0 B10R1.17 BrC=C=Cc1ccccc1 Amb17673290 [0,0,0,0,0,0|2,0,2]=4 1 B10R1.17 BrCCCc1cc[n]cc1 Amb24094393 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.17 BrCCCc1cccnc1 Amb1102301 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.17 BrCCCc1cccnc1 Amb17610084 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.17 BrCCOc1ccccc1 Amb1152333 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.17 Br[Mg]C#Cc1ccccc1 Amb22353480 [0,0,0,0,0,0|2,0,2]=4 6 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [0,0,0,0,0,0|2,0,1]=3 7 B10R1.17 Br[Zn]C#Cc1ccccc1 Amb22898101 [0,0,0,0,0,0|2,0,2]=4 8 B10R1.17 Br[Zn]CCc1ccccc1 Amb22000434 [0,0,0,0,0,0|2,0,1]=3 9 B10R1.17 Br\C=C/Oc1ccccc1 Amb25794486 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.17 Br\C=C\Cc1ccccc1 Amb22053885 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.17 Br\C=N/Nc1ccccc1 Amb25783866 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.17 Br\C=N\Nc1ccccc1 Amb25274154 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.17 C#CC#Cc1ccccc1 Amb24585690 [0,0,0,0,0,0|2,0,2]=4 14 B10R1.17 C#CCCc1c[n]ccc1 Amb24085226 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.17 C#CCCc1cc[n]cc1 Amb24091331 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.17 C#CCCc1cccc[n]1 Amb24571654 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.17 C#CCNc1ccccc1 Amb21953889 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.17 C#C\C=C/c1c[n]ccc1 Amb24085625 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.17 C#C\C=C/c1cc[n]cc1 Amb24103178 [0,0,0,0,0,0|3,0,1]=4 20 B10R1.17 C#C\C=C\c1c[n]ccc1 Amb24576151 [0,0,0,0,0,0|3,0,1]=4 21 B10R1.17 C#C\C=C\c1cc[n]cc1 Amb25249989 [0,0,0,0,0,0|3,0,1]=4 22 B10R1.17 C#C\C=C\c1cccc[n]1 Amb24101873 [0,0,0,0,0,0|3,0,1]=4 23 B10R1.17 C#C\C=C\c1ccccc1 Amb25146407 [0,0,0,0,0,0|2,0,1]=3 24 B10R1.17 C=C/C=C/c1ccccc1 Amb17938988 [0,0,0,0,0,0|2,0,1]=3 25 B10R1.17 C=C=CCc1cccc[n]1 Amb24649907 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.17 C=C=COc1ccccc1 Amb17673264 [0,0,0,0,0,0|3,0,0]=3 27 B10R1.17 C=CC#Cc1ccccc1 Amb25696607 [0,0,0,0,0,0|2,0,2]=4 28 B10R1.17 C=CCCc1c[n]ccc1 Amb24477186 [0,0,0,0,0,0|3,0,1]=4 29 B10R1.17 C=CCCc1cc[n]cc1 Amb25719590 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.17 C=CCCc1cccc[n]1 Amb25337662 [0,0,0,0,0,0|3,0,1]=4 31 B10R1.17 C=CC[Se]c1ccccc1 Amb22729991 [0,0,0,0,0,0|3,0,1]=4 32 B10R1.17 C=CNCc1ccccc1 Amb24505107 [0,0,0,0,0,0|3,0,0]=3 33 B10R1.17 C=COCc1ccccc1 Amb17940722 [0,0,0,0,0,0|3,0,0]=3 34 B10R1.17 C=C\C=C/c1cccc[n]1 Amb25697110 [0,0,0,0,0,0|3,0,1]=4 35 B10R1.17 C=C\C=C\c1cccc[n]1 Amb24101872 [0,0,0,0,0,0|3,0,1]=4 36 B10R1.17 C=NOCc1ccccc1 Amb24704253 [0,0,0,0,0,0|2,0,0]=2 37 B10R1.17 CC#COc1ccccc1 Amb25146348 [0,0,0,0,0,0|3,0,1]=4 38 B10R1.17 CC/C=C/c1ccccc1 Amb17673826 [0,0,0,0,0,0|2,0,1]=3 39 B10R1.17 CCC=Cc1c[n]ccc1 Amb24085334 [0,0,0,0,0,0|3,0,1]=4 40 B10R1.17 CCCCc1ccccn1 Amb10574134 [0,0,0,0,0,0|3,0,1]=4 41 B10R1.17 CCCCc1ccncc1 Amb10555008 [0,0,0,0,0,0|3,0,1]=4 42 B10R1.17 CCCNc1ccccc1 Amb22284540 [0,0,0,0,0,0|3,0,1]=4 43 B10R1.17 CCN=Cc1ccccc1 Amb15692852 [0,0,0,0,0,0|3,0,1]=4 44 B10R1.17 CCNCc1c[n]ccc1 Amb21972163 [0,0,0,0,0,0|4,0,0]=4 45 B10R1.17 CCNCc1ccncc1 Amb1214646 [0,0,0,0,0,0|4,0,0]=4 46 B10R1.17 CC\C=C/c1c[n]ccc1 Amb24602371 [0,0,0,0,0,0|3,0,1]=4 47 B10R1.17 CC\C=C/c1cc[n]cc1 Amb25831273 [0,0,0,0,0,0|3,0,1]=4 48 B10R1.17 CC\C=C\c1cc[n]cc1 Amb25379243 [0,0,0,0,0,0|3,0,1]=4 49 B10R1.17 CC\C=C\c1cccc[n]1 Amb22170387 [0,0,0,0,0,0|3,0,1]=4 50 B10R1.17 CC\N=C\c1ccccc1 Amb10558476 [0,0,0,0,0,0|3,0,1]=4 51 B10R1.17 CN/N=C/c1ccccc1 Amb17867553 [0,0,0,0,0,0|2,0,2]=4 52 B10R1.17 CN=C=Nc1ccccc1 Amb24096797 [0,0,0,0,0,0|2,0,1]=3 53 B10R1.17 CNCCc1cc[n]cc1 Amb19958269 [0,0,0,0,0,0|2,0,2]=4 54 B10R1.17 CNCCc1cccc[n]1 Amb22167479 [0,0,0,0,0,0|2,0,2]=4 55 B10R1.17 CNCCc1ccccc1 Amb1132990 [0,0,0,0,0,0|1,0,2]=3 56 B10R1.17 CNCCc1ccccc1 Amb2119452 [0,0,0,0,0,0|1,0,2]=3 57 B10R1.17 CNCCc1ccccn1 Amb1651624 [0,0,0,0,0,0|2,0,2]=4 58 B10R1.17 CNCCc1cccnc1 Amb10068754 [0,0,0,0,0,0|2,0,2]=4 59 B10R1.17 CNCCc1cccnc1 Amb10576212 [0,0,0,0,0,0|2,0,2]=4 60 B10R1.17 CNCCc1cccnc1 Amb10576410 [0,0,0,0,0,0|2,0,2]=4 61 B10R1.17 CNCCc1ccncc1 Amb10071184 [0,0,0,0,0,0|2,0,2]=4 62 B10R1.17 CNNCc1c[n]ccc1 Amb24558769 [0,0,0,0,0,0|3,0,1]=4 63 B10R1.17 CNNCc1ccccc1 Amb10553073 [0,0,0,0,0,0|2,0,1]=3 64 B10R1.17 CNOCc1ccccc1 Amb22059601 [0,0,0,0,0,0|2,0,1]=3 65 B10R1.17 CN\C=N\c1c[n]ccc1 Amb24671021 [0,0,0,0,0,0|3,0,1]=4 66 B10R1.17 CN\C=N\c1cc[n]cc1 Amb25147549 [0,0,0,0,0,0|3,0,1]=4 67 B10R1.17 CN\C=N\c1ccccc1 Amb25348617 [0,0,0,0,0,0|2,0,1]=3 68 B10R1.17 CN\N=N\c1ccccc1 Amb25720206 [0,0,0,0,0,0|3,0,1]=4 69 B10R1.17 COCC[n+]1ccccc1 Amb10554471 [0,0,0,0,0,0|3,0,1]=4 70 B10R1.17 COCCc1cccc[n]1 Amb24089662 [0,0,0,0,0,0|3,0,1]=4 71 B10R1.17 COCNc1ccccc1 Amb10565397 [0,0,0,0,0,0|3,0,1]=4 72 B10R1.17 CON=Cc1ccccc1 Amb22896936 [0,0,0,0,0,0|3,0,1]=4 73 B10R1.17 CONCc1c[n]ccc1 Amb24062508 [0,0,0,0,0,0|4,0,0]=4 74 B10R1.17 CONCc1cc[n]cc1 Amb25046027 [0,0,0,0,0,0|4,0,0]=4 75 B10R1.17 CONCc1cccc[n]1 Amb25723329 [0,0,0,0,0,0|4,0,0]=4 76 B10R1.17 CO\C=C/c1c[n]ccc1 Amb24085685 [0,0,0,0,0,0|3,0,1]=4 77 B10R1.17 CO\C=C/c1cc[n]cc1 Amb24103279 [0,0,0,0,0,0|3,0,1]=4 78 B10R1.17 CO\C=C/c1cccc[n]1 Amb24106783 [0,0,0,0,0,0|3,0,1]=4 79 B10R1.17 CO\C=C\c1c[n]ccc1 Amb24085666 [0,0,0,0,0,0|3,0,1]=4 80 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [0,0,0,0,0,0|2,0,1]=3 81 B10R1.17 CO\C=N\c1c[n]ccc1 Amb25217756 [0,0,0,0,0,0|4,0,0]=4 82 B10R1.17 CO\N=C\c1ccccc1 Amb25762975 [0,0,0,0,0,0|3,0,1]=4 83 B10R1.17 CSCCc1cccc[n]1 Amb24552366 [0,0,0,0,0,0|3,0,1]=4 84 B10R1.17 CSCCc1ccncc1 Amb1864660 [0,0,0,0,0,0|3,0,1]=4 85 B10R1.17 CSCOc1ccccc1 Amb22231357 [0,0,0,0,0,0|3,0,1]=4 86 B10R1.17 CSCSc1ccccc1 Amb25162526 [0,0,0,0,0,0|3,0,1]=4 87 B10R1.17 CSSCc1ccccc1 Amb22230274 [0,0,0,0,0,0|3,0,0]=3 88 B10R1.17 C\C=C/Oc1cccc[n]1 Amb24101907 [0,0,0,0,0,0|4,0,0]=4 89 B10R1.17 C\C=C\C[n+]1ccccc1 Amb24464480 [0,0,0,0,0,0|3,0,0]=3 90 B10R1.17 C\C=C\Oc1cccc[n]1 Amb24101879 [0,0,0,0,0,0|4,0,0]=4 91 B10R1.17 C\C=C\Oc1ccccc1 Amb10564701 [0,0,0,0,0,0|3,0,0]=3 92 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [0,0,0,0,0,0|3,0,0]=3 93 B10R1.17 C\C=N\Cc1cc[n]cc1 Amb25243601 [0,0,0,0,0,0|4,0,0]=4 94 B10R1.17 ClC=C=Cc1ccccc1 Amb17670635 [0,0,0,0,0,0|2,0,2]=4 95 B10R1.17 ClC=CCc1ccccc1 Amb24093913 [0,0,0,0,0,0|2,0,0]=2 96 B10R1.17 ClCC#Cc1ccccc1 Amb17772264 [0,0,0,0,0,0|2,0,2]=4 97 B10R1.17 ClCC=Cc1c[n]ccc1 Amb24082988 [0,0,0,0,0,0|3,0,1]=4 98 B10R1.17 ClCCC[n+]1ccccc1 Amb24487853 [0,0,0,0,0,0|3,0,1]=4 99 B10R1.17 ClCCCc1cc[n]cc1 Amb21961566 [0,0,0,0,0,0|3,0,1]=4 100 B10R1.17 ClCCCc1ccccn1 Amb17477793 [0,0,0,0,0,0|3,0,1]=4 101 B10R1.17 ClCCCc1cccnc1 Amb17477795 [0,0,0,0,0,0|3,0,1]=4 102 B10R1.17 ClCCCc1ccncc1 Amb17477794 [0,0,0,0,0,0|3,0,1]=4 103 B10R1.17 ClCCNc1ccccc1 Amb17334388 [0,0,0,0,0,0|3,0,1]=4 104 B10R1.17 ClCCPc1ccccc1 Amb24390336 [0,0,0,0,0,0|3,0,1]=4 105 B10R1.17 ClCSCc1ccccc1 Amb16231183 [0,0,0,0,0,0|3,0,0]=3 106 B10R1.17 ClC[SiH2]Cc1ccccc1 Amb24433498 [0,0,0,0,0,0|2,1,0]=3 107 B10R1.17 ClC\C=C/c1c[n]ccc1 Amb24567985 [0,0,0,0,0,0|3,0,1]=4 108 B10R1.17 ClC\C=C\c1cccc[n]1 Amb24353572 [0,0,0,0,0,0|3,0,1]=4 109 B10R1.17 Cl[Mg]CCc1ccccc1 Amb22338391 [0,0,0,0,0,0|2,0,1]=3 110 B10R1.17 Cl\C=C\C[n+]1ccccc1 Amb24396864 [0,0,0,0,0,0|3,0,0]=3 111 B10R1.17 Cl\C=C\Cc1cc[n]cc1 Amb24697784 [0,0,0,0,0,0|3,0,0]=3 112 B10R1.17 Cl\C=C\Cc1ccccc1 Amb24384369 [0,0,0,0,0,0|2,0,0]=2 113 B10R1.17 Cl\C=C\Sc1cccc[n]1 Amb24482148 [0,0,0,0,0,0|4,0,0]=4 114 B10R1.17 FCC#Cc1ccccc1 Amb24586400 [0,0,0,0,0,0|2,0,2]=4 115 B10R1.17 FCCCc1ccccc1 Amb25737014 [0,0,0,0,0,0|2,0,1]=3 116 B10R1.17 FCCOc1ccccc1 Amb25350055 [0,0,0,0,0,0|3,0,1]=4 117 B10R1.17 ICCCc1ccccc1 Amb10605506 [0,0,0,0,0,0|2,0,1]=3 118 B10R1.17 ICCOc1ccccc1 Amb10608588 [0,0,0,0,0,0|3,0,1]=4 119 B10R1.17 N#CC#Cc1ccccc1 Amb17593333 [0,0,0,0,0,0|2,0,2]=4 120 B10R1.17 N#CCCc1ccccn1 Amb1102488 [0,0,0,0,0,0|3,0,1]=4 121 B10R1.17 N#CCCc1cccnc1 Amb10605345 [0,0,0,0,0,0|3,0,1]=4 122 B10R1.17 N#CCNc1ccccc1 Amb1651088 [0,0,0,0,0,0|3,0,1]=4 123 B10R1.17 N#CNCc1cccnc1 Amb16186969 [0,0,0,0,0,0|4,0,0]=4 124 B10R1.17 N#CSCc1cc[n]cc1 Amb24596154 [0,0,0,0,0,0|4,0,0]=4 125 B10R1.17 N#C[Se]Cc1ccccc1 Amb22731764 [0,0,0,0,0,0|3,0,0]=3 126 B10R1.17 N#C\C=C\c1ccccc1 Amb1678044 [0,0,0,0,0,0|2,0,1]=3 127 B10R1.17 N#C\C=C\c1ccccn1 Amb17477820 [0,0,0,0,0,0|3,0,1]=4 128 B10R1.17 N#C\C=C\c1cccnc1 Amb17477822 [0,0,0,0,0,0|3,0,1]=4 129 B10R1.17 N#C\C=C\c1ccncc1 Amb17477821 [0,0,0,0,0,0|3,0,1]=4 130 B10R1.17 N=COCc1ccccc1 Amb22269902 [0,0,0,0,0,0|3,0,0]=3 131 B10R1.17 N=COCc1ccccc1 Amb24652885 [0,0,0,0,0,0|3,0,0]=3 132 B10R1.17 NCC#Cc1ccccc1 Amb1239477 [0,0,0,0,0,0|2,0,2]=4 133 B10R1.17 NCC#Cc1ccccc1 Amb2371766 [0,0,0,0,0,0|2,0,2]=4 134 B10R1.17 NCCCc1c[n]ccc1 Amb18363942 [0,0,0,0,0,0|3,0,1]=4 135 B10R1.17 NCCCc1cc[n]cc1 Amb22490382 [0,0,0,0,0,0|3,0,1]=4 136 B10R1.17 NCCCc1cc[n]cc1 Amb24099592 [0,0,0,0,0,0|3,0,1]=4 137 B10R1.17 NCCCc1cccc[n]1 Amb21954278 [0,0,0,0,0,0|3,0,1]=4 138 B10R1.17 NCCCc1ccccc1 Amb22490482 [0,0,0,0,0,0|2,0,1]=3 139 B10R1.17 NCCCc1ccccn1 Amb1088884 [0,0,0,0,0,0|3,0,1]=4 140 B10R1.17 NCCNc1ccccc1 Amb23412206 [0,0,0,0,0,0|3,0,1]=4 141 B10R1.17 NCCOc1ccccc1 Amb1214559 [0,0,0,0,0,0|3,0,1]=4 142 B10R1.17 NCCOc1ccccc1 Amb2099529 [0,0,0,0,0,0|3,0,1]=4 143 B10R1.17 NCCPc1ccccc1 Amb24482461 [0,0,0,0,0,0|3,0,1]=4 144 B10R1.17 NC\C=C/c1c[n]ccc1 Amb25349251 [0,0,0,0,0,0|3,0,1]=4 145 B10R1.17 NC\C=C/c1cc[n]cc1 Amb25295348 [0,0,0,0,0,0|3,0,1]=4 146 B10R1.17 NC\C=C/c1cccc[n]1 Amb25299216 [0,0,0,0,0,0|3,0,1]=4 147 B10R1.17 NC\C=C/c1ccccc1 Amb24746209 [0,0,0,0,0,0|2,0,1]=3 148 B10R1.17 NC\C=C\c1c[n]ccc1 Amb18063302 [0,0,0,0,0,0|3,0,1]=4 149 B10R1.17 NC\C=C\c1cc[n]cc1 Amb18062333 [0,0,0,0,0,0|3,0,1]=4 150 B10R1.17 NC\C=C\c1cccc[n]1 Amb18063261 [0,0,0,0,0,0|3,0,1]=4 151 B10R1.17 NC\C=C\c1ccccc1 Amb16187112 [0,0,0,0,0,0|2,0,1]=3 152 B10R1.17 NNC#Cc1ccccc1 Amb24443265 [0,0,0,0,0,0|1,0,3]=4 153 B10R1.17 NNCCc1c[n]ccc1 Amb22491198 [0,0,0,0,0,0|2,0,2]=4 154 B10R1.17 NNCCc1cccc[n]1 Amb20669588 [0,0,0,0,0,0|2,0,2]=4 155 B10R1.17 NNCCc1ccccc1 Amb10608987 [0,0,0,0,0,0|1,0,2]=3 156 B10R1.17 NNCCc1ccccc1 Amb1117029 [0,0,0,0,0,0|1,0,2]=3 157 B10R1.17 NOCCc1c[n]ccc1 Amb25779030 [0,0,0,0,0,0|3,0,1]=4 158 B10R1.17 NOCCc1ccccn1 Amb17231907 [0,0,0,0,0,0|3,0,1]=4 159 B10R1.17 NOCCc1ccncc1 Amb17231908 [0,0,0,0,0,0|3,0,1]=4 160 B10R1.17 O=C=C\C=C/1\C=CC=CN1 Amb25689817 [0,0,0,0,0,0|2,0,2]=4 161 B10R1.17 O=C=NCc1cccnc1 Amb17090261 [0,0,0,0,0,0|3,0,1]=4 162 B10R1.17 O=C=NCc1ccncc1 Amb17090262 [0,0,0,0,0,0|3,0,1]=4 163 B10R1.17 O=CCCc1ccccn1 Amb17081674 [0,0,0,0,0,0|2,0,2]=4 164 B10R1.17 O=CCCc1cccnc1 Amb17081675 [0,0,0,0,0,0|2,0,2]=4 165 B10R1.17 O=CCNc1ccccc1 Amb24566865 [0,0,0,0,0,0|2,0,2]=4 166 B10R1.17 O=CCSc1ccccc1 Amb17082903 [0,0,0,0,0,0|2,0,2]=4 167 B10R1.17 O=CNCc1cccc[n]1 Amb22370826 [0,0,0,0,0,0|3,0,1]=4 168 B10R1.17 O=CNCc1ccccc1 Amb1916036 [0,0,0,0,0,0|2,0,1]=3 169 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [0,0,0,0,0,0|1,0,2]=3 170 B10R1.17 O=C\C=C\c1cc[n]cc1 Amb24325387 [0,0,0,0,0,0|2,0,2]=4 171 B10R1.17 O=C\C=C\c1ccccn1 Amb17334135 [0,0,0,0,0,0|2,0,2]=4 172 B10R1.17 O=C\C=C\c1cccnc1 Amb17334136 [0,0,0,0,0,0|2,0,2]=4 173 B10R1.17 O=C\C=C\c1ccncc1 Amb17334137 [0,0,0,0,0,0|2,0,2]=4 174 B10R1.17 O=C\C=N\c1ccccc1 Amb24561719 [0,0,0,0,0,0|2,0,1]=3 175 B10R1.17 O=NC#Cc1ccccc1 Amb24068843 [0,0,0,0,0,0|0,0,3]=3 176 B10R1.17 OCC#Cc1ccccn1 Amb2227478 [0,0,0,0,0,0|2,0,2]=4 177 B10R1.17 OCCCC=1CC=CCC1 Amb22047467 [0,0,0,0,0,0|1,0,3]=4 178 B10R1.17 OCCCc1[n]ccc[n]1 Amb22499265 [0,0,0,0,0,0|3,0,1]=4 179 B10R1.17 OCCCc1c[n][n]cc1 Amb23559794 [0,0,0,0,0,0|3,0,1]=4 180 B10R1.17 OCCCc1c[n]c[n]c1 Amb24063145 [0,0,0,0,0,0|3,0,1]=4 181 B10R1.17 OCCCc1c[n]cc[n]1 Amb22499266 [0,0,0,0,0,0|3,0,1]=4 182 B10R1.17 OCCCc1cc[n]c[n]1 Amb24099660 [0,0,0,0,0,0|3,0,1]=4 183 B10R1.17 OCCCc1cccc[n]1 Amb22749323 [0,0,0,0,0,0|2,0,1]=3 184 B10R1.17 OCCNc1c[n]ccc1 Amb18266115 [0,0,0,0,0,0|3,0,1]=4 185 B10R1.17 OCCNc1ccccc1 Amb24065196 [0,0,0,0,0,0|2,0,1]=3 186 B10R1.17 OCCNc1ccccc1 Amb24065197 [0,0,0,0,0,0|2,0,1]=3 187 B10R1.17 OCCNc1ccccn1 Amb10809152 [0,0,0,0,0,0|3,0,1]=4 188 B10R1.17 OCCOc1c[n]ccc1 Amb19333986 [0,0,0,0,0,0|3,0,1]=4 189 B10R1.17 OCCOc1cccc[n]1 Amb23598433 [0,0,0,0,0,0|3,0,1]=4 190 B10R1.17 OCCOc1ccccc1 Amb2209344 [0,0,0,0,0,0|2,0,1]=3 191 B10R1.17 OCCOc1ccncc1 Amb10552812 [0,0,0,0,0,0|3,0,1]=4 192 B10R1.17 OCCSc1c[n]ccc1 Amb25343843 [0,0,0,0,0,0|3,0,1]=4 193 B10R1.17 OCNCc1ccccc1 Amb24756521 [0,0,0,0,0,0|2,0,0]=2 194 B10R1.17 OCOCc1ccccc1 Amb25727798 [0,0,0,0,0,0|2,0,0]=2 195 B10R1.17 OC\C=C\c1cc[n]cc1 Amb22749186 [0,0,0,0,0,0|2,0,1]=3 196 B10R1.17 OC\C=C\c1cccc[n]1 Amb22749315 [0,0,0,0,0,0|2,0,1]=3 197 B10R1.17 OC\C=C\c1cccnc1 Amb17619713 [0,0,0,0,0,0|2,0,1]=3 198 B10R1.17 OC\C=N\c1ccccc1 Amb25740591 [0,0,0,0,0,0|2,0,0]=2 199 B10R1.17 OC\N=C\c1ccccc1 Amb25105990 [0,0,0,0,0,0|2,0,1]=3 200 B10R1.17 ONCCc1ccccc1 Amb24117032 [0,0,0,0,0,0|0,0,2]=2 201 B10R1.17 ON\C=N\c1c[n]cc[n]1 Amb24743883 [0,0,0,0,0,0|3,0,1]=4 202 B10R1.17 O\N=C/Nc1ccc[n][n]1 Amb24478914 [0,0,0,0,0,0|3,0,0]=3 203 B10R1.17 O\N=C\Cc1cc[n]c[n]1 Amb24559505 [0,0,0,0,0,0|2,0,0]=2 204 B10R1.17 O\N=C\Nc1cc[n]c[n]1 Amb25367837 [0,0,0,0,0,0|3,0,0]=3 205 B10R1.17 S=C=CNc1ccccc1 Amb25728146 [0,0,0,0,0,0|2,1,0]=3 206 B10R1.17 S=C=NCc1ccccc1 Amb1102095 [0,0,0,0,0,0|2,1,0]=3 207 B10R1.17 S=C=NCc1cccnc1 Amb1107163 [0,0,0,0,0,0|3,1,0]=4 208 B10R1.17 SCCCc1ccccn1 Amb17399950 [0,0,0,0,0,0|2,1,1]=4 209 B10R1.17 SCCCc1cccnc1 Amb17399951 [0,0,0,0,0,0|2,1,1]=4 210 B10R1.17 SCCCc1ccncc1 Amb17399952 [0,0,0,0,0,0|2,1,1]=4 211 B10R1.17 SCCNc1ccccc1 Amb24065195 [0,0,0,0,0,0|2,1,1]=4 212 B10R1.17 SCCSc1ccccc1 Amb13881734 [0,0,0,0,0,0|2,1,1]=4 213 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [0,0,0,0,0,0|1,0,2]=3 214 B10R1.17 [C-]#[N+]CCc1ccncc1 Amb2235948 [0,0,0,0,0,0|2,0,2]=4 215 B10R1.17 [N-]=[N+]=NCc1cc[n]cc1 Amb19373643 [0,0,0,0,0,0|3,0,1]=4 216 B10R1.17 [N-]=[N+]=NCc1ccccn1 Amb10608487 [0,0,0,0,0,0|3,0,1]=4 217 B10R1.17 [N-]=[N+]=NCc1cccnc1 Amb10608488 [0,0,0,0,0,0|3,0,1]=4 218 B10R1.17 [NH-]\[NH+]=N\Cc1ccccc1 Amb25857928 [0,0,0,0,0,0|2,0,1]=3 219 B10R1.17 [NH3+]CC#Cc1ccccc1 Amb10555899 [0,0,0,0,0,0|2,0,2]=4 220 B10R1.17 [SiH3]CCCc1c[n]ccc1 Amb24085247 [0,0,0,0,0,0|3,0,1]=4 221 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [0,0,0,0,0,0|2,0,1]=3 222 B9R1.8 BOCc1cccc[n]1 Amb24406683 [1,0,0,0,0,0|3,0,0]=4 223 B9R1.8 BrC#Cc1ccccc1 Amb16233213 [1,0,0,0,0,0|1,0,2]=4 224 B9R1.8 BrCCc1c[n]ccc1 Amb19069960 [1,0,0,0,0,0|2,0,1]=4 225 B9R1.8 BrCCc1c[n]ccc1 Amb19372982 [1,0,0,0,0,0|2,0,1]=4 226 B9R1.8 BrCCc1cc[n]cc1 Amb18326675 [1,0,0,0,0,0|2,0,1]=4 227 B9R1.8 BrCCc1ccccn1 Amb1102303 [1,0,0,0,0,0|2,0,1]=4 228 B9R1.8 BrCCc1ccccn1 Amb17935743 [1,0,0,0,0,0|2,0,1]=4 229 B9R1.8 BrCNc1ccccc1 Amb25758335 [1,0,0,0,0,0|2,0,1]=4 230 B9R1.8 Br[Mg]Cc1ccccc1 Amb20240676 [1,0,0,0,0,0|2,0,0]=3 231 B9R1.8 Br[Zn]Cc1ccccc1 Amb22000396 [1,0,0,0,0,0|2,0,0]=3 232 B9R1.8 Br\C=C/c1c[n]ccc1 Amb24085678 [1,0,0,0,0,0|2,0,1]=4 233 B9R1.8 Br\C=C/c1cc[n]cc1 Amb25074029 [1,0,0,0,0,0|2,0,1]=4 234 B9R1.8 Br\C=C/c1cccc[n]1 Amb25200984 [1,0,0,0,0,0|2,0,1]=4 235 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [1,0,0,0,0,0|1,0,1]=3 236 B9R1.8 Br\C=C\c1c[n]ccc1 Amb24085662 [1,0,0,0,0,0|2,0,1]=4 237 B9R1.8 Br\C=C\c1cccc[n]1 Amb24546348 [1,0,0,0,0,0|2,0,1]=4 238 B9R1.8 C#CC[n+]1ccccc1 Amb2227878 [1,0,0,0,0,0|2,0,1]=4 239 B9R1.8 C#CCc1cc[n]cc1 Amb24478677 [1,0,0,0,0,0|2,0,1]=4 240 B9R1.8 C#CCc1cccc[n]1 Amb25759001 [1,0,0,0,0,0|2,0,1]=4 241 B9R1.8 C#CSc1ccccc1 Amb17940373 [1,0,0,0,0,0|2,0,1]=4 242 B9R1.8 C#C[I+]c1ccccc1 Amb19883870 [1,0,0,0,0,0|2,0,1]=4 243 B9R1.8 C=C=Cc1c[n]ccc1 Amb24102495 [1,0,0,0,0,0|3,0,0]=4 244 B9R1.8 C=CC[n+]1ccccc1 Amb10554482 [1,0,0,0,0,0|2,0,0]=3 245 B9R1.8 C=CC[n+]1ccccc1 Amb10573243 [1,0,0,0,0,0|2,0,0]=3 246 B9R1.8 C=CCc1c[n]cc[n]1 Amb24365743 [1,0,0,0,0,0|3,0,0]=4 247 B9R1.8 C=CCc1c[n]ccc1 Amb24477831 [1,0,0,0,0,0|2,0,0]=3 248 B9R1.8 C=CCc1cc[n]c[n]1 Amb24091172 [1,0,0,0,0,0|3,0,0]=4 249 B9R1.8 C=CNc1ccccc1 Amb24476658 [1,0,0,0,0,0|2,0,0]=3 250 B9R1.8 C=COc1c[n]ccc1 Amb24085952 [1,0,0,0,0,0|3,0,0]=4 251 B9R1.8 C=COc1cc[n]cc1 Amb24091446 [1,0,0,0,0,0|3,0,0]=4 252 B9R1.8 C=COc1ccccc1 Amb10564213 [1,0,0,0,0,0|2,0,0]=3 253 B9R1.8 C=CSc1c[n]ccc1 Amb24102618 [1,0,0,0,0,0|3,0,0]=4 254 B9R1.8 C=CSc1cc[n]cc1 Amb24070689 [1,0,0,0,0,0|3,0,0]=4 255 B9R1.8 C=C\C=C\1/C=CC=CN1 Amb24691445 [1,0,0,0,0,0|2,0,1]=4 256 B9R1.8 C=NCc1c[n]ccc1 Amb24062506 [1,0,0,0,0,0|2,0,0]=3 257 B9R1.8 CCC[n+]1ccccc1 Amb24325390 [1,0,0,0,0,0|2,0,1]=4 258 B9R1.8 CCCc1ccccc1 Amb2447143 [1,0,0,0,0,0|1,0,1]=3 259 B9R1.8 CCNc1ccccc1 Amb22731692 [1,0,0,0,0,0|2,0,1]=4 260 B9R1.8 CNCc1ccccn1 Amb10068750 [1,0,0,0,0,0|2,0,1]=4 261 B9R1.8 CNCc1ccccn1 Amb10576408 [1,0,0,0,0,0|2,0,1]=4 262 B9R1.8 CNCc1cccnc1 Amb10066918 [1,0,0,0,0,0|2,0,1]=4 263 B9R1.8 CNCc1cccnc1 Amb10576409 [1,0,0,0,0,0|2,0,1]=4 264 B9R1.8 CNCc1cccnc1 Amb1648828 [1,0,0,0,0,0|2,0,1]=4 265 B9R1.8 CNCc1ccncc1 Amb10068773 [1,0,0,0,0,0|2,0,1]=4 266 B9R1.8 CNCc1ccncc1 Amb10576211 [1,0,0,0,0,0|2,0,1]=4 267 B9R1.8 CNCc1ccncc1 Amb1115812 [1,0,0,0,0,0|2,0,1]=4 268 B9R1.8 CNNc1ccccc1 Amb20242875 [1,0,0,0,0,0|2,0,1]=4 269 B9R1.8 CNSc1ccccc1 Amb25811332 [1,0,0,0,0,0|2,0,1]=4 270 B9R1.8 COC[n+]1ccccc1 Amb25309455 [1,0,0,0,0,0|3,0,0]=4 271 B9R1.8 COCc1c[n]ccc1 Amb24106446 [1,0,0,0,0,0|3,0,0]=4 272 B9R1.8 COCc1cc[n]cc1 Amb24075931 [1,0,0,0,0,0|3,0,0]=4 273 B9R1.8 COPc1ccccc1 Amb22729661 [1,0,0,0,0,0|3,0,0]=4 274 B9R1.8 CSCc1c[n]ccc1 Amb24523080 [1,0,0,0,0,0|3,0,0]=4 275 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [1,0,0,0,0,0|1,0,1]=3 276 B9R1.8 C\C=C/c1c[n]ccc1 Amb25147168 [1,0,0,0,0,0|2,0,1]=4 277 B9R1.8 C\C=C/c1cc[n]cc1 Amb25064785 [1,0,0,0,0,0|2,0,1]=4 278 B9R1.8 C\C=C\[n+]1ccccc1 Amb22485619 [1,0,0,0,0,0|2,0,1]=4 279 B9R1.8 C\C=C\c1c[n]ccc1 Amb25290985 [1,0,0,0,0,0|2,0,1]=4 280 B9R1.8 C\C=N\c1cccc[n]1 Amb24533295 [1,0,0,0,0,0|3,0,0]=4 281 B9R1.8 C\N=C/c1cccc[n]1 Amb25337459 [1,0,0,0,0,0|2,0,0]=3 282 B9R1.8 C\N=C\c1c[n]ccc1 Amb21962079 [1,0,0,0,0,0|2,0,0]=3 283 B9R1.8 C\N=C\c1cc[n]cc1 Amb22330508 [1,0,0,0,0,0|2,0,0]=3 284 B9R1.8 C\N=C\c1cccc[n]1 Amb24553183 [1,0,0,0,0,0|2,0,0]=3 285 B9R1.8 ClC#Cc1ccccc1 Amb17670521 [1,0,0,0,0,0|1,0,2]=4 286 B9R1.8 ClC=Pc1ccccc1 Amb24480023 [1,0,0,0,0,0|2,0,0]=3 287 B9R1.8 ClCCc1c[n]ccc1 Amb20241066 [1,0,0,0,0,0|2,0,1]=4 288 B9R1.8 ClCCc1c[n]ccc1 Amb24061504 [1,0,0,0,0,0|2,0,1]=4 289 B9R1.8 ClCCc1cc[n]cc1 Amb23400891 [1,0,0,0,0,0|2,0,1]=4 290 B9R1.8 ClCCc1cccc[n]1 Amb19892295 [1,0,0,0,0,0|2,0,1]=4 291 B9R1.8 ClCCc1ccccn1 Amb1102254 [1,0,0,0,0,0|2,0,1]=4 292 B9R1.8 ClCNc1ccccc1 Amb25836772 [1,0,0,0,0,0|2,0,1]=4 293 B9R1.8 ClCOc1ccccc1 Amb22059503 [1,0,0,0,0,0|2,0,1]=4 294 B9R1.8 ClCPc1ccccc1 Amb25294535 [1,0,0,0,0,0|2,0,1]=4 295 B9R1.8 ClC[SiH2]c1ccccc1 Amb22230170 [1,0,0,0,0,0|1,1,1]=4 296 B9R1.8 ClSSc1ccccc1 Amb25248198 [1,0,0,0,0,0|3,0,0]=4 297 B9R1.8 Cl[Hg]Cc1ccccc1 Amb22360147 [1,0,0,0,0,0|2,0,0]=3 298 B9R1.8 Cl[Zn]Cc1cccc[n]1 Amb22000362 [1,0,0,0,0,0|3,0,0]=4 299 B9R1.8 Cl\C=C/c1c[n]ccc1 Amb24085684 [1,0,0,0,0,0|2,0,1]=4 300 B9R1.8 Cl\C=C/c1cc[n]cc1 Amb24103276 [1,0,0,0,0,0|2,0,1]=4 301 B9R1.8 Cl\C=C/c1cccc[n]1 Amb24106765 [1,0,0,0,0,0|2,0,1]=4 302 B9R1.8 Cl\C=C\c1cccc[n]1 Amb24106741 [1,0,0,0,0,0|2,0,1]=4 303 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [1,0,0,0,0,0|1,0,1]=3 304 B9R1.8 Cl\C=N\c1ccccc1 Amb24710175 [1,0,0,0,0,0|2,0,0]=3 305 B9R1.8 Cl\N=C\c1c[n]ccc1 Amb24096978 [1,0,0,0,0,0|2,0,0]=3 306 B9R1.8 Cl\N=C\c1cc[n]cc1 Amb24096987 [1,0,0,0,0,0|2,0,0]=3 307 B9R1.8 Cl\N=C\c1cccc[n]1 Amb24096969 [1,0,0,0,0,0|2,0,0]=3 308 B9R1.8 FC#Cc1ccccc1 Amb25080554 [1,0,0,0,0,0|1,0,2]=4 309 B9R1.8 FCCc1c[n]ccc1 Amb24085191 [1,0,0,0,0,0|2,0,1]=4 310 B9R1.8 FCCc1cc[n]cc1 Amb24102730 [1,0,0,0,0,0|2,0,1]=4 311 B9R1.8 FCCc1cccc[n]1 Amb24070130 [1,0,0,0,0,0|2,0,1]=4 312 B9R1.8 FCOc1ccccc1 Amb24099991 [1,0,0,0,0,0|2,0,1]=4 313 B9R1.8 F\C=C/c1cccc[n]1 Amb24106770 [1,0,0,0,0,0|2,0,1]=4 314 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [1,0,0,0,0,0|1,0,1]=3 315 B9R1.8 F\N=N/c1cccc[n]1 Amb24106785 [1,0,0,0,0,0|3,0,0]=4 316 B9R1.8 ICCc1cccc[n]1 Amb24573930 [1,0,0,0,0,0|2,0,1]=4 317 B9R1.8 I[Hg]Cc1ccccc1 Amb22347189 [1,0,0,0,0,0|2,0,0]=3 318 B9R1.8 I\C=C\c1c[n]ccc1 Amb24628558 [1,0,0,0,0,0|2,0,1]=4 319 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [1,0,0,0,0,0|1,0,1]=3 320 B9R1.8 N#CC[n+]1ccccc1 Amb10554489 [1,0,0,0,0,0|1,0,2]=4 321 B9R1.8 N#COc1ccccc1 Amb15692860 [1,0,0,0,0,0|1,0,2]=4 322 B9R1.8 N#C[13CH2]c1ccccc1 Amb22337751 [1,0,0,0,0,0|0,0,2]=3 323 B9R1.8 N#[13C]Cc1ccccc1 Amb22363279 [1,0,0,0,0,0|0,0,2]=3 324 B9R1.8 N#[13C][13CH2]c1ccccc1 Amb22367491 [1,0,0,0,0,0|0,0,2]=3 325 B9R1.8 N=CNc1[n]ccc[n]1 Amb24073528 [1,0,0,0,0,0|3,0,0]=4 326 B9R1.8 N=CNc1cccc[n]1 Amb24073535 [1,0,0,0,0,0|2,0,0]=3 327 B9R1.8 NCCc1c[n]ccc1 Amb20241523 [1,0,0,0,0,0|1,0,2]=4 328 B9R1.8 NCCc1cc[n]cc1 Amb20240779 [1,0,0,0,0,0|1,0,2]=4 329 B9R1.8 NCCc1cccc[n]1 Amb24065228 [1,0,0,0,0,0|1,0,2]=4 330 B9R1.8 NCCc1cccc[n]1 Amb24066975 [1,0,0,0,0,0|1,0,2]=4 331 B9R1.8 NCCc1ccccc1 Amb17772283 [1,0,0,0,0,0|0,0,2]=3 332 B9R1.8 NCCc1ccccc1 Amb17843439 [1,0,0,0,0,0|0,0,2]=3 333 B9R1.8 NCCc1ccccc1 Amb22360716 [1,0,0,0,0,0|0,0,2]=3 334 B9R1.8 NCCc1ccccc1 Amb24325112 [1,0,0,0,0,0|0,0,2]=3 335 B9R1.8 NCCc1ccccc1 Amb24325408 [1,0,0,0,0,0|0,0,2]=3 336 B9R1.8 NCCc1ccccn1 Amb1156071 [1,0,0,0,0,0|1,0,2]=4 337 B9R1.8 NCCc1cccnc1 Amb1134784 [1,0,0,0,0,0|1,0,2]=4 338 B9R1.8 NCCc1cccnc1 Amb16230500 [1,0,0,0,0,0|1,0,2]=4 339 B9R1.8 NCCc1ccncc1 Amb1102164 [1,0,0,0,0,0|1,0,2]=4 340 B9R1.8 NCNc1ccccc1 Amb17117015 [1,0,0,0,0,0|1,0,2]=4 341 B9R1.8 NCOc1ccccc1 Amb25128781 [1,0,0,0,0,0|1,0,2]=4 342 B9R1.8 NCSc1ccccc1 Amb25128061 [1,0,0,0,0,0|1,0,2]=4 343 B9R1.8 NC[13CH2]c1ccccc1 Amb22367506 [1,0,0,0,0,0|0,0,2]=3 344 B9R1.8 NN=Cc1c[n]ccc1 Amb24082007 [1,0,0,0,0,0|2,0,0]=3 345 B9R1.8 NNCc1c[n]ccc1 Amb19893243 [1,0,0,0,0,0|2,0,1]=4 346 B9R1.8 NNCc1c[n]ccc1 Amb22491471 [1,0,0,0,0,0|2,0,1]=4 347 B9R1.8 NNCc1cc[n]cc1 Amb19893255 [1,0,0,0,0,0|2,0,1]=4 348 B9R1.8 NNCc1cccc[n]1 Amb19893254 [1,0,0,0,0,0|2,0,1]=4 349 B9R1.8 NNCc1ccccc1 Amb1105200 [1,0,0,0,0,0|1,0,1]=3 350 B9R1.8 NNCc1ccccc1 Amb16231890 [1,0,0,0,0,0|1,0,1]=3 351 B9R1.8 NNCc1ccccc1 Amb22492438 [1,0,0,0,0,0|1,0,1]=3 352 B9R1.8 NNCc1ccccn1 Amb1117330 [1,0,0,0,0,0|2,0,1]=4 353 B9R1.8 NNCc1cccnc1 Amb1121062 [1,0,0,0,0,0|2,0,1]=4 354 B9R1.8 NNCc1ccncc1 Amb1118337 [1,0,0,0,0,0|2,0,1]=4 355 B9R1.8 NOCc1c[n]ccc1 Amb22059440 [1,0,0,0,0,0|2,0,1]=4 356 B9R1.8 NOCc1c[n]ccc1 Amb24074265 [1,0,0,0,0,0|2,0,1]=4 357 B9R1.8 NOCc1cc[n]cc1 Amb22397036 [1,0,0,0,0,0|2,0,1]=4 358 B9R1.8 NOCc1cccc[n]1 Amb18642195 [1,0,0,0,0,0|2,0,1]=4 359 B9R1.8 NOCc1ccccc1 Amb1154307 [1,0,0,0,0,0|1,0,1]=3 360 B9R1.8 NOCc1ccccc1 Amb16204809 [1,0,0,0,0,0|1,0,1]=3 361 B9R1.8 NOCc1ccccc1 Amb22489499 [1,0,0,0,0,0|1,0,1]=3 362 B9R1.8 N[13CH2][13CH2]c1ccccc1 Amb22367507 [1,0,0,0,0,0|0,0,2]=3 363 B9R1.8 N\C=C/c1cc[n]cc1 Amb24068867 [1,0,0,0,0,0|1,0,2]=4 364 B9R1.8 N\C=C\c1cc[n]cc1 Amb24749618 [1,0,0,0,0,0|1,0,2]=4 365 B9R1.8 N\C=C\c1cccc[n]1 Amb24518526 [1,0,0,0,0,0|1,0,2]=4 366 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [1,0,0,0,0,0|1,0,1]=3 367 B9R1.8 N\N=C/c1cc[n]cc1 Amb25146897 [1,0,0,0,0,0|2,0,0]=3 368 B9R1.8 N\N=C\c1cc[n]c[n]1 Amb24571961 [1,0,0,0,0,0|3,0,0]=4 369 B9R1.8 N\N=C\c1ccccc1 Amb2539422 [1,0,0,0,0,0|1,0,0]=2 370 B9R1.8 O/N=N/c1ccccn1 Amb17940654 [1,0,0,0,0,0|2,0,0]=3 371 B9R1.8 O=C=Cc1cc[n]cc1 Amb24100723 [1,0,0,0,0,0|2,0,1]=4 372 B9R1.8 O=C=Cc1cccc[n]1 Amb24070207 [1,0,0,0,0,0|2,0,1]=4 373 B9R1.8 O=C=Cc1ccccc1 Amb25348365 [1,0,0,0,0,0|1,0,1]=3 374 B9R1.8 O=C=Nc1ccccc1 Amb22336344 [1,0,0,0,0,0|1,0,2]=4 375 B9R1.8 O=CCc1[n]ccc[n]1 Amb24061341 [1,0,0,0,0,0|2,0,1]=4 376 B9R1.8 O=CCc1c[n]c[n]c1 Amb24634482 [1,0,0,0,0,0|2,0,1]=4 377 B9R1.8 O=CCc1c[n]cc[n]1 Amb25124492 [1,0,0,0,0,0|2,0,1]=4 378 B9R1.8 O=CCc1cc[n]c[n]1 Amb24099612 [1,0,0,0,0,0|2,0,1]=4 379 B9R1.8 O=CCc1ccc[n][n]1 Amb24682971 [1,0,0,0,0,0|2,0,1]=4 380 B9R1.8 O=CCc1ccccn1 Amb17089528 [1,0,0,0,0,0|1,0,1]=3 381 B9R1.8 O=CCc1ccncc1 Amb17089529 [1,0,0,0,0,0|1,0,1]=3 382 B9R1.8 O=COc1c[n]ccc1 Amb25299157 [1,0,0,0,0,0|2,0,1]=4 383 B9R1.8 O=COc1ccccc1 Amb22002710 [1,0,0,0,0,0|1,0,1]=3 384 B9R1.8 O=C\C=C/1\C=CC=CN1 Amb24068319 [1,0,0,0,0,0|1,0,2]=4 385 B9R1.8 OCC[n+]1ccccc1 Amb22364462 [1,0,0,0,0,0|1,0,1]=3 386 B9R1.8 OCCc1[n]ccc[n]1 Amb22896758 [1,0,0,0,0,0|2,0,1]=4 387 B9R1.8 OCCc1c[n][n]cc1 Amb23559765 [1,0,0,0,0,0|2,0,1]=4 388 B9R1.8 OCCc1c[n]c[n]c1 Amb20240921 [1,0,0,0,0,0|2,0,1]=4 389 B9R1.8 OCCc1cc[n]cc1 Amb24325389 [1,0,0,0,0,0|1,0,1]=3 390 B9R1.8 OCCc1ccc[n][n]1 Amb25086060 [1,0,0,0,0,0|2,0,1]=4 391 B9R1.8 OCCc1ccncn1 Amb17593271 [1,0,0,0,0,0|2,0,1]=4 392 B9R1.8 OCNc1cccc[n]1 Amb25066721 [1,0,0,0,0,0|2,0,1]=4 393 B9R1.8 OCOc1ccccc1 Amb25847006 [1,0,0,0,0,0|1,0,1]=3 394 B9R1.8 ON=Cc1cc[n]c[n]1 Amb20668794 [1,0,0,0,0,0|2,0,0]=3 395 B9R1.8 ON=Cc1ccccn1 Amb10573542 [1,0,0,0,0,0|1,0,0]=2 396 B9R1.8 ON=Cc1ccncc1 Amb10075320 [1,0,0,0,0,0|1,0,0]=2 397 B9R1.8 ONCc1[n]ccc[n]1 Amb23586395 [1,0,0,0,0,0|2,0,1]=4 398 B9R1.8 ONCc1c[n][n]cc1 Amb23586390 [1,0,0,0,0,0|2,0,1]=4 399 B9R1.8 ONCc1c[n]ccc1 Amb25147084 [1,0,0,0,0,0|1,0,1]=3 400 B9R1.8 ONCc1cc[n]c[n]1 Amb23586394 [1,0,0,0,0,0|2,0,1]=4 401 B9R1.8 ONCc1cc[n]cc1 Amb25851052 [1,0,0,0,0,0|1,0,1]=3 402 B9R1.8 ONCc1ccc[n][n]1 Amb23586391 [1,0,0,0,0,0|2,0,1]=4 403 B9R1.8 ONCc1ccccc1 Amb22001943 [1,0,0,0,0,0|0,0,1]=2 404 B9R1.8 O\N=C/c1c[n]ccc1 Amb24611619 [1,0,0,0,0,0|1,0,0]=2 405 B9R1.8 O\N=C/c1ccccn1 Amb10069892 [1,0,0,0,0,0|1,0,0]=2 406 B9R1.8 O\N=C\C=1CC=CNC1 Amb24668003 [1,0,0,0,0,0|1,0,1]=3 407 B9R1.8 O\N=C\c1c[n][n]cc1 Amb23539003 [1,0,0,0,0,0|2,0,0]=3 408 B9R1.8 O\N=C\c1c[n]c[n]c1 Amb23412257 [1,0,0,0,0,0|2,0,0]=3 409 B9R1.8 O\N=C\c1cc[n]c[n]1 Amb22292199 [1,0,0,0,0,0|2,0,0]=3 410 B9R1.8 O\N=C\c1ccc[n][n]1 Amb23539035 [1,0,0,0,0,0|2,0,0]=3 411 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [1,0,0,0,0,0|0,0,0]=1 412 B9R1.8 O\N=C\c1ccncc1 Amb1793802 [1,0,0,0,0,0|1,0,0]=2 413 B9R1.8 O\N=N\c1c[n]cc[n]1 Amb24744897 [1,0,0,0,0,0|3,0,0]=4 414 B9R1.8 S=C=Cc1ccccc1 Amb24084687 [1,0,0,0,0,0|1,1,0]=3 415 B9R1.8 S=C=Nc1ccccc1 Amb1161696 [1,0,0,0,0,0|1,1,1]=4 416 B9R1.8 S=CNc1cccc[n]1 Amb25785094 [1,0,0,0,0,0|2,1,0]=4 417 B9R1.8 S=CNc1ccccc1 Amb25788857 [1,0,0,0,0,0|1,1,0]=3 418 B9R1.8 SCCc1c[n]ccc1 Amb22008806 [1,0,0,0,0,0|1,1,1]=4 419 B9R1.8 SCCc1ccccn1 Amb17619707 [1,0,0,0,0,0|1,1,1]=4 420 B9R1.8 SCCc1ccncc1 Amb10552830 [1,0,0,0,0,0|1,1,1]=4 421 B9R1.8 [2H]C#Cc1ccccc1 Amb22351662 [1,0,0,0,0,0|1,0,2]=4 422 B9R1.8 [2H]\C=C/c1ccccc1 Amb22338396 [1,0,0,0,0,0|1,0,1]=3 423 B9R1.8 [2H]\C=C\c1ccccc1 Amb22351848 [1,0,0,0,0,0|1,0,1]=3 424 B9R1.8 [C-]#[N+]Cc1ccccc1 Amb2234859 [1,0,0,0,0,0|1,0,1]=3 425 B9R1.8 [C-]#[N+]Cc1ccccn1 Amb1981098 [1,0,0,0,0,0|2,0,1]=4 426 B9R1.8 [C-]#[N+]Cc1cccnc1 Amb1981058 [1,0,0,0,0,0|2,0,1]=4 427 B9R1.8 [C-]#[N+]Cc1ccncc1 Amb1981059 [1,0,0,0,0,0|2,0,1]=4 428 B9R1.8 [CH2-]\C=C\c1ccccc1 Amb22748801 [1,0,0,0,0,0|1,0,1]=3 429 B9R1.8 [Cu]C#Cc1ccccc1 Amb2480676 [1,0,0,0,0,0|1,0,2]=4 430 B9R1.8 [Li]C#Cc1ccccc1 Amb22336681 [1,0,0,0,0,0|1,0,2]=4 431 B9R1.8 [N-]=[N+]=Cc1cc[n]cc1 Amb25320767 [1,0,0,0,0,0|2,0,1]=4 432 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [1,0,0,0,0,0|1,0,1]=3 433 B9R1.8 [NH3+]CCc1cc[nH+]cc1 Amb10553712 [1,0,0,0,0,0|1,0,2]=4 434 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [1,0,0,0,0,0|0,0,2]=3 435 B11R1.1 BrCCCc1ccc(I)cc1 Amb25083701 [0,1,0,0,0,0|2,0,1]=4 436 B11R1.1 BrCCCc1ccc(cc1)Br