1,0,0|1,0,0]=3 8928 B12R2.2302 Oc1ccc(c[n]1)C2CCN2 Amb25680099 [0,1,0,1,0,0|2,0,0]=4 8929 B12R2.2302 Oc1ccc(c[n]1)[C@@H]2CCN2 Amb25698304 [0,1,0,1,0,0|2,0,0]=4 8930 B12R2.2302 Oc1ccc(c[n]1)[C@H]2CCN2 Amb24351653 [0,1,0,1,0,0|2,0,0]=4 8931 B12R2.2302 Oc1ccc(cc1)C2CCC2 Amb20617093 [0,1,0,1,0,0|2,0,0]=4 8932 B12R2.2302 Oc1ccc(cc1)C2CCN2 Amb24533045 [0,1,0,1,0,0|1,0,0]=3 8933 B12R2.2302 Oc1ccc(cc1)[C@H]2CCN2 Amb25762318 [0,1,0,1,0,0|1,0,0]=3 8934 B12R2.2302 Sc1ccc(c[n]1)C2CNC2 Amb24417726 [0,1,0,1,0,0|2,0,0]=4 8935 B12R2.2302 Sc1ccc(cc1)C2CCN2 Amb24484464 [0,1,0,1,0,0|1,0,0]=3 8936 B12R2.2 C1C=CC(N1)c2ccccc2 Amb25087257 [0,1,0,1,0,0|1,0,1]=4 8937 B12R2.2 C1C=CNC1c2c[n]ccc2 Amb24085149 [0,1,0,1,0,0|2,0,0]=4 8938 B12R2.2 C1C=COC1c2ccccc2 Amb24081226 [0,1,0,1,0,0|2,0,0]=4 8939 B12R2.2 C1C=NC(N1)c2ccccc2 Amb25145901 [0,1,0,1,0,0|1,0,1]=4 8940 B12R2.2 C1C=NC(S1)c2ccccc2 Amb25375170 [0,1,0,1,0,0|1,0,1]=4 8941 B12R2.2 C1C=NNC1c2cc[n]cc2 Amb25151828 [0,1,0,1,0,0|1,0,1]=4 8942 B12R2.2 C1CC(ON1)c2cc[n]cc2 Amb24102629 [0,1,0,1,0,0|2,0,0]=4 8943 B12R2.2 C1CC=C(N1)c2ccccc2 Amb17938860 [0,1,0,1,0,0|1,0,1]=4 8944 B12R2.2 C1CCC(N1)c2c[n]ccc2 Amb17659140 [0,1,0,1,0,0|2,0,0]=4 8945 B12R2.2 C1CCC(N1)c2c[n]ccc2 Amb22899128 [0,1,0,1,0,0|2,0,0]=4 8946 B12R2.2 C1CCC(N1)c2cc[n]cc2 Amb17659139 [0,1,0,1,0,0|2,0,0]=4 8947 B12R2.2 C1CCC(N1)c2cccc[n]2 Amb21960411 [0,1,0,1,0,0|2,0,0]=4 8948 B12R2.2 C1CCC(S1)c2ccccc2 Amb25801021 [0,1,0,1,0,0|2,0,0]=4 8949 B12R2.2 C1CCCB1c2ccccc2 Amb25240096 [0,1,0,1,0,0|2,0,0]=4 8950 B12R2.2 C1CC[C@@H](N1)c2c[n]ccc2 Amb22748224 [0,1,0,1,0,0|2,0,0]=4 8951 B12R2.2 C1CC[C@@H](N1)c2c[n]ccc2 Amb22899133 [0,1,0,1,0,0|2,0,0]=4 8952 B12R2.2 C1CC[C@@H](N1)c2cccc[n]2 Amb22747201 [0,1,0,1,0,0|2,0,0]=4 8953 B12R2.2 C1CC[C@@H](N1)c2cccc[n]2 Amb22754028 [0,1,0,1,0,0|2,0,0]=4 8954 B12R2.2 C1CC[C@@H](N1)c2cccc[n]2 Amb22754034 [0,1,0,1,0,0|2,0,0]=4 8955 B12R2.2 C1CC[C@@H](N1)c2ccccc2 Amb20241932 [0,1,0,1,0,0|1,0,0]=3 8956 B12R2.2 C1CC[C@H](N1)c2cccc[n]2 Amb22802416 [0,1,0,1,0,0|2,0,0]=4 8957 B12R2.2 C1CC[C@H](N1)c2ccccc2 Amb20241933 [0,1,0,1,0,0|1,0,0]=3 8958 B12R2.2 C1CC[S+](C1)c2ccccc2 Amb10576181 [0,1,0,1,0,0|2,0,0]=4 8959 B12R2.2 C1CC[S+](C1)c2ccccc2 Amb2447150 [0,1,0,1,0,0|2,0,0]=4 8960 B12R2.2 C1CN(C=N1)c2ccccc2 Amb22527125 [0,1,0,1,0,0|1,0,1]=4 8961 B12R2.2 C1CNC(C1)c2ccccc2 Amb10808365 [0,1,0,1,0,0|1,0,0]=3 8962 B12R2.2 C1CNC(C1)c2ccccc2 Amb1106311 [0,1,0,1,0,0|1,0,0]=3 8963 B12R2.2 C1CNC(C1)c2ccccn2 Amb2235736 [0,1,0,1,0,0|2,0,0]=4 8964 B12R2.2 C1CNC(C1)c2cccnc2 Amb10067968 [0,1,0,1,0,0|2,0,0]=4 8965 B12R2.2 C1CNC(C1)c2cccnc2 Amb2234638 [0,1,0,1,0,0|2,0,0]=4 8966 B12R2.2 C1CNC(C1)c2ccncc2 Amb1162826 [0,1,0,1,0,0|2,0,0]=4 8967 B12R2.2 C1CNC(C1)c2ccncc2 Amb2234645 [0,1,0,1,0,0|2,0,0]=4 8968 B12R2.2 C1CNN=C1c2cccc[n]2 Amb22055158 [0,1,0,1,0,0|1,0,1]=4 8969 B12R2.2 C1CNN=C1c2ccccc2 Amb25354740 [0,1,0,1,0,0|0,0,1]=3 8970 B12R2.2 C1COC(C1)c2ccccc2 Amb17334283 [0,1,0,1,0,0|2,0,0]=4 8971 B12R2.2 C1COC(N1)c2ccccc2 Amb17334284 [0,1,0,1,0,0|1,0,0]=3 8972 B12R2.2 C1COC(N1)c2ccccn2 Amb17334298 [0,1,0,1,0,0|2,0,0]=4 8973 B12R2.2 C1COC(N1)c2cccnc2 Amb17334299 [0,1,0,1,0,0|2,0,0]=4 8974 B12R2.2 C1COC(N1)c2ccncc2 Amb17334300 [0,1,0,1,0,0|2,0,0]=4 8975 B12R2.2 C1CSC(N1)c2cccc[n]2 Amb18792844 [0,1,0,1,0,0|2,0,0]=4 8976 B12R2.2 C1CSC(S1)c2ccccc2 Amb23401446 [0,1,0,1,0,0|2,0,0]=4 8977 B12R2.2 C1N=CNC1c2c[n]ccc2 Amb24085256 [0,1,0,1,0,0|1,0,1]=4 8978 B12R2.2 C1NC(CO1)c2ccccc2 Amb25258799 [0,1,0,1,0,0|1,0,0]=3 8979 B12R2.2 C1NC(CS1)c2ccccc2 Amb24460745 [0,1,0,1,0,0|1,0,0]=3 8980 B12R2.2 C1NCC(C1)c2ccccc2 Amb10069263 [0,1,0,1,0,0|1,0,0]=3 8981 B12R2.2 C1NCC(C1)c2ccccc2 Amb10072809 [0,1,0,1,0,0|1,0,0]=3 8982 B12R2.2 C1NCC(C1)c2ccccn2 Amb10808435 [0,1,0,1,0,0|2,0,0]=4 8983 B12R2.2 C1NCC(C1)c2ccncc2 Amb10576618 [0,1,0,1,0,0|2,0,0]=4 8984 B12R2.2 C1NCC(O1)c2c[n]ccc2 Amb18065317 [0,1,0,1,0,0|2,0,0]=4 8985 B12R2.2 C1NCC(O1)c2cc[n]cc2 Amb18065319 [0,1,0,1,0,0|2,0,0]=4 8986 B12R2.2 C1NCC(O1)c2cccc[n]2 Amb18065316 [0,1,0,1,0,0|2,0,0]=4 8987 B12R2.2 C1NCC(O1)c2ccccc2 Amb18065307 [0,1,0,1,0,0|1,0,0]=3 8988 B12R2.2 C1NCC=C1c2ccccc2 Amb22059494 [0,1,0,1,0,0|1,0,1]=4 8989 B12R2.2 C1NCCC1c2c[n]ccc2 Amb19958035 [0,1,0,1,0,0|2,0,0]=4 8990 B12R2.2 C1NCCC1c2c[n]ccc2 Amb22490712 [0,1,0,1,0,0|2,0,0]=4 8991 B12R2.2 C1NCCC1c2cc[n]cc2 Amb22233781 [0,1,0,1,0,0|2,0,0]=4 8992 B12R2.2 C1NCC[C@@H]1c2c[n]ccc2 Amb24673743 [0,1,0,1,0,0|2,0,0]=4 8993 B12R2.2 C1NCC[C@@H]1c2cc[n]cc2 Amb24487080 [0,1,0,1,0,0|2,0,0]=4 8994 B12R2.2 C1NCC[C@@H]1c2ccccc2 Amb19887561 [0,1,0,1,0,0|1,0,0]=3 8995 B12R2.2 C1NCC[C@@H]1c2ccccc2 Amb24183516 [0,1,0,1,0,0|1,0,0]=3 8996 B12R2.2 C1NCC[C@H]1c2c[n]ccc2 Amb24085651 [0,1,0,1,0,0|2,0,0]=4 8997 B12R2.2 C1NCC[C@H]1c2cc[n]cc2 Amb25716776 [0,1,0,1,0,0|2,0,0]=4 8998 B12R2.2 C1NCC[C@H]1c2ccccc2 Amb19888399 [0,1,0,1,0,0|1,0,0]=3 8999 B12R2.2 C1OC=NC1c2ccccc2 Amb20247138 [0,1,0,1,0,0|1,0,1]=4 9000 B12R2.2 C1OCCC1c2ccccc2 Amb21960825 [0,1,0,1,0,0|2,0,0]=4 9001 B12R2.2 C1OCOC1c2ccccc2 Amb24101078 [0,1,0,1,0,0|2,0,0]=4 9002 B12R2.2 N1=CN(CC1)c2ccccc2 Amb16226120 [0,1,0,1,0,0|1,0,1]=4 9003 B12R2.2 c1ccc(cc1)C2=NCCC2 Amb1106418 [0,1,0,1,0,0|1,0,1]=4 9004 B12R2.2 c1ccccc1C2NC=CO2 Amb20621985 [0,1,0,1,0,0|1,0,1]=4 9005 B12R2.22 Br[C@@H]1C[C@H](C1)c2ccccc2 Amb25119213 [0,1,0,1,0,0|2,0,0]=4 9006 B12R2.22 NC1CC(C1)c2ccc[n]c2 Amb24178936 [0,1,0,1,0,0|2,0,0]=4 9007 B12R2.22 NC1CC(C1)c2ccc[n]c2 Amb25313817 [0,1,0,1,0,0|2,0,0]=4 9008 B12R2.22 NC1CC(C1)c2ccccc2 Amb19514746 [0,1,0,1,0,0|1,0,0]=3 9009 B12R2.22 NC1CN(C1)c2ccccc2 Amb23598844 [0,1,0,1,0,0|2,0,0]=4 9010 B12R2.22 N[C@@H]1C[C@@H](C1)c2ccc[n]c2 Amb24178917 [0,1,0,1,0,0|2,0,0]=4 9011 B12R2.22 N[C@@H]1C[C@@H](C1)c2ccc[n]c2 Amb24667710 [0,1,0,1,0,0|2,0,0]=4 9012 B12R2.22 N[C@@H]1C[C@@H](C1)c2cccc[n]2 Amb24410945 [0,1,0,1,0,0|2,0,0]=4 9013 B12R2.22 N[C@@H]1C[C@@H](C1)c2ccccc2 Amb23439754 [0,1,0,1,0,0|1,0,0]=3 9014 B12R2.22 N[C@@H]1C[C@H](C1)c2ccc[n]c2 Amb24178920 [0,1,0,1,0,0|2,0,0]=4 9015 B12R2.22 N[C@@H]1C[C@H](C1)c2ccccc2 Amb23439755 [0,1,0,1,0,0|1,0,0]=3 9016 B12R2.22 O=C1CC(N1)c2ccc[n]c2 Amb25322297 [0,1,0,1,0,0|2,0,0]=4 9017 B12R2.22 O=C1CC(N1)c2ccccc2 Amb1993905 [0,1,0,1,0,0|1,0,0]=3 9018 B12R2.22 O=C1C[C@@H](N1)c2ccccc2 Amb24598586 [0,1,0,1,0,0|1,0,0]=3 9019 B12R2.22 OC1CC(C1)c2ccccc2 Amb20627950 [0,1,0,1,0,0|2,0,0]=4 9020 B12R2.22 O[C@@H]1C[C@H](C1)c2ccccc2 Amb25749083 [0,1,0,1,0,0|2,0,0]=4 9021 B12R2.22 SC1CC(C1)c2ccccc2 Amb24690234 [0,1,0,1,0,0|2,0,0]=4 9022 B12R2.27 BrCC1CC1c2ccccc2 Amb25099525 [0,1,0,1,0,0|2,0,0]=4 9023 B12R2.27 BrCC1OC1c2ccccc2 Amb25695964 [0,1,0,1,0,0|2,0,0]=4 9024 B12R2.27 BrC[C@@H]1O[C@@H]1c2ccccc2 Amb24540282 [0,1,0,1,0,0|2,0,0]=4 9025 B12R2.27 BrC[C@H]1O[C@@H]1c2ccccc2 Amb25287176 [0,1,0,1,0,0|2,0,0]=4 9026 B12R2.27 C#CC1CC1c2ccccc2 Amb22002424 [0,1,0,1,0,0|2,0,0]=4 9027 B12R2.27 C=CC1OC1c2ccccc2 Amb24624086 [0,1,0,1,0,0|2,0,0]=4 9028 B12R2.27 CNC1CC1c2ccccc2 Amb18957298 [0,1,0,1,0,0|1,0,0]=3 9029 B12R2.27 CNC1CC1c2ccccc2 Amb20630184 [0,1,0,1,0,0|1,0,0]=3 9030 B12R2.27 COC1OC1c2ccccc2 Amb24613179 [0,1,0,1,0,0|2,0,0]=4 9031 B12R2.27 CSC1CC1c2ccccc2 Amb25086341 [0,1,0,1,0,0|2,0,0]=4 9032 B12R2.27 ClCC1OC1c2ccccc2 Amb25169273 [0,1,0,1,0,0|2,0,0]=4 9033 B12R2.27 ClC[C@H]1O[C@@H]1c2ccccc2 Amb24568308 [0,1,0,1,0,0|2,0,0]=4 9034 B12R2.27 ClC[C@H]1O[C@H]1c2ccccc2 Amb24562256 [0,1,0,1,0,0|2,0,0]=4 9035 B12R2.27 N#CC1CC1c2ccccc2 Amb17231961 [0,1,0,1,0,0|1,0,1]=4 9036 B12R2.27 N#CC1OC1c2ccccc2 Amb17593640 [0,1,0,1,0,0|1,0,1]=4 9037 B12R2.27 N#C[C@@H]1C[C@H]1c2ccccc2 Amb25309014 [0,1,0,1,0,0|1,0,1]=4 9038 B12R2.27 N#C[C@H]1CC1c2ccccc2 Amb24544864 [0,1,0,1,0,0|1,0,1]=4 9039 B12R2.27 NCC1CC1c2cc[n]cc2 Amb18963616 [0,1,0,1,0,0|2,0,0]=4 9040 B12R2.27 NCC1CC1c2cccc[n]2 Amb18963618 [0,1,0,1,0,0|2,0,0]=4 9041 B12R2.27 NCC1CC1c2ccccc2 Amb17232030 [0,1,0,1,0,0|1,0,0]=3 9042 B12R2.27 NCC1CC1c2ccccc2 Amb19515036 [0,1,0,1,0,0|1,0,0]=3 9043 B12R2.27 NCC1CC1c2cccnc2 Amb17232044 [0,1,0,1,0,0|2,0,0]=4 9044 B12R2.27 NCC1OC1c2ccccc2 Amb25836323 [0,1,0,1,0,0|1,0,0]=3 9045 B12R2.27 NC[C@@H]1CC1c2ccccc2 Amb17605571 [0,1,0,1,0,0|1,0,0]=3 9046 B12R2.27 NC[C@@H]1C[C@H]1c2c[n]ccc2 Amb25168891 [0,1,0,1,0,0|2,0,0]=4 9047 B12R2.27 NC[C@@H]1C[C@H]1c2cc[n]cc2 Amb25271512 [0,1,0,1,0,0|2,0,0]=4 9048 B12R2.27 NC[C@@H]1C[C@H]1c2ccccc2 Amb24514797 [0,1,0,1,0,0|1,0,0]=3 9049 B12R2.27 NC[C@H]1C[C@@H]1c2ccccc2 Amb24606663 [0,1,0,1,0,0|1,0,0]=3 9050 B12R2.27 NNC1CC1c2ccccc2 Amb25244653 [0,1,0,1,0,0|0,0,0]=2 9051 B12R2.27 O=CC1CC1c2ccccc2 Amb10844842 [0,1,0,1,0,0|2,0,0]=4 9052 B12R2.27 O=CC1C[C@@H]1c2ccccc2 Amb24619601 [0,1,0,1,0,0|2,0,0]=4 9053 B12R2.27 O=CC1OC1c2ccccc2 Amb25737974 [0,1,0,1,0,0|2,0,0]=4 9054 B12R2.27 O=C[C@@H]1CC1c2ccccc2 Amb25128247 [0,1,0,1,0,0|2,0,0]=4 9055 B12R2.27 O=C[C@@H]1C[C@H]1c2ccccc2 Amb25368620 [0,1,0,1,0,0|2,0,0]=4 9056 B12R2.27 O=C[C@H]1CC1c2ccccc2 Amb24484808 [0,1,0,1,0,0|2,0,0]=4 9057 B12R2.27 OCC1CC1c2ccccc2 Amb17605543 [0,1,0,1,0,0|2,0,0]=4 9058 B12R2.27 OCC1OC1c2ccccc2 Amb24063567 [0,1,0,1,0,0|2,0,0]=4 9059 B12R2.27 OC[C@H]1O[C@@H]1c2ccccc2 Amb20242388 [0,1,0,1,0,0|2,0,0]=4 9060 B12R2.116 CC1(CCN1)c2c[n]ccc2 Amb24436088 [0,1,0,1,0,0|2,0,0]=4 9061 B12R2.116 CC1(CCO1)c2ccccc2 Amb22497354 [0,1,0,1,0,0|2,0,0]=4 9062 B12R2.116 CC1(CNC1)c2ccccc2 Amb18065223 [0,1,0,1,0,0|1,0,0]=3 9063 B12R2.116 CC1(CNC1)c2ccccc2 Amb22549211 [0,1,0,1,0,0|1,0,0]=3 9064 B12R2.116 CC1(COC1)c2ccccc2 Amb22497353 [0,1,0,1,0,0|2,0,0]=4 9065 B12R2.116 FC1(CNC1)c2c[n]ccc2 Amb25151802 [0,1,0,1,0,0|2,0,0]=4 9066 B12R2.116 FC1(COC1)c2ccccc2 Amb22738854 [0,1,0,1,0,0|2,0,0]=4 9067 B12R2.116 NC1(CCC1)c2ccccc2 Amb2371533 [0,1,0,1,0,0|2,0,0]=4 9068 B12R2.116 NC1(CNC1)c2ccccc2 Amb24120649 [0,1,0,1,0,0|1,0,0]=3 9069 B12R2.116 NC1(COC1)c2ccccc2 Amb19892665 [0,1,0,1,0,0|2,0,0]=4 9070 B12R2.116 NC1(COC1)c2ccccc2 Amb22386882 [0,1,0,1,0,0|2,0,0]=4 9071 B12R2.116 OC1(CCC1)c2ccccc2 Amb20668463 [0,1,0,1,0,0|2,0,0]=4 9072 B12R2.116 OC1(CNC1)c2cccc[n]2 Amb24486814 [0,1,0,1,0,0|2,0,0]=4 9073 B12R2.116 OC1(CNC1)c2ccccc2 Amb22406135 [0,1,0,1,0,0|1,0,0]=3 9074 B12R2.116 OC1(CNC1)c2ccccc2 Amb22496452 [0,1,0,1,0,0|1,0,0]=3 9075 B12R2.116 OC1(COC1)c2ccccc2 Amb21960821 [0,1,0,1,0,0|2,0,0]=4 9076 B12R2.116 OC1(CSC1)c2ccccc2 Amb22386890 [0,1,0,1,0,0|2,0,0]=4 9077 B12R2.235 CC1(CC1Cl)c2ccccc2 Amb25275063 [0,1,0,1,0,0|2,0,0]=4 9078 B12R2.235 CC1(CC1N)c2c[n]ccc2 Amb18947383 [0,1,0,1,0,0|2,0,0]=4 9079 B12R2.235 CC1(CC1N)c2cc[n]cc2 Amb18280066 [0,1,0,1,0,0|2,0,0]=4 9080 B12R2.235 CC1(CC1N)c2cccc[n]2 Amb18280087 [0,1,0,1,0,0|2,0,0]=4 9081 B12R2.235 CC1(CC1N)c2ccccc2 Amb18947391 [0,1,0,1,0,0|1,0,0]=3 9082 B12R2.235 CC1(CC1N)c2ccccc2 Amb19148136 [0,1,0,1,0,0|1,0,0]=3 9083 B12R2.235 C[C@@]1(C[C@@H]1Br)c2ccccc2 Amb25176508 [0,1,0,1,0,0|2,0,0]=4 9084 B12R2.235 C[C@]1(C[C@@H]1Cl)c2ccccc2 Amb24557815 [0,1,0,1,0,0|2,0,0]=4 9085 B12R2.235 NC1(CC1F)c2ccccc2 Amb25194668 [0,1,0,1,0,0|2,0,0]=4 9086 B12R2.235 N[C@@H]1C[C@@]1(F)c2ccccc2 Amb24100224 [0,1,0,1,0,0|1,0,0]=3 9087 B12R2.235 N[C@@H]1C[C@]1(F)c2ccccc2 Amb24100239 [0,1,0,1,0,0|1,0,0]=3 9088 B12R2.235 N[C@@]1(C[C@H]1F)c2ccccc2 Amb24655079 [0,1,0,1,0,0|2,0,0]=4 9089 B12R2.235 N[C@H]1C[C@]1(F)c2ccccc2 Amb24539890 [0,1,0,1,0,0|1,0,0]=3 9090 B12R2.235 N[C@]1(C[C@@H]1F)c2ccccc2 Amb24100238 [0,1,0,1,0,0|2,0,0]=4 9091 B12R2.235 N[C@]1(C[C@H]1F)c2ccccc2 Amb24744741 [0,1,0,1,0,0|2,0,0]=4 9092 B12R2.931 CNCC1Cc2ccccc21 Amb24670284 [0,1,0,1,0,0|1,0,0]=3 9093 B12R2.931 NCCC1Cc2ccccc21 Amb24600610 [0,1,0,1,0,0|1,0,0]=3 9094 B12R2.931 NNCC1Cc2ccccc21 Amb25149107 [0,1,0,1,0,0|0,0,0]=2 9095 B12R2.931 NOCC1Cc2ccccc21 Amb24340346 [0,1,0,1,0,0|1,0,0]=3 9096 B12R2.931 O=C=NC1Cc2ccccc21 Amb25149119 [0,1,0,1,0,0|1,0,1]=4 9097 B12R2.931 O=CCC1Cc2ccccc21 Amb25808254 [0,1,0,1,0,0|2,0,0]=4 9098 B12R2.1081 BrC1CCNc2ccncc12 Amb17748887 [0,1,0,1,0,0|2,0,0]=4 9099 B12R2.1081 BrC1COCc2ccccc21 Amb25095651 [0,1,0,1,0,0|2,0,0]=4 9100 B12R2.1081 BrC1OCCc2ccccc21 Amb23441457 [0,1,0,1,0,0|2,0,0]=4 9101 B12R2.1081 Brc1[n]ccc2NCCCc21 Amb25147839 [0,1,0,1,0,0|2,0,0]=4 9102 B12R2.1081 Brc1c[n]cc2CCNCc21 Amb25852779 [0,1,0,1,0,0|2,0,0]=4 9103 B12R2.1081 Brc1c[n]cc2CNCCc21 Amb18173750 [0,1,0,1,0,0|2,0,0]=4 9104 B12R2.1081 Brc1cc[n]c2CNCCc21 Amb24451051 [0,1,0,1,0,0|2,0,0]=4 9105 B12R2.1081 Brc1cccc2C=CCCc21 Amb22500941 [0,1,0,1,0,0|2,0,0]=4 9106 B12R2.1081 Brc1cccc2CCCOc21 Amb18769314 [0,1,0,1,0,0|2,0,0]=4 9107 B12R2.1081 Brc1cccc2CCCSc21 Amb18161542 [0,1,0,1,0,0|2,0,0]=4 9108 B12R2.1081 Brc1cccc2CCNCc21 Amb18131355 [0,1,0,1,0,0|1,0,0]=3 9109 B12R2.1081 Brc1cccc2CCOCc21 Amb22886734 [0,1,0,1,0,0|2,0,0]=4 9110 B12R2.1081 Brc1cccc2CNCCc21 Amb22491011 [0,1,0,1,0,0|1,0,0]=3 9111 B12R2.1081 Brc1cccc2NCCNc21 Amb24647259 [0,1,0,1,0,0|2,0,0]=4 9112 B12R2.1081 Brc1cccc2NCCOc21 Amb21964594 [0,1,0,1,0,0|2,0,0]=4 9113 B12R2.1081 Brc1cccc2NCCSc21 Amb25715188 [0,1,0,1,0,0|2,0,0]=4 9114 B12R2.1081 Brc1cccc2OCCCc21 Amb24081434 [0,1,0,1,0,0|2,0,0]=4 9115 B12R2.1081 Brc1cccc2SCCNc21 Amb22491567 [0,1,0,1,0,0|2,0,0]=4 9116 B12R2.1081 Brc1cccc2c1CCCN2 Amb16231479 [0,1,0,1,0,0|1,0,0]=3 9117 B12R2.1081 Brc1cccc2c1CCCN2 Amb2383331 [0,1,0,1,0,0|1,0,0]=3 9118 B12R2.1081 Brc1cccc2c1CCNC2 Amb2383351 [0,1,0,1,0,0|1,0,0]=3 9119 B12R2.1081 Brc1cccc2c1CNCC2 Amb10603937 [0,1,0,1,0,0|1,0,0]=3 9120 B12R2.1081 Brc1cccc2c1NCCC2 Amb1134947 [0,1,0,1,0,0|1,0,0]=3 9121 B12R2.1081 Brc1cccc2c1NCCC2 Amb13951989 [0,1,0,1,0,0|1,0,0]=3 9122 B12R2.1081 Brc1cccc2c1OCCN2 Amb2383437 [0,1,0,1,0,0|2,0,0]=4 9123 B12R2.1081 Brc1cncc2c1CCCN2 Amb10602840 [0,1,0,1,0,0|2,0,0]=4 9124 B12R2.1081 C=C1CCCc2ccccc21 Amb25736652 [0,1,0,1,0,0|2,0,0]=4 9125 B12R2.1081 C=C1CCSc2ccccc21 Amb25088063 [0,1,0,1,0,0|2,0,0]=4 9126 B12R2.1081 C=C1COCc2ccccc21 Amb24486797 [0,1,0,1,0,0|2,0,0]=4 9127 B12R2.1081 C=C1NCCc2ccccc21 Amb24685452 [0,1,0,1,0,0|1,0,0]=3 9128 B12R2.1081 CC1=CCCc2c1cccc2 Amb2439915 [0,1,0,1,0,0|2,0,0]=4 9129 B12R2.1081 CC1=NCCc2ccccc12 Amb17940779 [0,1,0,1,0,0|1,0,1]=4 9130 B12R2.1081 CC1CCCc2ccccc21 Amb22730060 [0,1,0,1,0,0|2,0,0]=4 9131 B12R2.1081 CC1CCSc2ccccc21 Amb24104681 [0,1,0,1,0,0|2,0,0]=4 9132 B12R2.1081 CC1CNCc2c1cccc2 Amb17399906 [0,1,0,1,0,0|1,0,0]=3 9133 B12R2.1081 CC1CNCc2ccc[n]c21 Amb18124939 [0,1,0,1,0,0|2,0,0]=4 9134 B12R2.1081 CC1CNCc2ccccc21 Amb22275944 [0,1,0,1,0,0|1,0,0]=3 9135 B12R2.1081 CC1COCc2ccccc21 Amb23580749 [0,1,0,1,0,0|2,0,0]=4 9136 B12R2.1081 CC1NCCc2[n]cccc21 Amb18124938 [0,1,0,1,0,0|2,0,0]=4 9137 B12R2.1081 CC1NCCc2[n]cccc21 Amb22899141 [0,1,0,1,0,0|2,0,0]=4 9138 B12R2.1081 CC1NCCc2ccccc21 Amb19514854 [0,1,0,1,0,0|1,0,0]=3 9139 B12R2.1081 CC1NCOc2ccccc21 Amb24637522 [0,1,0,1,0,0|2,0,0]=4 9140 B12R2.1081 CC1OCCc2ccccc21 Amb25773190 [0,1,0,1,0,0|2,0,0]=4 9141 B12R2.1081 CN1CCCc2c1cccc2 Amb15692645 [0,1,0,1,0,0|1,0,0]=3 9142 B12R2.1081 CN1CCCc2c[n]ccc12 Amb24089175 [0,1,0,1,0,0|2,0,0]=4 9143 B12R2.1081 CN1CCCc2ccc[n]c12 Amb24538105 [0,1,0,1,0,0|2,0,0]=4 9144 B12R2.1081 CN1CCNc2[n]cccc12 Amb18831324 [0,1,0,1,0,0|2,0,0]=4 9145 B12R2.1081 CN1CCNc2c1cccc2 Amb2383679 [0,1,0,1,0,0|1,0,0]=3 9146 B12R2.1081 CN1CCNc2c[n]ccc12 Amb18202042 [0,1,0,1,0,0|2,0,0]=4 9147 B12R2.1081 CN1CCNc2cc[n]cc12 Amb18831323 [0,1,0,1,0,0|2,0,0]=4 9148 B12R2.1081 CN1CCNc2ccc[n]c12 Amb19651729 [0,1,0,1,0,0|2,0,0]=4 9149 B12R2.1081 CN1CCNc2ccccc12 Amb19957895 [0,1,0,1,0,0|1,0,0]=3 9150 B12R2.1081 CN1CCNc2ccccc12 Amb22490719 [0,1,0,1,0,0|1,0,0]=3 9151 B12R2.1081 CN1CCOc2c1cccc2 Amb10569245 [0,1,0,1,0,0|1,0,0]=3 9152 B12R2.1081 CN1CCSc2ccccc12 Amb25220195 [0,1,0,1,0,0|1,0,0]=3 9153 B12R2.1081 C[C@@H]1CCNc2ccccc21 Amb25281259 [0,1,0,1,0,0|1,0,0]=3 9154 B12R2.1081 C[C@@H]1CNCc2ccccc21 Amb22751935 [0,1,0,1,0,0|1,0,0]=3 9155 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22751772 [0,1,0,1,0,0|1,0,0]=3 9156 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22756655 [0,1,0,1,0,0|1,0,0]=3 9157 B12R2.1081 C[C@H]1CCNc2ccccc21 Amb24375115 [0,1,0,1,0,0|1,0,0]=3 9158 B12R2.1081 C[C@H]1CNCc2ccccc21 Amb22886463 [0,1,0,1,0,0|1,0,0]=3 9159 B12R2.1081 Cc1[n]ccc2CCNCc21 Amb24702340 [0,1,0,1,0,0|2,0,0]=4 9160 B12R2.1081 Cc1[n]ccc2CNCCc21 Amb24462898 [0,1,0,1,0,0|2,0,0]=4 9161 B12R2.1081 Cc1[n]ccc2NCCCc21 Amb25703147 [0,1,0,1,0,0|2,0,0]=4 9162 B12R2.1081 Cc1cccc2C=NCCc21 Amb25852737 [0,1,0,1,0,0|1,0,1]=4 9163 B12R2.1081 Cc1cccc2CCCCc21 Amb22731111 [0,1,0,1,0,0|2,0,0]=4 9164 B12R2.1081 Cc1cccc2CCCNc21 Amb22499779 [0,1,0,1,0,0|1,0,0]=3 9165 B12R2.1081 Cc1cccc2CCCOc21 Amb25797643 [0,1,0,1,0,0|2,0,0]=4 9166 B12R2.1081 Cc1cccc2CCN=Cc21 Amb25721127 [0,1,0,1,0,0|1,0,1]=4 9167 B12R2.1081 Cc1cccc2CCNCc21 Amb22500762 [0,1,0,1,0,0|1,0,0]=3 9168 B12R2.1081 Cc1cccc2CNCCc21 Amb19373251 [0,1,0,1,0,0|1,0,0]=3 9169 B12R2.1081 Cc1cccc2COCCc21 Amb24743009 [0,1,0,1,0,0|2,0,0]=4 9170 B12R2.1081 Cc1cccc2COCNc21 Amb25211934 [0,1,0,1,0,0|2,0,0]=4 9171 B12R2.1081 Cc1cccc2NCCCc21 Amb19957907 [0,1,0,1,0,0|1,0,0]=3 9172 B12R2.1081 Cc1cccc2NCCOc21 Amb22230187 [0,1,0,1,0,0|2,0,0]=4 9173 B12R2.1081 Cc1cccc2c1CCCN2 Amb2383335 [0,1,0,1,0,0|1,0,0]=3 9174 B12R2.1081 Cc1cccc2c1CCNC2 Amb2383355 [0,1,0,1,0,0|1,0,0]=3 9175 B12R2.1081 Cc1cccc2c1CNCC2 Amb17194044 [0,1,0,1,0,0|1,0,0]=3 9176 B12R2.1081 Cc1cccc2c1NCCC2 Amb1107915 [0,1,0,1,0,0|1,0,0]=3 9177 B12R2.1081 Cc1cccc2c1OCCN2 Amb2383441 [0,1,0,1,0,0|2,0,0]=4 9178 B12R2.1081 Cc1ccnc2c1CCCN2 Amb10879387 [0,1,0,1,0,0|2,0,0]=4 9179 B12R2.1081 ClC1CCNc2ccccc21 Amb24636938 [0,1,0,1,0,0|1,0,0]=3 9180 B12R2.1081 ClC1COCc2ccccc21 Amb22490656 [0,1,0,1,0,0|2,0,0]=4 9181 B12R2.1081 ClC1SCCc2ccccc21 Amb24634203 [0,1,0,1,0,0|2,0,0]=4 9182 B12R2.1081 Clc1[n]ccc2CCCNc21 Amb22756341 [0,1,0,1,0,0|2,0,0]=4 9183 B12R2.1081 Clc1[n]ccc2NCCCc21 Amb20171367 [0,1,0,1,0,0|2,0,0]=4 9184 B12R2.1081 Clc1c[n]cc2CCNCc21 Amb24514188 [0,1,0,1,0,0|2,0,0]=4 9185 B12R2.1081 Clc1c[n]cc2CNCCc21 Amb24509630 [0,1,0,1,0,0|2,0,0]=4 9186 B12R2.1081 Clc1c[n]cc2NCCCc21 Amb24695535 [0,1,0,1,0,0|2,0,0]=4 9187 B12R2.1081 Clc1cc[n]c2NCCCc21 Amb24395295 [0,1,0,1,0,0|2,0,0]=4 9188 B12R2.1081 Clc1cccc2CCCCc21 Amb25797430 [0,1,0,1,0,0|2,0,0]=4 9189 B12R2.1081 Clc1cccc2CCCNc21 Amb19373263 [0,1,0,1,0,0|1,0,0]=3 9190 B12R2.1081 Clc1cccc2CCN=Cc21 Amb24578663 [0,1,0,1,0,0|1,0,1]=4 9191 B12R2.1081 Clc1cccc2CCNCc21 Amb19889644 [0,1,0,1,0,0|1,0,0]=3 9192 B12R2.1081 Clc1cccc2CCOCc21 Amb24702304 [0,1,0,1,0,0|2,0,0]=4 9193 B12R2.1081 Clc1cccc2NCCCc21 Amb19957902 [0,1,0,1,0,0|1,0,0]=3 9194 B12R2.1081 Clc1cccc2NCCNc21 Amb25282036 [0,1,0,1,0,0|2,0,0]=4 9195 B12R2.1081 Clc1cccc2NCCSc21 Amb22886397 [0,1,0,1,0,0|2,0,0]=4 9196 B12R2.1081 Clc1cccc2OCCCc21 Amb25308190 [0,1,0,1,0,0|2,0,0]=4 9197 B12R2.1081 Clc1cccc2SCCNc21 Amb22886398 [0,1,0,1,0,0|2,0,0]=4 9198 B12R2.1081 Clc1cccc2c1CCC=C2 Amb2383775 [0,1,0,1,0,0|2,0,0]=4 9199 B12R2.1081 Clc1cccc2c1CCCN2 Amb2383329 [0,1,0,1,0,0|1,0,0]=3 9200 B12R2.1081 Clc1cccc2c1CCNC2 Amb13948964 [0,1,0,1,0,0|1,0,0]=3 9201 B12R2.1081 Clc1cccc2c1CCNC2 Amb2383349 [0,1,0,1,0,0|1,0,0]=3 9202 B12R2.1081 Clc1cccc2c1CNCC2 Amb10067198 [0,1,0,1,0,0|1,0,0]=3 9203 B12R2.1081 Clc1cccc2c1NCCC2 Amb1140461 [0,1,0,1,0,0|1,0,0]=3 9204 B12R2.1081 Clc1cccc2c1OCCN2 Amb2383435 [0,1,0,1,0,0|2,0,0]=4 9205 B12R2.1081 FC1CCOc2ccccc21 Amb24396221 [0,1,0,1,0,0|2,0,0]=4 9206 B12R2.1081 FC1CCSc2ccccc21 Amb25249840 [0,1,0,1,0,0|2,0,0]=4 9207 B12R2.1081 FC1CNCc2c1cccc2 Amb10841578 [0,1,0,1,0,0|1,0,0]=3 9208 B12R2.1081 FC1COCc2ccccc21 Amb25768367 [0,1,0,1,0,0|2,0,0]=4 9209 B12R2.1081 FC1OCCc2ccccc21 Amb25073157 [0,1,0,1,0,0|2,0,0]=4 9210 B12R2.1081 Fc1[n]ccc2CCNCc21 Amb24718304 [0,1,0,1,0,0|2,0,0]=4 9211 B12R2.1081 Fc1cccc2C=NCCc21 Amb24563509 [0,1,0,1,0,0|1,0,1]=4 9212 B12R2.1081 Fc1cccc2CCCCc21 Amb25768617 [0,1,0,1,0,0|2,0,0]=4 9213 B12R2.1081 Fc1cccc2CCCOc21 Amb24554425 [0,1,0,1,0,0|2,0,0]=4 9214 B12R2.1081 Fc1cccc2CCCSc21 Amb25198716 [0,1,0,1,0,0|2,0,0]=4 9215 B12R2.1081 Fc1cccc2CCNCc21 Amb22232787 [0,1,0,1,0,0|1,0,0]=3 9216 B12R2.1081 Fc1cccc2CCOCc21 Amb25720944 [0,1,0,1,0,0|2,0,0]=4 9217 B12R2.1081 Fc1cccc2CNCCc21 Amb21858226 [0,1,0,1,0,0|1,0,0]=3 9218 B12R2.1081 Fc1cccc2COCCc21 Amb25773904 [0,1,0,1,0,0|2,0,0]=4 9219 B12R2.1081 Fc1cccc2NCCCc21 Amb19958505 [0,1,0,1,0,0|1,0,0]=3 9220 B12R2.1081 Fc1cccc2OCCCc21 Amb25084997 [0,1,0,1,0,0|2,0,0]=4 9221 B12R2.1081 Fc1cccc2OCCNc21 Amb18831161 [0,1,0,1,0,0|2,0,0]=4 9222 B12R2.1081 Fc1cccc2c1CCC=C2 Amb2383776 [0,1,0,1,0,0|2,0,0]=4 9223 B12R2.1081 Fc1cccc2c1CCCN2 Amb2383330 [0,1,0,1,0,0|1,0,0]=3 9224 B12R2.1081 Fc1cccc2c1CCNC2 Amb2383350 [0,1,0,1,0,0|1,0,0]=3 9225 B12R2.1081 Fc1cccc2c1CNCC2 Amb17194043 [0,1,0,1,0,0|1,0,0]=3 9226 B12R2.1081 Fc1cccc2c1NCCC2 Amb1108527 [0,1,0,1,0,0|1,0,0]=3 9227 B12R2.1081 Fc1cccc2c1NCCC2 Amb13951184 [0,1,0,1,0,0|1,0,0]=3 9228 B12R2.1081 Fc1cccc2c1OCCN2 Amb10603942 [0,1,0,1,0,0|2,0,0]=4 9229 B12R2.1081 Fc1cccc2c1OCCN2 Amb2383436 [0,1,0,1,0,0|2,0,0]=4 9230 B12R2.1081 IC1CCNc2ccccc21 Amb24754405 [0,1,0,1,0,0|1,0,0]=3 9231 B12R2.1081 IC1OCCc2ccccc21 Amb25309346 [0,1,0,1,0,0|2,0,0]=4 9232 B12R2.1081 Ic1cccc2CCNCc21 Amb24756500 [0,1,0,1,0,0|1,0,0]=3 9233 B12R2.1081 Ic1cccc2CCOCc21 Amb25324648 [0,1,0,1,0,0|2,0,0]=4 9234 B12R2.1081 Ic1cccc2CNCCc21 Amb22585545 [0,1,0,1,0,0|1,0,0]=3 9235 B12R2.1081 Ic1cccc2COCCc21 Amb25732468 [0,1,0,1,0,0|2,0,0]=4 9236 B12R2.1081 Ic1cccc2NCCCc21 Amb22586210 [0,1,0,1,0,0|1,0,0]=3 9237 B12R2.1081 Ic1cccc2NCCOc21 Amb22586347 [0,1,0,1,0,0|2,0,0]=4 9238 B12R2.1081 Ic1cccc2OCCCc21 Amb24707108 [0,1,0,1,0,0|2,0,0]=4 9239 B12R2.1081 Ic1cccc2c1CCCN2 Amb2383337 [0,1,0,1,0,0|1,0,0]=3 9240 B12R2.1081 Ic1cccc2c1CCNC2 Amb2383357 [0,1,0,1,0,0|1,0,0]=3 9241 B12R2.1081 Ic1cccc2c1OCCN2 Amb2383443 [0,1,0,1,0,0|2,0,0]=4 9242 B12R2.1081 NC1=NCCc2ccccc21 Amb18644285 [0,1,0,1,0,0|0,0,1]=3 9243 B12R2.1081 NC1=NCNc2ccccc21 Amb24099678 [0,1,0,1,0,0|1,0,1]=4 9244 B12R2.1081 NC1C=CCc2ccccc21 Amb18124751 [0,1,0,1,0,0|1,0,1]=4 9245 B12R2.1081 NC1CC=Cc2ccccc21 Amb24385870 [0,1,0,1,0,0|1,0,1]=4 9246 B12R2.1081 NC1CCCc2[n]cccc21 Amb22499722 [0,1,0,1,0,0|2,0,0]=4 9247 B12R2.1081 NC1CCCc2[n]cccc21 Amb22499726 [0,1,0,1,0,0|2,0,0]=4 9248 B12R2.1081 NC1CCCc2c1cccc2 Amb1154594 [0,1,0,1,0,0|1,0,0]=3 9249 B12R2.1081 NC1CCCc2c[n]ccc21 Amb20622033 [0,1,0,1,0,0|2,0,0]=4 9250 B12R2.1081 NC1CCCc2c[n]ccc21 Amb23399856 [0,1,0,1,0,0|2,0,0]=4 9251 B12R2.1081 NC1CCCc2c[n]ccc21 Amb23412279 [0,1,0,1,0,0|2,0,0]=4 9252 B12R2.1081 NC1CCCc2cc[n]cc21 Amb22751608 [0,1,0,1,0,0|2,0,0]=4 9253 B12R2.1081 NC1CCCc2ccc[n]c21 Amb22371548 [0,1,0,1,0,0|2,0,0]=4 9254 B12R2.1081 NC1CCCc2ccccc21 Amb24273096 [0,1,0,1,0,0|1,0,0]=3 9255 B12R2.1081 NC1CCNc2ccccc21 Amb22233827 [0,1,0,1,0,0|1,0,0]=3 9256 B12R2.1081 NC1CCNc2ccccc21 Amb22757242 [0,1,0,1,0,0|1,0,0]=3 9257 B12R2.1081 NC1CCOc2[n]cccc21 Amb25806168 [0,1,0,1,0,0|2,0,0]=4 9258 B12R2.1081 NC1CCOc2c1cccc2 Amb1107562 [0,1,0,1,0,0|1,0,0]=3 9259 B12R2.1081 NC1CCOc2cc[n]cc21 Amb24591818 [0,1,0,1,0,0|2,0,0]=4 9260 B12R2.1081 NC1CCOc2ccc[n]c21 Amb21858508 [0,1,0,1,0,0|2,0,0]=4 9261 B12R2.1081 NC1CCSc2c1cccc2 Amb1107564 [0,1,0,1,0,0|1,0,0]=3 9262 B12R2.1081 NC1CNCc2ccccc21 Amb19929632 [0,1,0,1,0,0|1,0,0]=3 9263 B12R2.1081 NC1CNCc2ccccc21 Amb22494720 [0,1,0,1,0,0|1,0,0]=3 9264 B12R2.1081 NC1CNCc2ccccc21 Amb22494721 [0,1,0,1,0,0|1,0,0]=3 9265 B12R2.1081 NC1COCc2c1cccc2 Amb10067658 [0,1,0,1,0,0|1,0,0]=3 9266 B12R2.1081 NC1COCc2ccccc21 Amb18202067 [0,1,0,1,0,0|1,0,0]=3 9267 B12R2.1081 NC1CSCc2c1cccc2 Amb10067686 [0,1,0,1,0,0|1,0,0]=3 9268 B12R2.1081 NC1NCCc2ccccc21 Amb22491370 [0,1,0,1,0,0|0,0,0]=2 9269 B12R2.1081 NC1NCCc2ccccc21 Amb25798402 [0,1,0,1,0,0|0,0,0]=2 9270 B12R2.1081 NC=1NCN=C2C=CC=CC21 Amb24748169 [0,1,0,1,0,0|1,0,0]=3 9271 B12R2.1081 NN1CC=Cc2ccccc12 Amb24060055 [0,1,0,1,0,0|0,0,1]=3 9272 B12R2.1081 NN1CCOc2ccccc12 Amb18125145 [0,1,0,1,0,0|0,0,0]=2 9273 B12R2.1081 NN1CCOc2ccccc12 Amb22228837 [0,1,0,1,0,0|0,0,0]=2 9274 B12R2.1081 NN1CCSc2ccccc12 Amb24454763 [0,1,0,1,0,0|0,0,0]=2 9275 B12R2.1081 N[C@@H]1CCCc2c1cccc2 Amb10844952 [0,1,0,1,0,0|1,0,0]=3 9276 B12R2.1081 N[C@@H]1CCCc2ccc[n]c21 Amb22748844 [0,1,0,1,0,0|2,0,0]=4 9277 B12R2.1081 N[C@@H]1CCCc2ccc[n]c21 Amb22748845 [0,1,0,1,0,0|2,0,0]=4 9278 B12R2.1081 N[C@@H]1CCCc2ccccc21 Amb22167169 [0,1,0,1,0,0|1,0,0]=3 9279 B12R2.1081 N[C@@H]1CCOc2c1cccc2 Amb13953038 [0,1,0,1,0,0|1,0,0]=3 9280 B12R2.1081 N[C@@H]1CCOc2ccccc21 Amb19515762 [0,1,0,1,0,0|1,0,0]=3 9281 B12R2.1081 N[C@@H]1CCSc2c1cccc2 Amb13952927 [0,1,0,1,0,0|1,0,0]=3 9282 B12R2.1081 N[C@H]1CCCc2[n]cccc21 Amb24068676 [0,1,0,1,0,0|2,0,0]=4 9283 B12R2.1081 N[C@H]1CCCc2cc[n]cc21 Amb25326344 [0,1,0,1,0,0|2,0,0]=4 9284 B12R2.1081 N[C@H]1CCCc2ccccc21 Amb19929634 [0,1,0,1,0,0|1,0,0]=3 9285 B12R2.1081 N[C@H]1CCNc2ccccc21 Amb25697589 [0,1,0,1,0,0|1,0,0]=3 9286 B12R2.1081 N[C@H]1CCOc2c1cccc2 Amb13953039 [0,1,0,1,0,0|1,0,0]=3 9287 B12R2.1081 N[C@H]1CCOc2ccccc21 Amb24052964 [0,1,0,1,0,0|1,0,0]=3 9288 B12R2.1081 N[C@H]1CCSc2c1cccc2 Amb13952928 [0,1,0,1,0,0|1,0,0]=3 9289 B12R2.1081 Nc1[n]ccc2CCNCc21 Amb25205269 [0,1,0,1,0,0|2,0,0]=4 9290 B12R2.1081 Nc1cc[n]c2CCNCc21 Amb24433278 [0,1,0,1,0,0|2,0,0]=4 9291 B12R2.1081 Nc1cccc2C=CCCc21 Amb18644206 [0,1,0,1,0,0|2,0,0]=4 9292 B12R2.1081 Nc1cccc2CCCNc21 Amb22494247 [0,1,0,1,0,0|1,0,0]=3 9293 B12R2.1081 Nc1cccc2CCCSc21 Amb18126429 [0,1,0,1,0,0|2,0,0]=4 9294 B12R2.1081 Nc1cccc2CCNCc21 Amb18355098 [0,1,0,1,0,0|1,0,0]=3 9295 B12R2.1081 Nc1cccc2CCOCc21 Amb25330800 [0,1,0,1,0,0|2,0,0]=4 9296 B12R2.1081 Nc1cccc2CNCCc21 Amb21858678 [0,1,0,1,0,0|1,0,0]=3 9297 B12R2.1081 Nc1cccc2NN=CCc21 Amb18644332 [0,1,0,1,0,0|0,0,2]=4 9298 B12R2.1081 Nc1cccc2c1CCCC2 Amb1088906 [0,1,0,1,0,0|2,0,0]=4 9299 B12R2.1081 Nc1cccc2c1CCCN2 Amb17232045 [0,1,0,1,0,0|1,0,0]=3 9300 B12R2.1081 Nc1cccc2c1CCCO2 Amb17570000 [0,1,0,1,0,0|2,0,0]=4 9301 B12R2.1081 Nc1cccc2c1CCNC2 Amb10067205 [0,1,0,1,0,0|1,0,0]=3 9302 B12R2.1081 Nc1cccc2c1NCCO2 Amb16191975 [0,1,0,1,0,0|2,0,0]=4 9303 B12R2.1081 Nc1cccc2c1OCCC2 Amb17569999 [0,1,0,1,0,0|2,0,0]=4 9304 B12R2.1081 Nc1cccc2c1OCCN2 Amb10067597 [0,1,0,1,0,0|2,0,0]=4 9305 B12R2.1081 Nc1cncc2c1NCCC2 Amb10879382 [0,1,0,1,0,0|2,0,0]=4 9306 B12R2.1081 Nc1nccc2c1CCNC2 Amb10602797 [0,1,0,1,0,0|2,0,0]=4 9307 B12R2.1081 O=C1C=CC=C2NCCCN21 Amb19516189 [0,1,0,1,0,0|2,0,0]=4 9308 B12R2.1081 O=C1C=CC=C2NCCCN21 Amb19516338 [0,1,0,1,0,0|2,0,0]=4 9309 B12R2.1081 O=C1CCC[13c]2[13cH][13cH][13cH][13cH][13c]21 Amb22056230 [0,1,0,1,0,0|2,0,0]=4 9310 B12R2.1081 O=C1CCNc2c1cccc2 Amb10067080 [0,1,0,1,0,0|1,0,1]=4 9311 B12R2.1081 O=C1CCOc2c1cccc2 Amb1153759 [0,1,0,1,0,0|2,0,0]=4 9312 B12R2.1081 O=C1CCSc2c1cccc2 Amb1151631 [0,1,0,1,0,0|2,0,0]=4 9313 B12R2.1081 O=C1CNCc2ccccc21 Amb22494722 [0,1,0,1,0,0|1,0,1]=4 9314 B12R2.1081 O=C1CNNc2ccccc21 Amb22057606 [0,1,0,1,0,0|0,0,1]=3 9315 B12R2.1081 O=C1CNNc2ccccc21 Amb22494235 [0,1,0,1,0,0|0,0,1]=3 9316 B12R2.1081 O=C1CNOc2ccccc21 Amb25086617 [0,1,0,1,0,0|1,0,1]=4 9317 B12R2.1081 O=C1COCc2c1cccc2 Amb10067824 [0,1,0,1,0,0|2,0,0]=4 9318 B12R2.1081 O=C1NC=CC=2CCCNC21 Amb24340456 [0,1,0,1,0,0|2,0,0]=4 9319 B12R2.1081 O=C1NC=CC=2CNCCC21 Amb21928075 [0,1,0,1,0,0|2,0,0]=4 9320 B12R2.1081 O=C1NC=CC=2CNCCC21 Amb22001417 [0,1,0,1,0,0|2,0,0]=4 9321 B12R2.1081 O=C1NC=CC=2NCCCC21 Amb22304713 [0,1,0,1,0,0|2,0,0]=4 9322 B12R2.1081 O=C1NCC[n+]2ccccc21 Amb23437947 [0,1,0,1,0,0|2,0,0]=4 9323 B12R2.1081 O=C1NCCc2[n]cccc21 Amb22002362 [0,1,0,1,0,0|2,0,0]=4 9324 B12R2.1081 O=C1NCCc2c1cccc2 Amb2502473 [0,1,0,1,0,0|1,0,0]=3 9325 B12R2.1081 O=C1NCCc2c[n]ccc21 Amb23455308 [0,1,0,1,0,0|2,0,0]=4 9326 B12R2.1081 O=C1NCCc2cc[n]cc21 Amb18202262 [0,1,0,1,0,0|2,0,0]=4 9327 B12R2.1081 O=C1NCCc2ccc[n]c21 Amb22234340 [0,1,0,1,0,0|2,0,0]=4 9328 B12R2.1081 O=C1NCOc2ccccc21 Amb24104580 [0,1,0,1,0,0|2,0,0]=4 9329 B12R2.1081 O=C1OCCc2c1cccc2 Amb16232507 [0,1,0,1,0,0|2,0,0]=4 9330 B12R2.1081 O=C1SCCc2ccccc21 Amb24484481 [0,1,0,1,0,0|2,0,0]=4 9331 B12R2.1081 O=S1CCNc2c1cccc2 Amb1106281 [0,1,0,1,0,0|2,0,0]=4 9332 B12R2.1081 O=c1cccc2NCCC[n]21 Amb22227688 [0,1,0,1,0,0|2,0,0]=4 9333 B12R2.1081 O=c1cccc2NCCC[n]21 Amb22227689 [0,1,0,1,0,0|2,0,0]=4 9334 B12R2.1081 OB1OCCc2c1cccc2 Amb10070693 [0,1,0,1,0,0|2,0,0]=4 9335 B12R2.1081 OC1=CNNc2ccccc21 Amb22057612 [0,1,0,1,0,0|0,0,2]=4 9336 B12R2.1081 OC1CC=Cc2ccccc21 Amb25122696 [0,1,0,1,0,0|2,0,0]=4 9337 B12R2.1081 OC1CCCc2c1cccc2 Amb1151324 [0,1,0,1,0,0|2,0,0]=4 9338 B12R2.1081 OC1CCNc2c1cccc2 Amb10553386 [0,1,0,1,0,0|1,0,0]=3 9339 B12R2.1081 OC1CCNc2ccccc21 Amb22276045 [0,1,0,1,0,0|1,0,0]=3 9340 B12R2.1081 OC1CCNc2ccccc21 Amb22497677 [0,1,0,1,0,0|1,0,0]=3 9341 B12R2.1081 OC1CNCc2[n]cccc21 Amb18201914 [0,1,0,1,0,0|2,0,0]=4 9342 B12R2.1081 OC1CNCc2c1cccc2 Amb16233378 [0,1,0,1,0,0|1,0,0]=3 9343 B12R2.1081 OC1CNCc2ccccc21 Amb22587041 [0,1,0,1,0,0|1,0,0]=3 9344 B12R2.1081 OC1COCc2ccccc21 Amb20171360 [0,1,0,1,0,0|2,0,0]=4 9345 B12R2.1081 ON1CCCc2ccccc12 Amb24085481 [0,1,0,1,0,0|1,0,0]=3 9346 B12R2.1081 O[C@@H]1CCCc2ccccc21 Amb22337827 [0,1,0,1,0,0|2,0,0]=4 9347 B12R2.1081 O[C@@H]1CCSc2c1cccc2 Amb13952924 [0,1,0,1,0,0|2,0,0]=4 9348 B12R2.1081 O[C@@H]1CNCc2ccccc21 Amb24746212 [0,1,0,1,0,0|1,0,0]=3 9349 B12R2.1081 O[C@@H]1COCc2ccccc21 Amb22748516 [0,1,0,1,0,0|2,0,0]=4 9350 B12R2.1081 O[C@H]1CCCc2ccccc21 Amb22336192 [0,1,0,1,0,0|2,0,0]=4 9351 B12R2.1081 O[C@H]1CCSc2c1cccc2 Amb13952926 [0,1,0,1,0,0|2,0,0]=4 9352 B12R2.1081 O[C@H]1CNCc2ccccc21 Amb24533225 [0,1,0,1,0,0|1,0,0]=3 9353 B12R2.1081 O[C@H]1COCc2ccccc21 Amb25748982 [0,1,0,1,0,0|2,0,0]=4 9354 B12R2.1081 Oc1c[n]cc2CCCNc21 Amb20241773 [0,1,0,1,0,0|2,0,0]=4 9355 B12R2.1081 Oc1c[n]cc2CNCCc21 Amb24439308 [0,1,0,1,0,0|2,0,0]=4 9356 B12R2.1081 Oc1c[n]cc2NCCCc21 Amb18125144 [0,1,0,1,0,0|2,0,0]=4 9357 B12R2.1081 Oc1cccc2C=CCCc21 Amb18644266 [0,1,0,1,0,0|2,0,0]=4 9358 B12R2.1081 Oc1cccc2CCC=Cc21 Amb18644265 [0,1,0,1,0,0|2,0,0]=4 9359 B12R2.1081 Oc1cccc2CCCOc21 Amb25142441 [0,1,0,1,0,0|2,0,0]=4 9360 B12R2.1081 Oc1cccc2CCCSc21 Amb24715725 [0,1,0,1,0,0|2,0,0]=4 9361 B12R2.1081 Oc1cccc2CCNCc21 Amb21858715 [0,1,0,1,0,0|1,0,0]=3 9362 B12R2.1081 Oc1cccc2CCNCc21 Amb22756331 [0,1,0,1,0,0|1,0,0]=3 9363 B12R2.1081 Oc1cccc2CNCCc21 Amb21858675 [0,1,0,1,0,0|1,0,0]=3 9364 B12R2.1081 Oc1cccc2CNCCc21 Amb23403654 [0,1,0,1,0,0|1,0,0]=3 9365 B12R2.1081 Oc1cccc2COCCc21 Amb24417190 [0,1,0,1,0,0|2,0,0]=4 9366 B12R2.1081 Oc1cccc2NCCCc21 Amb18124994 [0,1,0,1,0,0|1,0,0]=3 9367 B12R2.1081 Oc1cccc2NCCNc21 Amb20080169 [0,1,0,1,0,0|2,0,0]=4 9368 B12R2.1081 Oc1cccc2c1CCCC2 Amb2041248 [0,1,0,1,0,0|2,0,0]=4 9369 B12R2.1081 Oc1cccc2c1CNCC2 Amb10067195 [0,1,0,1,0,0|1,0,0]=3 9370 B12R2.1081 Oc1cccc2c1NCCC2 Amb1057683 [0,1,0,1,0,0|1,0,0]=3 9371 B12R2.1081 [NH3+]C1CCCc2ccccc21 Amb24113843 [0,1,0,1,0,0|1,0,1]=4 9372 B12R2.1081 [NH3+]C1CCOc2ccccc21 Amb21862674 [0,1,0,1,0,0|1,0,1]=4 9373 B12R2.2028 C=C1CC(Cl)c2ccccc21 Amb24513606 [0,1,0,1,0,0|2,0,0]=4 9374 B12R2.2028 C=C1C[C@@H](O)c2ccccc21 Amb25149657 [0,1,0,1,0,0|2,0,0]=4 9375 B12R2.2028 CC1CC(Br)c2ccccc21 Amb25131825 [0,1,0,1,0,0|2,0,0]=4 9376 B12R2.2028 CC1CC(N)c2ccccc21 Amb19373084 [0,1,0,1,0,0|1,0,0]=3 9377 B12R2.2028 CC1CC(O)c2ccccc21 Amb25709313 [0,1,0,1,0,0|2,0,0]=4 9378 B12R2.2028 CC1CC(S)c2ccccc21 Amb24465175 [0,1,0,1,0,0|2,0,0]=4 9379 B12R2.2028 CC1CN(N)c2ccccc21 Amb24519067 [0,1,0,1,0,0|0,0,0]=2 9380 B12R2.2028 CC1N=C(N)c2ccccc21 Amb24426364 [0,1,0,1,0,0|2,0,0]=4 9381 B12R2.2028 CN1CC(O)c2ccccc12 Amb24632103 [0,1,0,1,0,0|1,0,0]=3 9382 B12R2.2028 CN1CN(C)c2ccccc12 Amb24092822 [0,1,0,1,0,0|2,0,0]=4 9383 B12R2.2028 C[C@@H]1CC(=O)c2ccccc21 Amb24467053 [0,1,0,1,0,0|2,0,0]=4 9384 B12R2.2028 C[C@@H]1CC(O)c2ccccc21 Amb25188702 [0,1,0,1,0,0|2,0,0]=4 9385 B12R2.2028 C[C@@H]1C[C@H](Br)c2ccccc21 Amb24741831 [0,1,0,1,0,0|2,0,0]=4 9386 B12R2.2028 C[C@H]1CC(=O)c2ccccc21 Amb25768595 [0,1,0,1,0,0|2,0,0]=4 9387 B12R2.2028 C[C@H]1CC(O)c2ccccc21 Amb24533800 [0,1,0,1,0,0|2,0,0]=4 9388 B12R2.2028 C[C@H]1C[C@@H](O)c2ccccc21 Amb24740911 [0,1,0,1,0,0|2,0,0]=4 9389 B12R2.2028 Cc1c[n](N)c2ccccc21 Amb24608862 [0,1,0,1,0,0|0,0,2]=4 9390 B12R2.2028 N=C1CN(O)c2ccccc21 Amb24078909 [0,1,0,1,0,0|1,0,1]=4 9391 B12R2.2028 NC1CC(=O)c2ccccc21 Amb21955324 [0,1,0,1,0,0|1,0,1]=4 9392 B12R2.2028 NC1CC(F)c2ccccc21 Amb24117897 [0,1,0,1,0,0|1,0,0]=3 9393 B12R2.2028 NC1CC(F)c2ccccc21 Amb24361429 [0,1,0,1,0,0|1,0,0]=3 9394 B12R2.2028 N[C@@H]1CC(O)c2ccccc21 Amb25317541 [0,1,0,1,0,0|1,0,0]=3 9395 B12R2.2028 N[C@@H]1C[C@@H](O)c2ccccc21 