Amb17104577 [0,1,0,0,0,0|2,0,1]=4 437 B11R1.1 BrCCCc1ccc(cc1)C Amb17104554 [0,1,0,0,0,0|2,0,1]=4 438 B11R1.1 BrCCCc1ccc(cc1)Cl Amb17104562 [0,1,0,0,0,0|2,0,1]=4 439 B11R1.1 BrCCCc1ccc(cc1)F Amb17104556 [0,1,0,0,0,0|2,0,1]=4 440 B11R1.1 Br[Zn]CCc1ccc(cc1)Br Amb13890855 [0,1,0,0,0,0|2,0,1]=4 441 B11R1.1 Brc1ccc(C[Se]C#N)cc1 Amb17779550 [0,1,0,0,0,0|3,0,0]=4 442 B11R1.1 C#CCCc1ccc(Br)cc1 Amb18116967 [0,1,0,0,0,0|2,0,1]=4 443 B11R1.1 C#CCCc1ccc(Cl)cc1 Amb18116815 [0,1,0,0,0,0|2,0,1]=4 444 B11R1.1 C#CCCc1ccc(F)cc1 Amb18116891 [0,1,0,0,0,0|2,0,1]=4 445 B11R1.1 C=CCCc1ccc(I)cc1 Amb25349986 [0,1,0,0,0,0|2,0,1]=4 446 B11R1.1 C=CCCc1ccc(N)cc1 Amb18124837 [0,1,0,0,0,0|2,0,1]=4 447 B11R1.1 C=CCCc1ccc(O)cc1 Amb25249578 [0,1,0,0,0,0|2,0,1]=4 448 B11R1.1 C=C\C=C/c1ccc(O)cc1 Amb24103177 [0,1,0,0,0,0|2,0,1]=4 449 B11R1.1 C=C\C=C\c1ccc(Cl)cc1 Amb25260911 [0,1,0,0,0,0|2,0,1]=4 450 B11R1.1 C=C\C=C\c1ccc(N)cc1 Amb24673532 [0,1,0,0,0,0|2,0,1]=4 451 B11R1.1 C=C\C=C\c1ccc(O)cc1 Amb25227603 [0,1,0,0,0,0|2,0,1]=4 452 B11R1.1 C=NCCc1ccc(O)cc1 Amb25327788 [0,1,0,0,0,0|1,0,1]=3 453 B11R1.1 C=N\N=C\c1ccc(F)cc1 Amb25260127 [0,1,0,0,0,0|2,0,1]=4 454 B11R1.1 CC=CCc1ccc(O)cc1 Amb24094301 [0,1,0,0,0,0|2,0,0]=3 455 B11R1.1 CCCCc1ccc(F)cc1 Amb22730516 [0,1,0,0,0,0|2,0,1]=4 456 B11R1.1 CCNCc1ccc(I)cc1 Amb25050868 [0,1,0,0,0,0|3,0,0]=4 457 B11R1.1 CCNCc1ccc(cc1)O Amb13952053 [0,1,0,0,0,0|3,0,0]=4 458 B11R1.1 CCOCc1ccc(Br)cc1 Amb19415022 [0,1,0,0,0,0|3,0,0]=4 459 B11R1.1 CCOCc1ccc(O)cc1 Amb18125402 [0,1,0,0,0,0|3,0,0]=4 460 B11R1.1 CCOCc1ccc(cc1)N Amb1125782 [0,1,0,0,0,0|3,0,0]=4 461 B11R1.1 CCSCc1ccc(Br)cc1 Amb25684606 [0,1,0,0,0,0|3,0,0]=4 462 B11R1.1 CCSCc1ccc(Cl)cc1 Amb24402210 [0,1,0,0,0,0|3,0,0]=4 463 B11R1.1 CCSCc1ccc(F)cc1 Amb24486978 [0,1,0,0,0,0|3,0,0]=4 464 B11R1.1 CCSCc1ccc(O)cc1 Amb18126551 [0,1,0,0,0,0|3,0,0]=4 465 B11R1.1 CC\C=C/c1ccc(F)cc1 Amb24725207 [0,1,0,0,0,0|2,0,1]=4 466 B11R1.1 CC\C=C\c1ccc(O)cc1 Amb24655008 [0,1,0,0,0,0|2,0,1]=4 467 B11R1.1 CNCCc1ccc(N)cc1 Amb18290354 [0,1,0,0,0,0|1,0,2]=4 468 B11R1.1 CNCCc1ccc(cc1)O Amb15690577 [0,1,0,0,0,0|1,0,2]=4 469 B11R1.1 COCCc1ccc(Cl)cc1 Amb24118075 [0,1,0,0,0,0|2,0,1]=4 470 B11R1.1 COCCc1ccc(I)cc1 Amb25360538 [0,1,0,0,0,0|2,0,1]=4 471 B11R1.1 COCCc1ccc(cc1)N Amb1139224 [0,1,0,0,0,0|2,0,1]=4 472 B11R1.1 CONCc1ccc(Br)cc1 Amb25151171 [0,1,0,0,0,0|3,0,0]=4 473 B11R1.1 CONCc1ccc(O)cc1 Amb24383951 [0,1,0,0,0,0|3,0,0]=4 474 B11R1.1 CO\C=C\c1ccc(Br)cc1 Amb21962688 [0,1,0,0,0,0|2,0,1]=4 475 B11R1.1 CO\C=C\c1ccc(O)cc1 Amb25231662 [0,1,0,0,0,0|2,0,1]=4 476 B11R1.1 CO\C=N\c1ccc(Cl)cc1 Amb21936899 [0,1,0,0,0,0|3,0,0]=4 477 B11R1.1 CO\C=N\c1ccc(F)cc1 Amb21936897 [0,1,0,0,0,0|3,0,0]=4 478 B11R1.1 CSCCc1ccc(N)cc1 Amb18971649 [0,1,0,0,0,0|2,0,1]=4 479 B11R1.1 C\C=C/Oc1ccc(N)cc1 Amb24103180 [0,1,0,0,0,0|3,0,0]=4 480 B11R1.1 C\C=C\C[n+]1ccc(C)cc1 Amb25381025 [0,1,0,0,0,0|3,0,0]=4 481 B11R1.1 C\C=C\Cc1ccc(N)cc1 Amb22751067 [0,1,0,0,0,0|2,0,0]=3 482 B11R1.1 C\C=C\Cc1ccc(O)cc1 Amb18124917 [0,1,0,0,0,0|2,0,0]=3 483 B11R1.1 C\C=C\Nc1ccc(F)cc1 Amb24070275 [0,1,0,0,0,0|3,0,0]=4 484 B11R1.1 C\N=C\Nc1ccc(Cl)c[n]1 Amb24665989 [0,1,0,0,0,0|3,0,0]=4 485 B11R1.1 C\N=C\Nc1ccc(Cl)cc1 Amb25294306 [0,1,0,0,0,0|2,0,0]=3 486 B11R1.1 C\N=N\Nc1ccc(Br)cc1 Amb25312604 [0,1,0,0,0,0|3,0,0]=4 487 B11R1.1 Cc1cc[n+](CCCO)cc1 Amb24466262 [0,1,0,0,0,0|2,0,1]=4 488 B11R1.1 Cc1cc[n+](C\C=C\Cl)cc1 Amb24343685 [0,1,0,0,0,0|3,0,0]=4 489 B11R1.1 Cc1ccc(C=CCO)cc1 Amb22345885 [0,1,0,0,0,0|1,0,1]=3 490 B11R1.1 Cc1ccc(CCC#C)cc1 Amb18634818 [0,1,0,0,0,0|2,0,1]=4 491 B11R1.1 Cc1ccc(CCCC)cc1 Amb22002059 [0,1,0,0,0,0|2,0,1]=4 492 B11R1.1 Cc1ccc(CCCO)[n]c1 Amb25073187 [0,1,0,0,0,0|2,0,1]=4 493 B11R1.1 Cc1ccc(CCCO)c[n]1 Amb24533220 [0,1,0,0,0,0|2,0,1]=4 494 B11R1.1 Cc1ccc(CSC#N)cc1 Amb19944266 [0,1,0,0,0,0|3,0,0]=4 495 B11R1.1 Cc1ccc(CSCC)cc1 Amb24536616 [0,1,0,0,0,0|3,0,0]=4 496 B11R1.1 Cc1ccc(CSCCl)cc1 Amb25108662 [0,1,0,0,0,0|3,0,0]=4 497 B11R1.1 Cc1ccc(C[Se]C#N)cc1 Amb17779544 [0,1,0,0,0,0|3,0,0]=4 498 B11R1.1 Cc1ccc(C\C=C\Br)cc1 Amb25720563 [0,1,0,0,0,0|2,0,0]=3 499 B11R1.1 Cc1ccc(\C=C\CBr)cc1 Amb24575176 [0,1,0,0,0,0|2,0,1]=4 500 B11R1.1 Cc1ccc(\C=C\CN)cc1 Amb18563249 [0,1,0,0,0,0|2,0,1]=4 501 B11R1.1 Cc1ccc(\C=C\CO)c[n]1 Amb25790076 [0,1,0,0,0,0|2,0,1]=4 502 B11R1.1 Cc1ccc(\C=C\CO)cc1 Amb23442829 [0,1,0,0,0,0|1,0,1]=3 503 B11R1.1 Cc1ccc(\C=C\NO)cc1 Amb24621859 [0,1,0,0,0,0|0,0,2]=3 504 B11R1.1 Cc1ccc(cc1)NN=NC Amb22227984 [0,1,0,0,0,0|3,0,0]=4 505 B11R1.1 Cc1ccc(cc1)S\C=C\Cl Amb24603050 [0,1,0,0,0,0|3,0,0]=4 506 B11R1.1 Cc1ccc(cc1)\N=C\C=O Amb24484947 [0,1,0,0,0,0|2,0,1]=4 507 B11R1.1 Cc1ccc(cc1)\N=C\CCl Amb25791668 [0,1,0,0,0,0|3,0,0]=4 508 B11R1.1 Cc1ccc(cc1)\N=C\CO Amb24430956 [0,1,0,0,0,0|2,0,0]=3 509 B11R1.1 Cc1ccc(cc1)\N=C\OC Amb21936895 [0,1,0,0,0,0|3,0,0]=4 510 B11R1.1 ClCCCc1ccc(cc1)Br Amb17104549 [0,1,0,0,0,0|2,0,1]=4 511 B11R1.1 ClCCCc1ccc(cc1)C Amb17104527 [0,1,0,0,0,0|2,0,1]=4 512 B11R1.1 ClCCCc1ccc(cc1)F Amb17104529 [0,1,0,0,0,0|2,0,1]=4 513 B11R1.1 ClCCCc1ccc(cc1)N Amb17477708 [0,1,0,0,0,0|2,0,1]=4 514 B11R1.1 ClCCCc1ccc(cc1)O Amb17477722 [0,1,0,0,0,0|2,0,1]=4 515 B11R1.1 ClCOCc1ccc(Br)cc1 Amb24376347 [0,1,0,0,0,0|3,0,0]=4 516 B11R1.1 ClC\C=C\c1ccc(Br)cc1 Amb21926649 [0,1,0,0,0,0|2,0,1]=4 517 B11R1.1 ClC\C=C\c1ccc(I)cc1 Amb24614945 [0,1,0,0,0,0|2,0,1]=4 518 B11R1.1 Clc1ccc(CC[Mg]Cl)cc1 Amb22897275 [0,1,0,0,0,0|2,0,1]=4 519 B11R1.1 Clc1ccc(CC[Zn]Br)cc1 Amb22000488 [0,1,0,0,0,0|2,0,1]=4 520 B11R1.1 Clc1ccc(CC[Zn]Cl)cc1 Amb22897728 [0,1,0,0,0,0|2,0,1]=4 521 B11R1.1 Clc1ccc(CSCCl)cc1 Amb25704966 [0,1,0,0,0,0|3,0,0]=4 522 B11R1.1 Clc1ccc(\C=C\CBr)cc1 Amb22007806 [0,1,0,0,0,0|2,0,1]=4 523 B11R1.1 Clc1ccc(\C=C\CCl)cc1 Amb25185292 [0,1,0,0,0,0|2,0,1]=4 524 B11R1.1 Clc1ccc(cc1)O\C=C/Cl Amb24533093 [0,1,0,0,0,0|3,0,0]=4 525 B11R1.1 FCSCc1ccc(Cl)cc1 Amb24437363 [0,1,0,0,0,0|3,0,0]=4 526 B11R1.1 Fc1ccc(CC[Zn]Br)cc1 Amb22000495 [0,1,0,0,0,0|2,0,1]=4 527 B11R1.1 Fc1ccc(CNC=S)cc1 Amb25241123 [0,1,0,0,0,0|2,1,0]=4 528 B11R1.1 Fc1ccc(C[Se]C#N)cc1 Amb17779547 [0,1,0,0,0,0|3,0,0]=4 529 B11R1.1 Fc1ccc(\C=C\CCl)cc1 Amb25074621 [0,1,0,0,0,0|2,0,1]=4 530 B11R1.1 N#CCCc1ccc(I)cc1 Amb25785381 [0,1,0,0,0,0|2,0,1]=4 531 B11R1.1 N#CCCc1ccc(cc1)C Amb17204297 [0,1,0,0,0,0|2,0,1]=4 532 B11R1.1 N#CCCc1ccc(cc1)F Amb17204299 [0,1,0,0,0,0|2,0,1]=4 533 B11R1.1 N#CNCc1ccc(Br)cc1 Amb25761722 [0,1,0,0,0,0|3,0,0]=4 534 B11R1.1 N#CNCc1ccc(O)cc1 Amb25683003 [0,1,0,0,0,0|3,0,0]=4 535 B11R1.1 N#CNCc1ccc(cc1)C Amb16186976 [0,1,0,0,0,0|3,0,0]=4 536 B11R1.1 N#CNCc1ccc(cc1)Cl Amb16186974 [0,1,0,0,0,0|3,0,0]=4 537 B11R1.1 N#CNCc1ccc(cc1)F Amb16186972 [0,1,0,0,0,0|3,0,0]=4 538 B11R1.1 N#CSCc1ccc(Br)cc1 Amb21959352 [0,1,0,0,0,0|3,0,0]=4 539 B11R1.1 N#CSCc1ccc(Cl)cc1 Amb19889458 [0,1,0,0,0,0|3,0,0]=4 540 B11R1.1 N#CSCc1ccc(cc1)F Amb10789219 [0,1,0,0,0,0|3,0,0]=4 541 B11R1.1 N#C\C=C\c1ccc(O)cc1 Amb24477470 [0,1,0,0,0,0|2,0,1]=4 542 B11R1.1 N#C\C=C\c1ccc(cc1)C Amb17231964 [0,1,0,0,0,0|2,0,1]=4 543 B11R1.1 N#C\C=C\c1ccc(cc1)Cl Amb1158219 [0,1,0,0,0,0|2,0,1]=4 544 B11R1.1 N=C=COc1ccc(F)cc1 Amb24100657 [0,1,0,0,0,0|3,0,0]=4 545 B11R1.1 NCCCc1ccc(I)cc1 Amb25172834 [0,1,0,0,0,0|2,0,1]=4 546 B11R1.1 NCCCc1ccc(S)cc1 Amb25228495 [0,1,0,0,0,0|2,0,1]=4 547 B11R1.1 NCCCc1ccc(cc1)Cl Amb1092541 [0,1,0,0,0,0|2,0,1]=4 548 B11R1.1 NCCCc1ccc(cc1)Cl Amb13952055 [0,1,0,0,0,0|2,0,1]=4 549 B11R1.1 NCCCc1ccc(cc1)N Amb17477693 [0,1,0,0,0,0|2,0,1]=4 550 B11R1.1 NCCCc1ccc(cc1)O Amb10066893 [0,1,0,0,0,0|2,0,1]=4 551 B11R1.1 NCCCc1ccc(cc1)O Amb17598403 [0,1,0,0,0,0|2,0,1]=4 552 B11R1.1 NC\C=C/c1ccc(cc1)C Amb10560257 [0,1,0,0,0,0|2,0,1]=4 553 B11R1.1 NC\C=C\c1ccc(Br)cc1 Amb18066634 [0,1,0,0,0,0|2,0,1]=4 554 B11R1.1 NC\C=C\c1ccc(Cl)cc1 Amb18563824 [0,1,0,0,0,0|2,0,1]=4 555 B11R1.1 NC\C=C\c1ccc(F)cc1 Amb18065348 [0,1,0,0,0,0|2,0,1]=4 556 B11R1.1 NC\C=C\c1ccc(O)cc1 Amb18124993 [0,1,0,0,0,0|2,0,1]=4 557 B11R1.1 NOCCc1ccc(F)cc1 Amb22896631 [0,1,0,0,0,0|2,0,1]=4 558 B11R1.1 NOCCc1ccc(O)cc1 Amb25053130 [0,1,0,0,0,0|2,0,1]=4 559 B11R1.1 Nc1ccc(CCCBr)cc1 Amb22229466 [0,1,0,0,0,0|2,0,1]=4 560 B11R1.1 Nc1ccc(CCCF)cc1 Amb25697152 [0,1,0,0,0,0|2,0,1]=4 561 B11R1.1 Nc1ccc(CCCO)cc1 Amb21964655 [0,1,0,0,0,0|1,0,1]=3 562 B11R1.1 Nc1ccc(CNC=O)cc1 Amb24072314 [0,1,0,0,0,0|2,0,1]=4 563 B11R1.1 Nc1ccc(COCF)cc1 Amb25764872 [0,1,0,0,0,0|3,0,0]=4 564 B11R1.1 Nc1ccc(\C=C\CN)cc1 Amb24527675 [0,1,0,0,0,0|2,0,1]=4 565 B11R1.1 Nc1ccc(cc1)C#CCO Amb22228978 [0,1,0,0,0,0|1,0,2]=4 566 B11R1.1 O=C=NCc1ccc(cc1)O Amb17090278 [0,1,0,0,0,0|2,0,1]=4 567 B11R1.1 O=CC=Cc1ccc(cc1)Br Amb17609956 [0,1,0,0,0,0|1,0,2]=4 568 B11R1.1 O=CCCc1ccc(cc1)Br Amb10602155 [0,1,0,0,0,0|1,0,2]=4 569 B11R1.1 O=CCCc1ccc(cc1)F Amb10602156 [0,1,0,0,0,0|1,0,2]=4 570 B11R1.1 O=CCCc1ccc(cc1)O Amb17081693 [0,1,0,0,0,0|1,0,2]=4 571 B11R1.1 O=CNCc1ccc(Cl)cc1 Amb24486673 [0,1,0,0,0,0|2,0,1]=4 572 B11R1.1 O=CNCc1ccc(cc1)C Amb1916037 [0,1,0,0,0,0|2,0,1]=4 573 B11R1.1 O=C\C=C/c1ccc(Cl)cc1 Amb24484764 [0,1,0,0,0,0|1,0,2]=4 574 B11R1.1 O=C\C=C\c1ccc(I)cc1 Amb24523100 [0,1,0,0,0,0|1,0,2]=4 575 B11R1.1 O=C\C=C\c1ccc(cc1)Br Amb1787168 [0,1,0,0,0,0|1,0,2]=4 576 B11R1.1 O=C\C=C\c1ccc(cc1)C Amb17232009 [0,1,0,0,0,0|1,0,2]=4 577 B11R1.1 OCCCN1C=CC(=O)C=C1 Amb18041267 [0,1,0,0,0,0|2,0,1]=4 578 B11R1.1 OCCCc1ccc(Br)[n]c1 Amb21963678 [0,1,0,0,0,0|2,0,1]=4 579 B11R1.1 OCCCc1ccc(Br)c[n]1 Amb25309177 [0,1,0,0,0,0|2,0,1]=4 580 B11R1.1 OCCCc1ccc(Cl)[n]c1 Amb21963672 [0,1,0,0,0,0|2,0,1]=4 581 B11R1.1 OCCCc1ccc(F)[n]c1 Amb24085299 [0,1,0,0,0,0|2,0,1]=4 582 B11R1.1 OCCCc1ccc(I)cc1 Amb24406298 [0,1,0,0,0,0|1,0,1]=3 583 B11R1.1 OCCCc1ccc(cc1)Br Amb13883587 [0,1,0,0,0,0|1,0,1]=3 584 B11R1.1 OCCCc1ccc(cc1)F Amb17089497 [0,1,0,0,0,0|1,0,1]=3 585 B11R1.1 OCCCc1ccc(cc1)N Amb17477700 [0,1,0,0,0,0|1,0,1]=3 586 B11R1.1 OCCOc1ccc(S)cc1 Amb24100726 [0,1,0,0,0,0|2,0,1]=4 587 B11R1.1 OCCOc1ccc(cc1)C Amb2209347 [0,1,0,0,0,0|2,0,1]=4 588 B11R1.1 OCCOc1ccc(cc1)Cl Amb2209356 [0,1,0,0,0,0|2,0,1]=4 589 B11R1.1 OCCOc1ccc(cc1)N Amb15740917 [0,1,0,0,0,0|2,0,1]=4 590 B11R1.1 OCCSc1ccc(cc1)O Amb10575943 [0,1,0,0,0,0|2,0,1]=4 591 B11R1.1 OC\C=C\c1ccc(Cl)cc1 Amb21964138 [0,1,0,0,0,0|1,0,1]=3 592 B11R1.1 OC\C=C\c1ccc(F)cc1 Amb23442931 [0,1,0,0,0,0|1,0,1]=3 593 B11R1.1 OC\C=C\c1ccc(I)cc1 Amb24418980 [0,1,0,0,0,0|1,0,1]=3 594 B11R1.1 OC\C=C\c1ccc(cc1)O Amb2445151 [0,1,0,0,0,0|1,0,1]=3 595 B11R1.1 OC\N=C\c1ccc(Cl)cc1 Amb24466242 [0,1,0,0,0,0|2,0,1]=4 596 B11R1.1 ON=CNc1c[n]c(Cl)c[n]1 Amb24375681 [0,1,0,0,0,0|3,0,0]=4 597 B11R1.1 O\N=C\Nc1ccc(Br)c[n]1 Amb24741753 [0,1,0,0,0,0|2,0,0]=3 598 B11R1.1 O\N=C\Nc1ccc(Cl)c[n]1 Amb25217795 [0,1,0,0,0,0|2,0,0]=3 599 B11R1.1 Oc1ccc(CCCBr)cc1 Amb25703932 [0,1,0,0,0,0|2,0,1]=4 600 B11R1.1 Oc1ccc(CNC=O)cc1 Amb25172814 [0,1,0,0,0,0|2,0,1]=4 601 B11R1.1 Oc1ccc(C\C=C\Cl)cc1 Amb25724911 [0,1,0,0,0,0|2,0,0]=3 602 B11R1.1 Oc1ccc(C\C=N\O)cc1 Amb25705671 [0,1,0,0,0,0|0,0,0]=1 603 B11R1.1 Oc1ccc(\C=C/CO)cc1 Amb25720012 [0,1,0,0,0,0|1,0,1]=3 604 B11R1.1 Oc1ccc(\C=C\CCl)cc1 Amb24598884 [0,1,0,0,0,0|2,0,1]=4 605 B11R1.1 S=C=NCc1ccc(I)cc1 Amb24504908 [0,1,0,0,0,0|2,1,0]=4 606 B11R1.1 S=C=NCc1ccc(cc1)Cl Amb2092731 [0,1,0,0,0,0|2,1,0]=4 607 B11R1.1 S=C=NCc1ccc(cc1)O Amb17615159 [0,1,0,0,0,0|2,1,0]=4 608 B11R1.1 SCCCc1ccc(cc1)Br Amb17407562 [0,1,0,0,0,0|1,1,1]=4 609 B11R1.1 SCCCc1ccc(cc1)C Amb17400220 [0,1,0,0,0,0|1,1,1]=4 610 B11R1.1 SCCCc1ccc(cc1)Cl Amb17401097 [0,1,0,0,0,0|1,1,1]=4 611 B11R1.1 SCCCc1ccc(cc1)F Amb17400333 [0,1,0,0,0,0|1,1,1]=4 612 B11R1.1 [C-]#[N+]CCc1ccc(O)cc1 Amb25730088 [0,1,0,0,0,0|1,0,2]=4 613 B11R1.1 [N-]=[N+]=NCc1ccc(I)cc1 Amb22059741 [0,1,0,0,0,0|2,0,1]=4 614 B11R1.16 BrCCC(Br)c1ccccc1 Amb23456167 [0,1,0,0,0,0|2,0,1]=4 615 B11R1.16 C#CCC(Cl)c1ccccc1 Amb25264417 [0,1,0,0,0,0|2,0,1]=4 616 B11R1.16 C#CCC(N)c1ccccc1 Amb18959773 [0,1,0,0,0,0|2,0,1]=4 617 B11R1.16 C#CC[C@@H](N)c1ccccc1 Amb24181858 [0,1,0,0,0,0|2,0,1]=4 618 B11R1.16 C#CC[C@H](N)c1ccccc1 Amb25169470 [0,1,0,0,0,0|2,0,1]=4 619 B11R1.16 C=C=CC(=O)c1ccccc1 Amb25053112 [0,1,0,0,0,0|2,0,1]=4 620 B11R1.16 C=C=CC(O)c1ccccc1 Amb25198813 [0,1,0,0,0,0|2,0,0]=3 621 B11R1.16 C=C=C[C@@H](O)c1ccccc1 Amb25045780 [0,1,0,0,0,0|2,0,0]=3 622 B11R1.16 C=C=C[C@H](O)c1c[n]ccc1 Amb25152161 [0,1,0,0,0,0|3,0,0]=4 623 B11R1.16 C=CCC(Br)c1ccccc1 Amb24668989 [0,1,0,0,0,0|2,0,1]=4 624 B11R1.16 C=CCC(N)c1ccccc1 Amb22831520 [0,1,0,0,0,0|2,0,1]=4 625 B11R1.16 C=CCC(O)c1ccccc1 Amb22228007 [0,1,0,0,0,0|2,0,1]=4 626 B11R1.16 C=CCC(c1ccccc1)N Amb17226687 [0,1,0,0,0,0|2,0,1]=4 627 B11R1.16 C=CCC(c1ccccc1)O Amb2389146 [0,1,0,0,0,0|2,0,1]=4 628 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22829899 [0,1,0,0,0,0|2,0,1]=4 629 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22831832 [0,1,0,0,0,0|2,0,1]=4 630 B11R1.16 C=CC[C@@H](O)c1ccccc1 Amb24726216 [0,1,0,0,0,0|2,0,1]=4 631 B11R1.16 CC#CC(N)c1ccccc1 Amb25113894 [0,1,0,0,0,0|2,0,1]=4 632 B11R1.16 CC#CC(O)c1ccccc1 Amb25148346 [0,1,0,0,0,0|2,0,1]=4 633 B11R1.16 CC#C[C@@H](O)c1ccccc1 Amb25188578 [0,1,0,0,0,0|2,0,1]=4 634 B11R1.16 CC(=CCC)c1ccccc1 Amb22228912 [0,1,0,0,0,0|2,0,1]=4 635 B11R1.16 CC(CC#C)c1ccccc1 Amb18117214 [0,1,0,0,0,0|2,0,1]=4 636 B11R1.16 CC(CC=C)c1ccccc1 Amb25829403 [0,1,0,0,0,0|2,0,1]=4 637 B11R1.16 CC(CCN)c1ccccc1 Amb17991256 [0,1,0,0,0,0|2,0,1]=4 638 B11R1.16 CC(CCO)c1c[n]ccc1 Amb25808756 [0,1,0,0,0,0|2,0,1]=4 639 B11R1.16 CC(CNN)c1ccccc1 Amb18791463 [0,1,0,0,0,0|1,0,2]=4 640 B11R1.16 CC(C[Zn]Br)c1ccccc1 Amb22897843 [0,1,0,0,0,0|2,0,1]=4 641 B11R1.16 CC(N=[N+]=[N-])c1ccccc1 Amb18632995 [0,1,0,0,0,0|2,0,1]=4 642 B11R1.16 CC(NC=S)c1ccccc1 Amb25191191 [0,1,0,0,0,0|2,1,0]=4 643 B11R1.16 CC(NN=O)c1ccccc1 Amb24392128 [0,1,0,0,0,0|1,0,1]=3 644 B11R1.16 CC(OC=C)c1ccccc1 Amb22522122 [0,1,0,0,0,0|3,0,0]=4 645 B11R1.16 CC(OC=O)c1ccccc1 Amb22735162 [0,1,0,0,0,0|2,0,1]=4 646 B11R1.16 CC(OCO)c1ccccc1 Amb24613529 [0,1,0,0,0,0|2,0,0]=3 647 B11R1.16 CC(SCCl)c1ccccc1 Amb24487902 [0,1,0,0,0,0|3,0,0]=4 648 B11R1.16 CC(\C=C\Cl)c1ccccc1 Amb24710339 [0,1,0,0,0,0|2,0,0]=3 649 B11R1.16 CC(\C=N\N)c1ccccc1 Amb24412748 [0,1,0,0,0,0|1,0,0]=2 650 B11R1.16 CC(c1ccccc1)CC#N Amb17593643 [0,1,0,0,0,0|2,0,1]=4 651 B11R1.16 CC(c1ccccc1)N=C=O Amb2092860 [0,1,0,0,0,0|2,0,1]=4 652 B11R1.16 CC=CC(O)c1ccccc1 Amb22228005 [0,1,0,0,0,0|2,0,0]=3 653 B11R1.16 CCCC(c1ccccc1)[NH3+] Amb10560246 [0,1,0,0,0,0|2,0,1]=4 654 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb22388605 [0,1,0,0,0,0|2,0,1]=4 655 B11R1.16 CCC[C@@H](O)c1ccccc1 Amb22338826 [0,1,0,0,0,0|2,0,1]=4 656 B11R1.16 CCC[C@H](N)c1ccccc1 Amb20241164 [0,1,0,0,0,0|2,0,1]=4 657 B11R1.16 CCC[C@H](N)c1ccccc1 Amb23385315 [0,1,0,0,0,0|2,0,1]=4 658 B11R1.16 CCC[C@H](O)c1ccccc1 Amb22338698 [0,1,0,0,0,0|2,0,1]=4 659 B11R1.16 CCC[C@H](c1ccccc1)N Amb16233791 [0,1,0,0,0,0|2,0,1]=4 660 B11R1.16 CCNC(c1ccccc1)C Amb1771733 [0,1,0,0,0,0|3,0,0]=4 661 B11R1.16 CCN[C@H](C)c1ccccc1 Amb24363134 [0,1,0,0,0,0|3,0,0]=4 662 B11R1.16 CCOC(C)c1ccccc1 Amb17940188 [0,1,0,0,0,0|3,0,0]=4 663 B11R1.16 CCOC(Cl)c1ccccc1 Amb24419639 [0,1,0,0,0,0|3,0,0]=4 664 B11R1.16 CCSC(Cl)c1ccccc1 Amb25109977 [0,1,0,0,0,0|3,0,0]=4 665 B11R1.16 CNCC(Br)c1ccccc1 Amb25224394 [0,1,0,0,0,0|1,0,2]=4 666 B11R1.16 CNCC(F)c1ccccc1 Amb24710254 [0,1,0,0,0,0|1,0,2]=4 667 B11R1.16 CNCC(N)c1ccccc1 Amb18290185 [0,1,0,0,0,0|1,0,2]=4 668 B11R1.16 CNCC(S)c1ccccc1 Amb25685409 [0,1,0,0,0,0|1,0,2]=4 669 B11R1.16 CNCC(c1ccccc1)C Amb17619365 [0,1,0,0,0,0|1,0,2]=4 670 B11R1.16 CNCC(c1ccccc1)N Amb13883001 [0,1,0,0,0,0|1,0,2]=4 671 B11R1.16 CNC[C@@H](N)c1ccccc1 Amb24487965 [0,1,0,0,0,0|1,0,2]=4 672 B11R1.16 CNC[C@H](C)c1ccccc1 Amb24399611 [0,1,0,0,0,0|1,0,2]=4 673 B11R1.16 CNC[C@H](N)c1ccccc1 Amb25040662 [0,1,0,0,0,0|1,0,2]=4 674 B11R1.16 CNC[C@H](O)c1ccccc1 Amb25674653 [0,1,0,0,0,0|1,0,2]=4 675 B11R1.16 CNNC(Br)c1ccccc1 Amb24643804 [0,1,0,0,0,0|2,0,1]=4 676 B11R1.16 COCC(C)c1ccccc1 Amb24079980 [0,1,0,0,0,0|2,0,1]=4 677 B11R1.16 COCC(Cl)c1ccccc1 Amb24509304 [0,1,0,0,0,0|2,0,1]=4 678 B11R1.16 COCC(O)c1ccccc1 Amb18791504 [0,1,0,0,0,0|2,0,1]=4 679 B11R1.16 COCC(S)c1ccccc1 Amb25698414 [0,1,0,0,0,0|2,0,1]=4 680 B11R1.16 COCC(c1ccccc1)N Amb1134749 [0,1,0,0,0,0|2,0,1]=4 681 B11R1.16 COCC(c1ccccc1)N Amb13952604 [0,1,0,0,0,0|2,0,1]=4 682 B11R1.16 COC[C@@H](O)c1ccccc1 Amb22746575 [0,1,0,0,0,0|2,0,1]=4 683 B11R1.16 COC[C@H](N)c1ccccc1 Amb22737495 [0,1,0,0,0,0|2,0,1]=4 684 B11R1.16 COC[C@H](c1ccccc1)N Amb17061641 [0,1,0,0,0,0|2,0,1]=4 685 B11R1.16 CONC(C)c1ccccc1 Amb22896960 [0,1,0,0,0,0|3,0,0]=4 686 B11R1.16 CSCC(C)c1ccccc1 Amb25143821 [0,1,0,0,0,0|2,0,1]=4 687 B11R1.16 CSCC(N)c1ccccc1 Amb18300065 [0,1,0,0,0,0|2,0,1]=4 688 B11R1.16 CSCC(O)c1ccccc1 Amb18793198 [0,1,0,0,0,0|2,0,1]=4 689 B11R1.16 CSC[C@@H](N)c1ccccc1 Amb25368447 [0,1,0,0,0,0|2,0,1]=4 690 B11R1.16 C[C@@H](CCBr)c1ccccc1 Amb24395063 [0,1,0,0,0,0|2,0,1]=4 691 B11R1.16 C[C@@H](N=[N+]=[N-])c1ccccc1 Amb24671324 [0,1,0,0,0,0|2,0,1]=4 692 B11R1.16 C[C@H](CC=O)c1ccccc1 Amb25843699 [0,1,0,0,0,0|1,0,2]=4 693 B11R1.16 C[C@H](CCBr)c1ccccc1 Amb25690423 [0,1,0,0,0,0|2,0,1]=4 694 B11R1.16 C[C@H](CCO)c1ccccc1 Amb24371178 [0,1,0,0,0,0|1,0,1]=3 695 B11R1.16 C[C@H](NC=O)c1ccccc1 Amb24696096 [0,1,0,0,0,0|2,0,1]=4 696 B11R1.16 C\C(=C/CC)\c1ccccc1 Amb25151168 [0,1,0,0,0,0|2,0,1]=4 697 B11R1.16 C\C(=C/CN)\c1ccccc1 Amb23555622 [0,1,0,0,0,0|2,0,1]=4 698 B11R1.16 C\C(=C/CO)\c1cccc[n]1 Amb24373086 [0,1,0,0,0,0|2,0,1]=4 699 B11R1.16 C\C(=C\C#N)\c1ccccc1 Amb25720664 [0,1,0,0,0,0|2,0,1]=4 700 B11R1.16 C\C(=C\C=O)\c1ccccc1 Amb25124926 [0,1,0,0,0,0|1,0,2]=4 701 B11R1.16 C\C(=C\CCl)\c1ccccc1 Amb24579744 [0,1,0,0,0,0|2,0,1]=4 702 B11R1.16 C\C(=C\CN)\c1ccccc1 Amb25145810 [0,1,0,0,0,0|2,0,1]=4 703 B11R1.16 C\C(=C\CO)\c1cccc[n]1 Amb24563551 [0,1,0,0,0,0|2,0,1]=4 704 B11R1.16 C\C=C/C(O)c1c[n]ccc1 Amb25241944 [0,1,0,0,0,0|3,0,0]=4 705 B11R1.16 C\C=C\C(=O)c1ccccc1 Amb10574126 [0,1,0,0,0,0|2,0,1]=4 706 B11R1.16 C\C=C\C(C)c1cc[n]cc1 Amb24571960 [0,1,0,0,0,0|3,0,0]=4 707 B11R1.16 C\C=C\C(N)c1ccccc1 Amb18124850 [0,1,0,0,0,0|2,0,0]=3 708 B11R1.16 C\C=C\C(O)c1cccc[n]1 Amb24431006 [0,1,0,0,0,0|3,0,0]=4 709 B11R1.16 C\C=C\[C@@H](O)c1ccccc1 Amb25760539 [0,1,0,0,0,0|2,0,0]=3 710 B11R1.16 C\C=C\[C@H](O)c1ccccc1 Amb25190477 [0,1,0,0,0,0|2,0,0]=3 711 B11R1.16 ClCCC(Br)c1ccccc1 Amb21856734 [0,1,0,0,0,0|2,0,1]=4 712 B11R1.16 ClCCC(Cl)c1ccccc1 Amb17872667 [0,1,0,0,0,0|2,0,1]=4 713 B11R1.16 ClCCC(c1ccccc1)C Amb17232691 [0,1,0,0,0,0|2,0,1]=4 714 B11R1.16 ClCCC(c1ccccc1)O Amb17611064 [0,1,0,0,0,0|2,0,1]=4 715 B11R1.16 ClCC[C@@H](c1ccccc1)O Amb17611058 [0,1,0,0,0,0|2,0,1]=4 716 B11R1.16 ClC\C=C(\Br)/c1ccccc1 Amb25777111 [0,1,0,0,0,0|2,0,1]=4 717 B11R1.16 Cl\C=C\C(=O)c1ccccc1 Amb17594153 [0,1,0,0,0,0|2,0,1]=4 718 B11R1.16 Cl\C=C\C(Cl)c1ccccc1 Amb24634048 [0,1,0,0,0,0|2,0,0]=3 719 B11R1.16 N#CCC(Cl)c1ccccc1 Amb25238256 [0,1,0,0,0,0|2,0,1]=4 720 B11R1.16 N#CCC(F)c1ccccc1 Amb25127669 [0,1,0,0,0,0|2,0,1]=4 721 B11R1.16 N#CC[C@@H](O)c1ccccc1 Amb25680039 [0,1,0,0,0,0|2,0,1]=4 722 B11R1.16 N#CC[C@H](O)c1ccccc1 Amb24617537 [0,1,0,0,0,0|2,0,1]=4 723 B11R1.16 N#C\C=C(\c1ccccc1)/Br Amb17595559 [0,1,0,0,0,0|2,0,1]=4 724 B11R1.16 N#C\C=C(\c1ccccc1)/Cl Amb1107219 [0,1,0,0,0,0|2,0,1]=4 725 B11R1.16 NC(CC#N)c1ccccc1 Amb18964887 [0,1,0,0,0,0|2,0,1]=4 726 B11R1.16 NC(CC#N)c1ccccc1 Amb20632783 [0,1,0,0,0,0|2,0,1]=4 727 B11R1.16 NC(CCO)c1cccc[n]1 Amb18120551 [0,1,0,0,0,0|2,0,1]=4 728 B11R1.16 NC(CCO)c1ccccc1 Amb22730035 [0,1,0,0,0,0|1,0,1]=3 729 B11R1.16 NCCC(Cl)c1ccccc1 Amb24487859 [0,1,0,0,0,0|2,0,1]=4 730 B11R1.16 NCCC(N)c1ccccc1 Amb18972395 [0,1,0,0,0,0|2,0,1]=4 731 B11R1.16 NCCC(O)c1ccccc1 Amb21984527 [0,1,0,0,0,0|2,0,1]=4 732 B11R1.16 NCCC(S)c1ccccc1 Amb18251942 [0,1,0,0,0,0|2,0,1]=4 733 B11R1.16 NCCC(c1ccccc1)O Amb2383139 [0,1,0,0,0,0|2,0,1]=4 734 B11R1.16 NCC[C@@H](N)c1ccccc1 Amb25210474 [0,1,0,0,0,0|2,0,1]=4 735 B11R1.16 NCC[C@@H](O)c1ccccc1 Amb22225304 [0,1,0,0,0,0|2,0,1]=4 736 B11R1.16 NCC[C@H](O)c1ccccc1 Amb22226644 [0,1,0,0,0,0|2,0,1]=4 737 B11R1.16 NN(CCO)c1ccccc1 Amb24555138 [0,1,0,0,0,0|2,0,1]=4 738 B11R1.16 NNCC(F)c1ccccc1 Amb25061630 [0,1,0,0,0,0|1,0,2]=4 739 B11R1.16 NNCC(c1ccccc1)O Amb17232104 [0,1,0,0,0,0|1,0,2]=4 740 B11R1.16 NNC[C@@H](O)c1ccccc1 Amb24466315 [0,1,0,0,0,0|1,0,2]=4 741 B11R1.16 NNC[C@H](O)c1ccccc1 Amb25236157 [0,1,0,0,0,0|1,0,2]=4 742 B11R1.16 NOCC(c1ccccc1)O Amb17334342 [0,1,0,0,0,0|2,0,1]=4 743 B11R1.16 NOC[C@@H](O)c1ccccc1 Amb25152160 [0,1,0,0,0,0|2,0,1]=4 744 B11R1.16 N[C@@H](CCO)c1cc[n]cc1 Amb25131721 [0,1,0,0,0,0|2,0,1]=4 745 B11R1.16 N[C@H](CCO)c1cc[n]cc1 Amb25843798 [0,1,0,0,0,0|2,0,1]=4 746 B11R1.16 N[C@H](CCO)c1cccc[n]1 Amb25789774 [0,1,0,0,0,0|2,0,1]=4 747 B11R1.16 N[C@H](CCO)c1ccccc1 Amb22265524 [0,1,0,0,0,0|1,0,1]=3 748 B11R1.16 N\C(=C\C=O)\c1ccccc1 Amb24514799 [0,1,0,0,0,0|1,0,2]=4 749 B11R1.16 N\C=C/C(=O)c1ccccc1 Amb24706769 [0,1,0,0,0,0|2,0,1]=4 750 B11R1.16 N\C=C\C(=O)c1ccccc1 Amb25730024 [0,1,0,0,0,0|2,0,1]=4 751 B11R1.16 O=C(C=C=O)c1ccccc1 Amb24737519 [0,1,0,0,0,0|1,0,2]=4 752 B11R1.16 O=C(C=S=O)c1ccccc1 Amb25713057 [0,1,0,0,0,0|1,0,2]=4 753 B11R1.16 O=C(CN=O)c1ccccc1 Amb25821412 [0,1,0,0,0,0|0,0,3]=4 754 B11R1.16 O=C(\C=C/Cl)c1ccccc1 Amb25723188 [0,1,0,0,0,0|2,0,1]=4 755 B11R1.16 O=C(\C=N\Cl)c1ccccc1 Amb25319928 [0,1,0,0,0,0|1,0,1]=3 756 B11R1.16 O=C(c1ccccc1)C=[N+]=[N-] Amb16233231 [0,1,0,0,0,0|1,0,2]=4 757 B11R1.16 O=CC=C(c1ccccc1)Cl Amb17232626 [0,1,0,0,0,0|1,0,2]=4 758 B11R1.16 O=CCC(Cl)c1ccccc1 Amb24470053 [0,1,0,0,0,0|1,0,2]=4 759 B11R1.16 O=CCC(S)c1ccccc1 Amb18126455 [0,1,0,0,0,0|1,0,2]=4 760 B11R1.16 O=COC(Cl)c1ccccc1 Amb24710112 [0,1,0,0,0,0|2,0,1]=4 761 B11R1.16 O=C\C=C(/F)\c1ccccc1 Amb18125100 [0,1,0,0,0,0|1,0,2]=4 762 B11R1.16 O=C\C=C(/S)\c1ccccc1 Amb18646120 [0,1,0,0,0,0|1,0,2]=4 763 B11R1.16 O=C\C=C(\Br)/c1ccccc1 Amb25084228 [0,1,0,0,0,0|1,0,2]=4 764 B11R1.16 O=C\C=C(\Cl)/c1ccccc1 Amb19884139 [0,1,0,0,0,0|1,0,2]=4 765 B11R1.16 O=C\C=C(\c1ccccc1)/C Amb17593660 [0,1,0,0,0,0|1,0,2]=4 766 B11R1.16 O=NCC(Cl)c1ccccc1 Amb25177516 [0,1,0,0,0,0|0,0,2]=3 767 B11R1.16 OC(CC=O)c1ccccc1 Amb18125126 [0,1,0,0,0,0|1,0,2]=4 768 B11R1.16 OC(CCF)c1ccccc1 Amb24412986 [0,1,0,0,0,0|2,0,1]=4 769 B11R1.16 OC(CCS)c1ccccc1 Amb25837914 [0,1,0,0,0,0|1,1,1]=4 770 B11R1.16 OC(CNO)c1ccccc1 Amb22366087 [0,1,0,0,0,0|0,0,2]=3 771 B11R1.16 OC(c1ccccc1)C#CBr Amb1083115 [0,1,0,0,0,0|2,0,1]=4 772 B11R1.16 OCCC(=O)c1ccccc1 Amb16231606 [0,1,0,0,0,0|1,0,2]=4 773 B11R1.16 OCCC(O)c1cc[n]cc1 Amb25760239 [0,1,0,0,0,0|2,0,1]=4 774 B11R1.16 OCCC(O)c1cccc[n]1 Amb22756156 [0,1,0,0,0,0|2,0,1]=4 775 B11R1.16 OCCC(O)c1ccccc1 Amb17777842 [0,1,0,0,0,0|1,0,1]=3 776 B11R1.16 OCCC(c1ccccc1)N Amb1993953 [0,1,0,0,0,0|1,0,1]=3 777 B11R1.16 OCC[C@H](O)c1cc[n]cc1 Amb24715913 [0,1,0,0,0,0|2,0,1]=4 778 B11R1.16 OCNC(=O)c1ccccc1 Amb1200467 [0,1,0,0,0,0|2,0,1]=4 779 B11R1.16 OCNC(=S)c1ccccc1 Amb25289021 [0,1,0,0,0,0|2,0,1]=4 780 B11R1.16 OCOC(=O)c1ccccc1 Amb25115920 [0,1,0,0,0,0|2,0,1]=4 781 B11R1.16 OCSC(=S)c1ccccc1 Amb25806661 [0,1,0,0,0,0|2,0,1]=4 782 B11R1.16 OC\C=C(\Cl)/c1ccccc1 Amb24748632 [0,1,0,0,0,0|1,0,1]=3 783 B11R1.16 OC\C=C(\F)/c1ccccc1 Amb24355216 [0,1,0,0,0,0|1,0,1]=3 784 B11R1.16 ONCC(c1ccccn1)O Amb17334345 [0,1,0,0,0,0|1,0,2]=4 785 B11R1.16 ONCC(c1cccnc1)O Amb17334346 [0,1,0,0,0,0|1,0,2]=4 786 B11R1.16 ONCC(c1ccncc1)O Amb17334347 [0,1,0,0,0,0|1,0,2]=4 787 B11R1.16 OSCC(O)c1ccccc1 Amb25686224 [0,1,0,0,0,0|1,0,1]=3 788 B11R1.16 OSC[C@@H](O)c1ccccc1 Amb25787381 [0,1,0,0,0,0|1,0,1]=3 789 B11R1.16 O[C@H](CC=O)c1ccccc1 Amb24533175 [0,1,0,0,0,0|1,0,2]=4 790 B11R1.16 O\C=C\C(=S)c1ccccc1 Amb24645164 [0,1,0,0,0,0|1,0,1]=3 791 B11R1.16 O\N=C/C(=O)c1ccccc1 Amb25767720 [0,1,0,0,0,0|0,0,1]=2 792 B11R1.16 O\N=C\C(O)c1cccc[n]1 Amb25077983 [0,1,0,0,0,0|1,0,0]=2 793 B11R1.16 O\N=C\C(O)c1ccccc1 Amb25149681 [0,1,0,0,0,0|0,0,0]=1 794 B11R1.16 [N-]=[N+]=NC(O)c1ccccc1 Amb24724629 [0,1,0,0,0,0|2,0,1]=4 795 B11R1.16 [O-]/C=C\C(=O)c1ccccc1 Amb17843402 [0,1,0,0,0,0|1,0,2]=4 796 B11R1.16 [O-]SOC(O)c1ccccc1 Amb24403740 [0,1,0,0,0,0|2,0,1]=4 797 B11R1.16 [O-]\C=C/C(=O)c1ccccc1 Amb2385893 [0,1,0,0,0,0|1,0,2]=4 798 B11R1.16 [O-]\C=C\C(=O)c1ccccc1 Amb22360915 [0,1,0,0,0,0|1,0,2]=4 799 B11R1.17 BrCCCc1ccccc1C Amb17104552 [0,1,0,0,0,0|2,0,1]=4 800 B11R1.17 BrCCCc1ccccc1Cl Amb17104560 [0,1,0,0,0,0|2,0,1]=4 801 B11R1.17 BrCCCc1ccccc1F Amb17104555 [0,1,0,0,0,0|2,0,1]=4 802 B11R1.17 Br[Mg]CCc1ccccc1F Amb13890864 [0,1,0,0,0,0|2,0,1]=4 803 B11R1.17 Br[Zn]CCc1ccccc1F Amb13890853 [0,1,0,0,0,0|2,0,1]=4 804 B11R1.17 Brc1ccccc1CCCI Amb25329656 [0,1,0,0,0,0|2,0,1]=4 805 B11R1.17 Brc1ccccc1\C=C\CBr Amb25149093 [0,1,0,0,0,0|2,0,1]=4 806 B11R1.17 C#CCCc1ccccc1Cl Amb18116938 [0,1,0,0,0,0|2,0,1]=4 807 B11R1.17 C#CCCc1ccccc1F Amb18636110 [0,1,0,0,0,0|2,0,1]=4 808 B11R1.17 C=CCCc1ccccc1N Amb18124836 [0,1,0,0,0,0|2,0,1]=4 809 B11R1.17 C=CCCc1ccccc1O Amb18124913 [0,1,0,0,0,0|2,0,1]=4 810 B11R1.17 C=COCc1ccccc1Br Amb25679589 [0,1,0,0,0,0|3,0,0]=4 811 B11R1.17 C=COCc1ccccc1F Amb24569429 [0,1,0,0,0,0|3,0,0]=4 812 B11R1.17 C=C\C=C\c1ccccc1N Amb18644207 [0,1,0,0,0,0|2,0,1]=4 813 B11R1.17 C=C\C=C\c1ccccc1O Amb25142722 [0,1,0,0,0,0|2,0,1]=4 814 B11R1.17 CC=CCc1ccccc1O Amb24089583 [0,1,0,0,0,0|2,0,0]=3 815 B11R1.17 CCCCc1ccccc1Br Amb15690808 [0,1,0,0,0,0|2,0,1]=4 816 B11R1.17 CCCCc1ccccc1F Amb24426932 [0,1,0,0,0,0|2,0,1]=4 817 B11R1.17 CCCCc1ccccc1O Amb25744605 [0,1,0,0,0,0|2,0,1]=4 818 B11R1.17 CCNCc1ccccc1I Amb21861742 [0,1,0,0,0,0|3,0,0]=4 819 B11R1.17 CCOCc1ccccc1Br Amb22227882 [0,1,0,0,0,0|3,0,0]=4 820 B11R1.17 CCOCc1ccccc1O Amb10560038 [0,1,0,0,0,0|3,0,0]=4 821 B11R1.17 CCSCc1ccccc1Br Amb22228180 [0,1,0,0,0,0|3,0,0]=4 822 B11R1.17 CCSCc1ccccc1Cl Amb25676288 [0,1,0,0,0,0|3,0,0]=4 823 B11R1.17 CCSCc1ccccc1O Amb18126550 [0,1,0,0,0,0|3,0,0]=4 824 B11R1.17 CC\C=C/c1ccccc1O Amb25713551 [0,1,0,0,0,0|2,0,1]=4 825 B11R1.17 CC\C=C\c1ccccc1N Amb22751020 [0,1,0,0,0,0|2,0,1]=4 826 B11R1.17 CC\C=C\c1ccccc1O Amb18124914 [0,1,0,0,0,0|2,0,1]=4 827 B11R1.17 CC\C=N\c1ccccc1N Amb24060501 [0,1,0,0,0,0|3,0,0]=4 828 B11R1.17 CC\C=N\c1ccccc1O Amb24486452 [0,1,0,0,0,0|3,0,0]=4 829 B11R1.17 CNCCc1ccccc1Br Amb18299468 [0,1,0,0,0,0|1,0,2]=4 830 B11R1.17 CNCCc1ccccc1N Amb24106838 [0,1,0,0,0,0|1,0,2]=4 831 B11R1.17 CNCCc1ccccc1O Amb18560895 [0,1,0,0,0,0|1,0,2]=4 832 B11R1.17 COCCc1ccccc1Cl Amb24518157 [0,1,0,0,0,0|2,0,1]=4 833 B11R1.17 COCCc1ccccc1I Amb24483388 [0,1,0,0,0,0|2,0,1]=4 834 B11R1.17 COCCc1ccccc1N Amb18992153 [0,1,0,0,0,0|2,0,1]=4 835 B11R1.17 COCCc1ccccc1O Amb22055702 [0,1,0,0,0,0|2,0,1]=4 836 B11R1.17 CONCc1ccccc1F Amb24725975 [0,1,0,0,0,0|3,0,0]=4 837 B11R1.17 CONCc1ccccc1O Amb24432475 [0,1,0,0,0,0|3,0,0]=4 838 B11R1.17 CO\C=C/c1ccccc1O Amb24485852 [0,1,0,0,0,0|2,0,1]=4 839 B11R1.17 CO\C=C\c1ccccc1Cl Amb25802000 [0,1,0,0,0,0|2,0,1]=4 840 B11R1.17 CO\C=C\c1ccccc1O Amb25715988 [0,1,0,0,0,0|2,0,1]=4 841 B11R1.17 CSCCc1ccccc1Cl Amb25222784 [0,1,0,0,0,0|2,0,1]=4 842 B11R1.17 CSCCc1ccccc1N Amb18299122 [0,1,0,0,0,0|2,0,1]=4 843 B11R1.17 CS\C=C/c1ccccc1N Amb18646409 [0,1,0,0,0,0|2,0,1]=4 844 B11R1.17 CS\C=C\c1ccccc1O Amb18646619 [0,1,0,0,0,0|2,0,1]=4 845 B11R1.17 C\C=C/Cc1ccccc1O Amb25345359 [0,1,0,0,0,0|2,0,0]=3 846 B11R1.17 C\C=C\CC1=CC=CNC1=O Amb24411454 [0,1,0,0,0,0|3,0,0]=4 847 B11R1.17 C\C=C\C[n+]1ccccc1F Amb24343539 [0,1,0,0,0,0|3,0,0]=4 848 B11R1.17 C\C=C\Cc1ccccc1N Amb18644343 [0,1,0,0,0,0|2,0,0]=3 849 B11R1.17 C\C=C\Oc1ccccc1O Amb25143344 [0,1,0,0,0,0|3,0,0]=4 850 B11R1.17 C\N=C\Cc1ccccc1O Amb25844316 [0,1,0,0,0,0|1,0,0]=2 851 B11R1.17 Cc1[n]cccc1CCCO Amb24360630 [0,1,0,0,0,0|2,0,1]=4 852 B11R1.17 Cc1c[n]ccc1\C=C\CO Amb25262595 [0,1,0,0,0,0|2,0,1]=4 853 B11R1.17 Cc1cc[n]cc1CCCO Amb25717118 [0,1,0,0,0,0|2,0,1]=4 854 B11R1.17 Cc1ccc[n]c1CCCO Amb24685021 [0,1,0,0,0,0|2,0,1]=4 855 B11R1.17 Cc1ccc[n]c1C\C=C/C Amb24101994 [0,1,0,0,0,0|3,0,0]=4 856 B11R1.17 Cc1ccc[n]c1N\C=N\O Amb24652454 [0,1,0,0,0,0|2,0,0]=3 857 B11R1.17 Cc1ccccc1C#CCO Amb25117588 [0,1,0,0,0,0|1,0,2]=4 858 B11R1.17 Cc1ccccc1CCC#C Amb18636111 [0,1,0,0,0,0|2,0,1]=4 859 B11R1.17 Cc1ccccc1CCCC Amb25825024 [0,1,0,0,0,0|2,0,1]=4 860 B11R1.17 Cc1ccccc1CCNC Amb19959980 [0,1,0,0,0,0|1,0,2]=4 861 B11R1.17 Cc1ccccc1CC[Zn]Br Amb22000497 [0,1,0,0,0,0|2,0,1]=4 862 B11R1.17 Cc1ccccc1CNC=O Amb21859038 [0,1,0,0,0,0|2,0,1]=4 863 B11R1.17 Cc1ccccc1COC=O Amb17778964 [0,1,0,0,0,0|2,0,1]=4 864 B11R1.17 Cc1ccccc1COCCl Amb24352480 [0,1,0,0,0,0|3,0,0]=4 865 B11R1.17 Cc1ccccc1CSC#N Amb17778963 [0,1,0,0,0,0|3,0,0]=4 866 B11R1.17 Cc1ccccc1CSCC Amb24690023 [0,1,0,0,0,0|3,0,0]=4 867 B11R1.17 Cc1ccccc1C\C=C\Cl Amb25109327 [0,1,0,0,0,0|2,0,0]=3 868 B11R1.17 Cc1ccccc1O\C=C/Cl Amb25796451 [0,1,0,0,0,0|3,0,0]=4 869 B11R1.17 Cc1ccccc1SCCO Amb18180155 [0,1,0,0,0,0|2,0,1]=4 870 B11R1.17 Cc1ccccc1\C=C\CBr Amb25169542 [0,1,0,0,0,0|2,0,1]=4 871 B11R1.17 Cc1ccccc1\C=C\CN Amb18065178 [0,1,0,0,0,0|2,0,1]=4 872 B11R1.17 Cc1ccccc1\C=C\CO Amb23442935 [0,1,0,0,0,0|1,0,1]=3 873 B11R1.17 Cc1ccccc1\N=C\NC Amb25312744 [0,1,0,0,0,0|2,0,1]=4 874 B11R1.17 ClCCCc1ccccc1C Amb17104525 [0,1,0,0,0,0|2,0,1]=4 875 B11R1.17 ClCCCc1ccccc1Cl Amb17104533 [0,1,0,0,0,0|2,0,1]=4 876 B11R1.17 ClCCCc1ccccc1F Amb17104528 [0,1,0,0,0,0|2,0,1]=4 877 B11R1.17 ClCCCc1ccccc1N Amb17477710 [0,1,0,0,0,0|2,0,1]=4 878 B11R1.17 ClCCCc1ccccc1O Amb17477721 [0,1,0,0,0,0|2,0,1]=4 879 B11R1.17 ClCOCc1ccccc1Br Amb25679464 [0,1,0,0,0,0|3,0,0]=4 880 B11R1.17 Cl\C=C\C[n+]1ccccc1Br Amb25801790 [0,1,0,0,0,0|3,0,0]=4 881 B11R1.17 Clc1ccccc1CC[Zn]Br Amb22898141 [0,1,0,0,0,0|2,0,1]=4 882 B11R1.17 Clc1ccccc1CC[Zn]Cl Amb22897727 [0,1,0,0,0,0|2,0,1]=4 883 B11R1.17 Fc1cccc[n+]1C\C=C\Cl Amb24349914 [0,1,0,0,0,0|3,0,0]=4 884 B11R1.17 Fc1ccccc1\C=C\CBr Amb24374006 [0,1,0,0,0,0|2,0,1]=4 885 B11R1.17 N#CCCc1ccccc1Br Amb17204424 [0,1,0,0,0,0|2,0,1]=4 886 B11R1.17 N#CCCc1ccccc1C Amb17204295 [0,1,0,0,0,0|2,0,1]=4 887 B11R1.17 N#CCCc1ccccc1F Amb17204298 [0,1,0,0,0,0|2,0,1]=4 888 B11R1.17 N#CCCc1ccccc1O Amb17509008 [0,1,0,0,0,0|2,0,1]=4 889 B11R1.17 N#CNCc1ccccc1Br Amb25045111 [0,1,0,0,0,0|3,0,0]=4 890 B11R1.17 N#CNCc1ccccc1C Amb16186975 [0,1,0,0,0,0|3,0,0]=4 891 B11R1.17 N#CNCc1ccccc1Cl Amb16186973 [0,1,0,0,0,0|3,0,0]=4 892 B11R1.17 N#CNCc1ccccc1F Amb16186971 [0,1,0,0,0,0|3,0,0]=4 893 B11R1.17 N#CSCc1ccccc1Br Amb21959350 [0,1,0,0,0,0|3,0,0]=4 894 B11R1.17 N#CSCc1ccccc1Cl Amb19889456 [0,1,0,0,0,0|3,0,0]=4 895 B11R1.17 N#CSCc1ccccc1F Amb10789221 [0,1,0,0,0,0|3,0,0]=4 896 B11R1.17 N#C\C=C\c1ccccc1Br Amb17239681 [0,1,0,0,0,0|2,0,1]=4 897 B11R1.17 N#C\C=C\c1ccccc1C Amb17231962 [0,1,0,0,0,0|2,0,1]=4 898 B11R1.17 N#C\C=C\c1ccccc1Cl Amb17232457 [0,1,0,0,0,0|2,0,1]=4 899 B11R1.17 N#C\C=C\c1ccccc1F Amb17232025 [0,1,0,0,0,0|2,0,1]=4 900 B11R1.17 N#C\C=C\c1ccccc1O Amb18644195 [0,1,0,0,0,0|2,0,1]=4 901 B11R1.17 N=C=NCc1ccccc1O Amb24486464 [0,1,0,0,0,0|3,0,0]=4 902 B11R1.17 NCCCc1ccccc1Cl Amb1090913 [0,1,0,0,0,0|2,0,1]=4 903 B11R1.17 NCCCc1ccccc1Cl Amb19373405 [0,1,0,0,0,0|2,0,1]=4 904 B11R1.17 NCCCc1ccccc1F Amb13949158 [0,1,0,0,0,0|2,0,1]=4 905 B11R1.17 NCCCc1ccccc1N Amb17477695 [0,1,0,0,0,0|2,0,1]=4 906 B11R1.17 NC\C=C\c1ccccc1Br Amb18569373 [0,1,0,0,0,0|2,0,1]=4 907 B11R1.17 NC\C=C\c1ccccc1Cl Amb18065473 [0,1,0,0,0,0|2,0,1]=4 908 B11R1.17 NC\C=C\c1ccccc1F Amb18065347 [0,1,0,0,0,0|2,0,1]=4 909 B11R1.17 NNCCc1ccccc1Br Amb24701935 [0,1,0,0,0,0|1,0,2]=4 910 B11R1.17 NNCCc1ccccc1F Amb20668135 [0,1,0,0,0,0|1,0,2]=4 911 B11R1.17 NOCCc1ccccc1Br Amb18657908 [0,1,0,0,0,0|2,0,1]=4 912 B11R1.17 NOCCc1ccccc1Cl Amb18647570 [0,1,0,0,0,0|2,0,1]=4 913 B11R1.17 NOCCc1ccccc1F Amb22896629 [0,1,0,0,0,0|2,0,1]=4 914 B11R1.17 Nc1cc[n]cc1CCCO Amb24355779 [0,1,0,0,0,0|2,0,1]=4 915 B11R1.17 Nc1ccccc1C#CCO Amb22228947 [0,1,0,0,0,0|1,0,2]=4 916 B11R1.17 Nc1ccccc1CCC#N Amb18124793 [0,1,0,0,0,0|2,0,1]=4 917 B11R1.17 Nc1ccccc1CCC=O Amb25208520 [0,1,0,0,0,0|1,0,2]=4 918 B11R1.17 Nc1ccccc1CCCBr Amb22228093 [0,1,0,0,0,0|2,0,1]=4 919 B11R1.17 Nc1ccccc1CCCBr Amb25217893 [0,1,0,0,0,0|2,0,1]=4 920 B11R1.17 Nc1ccccc1CNC=O Amb24096445 [0,1,0,0,0,0|2,0,1]=4 921 B11R1.17 Nc1ccccc1\C=C\C#N Amb18644158 [0,1,0,0,0,0|2,0,1]=4 922 B11R1.17 Nc1ccccc1\C=C\C=O Amb24538270 [0,1,0,0,0,0|1,0,2]=4 923 B11R1.17 Nc1ccccc1\C=C\CO Amb25353301 [0,1,0,0,0,0|1,0,1]=3 924 B11R1.17 Nc1ncccc1CCCO Amb13890002 [0,1,0,0,0,0|2,0,1]=4 925 B11R1.17 O=C/1C=CC=C\C1=C\C=C=O Amb24378989 [0,1,0,0,0,0|1,0,2]=4 926 B11R1.17 O=C=NCc1ccccc1Br Amb25251434 [0,1,0,0,0,0|2,0,1]=4 927 B11R1.17 O=CCCc1ccccc1Br Amb22498060 [0,1,0,0,0,0|1,0,2]=4 928 B11R1.17 O=CCCc1ccccc1Cl Amb17081678 [0,1,0,0,0,0|1,0,2]=4 929 B11R1.17 O=CCCc1ccccc1F Amb10602147 [0,1,0,0,0,0|1,0,2]=4 930 B11R1.17 O=CCCc1ccccc1I Amb24093007 [0,1,0,0,0,0|1,0,2]=4 931 B11R1.17 O=CCCc1ccccc1S Amb25325144 [0,1,0,0,0,0|1,0,2]=4 932 B11R1.17 O=CNCc1ccccc1Cl Amb19871473 [0,1,0,0,0,0|2,0,1]=4 933 B11R1.17 O=CNCc1ccccc1F Amb25369873 [0,1,0,0,0,0|2,0,1]=4 934 B11R1.17 O=C\C=C/c1ccccc1S Amb24638879 [0,1,0,0,0,0|1,0,2]=4 935 B11R1.17 O=C\C=C\c1ccccc1Br Amb17240825 [0,1,0,0,0,0|1,0,2]=4 936 B11R1.17 O=C\C=C\c1ccccc1C Amb17232007 [0,1,0,0,0,0|1,0,2]=4 937 B11R1.17 O=C\C=C\c1ccccc1Cl Amb17232625 [0,1,0,0,0,0|1,0,2]=4 938 B11R1.17 O=C\C=C\c1ccccc1F Amb17232062 [0,1,0,0,0,0|1,0,2]=4 939 B11R1.17 OCC#Cc1ccccc1I Amb24731810 [0,1,0,0,0,0|1,0,2]=4 940 B11R1.17 OCC=Cc1ccccc1F Amb22228953 [0,1,0,0,0,0|1,0,1]=3 941 B11R1.17 OCCCN1C=CC=CC1=O Amb18041289 [0,1,0,0,0,0|2,0,1]=4 942 B11R1.17 OCCCc1[n]cccc1Br Amb25273165 [0,1,0,0,0,0|2,0,1]=4 943 B11R1.17 OCCCc1cc[n]cc1Cl Amb23596495 [0,1,0,0,0,0|2,0,1]=4 944 B11R1.17 OCCCc1cc[n]cc1F Amb25825625 [0,1,0,0,0,0|2,0,1]=4 945 B11R1.17 OCCCc1ccccc1Br Amb15692692 [0,1,0,0,0,0|1,0,1]=3 946 B11R1.17 OCCCc1ccccc1C Amb17089494 [0,1,0,0,0,0|1,0,1]=3 947 B11R1.17 OCCCc1ccccc1Cl Amb17089499 [0,1,0,0,0,0|1,0,1]=3 948 B11R1.17 OCCCc1ccccc1F Amb17089496 [0,1,0,0,0,0|1,0,1]=3 949 B11R1.17 OCCCc1ccccc1N Amb17477702 [0,1,0,0,0,0|1,0,1]=3 950 B11R1.17 OCCCc1ccccc1O Amb17477714 [0,1,0,0,0,0|1,0,1]=3 951 B11R1.17 OCCCc1ccncc1C Amb10573523 [0,1,0,0,0,0|2,0,1]=4 952 B11R1.17 OCCOc1ccccc1C Amb2209345 [0,1,0,0,0,0|2,0,1]=4 953 B11R1.17 OCCOc1ccccc1Cl Amb2209355 [0,1,0,0,0,0|2,0,1]=4 954 B11R1.17 OCCOc1ccccc1I Amb25761613 [0,1,0,0,0,0|2,0,1]=4 955 B11R1.17 OCCOc1ccccc1O Amb1144452 [0,1,0,0,0,0|2,0,1]=4 956 B11R1.17 OC\C=C\c1ccccc1Br Amb25149289 [0,1,0,0,0,0|1,0,1]=3 957 B11R1.17 OC\C=C\c1ccccc1F Amb23442840 [0,1,0,0,0,0|1,0,1]=3 958 B11R1.17 O\N=C/Cc1ccccc1F Amb24100286 [0,1,0,0,0,0|0,0,0]=1 959 B11R1.17 O\N=C\Cc1ccccc1F Amb25206635 [0,1,0,0,0,0|0,0,0]=1 960 B11R1.17 Oc1ccc[n]c1CCCO Amb18125538 [0,1,0,0,0,0|2,0,1]=4 961 B11R1.17 Oc1ccc[n]c1\N=C\NO Amb23589913 [0,1,0,0,0,0|2,0,1]=4 962 B11R1.17 Oc1ccccc1C#CCO Amb23412359 [0,1,0,0,0,0|1,0,2]=4 963 B11R1.17 Oc1ccccc1CCC=O Amb22228954 [0,1,0,0,0,0|1,0,2]=4 964 B11R1.17 Oc1ccccc1CCCF Amb24100539 [0,1,0,0,0,0|2,0,1]=4 965 B11R1.17 Oc1ccccc1C\C=C/Cl Amb24578313 [0,1,0,0,0,0|2,0,0]=3 966 B11R1.17 Oc1ccccc1C\C=C\Cl Amb18647090 [0,1,0,0,0,0|2,0,0]=3 967 B11R1.17 Oc1ccccc1NCCO Amb18644558 [0,1,0,0,0,0|2,0,1]=4 968 B11R1.17 Oc1ccccc1SCCO Amb18177935 [0,1,0,0,0,0|2,0,1]=4 969 B11R1.17 Oc1ccccc1\C=C/CCl Amb24401534 [0,1,0,0,0,0|2,0,1]=4 970 B11R1.17 Oc1ccccc1\C=C/CO Amb18125107 [0,1,0,0,0,0|1,0,1]=3 971 B11R1.17 Oc1ccccc1\C=C\CBr Amb25225899 [0,1,0,0,0,0|2,0,1]=4 972 B11R1.17 Oc1ccccc1\C=C\CO Amb25300470 [0,1,0,0,0,0|1,0,1]=3 973 B11R1.17 Oc1ccccc1\N=C\C=O Amb24759135 [0,1,0,0,0,0|2,0,1]=4 974 B11R1.17 Oc1ccncc1CCCO Amb13889999 [0,1,0,0,0,0|2,0,1]=4 975 B11R1.17 S=C=NCc1ccccc1Br Amb24402120 [0,1,0,0,0,0|2,1,0]=4 976 B11R1.17 SCCCc1ccccc1Br Amb18070447 [0,1,0,0,0,0|1,1,1]=4 977 B11R1.17 SCCCc1ccccc1C Amb17400218 [0,1,0,0,0,0|1,1,1]=4 978 B11R1.17 SCCCc1ccccc1Cl Amb17401095 [0,1,0,0,0,0|1,1,1]=4 979 B11R1.17 SCCCc1ccccc1F Amb17400332 [0,1,0,0,0,0|1,1,1]=4 980 B11R1.17 Sc1ccccc1CCCBr Amb25196016 [0,1,0,0,0,0|2,0,1]=4 981 B11R1.17 [C-]#[N+]CCc1ccccc1O Amb24644224 [0,1,0,0,0,0|1,0,2]=4 982 B11R1.24 BrCCCc1cccc(c1)Br Amb17104576 [0,1,0,0,0,0|2,0,1]=4 983 B11R1.24 BrCCCc1cccc(c1)C Amb17104553 [0,1,0,0,0,0|2,0,1]=4 984 B11R1.24 BrCCCc1cccc(c1)Cl Amb17104561 [0,1,0,0,0,0|2,0,1]=4 985 B11R1.24 Br[Zn]CCc1cccc(c1)Br Amb13890856 [0,1,0,0,0,0|2,0,1]=4 986 B11R1.24 C#CCCc1cccc(Cl)c1 Amb18116942 [0,1,0,0,0,0|2,0,1]=4 987 B11R1.24 C#CCCc1cccc(F)c1 Amb18118085 [0,1,0,0,0,0|2,0,1]=4 988 B11R1.24 C=CCCc1cccc(O)c1 Amb25275934 [0,1,0,0,0,0|2,0,1]=4 989 B11R1.24 C=C\C=C\c1cccc(Cl)c1 Amb25221723 [0,1,0,0,0,0|2,0,1]=4 990 B11R1.24 C=C\C=C\c1cccc(F)c1 Amb24485865 [0,1,0,0,0,0|2,0,1]=4 991 B11R1.24 C=C\C=C\c1cccc(O)c1 Amb25176416 [0,1,0,0,0,0|2,0,1]=4 992 B11R1.24 CCCCc1cccc(Br)c1 Amb19944057 [0,1,0,0,0,0|2,0,1]=4 993 B11R1.24 CCCCc1cccc(I)c1 Amb19944046 [0,1,0,0,0,0|2,0,1]=4 994 B11R1.24 CCCCc1cccc(S)c1 Amb24415059 [0,1,0,0,0,0|2,0,1]=4 995 B11R1.24 CCCCc1cccc(c1)N Amb17593719 [0,1,0,0,0,0|2,0,1]=4 996 B11R1.24 CCNCc1cc(I)ccc1 Amb24066806 [0,1,0,0,0,0|3,0,0]=4 997 B11R1.24 CCNCc1cc(I)ccc1 Amb24066807 [0,1,0,0,0,0|3,0,0]=4 998 B11R1.24 CCNCc1cc(N)ccc1 Amb18290000 [0,1,0,0,0,0|3,0,0]=4 999 B11R1.24 CCNCc1cc(S)ccc1 Amb25705598 [0,1,0,0,0,0|3,0,0]=4 1000 B11R1.24 CCNCc1cccc(c1)Br Amb13949217 [0,1,0,0,0,0|3,0,0]=4 1001 B11R1.24 CCOCc1cc(Br)ccc1 Amb23512545 [0,1,0,0,0,0|3,0,0]=4 1002 B11R1.24 CCOCc1cc(Cl)ccc1 Amb24486866 [0,1,0,0,0,0|3,0,0]=4 1003 B11R1.24 CCOCc1cc(O)ccc1 Amb23443319 [0,1,0,0,0,0|3,0,0]=4 1004 B11R1.24 CCSCc1cc(Br)ccc1 Amb24476579 [0,1,0,0,0,0|3,0,0]=4 1005 B11R1.24 CCSCc1cc(O)ccc1 Amb18126555 [0,1,0,0,0,0|3,0,0]=4 1006 B11R1.24 CC\C=C\c1cccc(Br)c1 Amb25132907 [0,1,0,0,0,0|2,0,1]=4 1007 B11R1.24 CC\C=C\c1cccc(c1)O Amb16231489 [0,1,0,0,0,0|2,0,1]=4 1008 B11R1.24 CNCCc1cccc(I)c1 Amb25187651 [0,1,0,0,0,0|1,0,2]=4 1009 B11R1.24 CNCCc1cccc(N)c1 Amb18550411 [0,1,0,0,0,0|1,0,2]=4 1010 B11R1.24 CNCCc1cccc(O)c1 Amb18560894 [0,1,0,0,0,0|1,0,2]=4 1011 B11R1.24 CNCCc1cccc(c1)Br Amb16230486 [0,1,0,0,0,0|1,0,2]=4 1012 B11R1.24 CNCCc1cccc(c1)C Amb16230487 [0,1,0,0,0,0|1,0,2]=4 1013 B11R1.24 CNNCc1cccc(Cl)c1 Amb22469834 [0,1,0,0,0,0|2,0,1]=4 1014 B11R1.24 COCCc1cccc(N)c1 Amb24373231 [0,1,0,0,0,0|2,0,1]=4 1015 B11R1.24 COCCc1cccc(O)c1 Amb22055706 [0,1,0,0,0,0|2,0,1]=4 1016 B11R1.24 CONCc1cccc(I)c1 Amb25719180 [0,1,0,0,0,0|3,0,0]=4 1017 B11R1.24 CO\C=C/c1cccc(F)c1 Amb25837369 [0,1,0,0,0,0|2,0,1]=4 1018 B11R1.24 CO\C=C\c1cccc(O)c1 Amb25373359 [0,1,0,0,0,0|2,0,1]=4 1019 B11R1.24 CSCCc1cccc(N)c1 Amb25364016 [0,1,0,0,0,0|2,0,1]=4 1020 B11R1.24 C\C=C\C[n+]1cc(O)ccc1 Amb25777709 [0,1,0,0,0,0|3,0,0]=4 1021 B11R1.24 Cc1c[n]cc(C\C=C\C)c1 Amb24062207 [0,1,0,0,0,0|3,0,0]=4 1022 B11R1.24 Cc1cc(CCON)ccc1 Amb25704227 [0,1,0,0,0,0|2,0,1]=4 1023 B11R1.24 Cc1cc(CNC#N)ccc1 Amb25782843 [0,1,0,0,0,0|3,0,0]=4 1024 B11R1.24 Cc1cc(COCCl)ccc1 Amb24443129 [0,1,0,0,0,0|3,0,0]=4 1025 B11R1.24 Cc1cc(CSCCl)ccc1 Amb25732759 [0,1,0,0,0,0|3,0,0]=4 1026 B11R1.24 Cc1cc(N\C=N\O)[n]cc1 Amb25061332 [0,1,0,0,0,0|2,0,0]=3 1027 B11R1.24 Cc1cc(\C=C\C=C)ccc1 Amb24604764 [0,1,0,0,0,0|2,0,1]=4 1028 B11R1.24 Cc1cc(\C=C\CBr)ccc1 Amb25068031 [0,1,0,0,0,0|2,0,1]=4 1029 B11R1.24 Cc1cc(\C=C\CN)ccc1 Amb18065182 [0,1,0,0,0,0|2,0,1]=4 1030 B11R1.24 Cc1cc(\C=C\CO)ccc1 Amb23442940 [0,1,0,0,0,0|1,0,1]=3 1031 B11R1.24 Cc1cccc(CCCC)c1 Amb22730119 [0,1,0,0,0,0|2,0,1]=4 1032 B11R1.24 Cc1cccc(CNOC)c1 Amb25362893 [0,1,0,0,0,0|3,0,0]=4 1033 B11R1.24 Cc1cccc(CSCC)c1 Amb25838308 [0,1,0,0,0,0|3,0,0]=4 1034 B11R1.24 Cc1cccc(N\C=N\O)[n]1 Amb25858091 [0,1,0,0,0,0|2,0,0]=3 1035 B11R1.24 ClCCCc1cccc(I)c1 Amb25239109 [0,1,0,0,0,0|2,0,1]=4 1036 B11R1.24 ClCCCc1cccc(c1)Br Amb17104548 [0,1,0,0,0,0|2,0,1]=4 1037 B11R1.24 ClCCCc1cccc(c1)C Amb17104526 [0,1,0,0,0,0|2,0,1]=4 1038 B11R1.24 ClCCCc1cccc(c1)Cl Amb17104534 [0,1,0,0,0,0|2,0,1]=4 1039 B11R1.24 ClCCCc1cccc(c1)N Amb17477709 [0,1,0,0,0,0|2,0,1]=4 1040 B11R1.24 ClCCCc1cccc(c1)O Amb17477723 [0,1,0,0,0,0|2,0,1]=4 1041 B11R1.24 ClC\C=C\c1cccc(Br)c1 Amb25149089 [0,1,0,0,0,0|2,0,1]=4 1042 B11R1.24 Clc1cc(\C=C\CBr)ccc1 Amb25117084 [0,1,0,0,0,0|2,0,1]=4 1043 B11R1.24 Clc1cccc(c1)\C=C\CCl Amb25858073 [0,1,0,0,0,0|2,0,1]=4 1044 B11R1.24 Fc1cc(CCCBr)ccc1 Amb22886712 [0,1,0,0,0,0|2,0,1]=4 1045 B11R1.24 Fc1cc(CCCCl)ccc1 Amb18803316 [0,1,0,0,0,0|2,0,1]=4 1046 B11R1.24 Fc1cc(CCCS)ccc1 Amb18065480 [0,1,0,0,0,0|1,1,1]=4 1047 B11R1.24 Fc1cc(CC[Zn]Br)ccc1 Amb22000496 [0,1,0,0,0,0|2,0,1]=4 1048 B11R1.24 Fc1cc(\C=C\CCl)ccc1 Amb25103585 [0,1,0,0,0,0|2,0,1]=4 1049 B11R1.24 N#CCCc1cccc(I)c1 Amb25312666 [0,1,0,0,0,0|2,0,1]=4 1050 B11R1.24 N#CCCc1cccc(c1)C Amb17204296 [0,1,0,0,0,0|2,0,1]=4 1051 B11R1.24 N#CCCc1cccc(c1)Cl Amb17204310 [0,1,0,0,0,0|2,0,1]=4 1052 B11R1.24 N#CCCc1cccc(c1)F Amb10841716 [0,1,0,0,0,0|2,0,1]=4 1053 B11R1.24 N#CNCc1cccc(Cl)c1 Amb18183546 [0,1,0,0,0,0|3,0,0]=4 1054 B11R1.24 N#CNCc1cccc(F)c1 Amb18799358 [0,1,0,0,0,0|3,0,0]=4 1055 B11R1.24 N#CSCc1cccc(Br)c1 Amb21959351 [0,1,0,0,0,0|3,0,0]=4 1056 B11R1.24 N#CSCc1cccc(Cl)c1 Amb19889457 [0,1,0,0,0,0|3,0,0]=4 1057 B11R1.24 N#CSCc1cccc(c1)F Amb10789220 [0,1,0,0,0,0|3,0,0]=4 1058 B11R1.24 N#C\C=C\c1cccc(I)c1 Amb24636500 [0,1,0,0,0,0|2,0,1]=4 1059 B11R1.24 N#C\C=C\c1cccc(O)c1 Amb25142718 [0,1,0,0,0,0|2,0,1]=4 1060 B11R1.24 N#C\C=C\c1cccc(c1)Br Amb17239682 [0,1,0,0,0,0|2,0,1]=4 1061 B11R1.24 N#C\C=C\c1cccc(c1)C Amb17231963 [0,1,0,0,0,0|2,0,1]=4 1062 B11R1.24 N#C\C=C\c1cccc(c1)Cl Amb17232458 [0,1,0,0,0,0|2,0,1]=4 1063 B11R1.24 N#C\C=C\c1cccc(c1)F Amb17232026 [0,1,0,0,0,0|2,0,1]=4 1064 B11R1.24 NCCCc1cccc(Br)c1 Amb19373503 [0,1,0,0,0,0|2,0,1]=4 1065 B11R1.24 NCCCc1cccc(c1)Cl Amb13951536 [0,1,0,0,0,0|2,0,1]=4 1066 B11R1.24 NCCCc1cccc(c1)F Amb13949159 [0,1,0,0,0,0|2,0,1]=4 1067 B11R1.24 NCCCc1cccc(c1)N Amb17477694 [0,1,0,0,0,0|2,0,1]=4 1068 B11R1.24 NCCCc1cccc(c1)O Amb17101314 [0,1,0,0,0,0|2,0,1]=4 1069 B11R1.24 NC\C=C\c1cccc(Br)c1 Amb18066633 [0,1,0,0,0,0|2,0,1]=4 1070 B11R1.24 NC\C=C\c1cccc(Cl)c1 Amb18065474 [0,1,0,0,0,0|2,0,1]=4 1071 B11R1.24 NC\C=C\c1cccc(F)c1 Amb18065349 [0,1,0,0,0,0|2,0,1]=4 1072 B11R1.24 NNCCc1cccc(Cl)c1 Amb24064170 [0,1,0,0,0,0|1,0,2]=4 1073 B11R1.24 NNCCc1cccc(c1)Br Amb17404394 [0,1,0,0,0,0|1,0,2]=4 1074 B11R1.24 NNCCc1cccc(c1)C Amb17399915 [0,1,0,0,0,0|1,0,2]=4 1075 B11R1.24 NNCCc1cccc(c1)Cl Amb17400340 [0,1,0,0,0,0|1,0,2]=4 1076 B11R1.24 NOCCc1cccc(Cl)c1 Amb25152729 [0,1,0,0,0,0|2,0,1]=4 1077 B11R1.24 NOCCc1cccc(F)c1 Amb22896630 [0,1,0,0,0,0|2,0,1]=4 1078 B11R1.24 Nc1cc(CCC=O)ccc1 Amb24486988 [0,1,0,0,0,0|1,0,2]=4 1079 B11R1.24 Nc1cc(CNC#N)ccc1 Amb25148290 [0,1,0,0,0,0|3,0,0]=4 1080 B11R1.24 Nc1cc(\C=C\CO)ccc1 Amb24462850 [0,1,0,0,0,0|1,0,1]=3 1081 B11R1.24 Nc1cc(ccc1)C#CCO Amb22228962 [0,1,0,0,0,0|1,0,2]=4 1082 B11R1.24 Nc1cc(ccc1)SCCO Amb18289366 [0,1,0,0,0,0|2,0,1]=4 1083 B11R1.24 O=C=NCc1cccc(c1)Br Amb17090280 [0,1,0,0,0,0|2,0,1]=4 1084 B11R1.24 O=C=NCc1cccc(c1)Cl Amb17090264 [0,1,0,0,0,0|2,0,1]=4 1085 B11R1.24 O=C=NCc1cccc(c1)O Amb17090279 [0,1,0,0,0,0|2,0,1]=4 1086 B11R1.24 O=CCCc1cccc(I)c1 Amb24637998 [0,1,0,0,0,0|1,0,2]=4 1087 B11R1.24 O=CCCc1cccc(S)c1 Amb24615973 [0,1,0,0,0,0|1,0,2]=4 1088 B11R1.24 O=CCCc1cccc(c1)Br Amb17081695 [0,1,0,0,0,0|1,0,2]=4 1089 B11R1.24 O=CCCc1cccc(c1)O Amb17081694 [0,1,0,0,0,0|1,0,2]=4 1090 B11R1.24 O=CNCc1cccc(Cl)c1 Amb24544518 [0,1,0,0,0,0|2,0,1]=4 1091 B11R1.24 O=CNCc1cccc(F)c1 Amb19958743 [0,1,0,0,0,0|2,0,1]=4 1092 B11R1.24 O=C\C=C\c1cccc(c1)Br Amb17240826 [0,1,0,0,0,0|1,0,2]=4 1093 B11R1.24 O=C\C=C\c1cccc(c1)C Amb17232008 [0,1,0,0,0,0|1,0,2]=4 1094 B11R1.24 O=C\C=C\c1cccc(c1)Cl Amb16193215 [0,1,0,0,0,0|1,0,2]=4 1095 B11R1.24 O=C\C=C\c1cccc(c1)F Amb17232063 [0,1,0,0,0,0|1,0,2]=4 1096 B11R1.24 O=C\C=C\c1cccc(c1)O Amb17334281 [0,1,0,0,0,0|1,0,2]=4 1097 B11R1.24 OCC#Cc1cc(I)ccc1 Amb25742450 [0,1,0,0,0,0|1,0,2]=4 1098 B11R1.24 OCCCc1cc[n]c(Br)c1 Amb24763525 [0,1,0,0,0,0|2,0,1]=4 1099 B11R1.24 OCCCc1cccc(F)[n]1 Amb24546387 [0,1,0,0,0,0|2,0,1]=4 1100 B11R1.24 OCCCc1cccc(I)c1 Amb25075756 [0,1,0,0,0,0|1,0,1]=3 1101 B11R1.24 OCCCc1cccc(c1)Br Amb17089515 [0,1,0,0,0,0|1,0,1]=3 1102 B11R1.24 OCCCc1cccc(c1)C Amb17089495 [0,1,0,0,0,0|1,0,1]=3 1103 B11R1.24 OCCCc1cccc(c1)Cl Amb17089500 [0,1,0,0,0,0|1,0,1]=3 1104 B11R1.24 OCCCc1cccc(c1)F Amb17605781 [0,1,0,0,0,0|1,0,1]=3 1105 B11R1.24 OCCCc1cccc(c1)N Amb17477701 [0,1,0,0,0,0|1,0,1]=3 1106 B11R1.24 OCCCc1cccc(c1)O Amb17089514 [0,1,0,0,0,0|1,0,1]=3 1107 B11R1.24 OCCOc1cccc(c1)C Amb2209346 [0,1,0,0,0,0|2,0,1]=4 1108 B11R1.24 OCCSc1cc(Br)ccc1 Amb21861665 [0,1,0,0,0,0|2,0,1]=4 1109 B11R1.24 OC\C=C\c1c[n]cc(Br)c1 Amb25065053 [0,1,0,0,0,0|2,0,1]=4 1110 B11R1.24 OC\C=C\c1cccc(Br)[n]1 Amb20248560 [0,1,0,0,0,0|2,0,1]=4 1111 B11R1.24 OC\C=C\c1cccc(Br)c1 Amb19516160 [0,1,0,0,0,0|1,0,1]=3 1112 B11R1.24 OC\C=C\c1cccc(Cl)c1 Amb23442783 [0,1,0,0,0,0|1,0,1]=3 1113 B11R1.24 OC\C=C\c1cccc(F)c1 Amb23442888 [0,1,0,0,0,0|1,0,1]=3 1114 B11R1.24 O\N=C\Nc1c[n]cc(Cl)[n]1 Amb24664367 [0,1,0,0,0,0|3,0,0]=4 1115 B11R1.24 Oc1cc(CCCBr)ccc1 Amb18657769 [0,1,0,0,0,0|2,0,1]=4 1116 B11R1.24 Oc1cc(CNC=O)ccc1 Amb18179387 [0,1,0,0,0,0|2,0,1]=4 1117 B11R1.24 Oc1cc(ccc1)C#CCO Amb24085233 [0,1,0,0,0,0|1,0,2]=4 1118 B11R1.24 Oc1cccc(c1)\C=C\CO Amb18125120 [0,1,0,0,0,0|1,0,1]=3 1119 B11R1.24 SCCCc1cccc(c1)Br Amb17407561 [0,1,0,0,0,0|1,1,1]=4 1120 B11R1.24 SCCCc1cccc(c1)C Amb17400219 [0,1,0,0,0,0|1,1,1]=4 1121 B11R1.24 SCCCc1cccc(c1)Cl Amb17401096 [0,1,0,0,0,0|1,1,1]=4 1122 B11R1.24 [N-]=[N+]=NCc1cccc(O)c1 Amb24447426 [0,1,0,0,0,0|2,0,1]=4 1123 B11R1.28 BrCC=C=Cc1ccccc1 Amb24624052 [0,1,0,0,0,0|2,0,1]=4 1124 B11R1.28 BrCCCOc1ccccc1 Amb1154134 [0,1,0,0,0,0|2,0,1]=4 1125 B11R1.28 BrCCNCc1ccccc1 Amb18131678 [0,1,0,0,0,0|2,0,1]=4 1126 B11R1.28 BrCC\C=C\c1ccccc1 Amb17140564 [0,1,0,0,0,0|2,0,1]=4 1127 B11R1.28 BrC\C=C\Cc1ccccc1 Amb25039914 [0,1,0,0,0,0|2,0,0]=3 1128 B11R1.28 Br[Zn]CCCc1ccccc1 Amb22000503 [0,1,0,0,0,0|2,0,1]=4 1129 B11R1.28 Br\C=C/CNc1ccccc1 Amb25063133 [0,1,0,0,0,0|2,0,0]=3 1130 B11R1.28 C#CCCCc1ccccc1 Amb10071067 [0,1,0,0,0,0|2,0,1]=4 1131 B11R1.28 C#CCCNc1ccccc1 Amb25063678 [0,1,0,0,0,0|2,0,1]=4 1132 B11R1.28 C#CCCSc1ccccc1 Amb24477610 [0,1,0,0,0,0|2,0,1]=4 1133 B11R1.28 C#CCNCc1ccccc1 Amb21972217 [0,1,0,0,0,0|2,0,1]=4 1134 B11R1.28 C#CCSCc1ccccc1 Amb18800670 [0,1,0,0,0,0|2,0,1]=4 1135 B11R1.28 C/C=C/C=C/c1ccccc1 Amb17939507 [0,1,0,0,0,0|2,0,1]=4 1136 B11R1.28 C/C=C/CCc1ccccc1 Amb17940149 [0,1,0,0,0,0|2,0,0]=3 1137 B11R1.28 C=C=CC#Cc1ccccc1 Amb24085507 [0,1,0,0,0,0|2,0,1]=4 1138 B11R1.28 C=CCCCc1ccccc1 Amb24062985 [0,1,0,0,0,0|2,0,1]=4 1139 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [0,1,0,0,0,0|2,0,1]=4 1140 B11R1.28 C=CCSCc1ccccc1 Amb17799426 [0,1,0,0,0,0|2,0,1]=4 1141 B11R1.28 C=CC\C=N\c1ccccc1 Amb10574759 [0,1,0,0,0,0|3,0,0]=4 1142 B11R1.28 C=C\C=N\Nc1ccccc1 Amb24649776 [0,1,0,0,0,0|3,0,0]=4 1143 B11R1.28 C=NCCNc1ccccc1 Amb24486057 [0,1,0,0,0,0|1,0,1]=3 1144 B11R1.28 CC#CCNc1ccccc1 Amb21953777 [0,1,0,0,0,0|2,0,1]=4 1145 B11R1.28 CC#CCOc1ccccc1 Amb25119404 [0,1,0,0,0,0|2,0,1]=4 1146 B11R1.28 CC=CCCc1cccc[n]1 Amb24100575 [0,1,0,0,0,0|3,0,0]=4 1147 B11R1.28 CC=CCCc1ccccc1 Amb24062987 [0,1,0,0,0,0|2,0,0]=3 1148 B11R1.28 CCCNCc1ccccc1 Amb1105937 [0,1,0,0,0,0|2,0,1]=4 1149 B11R1.28 CCC\C=N\c1ccccc1 Amb16231172 [0,1,0,0,0,0|3,0,0]=4 1150 B11R1.28 CCNCCc1ccccc1 Amb2119468 [0,1,0,0,0,0|1,0,2]=4 1151 B11R1.28 CCOCNc1ccccc1 Amb25856976 [0,1,0,0,0,0|3,0,0]=4 1152 B11R1.28 CCOCSc1ccccc1 Amb24762591 [0,1,0,0,0,0|3,0,0]=4 1153 B11R1.28 CCONCc1ccccc1 Amb25151184 [0,1,0,0,0,0|3,0,0]=4 1154 B11R1.28 CCSCSc1ccccc1 Amb25380606 [0,1,0,0,0,0|3,0,0]=4 1155 B11R1.28 CC\C=C/Cc1cc[n]cc1 Amb24103208 [0,1,0,0,0,0|3,0,0]=4 1156 B11R1.28 CC\N=C\Nc1ccccc1 Amb24384245 [0,1,0,0,0,0|2,0,0]=3 1157 B11R1.28 CNCCCc1ccccc1 Amb21954280 [0,1,0,0,0,0|1,0,2]=4 1158 B11R1.28 CNCCOc1ccccc1 Amb1105525 [0,1,0,0,0,0|1,0,2]=4 1159 B11R1.28 CNCCSc1ccccc1 Amb10608735 [0,1,0,0,0,0|1,0,2]=4 1160 B11R1.28 CNCCSc1ccccc1 Amb17622507 [0,1,0,0,0,0|1,0,2]=4 1161 B11R1.28 CNC\C=C\c1ccccc1 Amb2114273 [0,1,0,0,0,0|1,0,2]=4 1162 B11R1.28 COCC#Cc1ccccc1 Amb25308232 [0,1,0,0,0,0|1,0,2]=4 1163 B11R1.28 COCCCc1c[n]ccc1 Amb25382996 [0,1,0,0,0,0|2,0,1]=4 1164 B11R1.28 COCCCc1cccc[n]1 Amb25383067 [0,1,0,0,0,0|2,0,1]=4 1165 B11R1.28 COCNCc1ccccc1 Amb25053350 [0,1,0,0,0,0|2,0,0]=3 1166 B11R1.28 COC\C=C\c1cccc[n]1 Amb24101883 [0,1,0,0,0,0|2,0,1]=4 1167 B11R1.28 CONCCc1cccc[n]1 Amb24763045 [0,1,0,0,0,0|1,0,2]=4 1168 B11R1.28 CONCCc1ccccc1 Amb22897018 [0,1,0,0,0,0|0,0,2]=3 1169 B11R1.28 CONCOc1ccccc1 Amb24096695 [0,1,0,0,0,0|1,0,2]=4 1170 B11R1.28 CO\C=C/Oc1ccccc1 Amb24069136 [0,1,0,0,0,0|2,0,0]=3 1171 B11R1.28 CO\C=C\Oc1ccccc1 Amb24069134 [0,1,0,0,0,0|2,0,0]=3 1172 B11R1.28 CSCCCc1ccccc1 Amb25383748 [0,1,0,0,0,0|1,1,1]=4 1173 B11R1.28 CSCCNc1ccccc1 Amb17307504 [0,1,0,0,0,0|2,0,1]=4 1174 B11R1.28 CSCSCc1ccccc1 Amb25380610 [0,1,0,0,0,0|2,0,1]=4 1175 B11R1.28 C\C=C\CCc1cc[n]cc1 Amb25830692 [0,1,0,0,0,0|3,0,0]=4 1176 B11R1.28 C\C=C\CNc1c[n]ccc1 Amb25228933 [0,1,0,0,0,0|3,0,0]=4 1177 B11R1.28 C\C=C\COc1c[n]ccc1 Amb25151771 [0,1,0,0,0,0|3,0,0]=4 1178 B11R1.28 C\C=C\COc1cccc[n]1 Amb24101955 [0,1,0,0,0,0|3,0,0]=4 1179 B11R1.28 C\C=N\OCc1ccccc1 Amb24334870 [0,1,0,0,0,0|2,0,0]=3 1180 B11R1.28 ClCC#CCc1ccccc1 Amb24453719 [0,1,0,0,0,0|2,0,1]=4 1181 B11R1.28 ClCCCOc1ccccc1 Amb1128627 [0,1,0,0,0,0|2,0,1]=4 1182 B11R1.28 ClCCCSc1ccccc1 Amb1132759 [0,1,0,0,0,0|2,0,1]=4 1183 B11R1.28 ClCC\C=C\c1ccccc1 Amb17232628 [0,1,0,0,0,0|2,0,1]=4 1184 B11R1.28 ClC\C=C\Cc1ccccc1 Amb24462747 [0,1,0,0,0,0|2,0,0]=3 1185 B11R1.28 ClC\C=C\Oc1ccccc1 Amb24548862 [0,1,0,0,0,0|2,0,1]=4 1186 B11R1.28 Cl[Mg]CCCc1ccccc1 Amb19928784 [0,1,0,0,0,0|2,0,1]=4 1187 B11R1.28 Cl[Zn]C\C=C\c1ccccc1 Amb22897734 [0,1,0,0,0,0|2,0,1]=4 1188 B11R1.28 Cl\C=C/CNc1ccccc1 Amb25241241 [0,1,0,0,0,0|2,0,0]=3 1189 B11R1.28 Cl\C=C\CNc1ccccc1 Amb25148081 [0,1,0,0,0,0|2,0,0]=3 1190 B11R1.28 Cl\C=C\COc1c[n]ccc1 Amb25733978 [0,1,0,0,0,0|3,0,0]=4 1191 B11R1.28 FCCCOc1ccccc1 Amb22008296 [0,1,0,0,0,0|2,0,1]=4 1192 B11R1.28 FCCCSc1ccccc1 Amb25382654 [0,1,0,0,0,0|2,0,1]=4 1193 B11R1.28 FCCNCc1ccccc1 Amb24611358 [0,1,0,0,0,0|2,0,1]=4 1194 B11R1.28 ICCCCc1ccccc1 Amb25380384 [0,1,0,0,0,0|2,0,1]=4 1195 B11R1.28 ICCNCc1ccccc1 Amb25188796 [0,1,0,0,0,0|2,0,1]=4 1196 B11R1.28 ICCOCc1ccccc1 Amb16191915 [0,1,0,0,0,0|2,0,1]=4 1197 B11R1.28 N#CCCNc1ccccc1 Amb1645915 [0,1,0,0,0,0|2,0,1]=4 1198 B11R1.28 N#CCCOc1ccccc1 Amb1202508 [0,1,0,0,0,0|2,0,1]=4 1199 B11R1.28 N#CCNCc1ccccc1 Amb22491357 [0,1,0,0,0,0|2,0,1]=4 1200 B11R1.28 N#CC[NH2+]Cc1ccccc1 Amb24113886 [0,1,0,0,0,0|2,0,1]=4 1201 B11R1.28 N#CN\C=N\c1ccccc1 Amb22001821 [0,1,0,0,0,0|2,0,1]=4 1202 B11R1.28 N#C\C=C\Nc1ccccc1 Amb18124676 [0,1,0,0,0,0|2,0,1]=4 1203 B11R1.28 N#C\C=N\Nc1ccccc1 Amb24504734 [0,1,0,0,0,0|3,0,0]=4 1204 B11R1.28 N#C\N=C\Nc1cc[n]cc1 Amb24533224 [0,1,0,0,0,0|3,0,0]=4 1205 B11R1.28 N=N=NCSc1ccccc1 Amb22360722 [0,1,0,0,0,0|2,0,1]=4 1206 B11R1.28 NCC#CCc1ccccc1 Amb25104593 [0,1,0,0,0,0|2,0,1]=4 1207 B11R1.28 NCCCCc1ccccc1 Amb1227740 [0,1,0,0,0,0|2,0,1]=4 1208 B11R1.28 NCCCCc1ccccc1 Amb19929939 [0,1,0,0,0,0|2,0,1]=4 1209 B11R1.28 NCCCNc1ccccc1 Amb10086594 [0,1,0,0,0,0|2,0,1]=4 1210 B11R1.28 NCCCOc1ccccc1 Amb1108619 [0,1,0,0,0,0|2,0,1]=4 1211 B11R1.28 NCCCSc1ccccc1 Amb1089343 [0,1,0,0,0,0|2,0,1]=4 1212 B11R1.28 NCCCSc1ccccc1 Amb2099802 [0,1,0,0,0,0|2,0,1]=4 1213 B11R1.28 NCCOCc1ccccc1 Amb1081962 [0,1,0,0,0,0|2,0,1]=4 1214 B11R1.28 NCCOCc1ccccc1 Amb2137059 [0,1,0,0,0,0|2,0,1]=4 1215 B11R1.28 NCC\C=C\c1ccccc1 Amb17138419 [0,1,0,0,0,0|2,0,1]=4 1216 B11R1.28 NCNCCc1ccccc1 Amb25385258 [0,1,0,0,0,0|1,0,2]=4 1217 B11R1.28 NC\C=C\Cc1ccccc1 Amb24351087 [0,1,0,0,0,0|2,0,0]=3 1218 B11R1.28 NNCCCc1ccccc1 Amb19373221 [0,1,0,0,0,0|1,0,2]=4 1219 B11R1.28 NNCCSc1ccccc1 Amb18126564 [0,1,0,0,0,0|1,0,2]=4 1220 B11R1.28 NNC\C=C\c1ccccc1 Amb24563952 [0,1,0,0,0,0|1,0,2]=4 1221 B11R1.28 NNNCNc1ccccc1 Amb25251558 [0,1,0,0,0,0|2,0,1]=4 1222 B11R1.28 NOCCCc1ccccc1 Amb22231356 [0,1,0,0,0,0|1,0,1]=3 1223 B11R1.28 NOCCCc1ccccn1 Amb17089546 [0,1,0,0,0,0|2,0,1]=4 1224 B11R1.28 NOCCCc1cccnc1 Amb17089547 [0,1,0,0,0,0|2,0,1]=4 1225 B11R1.28 NOCCCc1ccncc1 Amb17089548 [0,1,0,0,0,0|2,0,1]=4 1226 B11R1.28 NOCCNc1ccccc1 Amb24486573 [0,1,0,0,0,0|2,0,1]=4 1227 B11R1.28 NOCCOc1ccccc1 Amb17088287 [0,1,0,0,0,0|2,0,1]=4 1228 B11R1.28 NOCCOc1ccccc1 Amb19894640 [0,1,0,0,0,0|2,0,1]=4 1229 B11R1.28 NOCOCc1ccccc1 Amb10606697 [0,1,0,0,0,0|2,0,0]=3 1230 B11R1.28 NOC\C=C\c1c[n]ccc1 Amb24085612 [0,1,0,0,0,0|2,0,1]=4 1231 B11R1.28 NOC\C=C\c1ccccc1 Amb18124997 [0,1,0,0,0,0|1,0,1]=3 1232 B11R1.28 N\C=C\C=Cc1ccccc1 Amb24628941 [0,1,0,0,0,0|2,0,1]=4 1233 B11R1.28 N\C=C\C=Nc1ccccc1 Amb24697696 [0,1,0,0,0,0|2,0,1]=4 1234 B11R1.28 N\C=N\N=Cc1ccccc1 Amb24655535 [0,1,0,0,0,0|2,0,1]=4 1235 B11R1.28 O=C=C=CNc1ccccc1 Amb24434760 [0,1,0,0,0,0|2,0,1]=4 1236 B11R1.28 O=C=NCCc1cc[n]cc1 Amb24477613 [0,1,0,0,0,0|1,0,2]=4 1237 B11R1.28 O=C=NCCc1cccc[n]1 Amb24390560 [0,1,0,0,0,0|1,0,2]=4 1238 B11R1.28 O=C=NCCc1ccccc1 Amb2092802 [0,1,0,0,0,0|0,0,2]=3 1239 B11R1.28 O=C=NCCc1cccnc1 Amb17232038 [0,1,0,0,0,0|1,0,2]=4 1240 B11R1.28 O=C=NCOc1ccccc1 Amb20668487 [0,1,0,0,0,0|1,0,2]=4 1241 B11R1.28 O=C=N\C=C\c1ccccc1 Amb23441382 [0,1,0,0,0,0|0,0,2]=3 1242 B11R1.28 O=CC#CCc1ccccc1 Amb25189233 [0,1,0,0,0,0|1,0,2]=4 1243 B11R1.28 O=CC=C=Cc1ccccc1 Amb24435266 [0,1,0,0,0,0|1,0,2]=4 1244 B11R1.28 O=CC=NNc1ccccc1 Amb24060829 [0,1,0,0,0,0|2,0,1]=4 1245 B11R1.28 O=CCCSc1ccccc1 Amb17082943 [0,1,0,0,0,0|1,0,2]=4 1246 B11R1.28 O=CCNCc1ccccc1 Amb19886524 [0,1,0,0,0,0|1,0,2]=4 1247 B11R1.28 O=CCSCc1ccccc1 Amb18801121 [0,1,0,0,0,0|1,0,2]=4 1248 B11R1.28 O=CC\C=C\c1ccccc1 Amb18644267 [0,1,0,0,0,0|1,0,2]=4 1249 B11R1.28 O=CNCCc1ccccc1 Amb10559023 [0,1,0,0,0,0|0,0,3]=4 1250 B11R1.28 O=CNCSc1ccccc1 Amb24382608 [0,1,0,0,0,0|2,0,1]=4 1251 B11R1.28 O=CN\C=C\c1ccccc1 Amb25327993 [0,1,0,0,0,0|0,0,3]=4 1252 B11R1.28 O=C\C=C/Sc1ccccc1 Amb25827121 [0,1,0,0,0,0|1,0,2]=4 1253 B11R1.28 O=C\C=C\Cc1ccccc1 Amb18124787 [0,1,0,0,0,0|1,0,1]=3 1254 B11R1.28 O=C\C=C\Nc1ccccc1 Amb18124821 [0,1,0,0,0,0|1,0,2]=4 1255 B11R1.28 O=C\C=C\Oc1ccccc1 Amb24585165 [0,1,0,0,0,0|1,0,2]=4 1256 B11R1.28 O=C\C=C\Sc1ccccc1 Amb10563475 [0,1,0,0,0,0|1,0,2]=4 1257 B11R1.28 O=C\C=N/Nc1ccccc1 Amb24638012 [0,1,0,0,0,0|2,0,1]=4 1258 B11R1.28 O=C\C=N\Nc1ccccc1 Amb2417721 [0,1,0,0,0,0|2,0,1]=4 1259 B11R1.28 OCC#CCc1c[n]ccc1 Amb24651956 [0,1,0,0,0,0|2,0,1]=4 1260 B11R1.28 OCC#CCc1cc[n]cc1 Amb25771948 [0,1,0,0,0,0|2,0,1]=4 1261 B11R1.28 OCC#COc1ccccc1 Amb25058509 [0,1,0,0,0,0|1,0,2]=4 1262 B11R1.28 OCC=C=Cc1ccccc1 Amb24398063 [0,1,0,0,0,0|1,0,1]=3 1263 B11R1.28 OCCCCc1c[n]ccc1 Amb22732495 [0,1,0,0,0,0|2,0,1]=4 1264 B11R1.28 OCCCCc1cccc[n]1 Amb21520414 [0,1,0,0,0,0|2,0,1]=4 1265 B11R1.28 OCCCCc1ccncc1 Amb17740015 [0,1,0,0,0,0|2,0,1]=4 1266 B11R1.28 OCCCNc1c[n]ccc1 Amb18267758 [0,1,0,0,0,0|2,0,1]=4 1267 B11R1.28 OCCCNc1ccccc1 Amb17307125 [0,1,0,0,0,0|1,0,1]=3 1268 B11R1.28 OCCCNc1ccccc1 Amb17772314 [0,1,0,0,0,0|1,0,1]=3 1269 B11R1.28 OCCCOc1cccc[n]1 Amb25383036 [0,1,0,0,0,0|2,0,1]=4 1270 B11R1.28 OCCN=Cc1ccccc1 Amb24065097 [0,1,0,0,0,0|1,0,2]=4 1271 B11R1.28 OCCNCc1cccc[n]1 Amb21955286 [0,1,0,0,0,0|2,0,1]=4 1272 B11R1.28 OCCNCc1ccccc1 Amb1835287 [0,1,0,0,0,0|1,0,1]=3 1273 B11R1.28 OCC\C=C\c1cc[n]cc1 Amb24666733 [0,1,0,0,0,0|2,0,1]=4 1274 B11R1.28 OCC\C=C\c1cccc[n]1 Amb25233577 [0,1,0,0,0,0|2,0,1]=4 1275 B11R1.28 OCC\C=C\c1ccccc1 Amb24756581 [0,1,0,0,0,0|1,0,1]=3 1276 B11R1.28 OCC\N=C\c1ccccc1 Amb20622247 [0,1,0,0,0,0|1,0,2]=4 1277 B11R1.28 OC\C=C\Cc1ccccc1 Amb25074433 [0,1,0,0,0,0|1,0,0]=2 1278 B11R1.28 OC\C=C\Nc1ccccc1 Amb25228349 [0,1,0,0,0,0|1,0,1]=3 1279 B11R1.28 OC\C=C\Oc1ccccc1 Amb25283274 [0,1,0,0,0,0|1,0,1]=3 1280 B11R1.28 OC\C=C\Sc1cccc[n]1 