Amb25213011 [0,1,0,1,0,0|1,0,0]=3 9396 B12R2.2028 N[C@@H]1C[C@H](O)c2ccccc21 Amb24657326 [0,1,0,1,0,0|1,0,0]=3 9397 B12R2.2028 N[C@H]1CC(O)c2ccccc21 Amb25716664 [0,1,0,1,0,0|1,0,0]=3 9398 B12R2.2028 N[n]1[n]c(Br)c2ccccc12 Amb24741933 [0,1,0,1,0,0|1,0,1]=4 9399 B12R2.2028 N[n]1[n]c(I)c2ccccc12 Amb24615979 [0,1,0,1,0,0|1,0,1]=4 9400 B12R2.2028 Nc1[n][n](N)c2ccccc12 Amb24089069 [0,1,0,1,0,0|1,0,1]=4 9401 B12R2.2028 O=C1CC(c2c1cccc2)Br Amb10068269 [0,1,0,1,0,0|2,0,0]=4 9402 B12R2.2028 O=C1CC(c2c1cccc2)N Amb17470381 [0,1,0,1,0,0|1,0,1]=4 9403 B12R2.2028 OC1CC(c2c1cccc2)N Amb17470387 [0,1,0,1,0,0|1,0,0]=3 9404 B12R2.2028 OC1CC(c2c1cccc2)O Amb1110942 [0,1,0,1,0,0|2,0,0]=4 9405 B12R2.2028 ON1CC(=O)c2ccccc12 Amb24078911 [0,1,0,1,0,0|1,0,1]=4 9406 B12R2.2028 O[C@@H]1CC(=O)c2ccccc21 Amb24724027 [0,1,0,1,0,0|2,0,0]=4 9407 B12R2.2028 O[C@H]1CC(=O)c2ccccc21 Amb25188743 [0,1,0,1,0,0|2,0,0]=4 9408 B12R2.2028 O[C@H]1C[C@@H](O)c2ccccc12 Amb17938072 [0,1,0,1,0,0|2,0,0]=4 9409 B12R2.2028 O[C@H]1C[C@@H](c2c1cccc2)O Amb10068281 [0,1,0,1,0,0|2,0,0]=4 9410 B12R2.2047 CC1C(CO)c2ccccc21 Amb24541544 [0,1,0,1,0,0|2,0,0]=4 9411 B12R2.2047 N#CC1C(Cl)c2ccccc21 Amb25257929 [0,1,0,1,0,0|1,0,1]=4 9412 B12R2.2075 BrC(C1CC1)c2ccccc2 Amb25205179 [0,1,0,1,0,0|2,0,0]=4 9413 B12R2.2075 ClC(C1CC1)c2ccccc2 Amb18792883 [0,1,0,1,0,0|2,0,0]=4 9414 B12R2.2075 FC(C1CO1)c2ccccc2 Amb24611783 [0,1,0,1,0,0|2,0,0]=4 9415 B12R2.2075 NC(c1ccccc1)C2CC2 Amb2371625 [0,1,0,1,0,0|2,0,0]=4 9416 B12R2.2075 N[C@@H](C1CC1)c2ccccc2 Amb22406367 [0,1,0,1,0,0|2,0,0]=4 9417 B12R2.2075 N[C@@H](C1CC1)c2ccccc2 Amb22744981 [0,1,0,1,0,0|2,0,0]=4 9418 B12R2.2075 N[C@H](C1CC1)c2ccccc2 Amb22406366 [0,1,0,1,0,0|2,0,0]=4 9419 B12R2.2075 O[C@@H]([C@H]1CO1)c2ccccc2 Amb24700386 [0,1,0,1,0,0|2,0,0]=4 9420 B12R2.2075 O[C@H](C1CC1)c2ccccc2 Amb25260486 [0,1,0,1,0,0|2,0,0]=4 9421 B12R2.2075 O[C@H]([C@@H]1CO1)c2ccccc2 Amb24718405 [0,1,0,1,0,0|2,0,0]=4 9422 B12R2.2075 SC(C1CC1)c2ccccc2 Amb18788326 [0,1,0,1,0,0|2,0,0]=4 9423 B12R2.32 BrCC1Cc2c(O1)cccc2 Amb17040446 [0,1,0,1,0,0|2,0,0]=4 9424 B12R2.32 BrCC1Cc2ccccc2C1 Amb22235471 [0,1,0,1,0,0|2,0,0]=4 9425 B12R2.32 BrC[C@H]1Cc2ccccc2O1 Amb25695955 [0,1,0,1,0,0|2,0,0]=4 9426 B12R2.32 C#CC1Cc2ccccc2C1 Amb24074759 [0,1,0,1,0,0|2,0,0]=4 9427 B12R2.32 CNC1Cc2ccccc2C1 Amb21955693 [0,1,0,1,0,0|1,0,0]=3 9428 B12R2.32 COC1Cc2ccccc2O1 Amb24084536 [0,1,0,1,0,0|2,0,0]=4 9429 B12R2.32 CSC1Cc2ccccc2C1 Amb25712718 [0,1,0,1,0,0|2,0,0]=4 9430 B12R2.32 ClCC1Cc2ccccc2S1 Amb24688554 [0,1,0,1,0,0|2,0,0]=4 9431 B12R2.32 FCC1Cc2ccccc2N1 Amb25276456 [0,1,0,1,0,0|2,0,0]=4 9432 B12R2.32 FC[C@@H]1Cc2ccccc2N1 Amb25041577 [0,1,0,1,0,0|2,0,0]=4 9433 B12R2.32 ICC1Cc2ccccc2N1 Amb24061262 [0,1,0,1,0,0|2,0,0]=4 9434 B12R2.32 ICC1Cc2ccccc2O1 Amb23513694 [0,1,0,1,0,0|2,0,0]=4 9435 B12R2.32 N#CC1Cc2ccccc2O1 Amb24384661 [0,1,0,1,0,0|1,0,1]=4 9436 B12R2.32 N#CC1Cc2ccccc2S1 Amb24465725 [0,1,0,1,0,0|1,0,1]=4 9437 B12R2.32 NCC1Cc2c(O1)cccc2 Amb1088943 [0,1,0,1,0,0|1,0,0]=3 9438 B12R2.32 NCC1Cc2ccc[n]c2C1 Amb25117954 [0,1,0,1,0,0|2,0,0]=4 9439 B12R2.32 NCC1Cc2ccccc2C1 Amb19287049 [0,1,0,1,0,0|1,0,0]=3 9440 B12R2.32 NCC1Nc2ccccc2N1 Amb24334873 [0,1,0,1,0,0|2,0,0]=4 9441 B12R2.32 NCC1Oc2ccccc2O1 Amb24060644 [0,1,0,1,0,0|2,0,0]=4 9442 B12R2.32 NCC=1Cc2ccccc2C1 Amb25178878 [0,1,0,1,0,0|1,0,1]=4 9443 B12R2.32 NN=C1Cc2ccccc2C1 Amb25279861 [0,1,0,1,0,0|0,0,2]=4 9444 B12R2.32 NNC1Cc2c(C1)cccc2 Amb10071076 [0,1,0,1,0,0|0,0,0]=2 9445 B12R2.32 NNC1Cc2ccccc2C1 Amb19890159 [0,1,0,1,0,0|0,0,0]=2 9446 B12R2.32 NNC1Cc2ccccc2C1 Amb21954062 [0,1,0,1,0,0|0,0,0]=2 9447 B12R2.32 NNC=1Cc2ccccc2N1 Amb18644335 [0,1,0,1,0,0|0,0,1]=3 9448 B12R2.32 NNc1cc2ccccc2[nH]1 Amb18124830 [0,1,0,1,0,0|0,0,2]=4 9449 B12R2.32 NNc1cc2ccccc2[s]1 Amb25178744 [0,1,0,1,0,0|0,0,2]=4 9450 B12R2.32 NNc1nc2c([nH]1)cccc2 Amb1068359 [0,1,0,1,0,0|1,0,1]=4 9451 B12R2.32 NNc1nc2c(o1)cccc2 Amb1148180 [0,1,0,1,0,0|1,0,1]=4 9452 B12R2.32 NNc1nc2c(s1)cccc2 Amb1101127 [0,1,0,1,0,0|1,0,1]=4 9453 B12R2.32 O=CC1Cc2ccccc2C1 Amb18124789 [0,1,0,1,0,0|2,0,0]=4 9454 B12R2.32 OCC1Cc2ccccc2C1 Amb19516120 [0,1,0,1,0,0|2,0,0]=4 9455 B12R2.32 OCC1Cc2ccccc2S1 Amb24513744 [0,1,0,1,0,0|2,0,0]=4 9456 B12R2.32 OC[C@@H]1Cc2ccccc2N1 Amb22336386 [0,1,0,1,0,0|2,0,0]=4 9457 B12R2.32 OC[C@H]1Cc2ccccc2N1 Amb24746775 [0,1,0,1,0,0|2,0,0]=4 9458 B12R2.32 ONC1Nc2ccccc2O1 Amb24523067 [0,1,0,1,0,0|2,0,0]=4 9459 B12R2.32 SCC1Cc2ccccc2S1 Amb25149129 [0,1,0,1,0,0|2,0,0]=4 9460 B12R2.115 BrC1CC1c2ccccc2I Amb25150585 [0,1,0,1,0,0|2,0,0]=4 9461 B12R2.115 Brc1ccccc1C2CC2Br Amb23454930 [0,1,0,1,0,0|2,0,0]=4 9462 B12R2.115 CC1CC1c2ccccc2Br Amb23247715 [0,1,0,1,0,0|2,0,0]=4 9463 B12R2.115 CC1CC1c2ccccc2N Amb24378033 [0,1,0,1,0,0|2,0,0]=4 9464 B12R2.115 C[C@@H]1C[C@H]1c2ccccc2N Amb24581604 [0,1,0,1,0,0|2,0,0]=4 9465 B12R2.115 C[C@@H]1C[C@H]1c2ccccc2O Amb25373423 [0,1,0,1,0,0|2,0,0]=4 9466 B12R2.115 C[C@H]1C[C@@H]1c2ccccc2N Amb25228469 [0,1,0,1,0,0|2,0,0]=4 9467 B12R2.115 C[C@H]1C[C@H]1c2ccccc2N Amb24514820 [0,1,0,1,0,0|2,0,0]=4 9468 B12R2.115 Cc1cc[n]cc1C2CC2N Amb25824994 [0,1,0,1,0,0|2,0,0]=4 9469 B12R2.115 Cc1ccccc1C2CC2Br Amb24484845 [0,1,0,1,0,0|2,0,0]=4 9470 B12R2.115 Cc1ccccc1C2CC2N Amb19374843 [0,1,0,1,0,0|1,0,0]=3 9471 B12R2.115 Cc1ccccc1C2CC2O Amb24526800 [0,1,0,1,0,0|2,0,0]=4 9472 B12R2.115 Cc1ccccc1[C@@H]2C[C@@H]2Br Amb24718273 [0,1,0,1,0,0|2,0,0]=4 9473 B12R2.115 Cc1ccccc1[C@@H]2C[C@@H]2Cl Amb25176073 [0,1,0,1,0,0|2,0,0]=4 9474 B12R2.115 Cc1ccccc1[C@@H]2C[C@H]2Br Amb24624562 [0,1,0,1,0,0|2,0,0]=4 9475 B12R2.115 Cc1ccccc1[C@@H]2C[C@H]2Cl Amb24540820 [0,1,0,1,0,0|2,0,0]=4 9476 B12R2.115 Cc1ccccc1[C@@H]2C[C@H]2N Amb24560305 [0,1,0,1,0,0|1,0,0]=3 9477 B12R2.115 Clc1ccccc1C2CC2Br Amb23454909 [0,1,0,1,0,0|2,0,0]=4 9478 B12R2.115 Fc1ccccc1C2CC2Br Amb23454901 [0,1,0,1,0,0|2,0,0]=4 9479 B12R2.115 NC1CC1c2ccccc2Br Amb19373270 [0,1,0,1,0,0|1,0,0]=3 9480 B12R2.115 NC1CC1c2ccccc2Cl Amb19346493 [0,1,0,1,0,0|1,0,0]=3 9481 B12R2.115 NC1CC1c2ccccc2F Amb19514922 [0,1,0,1,0,0|1,0,0]=3 9482 B12R2.115 NC1CC1c2ccccc2O Amb25223496 [0,1,0,1,0,0|1,0,0]=3 9483 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2Cl Amb25095403 [0,1,0,1,0,0|1,0,0]=3 9484 B12R2.196 C=C1CCc2c(Br)cccc21 Amb24380342 [0,1,0,1,0,0|2,0,0]=4 9485 B12R2.196 C=C1CCc2c(Cl)cccc21 Amb22229727 [0,1,0,1,0,0|2,0,0]=4 9486 B12R2.196 C=C1CCc2c(F)cccc21 Amb24334153 [0,1,0,1,0,0|2,0,0]=4 9487 B12R2.196 CC1CCc2c(O)cccc21 Amb24099162 [0,1,0,1,0,0|2,0,0]=4 9488 B12R2.196 CN1CCc2c(Br)cccc12 Amb24396224 [0,1,0,1,0,0|1,0,0]=3 9489 B12R2.196 CN1CCc2c(N)cccc12 Amb18669647 [0,1,0,1,0,0|1,0,0]=3 9490 B12R2.196 CN1CCc2c(O)cc[n]c12 Amb24435928 [0,1,0,1,0,0|2,0,0]=4 9491 B12R2.196 CN1CCc2c1cccc2O Amb17593716 [0,1,0,1,0,0|1,0,0]=3 9492 B12R2.196 Cc1cc[n]c2C(N)CCc21 Amb25769226 [0,1,0,1,0,0|2,0,0]=4 9493 B12R2.196 Cc1cccc2C(=C)CCc21 Amb25071609 [0,1,0,1,0,0|2,0,0]=4 9494 B12R2.196 Cc1cccc2C(Br)CCc21 Amb25319083 [0,1,0,1,0,0|2,0,0]=4 9495 B12R2.196 Cc1cccc2C(N)CCc21 Amb19514831 [0,1,0,1,0,0|1,0,0]=3 9496 B12R2.196 Cc1cccc2[C@@H](N)CCc21 Amb25145813 [0,1,0,1,0,0|1,0,0]=3 9497 B12R2.196 Cc1cccc2[C@@H](N)COc21 Amb24589207 [0,1,0,1,0,0|2,0,0]=4 9498 B12R2.196 Cc1cccc2[C@H](N)COc21 Amb25689740 [0,1,0,1,0,0|2,0,0]=4 9499 B12R2.196 Cc1cccc2c1c[n][n]2N Amb24538278 [0,1,0,1,0,0|1,0,1]=4 9500 B12R2.196 Cc1cccc2c1cc[n]2N Amb18202354 [0,1,0,1,0,0|0,0,2]=4 9501 B12R2.196 ClC1CCc2c(Br)cccc21 Amb22059235 [0,1,0,1,0,0|2,0,0]=4 9502 B12R2.196 ClC1CCc2c1cccc2C Amb17087981 [0,1,0,1,0,0|2,0,0]=4 9503 B12R2.196 ClC1CCc2c1cccc2Cl Amb17087984 [0,1,0,1,0,0|2,0,0]=4 9504 B12R2.196 ClC1CCc2c1cccc2F Amb17087983 [0,1,0,1,0,0|2,0,0]=4 9505 B12R2.196 Fc1cccc2C(Br)CCc21 Amb20623563 [0,1,0,1,0,0|2,0,0]=4 9506 B12R2.196 Fc1cccc2C(F)CCc12 Amb24514103 [0,1,0,1,0,0|2,0,0]=4 9507 B12R2.196 NC1CCN2C(=O)C=CC=C21 Amb24514617 [0,1,0,1,0,0|2,0,0]=4 9508 B12R2.196 NC1CCc2c(Br)cccc21 Amb19342600 [0,1,0,1,0,0|1,0,0]=3 9509 B12R2.196 NC1CCc2c(I)cccc21 Amb25691610 [0,1,0,1,0,0|1,0,0]=3 9510 B12R2.196 NC1CCc2c1cccc2Cl Amb10609924 [0,1,0,1,0,0|1,0,0]=3 9511 B12R2.196 NC1CCc2c1cccc2Cl Amb2383228 [0,1,0,1,0,0|1,0,0]=3 9512 B12R2.196 NC1CCc2c1cccc2F Amb10609944 [0,1,0,1,0,0|1,0,0]=3 9513 B12R2.196 NC1CCc2c1cccc2F Amb2383229 [0,1,0,1,0,0|1,0,0]=3 9514 B12R2.196 NC1COc2c(Cl)cccc21 Amb20626374 [0,1,0,1,0,0|2,0,0]=4 9515 B12R2.196 NC1COc2c(F)cccc21 Amb22586304 [0,1,0,1,0,0|2,0,0]=4 9516 B12R2.196 NC1COc2c(S)cccc21 Amb24533042 [0,1,0,1,0,0|2,0,0]=4 9517 B12R2.196 NC1COc2c1cccc2Cl Amb2383238 [0,1,0,1,0,0|2,0,0]=4 9518 B12R2.196 NC1COc2c1cccc2F Amb2383239 [0,1,0,1,0,0|2,0,0]=4 9519 B12R2.196 N[C@@H]1CCc2c(Br)cccc21 Amb22288665 [0,1,0,1,0,0|1,0,0]=3 9520 B12R2.196 N[C@@H]1CCc2c(F)cccc21 Amb22288666 [0,1,0,1,0,0|1,0,0]=3 9521 B12R2.196 N[C@@H]1CCc2c(F)cccc21 Amb22746050 [0,1,0,1,0,0|1,0,0]=3 9522 B12R2.196 N[C@@H]1CCc2c(I)cccc21 Amb25697307 [0,1,0,1,0,0|1,0,0]=3 9523 B12R2.196 N[C@@H]1CCc2c(S)cccc21 Amb24484494 [0,1,0,1,0,0|1,0,0]=3 9524 B12R2.196 N[C@@H]1CCc2c1cccc2Cl Amb13953028 [0,1,0,1,0,0|1,0,0]=3 9525 B12R2.196 N[C@@H]1COc2c(Br)cccc21 Amb25055297 [0,1,0,1,0,0|2,0,0]=4 9526 B12R2.196 N[C@@H]1COc2c(F)cccc21 Amb25060202 [0,1,0,1,0,0|2,0,0]=4 9527 B12R2.196 N[C@@H]1COc2c(I)cccc21 Amb24561110 [0,1,0,1,0,0|2,0,0]=4 9528 B12R2.196 N[C@@H]1COc2c(O)cccc21 Amb25837299 [0,1,0,1,0,0|2,0,0]=4 9529 B12R2.196 N[C@@H]1COc2c(S)cccc21 Amb24484516 [0,1,0,1,0,0|2,0,0]=4 9530 B12R2.196 N[C@H]1CCc2c(Br)cccc21 Amb22288709 [0,1,0,1,0,0|1,0,0]=3 9531 B12R2.196 N[C@H]1CCc2c(F)cccc21 Amb22388651 [0,1,0,1,0,0|1,0,0]=3 9532 B12R2.196 N[C@H]1CCc2c1cccc2Cl Amb13953027 [0,1,0,1,0,0|1,0,0]=3 9533 B12R2.196 N[C@H]1CCc2c1cccc2F Amb16233799 [0,1,0,1,0,0|1,0,0]=3 9534 B12R2.196 N[C@H]1COc2c(S)cccc21 Amb25791602 [0,1,0,1,0,0|2,0,0]=4 9535 B12R2.196 N[n]1[n][n]c2c(O)cccc12 Amb25093772 [0,1,0,1,0,0|2,0,0]=4 9536 B12R2.196 N[n]1ccc2c(Cl)cccc12 Amb18827406 [0,1,0,1,0,0|0,0,2]=4 9537 B12R2.196 N[n]1ccc2c(F)cccc12 Amb18201963 [0,1,0,1,0,0|0,0,2]=4 9538 B12R2.196 Nc1cccc2C(N)CCc12 Amb24436510 [0,1,0,1,0,0|1,0,0]=3 9539 B12R2.196 Nc1cccc2C(N)COc12 Amb24671202 [0,1,0,1,0,0|2,0,0]=4 9540 B12R2.196 Nc1cccc2[C@H](N)COc12 Amb24484515 [0,1,0,1,0,0|2,0,0]=4 9541 B12R2.196 Nc1cccc2c1cc[n]2N Amb25326417 [0,1,0,1,0,0|0,0,2]=4 9542 B12R2.196 O=C1CCc2c1cccc2Cl Amb2383535 [0,1,0,1,0,0|2,0,0]=4 9543 B12R2.196 O=C1CCc2c1cccc2F Amb2383536 [0,1,0,1,0,0|2,0,0]=4 9544 B12R2.196 O=C1CCc2c1cccc2I Amb10602518 [0,1,0,1,0,0|2,0,0]=4 9545 B12R2.196 O=C1CCc2c1cccc2N Amb10067615 [0,1,0,1,0,0|2,0,0]=4 9546 B12R2.196 O=C1CCc2c1cccc2O Amb1158068 [0,1,0,1,0,0|2,0,0]=4 9547 B12R2.196 OC1CCc2c(Br)cccc21 Amb20171517 [0,1,0,1,0,0|2,0,0]=4 9548 B12R2.196 OC1CCc2c1cccc2C Amb17087931 [0,1,0,1,0,0|2,0,0]=4 9549 B12R2.196 OC1CCc2c1cccc2Cl Amb17087934 [0,1,0,1,0,0|2,0,0]=4 9550 B12R2.196 OC1CCc2c1cccc2F Amb17087933 [0,1,0,1,0,0|2,0,0]=4 9551 B12R2.196 O[C@@H]1CCc2c(Br)cccc21 Amb22756414 [0,1,0,1,0,0|2,0,0]=4 9552 B12R2.196 O[C@@H]1CCc2c(F)cccc21 Amb24432762 [0,1,0,1,0,0|2,0,0]=4 9553 B12R2.196 O[C@@H]1CCc2c1cccc2Cl Amb13953026 [0,1,0,1,0,0|2,0,0]=4 9554 B12R2.196 O[C@H]1CCc2c1cccc2Cl Amb13953025 [0,1,0,1,0,0|2,0,0]=4 9555 B12R2.196 Oc1cccc2C(F)CCc21 Amb24511704 [0,1,0,1,0,0|2,0,0]=4 9556 B12R2.196 Oc1cccc2C(O)CCc12 Amb18179372 [0,1,0,1,0,0|2,0,0]=4 9557 B12R2.196 Oc1cccc2[C@@H](O)CCc12 Amb25032411 [0,1,0,1,0,0|2,0,0]=4 9558 B12R2.196 SC1CCc2c(Br)cccc21 Amb24352616 [0,1,0,1,0,0|2,0,0]=4 9559 B12R2.225 Cc1ccccc1CC2CO2 Amb25122222 [0,1,0,1,0,0|2,0,0]=4 9560 B12R2.225 Clc1ccccc1CC2CO2 Amb25094935 [0,1,0,1,0,0|2,0,0]=4 9561 B12R2.225 Nc1ccccc1CC2CC2 Amb24117001 [0,1,0,1,0,0|2,0,0]=4 9562 B12R2.225 Oc1ccccc1CC2CC2 Amb22752448 [0,1,0,1,0,0|2,0,0]=4 9563 B12R2.225 Oc1ccccc1CC2CO2 Amb24364096 [0,1,0,1,0,0|2,0,0]=4 9564 B12R2.225 Oc1ccccc1C[C@@H]2CO2 Amb24724020 [0,1,0,1,0,0|2,0,0]=4 9565 B12R2.517 Brc1[n]cccc1C2CCN2 Amb24663934 [0,1,0,1,0,0|2,0,0]=4 9566 B12R2.517 Brc1[n]cccc1[C@@H]2CCN2 Amb25083253 [0,1,0,1,0,0|2,0,0]=4 9567 B12R2.517 Brc1c[n]ccc1C2CCN2 Amb25103778 [0,1,0,1,0,0|2,0,0]=4 9568 B12R2.517 Brc1cc[n]cc1C2CNC2 Amb25075765 [0,1,0,1,0,0|2,0,0]=4 9569 B12R2.517 Brc1cc[n]cc1[C@@H]2CCN2 Amb24628506 [0,1,0,1,0,0|2,0,0]=4 9570 B12R2.517 Brc1ccccc1C2CCC2 Amb20617096 [0,1,0,1,0,0|2,0,0]=4 9571 B12R2.517 Brc1ccccc1C2CCN2 Amb22054565 [0,1,0,1,0,0|1,0,0]=3 9572 B12R2.517 Brc1ccccc1[C@@H]2CCN2 Amb25301204 [0,1,0,1,0,0|1,0,0]=3 9573 B12R2.517 Brc1ccccc1[C@H]2CCN2 Amb25805155 [0,1,0,1,0,0|1,0,0]=3 9574 B12R2.517 Cc1[n]cccc1[C@@H]2CCN2 Amb24715914 [0,1,0,1,0,0|2,0,0]=4 9575 B12R2.517 Cc1c[n]ccc1[C@H]2CCN2 Amb24376720 [0,1,0,1,0,0|2,0,0]=4 9576 B12R2.517 Cc1cc[n]cc1C2CCN2 Amb24597648 [0,1,0,1,0,0|2,0,0]=4 9577 B12R2.517 Cc1cc[n]cc1C2CNC2 Amb25807999 [0,1,0,1,0,0|2,0,0]=4 9578 B12R2.517 Cc1ccc[n]c1C2CCN2 Amb24715730 [0,1,0,1,0,0|2,0,0]=4 9579 B12R2.517 Cc1ccc[n]c1[C@@H]2CCN2 Amb25836870 [0,1,0,1,0,0|2,0,0]=4 9580 B12R2.517 Cc1ccccc1C2CNC2 Amb18065237 [0,1,0,1,0,0|1,0,0]=3 9581 B12R2.517 Cc1ccccc1[C@@H]2CCN2 Amb24446967 [0,1,0,1,0,0|1,0,0]=3 9582 B12R2.517 Cc1ccccc1[C@H]2CCN2 Amb25694410 [0,1,0,1,0,0|1,0,0]=3 9583 B12R2.517 Clc1[n]cccc1C2CCN2 Amb25118003 [0,1,0,1,0,0|2,0,0]=4 9584 B12R2.517 Clc1[n]cccc1[C@H]2CCN2 Amb25367237 [0,1,0,1,0,0|2,0,0]=4 9585 B12R2.517 Clc1c[n]ccc1[C@@H]2CCN2 Amb25836880 [0,1,0,1,0,0|2,0,0]=4 9586 B12R2.517 Clc1c[n]ccc1[C@H]2CCN2 Amb25191270 [0,1,0,1,0,0|2,0,0]=4 9587 B12R2.517 Clc1ccc[n]c1[C@@H]2CCN2 Amb25113502 [0,1,0,1,0,0|2,0,0]=4 9588 B12R2.517 Clc1ccccc1C2CCN2 Amb23555564 [0,1,0,1,0,0|1,0,0]=3 9589 B12R2.517 Clc1ccccc1C2CNC2 Amb18563825 [0,1,0,1,0,0|1,0,0]=3 9590 B12R2.517 Clc1ccccc1C2COC2 Amb25266061 [0,1,0,1,0,0|2,0,0]=4 9591 B12R2.517 Clc1ccccc1[C@@H]2CCN2 Amb25840853 [0,1,0,1,0,0|1,0,0]=3 9592 B12R2.517 Fc1[n]cccc1C2CCN2 Amb25694371 [0,1,0,1,0,0|2,0,0]=4 9593 B12R2.517 Fc1[n]cccc1[C@H]2CCN2 Amb25368243 [0,1,0,1,0,0|2,0,0]=4 9594 B12R2.517 Fc1c[n]ccc1[C@@H]2CCN2 Amb24351191 [0,1,0,1,0,0|2,0,0]=4 9595 B12R2.517 Fc1c[n]ccc1[C@H]2CCN2 Amb25145701 [0,1,0,1,0,0|2,0,0]=4 9596 B12R2.517 Fc1ccc[n]c1C2CCN2 Amb25151355 [0,1,0,1,0,0|2,0,0]=4 9597 B12R2.517 Fc1ccc[n]c1[C@H]2CCN2 Amb25843221 [0,1,0,1,0,0|2,0,0]=4 9598 B12R2.517 Fc1ccccc1C2CCN2 Amb20623300 [0,1,0,1,0,0|1,0,0]=3 9599 B12R2.517 Fc1ccccc1C2CCN2 Amb22059455 [0,1,0,1,0,0|1,0,0]=3 9600 B12R2.517 Fc1ccccc1C2CNC2 Amb18065350 [0,1,0,1,0,0|1,0,0]=3 9601 B12R2.517 Fc1ccccc1[C@@H]2CCN2 Amb25145827 [0,1,0,1,0,0|1,0,0]=3 9602 B12R2.517 Ic1ccccc1C2CCN2 Amb25047375 [0,1,0,1,0,0|1,0,0]=3 9603 B12R2.517 Ic1ccccc1[C@@H]2CCN2 Amb25858528 [0,1,0,1,0,0|1,0,0]=3 9604 B12R2.517 Ic1ccccc1[C@H]2CCN2 Amb25116697 [0,1,0,1,0,0|1,0,0]=3 9605 B12R2.517 Nc1[n]cccc1[C@H]2CCN2 Amb25152813 [0,1,0,1,0,0|2,0,0]=4 9606 B12R2.517 Nc1c[n]ccc1C2CCN2 Amb24654762 [0,1,0,1,0,0|2,0,0]=4 9607 B12R2.517 Nc1c[n]ccc1[C@@H]2CCN2 Amb25121090 [0,1,0,1,0,0|2,0,0]=4 9608 B12R2.517 Nc1cc[n]cc1C2CNC2 Amb25347407 [0,1,0,1,0,0|2,0,0]=4 9609 B12R2.517 Nc1ccc[n]c1C2CNC2 Amb24433321 [0,1,0,1,0,0|2,0,0]=4 9610 B12R2.517 Nc1ccc[n]c1[C@@H]2CCN2 Amb25072758 [0,1,0,1,0,0|2,0,0]=4 9611 B12R2.517 Nc1ccccc1C2CCC2 Amb20617097 [0,1,0,1,0,0|2,0,0]=4 9612 B12R2.517 Nc1ccccc1C2CCN2 Amb24484457 [0,1,0,1,0,0|1,0,0]=3 9613 B12R2.517 Nc1ccccc1C2CNC2 Amb25744446 [0,1,0,1,0,0|1,0,0]=3 9614 B12R2.517 Oc1[n]cccc1C2CCN2 Amb24484517 [0,1,0,1,0,0|2,0,0]=4 9615 B12R2.517 Oc1[n]cccc1C2CNC2 Amb25087241 [0,1,0,1,0,0|2,0,0]=4 9616 B12R2.517 Oc1[n]cccc1[C@@H]2CCN2 Amb24599397 [0,1,0,1,0,0|2,0,0]=4 9617 B12R2.517 Oc1[n]cccc1[C@H]2CCN2 Amb25064322 [0,1,0,1,0,0|2,0,0]=4 9618 B12R2.517 Oc1c[n]ccc1C2CCN2 Amb24670199 [0,1,0,1,0,0|2,0,0]=4 9619 B12R2.517 Oc1c[n]ccc1[C@@H]2CCN2 Amb24484440 [0,1,0,1,0,0|2,0,0]=4 9620 B12R2.517 Oc1c[n]ccc1[C@H]2CCN2 Amb24604348 [0,1,0,1,0,0|2,0,0]=4 9621 B12R2.517 Oc1cc[n]cc1C2CNC2 Amb25724344 [0,1,0,1,0,0|2,0,0]=4 9622 B12R2.517 Oc1ccc[n]c1C2CCN2 Amb25703086 [0,1,0,1,0,0|2,0,0]=4 9623 B12R2.517 Oc1ccc[n]c1C2CNC2 Amb24429190 [0,1,0,1,0,0|2,0,0]=4 9624 B12R2.517 Oc1ccc[n]c1[C@H]2CCN2 Amb25191269 [0,1,0,1,0,0|2,0,0]=4 9625 B12R2.517 Oc1ccccc1C2CCC2 Amb20617098 [0,1,0,1,0,0|2,0,0]=4 9626 B12R2.517 Oc1ccccc1C2CCN2 Amb24715881 [0,1,0,1,0,0|1,0,0]=3 9627 B12R2.517 Oc1ccccc1C2CNC2 Amb22228635 [0,1,0,1,0,0|1,0,0]=3 9628 B12R2.517 Oc1ccccc1C2COC2 Amb22737352 [0,1,0,1,0,0|2,0,0]=4 9629 B12R2.517 Oc1ccccc1[C@H]2CCN2 Amb25111618 [0,1,0,1,0,0|1,0,0]=3 9630 B12R2.517 Sc1ccccc1[C@@H]2CCN2 Amb25736329 [0,1,0,1,0,0|1,0,0]=3 9631 B12R2.517 Sc1ccccc1[C@H]2CCN2 Amb25152747 [0,1,0,1,0,0|1,0,0]=3 9632 B12R2.80 Brc1cccc(c1)C2CC2Br Amb23454931 [0,1,0,1,0,0|2,0,0]=4 9633 B12R2.80 CC1CC1c2cc(O)ccc2 Amb24662408 [0,1,0,1,0,0|2,0,0]=4 9634 B12R2.80 Cc1cc(ccc1)[C@@H]2C[C@@H]2Br Amb24519928 [0,1,0,1,0,0|2,0,0]=4 9635 B12R2.80 Cc1cc(ccc1)[C@@H]2C[C@H]2N Amb24100230 [0,1,0,1,0,0|1,0,0]=3 9636 B12R2.80 Clc1cc(ccc1)C2CC2Br Amb23454924 [0,1,0,1,0,0|2,0,0]=4 9637 B12R2.80 Fc1cc(ccc1)C2CC2Br Amb23454927 [0,1,0,1,0,0|2,0,0]=4 9638 B12R2.80 Fc1cc(ccc1)[C@@H]2C[C@@H]2Br Amb24671390 [0,1,0,1,0,0|2,0,0]=4 9639 B12R2.80 NC1CC1c2cc(Br)ccc2 Amb19346489 [0,1,0,1,0,0|1,0,0]=3 9640 B12R2.80 NC1CC1c2cc(Cl)ccc2 Amb19374842 [0,1,0,1,0,0|1,0,0]=3 9641 B12R2.80 NC1CC1c2cc(F)ccc2 Amb19514818 [0,1,0,1,0,0|1,0,0]=3 9642 B12R2.80 NC1CC1c2cccc(c2)O Amb17568188 [0,1,0,1,0,0|1,0,0]=3 9643 B12R2.80 N[C@@H]1C[C@H]1c2cc(Br)ccc2 Amb25307909 [0,1,0,1,0,0|1,0,0]=3 9644 B12R2.80 N[C@@H]1C[C@H]1c2cc(Cl)ccc2 Amb25683521 [0,1,0,1,0,0|1,0,0]=3 9645 B12R2.80 N[C@@H]1C[C@H]1c2cc(F)ccc2 Amb24100228 [0,1,0,1,0,0|1,0,0]=3 9646 B12R2.80 N[C@H]1C[C@@H]1c2cc(F)ccc2 Amb24552874 [0,1,0,1,0,0|1,0,0]=3 9647 B12R2.80 OC1CC1c2cc(F)ccc2 Amb24756969 [0,1,0,1,0,0|2,0,0]=4 9648 B12R2.203 CC1CCc2cccc(N)c21 Amb24654837 [0,1,0,1,0,0|2,0,0]=4 9649 B12R2.203 CC1CCc2cccc(O)c21 Amb24631584 [0,1,0,1,0,0|2,0,0]=4 9650 B12R2.203 CN1CCc2cccc(Br)c12 Amb18770838 [0,1,0,1,0,0|1,0,0]=3 9651 B12R2.203 CN1CCc2cccc(N)c12 Amb18202211 [0,1,0,1,0,0|1,0,0]=3 9652 B12R2.203 Cc1cccc2CCC(F)c21 Amb25207950 [0,1,0,1,0,0|2,0,0]=4 9653 B12R2.203 Cc1cccc2CCC(O)c21 Amb22886909 [0,1,0,1,0,0|2,0,0]=4 9654 B12R2.203 Cc1cccc2CCN(C)c12 Amb24351888 [0,1,0,1,0,0|1,0,0]=3 9655 B12R2.203 Cc1cccc2CC[C@@H](N)c21 Amb24398373 [0,1,0,1,0,0|1,0,0]=3 9656 B12R2.203 Cc1cccc2CC[C@@H](O)c21 Amb25032595 [0,1,0,1,0,0|2,0,0]=4 9657 B12R2.203 Cc1cccc2CC[C@H](O)c21 Amb24412154 [0,1,0,1,0,0|2,0,0]=4 9658 B12R2.203 NC1CCc2cccc(Br)c21 Amb24667972 [0,1,0,1,0,0|1,0,0]=3 9659 B12R2.203 NC1CCc2cccc(F)c21 Amb25279315 [0,1,0,1,0,0|1,0,0]=3 9660 B12R2.203 NC1CCc2cccc(O)c21 Amb25800015 [0,1,0,1,0,0|1,0,0]=3 9661 B12R2.203 NC1CCc2cccc(S)c21 Amb25702433 [0,1,0,1,0,0|1,0,0]=3 9662 B12R2.203 NC1COc2cccc(Br)c21 Amb24428244 [0,1,0,1,0,0|2,0,0]=4 9663 B12R2.203 N[C@@H]1CCc2cccc(Cl)c21 Amb25073529 [0,1,0,1,0,0|1,0,0]=3 9664 B12R2.203 N[C@@H]1CCc2cccc(I)c21 Amb25685478 [0,1,0,1,0,0|1,0,0]=3 9665 B12R2.203 N[C@@H]1CCc2cccc(O)c21 Amb24700449 [0,1,0,1,0,0|1,0,0]=3 9666 B12R2.203 N[C@@H]1COc2cccc(Cl)c21 Amb25335511 [0,1,0,1,0,0|2,0,0]=4 9667 B12R2.203 N[C@@H]1COc2cccc(F)c21 Amb24377677 [0,1,0,1,0,0|2,0,0]=4 9668 B12R2.203 N[C@@H]1COc2cccc(I)c21 Amb24663226 [0,1,0,1,0,0|2,0,0]=4 9669 B12R2.203 N[C@H]1CCc2cccc(Br)c21 Amb24728314 [0,1,0,1,0,0|1,0,0]=3 9670 B12R2.203 N[C@H]1CCc2cccc(I)c21 Amb25780692 [0,1,0,1,0,0|1,0,0]=3 9671 B12R2.203 N[C@H]1CCc2cccc(O)c21 Amb25068419 [0,1,0,1,0,0|1,0,0]=3 9672 B12R2.203 N[C@H]1CCc2cccc(S)c21 Amb24726197 [0,1,0,1,0,0|1,0,0]=3 9673 B12R2.203 N[C@H]1COc2cccc(Br)c21 Amb25322414 [0,1,0,1,0,0|2,0,0]=4 9674 B12R2.203 N[C@H]1COc2cccc(I)c21 Amb25147881 [0,1,0,1,0,0|2,0,0]=4 9675 B12R2.203 N[C@H]1COc2cccc(O)c21 Amb25152826 [0,1,0,1,0,0|2,0,0]=4 9676 B12R2.203 N[n]1ccc2cccc(Br)c12 Amb18176113 [0,1,0,1,0,0|0,0,2]=4 9677 B12R2.203 N[n]1ccc2cccc(Cl)c12 Amb18827405 [0,1,0,1,0,0|0,0,2]=4 9678 B12R2.203 Nc1cccc2CC[C@@H](N)c12 Amb25066858 [0,1,0,1,0,0|1,0,0]=3 9679 B12R2.203 Nc1cccc2OC[C@@H](N)c12 Amb25277392 [0,1,0,1,0,0|2,0,0]=4 9680 B12R2.203 Nc1cccc2c[n][n](N)c12 Amb24067242 [0,1,0,1,0,0|1,0,1]=4 9681 B12R2.203 Nc1cccc2cc[n](N)c12 Amb25268652 [0,1,0,1,0,0|0,0,2]=4 9682 B12R2.203 O=C1CCc2c1c(Br)ccc2 Amb16232616 [0,1,0,1,0,0|2,0,0]=4 9683 B12R2.203 O=C1CCc2c1c(C)ccc2 Amb16232631 [0,1,0,1,0,0|2,0,0]=4 9684 B12R2.203 O=C1CCc2c1c(F)ccc2 Amb10603926 [0,1,0,1,0,0|2,0,0]=4 9685 B12R2.203 O=C1CCc2c1c(I)ccc2 Amb10602520 [0,1,0,1,0,0|2,0,0]=4 9686 B12R2.203 O=C1CCc2c1c(N)ccc2 Amb10603890 [0,1,0,1,0,0|2,0,0]=4 9687 B12R2.203 OC1CCc2cccc(Br)c21 Amb24439435 [0,1,0,1,0,0|2,0,0]=4 9688 B12R2.203 Oc1cccc2CCC(O)c12 Amb18125105 [0,1,0,1,0,0|2,0,0]=4 9689 B12R2.203 Oc1cccc2CC[C@@H](O)c12 Amb24449232 [0,1,0,1,0,0|2,0,0]=4 9690 B12R2.203 Oc1cccc2CC[C@H](O)c12 Amb24746238 [0,1,0,1,0,0|2,0,0]=4 9691 B12R2.612 Brc1ccc2c(c1)CCC2N Amb10609946 [0,1,0,1,0,0|1,0,0]=3 9692 B12R2.612 C=C1CCc2cc(Br)ccc21 Amb22229945 [0,1,0,1,0,0|2,0,0]=4 9693 B12R2.612 C=C1CCc2cc(Cl)ccc21 Amb24369315 [0,1,0,1,0,0|2,0,0]=4 9694 B12R2.612 C=C1CCc2cc(F)ccc21 Amb24411882 [0,1,0,1,0,0|2,0,0]=4 9695 B12R2.612 C=C1CCc2cc(N)ccc21 Amb25837088 [0,1,0,1,0,0|2,0,0]=4 9696 B12R2.612 CC1CCc2cc(N)ccc21 Amb25150570 [0,1,0,1,0,0|2,0,0]=4 9697 B12R2.612 CC1CCc2cc(O)ccc21 Amb24099163 [0,1,0,1,0,0|2,0,0]=4 9698 B12R2.612 CN1CCc2cc(Br)c[n]c12 Amb22755415 [0,1,0,1,0,0|2,0,0]=4 9699 B12R2.612 CN1CCc2cc(N)c[n]c12 Amb18202040 [0,1,0,1,0,0|2,0,0]=4 9700 B12R2.612 CN1CCc2cc(O)c[n]c12 Amb25793075 [0,1,0,1,0,0|2,0,0]=4 9701 B12R2.612 CN1CCc2cc(O)ccc12 Amb24606547 [0,1,0,1,0,0|1,0,0]=3 9702 B12R2.612 CN1CNc2cc(Cl)ccc12 Amb25047689 [0,1,0,1,0,0|2,0,0]=4 