Amb24719685 [0,1,0,0,0,0|2,0,1]=4 1281 B11R1.28 OC\C=N\Nc1ccccc1 Amb25801902 [0,1,0,0,0,0|2,0,0]=3 1282 B11R1.28 ON=C\C=C\c1cc[n]c[n]1 Amb24518452 [0,1,0,0,0,0|2,0,1]=4 1283 B11R1.28 ONCCOc1ccccc1 Amb17088413 [0,1,0,0,0,0|0,0,2]=3 1284 B11R1.28 O\N=C/C=C/c1cc[n]c[n]1 Amb25707800 [0,1,0,0,0,0|2,0,1]=4 1285 B11R1.28 O\N=C\C=C/c1ccccc1 Amb24668019 [0,1,0,0,0,0|0,0,1]=2 1286 B11R1.28 O\N=C\C=Cc1c[n]ccc1 Amb24358914 [0,1,0,0,0,0|1,0,1]=3 1287 B11R1.28 O\N=C\C=Cc1cc[n]c[n]1 Amb24518376 [0,1,0,0,0,0|2,0,1]=4 1288 B11R1.28 O\N=C\C=Cc1cc[n]cc1 Amb25677492 [0,1,0,0,0,0|1,0,1]=3 1289 B11R1.28 O\N=C\CNc1ccccc1 Amb25211715 [0,1,0,0,0,0|0,0,0]=1 1290 B11R1.28 O\N=C\N=N\c1ccccc1 Amb2228038 [0,1,0,0,0,0|1,0,0]=2 1291 B11R1.28 S=C=NCCc1c[n]ccc1 Amb18035937 [0,1,0,0,0,0|1,1,1]=4 1292 B11R1.28 S=C=NCCc1cc[n]cc1 Amb18792582 [0,1,0,0,0,0|1,1,1]=4 1293 B11R1.28 SCCCCc1ccccc1 Amb17400224 [0,1,0,0,0,0|1,1,1]=4 1294 B11R1.28 SCC\C=C\c1ccccc1 Amb24390438 [0,1,0,0,0,0|1,1,1]=4 1295 B11R1.28 [N-]=[N+]=NCCc1cccc[n]1 Amb24476581 [0,1,0,0,0,0|2,0,1]=4 1296 B11R1.28 [N-]=[N+]=NCCc1ccccc1 Amb19149244 [0,1,0,0,0,0|1,0,1]=3 1297 B11R1.28 [N-]=[N+]=NCSc1ccccc1 Amb22735141 [0,1,0,0,0,0|2,0,1]=4 1298 B11R1.28 [NH3+]CCCCc1ccccc1 Amb22733934 [0,1,0,0,0,0|2,0,1]=4 1299 B11R1.28 [NH3+]OCCOc1ccccc1 Amb2420800 [0,1,0,0,0,0|2,0,1]=4 1300 B11R1.40 BrC(Cc1ccccc1)C#N Amb1154191 [0,1,0,0,0,0|2,0,1]=4 1301 B11R1.40 BrCC(=O)Cc1ccccc1 Amb17569850 [0,1,0,0,0,0|2,0,0]=3 1302 B11R1.40 BrCC(=O)Nc1ccccc1 Amb2222053 [0,1,0,0,0,0|3,0,0]=4 1303 B11R1.40 BrCC(Cc1ccccc1)O Amb17595843 [0,1,0,0,0,0|2,0,1]=4 1304 B11R1.40 C#CC(=O)Cc1cc[n]cc1 Amb25758182 [0,1,0,0,0,0|3,0,0]=4 1305 B11R1.40 C#CC(=O)Cc1ccc[n]c1 Amb25070158 [0,1,0,0,0,0|3,0,0]=4 1306 B11R1.40 C#CC(=O)Cc1ccccc1 Amb22059749 [0,1,0,0,0,0|2,0,0]=3 1307 B11R1.40 C#CC(=O)Nc1ccccc1 Amb2444736 [0,1,0,0,0,0|3,0,0]=4 1308 B11R1.40 C#CC(Cl)Cc1ccccc1 Amb24398624 [0,1,0,0,0,0|2,0,1]=4 1309 B11R1.40 C#CC(N)Cc1ccccc1 Amb24699229 [0,1,0,0,0,0|2,0,1]=4 1310 B11R1.40 C#C[C@@H](O)Cc1ccccc1 Amb25056589 [0,1,0,0,0,0|2,0,1]=4 1311 B11R1.40 C=C(C=C)Nc1ccccc1 Amb25131122 [0,1,0,0,0,0|3,0,0]=4 1312 B11R1.40 C=C(C=O)Oc1ccccc1 Amb18124880 [0,1,0,0,0,0|2,0,1]=4 1313 B11R1.40 C=C(C=O)Sc1ccccc1 Amb25347672 [0,1,0,0,0,0|2,0,1]=4 1314 B11R1.40 C=C(Cc1ccccc1)CCl Amb25185403 [0,1,0,0,0,0|2,0,0]=3 1315 B11R1.40 C=CC(=O)Cc1cccc[n]1 Amb24425169 [0,1,0,0,0,0|3,0,0]=4 1316 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [0,1,0,0,0,0|2,0,0]=3 1317 B11R1.40 C=CC(=O)Oc1ccccc1 Amb17934129 [0,1,0,0,0,0|3,0,0]=4 1318 B11R1.40 C=CC(N)Cc1ccccc1 Amb25064298 [0,1,0,0,0,0|2,0,1]=4 1319 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [0,1,0,0,0,0|2,0,1]=4 1320 B11R1.40 C=C[C@H](Cc1ccccc1)N Amb10982592 [0,1,0,0,0,0|2,0,1]=4 1321 B11R1.40 C=C[C@H](N)Cc1ccccc1 Amb19929662 [0,1,0,0,0,0|2,0,1]=4 1322 B11R1.40 CC(=NC)Oc1ccccc1 Amb24066830 [0,1,0,0,0,0|2,0,0]=3 1323 B11R1.40 CC(CBr)Cc1ccccc1 Amb25151397 [0,1,0,0,0,0|2,0,1]=4 1324 B11R1.40 CC(CN)Cc1ccccc1 Amb18010535 [0,1,0,0,0,0|2,0,1]=4 1325 B11R1.40 CC(CO)Cc1cc[n]cc1 Amb25374015 [0,1,0,0,0,0|2,0,1]=4 1326 B11R1.40 CC(CO)Nc1ccccc1 Amb18971804 [0,1,0,0,0,0|2,0,1]=4 1327 B11R1.40 CC(CO)Sc1ccccc1 Amb23449852 [0,1,0,0,0,0|2,0,1]=4 1328 B11R1.40 CC(Cc1ccccc1)=[N+]=[N-] Amb25173943 [0,1,0,0,0,0|1,0,1]=3 1329 B11R1.40 CC(Cc1ccccc1)C#N Amb24402121 [0,1,0,0,0,0|2,0,1]=4 1330 B11R1.40 CC(Cc1ccccc1)C=C Amb25850978 [0,1,0,0,0,0|2,0,1]=4 1331 B11R1.40 CC(Cc1ccccc1)NN Amb22487303 [0,1,0,0,0,0|1,0,2]=4 1332 B11R1.40 CC(Cc1ccccc1)[Mg]Br Amb22897350 [0,1,0,0,0,0|2,0,1]=4 1333 B11R1.40 CC(Cc1ccccc1)[Zn]Br Amb22897866 [0,1,0,0,0,0|2,0,1]=4 1334 B11R1.40 CCC(=O)Cc1cccnc1 Amb17477730 [0,1,0,0,0,0|3,0,0]=4 1335 B11R1.40 CCC(=O)Cc1ccncc1 Amb17477729 [0,1,0,0,0,0|3,0,0]=4 1336 B11R1.40 CCC(=S)Nc1ccccc1 Amb24757738 [0,1,0,0,0,0|3,0,0]=4 1337 B11R1.40 CCC(Br)Cc1ccccc1 Amb25189250 [0,1,0,0,0,0|2,0,1]=4 1338 B11R1.40 CCC(Cl)Cc1ccccc1 Amb18177890 [0,1,0,0,0,0|2,0,1]=4 1339 B11R1.40 CCN(Cc1ccccc1)C Amb10807414 [0,1,0,0,0,0|3,0,0]=4 1340 B11R1.40 CCN(Cc1ccccc1)N Amb17232076 [0,1,0,0,0,0|3,0,0]=4 1341 B11R1.40 CCS(=O)Cc1ccccc1 Amb24485048 [0,1,0,0,0,0|3,0,0]=4 1342 B11R1.40 CC[C@@H](Br)Cc1ccccc1 Amb25770013 [0,1,0,0,0,0|2,0,1]=4 1343 B11R1.40 CC[C@@H](Cl)Cc1ccccc1 Amb24710145 [0,1,0,0,0,0|2,0,1]=4 1344 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb22748727 [0,1,0,0,0,0|2,0,1]=4 1345 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb25141525 [0,1,0,0,0,0|2,0,1]=4 1346 B11R1.40 CC[C@@H](O)Cc1ccccc1 Amb19375372 [0,1,0,0,0,0|2,0,1]=4 1347 B11R1.40 CC[C@H](Cl)Cc1ccccc1 Amb25765719 [0,1,0,0,0,0|2,0,1]=4 1348 B11R1.40 CC[C@H](N)Cc1ccccc1 Amb19929690 [0,1,0,0,0,0|2,0,1]=4 1349 B11R1.40 CC\C(\I)=C/c1ccccc1 Amb22641702 [0,1,0,0,0,0|2,0,1]=4 1350 B11R1.40 CC\C(\N)=N\c1ccccc1 Amb24453266 [0,1,0,0,0,0|3,0,0]=4 1351 B11R1.40 CN(CCl)Cc1ccccc1 Amb25324443 [0,1,0,0,0,0|3,0,0]=4 1352 B11R1.40 CN(CO)Cc1ccccc1 Amb24555500 [0,1,0,0,0,0|2,0,0]=3 1353 B11R1.40 CN(Cc1cccc[n]1)N=O Amb24636522 [0,1,0,0,0,0|2,0,1]=4 1354 B11R1.40 CN(Cc1ccccc1)C#N Amb25072835 [0,1,0,0,0,0|3,0,0]=4 1355 B11R1.40 CN(Cc1ccccc1)C=S Amb25793091 [0,1,0,0,0,0|2,1,0]=4 1356 B11R1.40 CN(Cc1ccccc1)N=O Amb24074071 [0,1,0,0,0,0|1,0,1]=3 1357 B11R1.40 CNC(=N)Cc1cccc[n]1 Amb25261557 [0,1,0,0,0,0|2,0,1]=4 1358 B11R1.40 CNC(=O)C[n+]1ccccc1 Amb10553027 [0,1,0,0,0,0|2,0,1]=4 1359 B11R1.40 CNC(=O)Cc1cccnc1 Amb16231203 [0,1,0,0,0,0|2,0,1]=4 1360 B11R1.40 CNC(=O)Cc1ccncc1 Amb16231202 [0,1,0,0,0,0|2,0,1]=4 1361 B11R1.40 CNC(=S)Cc1ccccc1 Amb24559245 [0,1,0,0,0,0|1,0,1]=3 1362 B11R1.40 CNC(Cc1ccccc1)C Amb17616872 [0,1,0,0,0,0|1,0,2]=4 1363 B11R1.40 CN[C@H](Cc1ccccc1)C Amb17616868 [0,1,0,0,0,0|1,0,2]=4 1364 B11R1.40 CN\C(\Cl)=N\c1ccccc1 Amb24670343 [0,1,0,0,0,0|2,0,1]=4 1365 B11R1.40 COC(=N)Cc1cc[n]cc1 Amb18182737 [0,1,0,0,0,0|3,0,0]=4 1366 B11R1.40 COC(=N)Cc1ccc[n]c1 Amb18799364 [0,1,0,0,0,0|3,0,0]=4 1367 B11R1.40 COC(=N)Cc1cccc[n]1 Amb18179377 [0,1,0,0,0,0|3,0,0]=4 1368 B11R1.40 COC(=N)Cc1ccccc1 Amb17673180 [0,1,0,0,0,0|2,0,0]=3 1369 B11R1.40 COC(=N)Cc1ccccc1 Amb22366095 [0,1,0,0,0,0|2,0,0]=3 1370 B11R1.40 COC(=N)Nc1ccccc1 Amb24509579 [0,1,0,0,0,0|3,0,0]=4 1371 B11R1.40 COC(=O)Cc1cc[n]cc1 Amb20240688 [0,1,0,0,0,0|3,0,0]=4 1372 B11R1.40 COC(=O)Cc1ccc[n]c1 Amb22497118 [0,1,0,0,0,0|3,0,0]=4 1373 B11R1.40 COC(=O)Cc1ccccn1 Amb1223230 [0,1,0,0,0,0|3,0,0]=4 1374 B11R1.40 COC(=O)Nc1ccccc1 Amb1200636 [0,1,0,0,0,0|3,0,0]=4 1375 B11R1.40 COC(=O)Oc1ccccc1 Amb10807421 [0,1,0,0,0,0|3,0,0]=4 1376 B11R1.40 COC(Cl)Cc1ccccc1 Amb24711453 [0,1,0,0,0,0|2,0,1]=4 1377 B11R1.40 COC(O)Cc1ccccc1 Amb24659514 [0,1,0,0,0,0|2,0,1]=4 1378 B11R1.40 CO[SiH](C)Cc1ccccc1 Amb19893555 [0,1,0,0,0,0|2,1,0]=4 1379 B11R1.40 CO\C(=N/c1ccccc1)\[O-] Amb16224823 [0,1,0,0,0,0|3,0,0]=4 1380 B11R1.40 CSC(=N)Cc1ccccc1 Amb25211803 [0,1,0,0,0,0|2,0,0]=3 1381 B11R1.40 CSC(=O)Cc1ccccc1 Amb25293907 [0,1,0,0,0,0|2,0,0]=3 1382 B11R1.40 CSC(=S)C[N]1=CC=CC=C1 Amb17835327 [0,1,0,0,0,0|3,0,0]=4 1383 B11R1.40 CSC(=S)C[n+]1ccccc1 Amb2228085 [0,1,0,0,0,0|3,0,0]=4 1384 B11R1.40 C[C@@H](CN)Cc1ccccc1 Amb24615612 [0,1,0,0,0,0|2,0,1]=4 1385 B11R1.40 C[C@@H](CO)Sc1ccccc1 Amb25043604 [0,1,0,0,0,0|2,0,1]=4 1386 B11R1.40 C[C@H](CO)Cc1ccccc1 Amb25266388 [0,1,0,0,0,0|1,0,1]=3 1387 B11R1.40 C[C@H](Cc1ccccc1)C=O Amb25255421 [0,1,0,0,0,0|1,0,2]=4 1388 B11R1.40 C\C(=C/Cl)\Sc1ccccc1 Amb24694004 [0,1,0,0,0,0|3,0,0]=4 1389 B11R1.40 C\C(=C/c1ccccc1)\C#N Amb18644009 [0,1,0,0,0,0|2,0,1]=4 1390 B11R1.40 C\C(=C/c1ccccc1)\NC Amb25825428 [0,1,0,0,0,0|1,0,2]=4 1391 B11R1.40 C\C(=C\c1ccccc1)\C=O Amb22058732 [0,1,0,0,0,0|1,0,2]=4 1392 B11R1.40 C\C(=C\c1ccccc1)\N=O Amb25246172 [0,1,0,0,0,0|0,0,2]=3 1393 B11R1.40 C\C(\CBr)=C/c1ccccc1 Amb24605004 [0,1,0,0,0,0|2,0,1]=4 1394 B11R1.40 C\C(\CC)=C\c1ccccc1 Amb22546773 [0,1,0,0,0,0|2,0,1]=4 1395 B11R1.40 C\C(\CN)=C/c1ccccc1 Amb25076849 [0,1,0,0,0,0|2,0,1]=4 1396 B11R1.40 C\C(\CN)=C\c1ccccc1 Amb24634730 [0,1,0,0,0,0|2,0,1]=4 1397 B11R1.40 C\C(\CO)=C/c1cccc[n]1 Amb25060585 [0,1,0,0,0,0|2,0,1]=4 1398 B11R1.40 C\C(\CO)=C\c1ccc[n]c1 Amb24730218 [0,1,0,0,0,0|2,0,1]=4 1399 B11R1.40 C\C(\CO)=C\c1cccc[n]1 Amb25149286 [0,1,0,0,0,0|2,0,1]=4 1400 B11R1.40 C\C(\Cc1cc[n]cc1)=N/O Amb24630186 [0,1,0,0,0,0|1,0,0]=2 1401 B11R1.40 C\C(\Cc1cc[n]cc1)=N\O Amb24417230 [0,1,0,0,0,0|1,0,0]=2 1402 B11R1.40 C\C(\Cc1cccc[n]1)=N\N Amb25760219 [0,1,0,0,0,0|2,0,0]=3 1403 B11R1.40 C\C(\Cc1ccccc1)=C\Cl Amb24718044 [0,1,0,0,0,0|2,0,0]=3 1404 B11R1.40 C\C(\Cc1ccccc1)=N\N Amb24501436 [0,1,0,0,0,0|1,0,0]=2 1405 B11R1.40 C\N=C(/N)\Cc1c[n]ccc1 Amb24062497 [0,1,0,0,0,0|2,0,0]=3 1406 B11R1.40 C\N=C(\N)/Cc1ccccc1 Amb23569051 [0,1,0,0,0,0|1,0,0]=2 1407 B11R1.40 ClC(Cc1ccccc1)C#N Amb1103676 [0,1,0,0,0,0|2,0,1]=4 1408 B11R1.40 ClCC(=O)Cc1ccccc1 Amb2371529 [0,1,0,0,0,0|2,0,0]=3 1409 B11R1.40 ClCC(=O)Oc1ccccc1 Amb1914503 [0,1,0,0,0,0|3,0,0]=4 1410 B11R1.40 ClCC(Cc1ccccc1)C Amb17477588 [0,1,0,0,0,0|2,0,1]=4 1411 B11R1.40 ClCC(Cl)Cc1ccccc1 Amb25061392 [0,1,0,0,0,0|2,0,1]=4 1412 B11R1.40 ClC\C(\Br)=C\c1ccccc1 Amb25283246 [0,1,0,0,0,0|2,0,1]=4 1413 B11R1.40 Cl\C(\CCl)=C/c1ccccc1 Amb25362063 [0,1,0,0,0,0|2,0,1]=4 1414 B11R1.40 FCC(Br)Cc1ccccc1 Amb24611243 [0,1,0,0,0,0|2,0,1]=4 1415 B11R1.40 FCC(Cc1ccccc1)N Amb17614462 [0,1,0,0,0,0|2,0,1]=4 1416 B11R1.40 FCC(F)Cc1ccccc1 Amb22641518 [0,1,0,0,0,0|2,0,1]=4 1417 B11R1.40 F\C(\CBr)=C\c1ccccc1 Amb24745736 [0,1,0,0,0,0|2,0,1]=4 1418 B11R1.40 N#C[C@@H](O)Cc1ccccc1 Amb24715921 [0,1,0,0,0,0|2,0,1]=4 1419 B11R1.40 N#C[C@H](O)Cc1ccccc1 Amb25846935 [0,1,0,0,0,0|2,0,1]=4 1420 B11R1.40 N#C\C(\Cl)=C/c1ccccc1 Amb25209358 [0,1,0,0,0,0|2,0,1]=4 1421 B11R1.40 N#C\C(\Cl)=C\c1ccccc1 Amb18126389 [0,1,0,0,0,0|2,0,1]=4 1422 B11R1.40 N#C\C(\F)=C/c1ccccc1 Amb25187404 [0,1,0,0,0,0|2,0,1]=4 1423 B11R1.40 N#C\C(\F)=C\c1ccccc1 Amb18644314 [0,1,0,0,0,0|2,0,1]=4 1424 B11R1.40 N=C(CS)Nc1ccccc1 Amb25194642 [0,1,0,0,0,0|2,1,0]=4 1425 B11R1.40 N=C(Cc1ccccc1)NO Amb20671380 [0,1,0,0,0,0|0,0,1]=2 1426 B11R1.40 NC(CBr)Cc1ccccc1 Amb22489725 [0,1,0,0,0,0|2,0,1]=4 1427 B11R1.40 NC(Cc1[n]ccc[n]1)=NO Amb18796668 [0,1,0,0,0,0|2,0,0]=3 1428 B11R1.40 NC(Cc1c[n]ccc1)=NN Amb18182746 [0,1,0,0,0,0|2,0,0]=3 1429 B11R1.40 NC(Cc1cc[n]cc1)=NN Amb18182747 [0,1,0,0,0,0|2,0,0]=3 1430 B11R1.40 NC(Cc1ccccc1)=S=O Amb25053951 [0,1,0,0,0,0|1,0,1]=3 1431 B11R1.40 NC(Cc1ccccc1)C#N Amb1127111 [0,1,0,0,0,0|2,0,1]=4 1432 B11R1.40 NC(Cc1ccccc1)NO Amb25047325 [0,1,0,0,0,0|0,0,2]=3 1433 B11R1.40 NC(Nc1c[n]ccc1)=NO Amb18182780 [0,1,0,0,0,0|2,0,0]=3 1434 B11R1.40 NC(Nc1ccccc1)=NO Amb18799378 [0,1,0,0,0,0|1,0,0]=2 1435 B11R1.40 NCC(=N)Nc1ccccc1 Amb24746458 [0,1,0,0,0,0|3,0,0]=4 1436 B11R1.40 NCC(=O)Cc1c[n]ccc1 Amb18251321 [0,1,0,0,0,0|3,0,0]=4 1437 B11R1.40 NCC(=O)Cc1cc[n]cc1 Amb18201930 [0,1,0,0,0,0|3,0,0]=4 1438 B11R1.40 NCC(=O)Cc1cccc[n]1 Amb18908409 [0,1,0,0,0,0|3,0,0]=4 1439 B11R1.40 NCC(=O)Cc1ccccc1 Amb18202084 [0,1,0,0,0,0|2,0,0]=3 1440 B11R1.40 NCC(=O)Cc1ccccc1 Amb19516183 [0,1,0,0,0,0|2,0,0]=3 1441 B11R1.40 NCC(=O)Nc1ccccc1 Amb10609338 [0,1,0,0,0,0|3,0,0]=4 1442 B11R1.40 NCC(=O)Oc1ccccc1 Amb17334310 [0,1,0,0,0,0|3,0,0]=4 1443 B11R1.40 NCC(=S)Nc1ccccc1 Amb25128037 [0,1,0,0,0,0|3,0,0]=4 1444 B11R1.40 NCC(Cl)Cc1ccccc1 Amb24740670 [0,1,0,0,0,0|2,0,1]=4 1445 B11R1.40 NCC(F)Cc1ccccc1 Amb24434017 [0,1,0,0,0,0|2,0,1]=4 1446 B11R1.40 NCC(S)Cc1ccccc1 Amb18251941 [0,1,0,0,0,0|2,0,1]=4 1447 B11R1.40 NC[C@@H](Cc1ccccc1)N Amb17619359 [0,1,0,0,0,0|2,0,1]=4 1448 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb22746804 [0,1,0,0,0,0|2,0,1]=4 1449 B11R1.40 NC[C@H](Cc1ccccc1)N Amb17619360 [0,1,0,0,0,0|2,0,1]=4 1450 B11R1.40 NC[C@H](O)Cc1ccccc1 Amb24538166 [0,1,0,0,0,0|2,0,1]=4 1451 B11R1.40 NC\C(\Cl)=C\c1ccccc1 Amb25259250 [0,1,0,0,0,0|2,0,1]=4 1452 B11R1.40 NNC(=N)Nc1ccccc1 Amb22459345 [0,1,0,0,0,0|2,0,1]=4 1453 B11R1.40 NNC(=O)C[N]1=CC=CC=C1 Amb17836433 [0,1,0,0,0,0|2,0,1]=4 1454 B11R1.40 NNC(=O)C[n+]1ccccc1 Amb10552843 [0,1,0,0,0,0|2,0,1]=4 1455 B11R1.40 NNC(=O)C[n+]1ccccc1 Amb1154171 [0,1,0,0,0,0|2,0,1]=4 1456 B11R1.40 NNC(=O)C[n+]1ccccc1 Amb19748594 [0,1,0,0,0,0|2,0,1]=4 1457 B11R1.40 NNC(=O)Cc1cccc[n]1 Amb19373217 [0,1,0,0,0,0|2,0,1]=4 1458 B11R1.40 NNC(=O)Cc1ccccc1 Amb24081244 [0,1,0,0,0,0|1,0,1]=3 1459 B11R1.40 NNC(=O)Cc1ccncc1 Amb1133661 [0,1,0,0,0,0|2,0,1]=4 1460 B11R1.40 NNC(=O)Nc1ccccc1 Amb1204373 [0,1,0,0,0,0|2,0,1]=4 1461 B11R1.40 NNC(=S)Cc1ccccc1 Amb24377114 [0,1,0,0,0,0|1,0,1]=3 1462 B11R1.40 NN\C(=N/c1ccccc1)\S Amb2502886 [0,1,0,0,0,0|2,0,1]=4 1463 B11R1.40 NOC(=O)Nc1ccccc1 Amb24484939 [0,1,0,0,0,0|3,0,0]=4 1464 B11R1.40 N[C@@H](CBr)Cc1ccccc1 Amb22747782 [0,1,0,0,0,0|2,0,1]=4 1465 B11R1.40 N[C@@H](CCl)Cc1ccccc1 Amb24758237 [0,1,0,0,0,0|2,0,1]=4 1466 B11R1.40 N[C@@H](CF)Cc1ccccc1 Amb24484482 [0,1,0,0,0,0|2,0,1]=4 1467 B11R1.40 N[C@@H](CO)Cc1ccccc1 Amb20242871 [0,1,0,0,0,0|1,0,1]=3 1468 B11R1.40 N[C@@H](CS)Cc1ccccc1 Amb25073967 [0,1,0,0,0,0|1,1,1]=4 1469 B11R1.40 N[C@@H](Cc1ccccc1)C#N Amb17399902 [0,1,0,0,0,0|2,0,1]=4 1470 B11R1.40 N[C@H](CCl)Cc1ccccc1 Amb24533056 [0,1,0,0,0,0|2,0,1]=4 1471 B11R1.40 N[C@H](CF)Cc1ccccc1 Amb25151303 [0,1,0,0,0,0|2,0,1]=4 1472 B11R1.40 N[C@H](CS)Cc1ccccc1 Amb25765677 [0,1,0,0,0,0|1,1,1]=4 1473 B11R1.40 N[C@H](Cc1ccccc1)C=O Amb24746755 [0,1,0,0,0,0|1,0,2]=4 1474 B11R1.40 N\C(\C#N)=N\c1ccccc1 Amb24680966 [0,1,0,0,0,0|3,0,0]=4 1475 B11R1.40 N\C(\Cc1cc[n]c[n]1)=N\O Amb24514544 [0,1,0,0,0,0|2,0,0]=3 1476 B11R1.40 N\C(\Cc1ccc[n][n]1)=N\O Amb24695789 [0,1,0,0,0,0|2,0,0]=3 1477 B11R1.40 N\C(\Cc1cccc[n]1)=N\N Amb18177153 [0,1,0,0,0,0|2,0,0]=3 1478 B11R1.40 N\C(\Cc1ccccc1)=C\O Amb25152159 [0,1,0,0,0,0|1,0,0]=2 1479 B11R1.40 N\C(\Cc1ccccc1)=N/N Amb17933233 [0,1,0,0,0,0|1,0,0]=2 1480 B11R1.40 N\C(\Cc1ccccc1)=N\Cl Amb25689858 [0,1,0,0,0,0|1,0,0]=2 1481 B11R1.40 N\C(\Nc1c[n]cc[n]1)=N\O Amb24358068 [0,1,0,0,0,0|3,0,0]=4 1482 B11R1.40 N\C(\Nc1c[n]ccc1)=N\N Amb25130297 [0,1,0,0,0,0|3,0,0]=4 1483 B11R1.40 N\C(\Nc1cccc[n]1)=N\N Amb25031331 [0,1,0,0,0,0|3,0,0]=4 1484 B11R1.40 N\C(\Nc1ccccc1)=N\N Amb25046170 [0,1,0,0,0,0|2,0,0]=3 1485 B11R1.40 N\N=C(\Cl)/Cc1ccccc1 Amb25188651 [0,1,0,0,0,0|1,0,0]=2 1486 B11R1.40 O=C(C=O)Oc1ccccc1 Amb18125060 [0,1,0,0,0,0|2,0,1]=4 1487 B11R1.40 O=C(CBr)C[n+]1ccccc1 Amb24641641 [0,1,0,0,0,0|3,0,0]=4 1488 B11R1.40 O=C(CBr)Sc1ccccc1 Amb24730786 [0,1,0,0,0,0|3,0,0]=4 1489 B11R1.40 O=C(CCl)Sc1ccccc1 Amb24712200 [0,1,0,0,0,0|3,0,0]=4 1490 B11R1.40 O=C(CF)Nc1ccccc1 Amb20246909 [0,1,0,0,0,0|3,0,0]=4 1491 B11R1.40 O=C(CI)Nc1ccccc1 Amb21964671 [0,1,0,0,0,0|3,0,0]=4 1492 B11R1.40 O=C(CP)Nc1ccccc1 Amb25032359 [0,1,0,0,0,0|3,0,0]=4 1493 B11R1.40 O=C(Cc1cc[n]cc1)CCl Amb22494556 [0,1,0,0,0,0|3,0,0]=4 1494 B11R1.40 O=C(Cc1ccccc1)CF Amb22234964 [0,1,0,0,0,0|2,0,0]=3 1495 B11R1.40 O=C(Cc1ccccc1)CS Amb25294429 [0,1,0,0,0,0|1,1,0]=3 1496 B11R1.40 O=C(Cc1ccccc1)O[Ag] Amb22359200 [0,1,0,0,0,0|2,0,0]=3 1497 B11R1.40 O=C(Nc1ccccc1)NCl Amb25756195 [0,1,0,0,0,0|2,0,1]=4 1498 B11R1.40 O=C(Nc1ccccc1)SCl Amb25095177 [0,1,0,0,0,0|3,0,0]=4 1499 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [0,1,0,0,0,0|1,0,1]=3 1500 B11R1.40 O=CC(Br)Cc1ccccc1 Amb18657408 [0,1,0,0,0,0|1,0,2]=4 1501 B11R1.40 O=CC(Cc1ccccc1)Cl Amb17204312 [0,1,0,0,0,0|1,0,2]=4 1502 B11R1.40 O=CC(F)Cc1ccccc1 Amb24714702 [0,1,0,0,0,0|1,0,2]=4 1503 B11R1.40 O=C[C@@H](Br)Cc1ccccc1 Amb24461614 [0,1,0,0,0,0|1,0,2]=4 1504 B11R1.40 O=C[C@@H](F)Cc1ccccc1 Amb24724556 [0,1,0,0,0,0|1,0,2]=4 1505 B11R1.40 O=C[C@H](Br)Cc1ccccc1 Amb25778238 [0,1,0,0,0,0|1,0,2]=4 1506 B11R1.40 O=C\C(\Br)=C/c1ccccc1 Amb25047719 [0,1,0,0,0,0|1,0,2]=4 1507 B11R1.40 O=C\C(\F)=C/c1ccccc1 Amb25714375 [0,1,0,0,0,0|1,0,2]=4 1508 B11R1.40 O=C\C(\F)=C\c1ccccc1 Amb18125101 [0,1,0,0,0,0|1,0,2]=4 1509 B11R1.40 O=NC(Cc1ccccn1)C Amb10549352 [0,1,0,0,0,0|1,0,2]=4 1510 B11R1.40 O=N\C(\Br)=C\c1ccccc1 Amb24666519 [0,1,0,0,0,0|0,0,2]=3 1511 B11R1.40 O=S(CCl)Cc1ccccc1 Amb24373167 [0,1,0,0,0,0|3,0,0]=4 1512 B11R1.40 OC(CF)Cc1ccccc1 Amb24733743 [0,1,0,0,0,0|2,0,1]=4 1513 B11R1.40 OC(CS)Cc1ccccc1 Amb25740621 [0,1,0,0,0,0|1,1,1]=4 1514 B11R1.40 OC(Cc1ccccc1)C=O Amb25065752 [0,1,0,0,0,0|1,0,2]=4 1515 B11R1.40 OCC(=O)Cc1ccccc1 Amb18182729 [0,1,0,0,0,0|1,0,0]=2 1516 B11R1.40 OCC(=O)Nc1ccccc1 Amb1110212 [0,1,0,0,0,0|2,0,0]=3 1517 B11R1.40 OCC(=O)Oc1ccccc1 Amb25149728 [0,1,0,0,0,0|2,0,0]=3 1518 B11R1.40 OCC(Cc1ccccc1)C Amb17477578 [0,1,0,0,0,0|1,0,1]=3 1519 B11R1.40 OCC(Cc1ccccc1)O Amb17593786 [0,1,0,0,0,0|1,0,1]=3 1520 B11R1.40 OCC(Cc1ccccn1)N Amb17062682 [0,1,0,0,0,0|2,0,1]=4 1521 B11R1.40 OCC(Cc1cccnc1)N Amb17062683 [0,1,0,0,0,0|2,0,1]=4 1522 B11R1.40 OCC(Cc1ccncc1)N Amb17062684 [0,1,0,0,0,0|2,0,1]=4 1523 B11R1.40 OCC(Cl)Cc1ccccc1 Amb24373181 [0,1,0,0,0,0|1,0,1]=3 1524 B11R1.40 OCC(F)Cc1ccccc1 Amb25225922 [0,1,0,0,0,0|1,0,1]=3 1525 B11R1.40 OCC(O)Nc1ccccc1 Amb25369775 [0,1,0,0,0,0|2,0,1]=4 1526 B11R1.40 OCC(Oc1ccccc1)C Amb17232100 [0,1,0,0,0,0|2,0,1]=4 1527 B11R1.40 OC[C@@H](O)Cc1ccccc1 Amb25204361 [0,1,0,0,0,0|1,0,1]=3 1528 B11R1.40 OC[C@H](Br)Cc1ccccc1 Amb24639076 [0,1,0,0,0,0|1,0,1]=3 1529 B11R1.40 OC[C@H](O)Cc1ccccc1 Amb24392862 [0,1,0,0,0,0|1,0,1]=3 1530 B11R1.40 OC\C(\Br)=C\c1ccccc1 Amb25187542 [0,1,0,0,0,0|1,0,1]=3 1531 B11R1.40 OC\C(\F)=C\c1cccc[n]1 Amb24354427 [0,1,0,0,0,0|2,0,1]=4 1532 B11R1.40 ON=C(Cc1ccccn1)N Amb13994155 [0,1,0,0,0,0|1,0,0]=2 1533 B11R1.40 ONC(=O)Cc1ccc[n]c1 Amb25052392 [0,1,0,0,0,0|1,0,1]=3 1534 B11R1.40 ONC(=O)Oc1ccccc1 Amb22493600 [0,1,0,0,0,0|1,0,1]=3 1535 B11R1.40 O[C@@H](CCl)Cc1ccccc1 Amb19929327 [0,1,0,0,0,0|2,0,1]=4 1536 B11R1.40 O[C@H](CBr)Cc1ccccc1 Amb24392488 [0,1,0,0,0,0|2,0,1]=4 1537 B11R1.40 O[C@H](CCl)Cc1ccccc1 Amb19929332 [0,1,0,0,0,0|2,0,1]=4 1538 B11R1.40 O[C@H](Cc1ccccc1)C=O Amb25683436 [0,1,0,0,0,0|1,0,2]=4 1539 B11R1.40 O\C(=C/c1ccccc1)\C=O Amb18124881 [0,1,0,0,0,0|1,0,2]=4 1540 B11R1.40 O\C(=C\c1ccccc1)\C=O Amb24595210 [0,1,0,0,0,0|1,0,2]=4 1541 B11R1.40 O\C(\Cc1ccccc1)=N/O Amb19986986 [0,1,0,0,0,0|0,0,0]=1 1542 B11R1.40 O\N=C(/Cc1ccccc1)\N Amb1106303 [0,1,0,0,0,0|0,0,0]=1 1543 B11R1.40 O\N=C(\Cc1ccccc1)/N Amb1159399 [0,1,0,0,0,0|0,0,0]=1 1544 B11R1.40 O\N=C(\Cl)/Cc1ccccc1 Amb25721012 [0,1,0,0,0,0|0,0,0]=1 1545 B11R1.40 SCC(=O)Nc1ccccc1 Amb1349645 [0,1,0,0,0,0|2,1,0]=4 1546 B11R1.91 CC(=C)OCc1ccccc1 Amb22731238 [0,1,0,0,0,0|3,0,0]=4 1547 B11R1.91 CC(=C)\C=C\c1ccccc1 Amb22546632 [0,1,0,0,0,0|2,0,1]=4 1548 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [0,1,0,0,0,0|3,0,0]=4 1549 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [0,1,0,0,0,0|3,0,0]=4 1550 B11R1.91 CC(=NCc1ccccc1)C Amb10568469 [0,1,0,0,0,0|3,0,0]=4 1551 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [0,1,0,0,0,0|2,0,1]=4 1552 B11R1.91 CC(=O)\C=C/c1ccccc1 Amb24380759 [0,1,0,0,0,0|1,0,2]=4 1553 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [0,1,0,0,0,0|1,0,2]=4 1554 B11R1.91 CC(=O)\C=N\c1ccccc1 Amb25230668 [0,1,0,0,0,0|2,0,1]=4 1555 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [0,1,0,0,0,0|2,1,0]=4 1556 B11R1.91 CC(=S)OCc1ccccc1 Amb22168133 [0,1,0,0,0,0|2,1,0]=4 1557 B11R1.91 CC(C)=CNc1ccccc1 Amb24715634 [0,1,0,0,0,0|3,0,0]=4 1558 B11R1.91 CC(C)\C=C/c1ccccc1 Amb22546593 [0,1,0,0,0,0|2,0,1]=4 1559 B11R1.91 CC(CCc1ccccn1)O Amb17507263 [0,1,0,0,0,0|2,0,1]=4 1560 B11R1.91 CC(CCc1cccnc1)O Amb17507264 [0,1,0,0,0,0|2,0,1]=4 1561 B11R1.91 CC(CCc1ccncc1)O Amb17507265 [0,1,0,0,0,0|2,0,1]=4 1562 B11R1.91 CC(N)C=Cc1ccccc1 Amb23536549 [0,1,0,0,0,0|2,0,1]=4 1563 B11R1.91 CC(N)\C=C\c1ccccc1 Amb18124854 [0,1,0,0,0,0|2,0,1]=4 1564 B11R1.91 CC(N)\C=C\c1ccccc1 Amb21961471 [0,1,0,0,0,0|2,0,1]=4 1565 B11R1.91 CC(NCc1ccccc1)C Amb2118435 [0,1,0,0,0,0|3,0,0]=4 1566 B11R1.91 CC(O)C#Cc1ccccc1 Amb24101080 [0,1,0,0,0,0|1,0,2]=4 1567 B11R1.91 CC(O)CSc1ccccc1 Amb18793066 [0,1,0,0,0,0|2,0,1]=4 1568 B11R1.91 CC(O)OCc1ccccc1 Amb25070837 [0,1,0,0,0,0|2,0,0]=3 1569 B11R1.91 CC(O)\C=C\c1c[n]ccc1 Amb25847379 [0,1,0,0,0,0|2,0,1]=4 1570 B11R1.91 CC(\C=C\c1ccccc1)O Amb17593695 [0,1,0,0,0,0|1,0,1]=3 1571 B11R1.91 CN(C)CCc1ccccc1 Amb22350299 [0,1,0,0,0,0|1,0,2]=4 1572 B11R1.91 CN(C)OCc1ccccc1 Amb24735469 [0,1,0,0,0,0|2,0,1]=4 1573 B11R1.91 CN(C)\C=C\c1ccccc1 Amb25056753 [0,1,0,0,0,0|1,0,2]=4 1574 B11R1.91 CN(C)\C=N\c1ccccc1 Amb22357796 [0,1,0,0,0,0|2,0,1]=4 1575 B11R1.91 CN(N)CCc1ccccc1 Amb18064284 [0,1,0,0,0,0|1,0,2]=4 1576 B11R1.91 CN(O)CCc1cc[n]cc1 Amb25684228 [0,1,0,0,0,0|1,0,2]=4 1577 B11R1.91 CN(O)N=Nc1ccccc1 Amb24064881 [0,1,0,0,0,0|2,0,1]=4 1578 B11R1.91 C[C@@H](N)\C=C\c1ccccc1 Amb24359903 [0,1,0,0,0,0|2,0,1]=4 1579 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [0,1,0,0,0,0|1,0,1]=3 1580 B11R1.91 C[C@@H](O)CSc1ccccc1 Amb25148170 [0,1,0,0,0,0|2,0,1]=4 1581 B11R1.91 C[C@@H](O)\C=C\c1c[n]ccc1 Amb24698684 [0,1,0,0,0,0|2,0,1]=4 1582 B11R1.91 C[C@H](N)\C=C\c1ccccc1 Amb25809484 [0,1,0,0,0,0|2,0,1]=4 1583 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [0,1,0,0,0,0|1,0,1]=3 1584 B11R1.91 C[C@H](O)CNc1ccccc1 Amb25060992 [0,1,0,0,0,0|2,0,1]=4 1585 B11R1.91 C[C@H](O)COc1ccccc1 Amb25786939 [0,1,0,0,0,0|2,0,1]=4 1586 B11R1.91 C[C@H](O)CSc1ccccc1 Amb25852129 [0,1,0,0,0,0|2,0,1]=4 1587 B11R1.91 C[NH+](\C=N\c1ccccc1)C Amb16205285 [0,1,0,0,0,0|2,0,1]=4 1588 B11R1.91 C[SiH](C)CCc1ccccc1 Amb22338692 [0,1,0,0,0,0|2,0,1]=4 1589 B11R1.91 C\C(=C\C[n+]1ccccc1)\Cl Amb2228412 [0,1,0,0,0,0|3,0,0]=4 1590 B11R1.91 C\C(\N)=C\Oc1ccccc1 Amb24674154 [0,1,0,0,0,0|3,0,0]=4 1591 B11R1.91 ClC(Cl)\C=C\c1ccccc1 Amb24634340 [0,1,0,0,0,0|2,0,1]=4 1592 B11R1.91 ClP(Cl)OCc1ccccc1 Amb22054434 [0,1,0,0,0,0|2,1,0]=4 1593 B11R1.91 N=C(/N)\SCc1ccccc1 Amb20655654 [0,1,0,0,0,0|3,0,0]=4 1594 B11R1.91 N=C([NH3+])SCc1ccccc1 Amb24113839 [0,1,0,0,0,0|3,0,0]=4 1595 B11R1.91 NC(=N)C=Cc1ccccc1 Amb22464717 [0,1,0,0,0,0|2,0,1]=4 1596 B11R1.91 NC(=N)NCc1ccccc1 Amb21955695 [0,1,0,0,0,0|3,0,0]=4 1597 B11R1.91 NC(=N)NCc1ccccc1 Amb22370878 [0,1,0,0,0,0|3,0,0]=4 1598 B11R1.91 NC(=N)SCc1ccccc1 Amb20676044 [0,1,0,0,0,0|3,0,0]=4 1599 B11R1.91 NC(=N)[NH2+]Cc1ccccc1 Amb22269907 [0,1,0,0,0,0|3,0,0]=4 1600 B11R1.91 NC(=N)\C=C\c1ccccc1 Amb22755484 [0,1,0,0,0,0|2,0,1]=4 1601 B11R1.91 NC(=N)\C=C\c1ccccc1 Amb22756994 [0,1,0,0,0,0|2,0,1]=4 1602 B11R1.91 NC(=NCc1ccccc1)N Amb16231121 [0,1,0,0,0,0|3,0,0]=4 1603 B11R1.91 NC(=O)NCc1ccccc1 Amb2435042 [0,1,0,0,0,0|2,0,1]=4 1604 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [0,1,0,0,0,0|1,1,1]=4 1605 B11R1.91 NC(=S)NCc1ccccc1 Amb1207502 [0,1,0,0,0,0|2,1,0]=4 1606 B11R1.91 NC(=S)SCc1ccccc1 Amb19999447 [0,1,0,0,0,0|2,1,0]=4 1607 B11R1.91 NC(=S)\C=C\c1ccccc1 Amb18105844 [0,1,0,0,0,0|1,1,1]=4 1608 B11R1.91 NC(=[NH2+])NCc1ccccc1 Amb22730911 [0,1,0,0,0,0|3,0,0]=4 1609 B11R1.91 NC(=[NH2+])SCc1ccccc1 Amb2407328 [0,1,0,0,0,0|3,0,0]=4 1610 B11R1.91 NC(N)=NCc1ccccc1 Amb19374239 [0,1,0,0,0,0|3,0,0]=4 1611 B11R1.91 O=C(Cl)NCc1ccccc1 Amb25772230 [0,1,0,0,0,0|2,0,1]=4 1612 B11R1.91 O=C(S)CCc1ccccc1 Amb24733716 [0,1,0,0,0,0|1,0,2]=4 1613 B11R1.91 O=S(Cl)CCc1ccccc1 Amb25371638 [0,1,0,0,0,0|1,0,2]=4 1614 B11R1.91 OB(CCc1ccccc1)O Amb2456045 [0,1,0,0,0,0|1,0,1]=3 1615 B11R1.91 OB(O)C#Cc1ccccc1 Amb25151882 [0,1,0,0,0,0|1,0,2]=4 1616 B11R1.91 OB(O)CCc1c[n]ccc1 Amb25259201 [0,1,0,0,0,0|2,0,1]=4 1617 B11R1.91 OB(O)CCc1cccc[n]1 Amb24392967 [0,1,0,0,0,0|2,0,1]=4 1618 B11R1.91 OB(O)O[Hg]c1ccccc1 Amb22345921 [0,1,0,0,0,0|3,0,0]=4 1619 B11R1.91 OB(O)\C=C/c1ccccc1 Amb24117859 [0,1,0,0,0,0|1,0,1]=3 1620 B11R1.91 OB(O)\C=C\c1c[n]ccc1 Amb24068965 [0,1,0,0,0,0|2,0,1]=4 1621 B11R1.91 OB(\C=C\c1ccccc1)O Amb2447227 [0,1,0,0,0,0|1,0,1]=3 1622 B11R1.91 OC(=O)CCc1ccccc1 Amb22366916 [0,1,0,0,0,0|1,0,1]=3 1623 B11R1.91 OC(=O)CCc1ccccn1 Amb1102533 [0,1,0,0,0,0|2,0,1]=4 1624 B11R1.91 OC(=O)CCc1cccnc1 Amb1214870 [0,1,0,0,0,0|2,0,1]=4 1625 B11R1.91 OC(=O)CCc1ccncc1 Amb1090849 [0,1,0,0,0,0|2,0,1]=4 1626 B11R1.91 OC(=O)COc1ccccc1 Amb1213413 [0,1,0,0,0,0|2,0,1]=4 1627 B11R1.91 OC(=O)COc1ccccc1 Amb22274444 [0,1,0,0,0,0|2,0,1]=4 1628 B11R1.91 OC(=O)CPc1ccccc1 Amb24487808 [0,1,0,0,0,0|2,0,1]=4 1629 B11R1.91 OC(=O)CSc1ccccc1 Amb1038999 [0,1,0,0,0,0|2,0,1]=4 1630 B11R1.91 OC(=O)NCc1ccccc1 Amb10603977 [0,1,0,0,0,0|2,0,0]=3 1631 B11R1.91 OC(=O)[13CH2][13CH2]c1ccccc1 Amb22336575 [0,1,0,0,0,0|1,0,1]=3 1632 B11R1.91 OC(=O)\C=C/c1cc[n]cc1 Amb20622011 [0,1,0,0,0,0|2,0,1]=4 1633 B11R1.91 OC(=O)\C=C/c1ccc[n]c1 Amb25378742 [0,1,0,0,0,0|2,0,1]=4 1634 B11R1.91 OC(=O)\C=C/c1ccccn1 Amb10071558 [0,1,0,0,0,0|2,0,1]=4 1635 B11R1.91 OC(=O)\C=C\c1ccccc1 Amb22366387 [0,1,0,0,0,0|1,0,1]=3 1636 B11R1.91 OC(=O)\C=C\c1ccncc1 Amb1107607 [0,1,0,0,0,0|2,0,1]=4 1637 B11R1.91 OC(=O)\C=N/c1cc[n]cc1 Amb24068310 [0,1,0,0,0,0|3,0,0]=4 1638 B11R1.91 OC(=O)\C=N\c1ccccc1 Amb25243930 [0,1,0,0,0,0|2,0,0]=3 1639 B11R1.91 OC(O)CCc1ccccc1 Amb25829695 [0,1,0,0,0,0|1,0,1]=3 1640 B11R1.91 OS(=O)CCc1cc[n]cc1 Amb24546017 [0,1,0,0,0,0|2,0,1]=4 1641 B11R1.91 OS(=O)CNc1ccccc1 Amb25798133 [0,1,0,0,0,0|2,0,1]=4 1642 B11R1.91 O[13C](=O)[13CH2][13CH2]c1ccccc1 Amb22336771 [0,1,0,0,0,0|1,0,1]=3 1643 B11R1.91 SC(=S)CCc1ccccc1 Amb24439493 [0,1,0,0,0,0|1,1,1]=4 1644 B11R1.91 SC(=S)OCc1ccccc1 Amb10553124 [0,1,0,0,0,0|2,1,0]=4 1645 B11R1.91 SC(=S)OCc1ccccc1 Amb25721135 [0,1,0,0,0,0|2,1,0]=4 1646 B11R1.91 [O-]C(=O)CCc1ccccc1 Amb22233349 [0,1,0,0,0,0|1,0,2]=4 1647 B11R1.91 [O-]C(=O)\C=C\c1ccccc1 Amb1814995 [0,1,0,0,0,0|1,0,2]=4 1648 B11R1.91 [O-]C(=O)\C=C\c1ccccc1 Amb22360910 [0,1,0,0,0,0|1,0,2]=4 1649 B11R1.91 [O-]P(=O)OCc1ccccc1 Amb22461723 [0,1,0,0,0,0|1,1,1]=4 1650 B11R1.91 [O-]S(=O)NCc1ccccc1 Amb22641608 [0,1,0,0,0,0|2,0,1]=4 1651 B11R1.91 [O-][N+](=O)CCc1ccccc1 Amb16192705 [0,1,0,0,0,0|0,0,3]=4 1652 B9R0.18 C\C=C\CC(=O)\C=C\C=C Amb24435526 [0,0,1,0,0,0|3,0,0]=4 1653 B9R0.45 C=CC=CC=CC=CCO Amb25052157 [0,0,1,0,0,0|1,0,1]=3 1654 B11R2.1 BN1CCc2ccccc12 Amb25180693 [0,0,0,1,0,0|1,0,2]=4 1655 B11R2.1 BrC1C=Cc2ccccc21 Amb25101590 [0,0,0,1,0,0|2,0,1]=4 1656 B11R2.1 BrC1NCc2ccccc21 Amb22500144 [0,0,0,1,0,0|3,0,0]=4 1657 B11R2.1 Br[n]1c[n]c2ccccc12 Amb25146351 [0,0,0,1,0,0|2,0,1]=4 1658 B11R2.1 Brc1c[nH]c2c1cccc2 Amb2447679 [0,0,0,1,0,0|3,0,0]=4 1659 B11R2.1 C=C1CCc2ccccc21 Amb24458532 [0,0,0,1,0,0|2,0,1]=4 1660 B11R2.1 CC1=CCc2ccccc12 Amb17778909 [0,0,0,1,0,0|2,0,0]=3 1661 B11R2.1 CC1C=Cc2ccccc12 Amb17844052 [0,0,0,1,0,0|2,0,1]=4 1662 B11R2.1 CC1NCc2ccccc21 Amb20623497 [0,0,0,1,0,0|3,0,0]=4 1663 B11R2.1 CC1SCc2ccccc21 Amb24092837 [0,0,0,1,0,0|3,0,0]=4 1664 B11R2.1 CN1CCc2c1cccc2 Amb15691717 [0,0,0,1,0,0|1,0,2]=4 1665 B11R2.1 C[C@@H]1NCc2ccccc21 Amb25353679 [0,0,0,1,0,0|3,0,0]=4 1666 B11R2.1 C[N+]1=CCc2c1cccc2 Amb10553677 [0,0,0,1,0,0|1,0,1]=3 1667 B11R2.1 C[SiH]1CCc2ccccc12 Amb24065297 [0,0,0,1,0,0|2,0,1]=4 1668 B11R2.1 C[n+]1csc2c1cccc2 Amb1147462 [0,0,0,1,0,0|2,0,1]=4 1669 B11R2.1 Cc1c[nH]c2c1cccc2 Amb1786299 [0,0,0,1,0,0|3,0,0]=4 1670 B11R2.1 ClC1C=Nc2ccccc21 Amb24078935 [0,0,0,1,0,0|3,0,0]=4 1671 B11R2.1 Cl[C@@H]1C=Cc2ccccc21 Amb24518031 [0,0,0,1,0,0|2,0,1]=4 1672 B11R2.1 Cl[C@H]1C=Cc2ccccc21 Amb25783948 [0,0,0,1,0,0|2,0,1]=4 1673 B11R2.1 Cl[n]1c[n]c2ccccc12 Amb24351571 [0,0,0,1,0,0|2,0,1]=4 1674 B11R2.1 Clc1c[nH]c2ccccc12 Amb17672708 [0,0,0,1,0,0|3,0,0]=4 1675 B11R2.1 Clc1coc2ccccc21 Amb21963868 [0,0,0,1,0,0|3,0,0]=4 1676 B11R2.1 Cn1cnc2c1cccc2 Amb10562077 [0,0,0,1,0,0|2,0,1]=4 1677 B11R2.1 FC1CCc2ccccc21 Amb25311534 [0,0,0,1,0,0|2,0,1]=4 1678 B11R2.1 FC1NCc2ccccc21 Amb22504231 [0,0,0,1,0,0|3,0,0]=4 1679 B11R2.1 Fc1c[nH]c2c1cccc2 Amb10841217 [0,0,0,1,0,0|3,0,0]=4 1680 B11R2.1 Fc1coc2ccccc21 Amb24409168 [0,0,0,1,0,0|3,0,0]=4 1681 B11R2.1 Ic1c[nH]c2c1cccc2 Amb17134442 [0,0,0,1,0,0|3,0,0]=4 1682 B11R2.1 Ic1c[s]c2ccccc21 Amb22002561 [0,0,0,1,0,0|3,0,0]=4 1683 B11R2.1 Ic1coc2ccccc21 Amb24622374 [0,0,0,1,0,0|3,0,0]=4 1684 B11R2.1 NC1C=Cc2c1cccc2 Amb17470367 [0,0,0,1,0,0|2,0,1]=4 1685 B11R2.1 NC1CCc2c1cccc2 Amb1158023 [0,0,0,1,0,0|2,0,1]=4 1686 B11R2.1 NC1CCc2c1cccc2 Amb16233857 [0,0,0,1,0,0|2,0,1]=4 1687 B11R2.1 NC1CCc2ccccc21 Amb24078253 [0,0,0,1,0,0|2,0,1]=4 1688 B11R2.1 N[C@@H]1CCc2c1cccc2 Amb16233854 [0,0,0,1,0,0|2,0,1]=4 1689 B11R2.1 N[C@H]1CCc2ccccc21 Amb20242239 [0,0,0,1,0,0|2,0,1]=4 1690 B11R2.1 Nc1c[s]c2ccccc21 Amb19957699 [0,0,0,1,0,0|3,0,0]=4 1691 B11R2.1 Nc1coc2ccccc21 Amb24371464 [0,0,0,1,0,0|3,0,0]=4 1692 B11R2.1 Nc1csc2c1cccc2 Amb13890519 [0,0,0,1,0,0|3,0,0]=4 1693 B11R2.1 Nn1ccc2c1cccc2 Amb16233739 [0,0,0,1,0,0|1,0,2]=4 1694 B11R2.1 O=C1C=Cc2c1cccc2 Amb10603436 [0,0,0,1,0,0|1,0,2]=4 1695 B11R2.1 O=C1SCc2c1cccc2 Amb2421358 [0,0,0,1,0,0|2,0,1]=4 1696 B11R2.1 O=S1C=Nc2ccccc12 Amb24479722 [0,0,0,1,0,0|2,0,1]=4 1697 B11R2.1 O=[s]1ccc2ccccc12 Amb24078341 [0,0,0,1,0,0|1,0,2]=4 1698 B11R2.1 OB1COc2ccccc21 Amb25132941 [0,0,0,1,0,0|2,0,1]=4 1699 B11R2.1 OB1OCc2c1cccc2 Amb1027843 [0,0,0,1,0,0|2,0,0]=3 1700 B11R2.1 OB1OCc2c1ccnc2 Amb13887161 [0,0,0,1,0,0|3,0,0]=4 1701 B11R2.1 OC1C=Cc2ccccc21 Amb24479258 [0,0,0,1,0,0|1,0,1]=3 1702 B11R2.1 OC1CCc2c1cccn2 Amb16231393 [0,0,0,1,0,0|2,0,1]=4 1703 B11R2.1 OC1CCc2ccc[n]c21 Amb19958431 [0,0,0,1,0,0|2,0,1]=4 1704 B11R2.1 OC1COc2ccccc21 Amb24104532 [0,0,0,1,0,0|2,0,1]=4 1705 B11R2.1 OC1OCc2ccc[n]c21 Amb25266798 [0,0,0,1,0,0|3,0,0]=4 1706 B11R2.1 OC1OCc2ccccc21 Amb21858794 [0,0,0,1,0,0|2,0,0]=3 1707 B11R2.1 O[C@@H]1CCc2[n]cccc21 Amb24511690 [0,0,0,1,0,0|2,0,1]=4 1708 B11R2.1 O[C@@H]1CCc2c1cccc2 Amb13953023 [0,0,0,1,0,0|1,0,1]=3 1709 B11R2.1 O[C@@H]1CCc2ccc[n]c21 Amb22745812 [0,0,0,1,0,0|2,0,1]=4 1710 B11R2.1 O[C@H]1C=Cc2ccccc21 Amb24748284 [0,0,0,1,0,0|1,0,1]=3 1711 B11R2.1 O[C@H]1CCc2c1cccc2 Amb13953022 [0,0,0,1,0,0|1,0,1]=3 1712 B11R2.1 O[C@H]1CSc2ccccc21 Amb25356604 [0,0,0,1,0,0|2,0,1]=4 1713 B11R2.1 O[n+]1c[nH]c2ccccc12 Amb24729556 [0,0,0,1,0,0|1,0,1]=3 1714 B11R2.1 O[n]1c[n]c2[n]cccc12 Amb22751042 [0,0,0,1,0,0|2,0,1]=4 1715 B11R2.1 O[n]1c[n]c2ccc[n]c12 Amb24078856 [0,0,0,1,0,0|2,0,1]=4 1716 B11R2.1 O[n]1ccc2ccc[n]c12 Amb25858298 [0,0,0,1,0,0|1,0,2]=4 1717 B11R2.1 Oc1[n][s]c2ccccc21 Amb22166851 [0,0,0,1,0,0|3,0,0]=4 1718 B11R2.1 Oc1[s][n]c2ccccc21 Amb22059084 [0,0,0,1,0,0|3,0,0]=4 1719 B11R2.1 Oc1c[nH]c2[n]cccc21 Amb24387306 [0,0,0,1,0,0|3,0,0]=4 1720 B11R2.1 Oc1c[n][n]2ccccc21 Amb25359066 [0,0,0,1,0,0|3,0,0]=4 1721 B11R2.1 Oc1c[n]c2cccc[n]21 Amb22008558 [0,0,0,1,0,0|3,0,0]=4 1722 B11R2.1 Oc1c[n]c2cccc[n]21 Amb24074110 [0,0,0,1,0,0|3,0,0]=4 1723 B11R2.1 Oc1c[s]c2ccc[n]c21 Amb24066972 [0,0,0,1,0,0|3,0,0]=4 1724 B11R2.1 Oc1coc2ccc[n]c21 Amb21963453 [0,0,0,1,0,0|3,0,0]=4 1725 B11R2.1 Oc1coc2ccccc21 Amb24097480 [0,0,0,1,0,0|2,0,0]=3 1726 B11R2.1 On1nnc2c1cccc2 Amb1151367 [0,0,0,1,0,0|2,0,1]=4 1727 B11R2.1 S=C1NCc2ccccc21 Amb24662530 [0,0,0,1,0,0|2,1,0]=4 1728 B11R2.1 Sc1c[s]c2ccccc21 Amb24396652 [0,0,0,1,0,0|2,1,0]=4 1729 B11R2.1 Sc1coc2ccccc21 Amb24061893 [0,0,0,1,0,0|2,1,0]=4 1730 B11R2.1 [NH3+]C1=NCc2c1cccc2 Amb2540026 [0,0,0,1,0,0|3,0,0]=4 1731 B11R2.1 [O-][N+]1=CCc2ccccc12 Amb25338460 [0,0,0,1,0,0|0,0,2]=3 1732 B11R2.1 [Ti+3]C1C=Cc2ccccc21 Amb22053615 [0,0,0,1,0,0|2,0,1]=4 1733 B11R2.4 BrC1CC1c2ccccc2 Amb23454923 [0,0,0,1,0,0|2,0,1]=4 1734 B11R2.4 Br[C@@H]1C[C@H]1c2ccccc2 Amb25791511 [0,0,0,1,0,0|2,0,1]=4 1735 B11R2.4 C=C1CC1c2ccccc2 Amb22733871 [0,0,0,1,0,0|2,0,1]=4 1736 B11R2.4 CC1CC1c2ccccc2 Amb16236859 [0,0,0,1,0,0|2,0,1]=4 1737 B11R2.4 CC1NC1c2ccccc2 Amb24056775 [0,0,0,1,0,0|3,0,0]=4 1738 B11R2.4 CC1OC1c2ccccc2 Amb1129298 [0,0,0,1,0,0|3,0,0]=4 1739 B11R2.4 CN1NC1c2ccccc2 Amb25766657 [0,0,0,1,0,0|2,0,1]=4 1740 B11R2.4 C[C@@H]1O[C@H]1c2ccccc2 Amb22367029 [0,0,0,1,0,0|3,0,0]=4 1741 B11R2.4 C[C@H]1O[C@@H]1c2ccccc2 Amb22224838 [0,0,0,1,0,0|3,0,0]=4 1742 B11R2.4 ClC1OC1c2ccccc2 Amb24372881 [0,0,0,1,0,0|3,0,0]=4 1743 B11R2.4 FC1CC1c2ccccc2 Amb25267358 [0,0,0,1,0,0|2,0,1]=4 1744 B11R2.4 F[C@@H]1C[C@@H]1c2ccccc2 Amb24600206 [0,0,0,1,0,0|2,0,1]=4 1745 B11R2.4 F[C@@H]1C[C@H]1c2ccccc2 Amb24538986 [0,0,0,1,0,0|2,0,1]=4 1746 B11R2.4 NC1CC1c2ccccc2 Amb19514914 [0,0,0,1,0,0|2,0,1]=4 1747 B11R2.4 NC1CC1c2ccccc2 Amb22729761 [0,0,0,1,0,0|2,0,1]=4 1748 B11R2.4 NC1OC1c2ccccc2 Amb25724793 [0,0,0,1,0,0|3,0,0]=4 1749 B11R2.4 NN1CC1c2ccccc2 Amb17593419 [0,0,0,1,0,0|1,0,2]=4 1750 B11R2.4 N[C@@H]1CC1c2ccccc2 Amb25077262 [0,0,0,1,0,0|2,0,1]=4 1751 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24183509 [0,0,0,1,0,0|2,0,1]=4 1752 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24579866 [0,0,0,1,0,0|2,0,1]=4 1753 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb22231696 [0,0,0,1,0,0|2,0,1]=4 1754 B11R2.4 N[C@H]1C[C@@H]1c2ccccc2 Amb22735917 [0,0,0,1,0,0|2,0,1]=4 1755 B11R2.4 O=C1C=C1c2ccccc2 Amb24722866 [0,0,0,1,0,0|1,0,2]=4 1756 B11R2.4 O=C1CC1c2ccccc2 Amb25689197 [0,0,0,1,0,0|1,0,2]=4 1757 B11R2.4 OC1CC1c2ccccc2 Amb17593413 [0,0,0,1,0,0|1,0,1]=3 1758 B11R2.4 O[C@H]1C[C@@H]1c2ccccc2 Amb17689138 [0,0,0,1,0,0|1,0,1]=3 1759 B11R2.20 B1OCc2ccccc2O1 Amb25185117 [0,0,0,1,0,0|2,0,0]=3 1760 B11R2.20 C1=Cc2c(CC1)cccc2 Amb1162229 [0,0,0,1,0,0|2,0,1]=4 1761 B11R2.20 C1=Cc2c(NC1)cccc2 Amb17593383 [0,0,0,1,0,0|2,0,1]=4 1762 B11R2.20 C1=NNc2[n]cccc2O1 Amb24559880 [0,0,0,1,0,0|3,0,0]=4 1763 B11R2.20 C1=NSc2ccccc2S1 Amb25187368 [0,0,0,1,0,0|1,1,0]=3 1764 B11R2.20 C1=Nc2c(CN1)cccc2 Amb10552960 [0,0,0,1,0,0|2,0,1]=4 1765 B11R2.20 C1=Nc2c(NC1)cccc2 Amb10174686 [0,0,0,1,0,0|3,0,0]=4 1766 B11R2.20 C1=Nc2c(SC1)cccc2 Amb10976509 [0,0,0,1,0,0|2,1,0]=4 1767 B11R2.20 C1C=CNc2ccccc21 Amb24700458 [0,0,0,1,0,0|2,0,0]=3 1768 B11R2.20 C1C=COc2[n]c[n]cc21 Amb24081500 [0,0,0,1,0,0|3,0,0]=4 1769 B11R2.20 C1C=COc2[n]cccc21 Amb25793536 [0,0,0,1,0,0|2,0,0]=3 1770 B11R2.20 C1C=COc2c[n]ccc21 Amb24390776 [0,0,0,1,0,0|2,0,0]=3 1771 B11R2.20 C1C=COc2ccccc21 Amb24715811 [0,0,0,1,0,0|1,0,0]=2 1772 B11R2.20 C1C=CSc2ccccc21 Amb25349026 [0,0,0,1,0,0|1,1,0]=3 1773 B11R2.20 C1C=Cc2[n]cccc2O1 Amb22896485 [0,0,0,1,0,0|2,0,1]=4 1774 B11R2.20 C1C=Cc2c[n]ccc2O1 Amb24665756 [0,0,0,1,0,0|2,0,1]=4 1775 B11R2.20 C1C=Cc2cc[n]cc2O1 Amb24065645 [0,0,0,1,0,0|2,0,1]=4 1776 B11R2.20 C1C=Nc2[n]cccc2O1 Amb25707817 [0,0,0,1,0,0|3,0,0]=4 1777 B11R2.20 C1CCCc2ccccc21 Amb22351371 [0,0,0,1,0,0|2,0,1]=4 1778 B11R2.20 C1CCOc2[n]cccc21 Amb22753924 [0,0,0,1,0,0|2,0,1]=4 1779 B11R2.20 C1CCc2c(N1)cccc2 Amb10072811 [0,0,0,1,0,0|2,0,1]=4 1780 B11R2.20 C1CCc2c(N1)cccc2 Amb1869492 [0,0,0,1,0,0|2,0,1]=4 1781 B11R2.20 C1CCc2c(S1)cccc2 Amb2237019 [0,0,0,1,0,0|1,1,1]=4 1782 B11R2.20 C1CNNc2ccccc21 Amb24564127 [0,0,0,1,0,0|1,0,2]=4 1783 B11R2.20 C1CNc2c(O1)cccc2 Amb2371970 [0,0,0,1,0,0|2,0,1]=4 1784 B11R2.20 C1COc2c(C1)cncc2 Amb13889664 [0,0,0,1,0,0|2,0,1]=4 1785 B11R2.20 C1COc2c(C1)nccc2 Amb13889663 [0,0,0,1,0,0|2,0,1]=4 1786 B11R2.20 C1COc2ccccc2N1 Amb18090793 [0,0,0,1,0,0|2,0,1]=4 1787 B11R2.20 C1CSc2ccccc2O1 Amb19374957 [0,0,0,1,0,0|2,0,1]=4 1788 B11R2.20 C1C[NH+]=Cc2ccccc21 Amb23569648 [0,0,0,1,0,0|1,0,2]=4 1789 B11R2.20 C1N=CNc2[n]cccc21 Amb25760705 [0,0,0,1,0,0|3,0,0]=4 1790 B11R2.20 C1N=CNc2ccccc21 Amb19374085 [0,0,0,1,0,0|2,0,0]=3 1791 B11R2.20 C1NCNc2ccccc21 Amb25147572 [0,0,0,1,0,0|3,0,0]=4 1792 B11R2.20 C1NCOc2ccccc21 Amb24087478 [0,0,0,1,0,0|2,0,0]=3 1793 B11R2.20 C1NN=Cc2[n]cccc21 Amb25065227 [0,0,0,1,0,0|3,0,0]=4 1794 B11R2.20 C1NNCc2ccccc21 Amb22497223 [0,0,0,1,0,0|2,0,1]=4 1795 B11R2.20 C1Nc2ccccc2C=N1 Amb25147432 [0,0,0,1,0,0|2,0,1]=4 1796 B11R2.20 C1OCOc2[n]cccc21 Amb24079202 [0,0,0,1,0,0|3,0,0]=4 1797 B11R2.20 C1OCOc2c[n]ccc21 Amb24079203 [0,0,0,1,0,0|3,0,0]=4 1798 B11R2.20 C1OCOc2ccccc21 Amb24066080 [0,0,0,1,0,0|2,0,0]=3 1799 B11R2.20 C1ON=Cc2c[n]ccc21 Amb25700338 [0,0,0,1,0,0|3,0,0]=4 1800 B11R2.20 C1ON=Cc2ccc[n]c21 Amb24467725 [0,0,0,1,0,0|3,0,0]=4 1801 B11R2.20 C1ON=Cc2ccccc21 Amb25217160 [0,0,0,1,0,0|2,0,0]=3 1802 B11R2.20 C1Oc2ccccc2C=C1 Amb17844055 [0,0,0,1,0,0|1,0,1]=3 1803 B11R2.20 C1PCNc2ccccc21 Amb25737691 [0,0,0,1,0,0|3,0,0]=4 1804 B11R2.20 C1SC=Cc2ccccc21 Amb25231190 [0,0,0,1,0,0|2,0,1]=4 1805 B11R2.20 C1SCCc2ccccc21 Amb24085482 [0,0,0,1,0,0|2,0,1]=4 1806 B11R2.20 C1SSCc2ccccc21 Amb25839327 [0,0,0,1,0,0|3,0,0]=4 1807 B11R2.20 C=1N=CNC2=CC=COC21 Amb24564703 [0,0,0,1,0,0|3,0,0]=4 1808 B11R2.20 C=1N=CNC2=COC=CC21 Amb24505153 [0,0,0,1,0,0|3,0,0]=4 1809 B11R2.20 C=1Nc2ccccc2NN1 Amb24479128 [0,0,0,1,0,0|2,0,0]=3 1810 B11R2.20 N1CCc2c(C1)cccc2 Amb2383348 [0,0,0,1,0,0|1,0,2]=4 1811 B11R2.20 [13cH]1[13cH][13cH][13c]2[13c]([13cH]1)[13cH][13cH][13cH][13cH]2 Amb17618237 [0,0,0,1,0,0|2,0,1]=4 1812 B11R2.20 c1[nH+]ccc2ccccc21 Amb22456232 [0,0,0,1,0,0|1,0,2]=4 1813 B11R2.20 c1[n][n][n]c2ccccc21 Amb24378063 [0,0,0,1,0,0|2,0,1]=4 1814 B11R2.20 c1[n][n]c2ccc[n]c2[n]1 Amb22496162 [0,0,0,1,0,0|3,0,0]=4 1815 B11R2.20 c1[n]c2ccc[n]c2[n][n]1 Amb25087733 [0,0,0,1,0,0|3,0,0]=4 1816 B11R2.20 c1[n]c2ccc[n]c2c[n]1 Amb24082024 [0,0,0,1,0,0|3,0,0]=4 1817 B11R2.20 c1[n]c[n]c2[n]cccc21 Amb24082020 [0,0,0,1,0,0|3,0,0]=4 1818 B11R2.20 c1[n]c[n]c2c[n]ccc21 Amb24082027 [0,0,0,1,0,0|3,0,0]=4 1819 B11R2.20 c1[n]ccc2NC=COc21 Amb24089126 [0,0,0,1,0,0|3,0,0]=4 1820 B11R2.20 c1[n]ccc2ONC=Cc21 Amb24100803 [0,0,0,1,0,0|1,0,2]=4 1821 B11R2.20 c1[n]ccc2OOC=Cc21 Amb24060614 [0,0,0,1,0,0|2,0,1]=4 1822 B11R2.20 c1[n]ccc2[n]c[n]cc21 Amb24082029 [0,0,0,1,0,0|3,0,0]=4 1823 B11R2.20 c1[n]ccc2cc[n]cc21 Amb20240662 [0,0,0,1,0,0|2,0,1]=4 1824 B11R2.20 c1cc[13c]2[13c](c1)[13cH][13cH][13cH][13cH]2 Amb17618236 [0,0,0,1,0,0|2,0,1]=4 1825 B11R2.20 c1cc[n]c2OC=CNc21 Amb24089117 [0,0,0,1,0,0|3,0,0]=4 1826 B11R2.20 c1cc[n]c2ONC=Cc21 Amb24100801 [0,0,0,1,0,0|1,0,2]=4 1827 B11R2.20 c1ccc2OOC=Cc2[n]1 Amb24060613 [0,0,0,1,0,0|2,0,1]=4 1828 B11R2.20 c1ccc2c(c1)C=NCC2 Amb10603654 [0,0,0,1,0,0|1,0,1]=3 1829 B11R2.20 c1ccc2c(c1)C=[NH+]CC2 Amb10553686 [0,0,0,1,0,0|1,0,2]=4 1830 B11R2.20 c1ccc2c(c1)[nH+]ccc2 Amb10839799 [0,0,0,1,0,0|2,0,1]=4 1831 B11R2.20 c1ccc2c(c1)cncc2 Amb10573326 [0,0,0,1,0,0|1,0,1]=3 1832 B11R2.20 c1ccc2c(c1)cnnc2 Amb10552942 [0,0,0,1,0,0|2,0,1]=4 1833 B11R2.20 c1ccc2c(c1)nccc2 Amb17619761 [0,0,0,1,0,0|2,0,1]=4 1834 B11R2.20 c1ccc2c(c1)nccn2 Amb2099438 [0,0,0,1,0,0|3,0,0]=4 1835 B11R2.20 c1cccc2NC=CNc21 Amb25217865 [0,0,0,1,0,0|3,0,0]=4 1836 B11R2.20 c1cccc2[13cH][13cH][13cH][13cH]c21 Amb22367374 [0,0,0,1,0,0|2,0,1]=4 1837 B11R2.20 c1cccc2[13cH]cccc21 Amb22353428 [0,0,0,1,0,0|2,0,1]=4 1838 B11R2.20 c1cccc2[14cH]cccc21 Amb22349781 [0,0,0,1,0,0|2,0,1]=4 1839 B11R2.20 c1cccc2[nH+]cccc21 Amb22411647 [0,0,0,1,0,0|2,0,1]=4 1840 B11R2.20 c1cccc2[nH+]cccc21 Amb22733403 [0,0,0,1,0,0|2,0,1]=4 1841 B11R2.20 c1cccc2[n][n]ccc21 Amb21858429 [0,0,0,1,0,0|1,0,1]=3 1842 B11R2.20 c1cccc2[n][n]ccc21 Amb22001549 [0,0,0,1,0,0|1,0,1]=3 1843 B11R2.20 c1cccc2[n]cccc21 Amb22002632 [0,0,0,1,0,0|2,0,1]=4 1844 B11R2.20 c1cccc2[n]cccc21 Amb22337856 [0,0,0,1,0,0|2,0,1]=4 1845 B11R2.20 c1ncc2c(c1)cncc2 Amb10573720 [0,0,0,1,0,0|2,0,1]=4 1846 B11R2.238 C(C1CC1)c2ccccc2 Amb22490220 [0,0,0,1,0,0|2,0,1]=4 1847 B11R2.238 C1CC1=Cc2ccccc2 Amb19515480 [0,0,0,1,0,0|2,0,1]=4 1848 B11R2.238 C1N=C1Cc2ccccc2 Amb22498074 [0,0,0,1,0,0|1,0,0]=2 1849 B11R2.238 C1OC1Cc2cc[n]cc2 Amb24677560 [0,0,0,1,0,0|2,0,1]=4 1850 B11R2.238 C1OC1Cc2cccc[n]2 Amb24649901 [0,0,0,1,0,0|2,0,1]=4 1851 B11R2.238 N1CC1Cc2ccccc2 Amb10072810 [0,0,0,1,0,0|1,0,2]=4 1852 B11R2.238 N1C[C@@H]1Cc2ccccc2 Amb15690958 [0,0,0,1,0,0|1,0,2]=4 1853 B11R2.238 N1C[C@H]1Cc2ccccc2 Amb10603217 [0,0,0,1,0,0|1,0,2]=4 1854 B11R2.239 C1CC(O1)c2ccccc2 Amb22298601 [0,0,0,1,0,0|1,0,1]=3 1855 B11R2.239 C1C[C@@H](O1)c2ccccc2 Amb24479262 [0,0,0,1,0,0|1,0,1]=3 1856 B11R2.239 C1C[C@H](O1)c2ccccc2 Amb25721124 [0,0,0,1,0,0|1,0,1]=3 1857 B11R2.239 C1OCC1c2ccccc2 Amb21963191 [0,0,0,1,0,0|2,0,1]=4 1858 B11R2.239 N1CC(C1)c2ccccc2 Amb10603719 [0,0,0,1,0,0|1,0,2]=4 1859 B11R2.988 C=CC1Cc2ccccc12 Amb17778869 [0,0,0,1,0,0|2,0,1]=4 1860 B11R2.988 CCC1Cc2ccccc21 Amb24647895 [0,0,0,1,0,0|2,0,1]=4 1861 B11R2.988 COC1Cc2ccccc21 Amb24455687 [0,0,0,1,0,0|2,0,1]=4 1862 B11R2.988 ClCC1Cc2ccccc21 Amb24588110 [0,0,0,1,0,0|2,0,1]=4 1863 B11R2.988 ICC1Cc2ccccc21 Amb24354685 [0,0,0,1,0,0|2,0,1]=4 1864 B11R2.988 N#CC1=Cc2ccccc21 Amb22227852 [0,0,0,1,0,0|2,0,1]=4 1865 B11R2.988 NCC1=Cc2ccccc21 Amb24596883 [0,0,0,1,0,0|2,0,1]=4 1866 B11R2.988 NCC1Cc2c1cccc2 Amb10609227 [0,0,0,1,0,0|2,0,1]=4 1867 B11R2.988 NC[C@@H]1Cc2ccccc21 Amb24182000 [0,0,0,1,0,0|2,0,1]=4 1868 B11R2.988 NNC1Cc2ccccc21 Amb25326415 [0,0,0,1,0,0|1,0,2]=4 1869 B11R2.988 O=CC1=Cc2ccccc21 Amb24632962 [0,0,0,1,0,0|1,0,2]=4 1870 B11R2.988 O=CC1Cc2c1cccc2 Amb16230472 [0,0,0,1,0,0|1,0,2]=4 1871 B11R2.988 OCC1=Cc2c1cccc2 Amb15691967 [0,0,0,1,0,0|1,0,1]=3 1872 B9R1.12 Br\C=C/Cc1cocc1 Amb25765630 [0,0,0,0,1,0|3,0,0]=4 1873 B9R1.12 Br\C=C\Cc1cocc1 Amb24608417 [0,0,0,0,1,0|3,0,0]=4 1874 B9R1.12 C\C=C\C[n]1cccc1 Amb24375826 [0,0,0,0,1,0|3,0,0]=4 1875 B9R1.12 C\C=C\Cc1c[nH]cc1 Amb25146026 [0,0,0,0,1,0|3,0,0]=4 1876 B9R1.12 C\C=C\Cc1ccc[nH]1 Amb25243730 [0,0,0,0,1,0|3,0,0]=4 1877 B9R1.12 Cl\C=C\C=C1C=CC=C1 Amb25109347 [0,0,0,0,1,0|2,0,1]=4 1878 B9R1.12 O=NSCc1ccco1 Amb25806081 [0,0,0,0,1,0|2,0,1]=4 1879 B9R1.12 OCCCC=1CC=CC1 Amb25851384 [0,0,0,0,1,0|1,0,2]=4 1880 B9R1.12 OCCCc1c[nH]cc1 Amb18222128 [0,0,0,0,1,0|2,0,1]=4 1881 B9R1.12 OCCCc1ccc[nH]1 Amb24428704 [0,0,0,0,1,0|2,0,1]=4 1882 B9R1.12 OCCCc1cccs1 Amb17089493 [0,0,0,0,1,0|2,0,1]=4 1883 B9R1.12 OCCCc1cscc1 Amb17605794 [0,0,0,0,1,0|2,0,1]=4 1884 B9R1.12 OCCCn1cccc1 Amb17593298 [0,0,0,0,1,0|2,0,1]=4 1885 B9R1.12 OCOC[n]1cccc1 Amb25788107 [0,0,0,0,1,0|3,0,0]=4 1886 B9R1.12 OC\C=C/c1ccc[nH]1 Amb24744418 [0,0,0,0,1,0|2,0,1]=4 1887 B9R1.12 OC\C=C\c1c[nH]cc1 Amb24454320 [0,0,0,0,1,0|2,0,1]=4 1888 B9R1.12 OC\C=C\c1c[s]cc1 Amb25315908 [0,0,0,0,1,0|2,0,1]=4 1889 B9R1.12 OC\C=C\c1ccc[nH]1 Amb25090739 [0,0,0,0,1,0|2,0,1]=4 1890 B9R1.12 OC\C=C\c1ccc[s]1 Amb23555588 [0,0,0,0,1,0|2,0,1]=4 1891 B9R1.12 OC\C=C\c1cocc1 Amb25177010 [0,0,0,0,1,0|2,0,1]=4 1892 B9R1.12 ON=CCc1c[n]c[nH]1 Amb25364639 [0,0,0,0,1,0|2,0,0]=3 1893 B11R1.203 NCCCC1=CNC=CC=C1 Amb25114442 [0,0,0,0,0,1|2,0,1]=4 1894 B11R1.203 OCCOC=1C=CNC=CC1 Amb24069979 [0,0,0,0,0,1|2,0,1]=4 1895 B8R0.4 C=CC\C=C\C=C/C=O Amb18642058 [1,0,1,0,0,0|2,0,0]=4 1896 B8R0.4 C=CC\C=C\C=CC=O Amb25259279 [1,0,1,0,0,0|2,0,0]=4 1897 B8R0.4 C=CC\C=C\C=C\C=O Amb25772895 [1,0,1,0,0,0|2,0,0]=4 1898 B8R0.4 CC=CC=CC=CCO Amb25741427 [1,0,1,0,0,0|1,0,1]=4 1899 B8R0.4 CCC\C=C\C=C\C=C Amb22641675 [1,0,1,0,0,0|1,0,1]=4 1900 B8R0.4 O=C\C=C/C=C\CC=O Amb24496324 [1,0,1,0,0,0|1,0,1]=4 1901 B8R0.4 OCC=CC=CC=CBr Amb24565670 [1,0,1,0,0,0|2,0,0]=4 1902 B8R0.4 OC\C=C\C=C\C=C\Br Amb25092806 [1,0,1,0,0,0|2,0,0]=4 1903 B8R1.2 BrC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367404 [2,0,0,0,0,0|1,0,0]=3 1904 B8R1.2 BrC[13c]1ccccc1 Amb22367396 [2,0,0,0,0,0|1,0,0]=3 1905 B8R1.2 BrCc1cc[n]cc1 Amb22753071 [2,0,0,0,0,0|2,0,0]=4 1906 B8R1.2 BrCc1cccc[n]1 Amb22751621 [2,0,0,0,0,0|2,0,0]=4 1907 B8R1.2 Br[13CH2]c1ccccc1 Amb22366910 [2,0,0,0,0,0|1,0,0]=3 1908 B8R1.2 Br[Hg]c1ccccc1 Amb22369231 [2,0,0,0,0,0|2,0,0]=4 1909 B8R1.2 C#[13C]c1ccccc1 Amb22367126 [2,0,0,0,0,0|0,0,2]=4 1910 B8R1.2 C=C[n+]1ccccc1 Amb10552726 [2,0,0,0,0,0|1,0,1]=4 1911 B8R1.2 C=C[n+]1ccccc1 Amb10552768 [2,0,0,0,0,0|1,0,1]=4 1912 B8R1.2 C=C[n+]1ccccc1 Amb10552769 [2,0,0,0,0,0|1,0,1]=4 1913 B8R1.2 C=C[n+]1ccccc1 Amb10552775 [2,0,0,0,0,0|1,0,1]=4 1914 B8R1.2 C=Cc1ccccc1 Amb22337033 [2,0,0,0,0,0|0,0,1]=3 1915 B8R1.2 C=Cc1ccccc1 Amb22337871 [2,0,0,0,0,0|0,0,1]=3 1916 B8R1.2 C=Cc1ccccc1 Amb22337937 [2,0,0,0,0,0|0,0,1]=3 1917 B8R1.2 C=Cc1ccccc1 Amb22338204 [2,0,0,0,0,0|0,0,1]=3 1918 B8R1.2 C=Cc1ccccc1 Amb22338475 [2,0,0,0,0,0|0,0,1]=3 1919 B8R1.2 C=Cc1ccccc1 Amb22351316 [2,0,0,0,0,0|0,0,1]=3 1920 B8R1.2 C=Cc1ccccc1 Amb22731028 [2,0,0,0,0,0|0,0,1]=3 1921 B8R1.2 C=Cc1ccccc1 Amb22733123 [2,0,0,0,0,0|0,0,1]=3 1922 B8R1.2 C=Cc1cccnc1 Amb10071930 [2,0,0,0,0,0|1,0,1]=4 1923 B8R1.2 C=Nc1ccccc1 Amb24605672 [2,0,0,0,0,0|1,0,0]=3 1924 B8R1.2 CC[n+]1ccccc1 Amb22739693 [2,0,0,0,0,0|1,0,1]=4 1925 B8R1.2 CCc1ccccc1 Amb22336270 [2,0,0,0,0,0|0,0,1]=3 1926 B8R1.2 CCc1ccccc1 Amb22366965 [2,0,0,0,0,0|0,0,1]=3 1927 B8R1.2 CCc1ccccc1 Amb2447474 [2,0,0,0,0,0|0,0,1]=3 1928 B8R1.2 CO[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17608460 [2,0,0,0,0,0|1,0,1]=4 1929 B8R1.2 CO[13c]1ccccc1 Amb22362658 [2,0,0,0,0,0|1,0,1]=4 1930 B8R1.2 CPc1ccccc1 Amb25341327 [2,0,0,0,0,0|1,0,1]=4 1931 B8R1.2 C[13CH2]c1ccccc1 Amb22362696 [2,0,0,0,0,0|0,0,1]=3 1932 B8R1.2 C[SiH2]c1ccccc1 Amb19893954 [2,0,0,0,0,0|0,1,1]=4 1933 B8R1.2 ClC=C1C=COC=C1 Amb24470181 [2,0,0,0,0,0|2,0,0]=4 1934 B8R1.2 ClC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367253 [2,0,0,0,0,0|1,0,0]=3 1935 B8R1.2 ClCc1cccc[n]1 Amb22489454 [2,0,0,0,0,0|2,0,0]=4 1936 B8R1.2 ClCc1ccccc1 Amb22363332 [2,0,0,0,0,0|1,0,0]=3 1937 B8R1.2 ClCc1ccncc1 Amb1933717 [2,0,0,0,0,0|2,0,0]=4 1938 B8R1.2 ClSc1ccccc1 Amb10575597 [2,0,0,0,0,0|2,0,0]=4 1939 B8R1.2 Cl[13CH2]c1ccccc1 Amb22351323 [2,0,0,0,0,0|1,0,0]=3 1940 B8R1.2 Cl[SiH2]c1ccccc1 Amb22351128 [2,0,0,0,0,0|1,1,0]=4 1941 B8R1.2 FCc1c[n]ccc1 Amb25259171 [2,0,0,0,0,0|2,0,0]=4 1942 B8R1.2 FCc1cc[n]cc1 Amb22372287 [2,0,0,0,0,0|2,0,0]=4 1943 B8R1.2 FCc1cccc[n]1 Amb24093657 [2,0,0,0,0,0|2,0,0]=4 1944 B8R1.2 FCc1ccccc1 Amb10838335 [2,0,0,0,0,0|1,0,0]=3 1945 B8R1.2 FSc1ccccc1 Amb25198589 [2,0,0,0,0,0|2,0,0]=4 1946 B8R1.2 ICc1cc[n]cc1 Amb22489735 [2,0,0,0,0,0|2,0,0]=4 1947 B8R1.2 ICc1cc[n]cc1 Amb22748952 [2,0,0,0,0,0|2,0,0]=4 1948 B8R1.2 ICc1cccnc1 Amb10602162 [2,0,0,0,0,0|2,0,0]=4 1949 B8R1.2 I[Hg]c1ccccc1 Amb22347346 [2,0,0,0,0,0|2,0,0]=4 1950 B8R1.2 I[Mg]c1ccccc1 Amb22730124 [2,0,0,0,0,0|2,0,0]=4 1951 B8R1.2 I[Se]c1ccccc1 Amb10601593 [2,0,0,0,0,0|2,0,0]=4 1952 B8R1.2 N#Cc1ccccc1 Amb21864642 [2,0,0,0,0,0|0,0,2]=4 1953 B8R1.2 N#Cc1ccccc1 Amb22167299 [2,0,0,0,0,0|0,0,2]=4 1954 B8R1.2 N#[N+]c1ccccc1 Amb10564805 [2,0,0,0,0,0|1,0,1]=4 1955 B8R1.2 N=Cc1c[n]ccc1 Amb24062509 [2,0,0,0,0,0|1,0,0]=3 1956 B8R1.2 N=Cc1cccc[n]1 Amb24081259 [2,0,0,0,0,0|1,0,0]=3 1957 B8R1.2 N=Nc1cccc[n]1 Amb24104371 [2,0,0,0,0,0|2,0,0]=4 1958 B8R1.2 NC[n+]1ccccc1 Amb24716810 [2,0,0,0,0,0|1,0,1]=4 1959 B8R1.2 NCc1cc[n]cc1 Amb20620293 [2,0,0,0,0,0|1,0,1]=4 1960 B8R1.2 NCc1cc[n]cc1 Amb20622010 [2,0,0,0,0,0|1,0,1]=4 1961 B8R1.2 NCc1cccc[n]1 Amb20620292 [2,0,0,0,0,0|1,0,1]=4 1962 B8R1.2 NCc1cccc[n]1 Amb22274458 [2,0,0,0,0,0|1,0,1]=4 1963 B8R1.2 NCc1ccccc1 Amb19958612 [2,0,0,0,0,0|0,0,1]=3 1964 B8R1.2 NCc1ccccc1 Amb22052549 [2,0,0,0,0,0|0,0,1]=3 1965 B8R1.2 NCc1ccccc1 Amb23459863 [2,0,0,0,0,0|0,0,1]=3 1966 B8R1.2 NCc1ccccc1 Amb24325406 [2,0,0,0,0,0|0,0,1]=3 1967 B8R1.2 NCc1cccnc1 Amb1481403 [2,0,0,0,0,0|1,0,1]=4 1968 B8R1.2 NCc1cccnc1 Amb2189172 [2,0,0,0,0,0|1,0,1]=4 1969 B8R1.2 NCc1ccncc1 Amb1156526 [2,0,0,0,0,0|1,0,1]=4 1970 B8R1.2 NNc1ccccc1 Amb22002446 [2,0,0,0,0,0|1,0,1]=4 1971 B8R1.2 NNc1ccccc1 Amb22166856 [2,0,0,0,0,0|1,0,1]=4 1972 B8R1.2 NNc1ccccc1 Amb22731573 [2,0,0,0,0,0|1,0,1]=4 1973 B8R1.2 NOc1ccccc1 Amb18123833 [2,0,0,0,0,0|1,0,1]=4 1974 B8R1.2 NOc1ccccc1 Amb22231364 [2,0,0,0,0,0|1,0,1]=4 1975 B8R1.2 N\N=C\1/C=CC=CN1 Amb22732534 [2,0,0,0,0,0|2,0,0]=4 1976 B8R1.2 O=Bc1ccccc1 Amb25221658 [2,0,0,0,0,0|1,0,1]=4 1977 B8R1.2 O=C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367549 [2,0,0,0,0,0|0,0,1]=3 1978 B8R1.2 O=Cc1cc[n]cc1 Amb20672039 [2,0,0,0,0,0|1,0,1]=4 1979 B8R1.2 O=[13CH]c1ccccc1 Amb22349200 [2,0,0,0,0,0|0,0,1]=3 1980 B8R1.2 O=[I]c1ccccc1 Amb15692855 [2,0,0,0,0,0|1,0,1]=4 1981 B8R1.2 OCC1=CCNC=C1 Amb25662609 [2,0,0,0,0,0|1,0,1]=4 1982 B8R1.2 OCN1C=CNC=C1 Amb17938355 [2,0,0,0,0,0|2,0,0]=4 1983 B8R1.2 OC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367395 [2,0,0,0,0,0|0,0,0]=2 1984 B8R1.2 OCc1c[n][n]cc1 Amb21856410 [2,0,0,0,0,0|2,0,0]=4 1985 B8R1.2 OCc1c[n]ccc1 Amb20622013 [2,0,0,0,0,0|1,0,0]=3 1986 B8R1.2 OCc1c[n]ccc1 Amb22434305 [2,0,0,0,0,0|1,0,0]=3 1987 B8R1.2 OCc1cc[n]cc1 Amb24183964 [2,0,0,0,0,0|1,0,0]=3 1988 B8R1.2 OCc1ccccn1 Amb16231923 [2,0,0,0,0,0|1,0,0]=3 1989 B8R1.2 OCc1ccncc1 Amb16231990 [2,0,0,0,0,0|1,0,0]=3 1990 B8R1.2 ONc1cccc[n]1 Amb25057797 [2,0,0,0,0,0|1,0,1]=4 1991 B8R1.2 ONc1ccccc1 Amb17672282 [2,0,0,0,0,0|0,0,1]=3 1992 B8R1.2 ONc1ccccc1 Amb22445293 [2,0,0,0,0,0|0,0,1]=3 1993 B8R1.2 OSc1cccc[n]1 Amb24061294 [2,0,0,0,0,0|2,0,0]=4 1994 B8R1.2 OSc1ccccc1 Amb25200260 [2,0,0,0,0,0|1,0,0]=3 1995 B8R1.2 O[13CH2]c1ccccc1 Amb22363258 [2,0,0,0,0,0|0,0,0]=2 1996 B8R1.2 O[14CH2]c1ccccc1 Amb22733558 [2,0,0,0,0,0|0,0,0]=2 1997 B8R1.2 O[Hg]c1ccccc1 Amb17940723 [2,0,0,0,0,0|1,0,0]=3 1998 B8R1.2 S=Nc1c[n]ccc1 Amb24085398 [2,0,0,0,0,0|1,1,0]=4 1999 B8R1.2 S=Nc1cccc[n]1 Amb24101381 [2,0,0,0,0,0|1,1,0]=4 2000 B8R1.2 SCc1c[n]ccc1 Amb21984718 [2,0,0,0,0,0|1,1,0]=4 2001 B8R1.2 SCc1cc[n]cc1 Amb22008603 [2,0,0,0,0,0|1,1,0]=4 2002 B8R1.2 SCc1cccc[n]1 Amb20622005 [2,0,0,0,0,0|1,1,0]=4 2003 B8R1.2 [13CH3]Cc1ccccc1 Amb22353602 [2,0,0,0,0,0|0,0,1]=3 2004 B8R1.2 [15NH2]Cc1ccccc1 Amb22351500 [2,0,0,0,0,0|0,0,1]=3 2005 B8R1.2 [C-]#Cc1ccccc1 Amb22731283 [2,0,0,0,0,0|0,0,2]=4 2006 B8R1.2 [C-]#Cc1ccccc1 Amb22731714 [2,0,0,0,0,0|0,0,2]=4 2007 B8R1.2 [C-]#Cc1ccccc1 Amb22733589 [2,0,0,0,0,0|0,0,2]=4 2008 B8R1.2 [C-]#[N+]c1ccccc1 Amb1107613 [2,0,0,0,0,0|1,0,1]=4 2009 B8R1.2 [Li]Sc1ccccc1 Amb17939763 [2,0,0,0,0,0|2,0,0]=4 2010 B8R1.2 [Mg+]Cc1ccccc1 Amb22043988 [2,0,0,0,0,0|1,0,0]=3 2011 B8R1.2 [NH3+]Cc1ccccc1 Amb10555897 [2,0,0,0,0,0|0,0,1]=3 2012 B8R1.2 [NH3+]Oc1ccccc1 Amb10552602 [2,0,0,0,0,0|1,0,1]=4 2013 B8R1.2 [Na]Sc1ccccc1 Amb22353443 [2,0,0,0,0,0|2,0,0]=4 2014 B8R1.2 [O-]Cc1ccccc1 Amb22367041 [2,0,0,0,0,0|0,0,1]=3 2015 B8R1.2 [SiH3]Cc1ccccc1 Amb22347052 [2,0,0,0,0,0|0,1,0]=3 2016 B8R1.2 [Tl]Sc1ccccc1 Amb22366489 [2,0,0,0,0,0|2,0,0]=4 2017 B10R0.4 C=C\C=C\C=C\C=C\C(O)=O Amb25386381 [0,1,1,0,0,0|1,0,1]=4 2018 B10R1.1 BrC=Cc1ccc(cc1)Cl Amb17609952 [1,1,0,0,0,0|1,0,1]=4 2019 B10R1.1 BrCCc1ccc(I)cc1 Amb25266376 [1,1,0,0,0,0|1,0,1]=4 2020 B10R1.1 BrCCc1ccc(cc1)N Amb17595296 [1,1,0,0,0,0|1,0,1]=4 2021 B10R1.1 Br[Zn]Cc1ccc(I)cc1 Amb22000470 [1,1,0,0,0,0|2,0,0]=4 2022 B10R1.1 Br\C=C\c1ccc(cc1)Br Amb17609929 [1,1,0,0,0,0|1,0,1]=4 2023 B10R1.1 Brc1ccc(CCI)cc1 Amb22002540 [1,1,0,0,0,0|1,0,1]=4 2024 B10R1.1 Brc1ccc(C[Mg]Br)cc1 Amb22000536 [1,1,0,0,0,0|2,0,0]=4 2025 B10R1.1 Brc1ccc(C[Zn]Br)cc1 Amb22000432 [1,1,0,0,0,0|2,0,0]=4 2026 B10R1.1 C#CCc1ccc(F)cc1 Amb25679386 [1,1,0,0,0,0|1,0,1]=4 2027 B10R1.1 C=CCC1C=CC(=O)C=C1 Amb25718380 [1,1,0,0,0,0|1,0,1]=4 2028 B10R1.1 C=CC[n+]1ccc(N)cc1 Amb24486611 [1,1,0,0,0,0|2,0,0]=4 2029 B10R1.1 C=CCc1ccc(O)cc1 Amb18124422 [1,1,0,0,0,0|1,0,0]=3 2030 B10R1.1 C=COc1ccc(Br)cc1 Amb24366552 [1,1,0,0,0,0|2,0,0]=4 2031 B10R1.1 C=COc1ccc(I)cc1 Amb24753381 [1,1,0,0,0,0|2,0,0]=4 2032 B10R1.1 C=COc1ccc(O)cc1 Amb25134046 [1,1,0,0,0,0|2,0,0]=4 2033 B10R1.1 C=CSc1ccc(N)cc1 Amb18125327 [1,1,0,0,0,0|2,0,0]=4 2034 B10R1.1 CCCc1ccc(cc1)F Amb10845722 [1,1,0,0,0,0|1,0,1]=4 2035 B10R1.1 CNC=C1C=CC(=O)C=C1 Amb24459841 [1,1,0,0,0,0|1,0,1]=4 2036 B10R1.1 CNCc1ccc(Br)cc1 Amb17739893 [1,1,0,0,0,0|1,0,1]=4 2037 B10R1.1 CNCc1ccc(Cl)cc1 Amb17935917 [1,1,0,0,0,0|1,0,1]=4 2038 B10R1.1 CNCc1ccc(I)cc1 Amb23569028 [1,1,0,0,0,0|1,0,1]=4 2039 B10R1.1 CNCc1ccc(cc1)Br Amb1209641 [1,1,0,0,0,0|1,0,1]=4 2040 B10R1.1 CNCc1ccc(cc1)C Amb1241142 [1,1,0,0,0,0|1,0,1]=4 2041 B10R1.1 CNCc1ccc(cc1)Cl Amb1648458 [1,1,0,0,0,0|1,0,1]=4 2042 B10R1.1 CNCc1ccc(cc1)F Amb1105922 [1,1,0,0,0,0|1,0,1]=4 2043 B10R1.1 CNCc1ccc(cc1)O Amb1116278 [1,1,0,0,0,0|1,0,1]=4 2044 B10R1.1 COCc1ccc(Br)cc1 Amb18320178 [1,1,0,0,0,0|2,0,0]=4 2045 B10R1.1 COCc1ccc(Cl)cc1 Amb22497336 [1,1,0,0,0,0|2,0,0]=4 2046 B10R1.1 COCc1ccc(F)cc1 Amb24064703 [1,1,0,0,0,0|2,0,0]=4 2047 B10R1.1 COCc1ccc(I)cc1 Amb22234050 [1,1,0,0,0,0|2,0,0]=4 2048 B10R1.1 COCc1ccc(S)cc1 Amb19149369 [1,1,0,0,0,0|2,0,0]=4 2049 B10R1.1 COCc1ccc(cc1)N Amb1137167 [1,1,0,0,0,0|2,0,0]=4 2050 B10R1.1 CSCc1ccc(Br)cc1 Amb19373540 [1,1,0,0,0,0|2,0,0]=4 2051 B10R1.1 CSCc1ccc(I)cc1 Amb25799869 [1,1,0,0,0,0|2,0,0]=4 2052 B10R1.1 CSCc1ccc(N)cc1 Amb18544980 [1,1,0,0,0,0|2,0,0]=4 2053 B10R1.1 CSCc1ccc(O)cc1 Amb18644673 [1,1,0,0,0,0|2,0,0]=4 2054 B10R1.1 CSCc1ccc(cc1)C Amb16185125 [1,1,0,0,0,0|2,0,0]=4 2055 B10R1.1 C\C=C\c1ccc(Br)cc1 Amb25698766 [1,1,0,0,0,0|1,0,1]=4 2056 B10R1.1 C\C=C\c1ccc(O)cc1 Amb18124423 [1,1,0,0,0,0|1,0,1]=4 2057 B10R1.1 C\N=C\c1c[n]c(Cl)cc1 Amb25045134 [1,1,0,0,0,0|2,0,0]=4 2058 B10R1.1 C\N=C\c1ccc(O)cc1 Amb25179792 [1,1,0,0,0,0|1,0,0]=3 2059 B10R1.1 Cc1[n]cc(C=NO)c[n]1 Amb25268260 [1,1,0,0,0,0|2,0,0]=4 2060 B10R1.1 Cc1ccc(C=C=O)cc1 Amb24100707 [1,1,0,0,0,0|1,0,1]=4 2061 B10R1.1 Cc1ccc(CCC)cc1 Amb22227992 [1,1,0,0,0,0|1,0,1]=4 2062 B10R1.1 Cc1ccc(CCF)cc1 Amb24659769 [1,1,0,0,0,0|1,0,1]=4 2063 B10R1.1 Cc1ccc(CCI)cc1 Amb25096362 [1,1,0,0,0,0|1,0,1]=4 2064 B10R1.1 Cc1ccc(CCN)cc1 Amb19261118 [1,1,0,0,0,0|0,0,2]=4 2065 B10R1.1 Cc1ccc(CNN)cc1 Amb19890079 [1,1,0,0,0,0|1,0,1]=4 2066 B10R1.1 Cc1ccc(CNN)cc1 Amb21954052 [1,1,0,0,0,0|1,0,1]=4 2067 B10R1.1 Cc1ccc(CNO)[n]c1 Amb25145636 [1,1,0,0,0,0|1,0,1]=4 2068 B10R1.1 Cc1ccc(CNO)c[n]1 Amb25305252 [1,1,0,0,0,0|1,0,1]=4 2069 B10R1.1 Cc1ccc(CNO)cc1 Amb25798742 [1,1,0,0,0,0|0,0,1]=3 2070 B10R1.1 Cc1ccc(CON)cc1 Amb21929103 [1,1,0,0,0,0|1,0,1]=4 2071 B10R1.1 Cc1ccc(C[Mg]Cl)cc1 Amb19928780 [1,1,0,0,0,0|2,0,0]=4 2072 B10R1.1 Cc1ccc(C[Zn]Cl)cc1 Amb22000457 [1,1,0,0,0,0|2,0,0]=4 2073 B10R1.1 Cc1ccc(OC=C)cc1 Amb17674188 [1,1,0,0,0,0|2,0,0]=4 2074 B10R1.1 Cc1ccc(\C=C\Cl)cc1 Amb24652500 [1,1,0,0,0,0|1,0,1]=4 2075 B10R1.1 Cc1ccc(\C=N\C)cc1 Amb24589231 [1,1,0,0,0,0|1,0,0]=3 2076 B10R1.1 Cc1ccc(\C=N\N)[n]c1 Amb25066092 [1,1,0,0,0,0|2,0,0]=4 2077 B10R1.1 Cc1ccc(\C=N\N)c[n]1 Amb25848112 [1,1,0,0,0,0|2,0,0]=4 2078 B10R1.1 Cc1ccc(cc1)C[N+]#[C-] Amb1981066 [1,1,0,0,0,0|1,0,1]=4 2079 B10R1.1 Cc1ccc(cc1)NC=S Amb24427648 [1,1,0,0,0,0|1,1,0]=4 2080 B10R1.1 Cc1ccc(cc1)NCO Amb24745213 [1,1,0,0,0,0|1,0,1]=4 2081 B10R1.1 Cc1ccc(cc1)OC=O Amb25248584 [1,1,0,0,0,0|1,0,1]=4 2082 B10R1.1 Cc1ccc(cc1)SC=C Amb24375563 [1,1,0,0,0,0|2,0,0]=4 2083 B10R1.1 Cl\C=C\c1ccc(cc1)Cl Amb10573154 [1,1,0,0,0,0|1,0,1]=4 2084 B10R1.1 Clc1ccc(CCI)cc1 Amb25363991 [1,1,0,0,0,0|1,0,1]=4 2085 B10R1.1 Clc1ccc(C[Zn]Cl)cc1 Amb22000429 [1,1,0,0,0,0|2,0,0]=4 2086 B10R1.1 Clc1ccc(\C=C\Br)cc1 Amb25145661 [1,1,0,0,0,0|1,0,1]=4 2087 B10R1.1 Clc1ccc(cc1)C[N+]#[C-] Amb2235910 [1,1,0,0,0,0|1,0,1]=4 2088 B10R1.1 FCCc1ccc(Br)cc1 Amb25047426 [1,1,0,0,0,0|1,0,1]=4 2089 B10R1.1 Fc1ccc(C[Mg]Cl)cc1 Amb17938181 [1,1,0,0,0,0|2,0,0]=4 2090 B10R1.1 Fc1ccc(C[Zn]Cl)cc1 Amb17938179 [1,1,0,0,0,0|2,0,0]=4 2091 B10R1.1 Fc1ccc(\C=C\Br)cc1 Amb24553254 [1,1,0,0,0,0|1,0,1]=4 2092 B10R1.1 Fc1ccc(\C=C\Cl)cc1 Amb24482350 [1,1,0,0,0,0|1,0,1]=4 2093 B10R1.1 Fc1ccc(cc1)C[N+]#[C-] Amb1981065 [1,1,0,0,0,0|1,0,1]=4 2094 B10R1.1 Fc1ccc(cc1)NC=S Amb24703342 [1,1,0,0,0,0|1,1,0]=4 2095 B10R1.1 N#CCc1ccc(S)cc1 Amb24509708 [1,1,0,0,0,0|0,0,2]=4 2096 B10R1.1 N#CCc1ccc(cc1)Br Amb1130758 [1,1,0,0,0,0|0,0,2]=4 2097 B10R1.1 N#CCc1ccc(cc1)Cl Amb1883007 [1,1,0,0,0,0|0,0,2]=4 2098 B10R1.1 N#CCc1ccc(cc1)F Amb1154069 [1,1,0,0,0,0|0,0,2]=4 2099 B10R1.1 N#CCc1ccc(cc1)N Amb1215260 [1,1,0,0,0,0|0,0,2]=4 2100 B10R1.1 N#CCc1ccc(cc1)O Amb1154109 [1,1,0,0,0,0|0,0,2]=4 2101 B10R1.1 N=CNc1ccc(Br)c[n]1 Amb25137308 [1,1,0,0,0,0|2,0,0]=4 2102 B10R1.1 N=CNc1ccc(Cl)cc1 Amb25683127 [1,1,0,0,0,0|1,0,0]=3 2103 B10R1.1 NCCc1ccc(Cl)cc1 Amb22497649 [1,1,0,0,0,0|0,0,2]=4 2104 B10R1.1 NCCc1ccc(I)cc1 Amb19516023 [1,1,0,0,0,0|0,0,2]=4 2105 B10R1.1 NCCc1ccc(N)cc1 Amb17772211 [1,1,0,0,0,0|0,0,2]=4 2106 B10R1.1 NCCc1ccc(O)cc1 Amb17778990 [1,1,0,0,0,0|0,0,2]=4 2107 B10R1.1 NCCc1ccc(S)cc1 Amb25700837 [1,1,0,0,0,0|0,0,2]=4 2108 B10R1.1 NCCc1ccc(cc1)Br Amb10808111 [1,1,0,0,0,0|0,0,2]=4 2109 B10R1.1 NCCc1ccc(cc1)C Amb1129454 [1,1,0,0,0,0|0,0,2]=4 2110 B10R1.1 NCCc1ccc(cc1)Cl Amb1212558 [1,1,0,0,0,0|0,0,2]=4 2111 B10R1.1 NCCc1ccc(cc1)F Amb1215262 [1,1,0,0,0,0|0,0,2]=4 2112 B10R1.1 NNCc1ccc(Br)cc1 