9703 B12R2.612 CN1CNc2cc(F)ccc12 Amb24592119 [0,1,0,1,0,0|2,0,0]=4 9704 B12R2.612 Cc1cc2CCC(=S)c2cc1 Amb25151236 [0,1,0,1,0,0|2,0,0]=4 9705 B12R2.612 Cc1cc2CCC(Cl)c2cc1 Amb24484465 [0,1,0,1,0,0|2,0,0]=4 9706 B12R2.612 Cc1cc2CCC(N)c2[n]c1 Amb24630389 [0,1,0,1,0,0|2,0,0]=4 9707 B12R2.612 Cc1cc2CCC(O)c2cc1 Amb21964865 [0,1,0,1,0,0|2,0,0]=4 9708 B12R2.612 Cc1cc2CCN(N)c2cc1 Amb24569532 [0,1,0,1,0,0|0,0,0]=2 9709 B12R2.612 Cc1cc2CC[C@H](N)c2[n]c1 Amb24447124 [0,1,0,1,0,0|2,0,0]=4 9710 B12R2.612 Cc1cc2OC[C@@H](N)c2cc1 Amb24365216 [0,1,0,1,0,0|2,0,0]=4 9711 B12R2.612 Cc1cc2OC[C@H](N)c2cc1 Amb25335510 [0,1,0,1,0,0|2,0,0]=4 9712 B12R2.612 Cc1cc2[n][n][n](N)c2cc1 Amb24359101 [0,1,0,1,0,0|2,0,0]=4 9713 B12R2.612 Cc1cc2c[n][n](N)c2cc1 Amb22493906 [0,1,0,1,0,0|1,0,1]=4 9714 B12R2.612 Cc1cc2cc[n](N)c2cc1 Amb18202355 [0,1,0,1,0,0|0,0,2]=4 9715 B12R2.612 Cc1ccc2c(CCN2C)c1 Amb25318233 [0,1,0,1,0,0|1,0,0]=3 9716 B12R2.612 Cc1ccc2c(c1)CCC2N Amb10609950 [0,1,0,1,0,0|1,0,0]=3 9717 B12R2.612 Cc1ccc2c(c1)NCN2C Amb25148182 [0,1,0,1,0,0|2,0,0]=4 9718 B12R2.612 ClC1CCc2cc(Br)ccc21 Amb22001687 [0,1,0,1,0,0|2,0,0]=4 9719 B12R2.612 Clc1ccc2C(Cl)CCc2c1 Amb25351129 [0,1,0,1,0,0|2,0,0]=4 9720 B12R2.612 Clc1ccc2c(c1)CCC2N Amb10609861 [0,1,0,1,0,0|1,0,0]=3 9721 B12R2.612 Clc1ccc2c(c1)CC[C@@H]2N Amb13953031 [0,1,0,1,0,0|1,0,0]=3 9722 B12R2.612 Clc1ccc2c(c1)CC[C@@H]2O Amb13953030 [0,1,0,1,0,0|2,0,0]=4 9723 B12R2.612 Clc1ccc2c(c1)CC[C@H]2N Amb13953032 [0,1,0,1,0,0|1,0,0]=3 9724 B12R2.612 Clc1ccc2c(c1)CC[C@H]2O Amb13953029 [0,1,0,1,0,0|2,0,0]=4 9725 B12R2.612 FC1CCc2cc(Cl)ccc21 Amb24513908 [0,1,0,1,0,0|2,0,0]=4 9726 B12R2.612 Fc1cc2CCC(Br)c2cc1 Amb24461653 [0,1,0,1,0,0|2,0,0]=4 9727 B12R2.612 Fc1ccc2c(c1)CCC2N Amb10609896 [0,1,0,1,0,0|1,0,0]=3 9728 B12R2.612 Fc1ccc2c(c1)CC[C@@H]2N Amb13953037 [0,1,0,1,0,0|1,0,0]=3 9729 B12R2.612 Fc1ccc2c(c1)CC[C@@H]2O Amb13953033 [0,1,0,1,0,0|2,0,0]=4 9730 B12R2.612 Fc1ccc2c(c1)CC[C@H]2N Amb13953036 [0,1,0,1,0,0|1,0,0]=3 9731 B12R2.612 Fc1ccc2c(c1)CC[C@H]2O Amb13953035 [0,1,0,1,0,0|2,0,0]=4 9732 B12R2.612 Ic1ccc2c(c1)CCC2=O Amb10602519 [0,1,0,1,0,0|2,0,0]=4 9733 B12R2.612 NC1=NCc2cc(Cl)ccc21 Amb25724500 [0,1,0,1,0,0|2,0,0]=4 9734 B12R2.612 NC1CCc2[n]c(Br)ccc21 Amb25735551 [0,1,0,1,0,0|2,0,0]=4 9735 B12R2.612 NC1CCc2cc(I)ccc21 Amb25215234 [0,1,0,1,0,0|1,0,0]=3 9736 B12R2.612 NC1CCc2cc(S)ccc21 Amb25378804 [0,1,0,1,0,0|1,0,0]=3 9737 B12R2.612 NC1CNc2cc(Br)ccc21 Amb25311429 [0,1,0,1,0,0|2,0,0]=4 9738 B12R2.612 NC1COc2cc(Br)ccc21 Amb19516088 [0,1,0,1,0,0|2,0,0]=4 9739 B12R2.612 NC1COc2cc(Br)ccc21 Amb21962144 [0,1,0,1,0,0|2,0,0]=4 9740 B12R2.612 NC1COc2cc(I)ccc21 Amb25731928 [0,1,0,1,0,0|2,0,0]=4 9741 B12R2.612 NC1COc2cc(S)ccc21 Amb24484478 [0,1,0,1,0,0|2,0,0]=4 9742 B12R2.612 NN1CCc2cc(F)ccc12 Amb25178613 [0,1,0,1,0,0|0,0,0]=2 9743 B12R2.612 N[C@@H]1CCc2cc(Br)ccc21 Amb22745142 [0,1,0,1,0,0|1,0,0]=3 9744 B12R2.612 N[C@@H]1CCc2cc(Br)ccc21 Amb22745143 [0,1,0,1,0,0|1,0,0]=3 9745 B12R2.612 N[C@@H]1CCc2cc(F)ccc21 Amb22288667 [0,1,0,1,0,0|1,0,0]=3 9746 B12R2.612 N[C@@H]1CCc2cc(I)ccc21 Amb25726414 [0,1,0,1,0,0|1,0,0]=3 9747 B12R2.612 N[C@@H]1CCc2cc(O)ccc21 Amb25841173 [0,1,0,1,0,0|1,0,0]=3 9748 B12R2.612 N[C@@H]1COc2cc(Br)ccc21 Amb24462735 [0,1,0,1,0,0|2,0,0]=4 9749 B12R2.612 N[C@@H]1COc2cc(O)ccc21 Amb24418721 [0,1,0,1,0,0|2,0,0]=4 9750 B12R2.612 N[C@H]1CCc2cc(F)ccc21 Amb22270166 [0,1,0,1,0,0|1,0,0]=3 9751 B12R2.612 N[C@H]1COc2cc(I)ccc21 Amb25764549 [0,1,0,1,0,0|2,0,0]=4 9752 B12R2.612 N[C@H]1COc2cc(O)ccc21 Amb25737189 [0,1,0,1,0,0|2,0,0]=4 9753 B12R2.612 N[n]1[n]cc2cc(Cl)ccc12 Amb25714214 [0,1,0,1,0,0|1,0,1]=4 9754 B12R2.612 N[n]1[n]cc2cc(I)ccc12 Amb25046837 [0,1,0,1,0,0|1,0,1]=4 9755 B12R2.612 N[n]1c[n]c2cc(F)ccc12 Amb25079195 [0,1,0,1,0,0|1,0,1]=4 9756 B12R2.612 N[n]1ccc2cc(Br)ccc12 Amb18176116 [0,1,0,1,0,0|0,0,2]=4 9757 B12R2.612 N[n]1ccc2cc(Cl)ccc12 Amb18199547 [0,1,0,1,0,0|0,0,2]=4 9758 B12R2.612 N[n]1ccc2cc(F)ccc12 Amb18201964 [0,1,0,1,0,0|0,0,2]=4 9759 B12R2.612 Nc1cc2CCC(O)c2cc1 Amb24386265 [0,1,0,1,0,0|2,0,0]=4 9760 B12R2.612 Nc1cc2CC[C@@H](O)c2cc1 Amb24474275 [0,1,0,1,0,0|2,0,0]=4 9761 B12R2.612 Nc1cc2CC[C@H](O)c2cc1 Amb24733416 [0,1,0,1,0,0|2,0,0]=4 9762 B12R2.612 Nc1ccc2C(N)COc2c1 Amb24763672 [0,1,0,1,0,0|2,0,0]=4 9763 B12R2.612 Nc1ccc2[C@@H](N)COc2c1 Amb25719428 [0,1,0,1,0,0|2,0,0]=4 9764 B12R2.612 Nc1ccc2c(c1)CCC2=O Amb1348304 [0,1,0,1,0,0|2,0,0]=4 9765 B12R2.612 Nc1ccc2c(c1)CCC2N Amb13952222 [0,1,0,1,0,0|1,0,0]=3 9766 B12R2.612 Nc1ccc2c(c1)CCN2C Amb13952548 [0,1,0,1,0,0|1,0,0]=3 9767 B12R2.612 Nc1ccc2c(c1)CCN2C Amb13998577 [0,1,0,1,0,0|1,0,0]=3 9768 B12R2.612 O=C1CCc2cc(S)ccc21 Amb24458838 [0,1,0,1,0,0|2,0,0]=4 9769 B12R2.612 OC1CCc2cc(Cl)ccc21 Amb22001631 [0,1,0,1,0,0|2,0,0]=4 9770 B12R2.612 OC1CCc2cc(F)ccc21 Amb22756387 [0,1,0,1,0,0|2,0,0]=4 9771 B12R2.612 O[C@@H]1CCc2cc(Br)ccc21 Amb22886733 [0,1,0,1,0,0|2,0,0]=4 9772 B12R2.612 O[C@H]1CCc2cc(Br)ccc21 Amb24420879 [0,1,0,1,0,0|2,0,0]=4 9773 B12R2.612 Oc1ccc2C(O)CCc2c1 Amb22001818 [0,1,0,1,0,0|2,0,0]=4 9774 B12R2.612 Oc1ccc2c(c1)OCC2N Amb1131908 [0,1,0,1,0,0|2,0,0]=4 9775 B12R2.612 S=C1CCc2cc(Br)ccc21 Amb24361326 [0,1,0,1,0,0|2,0,0]=4 9776 B12R2.612 SC1CCc2cc(Br)ccc21 Amb25821808 [0,1,0,1,0,0|2,0,0]=4 9777 B12R2.612 SC1CCc2cc(Cl)ccc21 Amb24639650 [0,1,0,1,0,0|2,0,0]=4 9778 B12R2.1286 Fc1cc(CC2CO2)ccc1 Amb24558530 [0,1,0,1,0,0|2,0,0]=4 9779 B12R2.1783 N#CC1Cc2cccc(F)c21 Amb25681332 [0,1,0,1,0,0|1,0,1]=4 9780 B12R2.2313 Brc1cc([n]cc1)[C@@H]2CCN2 Amb24668866 [0,1,0,1,0,0|2,0,0]=4 9781 B12R2.2313 Brc1cc(c[n]c1)C2CNC2 Amb25147879 [0,1,0,1,0,0|2,0,0]=4 9782 B12R2.2313 Brc1cc(c[n]c1)[C@@H]2CCN2 Amb24522968 [0,1,0,1,0,0|2,0,0]=4 9783 B12R2.2313 Brc1cc(c[n]c1)[C@H]2CCN2 Amb25149065 [0,1,0,1,0,0|2,0,0]=4 9784 B12R2.2313 Brc1cc(cc[n]1)[C@H]2CCN2 Amb25739247 [0,1,0,1,0,0|2,0,0]=4 9785 B12R2.2313 Brc1cc(ccc1)C2CCC2 Amb20617094 [0,1,0,1,0,0|2,0,0]=4 9786 B12R2.2313 Brc1cc(ccc1)C2CNC2 Amb18066357 [0,1,0,1,0,0|1,0,0]=3 9787 B12R2.2313 Brc1cc(ccc1)C2COC2 Amb22737351 [0,1,0,1,0,0|2,0,0]=4 9788 B12R2.2313 Brc1cc(ccc1)[C@H]2CCN2 Amb25149014 [0,1,0,1,0,0|1,0,0]=3 9789 B12R2.2313 Brc1cccc([n]1)[C@H]2CCN2 Amb25800124 [0,1,0,1,0,0|2,0,0]=4 9790 B12R2.2313 Cc1cc([n]cc1)C2CNC2 Amb24078448 [0,1,0,1,0,0|2,0,0]=4 9791 B12R2.2313 Cc1cc(c[n]c1)[C@@H]2CCN2 Amb24470667 [0,1,0,1,0,0|2,0,0]=4 9792 B12R2.2313 Cc1cc(c[n]c1)[C@H]2CCN2 Amb24715915 [0,1,0,1,0,0|2,0,0]=4 9793 B12R2.2313 Cc1cc(cc[n]1)C2CCN2 Amb25041966 [0,1,0,1,0,0|2,0,0]=4 9794 B12R2.2313 Cc1cc(cc[n]1)C2CNC2 Amb25756833 [0,1,0,1,0,0|2,0,0]=4 9795 B12R2.2313 Cc1cc(cc[n]1)[C@@H]2CCN2 Amb25145702 [0,1,0,1,0,0|2,0,0]=4 9796 B12R2.2313 Cc1cc(cc[n]1)[C@H]2CCN2 Amb25063620 [0,1,0,1,0,0|2,0,0]=4 9797 B12R2.2313 Cc1cc(ccc1)C2CNC2 Amb18065251 [0,1,0,1,0,0|1,0,0]=3 9798 B12R2.2313 Clc1cc([n]cc1)[C@@H]2CCN2 Amb24738587 [0,1,0,1,0,0|2,0,0]=4 9799 B12R2.2313 Clc1cc(c[n]c1)C2CNC2 Amb25768976 [0,1,0,1,0,0|2,0,0]=4 9800 B12R2.2313 Clc1cc(c[n]c1)[C@@H]2CCN2 Amb25145842 [0,1,0,1,0,0|2,0,0]=4 9801 B12R2.2313 Clc1cc(c[n]c1)[C@H]2CCN2 Amb24427269 [0,1,0,1,0,0|2,0,0]=4 9802 B12R2.2313 Clc1cc(cc[n]1)C2CCN2 Amb24687212 [0,1,0,1,0,0|2,0,0]=4 9803 B12R2.2313 Clc1cc(ccc1)C2CNC2 Amb18563826 [0,1,0,1,0,0|1,0,0]=3 9804 B12R2.2313 Clc1cc(ccc1)C2COC2 Amb24739899 [0,1,0,1,0,0|2,0,0]=4 9805 B12R2.2313 Clc1cccc([n]1)C2CCN2 Amb24484519 [0,1,0,1,0,0|2,0,0]=4 9806 B12R2.2313 Clc1cccc([n]1)[C@H]2CCN2 Amb25831545 [0,1,0,1,0,0|2,0,0]=4 9807 B12R2.2313 Fc1cc(c[n]c1)[C@@H]2CCN2 Amb24745651 [0,1,0,1,0,0|2,0,0]=4 9808 B12R2.2313 Fc1cc(c[n]c1)[C@H]2CCN2 Amb25145700 [0,1,0,1,0,0|2,0,0]=4 9809 B12R2.2313 Fc1cc(cc[n]1)C2CCN2 Amb25340514 [0,1,0,1,0,0|2,0,0]=4 9810 B12R2.2313 Fc1cc(cc[n]1)C2CNC2 Amb25151170 [0,1,0,1,0,0|2,0,0]=4 9811 B12R2.2313 Fc1cc(cc[n]1)[C@@H]2CCN2 Amb24427252 [0,1,0,1,0,0|2,0,0]=4 9812 B12R2.2313 Fc1cc(cc[n]1)[C@H]2CCN2 Amb25292217 [0,1,0,1,0,0|2,0,0]=4 9813 B12R2.2313 Fc1cc(ccc1)C2CCN2 Amb19375411 [0,1,0,1,0,0|1,0,0]=3 9814 B12R2.2313 Fc1cc(ccc1)C2CCN2 Amb25273667 [0,1,0,1,0,0|1,0,0]=3 9815 B12R2.2313 Fc1cc(ccc1)C2CNC2 Amb20669554 [0,1,0,1,0,0|1,0,0]=3 9816 B12R2.2313 Fc1cc(ccc1)C2CNC2 Amb22055311 [0,1,0,1,0,0|1,0,0]=3 9817 B12R2.2313 Fc1cc(ccc1)C2COC2 Amb25219965 [0,1,0,1,0,0|2,0,0]=4 9818 B12R2.2313 Fc1cc(ccc1)[C@@H]2CCN2 Amb24753481 [0,1,0,1,0,0|1,0,0]=3 9819 B12R2.2313 Fc1cccc([n]1)C2CCN2 Amb25046608 [0,1,0,1,0,0|2,0,0]=4 9820 B12R2.2313 Fc1cccc([n]1)C2CNC2 Amb22236355 [0,1,0,1,0,0|2,0,0]=4 9821 B12R2.2313 Fc1cccc([n]1)C2CNC2 Amb25714213 [0,1,0,1,0,0|2,0,0]=4 9822 B12R2.2313 Fc1cccc([n]1)[C@@H]2CCN2 Amb25145692 [0,1,0,1,0,0|2,0,0]=4 9823 B12R2.2313 Fc1cccc([n]1)[C@H]2CCN2 Amb24349712 [0,1,0,1,0,0|2,0,0]=4 9824 B12R2.2313 Ic1cc(ccc1)C2CCN2 Amb24444284 [0,1,0,1,0,0|1,0,0]=3 9825 B12R2.2313 Nc1cc([n]cc1)C2CCN2 Amb24453203 [0,1,0,1,0,0|2,0,0]=4 9826 B12R2.2313 Nc1cc([n]cc1)[C@@H]2CCN2 Amb24466115 [0,1,0,1,0,0|2,0,0]=4 9827 B12R2.2313 Nc1cc([n]cc1)[C@H]2CCN2 Amb25044374 [0,1,0,1,0,0|2,0,0]=4 9828 B12R2.2313 Nc1cc(c[n]c1)C2CCN2 Amb24622460 [0,1,0,1,0,0|2,0,0]=4 9829 B12R2.2313 Nc1cc(c[n]c1)[C@H]2CCN2 Amb25808528 [0,1,0,1,0,0|2,0,0]=4 9830 B12R2.2313 Nc1cc(cc[n]1)[C@H]2CCN2 Amb24736128 [0,1,0,1,0,0|2,0,0]=4 9831 B12R2.2313 Nc1cc(ccc1)C2CCC2 Amb20617095 [0,1,0,1,0,0|2,0,0]=4 9832 B12R2.2313 Nc1cc(ccc1)C2CNC2 Amb25292216 [0,1,0,1,0,0|1,0,0]=3 9833 B12R2.2313 Nc1cc(ccc1)[C@@H]2CCN2 Amb25152853 [0,1,0,1,0,0|1,0,0]=3 9834 B12R2.2313 Nc1cc(ccc1)[C@H]2CCN2 Amb25839840 [0,1,0,1,0,0|1,0,0]=3 9835 B12R2.2313 Nc1cccc([n]1)C2CCN2 Amb25727312 [0,1,0,1,0,0|2,0,0]=4 9836 B12R2.2313 Nc1cccc([n]1)[C@@H]2CCN2 Amb25830500 [0,1,0,1,0,0|2,0,0]=4 9837 B12R2.2313 Nc1cccc([n]1)[C@H]2CCN2 Amb24753227 [0,1,0,1,0,0|2,0,0]=4 9838 B12R2.2313 Oc1cc(ccc1)C2CCC2 Amb20617090 [0,1,0,1,0,0|2,0,0]=4 9839 B12R2.2313 Oc1cc(ccc1)C2CCN2 Amb24085164 [0,1,0,1,0,0|1,0,0]=3 9840 B12R2.2313 Oc1cc(ccc1)[C@@H]2CCN2 Amb25064272 [0,1,0,1,0,0|1,0,0]=3 9841 B12R2.2313 Oc1cccc([n]1)C2CNC2 Amb25794155 [0,1,0,1,0,0|2,0,0]=4 9842 B12R2.2313 Sc1cc(ccc1)C2CNC2 Amb25152864 [0,1,0,1,0,0|1,0,0]=3 9843 B12R2.2313 Sc1cc(ccc1)[C@@H]2CCN2 Amb24465071 [0,1,0,1,0,0|1,0,0]=3 9844 B12R2.1 BrCC1CCc2ccccc21 Amb22500999 [0,1,0,1,0,0|2,0,0]=4 9845 B12R2.1 BrCC1COc2ccccc21 Amb25063018 [0,1,0,1,0,0|2,0,0]=4 9846 B12R2.1 BrCC1CSc2ccccc21 Amb25720096 [0,1,0,1,0,0|2,0,0]=4 9847 B12R2.1 BrC[C@@H]1COc2ccccc21 Amb25694007 [0,1,0,1,0,0|2,0,0]=4 9848 B12R2.1 BrC[C@H]1COc2ccccc21 Amb24368636 [0,1,0,1,0,0|2,0,0]=4 9849 B12R2.1 C=CC1CNc2ccccc21 Amb24486031 [0,1,0,1,0,0|2,0,0]=4 9850 B12R2.1 CCC1CCc2ccccc21 Amb20248519 [0,1,0,1,0,0|2,0,0]=4 9851 B12R2.1 CCC1NCc2ccccc21 Amb24377125 [0,1,0,1,0,0|2,0,0]=4 9852 B12R2.1 CCC1SCc2ccccc21 Amb24092839 [0,1,0,1,0,0|2,0,0]=4 9853 B12R2.1 CCN1CCc2ccccc12 Amb17689295 [0,1,0,1,0,0|1,0,0]=3 9854 B12R2.1 CCN1CNc2ccccc12 Amb24064698 [0,1,0,1,0,0|2,0,0]=4 9855 B12R2.1 CCN1COc2ccccc12 Amb24102073 [0,1,0,1,0,0|2,0,0]=4 9856 B12R2.1 CCN1CSc2c1cccc2 Amb10571430 [0,1,0,1,0,0|2,0,0]=4 9857 B12R2.1 CNC1CCc2c1cccc2 Amb1117068 [0,1,0,1,0,0|1,0,0]=3 9858 B12R2.1 CNC1CCc2c[n]ccc21 Amb24679526 [0,1,0,1,0,0|2,0,0]=4 9859 B12R2.1 CNC1CCc2ccccc21 Amb22757336 [0,1,0,1,0,0|1,0,0]=3 9860 B12R2.1 CN[C@@H]1CCc2ccccc21 Amb25808104 [0,1,0,1,0,0|1,0,0]=3 9861 B12R2.1 COC1COc2ccccc21 Amb24102318 [0,1,0,1,0,0|2,0,0]=4 9862 B12R2.1 COC1OCc2ccccc21 Amb24323529 [0,1,0,1,0,0|2,0,0]=4 9863 B12R2.1 CSC1CCc2ccccc21 Amb24684843 [0,1,0,1,0,0|2,0,0]=4 9864 B12R2.1 ClCC1CCc2ccccc21 Amb22500998 [0,1,0,1,0,0|2,0,0]=4 9865 B12R2.1 Cl\C=C/1\CCc2ccccc21 Amb24519209 [0,1,0,1,0,0|2,0,0]=4 9866 B12R2.1 FCC1CNc2ccccc21 Amb25178926 [0,1,0,1,0,0|2,0,0]=4 9867 B12R2.1 ICC1CCc2ccccc21 Amb24721376 [0,1,0,1,0,0|2,0,0]=4 9868 B12R2.1 ICC1COc2ccccc21 Amb24060947 [0,1,0,1,0,0|2,0,0]=4 9869 B12R2.1 ICC1CSc2ccccc21 Amb24513745 [0,1,0,1,0,0|2,0,0]=4 9870 B12R2.1 N#CC1CNc2ccccc21 Amb18063484 [0,1,0,1,0,0|1,0,1]=4 9871 B12R2.1 N#CC1COc2ccccc21 Amb23586274 [0,1,0,1,0,0|1,0,1]=4 9872 B12R2.1 N#CC1CSc2ccccc21 Amb18126297 [0,1,0,1,0,0|1,0,1]=4 9873 B12R2.1 N#CN1CCc2ccccc12 Amb24484539 [0,1,0,1,0,0|0,0,1]=3 9874 B12R2.1 NCC1=CCc2ccccc12 Amb18560208 [0,1,0,1,0,0|1,0,1]=4 9875 B12R2.1 NCC1C=Cc2c1cccc2 Amb17470375 [0,1,0,1,0,0|1,0,1]=4 9876 B12R2.1 NCC1CCc2ccc[n]c21 Amb24561429 [0,1,0,1,0,0|2,0,0]=4 9877 B12R2.1 NCC1CCc2ccccc21 Amb22500956 [0,1,0,1,0,0|1,0,0]=3 9878 B12R2.1 NCC1CNc2ccccc21 Amb18063038 [0,1,0,1,0,0|1,0,0]=3 9879 B12R2.1 NCC1COc2c[n]ccc21 Amb22756834 [0,1,0,1,0,0|2,0,0]=4 9880 B12R2.1 NCC1COc2ccccc21 Amb18644395 [0,1,0,1,0,0|1,0,0]=3 9881 B12R2.1 NCC1COc2ccccc21 Amb20668243 [0,1,0,1,0,0|1,0,0]=3 9882 B12R2.1 NC[n]1c[n]c2ccccc12 Amb24078485 [0,1,0,1,0,0|1,0,1]=4 9883 B12R2.1 NC[n]1ccc2ccccc12 Amb24089082 [0,1,0,1,0,0|0,0,2]=4 9884 B12R2.1 NNC1=NCc2ccccc12 Amb18124833 [0,1,0,1,0,0|0,0,1]=3 9885 B12R2.1 NNC1CCc2[n]cccc21 Amb24453229 [0,1,0,1,0,0|1,0,0]=3 9886 B12R2.1 NNC1CCc2cc[n]cc21 Amb24484405 [0,1,0,1,0,0|1,0,0]=3 9887 B12R2.1 NNC1CCc2ccc[n]c21 Amb24745581 [0,1,0,1,0,0|1,0,0]=3 9888 B12R2.1 NNc1[n][nH]c2ccccc12 Amb24656596 [0,1,0,1,0,0|1,0,1]=4 9889 B12R2.1 NNc1[n]oc2ccccc21 Amb25151937 [0,1,0,1,0,0|1,0,1]=4 9890 B12R2.1 NNc1c[nH]c2ccccc12 Amb25113889 [0,1,0,1,0,0|0,0,2]=4 9891 B12R2.1 NNc1c[s]c2ccccc21 Amb25359511 [0,1,0,1,0,0|0,0,2]=4 9892 B12R2.1 NNc1nsc2c1cccc2 Amb1115216 [0,1,0,1,0,0|1,0,1]=4 9893 B12R2.1 NOC1CCc2ccccc21 Amb25808729 [0,1,0,1,0,0|1,0,0]=3 9894 B12R2.1 N\N=C/1\CCc2c1cccc2 Amb2384463 [0,1,0,1,0,0|0,0,1]=3 9895 B12R2.1 O=CC1CCc2ccccc21 Amb18644272 [0,1,0,1,0,0|2,0,0]=4 9896 B12R2.1 O=CC1CNc2ccccc21 Amb23590098 [0,1,0,1,0,0|2,0,0]=4 9897 B12R2.1 O=CC1COc2ccccc21 Amb23586276 [0,1,0,1,0,0|2,0,0]=4 9898 B12R2.1 O=NN1CCc2ccccc12 Amb17689298 [0,1,0,1,0,0|0,0,1]=3 9899 B12R2.1 OCC1CCc2ccccc21 Amb19329220 [0,1,0,1,0,0|2,0,0]=4 9900 B12R2.1 OCC1CNc2ccccc21 Amb18063448 [0,1,0,1,0,0|2,0,0]=4 9901 B12R2.1 OCC1COc2ccccc21 Amb22224879 [0,1,0,1,0,0|2,0,0]=4 9902 B12R2.1 OCC1CSc2ccccc21 Amb24615579 [0,1,0,1,0,0|2,0,0]=4 9903 B12R2.1 OCC1NCc2ccccc21 Amb25736151 [0,1,0,1,0,0|2,0,0]=4 9904 B12R2.1 OC[C@@H]1COc2ccccc21 Amb24487044 [0,1,0,1,0,0|2,0,0]=4 9905 B12R2.1 OC[C@H]1OCc2ccccc21 Amb24412216 [0,1,0,1,0,0|2,0,0]=4 9906 B12R2.1 O\N=C/1\CCc2ccccc21 Amb24121339 [0,1,0,1,0,0|1,0,1]=4 9907 B12R2.1 O\N=C\1/CCc2ccccc21 Amb22731286 [0,1,0,1,0,0|1,0,1]=4 9908 B12R2.11 Br[C@@H]1C[C@@H]1Cc2ccccc2 Amb25280103 [0,1,0,1,0,0|2,0,0]=4 9909 B12R2.11 CC1CC1Nc2ccccc2 Amb24743217 [0,1,0,1,0,0|2,0,0]=4 9910 B12R2.11 C[C@H]1C[C@@H]1Nc2ccccc2 Amb24581235 [0,1,0,1,0,0|2,0,0]=4 9911 B12R2.11 ClC1CC1Oc2ccccc2 Amb25799021 [0,1,0,1,0,0|2,0,0]=4 9912 B12R2.11 Cl[C@@H]1C[C@@H]1Oc2ccccc2 Amb24652641 [0,1,0,1,0,0|2,0,0]=4 9913 B12R2.11 NC1CC1Cc2ccccc2 Amb18960797 [0,1,0,1,0,0|1,0,0]=3 9914 B12R2.11 NC1CC1Cc2ccccc2 Amb19375025 [0,1,0,1,0,0|1,0,0]=3 9915 B12R2.11 NC1CC1Oc2ccccc2 Amb24761155 [0,1,0,1,0,0|1,0,0]=3 9916 B12R2.11 OC1CC1Cc2ccccc2 Amb25145316 [0,1,0,1,0,0|2,0,0]=4 9917 B12R2.11 OC1CC1Sc2ccccc2 Amb25788139 [0,1,0,1,0,0|2,0,0]=4 9918 B12R2.11 O[C@H]1C[C@@H]1Cc2ccccc2 Amb25326057 [0,1,0,1,0,0|2,0,0]=4 9919 B12R2.11 O[C@H]1C[C@@H]1Sc2ccccc2 Amb24745857 [0,1,0,1,0,0|2,0,0]=4 9920 B12R2.23 BrC1COC1c2ccccc2 Amb24484887 [0,1,0,1,0,0|2,0,0]=4 9921 B12R2.23 Br[C@@H]1CO[C@H]1c2ccccc2 Amb25198843 [0,1,0,1,0,0|2,0,0]=4 9922 B12R2.23 CC1CNC1c2ccccc2 Amb19338009 [0,1,0,1,0,0|1,0,0]=3 9923 B12R2.23 CC1NCC1c2ccccc2 Amb25842786 [0,1,0,1,0,0|1,0,0]=3 9924 B12R2.23 C[C@@H]1NC[C@H]1c2ccccc2 Amb24618159 [0,1,0,1,0,0|1,0,0]=3 9925 B12R2.23 NC1CCC1c2ccccc2 Amb19335290 [0,1,0,1,0,0|1,0,0]=3 9926 B12R2.23 NC1CCC1c2ccccc2 Amb24120632 [0,1,0,1,0,0|1,0,0]=3 9927 B12R2.23 NC1CSC1c2ccccc2 Amb25076286 [0,1,0,1,0,0|1,0,0]=3 9928 B12R2.23 N[C@@H]1CC[C@H]1c2ccccc2 Amb25174969 [0,1,0,1,0,0|1,0,0]=3 9929 B12R2.23 O=C1CCC1c2ccccc2 Amb19515483 [0,1,0,1,0,0|2,0,0]=4 9930 B12R2.23 O=C1CCN1c2ccccc2 Amb16191926 [0,1,0,1,0,0|2,0,0]=4 9931 B12R2.23 O=C1CNC1c2ccccc2 Amb24449898 [0,1,0,1,0,0|1,0,1]=4 9932 B12R2.23 O=C1COC1c2ccccc2 Amb23456091 [0,1,0,1,0,0|2,0,0]=4 9933 B12R2.23 OC1CCC1c2ccccc2 Amb19374437 [0,1,0,1,0,0|2,0,0]=4 9934 B12R2.23 OC1CNC1c2ccc[n]c2 Amb25145873 [0,1,0,1,0,0|2,0,0]=4 9935 B12R2.23 OC1CNC1c2ccccc2 Amb25680030 [0,1,0,1,0,0|1,0,0]=3 9936 B12R2.23 O[C@@H]1CC[C@H]1c2ccccc2 Amb24620488 [0,1,0,1,0,0|2,0,0]=4 9937 B12R2.23 O[C@@H]1CS[C@H]1c2ccccc2 Amb25334761 [0,1,0,1,0,0|2,0,0]=4 9938 B12R2.23 O[C@H]1CS[C@H]1c2ccccc2 Amb25176781 [0,1,0,1,0,0|2,0,0]=4 9939 B12R2.23 S=C1CCN1c2ccccc2 Amb24709242 [0,1,0,1,0,0|2,0,0]=4 9940 B12R2.2057 C(NC1CC1)c2ccccc2 Amb19515725 [0,1,0,1,0,0|2,0,0]=4 9941 B12R2.2057 C(Nc1ccccc1)C2CC2 Amb22586372 [0,1,0,1,0,0|2,0,0]=4 9942 B12R2.2057 C(Oc1ccccc1)C2CC2 Amb22752457 [0,1,0,1,0,0|2,0,0]=4 9943 B12R2.2057 C(Oc1ccccc1)C2CO2 Amb22366990 [0,1,0,1,0,0|2,0,0]=4 9944 B12R2.2057 C(SC1CC1)c2ccccc2 Amb25824339 [0,1,0,1,0,0|2,0,0]=4 9945 B12R2.2057 C1CC1CNc2ccccc2 Amb2383311 [0,1,0,1,0,0|2,0,0]=4 9946 B12R2.2057 C1OC1CCc2ccccc2 Amb24105379 [0,1,0,1,0,0|2,0,0]=4 9947 B12R2.2057 C1O[C@@H]1CSc2ccccc2 Amb25680899 [0,1,0,1,0,0|2,0,0]=4 9948 B12R2.2057 C1O[C@@H]1OCc2ccccc2 Amb24631881 [0,1,0,1,0,0|2,0,0]=4 9949 B12R2.2058 B1CC(C1)Cc2ccccc2 Amb25243383 [0,1,0,1,0,0|2,0,0]=4 9950 B12R2.2058 C(C1CCN1)c2ccccc2 Amb20623701 [0,1,0,1,0,0|1,0,0]=3 9951 B12R2.2058 C1CC(C1)Sc2ccccc2 Amb10976023 [0,1,0,1,0,0|2,0,0]=4 9952 B12R2.2058 C1CCC1Nc2ccccc2 Amb18283820 [0,1,0,1,0,0|2,0,0]=4 9953 B12R2.2058 C1N=CN1Cc2ccccc2 Amb25709568 [0,1,0,1,0,0|1,0,1]=4 9954 B12R2.2058 C1NCC1=Cc2ccccc2 Amb24630245 [0,1,0,1,0,0|1,0,1]=4 9955 B12R2.2058 C1NCC1Cc2c[n]ccc2 Amb23598850 [0,1,0,1,0,0|2,0,0]=4 9956 B12R2.2058 C1NCC1Cc2cc[n]cc2 Amb23598871 [0,1,0,1,0,0|2,0,0]=4 9957 B12R2.2058 C1NCC1Cc2cccc[n]2 Amb23598870 [0,1,0,1,0,0|2,0,0]=4 9958 B12R2.2058 C1NCC1Cc2ccccc2 Amb19373673 [0,1,0,1,0,0|1,0,0]=3 9959 B12R2.2058 C1NCC1Nc2cc[n]cc2 Amb23598900 [0,1,0,1,0,0|2,0,0]=4 9960 B12R2.2058 C1NCC1Nc2cccc[n]2 Amb23598896 [0,1,0,1,0,0|2,0,0]=4 9961 B12R2.2058 C1NCC1Oc2c[n]ccc2 Amb21956447 [0,1,0,1,0,0|2,0,0]=4 9962 B12R2.2058 C1NCC1Oc2c[n]ccc2 Amb22490470 [0,1,0,1,0,0|2,0,0]=4 9963 B12R2.2058 C1NCC1Oc2cc[n]cc2 Amb19373091 [0,1,0,1,0,0|2,0,0]=4 9964 B12R2.2058 C1NCC1Oc2cccc[n]2 Amb22642174 [0,1,0,1,0,0|2,0,0]=4 9965 B12R2.2058 C1NCC1Oc2ccccc2 Amb19312256 [0,1,0,1,0,0|1,0,0]=3 9966 B12R2.2058 C1NCC1Sc2cccc[n]2 Amb18798681 [0,1,0,1,0,0|2,0,0]=4 9967 B12R2.2058 C1NCC1Sc2ccccc2 Amb18798478 [0,1,0,1,0,0|1,0,0]=3 9968 B12R2.2058 C1OCC1Nc2ccccc2 Amb22737358 [0,1,0,1,0,0|2,0,0]=4 9969 B12R2.2058 C1OCC1Sc2ccccc2 Amb25145934 [0,1,0,1,0,0|2,0,0]=4 9970 B12R2.2058 C1SCC1Nc2ccccc2 Amb25362257 [0,1,0,1,0,0|2,0,0]=4 9971 B12R2.2058 N1CC(C1)Cc2ccccc2 Amb1123190 [0,1,0,1,0,0|1,0,0]=3 9972 B12R2.2058 N1CC(C1)Oc2ccccc2 Amb15701497 [0,1,0,1,0,0|1,0,0]=3 9973 B12R2.18 BN1C(C)Sc2ccccc12 Amb24085866 [0,1,0,1,0,0|2,0,0]=4 9974 B12R2.18 C=C1C(O)Cc2ccccc21 Amb24576594 [0,1,0,1,0,0|2,0,0]=4 9975 B12R2.18 CC1C(N)Cc2ccccc21 Amb18124847 [0,1,0,1,0,0|2,0,0]=4 9976 B12R2.18 CC1C(O)Cc2ccccc21 Amb20622729 [0,1,0,1,0,0|2,0,0]=4 9977 B12R2.18 CC1Cc2ccccc2C1Br Amb25106421 [0,1,0,1,0,0|2,0,0]=4 9978 B12R2.18 CC1Cc2ccccc2C1Cl Amb18183547 [0,1,0,1,0,0|2,0,0]=4 9979 B12R2.18 CC1Cc2ccccc2C1N Amb19373701 [0,1,0,1,0,0|1,0,0]=3 9980 B12R2.18 CC1Cc2ccccc2N1N Amb24065299 [0,1,0,1,0,0|0,0,0]=2 9981 B12R2.18 CC1Nc2ccccc2N1Cl Amb25095932 [0,1,0,1,0,0|2,0,0]=4 9982 B12R2.18 CC1Oc2ccccc2C1N Amb18943788 [0,1,0,1,0,0|2,0,0]=4 9983 B12R2.18 CC1Sc2ccccc2C1N Amb18278067 [0,1,0,1,0,0|2,0,0]=4 9984 B12R2.18 CN1C(C)Cc2c[n]ccc12 Amb25677255 [0,1,0,1,0,0|2,0,0]=4 9985 B12R2.18 CN1C(N)Sc2ccccc12 Amb24102371 [0,1,0,1,0,0|2,0,0]=4 9986 B12R2.18 CN1[C@H](C)Cc2ccccc12 Amb24068204 [0,1,0,1,0,0|1,0,0]=3 9987 B12R2.18 C[C@@H]1Cc2ccccc2C1=O Amb25282759 [0,1,0,1,0,0|2,0,0]=4 9988 B12R2.18 C[C@@H]1Cc2ccccc2[C@@H]1N Amb24578752 [0,1,0,1,0,0|1,0,0]=3 9989 B12R2.18 C[C@@H]1[C@@H](O)Cc2ccccc21 Amb25176418 [0,1,0,1,0,0|2,0,0]=4 9990 B12R2.18 C[C@@H]1[C@H](O)Cc2ccccc21 Amb24546023 [0,1,0,1,0,0|2,0,0]=4 9991 B12R2.18 C[C@H]1[C@@H](N)Cc2ccccc21 Amb24562844 [0,1,0,1,0,0|2,0,0]=4 9992 B12R2.18 ClC1Cc2ccccc2C1Cl Amb25770688 [0,1,0,1,0,0|2,0,0]=4 9993 B12R2.18 Cl[C@@H]1Cc2ccccc2[C@@H]1Cl Amb25366590 [0,1,0,1,0,0|2,0,0]=4 9994 B12R2.18 Cl[C@@H]1Cc2ccccc2[C@H]1Cl Amb25242520 [0,1,0,1,0,0|2,0,0]=4 9995 B12R2.18 FC1C(Br)Cc2ccccc21 Amb25857057 [0,1,0,1,0,0|2,0,0]=4 9996 B12R2.18 NC1C(C)Cc2c1cccc2 Amb17232033 [0,1,0,1,0,0|1,0,0]=3 9997 B12R2.18 NC1C(F)Cc2ccccc21 Amb24459876 [0,1,0,1,0,0|1,0,0]=3 9998 B12R2.18 NC1C(N)Cc2c1cccc2 Amb13953204 [0,1,0,1,0,0|1,0,0]=3 9999 B12R2.18 NC1C(O)Nc2ccccc21 Amb25722216 [0,1,0,1,0,0|2,0,0]=4 10000 B12R2.18 NC1Cc2ccccc2C1=O Amb19958907 [0,1,0,1,0,0|2,0,0]=4 10001 B12R2.18 NC1Cc2ccccc2C1F Amb24655749 [0,1,0,1,0,0|2,0,0]=4 10002 B12R2.18 NC1Cc2ccccc2C1O Amb20623676 [0,1,0,1,0,0|2,0,0]=4 10003 B12R2.18 NC1[C@H](O)Cc2ccccc21 Amb24401902 [0,1,0,1,0,0|1,0,0]=3 10004 B12R2.18 NN1C(=O)Nc2ccccc12 Amb18124952 [0,1,0,1,0,0|1,0,1]=4 10005 B12R2.18 NN1C(=O)Oc2ccccc12 Amb18644412 [0,1,0,1,0,0|1,0,1]=4 10006 B12R2.18 N[C@@H]1Cc2ccccc2C1=O Amb22747360 [0,1,0,1,0,0|2,0,0]=4 10007 B12R2.18 N[C@@H]1Cc2ccccc2C1=O Amb24390795 [0,1,0,1,0,0|2,0,0]=4 10008 B12R2.18 N[C@@H]1Cc2ccccc2C1O Amb25209005 [0,1,0,1,0,0|2,0,0]=4 10009 B12R2.18 N[C@@H]1Cc2ccccc2[C@@H]1N Amb22745804 [0,1,0,1,0,0|1,0,0]=3 10010 B12R2.18 N[C@@H]1Cc2ccccc2[C@@H]1O Amb24501357 [0,1,0,1,0,0|2,0,0]=4 10011 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1N Amb22748292 [0,1,0,1,0,0|1,0,0]=3 10012 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb22388538 [0,1,0,1,0,0|2,0,0]=4 10013 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb25379044 [0,1,0,1,0,0|2,0,0]=4 10014 B12R2.18 N[C@@H]1[C@@H](Cl)Cc2ccccc21 Amb24519208 [0,1,0,1,0,0|1,0,0]=3 10015 B12R2.18 N[C@@H]1[C@@H](F)Cc2ccccc21 Amb25252184 [0,1,0,1,0,0|1,0,0]=3 10016 B12R2.18 N[C@@H]1[C@@H](O)Cc2c1cccc2 Amb10842191 [0,1,0,1,0,0|1,0,0]=3 10017 B12R2.18 N[C@@H]1[C@H](Cl)Cc2ccccc21 Amb24641556 [0,1,0,1,0,0|1,0,0]=3 10018 B12R2.18 N[C@@H]1[C@H](O)Cc2ccccc12 Amb17779311 [0,1,0,1,0,0|1,0,0]=3 10019 B12R2.18 N[C@H]1C(O)Cc2ccccc21 Amb24427360 [0,1,0,1,0,0|1,0,0]=3 10020 B12R2.18 N[C@H]1Cc2ccccc2[C@@H]1N Amb24624674 [0,1,0,1,0,0|1,0,0]=3 10021 B12R2.18 N[C@H]1Cc2ccccc2[C@H]1O Amb24540566 [0,1,0,1,0,0|2,0,0]=4 10022 B12R2.18 N[C@H]1[C@H](O)Cc2c1cccc2 Amb10842210 [0,1,0,1,0,0|1,0,0]=3 10023 B12R2.18 Nn1c(C)nc2c1cccc2 Amb1156070 [0,1,0,1,0,0|1,0,1]=4 10024 B12R2.18 Nn1c(Cl)nc2c1cccc2 Amb1082479 [0,1,0,1,0,0|1,0,1]=4 10025 B12R2.18 Nn1c(N)nc2c1cccc2 Amb1147317 [0,1,0,1,0,0|1,0,1]=4 10026 B12R2.18 O=C1C(F)Cc2c1cccc2 Amb17593723 [0,1,0,1,0,0|2,0,0]=4 10027 B12R2.18 O=C1C(I)Cc2c1cccc2 Amb16232280 [0,1,0,1,0,0|2,0,0]=4 10028 B12R2.18 O=C1C(N)Cc2c1cccc2 Amb17470380 [0,1,0,1,0,0|2,0,0]=4 10029 B12R2.18 O=C1Cc2c(N1C)cccc2 Amb1398903 [0,1,0,1,0,0|1,0,1]=4 10030 B12R2.18 O=C1Cc2c(N1N)cccc2 Amb10560115 [0,1,0,1,0,0|0,0,1]=3 10031 B12R2.18 O=C1[C@@H](Br)Cc2ccccc21 Amb24669064 [0,1,0,1,0,0|2,0,0]=4 10032 B12R2.18 O=C1[C@H](Br)Cc2ccccc21 Amb25827588 [0,1,0,1,0,0|2,0,0]=4 10033 B12R2.18 OC1C(Br)Cc2c1cccc2 Amb1159074 [0,1,0,1,0,0|2,0,0]=4 10034 B12R2.18 OC1C(F)Cc2ccccc21 Amb24423988 [0,1,0,1,0,0|2,0,0]=4 10035 B12R2.18 OC1C(N)Cc2c1cccc2 Amb2383051 [0,1,0,1,0,0|2,0,0]=4 10036 B12R2.18 OC1Cc2ccccc2C1=O Amb25342077 [0,1,0,1,0,0|2,0,0]=4 10037 B12R2.18 OC1Cc2ccccc2C1Br Amb25785578 [0,1,0,1,0,0|2,0,0]=4 10038 B12R2.18 OC1Cc2ccccc2C1F Amb24672733 [0,1,0,1,0,0|2,0,0]=4 10039 B12R2.18 OC1Cc2ccccc2C1O Amb24323306 [0,1,0,1,0,0|2,0,0]=4 10040 B12R2.18 OC1Cc2ccccc2C1S Amb24430077 [0,1,0,1,0,0|2,0,0]=4 10041 B12R2.18 ON1C(=O)Cc2ccccc12 Amb17940424 [0,1,0,1,0,0|1,0,1]=4 10042 B12R2.18 O[C@@H]1C(Br)Cc2ccccc21 Amb25061997 [0,1,0,1,0,0|2,0,0]=4 10043 B12R2.18 O[C@@H]1Cc2ccccc2C1=O Amb24725355 [0,1,0,1,0,0|2,0,0]=4 10044 B12R2.18 O[C@@H]1Cc2ccccc2[C@@H]1Cl Amb24650956 [0,1,0,1,0,0|2,0,0]=4 10045 B12R2.18 O[C@@H]1Cc2ccccc2[C@@H]1O Amb22800784 [0,1,0,1,0,0|2,0,0]=4 10046 B12R2.18 O[C@@H]1[C@@H](F)Cc2ccccc21 Amb25200299 [0,1,0,1,0,0|2,0,0]=4 10047 B12R2.18 O[C@@H]1[C@H](F)Cc2ccccc21 Amb25176954 [0,1,0,1,0,0|2,0,0]=4 10048 B12R2.18 O[C@H]1Cc2ccccc2[C@@H]1Br Amb24682797 [0,1,0,1,0,0|2,0,0]=4 10049 B12R2.18 O[C@H]1Cc2ccccc2[C@@H]1F Amb25240021 [0,1,0,1,0,0|2,0,0]=4 10050 B12R2.18 O[C@H]1Cc2ccccc2[C@H]1O Amb22230411 [0,1,0,1,0,0|2,0,0]=4 10051 B12R2.18 O[C@H]1[C@H](Cl)Cc2ccccc21 Amb24519428 [0,1,0,1,0,0|2,0,0]=4 10052 B12R2.18 O[C@H]1[C@H](O)Cc2c1cccc2 Amb10982589 [0,1,0,1,0,0|2,0,0]=4 10053 B12R2.18 [NH3+][C@@H]1Cc2ccccc2[C@H]1O Amb22224837 [0,1,0,1,0,0|2,0,0]=4 10054 B12R2.37 CC1C(O)C1c2ccccc2 Amb24457875 [0,1,0,1,0,0|2,0,0]=4 10055 B12R2.37 C[C@@H]1C(c2ccccc2)[N@@]1C Amb23513697 [0,1,0,1,0,0|1,0,0]=3 10056 B12R2.37 C[C@@H]1[C@H](Cl)[C@@H]1c2ccccc2 Amb25321015 [0,1,0,1,0,0|2,0,0]=4 10057 B12R2.37 C[C@@H]1[C@H](Cl)[C@H]1c2ccccc2 Amb24511894 [0,1,0,1,0,0|2,0,0]=4 10058 B12R2.37 C[C@H]1C(Cl)[C@@H]1c2ccccc2 Amb25173083 [0,1,0,1,0,0|2,0,0]=4 10059 B12R2.37 C[C@H]1[C@H](Cl)[C@@H]1c2ccccc2 Amb25320879 [0,1,0,1,0,0|2,0,0]=4 10060 B12R2.37 N[C@@H]1[C@H]([C@@H]1N)c2ccccc2 Amb24761507 [0,1,0,1,0,0|1,0,0]=3 10061 B12R2.37 N[C@H]1C([C@@H]1N)c2ccccc2 Amb25230184 [0,1,0,1,0,0|1,0,0]=3 10062 B12R2.94 CC1(Cc2ccccc2)NN1 Amb24672487 [0,1,0,1,0,0|0,0,0]=2 10063 B12R2.94 FC1(Cc2ccccc2)N=N1 Amb24425472 [0,1,0,1,0,0|0,0,2]=4 10064 B12R2.94 NC1(Cc2ccccc2)CC1 Amb22587208 [0,1,0,1,0,0|2,0,0]=4 10065 B12R2.94 OC1(Cc2ccccc2)CC1 Amb19374431 [0,1,0,1,0,0|2,0,0]=4 10066 B12R2.2051 CC1(Cc2ccccc12)C=C Amb17778871 [0,1,0,1,0,0|2,0,0]=4 10067 B12R2.2051 ClC1(Cc2ccccc12)C#N Amb17844057 [0,1,0,1,0,0|1,0,1]=4 10068 B12R2.92 BrC1(Br)CC1c2ccccc2 Amb22363907 [0,1,0,1,0,0|2,0,0]=4 10069 B12R2.92 CC1(C)CC1c2ccccc2 Amb22052702 [0,1,0,1,0,0|2,0,0]=4 10070 B12R2.92 C[C@@]1(N)C[C@H]1c2ccccc2 Amb25378765 [0,1,0,1,0,0|1,0,0]=3 10071 B12R2.92 C[C@]1(N)C[C@@H]1c2ccccc2 Amb24613115 [0,1,0,1,0,0|1,0,0]=3 10072 B12R2.92 FC1(F)CC1c2ccccc2 Amb22227684 [0,1,0,1,0,0|2,0,0]=4 10073 B12R2.2403 CC1(C)CCc2ccccc12 Amb24657207 [0,1,0,1,0,0|2,0,0]=4 10074 B12R2.2403 N[C@]1(O)CCc2ccccc12 Amb24472858 [0,1,0,1,0,0|1,0,0]=3 10075 B12R2.3190 CC(O)C1Cc2ccccc21 Amb24538275 [0,1,0,1,0,0|2,0,0]=4 10076 B12R2.3190 C[C@@H](N)C1Cc2ccccc21 Amb25047176 [0,1,0,1,0,0|1,0,0]=3 10077 B12R2.3190 C[C@@H](O)C1Cc2ccccc21 Amb25151401 [0,1,0,1,0,0|2,0,0]=4 10078 B12R2.3190 C[C@H](O)C1Cc2ccccc21 Amb25172779 [0,1,0,1,0,0|2,0,0]=4 10079 B12R2.3190 NC(=N)C1Cc2ccccc21 Amb25152697 [0,1,0,1,0,0|1,0,0]=3 10080 B12R2.3190 NC(=O)C1Cc2ccccc21 Amb25064297 [0,1,0,1,0,0|1,0,0]=3 10081 B12R2.3190 NC(=S)C1Cc2ccccc21 Amb25152696 [0,1,0,1,0,0|1,0,0]=3 10082 B12R2.3190 O=C(Cl)C1Cc2ccccc21 Amb24745572 [0,1,0,1,0,0|2,0,0]=4 10083 B12R3.12 c1ccc2c(c1)C3OC3C2 Amb1131588 [0,0,0,2,0,0|2,0,0]=4 10084 B8R1.8 BrCC[n]1cccc1 Amb17933298 [1,0,0,0,1,0|2,0,0]=4 10085 B8R1.8 BrCCc1c[nH]cc1 Amb18862863 [1,0,0,0,1,0|2,0,0]=4 10086 B8R1.8 BrCCc1c[s]cc1 Amb18325324 [1,0,0,0,1,0|2,0,0]=4 10087 B8R1.8 BrCCc1ccc[nH]1 Amb25312927 [1,0,0,0,1,0|2,0,0]=4 10088 B8R1.8 BrCCc1ccco1 Amb22752866 [1,0,0,0,1,0|2,0,0]=4 10089 B8R1.8 BrCCc1cccs1 Amb16234134 [1,0,0,0,1,0|2,0,0]=4 10090 B8R1.8 BrCCc1cocc1 Amb19374721 [1,0,0,0,1,0|2,0,0]=4 10091 B8R1.8 CCCc1ccco1 Amb10070288 [1,0,0,0,1,0|2,0,0]=4 10092 B8R1.8 CCCc1ccsc1 Amb17689448 [1,0,0,0,1,0|2,0,0]=4 10093 B8R1.8 CCCc1cocc1 Amb24332079 [1,0,0,0,1,0|2,0,0]=4 10094 B8R1.8 CNCc1c[nH]cc1 Amb18062155 [1,0,0,0,1,0|2,0,0]=4 10095 B8R1.8 CNCc1ccco1 Amb1153202 [1,0,0,0,1,0|2,0,0]=4 10096 B8R1.8 CNCc1cccs1 Amb1152299 [1,0,0,0,1,0|2,0,0]=4 10097 B8R1.8 CNCc1cocc1 Amb17658965 [1,0,0,0,1,0|2,0,0]=4 10098 B8R1.8 CNCc1cscc1 Amb1154137 [1,0,0,0,1,0|2,0,0]=4 10099 B8R1.8 ClCC[n]1cccc1 Amb19944678 [1,0,0,0,1,0|2,0,0]=4 10100 B8R1.8 ClCCc1c[nH]cc1 Amb18222716 [1,0,0,0,1,0|2,0,0]=4 10101 B8R1.8 ClCCc1ccco1 Amb24555129 [1,0,0,0,1,0|2,0,0]=4 10102 B8R1.8 ICCc1c[s]cc1 Amb25857183 [1,0,0,0,1,0|2,0,0]=4 10103 B8R1.8 ICCc1ccc[s]1 Amb25106538 [1,0,0,0,1,0|2,0,0]=4 10104 B8R1.8 NCC[n]1c[n]cc1 Amb17659443 [1,0,0,0,1,0|2,0,0]=4 10105 B8R1.8 NCC[n]1c[n]cc1 Amb22490720 [1,0,0,0,1,0|2,0,0]=4 10106 B8R1.8 NCC[n]1ccc[n]1 Amb21954209 [1,0,0,0,1,0|2,0,0]=4 10107 B8R1.8 NCC[n]1ccc[n]1 Amb22284088 [1,0,0,0,1,0|2,0,0]=4 10108 B8R1.8 NCC[n]1cccc1 Amb22757166 [1,0,0,0,1,0|1,0,0]=3 10109 B8R1.8 NCC[n]1cccc1 Amb22904207 [1,0,0,0,1,0|1,0,0]=3 10110 B8R1.8 NCCc1[nH]cc[n]1 Amb19373032 [1,0,0,0,1,0|2,0,0]=4 10111 B8R1.8 NCCc1[nH]cc[n]1 Amb22752058 [1,0,0,0,1,0|2,0,0]=4 10112 B8R1.8 NCCc1c[nH][n]c1 Amb21954289 [1,0,0,0,1,0|2,0,0]=4 10113 B8R1.8 NCCc1c[nH][n]c1 Amb22498643 [1,0,0,0,1,0|2,0,0]=4 10114 B8R1.8 NCCc1c[nH]c[n]1 Amb22167389 [1,0,0,0,1,0|2,0,0]=4 10115 B8R1.8 NCCc1c[nH]c[n]1 Amb22265029 [1,0,0,0,1,0|2,0,0]=4 10116 B8R1.8 NCCc1c[nH]c[n]1 Amb22265030 [1,0,0,0,1,0|2,0,0]=4 10117 B8R1.8 NCCc1c[nH]c[n]1 Amb22396005 [1,0,0,0,1,0|2,0,0]=4 10118 B8R1.8 NCCc1c[nH]cc1 Amb18061637 [1,0,0,0,1,0|1,0,0]=3 10119 B8R1.8 NCCc1c[nH]cn1 Amb1101977 [1,0,0,0,1,0|2,0,0]=4 10120 B8R1.8 NCCc1c[nH]nc1 Amb1102694 [1,0,0,0,1,0|2,0,0]=4 10121 B8R1.8 NCCc1c[n][s]c1 Amb18202921 [1,0,0,0,1,0|2,0,0]=4 10122 B8R1.8 NCCc1c[n]c[nH]1 Amb22489452 [1,0,0,0,1,0|2,0,0]=4 10123 B8R1.8 NCCc1c[n]c[s]1 Amb22491501 [1,0,0,0,1,0|2,0,0]=4 10124 B8R1.8 NCCc1c[n]c[s]1 Amb22491503 [1,0,0,0,1,0|2,0,0]=4 10125 B8R1.8 NCCc1c[n]oc1 Amb22756366 [1,0,0,0,1,0|2,0,0]=4 10126 B8R1.8 NCCc1cc[nH][n]1 Amb21961487 [1,0,0,0,1,0|2,0,0]=4 10127 B8R1.8 NCCc1cc[s][n]1 Amb18832148 [1,0,0,0,1,0|2,0,0]=4 10128 B8R1.8 NCCc1ccc[nH]1 Amb18281448 [1,0,0,0,1,0|1,0,0]=3 10129 B8R1.8 NCCc1ccc[nH]1 Amb22497242 [1,0,0,0,1,0|1,0,0]=3 10130 B8R1.8 NCCc1ccc[nH]1 Amb22751407 [1,0,0,0,1,0|1,0,0]=3 10131 B8R1.8 NCCc1ccco1 Amb1080943 [1,0,0,0,1,0|1,0,0]=3 10132 B8R1.8 NCCc1ccco1 Amb22587649 [1,0,0,0,1,0|1,0,0]=3 10133 B8R1.8 NCCc1cccs1 Amb1073690 [1,0,0,0,1,0|1,0,0]=3 10134 B8R1.8 NCCc1ccn[nH]1 Amb17621964 [1,0,0,0,1,0|2,0,0]=4 10135 B8R1.8 NCCc1cocc1 Amb18833105 [1,0,0,0,1,0|1,0,0]=3 10136 B8R1.8 NCCc1cscc1 Amb2236392 [1,0,0,0,1,0|1,0,0]=3 10137 B8R1.8 NCCc1cscn1 Amb17935894 [1,0,0,0,1,0|2,0,0]=4 10138 B8R1.8 NCCc1nccs1 Amb10072657 [1,0,0,0,1,0|2,0,0]=4 10139 B8R1.8 NCCc1nccs1 Amb15741139 [1,0,0,0,1,0|2,0,0]=4 10140 B8R1.8 NCCn1cccc1 Amb2422800 [1,0,0,0,1,0|1,0,0]=3 10141 B8R1.8 NCCn1cccn1 Amb1099286 [1,0,0,0,1,0|2,0,0]=4 10142 B8R1.8 NCCn1cncc1 Amb10068902 [1,0,0,0,1,0|2,0,0]=4 10143 B8R1.8 NCCn1cncc1 Amb2236264 [1,0,0,0,1,0|2,0,0]=4 10144 B8R1.8 NNCc1[nH]cc[n]1 Amb25328254 [1,0,0,0,1,0|2,0,0]=4 10145 B8R1.8 NNCc1c[n]c[s]1 Amb19664525 [1,0,0,0,1,0|2,0,0]=4 10146 B8R1.8 NNCc1cc[n][s]1 Amb24548952 [1,0,0,0,1,0|2,0,0]=4 10147 B8R1.8 NNCc1cc[s][n]1 Amb25358721 [1,0,0,0,1,0|2,0,0]=4 10148 B8R1.8 NNCc1ccc[nH]1 Amb19664692 [1,0,0,0,1,0|1,0,0]=3 10149 B8R1.8 NNCc1ccc[s]1 Amb22587449 [1,0,0,0,1,0|1,0,0]=3 10150 B8R1.8 NNCc1cco[n]1 Amb24465273 [1,0,0,0,1,0|2,0,0]=4 10151 B8R1.8 NOCc1c[nH]cc1 Amb25045375 [1,0,0,0,1,0|2,0,0]=4 10152 B8R1.8 NOCc1c[s]cc1 Amb24746528 [1,0,0,0,1,0|2,0,0]=4 10153 B8R1.8 NOCc1ccc[s]1 Amb25189036 [1,0,0,0,1,0|2,0,0]=4 10154 B8R1.8 NOCc1ccco1 Amb25141783 [1,0,0,0,1,0|2,0,0]=4 10155 B8R1.8 NOCc1cocc1 Amb24564546 [1,0,0,0,1,0|2,0,0]=4 10156 B8R1.8 OCCC1=CCC=C1 Amb25700126 [1,0,0,0,1,0|1,0,1]=4 10157 B8R1.8 OCCC1C=CC=C1 Amb25356398 [1,0,0,0,1,0|1,0,1]=4 10158 B8R1.8 OCCC=1CC=CC1 Amb25795365 [1,0,0,0,1,0|1,0,1]=4 10159 B8R1.8 OCCc1c[nH]cc1 Amb18860246 [1,0,0,0,1,0|2,0,0]=4 10160 B8R1.8 OCCc1ccc[nH]1 Amb17593146 [1,0,0,0,1,0|2,0,0]=4 10161 B8R1.8 OCCc1ccco1 Amb17089516 [1,0,0,0,1,0|2,0,0]=4 10162 B8R1.8 OCCc1cccs1 Amb2099445 [1,0,0,0,1,0|2,0,0]=4 10163 B8R1.8 OCCc1cocc1 Amb25802261 [1,0,0,0,1,0|2,0,0]=4 10164 B8R1.8 ONCc1c[nH]cc1 Amb25677397 [1,0,0,0,1,0|2,0,0]=4 10165 B8R1.8 ONCc1ccc[nH]1 Amb25071150 [1,0,0,0,1,0|2,0,0]=4 10166 B8R1.8 ONCc1ccc[s]1 Amb23449451 [1,0,0,0,1,0|2,0,0]=4 10167 B8R1.8 ONCc1ccco1 Amb23449450 [1,0,0,0,1,0|2,0,0]=4 10168 B8R1.8 SCCc1c[nH]cc1 Amb18560654 [1,0,0,0,1,0|2,0,0]=4 10169 B8R1.8 SCCc1c[s]cc1 Amb25300451 [1,0,0,0,1,0|2,0,0]=4 10170 B8R1.8 SCCc1ccco1 Amb24511324 [1,0,0,0,1,0|2,0,0]=4 10171 B8R1.8 SCCc1cccs1 Amb17399886 [1,0,0,0,1,0|2,0,0]=4 10172 B12R1.329 OCCCC=1C=CC=CC=CC1 Amb25225983 [0,0,0,0,0,2|2,0,0]=4