Amb19893264 [1,1,0,0,0,0|1,0,1]=4 2113 B10R1.1 NNCc1ccc(Br)cc1 Amb23439145 [1,1,0,0,0,0|1,0,1]=4 2114 B10R1.1 NNCc1ccc(Cl)cc1 Amb19890158 [1,1,0,0,0,0|1,0,1]=4 2115 B10R1.1 NNCc1ccc(Cl)cc1 Amb20668069 [1,1,0,0,0,0|1,0,1]=4 2116 B10R1.1 NNCc1ccc(Cl)cc1 Amb21954056 [1,1,0,0,0,0|1,0,1]=4 2117 B10R1.1 NNCc1ccc(F)cc1 Amb19893258 [1,1,0,0,0,0|1,0,1]=4 2118 B10R1.1 NNCc1ccc(I)cc1 Amb25794991 [1,1,0,0,0,0|1,0,1]=4 2119 B10R1.1 NNCc1ccc(cc1)Br Amb1114984 [1,1,0,0,0,0|1,0,1]=4 2120 B10R1.1 NNCc1ccc(cc1)C Amb1112560 [1,1,0,0,0,0|1,0,1]=4 2121 B10R1.1 NNCc1ccc(cc1)Cl Amb1121233 [1,1,0,0,0,0|1,0,1]=4 2122 B10R1.1 NNCc1ccc(cc1)F Amb10841872 [1,1,0,0,0,0|1,0,1]=4 2123 B10R1.1 NNCc1ccc(cc1)F Amb1112880 [1,1,0,0,0,0|1,0,1]=4 2124 B10R1.1 NOCc1ccc(Br)cc1 Amb22234858 [1,1,0,0,0,0|1,0,1]=4 2125 B10R1.1 NOCc1ccc(Cl)cc1 Amb19889791 [1,1,0,0,0,0|1,0,1]=4 2126 B10R1.1 NOCc1ccc(F)cc1 Amb19883929 [1,1,0,0,0,0|1,0,1]=4 2127 B10R1.1 NOCc1ccc(cc1)C Amb1946246 [1,1,0,0,0,0|1,0,1]=4 2128 B10R1.1 NOCc1ccc(cc1)Cl Amb10607411 [1,1,0,0,0,0|1,0,1]=4 2129 B10R1.1 NOCc1ccc(cc1)F Amb17091427 [1,1,0,0,0,0|1,0,1]=4 2130 B10R1.1 N\C=C\c1ccc(Cl)cc1 Amb24418167 [1,1,0,0,0,0|0,0,2]=4 2131 B10R1.1 N\N=C\c1c[n]c(F)cc1 Amb24705093 [1,1,0,0,0,0|2,0,0]=4 2132 B10R1.1 Nc1[n]cc(\C=N\O)c[n]1 Amb23401806 [1,1,0,0,0,0|2,0,0]=4 2133 B10R1.1 Nc1ccc(CC=O)c[n]1 Amb24549097 [1,1,0,0,0,0|1,0,1]=4 2134 B10R1.1 Nc1ccc(CC=O)cc1 Amb22831156 [1,1,0,0,0,0|0,0,1]=3 2135 B10R1.1 Nc1ccc(CCBr)cc1 Amb24066884 [1,1,0,0,0,0|1,0,1]=4 2136 B10R1.1 Nc1ccc(CCCl)cc1 Amb18125908 [1,1,0,0,0,0|1,0,1]=4 2137 B10R1.1 Nc1ccc(CCF)cc1 Amb24655949 [1,1,0,0,0,0|1,0,1]=4 2138 B10R1.1 Nc1ccc(CCO)[n]c1 Amb24593512 [1,1,0,0,0,0|1,0,1]=4 2139 B10R1.1 Nc1ccc(CCO)c[n]1 Amb23446333 [1,1,0,0,0,0|1,0,1]=4 2140 B10R1.1 Nc1ccc(CNO)cc1 Amb25835653 [1,1,0,0,0,0|0,0,1]=3 2141 B10R1.1 Nc1ccc(C[PH2]=O)cc1 Amb25118632 [1,1,0,0,0,0|0,1,1]=4 2142 B10R1.1 Nc1ccc(\C=N\O)c[n]1 Amb23446322 [1,1,0,0,0,0|1,0,0]=3 2143 B10R1.1 Nc1ccc(c[n]1)\C=N\N Amb25048233 [1,1,0,0,0,0|2,0,0]=4 2144 B10R1.1 Nc1ccc(cc1)ON=O Amb25147338 [1,1,0,0,0,0|1,0,1]=4 2145 B10R1.1 Nc1ccc(cc1)SC=O Amb25299329 [1,1,0,0,0,0|1,0,1]=4 2146 B10R1.1 O=CCN1C=CC(=O)C=C1 Amb25337339 [1,1,0,0,0,0|1,0,1]=4 2147 B10R1.1 O=CCc1ccc(Br)[n]c1 Amb24068700 [1,1,0,0,0,0|1,0,1]=4 2148 B10R1.1 O=CCc1ccc(I)cc1 Amb24079622 [1,1,0,0,0,0|0,0,1]=3 2149 B10R1.1 O=CCc1ccc(cc1)Br Amb16230450 [1,1,0,0,0,0|0,0,1]=3 2150 B10R1.1 O=CCc1ccc(cc1)Cl Amb10603161 [1,1,0,0,0,0|0,0,1]=3 2151 B10R1.1 O=CCc1ccc(cc1)F Amb16230451 [1,1,0,0,0,0|0,0,1]=3 2152 B10R1.1 O=CNc1ccc(F)cc1 Amb20407399 [1,1,0,0,0,0|1,0,1]=4 2153 B10R1.1 O=CNc1ccc(cc1)N Amb17334152 [1,1,0,0,0,0|1,0,1]=4 2154 B10R1.1 O=CNc1ccc(cc1)O Amb2370690 [1,1,0,0,0,0|1,0,1]=4 2155 B10R1.1 O=COc1ccc(Cl)cc1 Amb24436068 [1,1,0,0,0,0|1,0,1]=4 2156 B10R1.1 OCCN1C=CC(=O)C=C1 Amb18041230 [1,1,0,0,0,0|1,0,1]=4 2157 B10R1.1 OCCN1C=CC(=S)C=C1 Amb25739794 [1,1,0,0,0,0|1,0,1]=4 2158 B10R1.1 OCCc1ccc(Br)[n]c1 Amb23569407 [1,1,0,0,0,0|1,0,1]=4 2159 B10R1.1 OCCc1ccc(Br)c[n]1 Amb21858814 [1,1,0,0,0,0|1,0,1]=4 2160 B10R1.1 OCCc1ccc(Cl)[n]c1 Amb22752853 [1,1,0,0,0,0|1,0,1]=4 2161 B10R1.1 OCCc1ccc(F)[n]c1 Amb25063775 [1,1,0,0,0,0|1,0,1]=4 2162 B10R1.1 OCCc1ccc(F)c[n]1 Amb24426849 [1,1,0,0,0,0|1,0,1]=4 2163 B10R1.1 OCCc1ccc(I)[n]c1 Amb23446988 [1,1,0,0,0,0|1,0,1]=4 2164 B10R1.1 OCCc1ccc(I)cc1 Amb19668873 [1,1,0,0,0,0|0,0,1]=3 2165 B10R1.1 OCCc1ccc(S)[n]c1 Amb23446733 [1,1,0,0,0,0|1,0,1]=4 2166 B10R1.1 OCCc1ccc(S)cc1 Amb24379931 [1,1,0,0,0,0|0,0,1]=3 2167 B10R1.1 OCCc1ccc(nc1)C Amb10603991 [1,1,0,0,0,0|1,0,1]=4 2168 B10R1.1 OCNc1ccc(Cl)cc1 Amb24702524 [1,1,0,0,0,0|1,0,1]=4 2169 B10R1.1 ONCc1ccc(Br)cc1 Amb23449447 [1,1,0,0,0,0|0,0,1]=3 2170 B10R1.1 ONCc1ccc(Cl)cc1 Amb25145635 [1,1,0,0,0,0|0,0,1]=3 2171 B10R1.1 ONCc1ccc(F)cc1 Amb22157298 [1,1,0,0,0,0|0,0,1]=3 2172 B10R1.1 ONCc1ccc(I)cc1 Amb24529167 [1,1,0,0,0,0|0,0,1]=3 2173 B10R1.1 O\N=C/c1c[n]c(Br)cc1 Amb20242034 [1,1,0,0,0,0|1,0,0]=3 2174 B10R1.1 O\N=C/c1c[n]c(Cl)cc1 Amb19944612 [1,1,0,0,0,0|1,0,0]=3 2175 B10R1.1 O\N=C\c1c[n]c(Br)cc1 Amb23446251 [1,1,0,0,0,0|1,0,0]=3 2176 B10R1.1 O\N=C\c1c[n]c(Cl)cc1 Amb23446914 [1,1,0,0,0,0|1,0,0]=3 2177 B10R1.1 O\N=C\c1c[n]c(I)cc1 Amb23446973 [1,1,0,0,0,0|1,0,0]=3 2178 B10R1.1 O\N=C\c1c[n]c(S)cc1 Amb23446557 [1,1,0,0,0,0|1,0,0]=3 2179 B10R1.1 O\N=C\c1ccc(Br)c[n]1 Amb24701662 [1,1,0,0,0,0|1,0,0]=3 2180 B10R1.1 O\N=C\c1ccc(Cl)c[n]1 Amb25298417 [1,1,0,0,0,0|1,0,0]=3 2181 B10R1.1 O\N=C\c1ccc(cc1)Br Amb1152409 [1,1,0,0,0,0|0,0,0]=2 2182 B10R1.1 O\N=C\c1ccc(cc1)C Amb1152459 [1,1,0,0,0,0|0,0,0]=2 2183 B10R1.1 O\N=C\c1ccc(cc1)Cl Amb1152205 [1,1,0,0,0,0|0,0,0]=2 2184 B10R1.1 O\N=C\c1ccc(cc1)F Amb1152218 [1,1,0,0,0,0|0,0,0]=2 2185 B10R1.1 Oc1ccc(CCCl)cc1 Amb25709371 [1,1,0,0,0,0|1,0,1]=4 2186 B10R1.1 Oc1ccc(CCF)cc1 Amb25735077 [1,1,0,0,0,0|1,0,1]=4 2187 B10R1.1 Oc1ccc(CCI)cc1 Amb24094233 [1,1,0,0,0,0|1,0,1]=4 2188 B10R1.1 Oc1ccc(CCO)c[n]1 Amb23446664 [1,1,0,0,0,0|1,0,1]=4 2189 B10R1.1 Oc1ccc(CCS)cc1 Amb25767004 [1,1,0,0,0,0|0,1,1]=4 2190 B10R1.1 Oc1ccc(CNO)cc1 Amb23449449 [1,1,0,0,0,0|0,0,1]=3 2191 B10R1.1 Oc1ccc(\C=C/Br)cc1 Amb25830036 [1,1,0,0,0,0|1,0,1]=4 2192 B10R1.1 Oc1ccc(\C=N\Cl)cc1 Amb25706980 [1,1,0,0,0,0|1,0,0]=3 2193 B10R1.1 Oc1ccc(\C=N\O)[n]c1 Amb22491238 [1,1,0,0,0,0|1,0,0]=3 2194 B10R1.1 Oc1ccc(c[n]1)\C=N\O Amb23446706 [1,1,0,0,0,0|1,0,0]=3 2195 B10R1.1 Oc1ccc(cc1)OC=O Amb18643207 [1,1,0,0,0,0|1,0,1]=4 2196 B10R1.1 Oc1ccc(cc1)ON=O Amb25729156 [1,1,0,0,0,0|1,0,1]=4 2197 B10R1.1 Oc1ccc(cc1)SCO Amb24631003 [1,1,0,0,0,0|1,0,1]=4 2198 B10R1.1 S=CNc1ccc(Br)cc1 Amb24453374 [1,1,0,0,0,0|1,1,0]=4 2199 B10R1.1 S=CNc1ccc(Cl)cc1 Amb25040558 [1,1,0,0,0,0|1,1,0]=4 2200 B10R1.1 SCCc1ccc(cc1)Br Amb17404679 [1,1,0,0,0,0|0,1,1]=4 2201 B10R1.1 SCCc1ccc(cc1)C Amb16183304 [1,1,0,0,0,0|0,1,1]=4 2202 B10R1.1 SCCc1ccc(cc1)Cl Amb17400376 [1,1,0,0,0,0|0,1,1]=4 2203 B10R1.1 SCCc1ccc(cc1)F Amb17400005 [1,1,0,0,0,0|0,1,1]=4 2204 B10R1.1 Sc1ccc(CCBr)cc1 Amb24428628 [1,1,0,0,0,0|1,0,1]=4 2205 B10R1.1 Sc1ccc(CCCl)cc1 Amb24482361 [1,1,0,0,0,0|1,0,1]=4 2206 B10R1.1 [NH3+]OCc1ccc(cc1)Cl Amb2427236 [1,1,0,0,0,0|1,0,1]=4 2207 B10R1.1 [NH3+]OCc1ccc(cc1)F Amb2420803 [1,1,0,0,0,0|1,0,1]=4 2208 B10R1.1 [O-][n+]1ccc(CCO)cc1 Amb25236037 [1,1,0,0,0,0|1,0,1]=4 2209 B10R1.1 [O-][n+]1ccc(\C=N\O)cc1 Amb25290975 [1,1,0,0,0,0|1,0,0]=3 2210 B10R1.4 Bc1ccccc1CCN Amb24629754 [1,1,0,0,0,0|0,0,2]=4 2211 B10R1.4 BrCCc1ccccc1I Amb25742518 [1,1,0,0,0,0|1,0,1]=4 2212 B10R1.4 Br\C=C\c1ccccc1Br Amb17609930 [1,1,0,0,0,0|1,0,1]=4 2213 B10R1.4 Brc1ccccc1CCBr Amb19515770 [1,1,0,0,0,0|1,0,1]=4 2214 B10R1.4 Brc1ccccc1CCI Amb25255595 [1,1,0,0,0,0|1,0,1]=4 2215 B10R1.4 Brc1ccccc1C[Mg]Br Amb22000538 [1,1,0,0,0,0|2,0,0]=4 2216 B10R1.4 Brc1ccccc1C[Zn]Br Amb22000430 [1,1,0,0,0,0|2,0,0]=4 2217 B10R1.4 C#CCc1ccccc1O Amb24478360 [1,1,0,0,0,0|1,0,1]=4 2218 B10R1.4 C=CCC1=CC=CNC1=O Amb24479088 [1,1,0,0,0,0|2,0,0]=4 2219 B10R1.4 C=CCC1=COC=CC1=O Amb22749954 [1,1,0,0,0,0|2,0,0]=4 2220 B10R1.4 C=CCN1C=CC=CC1=O Amb22364461 [1,1,0,0,0,0|2,0,0]=4 2221 B10R1.4 C=CCN1C=CC=CC1=O Amb22730630 [1,1,0,0,0,0|2,0,0]=4 2222 B10R1.4 C=CCN1C=CC=CC1=S Amb24365325 [1,1,0,0,0,0|2,0,0]=4 2223 B10R1.4 C=CC[n+]1ccccc1Br Amb25854845 [1,1,0,0,0,0|2,0,0]=4 2224 B10R1.4 C=CC[n+]1ccccc1N Amb1394989 [1,1,0,0,0,0|2,0,0]=4 2225 B10R1.4 C=CCc1[n]cccc1O Amb20248276 [1,1,0,0,0,0|2,0,0]=4 2226 B10R1.4 C=CCc1c[n]ccc1Br Amb25167378 [1,1,0,0,0,0|2,0,0]=4 2227 B10R1.4 C=CCc1cc[n]cc1F Amb24524528 [1,1,0,0,0,0|2,0,0]=4 2228 B10R1.4 C=CCc1cccc[n+]1[O-] Amb24433371 [1,1,0,0,0,0|2,0,0]=4 2229 B10R1.4 C=CCc1ccccc1N Amb18642928 [1,1,0,0,0,0|1,0,0]=3 2230 B10R1.4 C=CCc1ccccc1O Amb1971446 [1,1,0,0,0,0|1,0,0]=3 2231 B10R1.4 C=COc1ccccc1Br Amb25095432 [1,1,0,0,0,0|2,0,0]=4 2232 B10R1.4 C=COc1ccccc1N Amb18124449 [1,1,0,0,0,0|2,0,0]=4 2233 B10R1.4 C=COc1ccccc1O Amb18643057 [1,1,0,0,0,0|2,0,0]=4 2234 B10R1.4 CCCc1ccccc1I Amb20622716 [1,1,0,0,0,0|1,0,1]=4 2235 B10R1.4 CNCc1ccccc1Br Amb1210073 [1,1,0,0,0,0|1,0,1]=4 2236 B10R1.4 CNCc1ccccc1C Amb1648007 [1,1,0,0,0,0|1,0,1]=4 2237 B10R1.4 CNCc1ccccc1Cl Amb1694838 [1,1,0,0,0,0|1,0,1]=4 2238 B10R1.4 CNCc1ccccc1F Amb10609411 [1,1,0,0,0,0|1,0,1]=4 2239 B10R1.4 CNCc1ccccc1F Amb1675335 [1,1,0,0,0,0|1,0,1]=4 2240 B10R1.4 CNCc1ccccc1I Amb21861741 [1,1,0,0,0,0|1,0,1]=4 2241 B10R1.4 CNCc1ccccc1O Amb1113119 [1,1,0,0,0,0|1,0,1]=4 2242 B10R1.4 CNCc1ccccc1O Amb19930187 [1,1,0,0,0,0|1,0,1]=4 2243 B10R1.4 CN\C=C/1\C=CC=CC1=N Amb24392543 [1,1,0,0,0,0|1,0,1]=4 2244 B10R1.4 COCc1ccccc1I Amb19373361 [1,1,0,0,0,0|2,0,0]=4 2245 B10R1.4 COCc1ccccc1O Amb22751673 [1,1,0,0,0,0|2,0,0]=4 2246 B10R1.4 CSCc1ccccc1N Amb18951025 [1,1,0,0,0,0|2,0,0]=4 2247 B10R1.4 CSCc1ccccc1O Amb18125792 [1,1,0,0,0,0|2,0,0]=4 2248 B10R1.4 C[n+]1ccccc1C=NO Amb22345876 [1,1,0,0,0,0|1,0,0]=3 2249 B10R1.4 C\C=C/c1ccccc1O Amb24422361 [1,1,0,0,0,0|1,0,1]=4 2250 B10R1.4 C\C=C\c1ccccc1Cl Amb22054732 [1,1,0,0,0,0|1,0,1]=4 2251 B10R1.4 C\C=C\c1ccccc1N Amb18642929 [1,1,0,0,0,0|1,0,1]=4 2252 B10R1.4 C\C=N\c1ccccc1N Amb24715815 [1,1,0,0,0,0|2,0,0]=4 2253 B10R1.4 C\C=N\c1ccccc1O Amb25296771 [1,1,0,0,0,0|2,0,0]=4 2254 B10R1.4 C\N=C\c1[n]cccc1O Amb24696955 [1,1,0,0,0,0|2,0,0]=4 2255 B10R1.4 C\N=C\c1ccccc1O Amb25179640 [1,1,0,0,0,0|1,0,0]=3 2256 B10R1.4 C\N=N\c1ccccc1N Amb25316282 [1,1,0,0,0,0|2,0,0]=4 2257 B10R1.4 Cc1[n]cc[n]c1\C=N/O Amb22900074 [1,1,0,0,0,0|2,0,0]=4 2258 B10R1.4 Cc1[n]cccc1CCO Amb24061576 [1,1,0,0,0,0|1,0,1]=4 2259 B10R1.4 Cc1[n]cccc1\C=N/O Amb25803964 [1,1,0,0,0,0|1,0,0]=3 2260 B10R1.4 Cc1c[n]c[n]c1C=NO Amb24518427 [1,1,0,0,0,0|2,0,0]=4 2261 B10R1.4 Cc1c[n]ccc1CC=O Amb25368595 [1,1,0,0,0,0|1,0,1]=4 2262 B10R1.4 Cc1cc[n]cc1CNO Amb25135601 [1,1,0,0,0,0|1,0,1]=4 2263 B10R1.4 Cc1cc[n]cc1\C=N\C Amb25126303 [1,1,0,0,0,0|2,0,0]=4 2264 B10R1.4 Cc1ccc[n]c1\C=N\N Amb25688638 [1,1,0,0,0,0|2,0,0]=4 2265 B10R1.4 Cc1ccc[n]c1\C=N\O Amb24518378 [1,1,0,0,0,0|1,0,0]=3 2266 B10R1.4 Cc1ccccc1C=NO Amb24084825 [1,1,0,0,0,0|0,0,0]=2 2267 B10R1.4 Cc1ccccc1C=[N+]=[N-] Amb25218933 [1,1,0,0,0,0|1,0,1]=4 2268 B10R1.4 Cc1ccccc1CCC Amb22227985 [1,1,0,0,0,0|1,0,1]=4 2269 B10R1.4 Cc1ccccc1CCN Amb20622598 [1,1,0,0,0,0|0,0,2]=4 2270 B10R1.4 Cc1ccccc1CNN Amb21954057 [1,1,0,0,0,0|1,0,1]=4 2271 B10R1.4 Cc1ccccc1CNO Amb25343987 [1,1,0,0,0,0|0,0,1]=3 2272 B10R1.4 Cc1ccccc1CSC Amb24370548 [1,1,0,0,0,0|2,0,0]=4 2273 B10R1.4 Cc1ccccc1C[Mg]Cl Amb22000539 [1,1,0,0,0,0|2,0,0]=4 2274 B10R1.4 Cc1ccccc1C[Zn]Cl Amb22000455 [1,1,0,0,0,0|2,0,0]=4 2275 B10R1.4 Cc1ccccc1OC=C Amb17674186 [1,1,0,0,0,0|2,0,0]=4 2276 B10R1.4 Cc1ccccc1\C=N\N Amb24533187 [1,1,0,0,0,0|1,0,0]=3 2277 B10R1.4 Cc1ccncc1/C=N/O Amb17843883 [1,1,0,0,0,0|1,0,0]=3 2278 B10R1.4 ClCCc1ccccc1Br Amb24644893 [1,1,0,0,0,0|1,0,1]=4 2279 B10R1.4 ClCCc1ccccc1I Amb24742826 [1,1,0,0,0,0|1,0,1]=4 2280 B10R1.4 Cl\C=C\c1ccccc1Cl Amb10572874 [1,1,0,0,0,0|1,0,1]=4 2281 B10R1.4 Clc1ccccc1CCI Amb25048390 [1,1,0,0,0,0|1,0,1]=4 2282 B10R1.4 Clc1ccccc1C[Mg]Cl Amb19928783 [1,1,0,0,0,0|2,0,0]=4 2283 B10R1.4 Clc1ccccc1C[Zn]Cl Amb22000427 [1,1,0,0,0,0|2,0,0]=4 2284 B10R1.4 Clc1ccccc1\C=C\Br Amb24449703 [1,1,0,0,0,0|1,0,1]=4 2285 B10R1.4 FCCc1ccccc1Br Amb24754179 [1,1,0,0,0,0|1,0,1]=4 2286 B10R1.4 FCCc1ccccc1I Amb22739042 [1,1,0,0,0,0|1,0,1]=4 2287 B10R1.4 Fc1ccccc1C[Zn]Cl Amb17672035 [1,1,0,0,0,0|2,0,0]=4 2288 B10R1.4 Fc1ccccc1\C=C\Br Amb25141256 [1,1,0,0,0,0|1,0,1]=4 2289 B10R1.4 N#CCc1ccccc1Br Amb1140623 [1,1,0,0,0,0|0,0,2]=4 2290 B10R1.4 N#CCc1ccccc1C Amb1651450 [1,1,0,0,0,0|0,0,2]=4 2291 B10R1.4 N#CCc1ccccc1Cl Amb1644930 [1,1,0,0,0,0|0,0,2]=4 2292 B10R1.4 N#CCc1ccccc1N Amb17607888 [1,1,0,0,0,0|0,0,2]=4 2293 B10R1.4 N#CCc1ccccc1O Amb18642921 [1,1,0,0,0,0|0,0,2]=4 2294 B10R1.4 N=C1C=CC=CN1CCO Amb18548415 [1,1,0,0,0,0|1,0,1]=4 2295 B10R1.4 NCCc1ccccc1Br Amb22395128 [1,1,0,0,0,0|0,0,2]=4 2296 B10R1.4 NCCc1ccccc1C Amb1212557 [1,1,0,0,0,0|0,0,2]=4 2297 B10R1.4 NCCc1ccccc1Cl Amb22490604 [1,1,0,0,0,0|0,0,2]=4 2298 B10R1.4 NCCc1ccccc1F Amb22039505 [1,1,0,0,0,0|0,0,2]=4 2299 B10R1.4 NCCc1ccccc1O Amb10609215 [1,1,0,0,0,0|0,0,2]=4 2300 B10R1.4 NCCc1ccccc1S Amb25831177 [1,1,0,0,0,0|0,0,2]=4 2301 B10R1.4 NNCc1ccccc1Br Amb1116234 [1,1,0,0,0,0|1,0,1]=4 2302 B10R1.4 NNCc1ccccc1Br Amb19893262 [1,1,0,0,0,0|1,0,1]=4 2303 B10R1.4 NNCc1ccccc1C Amb1118964 [1,1,0,0,0,0|1,0,1]=4 2304 B10R1.4 NNCc1ccccc1Cl Amb21959997 [1,1,0,0,0,0|1,0,1]=4 2305 B10R1.4 NNCc1ccccc1F Amb19893256 [1,1,0,0,0,0|1,0,1]=4 2306 B10R1.4 NNCc1ccccc1O Amb24681968 [1,1,0,0,0,0|1,0,1]=4 2307 B10R1.4 NOCc1ccccc1Br Amb17091454 [1,1,0,0,0,0|1,0,1]=4 2308 B10R1.4 NOCc1ccccc1Br Amb21929112 [1,1,0,0,0,0|1,0,1]=4 2309 B10R1.4 NOCc1ccccc1C Amb17091424 [1,1,0,0,0,0|1,0,1]=4 2310 B10R1.4 NOCc1ccccc1Cl Amb19889789 [1,1,0,0,0,0|1,0,1]=4 2311 B10R1.4 NOCc1ccccc1F Amb19894376 [1,1,0,0,0,0|1,0,1]=4 2312 B10R1.4 NOCc1ccccc1I Amb22235087 [1,1,0,0,0,0|1,0,1]=4 2313 B10R1.4 NOCc1ccccc1O Amb24502260 [1,1,0,0,0,0|1,0,1]=4 2314 B10R1.4 N\C=N\c1ccccc1O Amb18643068 [1,1,0,0,0,0|1,0,1]=4 2315 B10R1.4 N\N=C/c1cccc[n+]1[O-] Amb24608851 [1,1,0,0,0,0|2,0,0]=4 2316 B10R1.4 N\N=C\c1ccccc1F Amb25225811 [1,1,0,0,0,0|1,0,0]=3 2317 B10R1.4 N\N=C\c1ccccc1I Amb25048234 [1,1,0,0,0,0|1,0,0]=3 2318 B10R1.4 Nc1[n]cc[n]c1C=NO Amb25352025 [1,1,0,0,0,0|2,0,0]=4 2319 B10R1.4 Nc1[n]cccc1C=NO Amb24063665 [1,1,0,0,0,0|1,0,0]=3 2320 B10R1.4 Nc1[n]cccc1CCO Amb21858404 [1,1,0,0,0,0|1,0,1]=4 2321 B10R1.4 Nc1[n]cccc1\C=N\N Amb24633063 [1,1,0,0,0,0|2,0,0]=4 2322 B10R1.4 Nc1[n]cccc1\C=N\O Amb25227661 [1,1,0,0,0,0|1,0,0]=3 2323 B10R1.4 Nc1c[n]ccc1CCO Amb25291562 [1,1,0,0,0,0|1,0,1]=4 2324 B10R1.4 Nc1cc[n]cc1CC=O Amb25703380 [1,1,0,0,0,0|1,0,1]=4 2325 B10R1.4 Nc1cc[n]cc1CCO Amb24062498 [1,1,0,0,0,0|1,0,1]=4 2326 B10R1.4 Nc1ccccc1C=C=O Amb25331219 [1,1,0,0,0,0|1,0,1]=4 2327 B10R1.4 Nc1ccccc1CCBr Amb24079731 [1,1,0,0,0,0|1,0,1]=4 2328 B10R1.4 Nc1ccccc1CCBr Amb24573051 [1,1,0,0,0,0|1,0,1]=4 2329 B10R1.4 Nc1ccccc1CCF Amb24554505 [1,1,0,0,0,0|1,0,1]=4 2330 B10R1.4 Nc1ccccc1CCN Amb20670599 [1,1,0,0,0,0|0,0,2]=4 2331 B10R1.4 Nc1ccccc1CCP Amb25808564 [1,1,0,0,0,0|0,1,1]=4 2332 B10R1.4 Nc1ccccc1CCS Amb25114690 [1,1,0,0,0,0|0,1,1]=4 2333 B10R1.4 Nc1ccccc1CNN Amb25294794 [1,1,0,0,0,0|1,0,1]=4 2334 B10R1.4 Nc1ccccc1CNO Amb25345206 [1,1,0,0,0,0|0,0,1]=3 2335 B10R1.4 Nc1ccccc1NC=O Amb18643067 [1,1,0,0,0,0|1,0,1]=4 2336 B10R1.4 Nc1ccccc1NC=S Amb24390820 [1,1,0,0,0,0|1,1,0]=4 2337 B10R1.4 Nc1ccccc1\C=C\Br Amb25109193 [1,1,0,0,0,0|1,0,1]=4 2338 B10R1.4 Nc1ccccc1\C=N\N Amb24602310 [1,1,0,0,0,0|1,0,0]=3 2339 B10R1.4 O=C/1C=CC=C\C1=C\NCl Amb24737402 [1,1,0,0,0,0|1,0,1]=4 2340 B10R1.4 O=C/1C=CC=C\C1=C\NF Amb24737383 [1,1,0,0,0,0|1,0,1]=4 2341 B10R1.4 O=CCN1C=CC=CC1=O Amb24059958 [1,1,0,0,0,0|1,0,1]=4 2342 B10R1.4 O=CCN1C=CC=CC1=S Amb24059961 [1,1,0,0,0,0|1,0,1]=4 2343 B10R1.4 O=CCc1cc[n]cc1Cl Amb25250526 [1,1,0,0,0,0|1,0,1]=4 2344 B10R1.4 O=CCc1cc[n]cc1F Amb24553979 [1,1,0,0,0,0|1,0,1]=4 2345 B10R1.4 O=CCc1ccc[n]c1Br Amb24746150 [1,1,0,0,0,0|1,0,1]=4 2346 B10R1.4 O=CCc1ccc[n]c1Cl Amb25768390 [1,1,0,0,0,0|1,0,1]=4 2347 B10R1.4 O=CCc1ccccc1Br Amb18634182 [1,1,0,0,0,0|0,0,1]=3 2348 B10R1.4 O=CCc1ccccc1C Amb10844840 [1,1,0,0,0,0|0,0,1]=3 2349 B10R1.4 O=CCc1ccccc1Cl Amb16230448 [1,1,0,0,0,0|0,0,1]=3 2350 B10R1.4 O=CCc1ccccc1F Amb10844839 [1,1,0,0,0,0|0,0,1]=3 2351 B10R1.4 O=CCc1ccccc1I Amb25377055 [1,1,0,0,0,0|0,0,1]=3 2352 B10R1.4 O=CNc1ccccc1F Amb24401130 [1,1,0,0,0,0|1,0,1]=4 2353 B10R1.4 O=COc1ccccc1O Amb17593488 [1,1,0,0,0,0|1,0,1]=4 2354 B10R1.4 OCCN1C=CC=CC1=O Amb18041231 [1,1,0,0,0,0|1,0,1]=4 2355 B10R1.4 OCCN1C=CC=CC1=S Amb25065240 [1,1,0,0,0,0|1,0,1]=4 2356 B10R1.4 OCCc1[n]cccc1Br Amb22896751 [1,1,0,0,0,0|1,0,1]=4 2357 B10R1.4 OCCc1c[n]ccc1Cl Amb24364650 [1,1,0,0,0,0|1,0,1]=4 2358 B10R1.4 OCCc1cc[n]cc1Br Amb24482101 [1,1,0,0,0,0|1,0,1]=4 2359 B10R1.4 OCCc1cc[n]cc1F Amb25776747 [1,1,0,0,0,0|1,0,1]=4 2360 B10R1.4 OCCc1ccc[n]c1F Amb24513826 [1,1,0,0,0,0|1,0,1]=4 2361 B10R1.4 OCCc1ccccc1I Amb22753529 [1,1,0,0,0,0|0,0,1]=3 2362 B10R1.4 OCCc1ccccc1S Amb24672563 [1,1,0,0,0,0|0,0,1]=3 2363 B10R1.4 ONCc1ccc[n]c1Cl Amb21847006 [1,1,0,0,0,0|1,0,1]=4 2364 B10R1.4 ONCc1ccccc1Br Amb23449448 [1,1,0,0,0,0|0,0,1]=3 2365 B10R1.4 ONCc1ccccc1Cl Amb25729506 [1,1,0,0,0,0|0,0,1]=3 2366 B10R1.4 O\N=C/c1[n]cc[n]c1Cl Amb24417086 [1,1,0,0,0,0|2,0,0]=4 2367 B10R1.4 O\N=C/c1ccc[n]c1Cl Amb25209590 [1,1,0,0,0,0|1,0,0]=3 2368 B10R1.4 O\N=C/c1ccccc1Br Amb25247795 [1,1,0,0,0,0|0,0,0]=2 2369 B10R1.4 O\N=C\c1[n]cccc1Cl Amb25255456 [1,1,0,0,0,0|1,0,0]=3 2370 B10R1.4 O\N=C\c1[n]cccc1F Amb24340328 [1,1,0,0,0,0|1,0,0]=3 2371 B10R1.4 O\N=C\c1c[n]ccc1Br Amb22235662 [1,1,0,0,0,0|1,0,0]=3 2372 B10R1.4 O\N=C\c1cccc[n+]1C Amb1153960 [1,1,0,0,0,0|1,0,0]=3 2373 B10R1.4 O\N=C\c1ccccc1Br Amb1152031 [1,1,0,0,0,0|0,0,0]=2 2374 B10R1.4 O\N=C\c1ccccc1C Amb1647706 [1,1,0,0,0,0|0,0,0]=2 2375 B10R1.4 O\N=C\c1ccccc1Cl Amb1152026 [1,1,0,0,0,0|0,0,0]=2 2376 B10R1.4 O\N=C\c1ccccc1F Amb1152952 [1,1,0,0,0,0|0,0,0]=2 2377 B10R1.4 O\N=C\c1ccccc1I Amb1782090 [1,1,0,0,0,0|0,0,0]=2 2378 B10R1.4 O\N=C\c1ccccc1O Amb1159212 [1,1,0,0,0,0|0,0,0]=2 2379 B10R1.4 O\N=C\c1cccnc1Cl Amb1154028 [1,1,0,0,0,0|1,0,0]=3 2380 B10R1.4 O\N=C\c1cnccc1Cl Amb13889902 [1,1,0,0,0,0|1,0,0]=3 2381 B10R1.4 Oc1ccc[n]c1CCO Amb24062095 [1,1,0,0,0,0|1,0,1]=4 2382 B10R1.4 Oc1ccc[n]c1\C=N\O Amb24564066 [1,1,0,0,0,0|1,0,0]=3 2383 B10R1.4 Oc1ccccc1CCBr Amb18130684 [1,1,0,0,0,0|1,0,1]=4 2384 B10R1.4 Oc1ccccc1CCCl Amb25790019 [1,1,0,0,0,0|1,0,1]=4 2385 B10R1.4 Oc1ccccc1CCF Amb25768394 [1,1,0,0,0,0|1,0,1]=4 2386 B10R1.4 Oc1ccccc1CCI Amb25208761 [1,1,0,0,0,0|1,0,1]=4 2387 B10R1.4 Oc1ccccc1CCS Amb24362789 [1,1,0,0,0,0|0,1,1]=4 2388 B10R1.4 Oc1ccccc1CNO Amb25128279 [1,1,0,0,0,0|0,0,1]=3 2389 B10R1.4 Oc1ccccc1\C=C/Cl Amb25774622 [1,1,0,0,0,0|1,0,1]=4 2390 B10R1.4 Oc1ccccc1\N=N\S Amb24575407 [1,1,0,0,0,0|1,1,0]=4 2391 B10R1.4 S=CNc1ccccc1Br Amb25803506 [1,1,0,0,0,0|1,1,0]=4 2392 B10R1.4 SCCc1ccccc1Br Amb25851259 [1,1,0,0,0,0|0,1,1]=4 2393 B10R1.4 SCCc1ccccc1C Amb17399938 [1,1,0,0,0,0|0,1,1]=4 2394 B10R1.4 SCCc1ccccc1Cl Amb17400374 [1,1,0,0,0,0|0,1,1]=4 2395 B10R1.4 SCCc1ccccc1F Amb17400004 [1,1,0,0,0,0|0,1,1]=4 2396 B10R1.4 SCCc1ccccc1I Amb24089655 [1,1,0,0,0,0|0,1,1]=4 2397 B10R1.4 [NH3+]OCc1ccccc1Br Amb2414824 [1,1,0,0,0,0|1,0,1]=4 2398 B10R1.4 [NH3+]OCc1ccccc1Cl Amb2437206 [1,1,0,0,0,0|1,0,1]=4 2399 B10R1.10 BrCCc1cc(I)ccc1 Amb25137377 [1,1,0,0,0,0|1,0,1]=4 2400 B10R1.10 Br[Zn]Cc1cccc(I)c1 Amb22000468 [1,1,0,0,0,0|2,0,0]=4 2401 B10R1.10 Brc1cc(\C=C/I)ccc1 Amb22231752 [1,1,0,0,0,0|1,0,1]=4 2402 B10R1.10 Brc1cccc(CCBr)c1 Amb18048758 [1,1,0,0,0,0|1,0,1]=4 2403 B10R1.10 Brc1cccc(C[Mg]Br)c1 Amb22000537 [1,1,0,0,0,0|2,0,0]=4 2404 B10R1.10 Brc1cccc(C[Zn]Br)c1 Amb22000431 [1,1,0,0,0,0|2,0,0]=4 2405 B10R1.10 Brc1cccc(c1)\C=C\Br Amb22831297 [1,1,0,0,0,0|1,0,1]=4 2406 B10R1.10 C=C=Cc1cccc(O)c1 Amb24102484 [1,1,0,0,0,0|2,0,0]=4 2407 B10R1.10 C=CC[n+]1cc(Br)ccc1 Amb25722840 [1,1,0,0,0,0|2,0,0]=4 2408 B10R1.10 C=CC[n+]1cc(O)ccc1 Amb25781445 [1,1,0,0,0,0|2,0,0]=4 2409 B10R1.10 C=CCc1c[n]cc(Cl)c1 Amb25137887 [1,1,0,0,0,0|2,0,0]=4 2410 B10R1.10 C=CCc1c[n]cc(F)c1 Amb25772526 [1,1,0,0,0,0|2,0,0]=4 2411 B10R1.10 C=CCc1cc[n]c(Cl)c1 Amb24101015 [1,1,0,0,0,0|2,0,0]=4 2412 B10R1.10 C=CCc1cccc(Br)[n]1 Amb25363953 [1,1,0,0,0,0|2,0,0]=4 2413 B10R1.10 C=CCc1cccc(N)c1 Amb25147344 [1,1,0,0,0,0|1,0,0]=3 2414 B10R1.10 C=CCc1cccc(O)c1 Amb22735821 [1,1,0,0,0,0|1,0,0]=3 2415 B10R1.10 C=COc1cccc(Br)c1 Amb25248086 [1,1,0,0,0,0|2,0,0]=4 2416 B10R1.10 C=COc1cccc(Cl)c1 Amb24092694 [1,1,0,0,0,0|2,0,0]=4 2417 B10R1.10 C=COc1cccc(I)c1 Amb25144604 [1,1,0,0,0,0|2,0,0]=4 2418 B10R1.10 C=COc1cccc(N)c1 Amb18124447 [1,1,0,0,0,0|2,0,0]=4 2419 B10R1.10 CCCc1cc(Br)ccc1 Amb25736130 [1,1,0,0,0,0|1,0,1]=4 2420 B10R1.10 CCCc1cc(F)ccc1 Amb22235098 [1,1,0,0,0,0|1,0,1]=4 2421 B10R1.10 CCCc1cc(N)ccc1 Amb18643014 [1,1,0,0,0,0|1,0,1]=4 2422 B10R1.10 CNCc1cccc(Br)c1 Amb17935918 [1,1,0,0,0,0|1,0,1]=4 2423 B10R1.10 CNCc1cccc(Cl)c1 Amb19958745 [1,1,0,0,0,0|1,0,1]=4 2424 B10R1.10 CNCc1cccc(I)c1 Amb23569027 [1,1,0,0,0,0|1,0,1]=4 2425 B10R1.10 CNCc1cccc(O)c1 Amb19115406 [1,1,0,0,0,0|1,0,1]=4 2426 B10R1.10 CNCc1cccc(c1)Br Amb1114712 [1,1,0,0,0,0|1,0,1]=4 2427 B10R1.10 CNCc1cccc(c1)C Amb1116082 [1,1,0,0,0,0|1,0,1]=4 2428 B10R1.10 CNCc1cccc(c1)Cl Amb1648830 [1,1,0,0,0,0|1,0,1]=4 2429 B10R1.10 CNCc1cccc(c1)F Amb1647905 [1,1,0,0,0,0|1,0,1]=4 2430 B10R1.10 CNCc1cccc(c1)O Amb1131158 [1,1,0,0,0,0|1,0,1]=4 2431 B10R1.10 COCc1cccc(Br)c1 Amb18320155 [1,1,0,0,0,0|2,0,0]=4 2432 B10R1.10 COCc1cccc(Cl)c1 Amb24092696 [1,1,0,0,0,0|2,0,0]=4 2433 B10R1.10 COCc1cccc(F)c1 Amb20241023 [1,1,0,0,0,0|2,0,0]=4 2434 B10R1.10 COCc1cccc(I)c1 Amb24478076 [1,1,0,0,0,0|2,0,0]=4 2435 B10R1.10 COCc1cccc(O)c1 Amb19301751 [1,1,0,0,0,0|2,0,0]=4 2436 B10R1.10 CSCc1cccc(Br)c1 Amb22058705 [1,1,0,0,0,0|2,0,0]=4 2437 B10R1.10 CSCc1cccc(N)c1 Amb18951026 [1,1,0,0,0,0|2,0,0]=4 2438 B10R1.10 CSCc1cccc(O)c1 Amb23443323 [1,1,0,0,0,0|2,0,0]=4 2439 B10R1.10 C\C=C\c1cccc(O)c1 Amb18124427 [1,1,0,0,0,0|1,0,1]=4 2440 B10R1.10 C\N=C\c1cc[n]c(Cl)c1 Amb24615951 [1,1,0,0,0,0|2,0,0]=4 2441 B10R1.10 C\N=C\c1cccc(O)c1 Amb19115409 [1,1,0,0,0,0|1,0,0]=3 2442 B10R1.10 Cc1cc(CCCl)ccc1 Amb18181942 [1,1,0,0,0,0|1,0,1]=4 2443 B10R1.10 Cc1cc(CCO)[n]cc1 Amb25679639 [1,1,0,0,0,0|1,0,1]=4 2444 B10R1.10 Cc1cc(CCO)cc[n]1 Amb24568116 [1,1,0,0,0,0|1,0,1]=4 2445 B10R1.10 Cc1cc(CNN)ccc1 Amb19890111 [1,1,0,0,0,0|1,0,1]=4 2446 B10R1.10 Cc1cc(CNO)ccc1 Amb25784359 [1,1,0,0,0,0|0,0,1]=3 2447 B10R1.10 Cc1cc(C[Zn]Cl)ccc1 Amb22000456 [1,1,0,0,0,0|2,0,0]=4 2448 B10R1.10 Cc1cc(NC=N)[n]cc1 Amb24072428 [1,1,0,0,0,0|2,0,0]=4 2449 B10R1.10 Cc1cc(\C=C/Br)ccc1 Amb24737652 [1,1,0,0,0,0|1,0,1]=4 2450 B10R1.10 Cc1cc(\C=N/O)[n]c[n]1 Amb24480417 [1,1,0,0,0,0|2,0,0]=4 2451 B10R1.10 Cc1cc(\C=N\N)ccc1 Amb25369227 [1,1,0,0,0,0|1,0,0]=3 2452 B10R1.10 Cc1cc(\C=N\O)[n]cc1 Amb24518396 [1,1,0,0,0,0|1,0,0]=3 2453 B10R1.10 Cc1cc(\C=N\O)c[n]c1 Amb24068835 [1,1,0,0,0,0|1,0,0]=3 2454 B10R1.10 Cc1cc(\C=N\O)cc[n]1 Amb22170539 [1,1,0,0,0,0|1,0,0]=3 2455 B10R1.10 Cc1cc(\C=N\O)ccc1 Amb18041948 [1,1,0,0,0,0|0,0,0]=2 2456 B10R1.10 Cc1cc(ccc1)NC=N Amb24548031 [1,1,0,0,0,0|1,0,0]=3 2457 B10R1.10 Cc1cccc(C=NO)[n]1 Amb24077154 [1,1,0,0,0,0|1,0,0]=3 2458 B10R1.10 Cc1cccc(CCC)c1 Amb22232362 [1,1,0,0,0,0|1,0,1]=4 2459 B10R1.10 Cc1cccc(CSC)c1 Amb24416576 [1,1,0,0,0,0|2,0,0]=4 2460 B10R1.10 Cc1cccc(NC=N)[n]1 Amb25806229 [1,1,0,0,0,0|2,0,0]=4 2461 B10R1.10 Cc1cccc(OC=C)c1 Amb17674187 [1,1,0,0,0,0|2,0,0]=4 2462 B10R1.10 Cc1cccc(c1)\C=N\C Amb24524529 [1,1,0,0,0,0|1,0,0]=3 2463 B10R1.10 Cc1cccc(n1)\C=N\O Amb2099576 [1,1,0,0,0,0|1,0,0]=3 2464 B10R1.10 ClCCc1cc(Br)ccc1 Amb24502263 [1,1,0,0,0,0|1,0,1]=4 2465 B10R1.10 Clc1cc(\C=C\Br)ccc1 Amb25262044 [1,1,0,0,0,0|1,0,1]=4 2466 B10R1.10 Clc1cccc(CCCl)c1 Amb18185798 [1,1,0,0,0,0|1,0,1]=4 2467 B10R1.10 Clc1cccc(C[Mg]Cl)c1 Amb19928782 [1,1,0,0,0,0|2,0,0]=4 2468 B10R1.10 Clc1cccc(C[Zn]Cl)c1 Amb22000428 [1,1,0,0,0,0|2,0,0]=4 2469 B10R1.10 Fc1cc(CCI)ccc1 Amb25766475 [1,1,0,0,0,0|1,0,1]=4 2470 B10R1.10 Fc1cc(\C=C\I)ccc1 Amb25049507 [1,1,0,0,0,0|1,0,1]=4 2471 B10R1.10 Fc1cc(ccc1)NC=S Amb24695430 [1,1,0,0,0,0|1,1,0]=4 2472 B10R1.10 Fc1cccc(C[Mg]Cl)c1 Amb17672020 [1,1,0,0,0,0|2,0,0]=4 2473 B10R1.10 Fc1cccc(C[Zn]Cl)c1 Amb17938200 [1,1,0,0,0,0|2,0,0]=4 2474 B10R1.10 N#CCc1cccc(c1)Br Amb1138679 [1,1,0,0,0,0|0,0,2]=4 2475 B10R1.10 N#CCc1cccc(c1)Cl Amb1651451 [1,1,0,0,0,0|0,0,2]=4 2476 B10R1.10 N#CCc1cccc(c1)N Amb1215231 [1,1,0,0,0,0|0,0,2]=4 2477 B10R1.10 NCCc1cc(Br)ccc1 Amb22900947 [1,1,0,0,0,0|0,0,2]=4 2478 B10R1.10 NCCc1cc(Cl)ccc1 Amb22490605 [1,1,0,0,0,0|0,0,2]=4 2479 B10R1.10 NCCc1cc(I)ccc1 Amb25096322 [1,1,0,0,0,0|0,0,2]=4 2480 B10R1.10 NCCc1cccc(c1)C Amb1126573 [1,1,0,0,0,0|0,0,2]=4 2481 B10R1.10 NCCc1cccc(c1)C Amb13952645 [1,1,0,0,0,0|0,0,2]=4 2482 B10R1.10 NCCc1cccc(c1)Cl Amb1212556 [1,1,0,0,0,0|0,0,2]=4 2483 B10R1.10 NCCc1cccc(c1)F Amb1216921 [1,1,0,0,0,0|0,0,2]=4 2484 B10R1.10 NNCc1cccc(Br)c1 Amb19893263 [1,1,0,0,0,0|1,0,1]=4 2485 B10R1.10 NNCc1cccc(Br)c1 Amb20667747 [1,1,0,0,0,0|1,0,1]=4 2486 B10R1.10 NNCc1cccc(F)c1 Amb19893257 [1,1,0,0,0,0|1,0,1]=4 2487 B10R1.10 NNCc1cccc(F)c1 Amb20669586 [1,1,0,0,0,0|1,0,1]=4 2488 B10R1.10 NNCc1cccc(I)c1 Amb25355316 [1,1,0,0,0,0|1,0,1]=4 2489 B10R1.10 NNCc1cccc(c1)Br Amb1119246 [1,1,0,0,0,0|1,0,1]=4 2490 B10R1.10 NNCc1cccc(c1)C Amb1116333 [1,1,0,0,0,0|1,0,1]=4 2491 B10R1.10 NNCc1cccc(c1)Cl Amb1111798 [1,1,0,0,0,0|1,0,1]=4 2492 B10R1.10 NNCc1cccc(c1)Cl Amb13949121 [1,1,0,0,0,0|1,0,1]=4 2493 B10R1.10 NNCc1cccc(c1)F Amb1121411 [1,1,0,0,0,0|1,0,1]=4 2494 B10R1.10 NOCc1cccc(Br)c1 Amb22231355 [1,1,0,0,0,0|1,0,1]=4 2495 B10R1.10 NOCc1cccc(Cl)c1 Amb19889790 [1,1,0,0,0,0|1,0,1]=4 2496 B10R1.10 NOCc1cccc(F)c1 Amb19883930 [1,1,0,0,0,0|1,0,1]=4 2497 B10R1.10 NOCc1cccc(c1)Br Amb17091429 [1,1,0,0,0,0|1,0,1]=4 2498 B10R1.10 NOCc1cccc(c1)C Amb17091425 [1,1,0,0,0,0|1,0,1]=4 2499 B10R1.10 NOCc1cccc(c1)Cl Amb17091428 [1,1,0,0,0,0|1,0,1]=4 2500 B10R1.10 NOCc1cccc(c1)F Amb17091426 [1,1,0,0,0,0|1,0,1]=4 2501 B10R1.10 N\N=C\c1c[n]cc(F)c1 Amb24612857 [1,1,0,0,0,0|2,0,0]=4 2502 B10R1.10 N\N=C\c1cccc(Br)[n]1 Amb24473432 [1,1,0,0,0,0|2,0,0]=4 2503 B10R1.10 N\N=C\c1cccc(Br)c1 Amb25119700 [1,1,0,0,0,0|1,0,0]=3 2504 B10R1.10 Nc1cc(CC#N)ccc1 Amb21857787 [1,1,0,0,0,0|0,0,2]=4 2505 B10R1.10 Nc1cc(CC=O)cc[n]1 Amb25146413 [1,1,0,0,0,0|1,0,1]=4 2506 B10R1.10 Nc1cc(CC=O)ccc1 Amb25147333 [1,1,0,0,0,0|0,0,1]=3 2507 B10R1.10 Nc1cc(CCCl)ccc1 Amb24748802 [1,1,0,0,0,0|1,0,1]=4 2508 B10R1.10 Nc1cc(CCO)[n]cc1 Amb25027828 [1,1,0,0,0,0|1,0,1]=4 2509 B10R1.10 Nc1cc(CCO)cc[n]1 Amb25146377 [1,1,0,0,0,0|1,0,1]=4 2510 B10R1.10 Nc1cc(CCO)ccc1 Amb21857105 [1,1,0,0,0,0|0,0,1]=3 2511 B10R1.10 Nc1cc(CCS)ccc1 Amb22728749 [1,1,0,0,0,0|0,1,1]=4 2512 B10R1.10 Nc1cccc(CCN)c1 Amb22733355 [1,1,0,0,0,0|0,0,2]=4 2513 B10R1.10 Nc1cccc(CCO)[n]1 Amb24401500 [1,1,0,0,0,0|1,0,1]=4 2514 B10R1.10 Nc1cccc(c1)\C=N\N Amb25239736 [1,1,0,0,0,0|1,0,0]=3 2515 B10R1.10 O=CCc1cc(Br)cc[n]1 Amb24482134 [1,1,0,0,0,0|1,0,1]=4 2516 B10R1.10 O=CCc1cccc(Br)[n]1 Amb21858958 [1,1,0,0,0,0|1,0,1]=4 2517 B10R1.10 O=CCc1cccc(F)c1 Amb19929928 [1,1,0,0,0,0|0,0,1]=3 2518 B10R1.10 O=CCc1cccc(c1)Br Amb16230449 [1,1,0,0,0,0|0,0,1]=3 2519 B10R1.10 O=CCc1cccc(c1)C Amb16230453 [1,1,0,0,0,0|0,0,1]=3 2520 B10R1.10 O=CCc1cccc(c1)Cl Amb10844835 [1,1,0,0,0,0|0,0,1]=3 2521 B10R1.10 O=CCc1cccc(c1)O Amb17089543 [1,1,0,0,0,0|0,0,1]=3 2522 B10R1.10 O=CNc1cccc(Br)c1 Amb22367295 [1,1,0,0,0,0|1,0,1]=4 2523 B10R1.10 O=CNc1cccc(F)c1 Amb25830595 [1,1,0,0,0,0|1,0,1]=4 2524 B10R1.10 O=CNc1cccc(I)c1 Amb25240204 [1,1,0,0,0,0|1,0,1]=4 2525 B10R1.10 OCC[n+]1cc(S)ccc1 Amb25831912 [1,1,0,0,0,0|1,0,1]=4 2526 B10R1.10 OCC[n+]1cccc(c1)C Amb10553046 [1,1,0,0,0,0|1,0,1]=4 2527 B10R1.10 OCCc1cc(Br)[n]cc1 Amb25773220 [1,1,0,0,0,0|1,0,1]=4 2528 B10R1.10 OCCc1cc(Br)c[n]c1 Amb25114229 [1,1,0,0,0,0|1,0,1]=4 2529 B10R1.10 OCCc1cc(Br)cc[n]1 Amb24065849 [1,1,0,0,0,0|1,0,1]=4 2530 B10R1.10 OCCc1cc(Cl)[n]cc1 Amb22754705 [1,1,0,0,0,0|1,0,1]=4 2531 B10R1.10 OCCc1cc(F)cc[n]1 Amb25032462 [1,1,0,0,0,0|1,0,1]=4 2532 B10R1.10 OCCc1cc(I)ccc1 Amb24524319 [1,1,0,0,0,0|0,0,1]=3 2533 B10R1.10 OCCc1cccc(F)[n]1 Amb25076783 [1,1,0,0,0,0|1,0,1]=4 2534 B10R1.10 OCCc1cccc(n1)Br Amb13883481 [1,1,0,0,0,0|1,0,1]=4 2535 B10R1.10 OCNc1cccc(Cl)c1 Amb25804223 [1,1,0,0,0,0|1,0,1]=4 2536 B10R1.10 ON=CC=1C=CNC(=O)N1 Amb19515516 [1,1,0,0,0,0|2,0,0]=4 2537 B10R1.10 ONCc1cccc(Br)[n]1 Amb24647347 [1,1,0,0,0,0|1,0,1]=4 2538 B10R1.10 ONCc1cccc(Br)c1 Amb23449439 [1,1,0,0,0,0|0,0,1]=3 2539 B10R1.10 ONCc1cccc(Cl)c1 Amb25210787 [1,1,0,0,0,0|0,0,1]=3 2540 B10R1.10 O\N=C\C=1C=CNC(=O)N1 Amb21927489 [1,1,0,0,0,0|2,0,0]=4 2541 B10R1.10 O\N=C\c1cc(Cl)cc[n]1 Amb24743996 [1,1,0,0,0,0|1,0,0]=3 2542 B10R1.10 O\N=C\c1cc[n]c(Cl)c1 Amb25322425 [1,1,0,0,0,0|1,0,0]=3 2543 B10R1.10 O\N=C\c1cc[n]c(F)c1 Amb24616465 [1,1,0,0,0,0|1,0,0]=3 2544 B10R1.10 O\N=C\c1cccc(Cl)[n]1 Amb24634668 [1,1,0,0,0,0|1,0,0]=3 2545 B10R1.10 O\N=C\c1cccc(c1)Cl Amb1776533 [1,1,0,0,0,0|0,0,0]=2 2546 B10R1.10 O\N=C\c1cccc(c1)F Amb1152958 [1,1,0,0,0,0|0,0,0]=2 2547 B10R1.10 O\N=C\c1cccc(c1)I Amb1831123 [1,1,0,0,0,0|0,0,0]=2 2548 B10R1.10 Oc1[n]c(\C=N\O)cc[n]1 Amb21984664 [1,1,0,0,0,0|2,0,0]=4 2549 B10R1.10 Oc1c[n]cc(CCO)c1 Amb24757058 [1,1,0,0,0,0|1,0,1]=4 2550 B10R1.10 Oc1cc(CCBr)ccc1 Amb18130690 [1,1,0,0,0,0|1,0,1]=4 2551 B10R1.10 Oc1cc(\C=C\Br)ccc1 Amb24518614 [1,1,0,0,0,0|1,0,1]=4 2552 B10R1.10 Oc1cc(\C=C\Cl)ccc1 Amb24686373 [1,1,0,0,0,0|1,0,1]=4 2553 B10R1.10 Oc1cc(ccc1)OC=O Amb18643208 [1,1,0,0,0,0|1,0,1]=4 2554 B10R1.10 Oc1cc[n]c(CCO)c1 Amb24544455 [1,1,0,0,0,0|1,0,1]=4 2555 B10R1.10 Oc1cccc(CNO)c1 Amb24524626 [1,1,0,0,0,0|0,0,1]=3 2556 B10R1.10 Oc1cccc(c1)OCO Amb25712897 [1,1,0,0,0,0|1,0,1]=4 2557 B10R1.10 Oc1cccc(c1)\C=N/O Amb25162781 [1,1,0,0,0,0|0,0,0]=2 2558 B10R1.10 SCCc1cccc(c1)Br Amb17404678 [1,1,0,0,0,0|0,1,1]=4 2559 B10R1.10 SCCc1cccc(c1)C Amb17399939 [1,1,0,0,0,0|0,1,1]=4 2560 B10R1.10 SCCc1cccc(c1)Cl Amb17400375 [1,1,0,0,0,0|0,1,1]=4 2561 B10R1.10 SCCc1cccc(c1)F Amb17400006 [1,1,0,0,0,0|0,1,1]=4 2562 B10R1.10 Sc1cc(CCCl)ccc1 Amb24627571 [1,1,0,0,0,0|1,0,1]=4 2563 B10R1.10 [NH3+]OCc1cccc(c1)Br Amb2444298 [1,1,0,0,0,0|1,0,1]=4 2564 B10R1.10 [NH3+]OCc1cccc(c1)Cl Amb2405661 [1,1,0,0,0,0|1,0,1]=4 2565 B10R1.10 [NH3+]OCc1cccc(c1)F Amb2424153 [1,1,0,0,0,0|1,0,1]=4 2566 B10R1.10 [O-][n+]1cc(CC=O)ccc1 Amb24099139 [1,1,0,0,0,0|1,0,1]=4 2567 B10R1.10 [O-][n+]1cc(\C=N\O)ccc1 Amb22522547 [1,1,0,0,0,0|1,0,0]=3 2568 B10R1.10 [O-]c1c[n+](CCO)ccc1 Amb24464239 [1,1,0,0,0,0|1,0,1]=4 2569 B10R1.15 BrCC(=O)c1ccccc1 Amb1102084 [1,1,0,0,0,0|2,0,0]=4 2570 B10R1.15 BrCC(c1ccccc1)O Amb17206105 [1,1,0,0,0,0|1,0,1]=4 2571 B10R1.15 Br[13CH2]C(Br)c1ccccc1 Amb22367266 [1,1,0,0,0,0|1,0,1]=4 2572 B10R1.15 C#CC(=O)c1ccccc1 Amb1088846 [1,1,0,0,0,0|2,0,0]=4 2573 B10R1.15 C#CC(N)c1ccccc1 Amb23504019 [1,1,0,0,0,0|1,0,1]=4 2574 B10R1.15 C#C[C@@H](Cl)c1ccccc1 Amb25114793 [1,1,0,0,0,0|1,0,1]=4 2575 B10R1.15 C#C[C@H](N)c1ccccc1 Amb25757944 [1,1,0,0,0,0|1,0,1]=4 2576 B10R1.15 C#C[C@H](O)c1ccccc1 Amb22360907 [1,1,0,0,0,0|1,0,1]=4 2577 B10R1.15 C/C=C(\C)c1ccccc1 Amb17940650 [1,1,0,0,0,0|1,0,1]=4 2578 B10R1.15 C=C(CO)c1ccc[n]c1 Amb25829121 [1,1,0,0,0,0|2,0,0]=4 2579 B10R1.15 C=C([Zn]Br)c1ccccc1 Amb22000417 [1,1,0,0,0,0|2,0,0]=4 2580 B10R1.15 C=CC(=O)c1ccccc1 Amb18062256 [1,1,0,0,0,0|1,0,1]=4 2581 B10R1.15 C=CC(N)c1cc[n]cc1 Amb25789567 [1,1,0,0,0,0|2,0,0]=4 2582 B10R1.15 C=CC(N)c1cccc[n]1 Amb24561652 [1,1,0,0,0,0|2,0,0]=4 2583 B10R1.15 C=CC(N)c1ccccc1 Amb18642931 [1,1,0,0,0,0|1,0,0]=3 2584 B10R1.15 C=CC(N)c1ccccc1 Amb22584092 [1,1,0,0,0,0|1,0,0]=3 2585 B10R1.15 C=CC(O)c1cc[n]cc1 Amb24546417 [1,1,0,0,0,0|2,0,0]=4 2586 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [1,1,0,0,0,0|1,0,0]=3 2587 B10R1.15 C=CS(=O)c1ccccc1 Amb15692858 [1,1,0,0,0,0|2,0,0]=4 2588 B10R1.15 C=C[C@@H](N)c1cccc[n]1 Amb25146457 [1,1,0,0,0,0|2,0,0]=4 2589 B10R1.15 C=C[C@@H](O)c1c[n]ccc1 Amb25335661 [1,1,0,0,0,0|2,0,0]=4 2590 B10R1.15 C=C[C@@H](O)c1cccc[n]1 Amb25109191 [1,1,0,0,0,0|2,0,0]=4 2591 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [1,1,0,0,0,0|1,0,0]=3 2592 B10R1.15 C=C[C@H](N)c1cccc[n]1 Amb25237215 [1,1,0,0,0,0|2,0,0]=4 2593 B10R1.15 C=C[C@H](O)c1cccc[n]1 Amb24105810 [1,1,0,0,0,0|2,0,0]=4 2594 B10R1.15 C=C[C@H](O)c1ccccc1 Amb22348430 [1,1,0,0,0,0|1,0,0]=3 2595 B10R1.15 C=C[S@@](=O)c1ccccc1 Amb22747463 [1,1,0,0,0,0|2,0,0]=4 2596 B10R1.15 CC(C#C)c1ccccc1 Amb24106607 [1,1,0,0,0,0|1,0,1]=4 2597 B10R1.15 CC(C=O)c1c[n]ccc1 Amb24100578 [1,1,0,0,0,0|1,0,1]=4 2598 B10R1.15 CC(CN)c1ccccc1 Amb19958781 [1,1,0,0,0,0|0,0,2]=4 2599 B10R1.15 CC(CO)c1cc[n]cc1 Amb24480432 [1,1,0,0,0,0|1,0,1]=4 2600 B10R1.15 CC(CO)c1cccc[n]1 Amb22896757 [1,1,0,0,0,0|1,0,1]=4 2601 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [1,1,0,0,0,0|1,0,1]=4 2602 B10R1.15 CC([Zn]Br)c1ccccc1 Amb22000433 [1,1,0,0,0,0|2,0,0]=4 2603 B10R1.15 CC([Zn]Cl)c1ccccc1 Amb22052836 [1,1,0,0,0,0|2,0,0]=4 2604 B10R1.15 CC(c1ccccc1)C#N Amb2387010 [1,1,0,0,0,0|0,0,2]=4 2605 B10R1.15 CC=C(F)c1ccccc1 Amb22008093 [1,1,0,0,0,0|1,0,1]=4 2606 B10R1.15 CCC(=C)c1ccccc1 Amb22234837 [1,1,0,0,0,0|2,0,0]=4 2607 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [1,1,0,0,0,0|1,0,1]=4 2608 B10R1.15 CCC(c1ccccc1)N Amb1108026 [1,1,0,0,0,0|1,0,1]=4 2609 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [1,1,0,0,0,0|1,0,1]=4 2610 B10R1.15 CC[C@H](Cl)c1ccccc1 Amb24429104 [1,1,0,0,0,0|1,0,1]=4 2611 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [1,1,0,0,0,0|1,0,1]=4 2612 B10R1.15 CN([13CH]=O)c1ccccc1 Amb22351846 [1,1,0,0,0,0|1,0,1]=4 2613 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [1,1,0,0,0,0|1,0,1]=4 2614 B10R1.15 CNC(=O)c1ccccc1 Amb1793916 [1,1,0,0,0,0|1,0,1]=4 2615 B10R1.15 CNC(=S)c1ccccc1 Amb10552988 [1,1,0,0,0,0|1,0,1]=4 2616 B10R1.15 CNC(c1ccccc1)C Amb1215689 [1,1,0,0,0,0|1,0,1]=4 2617 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [1,1,0,0,0,0|1,0,1]=4 2618 B10R1.15 CN[C@@H](C)c1ccccc1 Amb22899444 [1,1,0,0,0,0|1,0,1]=4 2619 B10R1.15 CN[C@@H](c1ccccc1)C Amb10844610 [1,1,0,0,0,0|1,0,1]=4 2620 B10R1.15 COC(=C)c1ccccc1 Amb10558859 [1,1,0,0,0,0|2,0,0]=4 2621 B10R1.15 COC(=S)c1ccccc1 Amb10569749 [1,1,0,0,0,0|2,0,0]=4 2622 B10R1.15 COC(=[NH2+])c1ccccc1 Amb10241351 [1,1,0,0,0,0|2,0,0]=4 2623 B10R1.15 COC(C)c1ccccc1 Amb23568513 [1,1,0,0,0,0|2,0,0]=4 2624 B10R1.15 COC(Cl)c1ccccc1 Amb17940179 [1,1,0,0,0,0|2,0,0]=4 2625 B10R1.15 COC(O)c1ccccc1 Amb25225981 [1,1,0,0,0,0|2,0,0]=4 2626 B10R1.15 CO[13C](=O)c1ccccc1 Amb22363354 [1,1,0,0,0,0|2,0,0]=4 2627 B10R1.15 CO[C@@H](Cl)c1ccccc1 Amb25108131 [1,1,0,0,0,0|2,0,0]=4 2628 B10R1.15 CPC(O)c1ccccc1 Amb25144461 [1,1,0,0,0,0|1,1,0]=4 2629 B10R1.15 CSC(=N)c1ccccc1 Amb22488568 [1,1,0,0,0,0|2,0,0]=4 2630 B10R1.15 CSC(=N)c1ccccc1 Amb24542868 [1,1,0,0,0,0|2,0,0]=4 2631 B10R1.15 CSC(=S)c1ccccc1 Amb24395059 [1,1,0,0,0,0|2,0,0]=4 2632 B10R1.15 C[C@@H](C=O)c1ccccc1 Amb24399258 [1,1,0,0,0,0|0,0,1]=3 2633 B10R1.15 C[C@@H](CBr)c1ccccc1 Amb25786304 [1,1,0,0,0,0|1,0,1]=4 2634 B10R1.15 C[C@@H](CCl)c1ccccc1 Amb24632311 [1,1,0,0,0,0|1,0,1]=4 2635 B10R1.15 C[C@@H](NN)c1ccccc1 Amb25824988 [1,1,0,0,0,0|1,0,1]=4 2636 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [1,1,0,0,0,0|0,0,1]=3 2637 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [1,1,0,0,0,0|0,0,1]=3 2638 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [1,1,0,0,0,0|1,0,1]=4 2639 B10R1.15 C[C@H](C=O)c1ccccc1 Amb24476962 [1,1,0,0,0,0|0,0,1]=3 2640 B10R1.15 C[C@H](CCl)c1ccccc1 Amb24658260 [1,1,0,0,0,0|1,0,1]=4 2641 B10R1.15 C[C@H](NO)c1cc[n]cc1 Amb24630448 [1,1,0,0,0,0|1,0,1]=4 2642 B10R1.15 C[C@H](NO)c1ccccc1 Amb20670900 [1,1,0,0,0,0|0,0,1]=3 2643 B10R1.15 C[C@H](NO)c1ccccc1 Amb22736688 [1,1,0,0,0,0|0,0,1]=3 2644 B10R1.15 C\C(=C/Br)\c1ccccc1 Amb25066105 [1,1,0,0,0,0|1,0,1]=4 2645 B10R1.15 C\C(=C\N)\c1ccccc1 Amb24674165 [1,1,0,0,0,0|0,0,2]=4 2646 B10R1.15 C\C(=C\O)\c1cc[n]cc1 Amb24661195 [1,1,0,0,0,0|1,0,1]=4 2647 B10R1.15 C\C(=C\O)\c1cccc[n]1 Amb24100288 [1,1,0,0,0,0|1,0,1]=4 2648 B10R1.15 C\C(=N/N)\c1cccc[n]1 Amb22552431 [1,1,0,0,0,0|2,0,0]=4 2649 B10R1.15 C\C(=N/O)\c1cc[n][n]c1 Amb22236262 [1,1,0,0,0,0|2,0,0]=4 2650 B10R1.15 C\C(=N/[O-])\c1cccc[n]1 Amb19941776 [1,1,0,0,0,0|1,0,1]=4 2651 B10R1.15 C\C(=N\C)\c1c[n]ccc1 Amb25230944 [1,1,0,0,0,0|2,0,0]=4 2652 B10R1.15 C\C(=N\C)\c1cccc[n]1 Amb24433259 [1,1,0,0,0,0|2,0,0]=4 2653 B10R1.15 C\C(=N\N)\c1cc[n]cc1 Amb25092436 [1,1,0,0,0,0|2,0,0]=4 2654 B10R1.15 C\C(=N\N)\c1cccc[n]1 Amb22586427 [1,1,0,0,0,0|2,0,0]=4 2655 B10R1.15 C\C(=N\O)\c1[n]ccc[n]1 Amb24100259 [1,1,0,0,0,0|2,0,0]=4 2656 B10R1.15 C\C(=N\O)\c1cnccn1 Amb2420090 [1,1,0,0,0,0|2,0,0]=4 2657 B10R1.15 C\C(=N\[O-])\c1cccc[n]1 Amb21867755 [1,1,0,0,0,0|1,0,1]=4 2658 B10R1.15 C\C(=N\[O-])\c1cccc[n]1 Amb21867825 [1,1,0,0,0,0|1,0,1]=4 2659 B10R1.15 C\C(=N\[O-])\c1cccc[n]1 Amb21867883 [1,1,0,0,0,0|1,0,1]=4 2660 B10R1.15 C\N=C(/N)\c1c[n]ccc1 Amb21970335 [1,1,0,0,0,0|2,0,0]=4 2661 B10R1.15 C\N=C(\Cl)/c1ccccc1 Amb25835717 [1,1,0,0,0,0|1,0,0]=3 2662 B10R1.15 C\[N+](=C\Cl)\c1ccccc1 Amb24740754 [1,1,0,0,0,0|2,0,0]=4 2663 B10R1.15 ClC(C#C)c1ccccc1 Amb17670636 [1,1,0,0,0,0|1,0,1]=4 2664 B10R1.15 ClC(C=C)c1ccccc1 Amb17943120 [1,1,0,0,0,0|1,0,0]=3 2665 B10R1.15 ClC(CBr)c1ccccc1 Amb24079929 [1,1,0,0,0,0|1,0,1]=4 2666 B10R1.15 ClCC(c1ccccc1)C Amb17232147 [1,1,0,0,0,0|1,0,1]=4 2667 B10R1.15 ClC[C@@H](c1ccccc1)O Amb16231709 [1,1,0,0,0,0|1,0,1]=4 2668 B10R1.15 ClC[C@H](Cl)c1ccccc1 Amb25131628 [1,1,0,0,0,0|1,0,1]=4 2669 B10R1.15 Cl\C(=C\Cl)\c1ccccc1 Amb25849275 [1,1,0,0,0,0|1,0,1]=4 2670 B10R1.15 FC(CBr)c1ccccc1 Amb20075900 [1,1,0,0,0,0|1,0,1]=4 2671 B10R1.15 FCC(=O)c1ccccc1 Amb10603600 [1,1,0,0,0,0|2,0,0]=4 2672 B10R1.15 FCC(Br)c1ccccc1 Amb25366148 [1,1,0,0,0,0|1,0,1]=4 2673 B10R1.15 FCC(Cl)c1ccccc1 Amb25361037 [1,1,0,0,0,0|1,0,1]=4 2674 B10R1.15 FCC(c1ccccc1)N Amb2372575 [1,1,0,0,0,0|1,0,1]=4 2675 B10R1.15 F\C(=C/Cl)\c1ccccc1 Amb24589902 [1,1,0,0,0,0|1,0,1]=4 2676 B10R1.15 F\C(=C\F)\c1ccccc1 Amb25762778 [1,1,0,0,0,0|1,0,1]=4 2677 B10R1.15 N#CC(=C)c1ccccc1 Amb17231856 [1,1,0,0,0,0|2,0,0]=4 2678 B10R1.15 N#CC(Cl)c1ccccc1 Amb18787437 [1,1,0,0,0,0|0,0,2]=4 2679 B10R1.15 N#CC(F)c1ccccc1 Amb22747439 [1,1,0,0,0,0|0,0,2]=4 2680 B10R1.15 N#C[C@@H](Br)c1ccccc1 Amb24479015 [1,1,0,0,0,0|0,0,2]=4 2681 B10R1.15 N#C[C@@H](O)c1ccccc1 Amb22744732 [1,1,0,0,0,0|0,0,2]=4 2682 B10R1.15 N#C[C@H](O)c1ccccc1 Amb21618705 [1,1,0,0,0,0|0,0,2]=4 2683 B10R1.15 N=C(OO)c1ccc[n]c1 Amb24062391 [1,1,0,0,0,0|2,0,0]=4 2684 B10R1.15 N=NC(=O)c1cc[n]cc1 Amb24102954 [1,1,0,0,0,0|2,0,0]=4 2685 B10R1.15 NC(=NN)c1ccccc1 Amb22488579 [1,1,0,0,0,0|1,0,0]=3 2686 B10R1.15 NC(=S=O)c1ccccc1 Amb24406743 [1,1,0,0,0,0|1,0,1]=4 2687 B10R1.15 NC(CBr)c1ccccc1 Amb25690830 [1,1,0,0,0,0|1,0,1]=4 2688 B10R1.15 NC(CI)c1ccccc1 Amb24404731 [1,1,0,0,0,0|1,0,1]=4 2689 B10R1.15 NC(CO)c1c[n]ccc1 Amb22756404 [1,1,0,0,0,0|1,0,1]=4 2690 B10R1.15 NC(CO)c1cc[n]cc1 Amb18561776 [1,1,0,0,0,0|1,0,1]=4 2691 B10R1.15 NC(CO)c1cccc[n]1 Amb18560041 [1,1,0,0,0,0|1,0,1]=4 2692 B10R1.15 NC(CO)c1ccccn1 Amb17935880 [1,1,0,0,0,0|1,0,1]=4 2693 B10R1.15 NC(CO)c1ccncc1 Amb17935881 [1,1,0,0,0,0|1,0,1]=4 2694 B10R1.15 NC(CS)c1ccccc1 Amb25061358 [1,1,0,0,0,0|0,1,1]=4 2695 B10R1.15 NCC(=C)c1ccccc1 Amb10609068 [1,1,0,0,0,0|2,0,0]=4 2696 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [1,1,0,0,0,0|2,0,0]=4 2697 B10R1.15 NCC(Br)c1ccccc1 Amb19516007 [1,1,0,0,0,0|0,0,2]=4 2698 B10R1.15 NCC(F)c1ccccc1 Amb23454844 [1,1,0,0,0,0|0,0,2]=4 2699 B10R1.15 NCC(N)c1ccccc1 Amb21857142 [1,1,0,0,0,0|0,0,2]=4 2700 B10R1.15 NCC(O)c1ccccc1 Amb21961704 [1,1,0,0,0,0|0,0,2]=4 2701 B10R1.15 NCC(S)c1ccccc1 Amb18125608 [1,1,0,0,0,0|0,0,2]=4 2702 B10R1.15 NCC(S)c1ccccc1 Amb24106048 [1,1,0,0,0,0|0,0,2]=4 2703 B10R1.15 NCC(c1ccccc1)C Amb1085937 [1,1,0,0,0,0|0,0,2]=4 2704 B10R1.15 NCC(c1ccccc1)O Amb2383121 [1,1,0,0,0,0|0,0,2]=4 2705 B10R1.15 NC[C@@H](Cl)c1ccccc1 Amb24717355 [1,1,0,0,0,0|0,0,2]=4 2706 B10R1.15 NC[C@@H](F)c1ccccc1 Amb25279947 [1,1,0,0,0,0|0,0,2]=4 2707 B10R1.15 NC[C@@H](O)c1ccccc1 Amb24107154 [1,1,0,0,0,0|0,0,2]=4 2708 B10R1.15 NC[C@@H](c1ccccc1)O Amb10070626 [1,1,0,0,0,0|0,0,2]=4 2709 B10R1.15 NC[C@H](F)c1ccccc1 Amb25044881 [1,1,0,0,0,0|0,0,2]=4 2710 B10R1.15 NC[C@H](N)c1ccccc1 Amb25757101 [1,1,0,0,0,0|0,0,2]=4 2711 B10R1.15 NC[C@H](c1ccccc1)C Amb10070369 [1,1,0,0,0,0|0,0,2]=4 2712 B10R1.15 NNC(=N)c1ccccc1 Amb22234855 [1,1,0,0,0,0|1,0,1]=4 2713 B10R1.15 NNC(=N)c1ccccc1 Amb22481319 [1,1,0,0,0,0|1,0,1]=4 2714 B10R1.15 NNC(=N)c1ccccc1 Amb22756451 [1,1,0,0,0,0|1,0,1]=4 2715 B10R1.15 NNC(=O)c1ccccc1 Amb1208583 [1,1,0,0,0,0|1,0,1]=4 2716 B10R1.15 NNC(=S)c1ccccc1 Amb23513674 [1,1,0,0,0,0|1,0,1]=4 2717 B10R1.15 NNC(O)c1ccccc1 Amb25306494 [1,1,0,0,0,0|1,0,1]=4 2718 B10R1.15 NNC(c1ccccc1)C Amb10610271 [1,1,0,0,0,0|1,0,1]=4 2719 B10R1.15 NOC(=O)c1ccccc1 Amb22054026 [1,1,0,0,0,0|2,0,0]=4 2720 B10R1.15 NOC(c1ccccc1)C Amb17089185 [1,1,0,0,0,0|1,0,1]=4 2721 B10R1.15 N[C@@H](C#N)c1ccccc1 Amb18039831 [1,1,0,0,0,0|0,0,2]=4 2722 B10R1.15 N[C@@H](C#N)c1ccccc1 Amb22746711 [1,1,0,0,0,0|0,0,2]=4 2723 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887019 [1,1,0,0,0,0|1,0,1]=4 2724 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887020 [1,1,0,0,0,0|1,0,1]=4 2725 B10R1.15 N[C@@H](CO)c1c[n]ccc1 Amb25146409 [1,1,0,0,0,0|1,0,1]=4 2726 B10R1.15 N[C@@H](CO)c1cc[n]cc1 Amb25146410 [1,1,0,0,0,0|1,0,1]=4 2727 B10R1.15 N[C@@H](CO)c1cccc[n]1 Amb22756435 [1,1,0,0,0,0|1,0,1]=4 2728 B10R1.15 N[C@@H](CS)c1ccccc1 Amb25689822 [1,1,0,0,0,0|0,1,1]=4 2729 B10R1.15 N[C@@H](c1ccccc1)C#N Amb17399826 [1,1,0,0,0,0|0,0,2]=4 2730 B10R1.15 N[C@H](CBr)c1ccccc1 Amb24391587 [1,1,0,0,0,0|1,0,1]=4 2731 B10R1.15 N[C@H](CO)c1c[n]ccc1 Amb24712243 [1,1,0,0,0,0|1,0,1]=4 2732 B10R1.15 N[C@H](CO)c1cc[n]cc1 Amb24714739 [1,1,0,0,0,0|1,0,1]=4 2733 B10R1.15 N[C@H](CS)c1ccccc1 Amb25111122 [1,1,0,0,0,0|0,1,1]=4 2734 B10R1.15 N\C(=C\N)\c1ccccc1 Amb25147590 [1,1,0,0,0,0|0,0,2]=4 2735 B10R1.15 N\C(=C\O)\c1ccccc1 Amb25675946 [1,1,0,0,0,0|0,0,1]=3 2736 B10R1.15 N\C(=N/Br)\c1ccccc1 Amb25046590 [1,1,0,0,0,0|1,0,0]=3 2737 B10R1.15 N\C(=N/N)\c1ccccc1 Amb20407822 [1,1,0,0,0,0|1,0,0]=3 2738 B10R1.15 N\C(=N/O)\c1cnccn1 Amb2436112 [1,1,0,0,0,0|2,0,0]=4 2739 B10R1.15 N\C(=N\Cl)\c1ccccc1 Amb24571718 [1,1,0,0,0,0|1,0,0]=3 2740 B10R1.15 N\C(=N\I)\c1ccccc1 Amb24599616 [1,1,0,0,0,0|1,0,0]=3 2741 B10R1.15 N\N=C(/c1ccncc1)\N Amb10608780 [1,1,0,0,0,0|2,0,0]=4 2742 B10R1.15 N\N=C(\c1ccccc1)/N Amb10608779 [1,1,0,0,0,0|1,0,0]=3 2743 B10R1.15 N\N=C(\c1ccncc1)/C Amb10552809 [1,1,0,0,0,0|2,0,0]=4 2744 B10R1.15 O/C=C(\O)c1ccccc1 Amb17943089 [1,1,0,0,0,0|0,0,1]=3 2745 B10R1.15 O/N=C(/O)c1ccccc1 Amb17843421 [1,1,0,0,0,0|0,0,0]=2 2746 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [1,1,0,0,0,0|2,0,0]=4 2747 B10R1.15 O=C(N=O)c1ccccc1 Amb24096802 [1,1,0,0,0,0|0,0,1]=3 2748 B10R1.15 O=C(NCl)c1ccccc1 Amb25277317 [1,1,0,0,0,0|1,0,1]=4 2749 B10R1.15 O=CC(=C)c1ccccc1 Amb16233227 [1,1,0,0,0,0|0,0,2]=4 2750 B10R1.15 O=CC(Br)c1ccccc1 Amb18130512 [1,1,0,0,0,0|0,0,1]=3 2751 B10R1.15 O=CC(Cl)c1ccccc1 Amb18644699 [1,1,0,0,0,0|0,0,1]=3 2752 B10R1.15 O=CC(F)c1ccccc1 Amb24117053 [1,1,0,0,0,0|0,0,1]=3 2753 B10R1.15 O=CC(c1ccccc1)O Amb17593446 [1,1,0,0,0,0|0,0,1]=3 2754 B10R1.15 O=C[C@@H](F)c1ccccc1 Amb24564571 [1,1,0,0,0,0|0,0,1]=3 2755 B10R1.15 OC(CF)c1ccccc1 Amb22731897 [1,1,0,0,0,0|1,0,1]=4 2756 B10R1.15 OCC(=C)c1ccccn1 Amb10552982 [1,1,0,0,0,0|2,0,0]=4 2757 B10R1.15 OCC(=O)c1cc[n]cc1 Amb18063686 [1,1,0,0,0,0|2,0,0]=4 2758 B10R1.15 OCC(=O)c1ccc[n]c1 Amb18063681 [1,1,0,0,0,0|2,0,0]=4 2759 B10R1.15 OCC(=O)c1cccc[n]1 Amb18063640 [1,1,0,0,0,0|2,0,0]=4 2760 B10R1.15 OCC(F)c1cccc[n]1 Amb24518945 [1,1,0,0,0,0|1,0,1]=4 2761 B10R1.15 OCC(F)c1ccccc1 Amb24105399 [1,1,0,0,0,0|0,0,1]=3 2762 B10R1.15 OCC(O)c1c[n]ccc1 Amb23538717 [1,1,0,0,0,0|1,0,1]=4 2763 B10R1.15 OCC(O)c1cc[n]cc1 Amb23538718 [1,1,0,0,0,0|1,0,1]=4 2764 B10R1.15 OCC(S)c1ccccc1 Amb25333535 [1,1,0,0,0,0|0,0,1]=3 2765 B10R1.15 OC[C@@H](Br)c1ccccc1 Amb25770108 [1,1,0,0,0,0|0,0,1]=3 2766 B10R1.15 OC[C@@H](Cl)c1ccccc1 Amb24417788 [1,1,0,0,0,0|0,0,1]=3 2767 B10R1.15 OC[C@@H](F)c1ccccc1 Amb25320636 [1,1,0,0,0,0|0,0,1]=3 2768 B10R1.15 OC[C@@H](S)c1ccccc1 Amb24504991 [1,1,0,0,0,0|0,0,1]=3 2769 B10R1.15 OC[C@H](O)c1c[n]ccc1 Amb24433399 [1,1,0,0,0,0|1,0,1]=4 2770 B10R1.15 OC[C@H](O)c1cc[n]cc1 Amb25831641 [1,1,0,0,0,0|1,0,1]=4 2771 B10R1.15 ON(C=O)c1ccccc1 Amb25027443 [1,1,0,0,0,0|1,0,1]=4 2772 B10R1.15 ON(N=O)c1ccccc1 Amb17666641 [1,1,0,0,0,0|1,0,1]=4 2773 B10R1.15 ON(N=O)c1ccccc1 Amb22001406 [1,1,0,0,0,0|1,0,1]=4 2774 B10R1.15 ON=C(Cl)c1c[n]c[n]c1 Amb24596881 [1,1,0,0,0,0|2,0,0]=4 2775 B10R1.15 ON=C(Cl)c1cc[n]cc1 Amb22446639 [1,1,0,0,0,0|1,0,0]=3 2776 B10R1.15 ONC(=N)c1ccccc1 Amb17231893 [1,1,0,0,0,0|0,0,1]=3 2777 B10R1.15 ONC(=N)c1cccnc1 Amb10576590 [1,1,0,0,0,0|1,0,1]=4 2778 B10R1.15 ONC(=O)c1ccccc1 Amb1645521 [1,1,0,0,0,0|0,0,1]=3 2779 B10R1.15 ONC(c1ccccc1)C Amb10605006 [1,1,0,0,0,0|0,0,1]=3 2780 B10R1.15 ONC(c1ccccn1)C Amb10605008 [1,1,0,0,0,0|1,0,1]=4 2781 B10R1.15 ONC(c1cccnc1)C Amb10605009 [1,1,0,0,0,0|1,0,1]=4 2782 B10R1.15 ONC(c1ccncc1)C Amb10605014 [1,1,0,0,0,0|1,0,1]=4 2783 B10R1.15 OOC(=O)c1cc[n]cc1 Amb24066209 [1,1,0,0,0,0|2,0,0]=4 2784 B10R1.15 OOC(=O)c1ccc[n]c1 Amb24094187 [1,1,0,0,0,0|2,0,0]=4 2785 B10R1.15 OOC(=O)c1ccccc1 Amb17672281 [1,1,0,0,0,0|1,0,0]=3 2786 B10R1.15 O[C@@H](CBr)c1ccccc1 Amb19929326 [1,1,0,0,0,0|1,0,1]=4 2787 B10R1.15 O[C@@H](CF)c1ccccc1 Amb24389146 [1,1,0,0,0,0|1,0,1]=4 2788 B10R1.15 O[C@@H](CI)c1ccccc1 Amb25738089 [1,1,0,0,0,0|1,0,1]=4 2789 B10R1.15 O[C@@H](c1ccccc1)C#C Amb10844978 [1,1,0,0,0,0|1,0,1]=4 2790 B10R1.15 O[C@H](CBr)c1ccccc1 Amb19929329 [1,1,0,0,0,0|1,0,1]=4 2791 B10R1.15 O[C@H](CF)c1ccccc1 Amb24437736 [1,1,0,0,0,0|1,0,1]=4 2792 B10R1.15 O\C(=C/Cl)\c1ccccc1 Amb24068872 [1,1,0,0,0,0|1,0,1]=4 2793 B10R1.15 O\C(=C/F)\c1ccccc1 Amb24068873 [1,1,0,0,0,0|1,0,1]=4 2794 B10R1.15 O\C(=C\F)\c1ccccc1 Amb25094625 [1,1,0,0,0,0|1,0,1]=4 2795 B10R1.15 O\C=C(\Cl)/c1ccccc1 Amb25332181 [1,1,0,0,0,0|0,0,1]=3 2796 B10R1.15 O\N=C(/Cl)\c1c[n]cc[n]1 Amb25091101 [1,1,0,0,0,0|2,0,0]=4 2797 B10R1.15 O\N=C(/Cl)\c1cccc[n]1 Amb21857890 [1,1,0,0,0,0|1,0,0]=3 2798 B10R1.15 O\N=C(/c1ccccc1)\N Amb2226909 [1,1,0,0,0,0|0,0,0]=2 2799 B10R1.15 O\N=C(/c1cccnc1)\C Amb10606945 [1,1,0,0,0,0|1,0,0]=3 2800 B10R1.15 O\N=C(/c1cccnc1)\N Amb10075270 [1,1,0,0,0,0|1,0,0]=3 2801 B10R1.15 O\N=C(/c1ccncc1)\N Amb2371661 [1,1,0,0,0,0|1,0,0]=3 2802 B10R1.15 O\N=C(/c1ncccn1)\N Amb10075280 [1,1,0,0,0,0|2,0,0]=4 2803 B10R1.15 O\N=C(\Cl)/c1[n]ccc[n]1 Amb25208499 [1,1,0,0,0,0|2,0,0]=4 2804 B10R1.15 O\N=C(\c1ccccc1)/C Amb2387477 [1,1,0,0,0,0|0,0,0]=2 2805 B10R1.15 O\N=C(\c1ccccc1)/Cl Amb10563288 [1,1,0,0,0,0|0,0,0]=2 2806 B10R1.15 O\N=C(\c1ccccc1)/N Amb1149046 [1,1,0,0,0,0|0,0,0]=2 2807 B10R1.15 O\N=C(\c1ccccn1)/N Amb1161253 [1,1,0,0,0,0|1,0,0]=3 2808 B10R1.15 O\N=C(\c1cccnc1)/N Amb1159396 [1,1,0,0,0,0|1,0,0]=3 2809 B10R1.15 O\N=C(\c1ccncc1)/N Amb1159214 [1,1,0,0,0,0|1,0,0]=3 2810 B10R1.15 O\N=C(\c1ccncn1)/N Amb16747055 [1,1,0,0,0,0|2,0,0]=4 2811 B10R1.15 SCC(=O)c1ccccc1 Amb16192503 [1,1,0,0,0,0|1,1,0]=4 2812 B10R1.15 SCC(c1ccccc1)O Amb10608997 [1,1,0,0,0,0|0,1,1]=4 2813 B10R1.15 [2H]\C(=C\[2H])\c1ccccc1 Amb22353430 [1,1,0,0,0,0|1,0,1]=4 2814 B10R1.15 [O-]NC(=O)c1ccccc1 Amb18800075 [1,1,0,0,0,0|0,0,2]=4 2815 B10R1.15 [O-]NC(=O)c1ccccc1 Amb22527267 [1,1,0,0,0,0|0,0,2]=4 2816 B10R1.18 BrC(Br)=Cc1ccccc1 Amb17843371 [1,1,0,0,0,0|1,0,1]=4 2817 B10R1.18 C=C(Cl)C[n+]1ccccc1 Amb24717958 [1,1,0,0,0,0|2,0,0]=4 2818 B10R1.18 C=C(F)Sc1ccccc1 Amb24630548 [1,1,0,0,0,0|2,0,0]=4 2819 B10R1.18 C=C(O)C=C1C=COC=C1 Amb24407180 [1,1,0,0,0,0|1,0,1]=4 2820 B10R1.18 C=[N+]([O-])Cc1ccccc1 Amb24708106 [1,1,0,0,0,0|0,0,2]=4 2821 B10R1.18 CC(=C)Nc1ccccc1 Amb25269461 [1,1,0,0,0,0|2,0,0]=4 2822 B10R1.18 CC(=N)Cc1cccc[n]1 Amb25315666 [1,1,0,0,0,0|1,0,0]=3 2823 B10R1.18 CC(=N)Nc1ccc[n]c1 Amb25848009 [1,1,0,0,0,0|2,0,0]=4 2824 B10R1.18 CC(=N)Nc1ccccc1 Amb1086198 [1,1,0,0,0,0|1,0,0]=3 2825 B10R1.18 CC(=O)C[n+]1ccccc1 Amb1102043 [1,1,0,0,0,0|1,0,1]=4 2826 B10R1.18 CC(=O)Cc1ccc[n]c1 Amb22587708 [1,1,0,0,0,0|1,0,1]=4 2827 B10R1.18 CC(=O)Cc1ccccn1 Amb1995147 [1,1,0,0,0,0|1,0,1]=4 2828 B10R1.18 CC(=O)Cc1cccnc1 Amb10608569 [1,1,0,0,0,0|1,0,1]=4 2829 B10R1.18 CC(=O)Cc1ccncc1 Amb17935754 [1,1,0,0,0,0|1,0,1]=4 2830 B10R1.18 CC(=O)N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17607311 [1,1,0,0,0,0|1,0,1]=4 2831 B10R1.18 CC(=O)Oc1ccccc1 Amb22367025 [1,1,0,0,0,0|1,0,1]=4 2832 B10R1.18 CC(=O)Sc1ccccc1 Amb10575810 [1,1,0,0,0,0|1,0,1]=4 2833 B10R1.18 CC(=O)[15NH]c1ccccc1 Amb22338649 [1,1,0,0,0,0|1,0,1]=4 2834 B10R1.18 CC(Cc1ccccc1)N Amb17608372 [1,1,0,0,0,0|0,0,2]=4 2835 B10R1.18 CC(Cc1ccccn1)O Amb1995148 [1,1,0,0,0,0|1,0,1]=4 2836 B10R1.18 CC(Cc1cccnc1)O Amb17477790 [1,1,0,0,0,0|1,0,1]=4 2837 B10R1.18 CC(Cc1ccncc1)O Amb17477789 [1,1,0,0,0,0|1,0,1]=4 2838 B10R1.18 CC(Cl)Cc1ccccc1 Amb18787554 [1,1,0,0,0,0|1,0,1]=4 2839 B10R1.18 CC(I)Cc1ccccc1 Amb24616287 [1,1,0,0,0,0|1,0,1]=4 2840 B10R1.18 CC(N)=Pc1ccccc1 Amb25351589 [1,1,0,0,0,0|1,0,1]=4 2841 B10R1.18 CC(N)Cc1ccccc1 Amb22346639 [1,1,0,0,0,0|0,0,2]=4 2842 B10R1.18 CC(N)Cc1ccccc1 Amb22352196 [1,1,0,0,0,0|0,0,2]=4 2843 B10R1.18 CC(O)Sc1ccccc1 Amb25045636 [1,1,0,0,0,0|1,0,1]=4 2844 B10R1.18 CC(S)Cc1ccccc1 Amb18177239 [1,1,0,0,0,0|0,1,1]=4 2845 B10R1.18 CN(C)Cc1ccccc1 Amb22359464 [1,1,0,0,0,0|1,0,1]=4 2846 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [1,1,0,0,0,0|1,0,1]=4 2847 B10R1.18 C[13C](=O)N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367563 [1,1,0,0,0,0|1,0,1]=4 2848 B10R1.18 C[C@@H](Cc1ccccc1)O Amb10068519 [1,1,0,0,0,0|0,0,1]=3 2849 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb19130510 [1,1,0,0,0,0|0,0,2]=4 2850 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb22745694 [1,1,0,0,0,0|0,0,2]=4 2851 B10R1.18 C[C@@H](O)Cc1c[n]ccc1 Amb22896922 [1,1,0,0,0,0|1,0,1]=4 2852 B10R1.18 C[C@@H](O)Cc1ccccc1 Amb17938083 [1,1,0,0,0,0|0,0,1]=3 2853 B10R1.18 C[C@H](Cc1ccccc1)N Amb17608368 [1,1,0,0,0,0|0,0,2]=4 2854 B10R1.18 C[SiH](C)Cc1ccccc1 Amb19893554 [1,1,0,0,0,0|1,1,0]=4 2855 B10R1.18 C[Si](C)Cc1ccccc1 Amb24527863 [1,1,0,0,0,0|1,1,0]=4 2856 B10R1.18 C\C(\O)=C/c1ccccc1 Amb24095309 [1,1,0,0,0,0|0,0,1]=3 2857 B10R1.18 C\C(\O)=C\c1cccc[n]1 Amb24100261 [1,1,0,0,0,0|1,0,1]=4 2858 B10R1.18 ClB(Cl)Cc1ccccc1 Amb25832795 [1,1,0,0,0,0|2,0,0]=4 2859 B10R1.18 ClC(Cl)=Nc1ccccc1 Amb22336308 [1,1,0,0,0,0|2,0,0]=4 2860 B10R1.18 ClC(Cl)Cc1ccccc1 Amb25783924 [1,1,0,0,0,0|1,0,1]=4 2861 B10R1.18 ClP(Cl)Cc1ccccc1 Amb25838123 [1,1,0,0,0,0|1,1,0]=4 2862 B10R1.18 FC(F)Cc1ccccc1 Amb19894546 [1,1,0,0,0,0|1,0,1]=4 2863 B10R1.18 F\C(\Br)=C\c1ccccc1 Amb24053589 [1,1,0,0,0,0|1,0,1]=4 2864 B10R1.18 N=C(O)Nc1ccccc1 Amb19516159 [1,1,0,0,0,0|1,0,0]=3 2865 B10R1.18 NC(=N)Cc1cc[n]cc1 Amb22499359 [1,1,0,0,0,0|1,0,0]=3 2866 B10R1.18 NC(=N)Cc1ccc[n]c1 Amb19890175 [1,1,0,0,0,0|1,0,0]=3 2867 B10R1.18 NC(=N)Nc1cc[n]cc1 Amb22752815 [1,1,0,0,0,0|2,0,0]=4 2868 B10R1.18 NC(=N)Nc1cccc[n]1 Amb24098501 [1,1,0,0,0,0|2,0,0]=4 2869 B10R1.18 NC(=N)Nc1cccc[n]1 Amb25751134 [1,1,0,0,0,0|2,0,0]=4 2870 B10R1.18 NC(=N)Nc1ccccc1 Amb20249360 [1,1,0,0,0,0|1,0,0]=3 2871 B10R1.18 NC(=N)Nc1ccccc1 Amb22732584 [1,1,0,0,0,0|1,0,0]=3 2872 B10R1.18 NC(=N)Oc1ccccc1 Amb24432258 [1,1,0,0,0,0|1,0,0]=3 2873 B10R1.18 NC(=O)Cc1ccc[n]c1 Amb21856113 [1,1,0,0,0,0|1,0,1]=4 2874 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [1,1,0,0,0,0|0,0,1]=3 2875 B10R1.18 NC(=O)Nc1ccccc1 Amb2373965 [1,1,0,0,0,0|1,0,1]=4 2876 B10R1.18 NC(=S)C[n+]1ccccc1 Amb17119656 [1,1,0,0,0,0|1,0,1]=4 2877 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [1,1,0,0,0,0|0,0,1]=3 2878 B10R1.18 NC(=[NH2+])Nc1ccccc1 Amb22734963 [1,1,0,0,0,0|1,0,1]=4 2879 B10R1.18 NC(O)Cc1ccccc1 Amb25348475 [1,1,0,0,0,0|0,0,1]=3 2880 B10R1.18 NS(=N)Cc1ccccc1 Amb25258845 [1,1,0,0,0,0|1,0,0]=3 2881 B10R1.18 N[C@@H](O)Cc1ccccc1 Amb25790547 [1,1,0,0,0,0|0,0,1]=3 2882 B10R1.18 N[C@H](O)Cc1ccccc1 Amb24444592 [1,1,0,0,0,0|0,0,1]=3 2883 B10R1.18 N\C(\O)=C\c1cccc[n]1 Amb24068863 [1,1,0,0,0,0|1,0,1]=4 2884 B10R1.18 O=C(Br)Oc1ccccc1 Amb25174288 [1,1,0,0,0,0|1,0,1]=4 2885 B10R1.18 O=C(Cl)Cc1cc[n]cc1 Amb24446208 [1,1,0,0,0,0|1,0,1]=4 2886 B10R1.18 O=C(Cl)Cc1ccc[n]c1 Amb24605722 [1,1,0,0,0,0|1,0,1]=4 2887 B10R1.18 O=C(Cl)Nc1ccccc1 Amb24425698 [1,1,0,0,0,0|1,0,1]=4 2888 B10R1.18 O=C(F)Nc1ccccc1 Amb22731751 [1,1,0,0,0,0|1,0,1]=4 2889 B10R1.18 OB(Cc1ccccc1)O Amb10071580 [1,1,0,0,0,0|1,0,0]=3 2890 B10R1.18 OB(O)Cc1c[n]ccc1 Amb24699248 [1,1,0,0,0,0|2,0,0]=4 2891 B10R1.18 OB(O)Cc1cc[n]cc1 Amb24105357 [1,1,0,0,0,0|2,0,0]=4 2892 B10R1.18 OC(=O)CC=1CC=CCC1 Amb24120619 [1,1,0,0,0,0|0,0,2]=4 2893 B10R1.18 OC(=O)C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22353637 [1,1,0,0,0,0|0,0,0]=2 2894 B10R1.18 OC(=O)C[N]1=CC=CC=C1 Amb17836439 [1,1,0,0,0,0|1,0,0]=3 2895 B10R1.18 OC(=O)C[n+]1ccccc1 Amb10552774 [1,1,0,0,0,0|1,0,0]=3 2896 B10R1.18 OC(=O)C[n+]1ccccc1 Amb23468426 [1,1,0,0,0,0|1,0,0]=3 2897 B10R1.18 OC(=O)Cc1c[n]cc[n]1 Amb19929342 [1,1,0,0,0,0|2,0,0]=4 2898 B10R1.18 OC(=O)Cc1cc[nH+]cc1 Amb24113836 [1,1,0,0,0,0|1,0,0]=3 2899 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb10807486 [1,1,0,0,0,0|1,0,0]=3 2900 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb24113838 [1,1,0,0,0,0|1,0,0]=3 2901 B10R1.18 OC(=O)Cc1cnccn1 Amb10602133 [1,1,0,0,0,0|2,0,0]=4 2902 B10R1.18 OC(=O)Nc1cc[n]cc1 Amb24070647 [1,1,0,0,0,0|2,0,0]=4 2903 B10R1.18 OC(=O)Nc1ccc[n]c1 Amb24102579 [1,1,0,0,0,0|2,0,0]=4 2904 B10R1.18 OC(=O)[13CH2]c1ccccc1 Amb22351854 [1,1,0,0,0,0|0,0,0]=2 2905 B10R1.18 OC(=S)Cc1cc[n]cc1 Amb24099577 [1,1,0,0,0,0|1,0,0]=3 2906 B10R1.18 OC(=S)Cc1ccccc1 Amb22262974 [1,1,0,0,0,0|0,0,0]=2 2907 B10R1.18 OC(=S)Nc1ccccc1 Amb24669066 [1,1,0,0,0,0|1,0,0]=3 2908 B10R1.18 OC(F)Cc1ccccc1 Amb25147731 [1,1,0,0,0,0|0,0,1]=3 2909 B10R1.18 OC(O)C[n+]1ccccc1 Amb25149726 [1,1,0,0,0,0|1,0,1]=4 2910 B10R1.18 OC(O)Cc1ccccc1 Amb24639712 [1,1,0,0,0,0|0,0,1]=3 2911 B10R1.18 OP(=O)Cc1cccc[n]1 Amb25787147 [1,1,0,0,0,0|1,1,0]=4 2912 B10R1.18 OP(=O)Cc1ccccc1 Amb24617740 [1,1,0,0,0,0|0,1,0]=3 2913 B10R1.18 OP(=O)Oc1ccccc1 Amb24520486 [1,1,0,0,0,0|1,1,0]=4 2914 B10R1.18 O[13C](=O)Cc1ccccc1 Amb22363120 [1,1,0,0,0,0|0,0,0]=2 2915 B10R1.18 O[13C](=O)[13CH2]c1ccccc1 Amb22351754 [1,1,0,0,0,0|0,0,0]=2 2916 B10R1.18 O[14C](=O)Cc1ccccc1 Amb22337596 [1,1,0,0,0,0|0,0,0]=2 2917 B10R1.18 S=C(Cl)Cc1cc[n]cc1 Amb24401128 [1,1,0,0,0,0|1,1,0]=4 2918 B10R1.18 SC(=O)Cc1ccccc1 Amb10561701 [1,1,0,0,0,0|0,0,1]=3 2919 B10R1.18 [2H]C([2H])=Cc1ccccc1 Amb22363280 [1,1,0,0,0,0|1,0,1]=4 2920 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10552724 [1,1,0,0,0,0|1,0,1]=4 2921 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10552757 [1,1,0,0,0,0|1,0,1]=4 2922 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10573238 [1,1,0,0,0,0|1,0,1]=4 2923 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb22345878 [1,1,0,0,0,0|1,0,1]=4 2924 B10R1.18 [O-]C(=O)Cc1ccc[n]c1 Amb21618883 [1,1,0,0,0,0|1,0,1]=4 2925 B10R1.18 [O-]C(=O)Cc1cccc[n]1 Amb22000882 [1,1,0,0,0,0|1,0,1]=4 2926 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20240609 [1,1,0,0,0,0|0,0,1]=3 2927 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20246797 [1,1,0,0,0,0|0,0,1]=3 2928 B10R1.18 [O-][N+](=O)Cc1ccccc1 Amb10606416 [1,1,0,0,0,0|0,0,2]=4 2929 B10R1.18 [O-][N+](O)=Cc1cccc[n]1 Amb24100496 [1,1,0,0,0,0|1,0,1]=4 2930 B10R1.18 [O-]\[N+](=C/c1ccccc1)\C Amb2420785 [1,1,0,0,0,0|0,0,2]=4 2931 B10R1.11 CC(\C=N\O)c1ccco1 Amb24727285 [0,1,0,0,1,0|1,0,0]=3 2932 B10R1.11 O\N=C\C(=O)c1ccco1 Amb25195877 [0,1,0,0,1,0|1,0,1]=4 2933 B10R1.11 O\N=C\C(=O)c1cccs1 Amb10576356 [0,1,0,0,1,0|1,0,1]=4 2934 B10R1.16 O\N=C\C[n+]1ccn(c1)C Amb1971452 [0,1,0,0,1,0|2,0,0]=4 2935 B10R1.21 OC\C=C\Cc1ccco1 Amb25261764 [0,1,0,0,1,0|2,0,0]=4 2936 B10R1.27 C\C(\Cc1cc[s]c1)=N\N Amb24421258 [0,1,0,0,1,0|2,0,0]=4 2937 B10R1.27 C\C(\Cc1ccc[s]1)=N\N Amb25821337 [0,1,0,0,1,0|2,0,0]=4 2938 B10R1.27 C\C(\Cc1ccco1)=N\N Amb25044890 [0,1,0,0,1,0|2,0,0]=4 2939 B10R1.27 C\C(\Cc1ccco1)=N\O Amb24476867 [0,1,0,0,1,0|1,0,0]=3 2940 B10R1.27 NC(Cc1c[nH]c[n]1)=NO Amb25376721 [0,1,0,0,1,0|2,0,0]=4 2941 B10R1.27 NC(Cc1c[s]c[n]1)=NO Amb25140744 [0,1,0,0,1,0|2,0,0]=4 2942 B10R1.27 NC(Cc1cc[n][nH]1)=NO Amb24586254 [0,1,0,0,1,0|2,0,0]=4 2943 B10R1.27 NC(Cc1ccc[s]1)=NN Amb18787584 [0,1,0,0,1,0|2,0,0]=4 2944 B10R1.27 N\C(\Cc1c[s]cc1)=N\N Amb18787582 [0,1,0,0,1,0|2,0,0]=4 2945 B10R1.27 N\C(\Cc1ccoc1)=N\O Amb24730300 [0,1,0,0,1,0|1,0,0]=3 2946 B10R1.27 OCC(=O)Cc1c[s]cc1 Amb25096464 [0,1,0,0,1,0|2,0,0]=4 2947 B10R1.27 OCC(=O)Cc1ccc[s]1 Amb24636460 [0,1,0,0,1,0|2,0,0]=4 2948 B10R1.27 ONC(=O)Cc1ccco1 Amb25050997 [0,1,0,0,1,0|1,0,1]=4 2949 B12R1.1 C=C\C=C\Cc1ccc(O)cc1 Amb18645358 [0,2,0,0,0,0|2,0,0]=4 2950 B12R1.1 CC\C=C\Cc1ccc(O)cc1 Amb24612459 [0,2,0,0,0,0|2,0,0]=4 2951 B12R1.1 COCSCc1ccc(cc1)N Amb17498310 [0,2,0,0,0,0|2,0,0]=4 2952 B12R1.1 COC\C=C\c1ccc(O)cc1 Amb25205735 [0,2,0,0,0,0|1,0,1]=4 2953 B12R1.1 C\C=C\CNc1ccc(Br)cc1 Amb24344587 [0,2,0,0,0,0|2,0,0]=4 2954 B12R1.1 C\C=C\CNc1ccc(F)cc1 Amb25321448 [0,2,0,0,0,0|2,0,0]=4 2955 B12R1.1 C\C=C\CNc1ccc(I)cc1 Amb25772468 [0,2,0,0,0,0|2,0,0]=4 2956 B12R1.1 C\C=C\CNc1ccc(N)cc1 Amb24578052 [0,2,0,0,0,0|2,0,0]=4 2957 B12R1.1 C\C=C\COc1ccc(Cl)cc1 Amb24484186 [0,2,0,0,0,0|2,0,0]=4 2958 B12R1.1 C\C=C\COc1ccc(F)cc1 Amb25667089 [0,2,0,0,0,0|2,0,0]=4 2959 B12R1.1 C\C=C\COc1ccc(I)cc1 Amb25755848 [0,2,0,0,0,0|2,0,0]=4 2960 B12R1.1 C\C=C\COc1ccc(N)cc1 Amb18971519 [0,2,0,0,0,0|2,0,0]=4 2961 B12R1.1 C\C=C\CSc1ccc(Br)cc1 Amb25105700 [0,2,0,0,0,0|2,0,0]=4 2962 B12R1.1 C\C=C\CSc1ccc(O)cc1 Amb18796325 [0,2,0,0,0,0|2,0,0]=4 2963 B12R1.1 C\C=N\OCc1ccc(Cl)cc1 Amb24745737 [0,2,0,0,0,0|2,0,0]=4 2964 B12R1.1 C\N=C\N=Cc1ccc(O)cc1 Amb25328903 [0,2,0,0,0,0|1,0,1]=4 2965 B12R1.1 Cc1ccc(C=C=CCO)cc1 Amb25045789 [0,2,0,0,0,0|1,0,1]=4 2966 B12R1.1 Cc1ccc(C\C=C\CCl)cc1 Amb24652329 [0,2,0,0,0,0|2,0,0]=4 2967 B12R1.1 Cc1ccc(\C=C\N=C=O)cc1 Amb23569114 [0,2,0,0,0,0|0,0,2]=4 2968 B12R1.1 Cc1ccc(cc1)NC\C=C\Cl Amb25772558 [0,2,0,0,0,0|2,0,0]=4 2969 B12R1.1 Cc1ccc(cc1)N\C=N\CC Amb24381974 [0,2,0,0,0,0|2,0,0]=4 2970 B12R1.1 Cc1ccc(cc1)SC\C=C\C Amb25802731 [0,2,0,0,0,0|2,0,0]=4 2971 B12R1.1 Cc1ccc(cc1)S\C=C\CO Amb25740678 [0,2,0,0,0,0|1,0,1]=4 2972 B12R1.1 Cl\C=C\CNc1ccc(Br)cc1 Amb24434354 [0,2,0,0,0,0|2,0,0]=4 2973 B12R1.1 Cl\C=C\CSc1ccc(Br)cc1 Amb24525403 [0,2,0,0,0,0|2,0,0]=4 2974 B12R1.1 Clc1ccc(cc1)NC\C=C\Cl Amb24710868 [0,2,0,0,0,0|2,0,0]=4 2975 B12R1.1 Clc1ccc(cc1)SC\C=C\Cl Amb24721239 [0,2,0,0,0,0|2,0,0]=4 2976 B12R1.1 N#C\N=C\Nc1ccc(Cl)cc1 Amb25275049 [0,2,0,0,0,0|2,0,0]=4 2977 B12R1.1 NOCCCc1ccc(cc1)Br Amb17089579 [0,2,0,0,0,0|1,0,1]=4 2978 B12R1.1 NOCCCc1ccc(cc1)C Amb17089551 [0,2,0,0,0,0|1,0,1]=4 2979 B12R1.1 NOCCCc1ccc(cc1)Cl Amb17089560 [0,2,0,0,0,0|1,0,1]=4 2980 B12R1.1 NOCCCc1ccc(cc1)F Amb17089553 [0,2,0,0,0,0|1,0,1]=4 2981 B12R1.1 NOCCCc1ccc(cc1)O Amb17089576 [0,2,0,0,0,0|1,0,1]=4 2982 B12R1.1 N\N=C\C=Cc1ccc(Cl)cc1 Amb25042591 [0,2,0,0,0,0|1,0,1]=4 2983 B12R1.1 N\N=C\CCc1ccc(F)cc1 Amb25854847 [0,2,0,0,0,0|1,0,0]=3 2984 B12R1.1 Nc1ccc(CCCCO)cc1 Amb18828232 [0,2,0,0,0,0|1,0,1]=4 2985 B12R1.1 Nc1ccc(cc1)OC\C=C\Cl Amb18971517 [0,2,0,0,0,0|2,0,0]=4 2986 B12R1.1 Nc1ccc(cc1)S\C=C\CO Amb24623670 [0,2,0,0,0,0|1,0,1]=4 2987 B12R1.1 O=C=NCCc1ccc(cc1)Br Amb17089357 [0,2,0,0,0,0|0,0,2]=4 2988 B12R1.1 O=C=NCCc1ccc(cc1)C Amb17089349 [0,2,0,0,0,0|0,0,2]=4 2989 B12R1.1 O=C=NCCc1ccc(cc1)F Amb17089356 [0,2,0,0,0,0|0,0,2]=4 2990 B12R1.1 O=C=N\C=C\c1ccc(Cl)cc1 Amb23569115 [0,2,0,0,0,0|0,0,2]=4 2991 B12R1.1 O=C=N\C=C\c1ccc(F)cc1 Amb23569111 [0,2,0,0,0,0|0,0,2]=4 2992 B12R1.1 O=C\C=C\Cc1ccc(F)cc1 Amb24620104 [0,2,0,0,0,0|1,0,1]=4 2993 B12R1.1 OCC#CCc1ccc(Cl)cc1 Amb24671401 [0,2,0,0,0,0|1,0,1]=4 2994 B12R1.1 OCC=C=Cc1ccc(Cl)cc1 Amb24475143 [0,2,0,0,0,0|1,0,1]=4 2995 B12R1.1 OCCC=Cc1ccc(F)cc1 Amb20671698 [0,2,0,0,0,0|1,0,1]=4 2996 B12R1.1 OCCCCc1ccc(cc1)Br Amb17089159 [0,2,0,0,0,0|1,0,1]=4 2997 B12R1.1 OCCCCc1ccc(cc1)C Amb16183285 [0,2,0,0,0,0|1,0,1]=4 2998 B12R1.1 OCCCCc1ccc(cc1)Cl Amb17089158 [0,2,0,0,0,0|1,0,1]=4 2999 B12R1.1 OCCCCc1ccc(cc1)F Amb17089157 [0,2,0,0,0,0|1,0,1]=4 3000 B12R1.1 OCCCNc1ccc(cc1)Br Amb17306798 [0,2,0,0,0,0|1,0,1]=4 3001 B12R1.1 OCCCNc1ccc(cc1)C Amb17306885 [0,2,0,0,0,0|1,0,1]=4 3002 B12R1.1 OCCCNc1ccc(cc1)Cl Amb17307252 [0,2,0,0,0,0|1,0,1]=4 3003 B12R1.1 OCCCNc1ccc(cc1)F Amb17306196 [0,2,0,0,0,0|1,0,1]=4 3004 B12R1.1 OCCCNc1ccc(cc1)I Amb17306250 [0,2,0,0,0,0|1,0,1]=4 3005 B12R1.1 OCCCOc1ccc(cc1)F Amb1109753 [0,2,0,0,0,0|1,0,1]=4 3006 B12R1.1 OCCOCc1ccc(cc1)Cl Amb2421036 [0,2,0,0,0,0|1,0,1]=4 3007 B12R1.1 OCC\C=C\c1ccc(F)cc1 Amb24763739 [0,2,0,0,0,0|1,0,1]=4 3008 B12R1.1 ONCCOc1ccc(cc1)Br Amb17088425 [0,2,0,0,0,0|0,0,2]=4 3009 B12R1.1 ONCCOc1ccc(cc1)C Amb17088416 [0,2,0,0,0,0|0,0,2]=4 3010 B12R1.1 ONCCOc1ccc(cc1)Cl Amb17088422 [0,2,0,0,0,0|0,0,2]=4 3011 B12R1.1 ONCCOc1ccc(cc1)F Amb17088419 [0,2,0,0,0,0|0,0,2]=4 3012 B12R1.1 Oc1ccc(C=C\C=N\O)cc1 Amb24697886 [0,2,0,0,0,0|0,0,1]=3 3013 B12R1.1 Oc1ccc(CCN=C=O)cc1 Amb25376148 [0,2,0,0,0,0|0,0,2]=4 3014 B12R1.1 Oc1ccc(CC\C=N\O)cc1 Amb24598916 [0,2,0,0,0,0|0,0,0]=2 3015 B12R1.1 Oc1ccc(cc1)SC\C=C\Cl Amb18320089 [0,2,0,0,0,0|2,0,0]=4 3016 B12R1.1 S=C=NCCc1ccc(cc1)Br Amb17255961 [0,2,0,0,0,0|0,1,1]=4 3017 B12R1.1 [N-]=[N+]=NCCc1ccc(F)cc1 Amb25780260 [0,2,0,0,0,0|1,0,1]=4 3018 B12R1.1 [N-]=[N+]=NCCc1ccc(N)cc1 Amb24419918 [0,2,0,0,0,0|1,0,1]=4 3019 B12R1.1 [N-]=[N+]=N\C=C\c1ccc(Cl)cc1 Amb24565825 [0,2,0,0,0,0|1,0,1]=4 3020 B12R1.1 [N-]=[N+]=N\C=C\c1ccc(O)cc1 Amb24519619 [0,2,0,0,0,0|1,0,1]=4 3021 B12R1.16 C=C=CC(O)c1ccc(Cl)cc1 Amb24497749 [0,2,0,0,0,0|2,0,0]=4 3022 B12R1.16 C=C=C[C@@H](O)c1ccc(F)cc1 Amb25205006 [0,2,0,0,0,0|2,0,0]=4 3023 B12R1.16 C=C=C[C@H](O)c1ccc(F)cc1 Amb24748631 [0,2,0,0,0,0|2,0,0]=4 3024 B12R1.16 CC(CCO)c1ccc(N)cc1 Amb24553218 [0,2,0,0,0,0|1,0,1]=4 3025 B12R1.16 C[C@@H](CCO)c1ccc(Cl)cc1 Amb25832765 [0,2,0,0,0,0|1,0,1]=4 3026 B12R1.16 C[C@@H](CCO)c1ccc(F)cc1 Amb25317656 [0,2,0,0,0,0|1,0,1]=4 3027 B12R1.16 C\C(=C\CO)\c1ccc(Br)cc1 Amb24579789 [0,2,0,0,0,0|1,0,1]=4 3028 B12R1.16 C\C(=C\CO)\c1ccc(F)cc1 Amb25848827 [0,2,0,0,0,0|1,0,1]=4 3029 B12R1.16 C\C=C\C(C)c1ccc(N)cc1 Amb18645538 [0,2,0,0,0,0|2,0,0]=4 3030 B12R1.16 C\C=C\C(C)c1ccc(O)cc1 Amb24737403 [0,2,0,0,0,0|2,0,0]=4 3031 B12R1.16 Cc1ccc(cc1)C(=O)\C=N/O Amb24531419 [0,2,0,0,0,0|0,0,1]=3 3032 B12R1.16 Cc1ccc(cc1)C(Cl)CCO Amb24552889 [0,2,0,0,0,0|1,0,1]=4 3033 B12R1.16 Cc1ccc(cc1)C(Cl)\C=C\C Amb25779946 [0,2,0,0,0,0|2,0,0]=4 3034 B12R1.16 Cc1ccc(cc1)C(O)C=C=C Amb25317608 [0,2,0,0,0,0|2,0,0]=4 3035 B12R1.16 Cc1ccc(cc1)C(O)CCO Amb18563722 [0,2,0,0,0,0|1,0,1]=4 3036 B12R1.16 Cc1ccc(cc1)[C@@H](C)CCO Amb25058547 [0,2,0,0,0,0|1,0,1]=4 3037 B12R1.16 Cc1ccc(cc1)[C@@H](N)CCO Amb19888370 [0,2,0,0,0,0|1,0,1]=4 3038 B12R1.16 Cc1ccc(cc1)[C@@H](N)CCO Amb23399704 [0,2,0,0,0,0|1,0,1]=4 3039 B12R1.16 Cc1ccc(cc1)[C@@H](O)C=C=C Amb24412915 [0,2,0,0,0,0|2,0,0]=4 3040 B12R1.16 Cc1ccc(cc1)[C@H](C)CCO Amb24671505 [0,2,0,0,0,0|1,0,1]=4 3041 B12R1.16 Cc1ccc(cc1)[C@H](N)CCO Amb19887704 [0,2,0,0,0,0|1,0,1]=4 3042 B12R1.16 NC(CCO)c1ccc(Cl)cc1 Amb19888463 [0,2,0,0,0,0|1,0,1]=4 3043 B12R1.16 NC(CCO)c1ccc(F)cc1 Amb22490662 [0,2,0,0,0,0|1,0,1]=4 3044 B12R1.16 N[C@@H](CCO)c1ccc(Cl)cc1 Amb19888405 [0,2,0,0,0,0|1,0,1]=4 3045 B12R1.16 N[C@@H](CCO)c1ccc(Cl)cc1 Amb22747365 [0,2,0,0,0,0|1,0,1]=4 3046 B12R1.16 N[C@@H](CCO)c1ccc(F)cc1 Amb19888378 [0,2,0,0,0,0|1,0,1]=4 3047 B12R1.16 N[C@@H](CCO)c1ccc(O)cc1 Amb24446583 [0,2,0,0,0,0|1,0,1]=4 3048 B12R1.16 N[C@H](CCO)c1ccc(Br)cc1 Amb19887638 [0,2,0,0,0,0|1,0,1]=4 3049 B12R1.16 N[C@H](CCO)c1ccc(Cl)cc1 Amb19887657 [0,2,0,0,0,0|1,0,1]=4 3050 B12R1.16 N[C@H](CCO)c1ccc(F)cc1 Amb19887667 [0,2,0,0,0,0|1,0,1]=4 3051 B12R1.16 N[C@H](CCO)c1ccc(O)cc1 Amb25339383 [0,2,0,0,0,0|1,0,1]=4 3052 B12R1.16 N[C@H](CCO)c1ccc(S)cc1 Amb25824151 [0,2,0,0,0,0|1,0,1]=4 3053 B12R1.16 Nc1ccc(cc1)C(N)CCO Amb19887602 [0,2,0,0,0,0|1,0,1]=4 3054 B12R1.16 Nc1ccc(cc1)[C@H](N)CCO Amb19887604 [0,2,0,0,0,0|1,0,1]=4 3055 B12R1.16 OCCC(Cl)c1ccc(Cl)cc1 Amb24752170 [0,2,0,0,0,0|1,0,1]=4 3056 B12R1.16 OCCC(F)c1ccc(F)cc1 Amb25158049 [0,2,0,0,0,0|1,0,1]=4 3057 B12R1.16 OCCC(O)c1ccc(Br)cc1 Amb18070318 [0,2,0,0,0,0|1,0,1]=4 3058 B12R1.16 OCCC(O)c1ccc(Cl)cc1 Amb18066186 [0,2,0,0,0,0|1,0,1]=4 3059 B12R1.16 OCCC(O)c1ccc(F)cc1 Amb18563926 [0,2,0,0,0,0|1,0,1]=4 3060 B12R1.16 OCCC(c1ccc(cc1)Br)C Amb17248426 [0,2,0,0,0,0|1,0,1]=4 3061 B12R1.16 OCCC(c1ccc(cc1)C)C Amb17232490 [0,2,0,0,0,0|1,0,1]=4 3062 B12R1.16 OCCC(c1ccc(cc1)C)N Amb17103955 [0,2,0,0,0,0|1,0,1]=4 3063 B12R1.16 OCCC(c1ccc(cc1)Cl)C Amb17234157 [0,2,0,0,0,0|1,0,1]=4 3064 B12R1.16 OCCC(c1ccc(cc1)Cl)N Amb1993959 [0,2,0,0,0,0|1,0,1]=4 3065 B12R1.16 OCCC(c1ccc(cc1)F)C Amb17232668 [0,2,0,0,0,0|1,0,1]=4 3066 B12R1.16 OCC[C@@H](O)c1ccc(Cl)cc1 Amb24749568 [0,2,0,0,0,0|1,0,1]=4 3067 B12R1.16 OCC[C@@H](O)c1ccc(F)cc1 Amb25070596 [0,2,0,0,0,0|1,0,1]=4 3068 B12R1.16 OCC[C@H](O)c1ccc(Cl)cc1 Amb25129763 [0,2,0,0,0,0|1,0,1]=4 3069 B12R1.16 OCC[C@H](O)c1ccc(F)cc1 Amb24601023 [0,2,0,0,0,0|1,0,1]=4 3070 B12R1.16 OC\C=C(\F)/c1ccc(Cl)cc1 Amb24569989 [0,2,0,0,0,0|1,0,1]=4 3071 B12R1.16 ONCC(c1ccc(cc1)Br)O Amb17345007 [0,2,0,0,0,0|0,0,2]=4 3072 B12R1.16 ONCC(c1ccc(cc1)C)O Amb17334704 [0,2,0,0,0,0|0,0,2]=4 3073 B12R1.16 ONCC(c1ccc(cc1)Cl)O Amb17335949 [0,2,0,0,0,0|0,0,2]=4 3074 B12R1.16 ONCC(c1ccc(cc1)F)O Amb17334838 [0,2,0,0,0,0|0,0,2]=4 3075 B12R1.16 ONCC(c1ccc(cc1)O)O Amb17334758 [0,2,0,0,0,0|0,0,2]=4 3076 B12R1.16 O\N=C\C(=O)c1ccc(cc1)Cl Amb2434431 [0,2,0,0,0,0|0,0,1]=3 3077 B12R1.16 Oc1ccc(cc1)C(=O)\C=N\O Amb25113482 [0,2,0,0,0,0|0,0,1]=3 3078 B12R1.16 Oc1ccc(cc1)C(O)\C=N\O Amb24697867 [0,2,0,0,0,0|0,0,0]=2 3079 B12R1.21 CC(CCc1ccc(cc1)Cl)O Amb17507284 [0,2,0,0,0,0|1,0,1]=4 3080 B12R1.21 CC(CCc1ccc(cc1)F)O Amb17507285 [0,2,0,0,0,0|1,0,1]=4 3081 B12R1.21 CC(CCc1ccc(cc1)O)O Amb1110722 [0,2,0,0,0,0|1,0,1]=4 3082 B12R1.21 CC(O)CCc1ccc(Br)cc1 Amb24056590 [0,2,0,0,0,0|1,0,1]=4 3083 B12R1.21 CC(O)\C=C\c1ccc(I)cc1 Amb24493262 [0,2,0,0,0,0|1,0,1]=4 3084 B12R1.21 C[C@@H](O)CCc1ccc(O)cc1 Amb23604212 [0,2,0,0,0,0|1,0,1]=4 3085 B12R1.21 C[C@@H](O)\C=C\c1ccc(Cl)cc1 Amb24497692 [0,2,0,0,0,0|1,0,1]=4 3086 B12R1.21 C[C@H](O)\C=C\c1ccc(Cl)cc1 Amb25051261 [0,2,0,0,0,0|1,0,1]=4 3087 B12R1.21 C[C@H](O)\C=C\c1ccc(F)cc1 Amb25052234 [0,2,0,0,0,0|1,0,1]=4 3088 B12R1.21 Cc1ccc(CCC(C)O)cc1 Amb18800837 [0,2,0,0,0,0|1,0,1]=4 3089 B12R1.21 Cc1ccc(\C=C\B(O)O)cc1 Amb20671353 [0,2,0,0,0,0|1,0,1]=4 3090 B12R1.21 Cc1ccc(\C=C\C(C)O)cc1 Amb24707156 [0,2,0,0,0,0|1,0,1]=4 3091 B12R1.21 Cc1ccc(\C=C\[C@@H](C)O)cc1 Amb25119983 [0,2,0,0,0,0|1,0,1]=4 3092 B12R1.21 Nc1ccc(\C=C\B(O)O)cc1 Amb24642812 [0,2,0,0,0,0|1,0,1]=4 3093 B12R1.21 OB(O)CCc1ccc(Cl)cc1 Amb25667152 [0,2,0,0,0,0|1,0,1]=4 3094 B12R1.21 OB(O)CCc1ccc(F)cc1 Amb25149900 [0,2,0,0,0,0|1,0,1]=4 3095 B12R1.21 OB(\C=C\c1ccc(cc1)Cl)O Amb2455790 [0,2,0,0,0,0|1,0,1]=4 3096 B12R1.21 OB(\C=C\c1ccc(cc1)F)O Amb2455999 [0,2,0,0,0,0|1,0,1]=4 3097 B12R1.21 OC(=O)C=Cc1ccc(I)cc1 Amb24079623 [0,2,0,0,0,0|1,0,1]=4 3098 B12R1.21 OC(=O)CCc1ccc(cc1)Br Amb1220330 [0,2,0,0,0,0|1,0,1]=4 3099 B12R1.21 OC(=O)CCc1ccc(cc1)C Amb1225383 [0,2,0,0,0,0|1,0,1]=4 3100 B12R1.21 OC(=O)CCc1ccc(cc1)Cl Amb1093991 [0,2,0,0,0,0|1,0,1]=4 3101 B12R1.21 OC(=O)CCc1ccc(cc1)F Amb1214879 [0,2,0,0,0,0|1,0,1]=4 3102 B12R1.21 OC(=O)\C=C/c1ccc(F)cc1 Amb24712642 [0,2,0,0,0,0|1,0,1]=4 3103 B12R1.21 OC(=O)\C=C/c1ccc(cc1)Cl Amb2553273 [0,2,0,0,0,0|1,0,1]=4 3104 B12R1.21 OC(=O)\C=C\c1ccc(cc1)Br Amb1209603 [0,2,0,0,0,0|1,0,1]=4 3105 B12R1.21 OC(=O)\C=C\c1ccc(cc1)Cl Amb1210744 [0,2,0,0,0,0|1,0,1]=4 3106 B12R1.21 OC(=O)\C=C\c1ccc(cc1)I Amb2227429 [0,2,0,0,0,0|1,0,1]=4 3107 B12R1.21 OC(=O)\C=C\c1ccc(cc1)N Amb1196689 [0,2,0,0,0,0|1,0,1]=4 3108 B12R1.21 OC(=O)\C=C\c1ccc(cc1)O Amb1207922 [0,2,0,0,0,0|1,0,1]=4 3109 B12R1.21 OC(=O)\C=C\c1ccc(cc1)S Amb17616840 [0,2,0,0,0,0|1,0,1]=4 3110 B12R1.21 Oc1ccc(CC=C(Cl)Cl)cc1 Amb25054845 [0,2,0,0,0,0|2,0,0]=4 3111 B12R1.49 C#CC(=O)Cc1ccc(Br)cc1 Amb24700806 [0,2,0,0,0,0|2,0,0]=4 3112 B12R1.49 C#CC(=O)Cc1ccc(Cl)cc1 Amb25710197 [0,2,0,0,0,0|2,0,0]=4 3113 B12R1.49 C#CC(=O)Cc1ccc(F)cc1 Amb25340982 [0,2,0,0,0,0|2,0,0]=4 3114 B12R1.49 C=C(Cc1ccc(Cl)cc1)C=O Amb25733131 [0,2,0,0,0,0|1,0,1]=4 3115 B12R1.49 C=C(Cc1ccc(F)cc1)C=O Amb24380075 [0,2,0,0,0,0|1,0,1]=4 3116 B12R1.49 C=CC(=O)Cc1ccc(Br)cc1 Amb25710195 [0,2,0,0,0,0|2,0,0]=4 3117 B12R1.49 C=CC(=O)Cc1ccc(Cl)cc1 Amb25715125 [0,2,0,0,0,0|2,0,0]=4 3118 B12R1.49 CC(CO)Cc1ccc(I)cc1 Amb25711706 [0,2,0,0,0,0|1,0,1]=4 3119 B12R1.49 CC(Cc1ccc(O)cc1)CO Amb25770294 [0,2,0,0,0,0|1,0,1]=4 3120 B12R1.49 CCC(=O)Cc1ccc(I)cc1 Amb25229794 [0,2,0,0,0,0|2,0,0]=4 3121 B12R1.49 CCC(=O)Cc1ccc(O)cc1 Amb18646040 [0,2,0,0,0,0|2,0,0]=4 3122 B12R1.49 CCC(=O)Cc1ccc(cc1)Br Amb17477612 [0,2,0,0,0,0|2,0,0]=4 3123 B12R1.49 CCC(=O)Cc1ccc(cc1)C Amb17138536 [0,2,0,0,0,0|2,0,0]=4 3124 B12R1.49 CCC(=O)Cc1ccc(cc1)Cl Amb17139038 [0,2,0,0,0,0|2,0,0]=4 3125 B12R1.49 CCC(=O)Cc1ccc(cc1)F Amb17138600 [0,2,0,0,0,0|2,0,0]=4 3126 B12R1.49 CN(Cc1ccc(F)cc1)N=O Amb25238622 [0,2,0,0,0,0|1,0,1]=4 3127 B12R1.49 CNC(=O)Cc1ccc(I)cc1 Amb25680399 [0,2,0,0,0,0|1,0,1]=4 3128 B12R1.49 CNC(=O)Cc1ccc(O)cc1 Amb18646280 [0,2,0,0,0,0|1,0,1]=4 3129 B12R1.49 CNC(=O)Cc1ccc(S)cc1 Amb24346465 [0,2,0,0,0,0|1,0,1]=4 3130 B12R1.49 CNC(=O)Cc1ccc(cc1)C Amb1795465 [0,2,0,0,0,0|1,0,1]=4 3131 B12R1.49 CNC(=O)Cc1ccc(cc1)N Amb1117771 [0,2,0,0,0,0|1,0,1]=4 3132 B12R1.49 CNC(=O)Cc1ccc(cc1)N Amb15740907 [0,2,0,0,0,0|1,0,1]=4 3133 B12R1.49 COC(=N)Cc1ccc(Cl)cc1 Amb19057372 [0,2,0,0,0,0|2,0,0]=4 3134 B12R1.49 COC(=N)Cc1ccc(F)cc1 Amb18180127 [0,2,0,0,0,0|2,0,0]=4 3135 B12R1.49 COC(=N)Cc1ccc(O)cc1 Amb18792627 [0,2,0,0,0,0|2,0,0]=4 3136 B12R1.49 COC(=O)Cc1ccc(cc1)I Amb10601390 [0,2,0,0,0,0|2,0,0]=4 3137 B12R1.49 C[C@@H](CO)Cc1ccc(Cl)cc1 Amb25847856 [0,2,0,0,0,0|1,0,1]=4 3138 B12R1.49 C[C@@H](Cc1ccc(O)cc1)CO Amb24647774 [0,2,0,0,0,0|1,0,1]=4 3139 B12R1.49 C[C@H](CO)Cc1ccc(F)cc1 Amb24387764 [0,2,0,0,0,0|1,0,1]=4 3140 B12R1.49 C[C@H](Cc1ccc(O)cc1)CO Amb25371827 [0,2,0,0,0,0|1,0,1]=4 3141 B12R1.49 C\C(\CO)=C\c1ccc(N)cc1 Amb24536329 [0,2,0,0,0,0|1,0,1]=4 3142 B12R1.49 C\C(\Cc1ccc(Cl)cc1)=N\O Amb25159945 [0,2,0,0,0,0|0,0,0]=2 3143 B12R1.49 C\C(\Cc1ccc(F)cc1)=N\N Amb25310183 [0,2,0,0,0,0|1,0,0]=3 3144 B12R1.49 C\C(\Cc1ccc(F)cc1)=N\O Amb24359271 [0,2,0,0,0,0|0,0,0]=2 3145 B12R1.49 C\C(\Cc1ccc(I)cc1)=N\O Amb25258473 [0,2,0,0,0,0|0,0,0]=2 3146 B12R1.49 C\C(\Cc1ccc(O)cc1)=N\O Amb25371887 [0,2,0,0,0,0|0,0,0]=2 3147 B12R1.49 C\[N+](\Cc1ccc(O)cc1)=N/[O-] Amb24662308 [0,2,0,0,0,0|1,0,1]=4 3148 B12R1.49 Cc1ccc(CC(=C)C=O)cc1 Amb24653692 [0,2,0,0,0,0|1,0,1]=4 3149 B12R1.49 Cc1ccc(CC(=N)NC)cc1 Amb25187482 [0,2,0,0,0,0|1,0,1]=4 3150 B12R1.49 Cc1ccc(CC(=N)OC)cc1 Amb18798199 [0,2,0,0,0,0|2,0,0]=4 3151 B12R1.49 Cc1ccc(CC(=O)C=C)cc1 Amb25069127 [0,2,0,0,0,0|2,0,0]=4 3152 B12R1.49 Cc1ccc(CC(=O)C=O)cc1 Amb24567096 [0,2,0,0,0,0|1,0,1]=4 3153 B12R1.49 Cc1ccc(CC(=O)CN)cc1 Amb18829243 [0,2,0,0,0,0|2,0,0]=4 3154 B12R1.49 Cc1ccc(CC(=O)CO)cc1 Amb18563613 [0,2,0,0,0,0|1,0,0]=3 3155 B12R1.49 Cc1ccc(CC(=O)NO)c[n]1 Amb25144208 [0,2,0,0,0,0|1,0,1]=4 3156 B12R1.49 Cc1ccc(CC(C)CO)cc1 Amb24354502 [0,2,0,0,0,0|1,0,1]=4 3157 B12R1.49 Cc1ccc(CC(N)=NN)cc1 Amb18788209 [0,2,0,0,0,0|1,0,0]=3 3158 B12R1.49 Cc1ccc(CN(C)N=O)cc1 Amb25154359 [0,2,0,0,0,0|1,0,1]=4 3159 B12R1.49 Cc1ccc(C[C@@H](C)CO)cc1 Amb25687834 [0,2,0,0,0,0|1,0,1]=4 3160 B12R1.49 Cc1ccc(C[C@H](C)CO)cc1 Amb25221031 [0,2,0,0,0,0|1,0,1]=4 3161 B12R1.49 Cc1ccc(C[C@H](N)CO)cc1 Amb25257357 [0,2,0,0,0,0|1,0,1]=4 3162 B12R1.49 Cc1ccc(C\C(\C)=N/O)cc1 Amb24563486 [0,2,0,0,0,0|0,0,0]=2 3163 B12R1.49 Cc1ccc(\C=C(\C)/CO)cc1 Amb24649471 [0,2,0,0,0,0|1,0,1]=4 3164 B12R1.49 Cc1ccc(cc1)NC(N)=NO Amb18800912 [0,2,0,0,0,0|1,0,0]=3 3165 B12R1.49 Cc1ccc(cc1)N\C(\C)=N/O Amb24754023 [0,2,0,0,0,0|1,0,0]=3 3166 B12R1.49 Cc1ccc(cc1)OC(=O)CO Amb25829911 [0,2,0,0,0,0|2,0,0]=4 3167 B12R1.49 N#CC(=O)Cc1ccc(Cl)cc1 Amb22498650 [0,2,0,0,0,0|2,0,0]=4 3168 B12R1.49 N=C(Cc1ccc(O)cc1)NO Amb22494626 [0,2,0,0,0,0|0,0,1]=3 3169 B12R1.49 NC(CO)Cc1ccc(I)cc1 Amb25140389 [0,2,0,0,0,0|1,0,1]=4 3170 B12R1.49 NC(Nc1ccc(Cl)cc1)=NO Amb19075680 [0,2,0,0,0,0|1,0,0]=3 3171 B12R1.49 NC(Nc1ccc(F)cc1)=NO Amb18185589 [0,2,0,0,0,0|1,0,0]=3 3172 B12R1.49 NCC(=O)Cc1ccc(Br)cc1 Amb18160380 [0,2,0,0,0,0|2,0,0]=4 3173 B12R1.49 NCC(=O)Cc1ccc(Cl)cc1 Amb18823029 [0,2,0,0,0,0|2,0,0]=4 3174 B12R1.49 NCC(=O)Cc1ccc(F)cc1 Amb18827238 [0,2,0,0,0,0|2,0,0]=4 3175 B12R1.49 NCC(=O)Cc1ccc(O)cc1 Amb25369044 [0,2,0,0,0,0|2,0,0]=4 3176 B12R1.49 NNC(=O)Cc1ccc(cc1)C Amb1921793 [0,2,0,0,0,0|1,0,1]=4 3177 B12R1.49 N[C@@H](CO)Cc1ccc(Cl)cc1 Amb22225388 [0,2,0,0,0,0|1,0,1]=4 3178 B12R1.49 N[C@@H](CO)Cc1ccc(Cl)cc1 Amb22747948 [0,2,0,0,0,0|1,0,1]=4 3179 B12R1.49 N[C@@H](CO)Cc1ccc(F)cc1 Amb22746377 [0,2,0,0,0,0|1,0,1]=4 3180 B12R1.49 N[C@@H](CO)Cc1ccc(I)cc1 Amb20242327 [0,2,0,0,0,0|1,0,1]=4 3181 B12R1.49 N[C@H](CO)Cc1ccc(Br)cc1 Amb24453435 [0,2,0,0,0,0|1,0,1]=4 3182 B12R1.49 N[C@H](CO)Cc1ccc(Cl)cc1 Amb19943950 [0,2,0,0,0,0|1,0,1]=4 3183 B12R1.49 N[C@H](CO)Cc1ccc(Cl)cc1 Amb22233150 [0,2,0,0,0,0|1,0,1]=4 3184 B12R1.49 N[C@H](CO)Cc1ccc(F)cc1 Amb22233151 [0,2,0,0,0,0|1,0,1]=4 3185 B12R1.49 N[C@H](CO)Cc1ccc(I)cc1 Amb25200273 [0,2,0,0,0,0|1,0,1]=4 3186 B12R1.49 N\C(\Cc1ccc(Br)cc1)=N\N Amb25056234 [0,2,0,0,0,0|1,0,0]=3 3187 B12R1.49 N\C(\Cc1ccc(Cl)cc1)=N\N Amb19045347 [0,2,0,0,0,0|1,0,0]=3 3188 B12R1.49 N\C(\Cc1ccc(F)cc1)=N\N Amb18788561 [0,2,0,0,0,0|1,0,0]=3 3189 B12R1.49 N\C(\Cc1ccc(I)cc1)=N\O Amb24454140 [0,2,0,0,0,0|0,0,0]=2 3190 B12R1.49 N\C(\NC=1C=CC(=O)NC1)=N\O Amb24401973 [0,2,0,0,0,0|2,0,0]=4 3191 B12R1.49 N\C(\Nc1ccc(Br)cc1)=N\N Amb25730674 [0,2,0,0,0,0|2,0,0]=4 3192 B12R1.49 N\C(\Nc1ccc(Cl)cc1)=N\N Amb24420505 [0,2,0,0,0,0|2,0,0]=4 3193 B12R1.49 N\C(\Nc1ccc(O)cc1)=N\O Amb24758895 [0,2,0,0,0,0|1,0,0]=3 3194 B12R1.49 Nc1ccc(CC(=O)CBr)cc1 Amb25247650 [0,2,0,0,0,0|2,0,0]=4 3195 B12R1.49 Nc1ccc(CC(=O)NN)cc1 Amb23247868 [0,2,0,0,0,0|1,0,1]=4 3196 B12R1.49 Nc1ccc(CC(=O)NO)[n]c1 Amb25347985 [0,2,0,0,0,0|1,0,1]=4 3197 B12R1.49 Nc1ccc(CC(=O)NO)cc1 Amb25222304 [0,2,0,0,0,0|0,0,1]=3 3198 B12R1.49 Nc1ccc(C[C@H](N)CO)cc1 Amb22233152 [0,2,0,0,0,0|1,0,1]=4 3199 B12R1.49 Nc1ccc(cc1)OC(=O)CO Amb24730945 [0,2,0,0,0,0|2,0,0]=4 3200 B12R1.49 O=C(CF)Cc1ccc(Cl)cc1 Amb23454833 [0,2,0,0,0,0|2,0,0]=4 3201 B12R1.49 O=C(Cc1ccc(Br)cc1)CBr Amb25364120 [0,2,0,0,0,0|2,0,0]=4 3202 B12R1.49 O=C(Cc1ccc(F)cc1)CBr Amb25082934 [0,2,0,0,0,0|2,0,0]=4 3203 B12R1.49 OCC(=O)Cc1ccc(Br)cc1 Amb18069830 [0,2,0,0,0,0|1,0,0]=3 3204 B12R1.49 OCC(=O)Cc1ccc(Cl)cc1 Amb18564300 [0,2,0,0,0,0|1,0,0]=3 3205 B12R1.49 OCC(=O)Cc1ccc(F)cc1 Amb18805789 [0,2,0,0,0,0|1,0,0]=3 3206 B12R1.49 OCC(=O)Nc1ccc(cc1)Br Amb1111396 [0,2,0,0,0,0|2,0,0]=4 3207 B12R1.49 OCC(=O)Nc1ccc(cc1)C Amb1109727 [0,2,0,0,0,0|2,0,0]=4 3208 B12R1.49 OCC(=O)Nc1ccc(cc1)Cl Amb1111272 [0,2,0,0,0,0|2,0,0]=4 3209 B12R1.49 OCC(=O)Nc1ccc(cc1)F Amb1110979 [0,2,0,0,0,0|2,0,0]=4 3210 B12R1.49 OCC(=O)Nc1ccc(cc1)I Amb1110138 [0,2,0,0,0,0|2,0,0]=4 3211 B12R1.49 OCC(Cc1ccc(cc1)Br)N Amb17062713 [0,2,0,0,0,0|1,0,1]=4 3212 B12R1.49 OCC(Cc1ccc(cc1)C)N Amb17062687 [0,2,0,0,0,0|1,0,1]=4 3213 B12R1.49 OCC(Cc1ccc(cc1)F)N Amb17062689 [0,2,0,0,0,0|1,0,1]=4 3214 B12R1.49 OCC(Cc1ccc(cc1)O)N Amb17062710 [0,2,0,0,0,0|1,0,1]=4 3215 B12R1.49 OCC(F)Cc1ccc(Cl)cc1 Amb25741479 [0,2,0,0,0,0|1,0,1]=4 3216 B12R1.49 OC[C@H](Cc1ccc(cc1)O)N Amb1157858 [0,2,0,0,0,0|1,0,1]=4 3217 B12R1.49 OC[C@H](F)Cc1ccc(F)cc1 Amb24749775 [0,2,0,0,0,0|1,0,1]=4 3218 B12R1.49 ONC(=O)Cc1ccc(I)cc1 Amb25119664 [0,2,0,0,0,0|0,0,1]=3 3219 B12R1.49 ONC(=O)Nc1ccc(I)cc1 Amb22475257 [0,2,0,0,0,0|1,0,1]=4 3220 B12R1.49 ONC(=S)Nc1ccc(F)cc1 Amb22465744 [0,2,0,0,0,0|1,0,1]=4 3221 B12R1.49 O\N=C(/Cc1ccc(cc1)O)\N Amb2224478 [0,2,0,0,0,0|0,0,0]=2 3222 B12R1.49 O\N=C(\Cc1ccc(cc1)Cl)/N Amb1114808 [0,2,0,0,0,0|0,0,0]=2 3223 B12R1.49 O\N=C(\Cc1ccc(cc1)N)/N Amb1114107 [0,2,0,0,0,0|0,0,0]=2 3224 B12R1.49 O\N=C(\Cc1ccc(cc1)O)/N Amb1113789 [0,2,0,0,0,0|0,0,0]=2 3225 B12R1.49 Oc1ccc(CC(=O)C=O)cc1 Amb25359086 [0,2,0,0,0,0|1,0,1]=4 3226 B12R1.49 Oc1ccc(CC(=O)NO)cc1 Amb24686463 [0,2,0,0,0,0|0,0,1]=3 3227 B12R1.49 Oc1ccc(CC(O)CO)cc1 Amb25092907 [0,2,0,0,0,0|1,0,1]=4 3228 B12R1.49 Oc1ccc(CN(O)N=O)cc1 Amb25249236 [0,2,0,0,0,0|1,0,1]=4 3229 B12R1.49 Oc1ccc(C[C@H](O)CO)cc1 Amb24497177 [0,2,0,0,0,0|1,0,1]=4 3230 B12R1.49 Oc1ccc(cc1)\N=C(/O)\N=O Amb25262712 [0,2,0,0,0,0|1,0,1]=4 3231 B12R1.69 Cc1cc(Br)ccc1CCCO Amb23537809 [0,2,0,0,0,0|1,0,1]=4 3232 B12R1.69 Cc1cc(Br)ccc1\C=C\CO Amb25160043 [0,2,0,0,0,0|1,0,1]=4 3233 B12R1.69 Cc1cc(C)c(cc1)N\C=N\C Amb22731945 [0,2,0,0,0,0|2,0,0]=4 3234 B12R1.69 Cc1cc(Cl)ccc1N\C=N\O Amb24634300 [0,2,0,0,0,0|1,0,0]=3 3235 B12R1.69 Cc1cc(Cl)ccc1\C=C\CO Amb25324808 [0,2,0,0,0,0|1,0,1]=4 3236 B12R1.69 Cc1cc(F)ccc1CCCO Amb25148633 [0,2,0,0,0,0|1,0,1]=4 3237 B12R1.69 Cc1cc(F)ccc1\C=C\CO Amb23442796 [0,2,0,0,0,0|1,0,1]=4 3238 B12R1.69 Cc1cc(O)c(COCO)cc1 Amb24065149 [0,2,0,0,0,0|2,0,0]=4 3239 B12R1.69 Cc1cc(O)c(C\C=C\C)cc1 Amb24408311 [0,2,0,0,0,0|2,0,0]=4 3240 B12R1.69 Cc1cc(O)c(\C=C/CO)cc1 Amb25373419 [0,2,0,0,0,0|1,0,1]=4 3241 B12R1.69 Cc1ccc(CCCO)c(Br)c1 Amb23537990 [0,2,0,0,0,0|1,0,1]=4 3242 B12R1.69 Cc1ccc(CCCO)c(Cl)c1 Amb25820255 [0,2,0,0,0,0|1,0,1]=4 3243 B12R1.69 Cc1ccc(CCCO)c(F)c1 Amb25135641 [0,2,0,0,0,0|1,0,1]=4 3244 B12R1.69 Cc1ccc(CCCO)c(N)c1 Amb22233216 [0,2,0,0,0,0|1,0,1]=4 3245 B12R1.69 N\N=C\Cc1ccc(F)cc1Cl Amb24686050 [0,2,0,0,0,0|1,0,0]=3 3246 B12R1.69 OCCCc1ccc(Br)cc1F Amb20171344 [0,2,0,0,0,0|1,0,1]=4 3247 B12R1.69 OCCCc1ccc(Cl)cc1F Amb25720643 [0,2,0,0,0,0|1,0,1]=4 3248 B12R1.69 OCCCc1ccc(F)cc1Br Amb24090111 [0,2,0,0,0,0|1,0,1]=4 3249 B12R1.69 OCCCc1ccc(F)cc1Cl Amb19072148 [0,2,0,0,0,0|1,0,1]=4 3250 B12R1.69 OCCCc1ccc(O)cc1O Amb18646882 [0,2,0,0,0,0|1,0,1]=4 3251 B12R1.69 OCCCc1ccc(cc1C)C Amb17400157 [0,2,0,0,0,0|1,0,1]=4 3252 B12R1.69 OCCCc1ccc(cc1Cl)Cl Amb17402981 [0,2,0,0,0,0|1,0,1]=4 3253 B12R1.69 OCCCc1ccc(cc1F)F Amb17605787 [0,2,0,0,0,0|1,0,1]=4 3254 B12R1.69 OC\C=C\c1ccc(Br)cc1Cl Amb25826292 [0,2,0,0,0,0|1,0,1]=4 3255 B12R1.69 OC\C=C\c1ccc(Cl)cc1Br Amb24465297 [0,2,0,0,0,0|1,0,1]=4 3256 B12R1.69 OC\C=C\c1ccc(Cl)cc1Cl Amb22499014 [0,2,0,0,0,0|1,0,1]=4 3257 B12R1.69 OC\C=C\c1ccc(Cl)cc1F Amb25697673 [0,2,0,0,0,0|1,0,1]=4 3258 B12R1.69 OC\C=C\c1ccc(F)cc1F Amb23442759 [0,2,0,0,0,0|1,0,1]=4 3259 B12R1.69 O\N=C\CN1C=CC(=O)NC1=O Amb18363464 [0,2,0,0,0,0|2,0,0]=4 3260 B12R1.69 Oc1cc(F)ccc1CCCO Amb25106077 [0,2,0,0,0,0|1,0,1]=4 3261 B12R1.69 Oc1ccc(CCCO)c(Cl)c1 Amb25690683 [0,2,0,0,0,0|1,0,1]=4 3262 B12R1.69 Oc1ccc(CCCO)c(F)c1 Amb25281830 [0,2,0,0,0,0|1,0,1]=4 3263 B12R1.71 CCc1ccc(\C=C\CO)cc1 Amb23442835 [0,2,0,0,0,0|1,0,1]=4 3264 B12R1.71 COc1ccc(CC=C=C)cc1 Amb25163691 [0,2,0,0,0,0|2,0,0]=4 3265 B12R1.71 COc1ccc(C\C=C/Cl)cc1 Amb25053917 [0,2,0,0,0,0|2,0,0]=4 3266 B12R1.71 COc1ccc(C\C=C\Cl)cc1 Amb24740768 [0,2,0,0,0,0|2,0,0]=4 3267 B12R1.71 COc1ccc(C\C=N\O)cc1 Amb25154213 [0,2,0,0,0,0|0,0,0]=2 3268 B12R1.71 COc1ccc(cc1)N\C=N\O Amb25055103 [0,2,0,0,0,0|1,0,0]=3 3269 B12R1.71 CSc1ccc(CCCO)cc1 Amb18863034 [0,2,0,0,0,0|1,0,1]=4 3270 B12R1.71 CSc1ccc(\C=C\CO)cc1 Amb25682133 [0,2,0,0,0,0|1,0,1]=4 3271 B12R1.71 C\C=C\Cc1ccc(C=O)cc1 Amb25179875 [0,2,0,0,0,0|2,0,0]=4 3272 B12R1.71 N#Cc1ccc(\C=C\CO)cc1 Amb25787543 [0,2,0,0,0,0|1,0,1]=4 3273 B12R1.71 NCc1ccc(CCCO)cc1 Amb23441994 [0,2,0,0,0,0|1,0,1]=4 3274 B12R1.71 O=Cc1ccc(C\C=C\Cl)cc1 Amb25065318 [0,2,0,0,0,0|2,0,0]=4 3275 B12R1.71 OCCCc1ccc(C=O)cc1 Amb18646079 [0,2,0,0,0,0|1,0,1]=4 3276 B12R1.71 OCCCc1ccc(cc1)C#N Amb13883607 [0,2,0,0,0,0|1,0,1]=4 3277 B12R1.71 OCCCc1ccc(cc1)CC Amb17089498 [0,2,0,0,0,0|1,0,1]=4 3278 B12R1.385 Cc1cc(CCCO)ccc1Cl Amb24465130 [0,2,0,0,0,0|1,0,1]=4 3279 B12R1.385 Cc1cc(CCCO)ccc1F Amb18862775 [0,2,0,0,0,0|1,0,1]=4 3280 B12R1.385 Cc1cc(CCCO)ccc1O Amb24624666 [0,2,0,0,0,0|1,0,1]=4 3281 B12R1.385 Cc1cc(C\C=C\C)ccc1N Amb24557731 [0,2,0,0,0,0|2,0,0]=4 3282 B12R1.385 Cc1cc(C\C=C\C)ccc1O Amb24598914 [0,2,0,0,0,0|2,0,0]=4 3283 B12R1.385 Cc1cc(C\C=C\Cl)ccc1O Amb18648713 [0,2,0,0,0,0|2,0,0]=4 3284 B12R1.385 Cc1cc(\C=C\CO)ccc1Br Amb25133361 [0,2,0,0,0,0|1,0,1]=4 3285 B12R1.385 Cc1ccc(CCCO)cc1Br Amb24664258 [0,2,0,0,0,0|1,0,1]=4 3286 B12R1.385 Cc1ccc(CCCO)cc1F Amb25265576 [0,2,0,0,0,0|1,0,1]=4 3287 B12R1.385 Cc1ccc(\C=C\CO)cc1Br Amb25331292 [0,2,0,0,0,0|1,0,1]=4 3288 B12R1.385 OCC=Cc1cc(Cl)c(Cl)cc1 Amb22488010 [0,2,0,0,0,0|1,0,1]=4 3289 B12R1.385 OCCCc1cc(F)c(F)cc1 Amb18224422 [0,2,0,0,0,0|1,0,1]=4 3290 B12R1.385 OCCCc1ccc(Cl)c(Br)c1 Amb23560508 [0,2,0,0,0,0|1,0,1]=4 3291 B12R1.385 OCCCc1ccc(F)c(Cl)c1 Amb18863384 [0,2,0,0,0,0|1,0,1]=4 3292 B12R1.385 OCCCc1ccc(c(c1)C)C Amb17605788 [0,2,0,0,0,0|1,0,1]=4 3293 B12R1.385 OCCCc1ccc(c(c1)Cl)Cl Amb17402982 [0,2,0,0,0,0|1,0,1]=4 3294 B12R1.385 OCCCc1ccc(c(c1)N)Cl Amb17477707 [0,2,0,0,0,0|1,0,1]=4 3295 B12R1.385 OCCCc1ccc(c(c1)N)O Amb17477699 [0,2,0,0,0,0|1,0,1]=4 3296 B12R1.385 OC\C=C/c1cc(O)c(O)cc1 Amb25271016 [0,2,0,0,0,0|1,0,1]=4 3297 B12R1.385 OC\C=C\C1=CC(=O)C(=O)C=C1 Amb24631190 [0,2,0,0,0,0|1,0,1]=4 3298 B12R1.385 OC\C=C\c1cc(Cl)c(Cl)cc1 Amb23442815 [0,2,0,0,0,0|1,0,1]=4 3299 B12R1.385 OC\C=C\c1cc(F)c(F)cc1 Amb23555608 [0,2,0,0,0,0|1,0,1]=4 3300 B12R1.385 OC\C=C\c1cc(O)c(O)cc1 Amb22583876 [0,2,0,0,0,0|1,0,1]=4 3301 B12R1.385 OC\C=C\c1ccc(Br)c(F)c1 Amb24438785 [0,2,0,0,0,0|1,0,1]=4 3302 B12R1.385 OC\C=C\c1ccc(Cl)c(Br)c1 Amb24452954 [0,2,0,0,0,0|1,0,1]=4 3303 B12R1.385 OC\C=C\c1ccc(Cl)c(F)c1 Amb25710181 [0,2,0,0,0,0|1,0,1]=4 3304 B12R1.385 Oc1ccc(CCCO)cc1F Amb24378042 [0,2,0,0,0,0|1,0,1]=4 3305 B12R1.385 Oc1ccc(\C=C\CO)cc1Cl Amb18649022 [0,2,0,0,0,0|1,0,1]=4 3306 B12R1.385 Oc1ccc(\C=C\CO)cc1F Amb25274595 [0,2,0,0,0,0|1,0,1]=4 3307 B12R1.3 C#CC(CCO)c1ccccc1 Amb25369422 [0,2,0,0,0,0|1,0,1]=4 3308 B12R1.3 C=C=CC(CO)c1ccccc1 Amb25837883 [0,2,0,0,0,0|2,0,0]=4 3309 B12R1.3 C=C\C(=C\CO)\c1ccccc1 Amb24619165 [0,2,0,0,0,0|1,0,1]=4 3310 B12R1.3 CC\C(=C\CO)\c1ccccc1 Amb25816528 [0,2,0,0,0,0|1,0,1]=4 3311 B12R1.3 CNC(C=C=C)c1ccccc1 Amb24427541 [0,2,0,0,0,0|2,0,0]=4 3312 B12R1.3 CNC(CCO)c1ccccc1 Amb18563697 [0,2,0,0,0,0|1,0,1]=4 3313 B12R1.3 COC(\C=C/Cl)c1ccccc1 Amb24426163 [0,2,0,0,0,0|2,0,0]=4 3314 B12R1.3 C\C=C\C(C=O)c1ccccc1 Amb24628954 [0,2,0,0,0,0|2,0,0]=4 3315 B12R1.3 C\C=C\C(CN)c1ccccc1 Amb24483889 [0,2,0,0,0,0|2,0,0]=4 3316 B12R1.3 C\C=C\C(CO)c1ccccc1 Amb24431887 [0,2,0,0,0,0|2,0,0]=4 3317 B12R1.3 C\C=C\C(NC)c1ccccc1 Amb18645551 [0,2,0,0,0,0|2,0,0]=4 3318 B12R1.3 OCCC(c1ccccc1)C#N Amb17334526 [0,2,0,0,0,0|1,0,1]=4 3319 B12R1.3 OCCC(c1ccccc1)CC Amb17232488 [0,2,0,0,0,0|1,0,1]=4 3320 B12R1.3 OC\C=C(\CF)/c1ccccc1 Amb25769424 [0,2,0,0,0,0|1,0,1]=4 3321 B12R1.3 ON/C=C(\C=O)c1ccccc1 Amb17777667 [0,2,0,0,0,0|0,0,2]=4 3322 B12R1.3 ON=C(\C=N\O)c1ccccc1 Amb24740111 [0,2,0,0,0,0|0,0,1]=3 3323 B12R1.3 O\N=C(\c1ccccc1)/C=N/O Amb1085990 [0,2,0,0,0,0|0,0,1]=3 3324 B12R1.3 O\N=C\C(C=O)c1ccccc1 Amb25302254 [0,2,0,0,0,0|0,0,0]=2 3325 B12R1.3 [C-]#[N+]C(CCO)c1ccccc1 Amb24431832 [0,2,0,0,0,0|1,0,1]=4 3326 B12R1.17 C=C=CC(O)c1cccc(Cl)c1 Amb24457897 [0,2,0,0,0,0|2,0,0]=4 3327 B12R1.17 C=C=C[C@@H](O)c1cccc(Cl)c1 Amb25058583 [0,2,0,0,0,0|2,0,0]=4 3328 B12R1.17 C=C=C[C@H](O)c1cccc(Cl)c1 Amb25205005 [0,2,0,0,0,0|2,0,0]=4 3329 B12R1.17 CC(\C=N\N)c1cccc(Br)c1 Amb24473846 [0,2,0,0,0,0|1,0,0]=3 3330 B12R1.17 CC(\C=N\N)c1cccc(Cl)c1 Amb25285373 [0,2,0,0,0,0|1,0,0]=3 3331 B12R1.17 C\C(=C\CO)\c1cccc(Br)c1 Amb25260939 [0,2,0,0,0,0|1,0,1]=4 3332 B12R1.17 Cc1cc(ccc1)C(Cl)CCO Amb24355343 [0,2,0,0,0,0|1,0,1]=4 3333 B12R1.17 Cc1cc(ccc1)C(O)C=C=C Amb25356399 [0,2,0,0,0,0|2,0,0]=4 3334 B12R1.17 Cc1cc(ccc1)[C@@H](N)CCO Amb19888371 [0,2,0,0,0,0|1,0,1]=4 3335 B12R1.17 Cc1cc(ccc1)[C@@H](O)C=C=C Amb25045732 [0,2,0,0,0,0|2,0,0]=4 3336 B12R1.17 Cc1cc(ccc1)[C@H](N)CCO Amb19887706 [0,2,0,0,0,0|1,0,1]=4 3337 B12R1.17 Cc1cc(ccc1)[C@H](O)C=C=C Amb25846980 [0,2,0,0,0,0|2,0,0]=4 3338 B12R1.17 Cc1cccc(c1)[C@@H](C)CCO Amb25155793 [0,2,0,0,0,0|1,0,1]=4 3339 B12R1.17 Cc1cccc(c1)\C(\C)=C/CO Amb25852937 [0,2,0,0,0,0|1,0,1]=4 3340 B12R1.17 NC(CCO)c1cc(Br)ccc1 Amb18990231 [0,2,0,0,0,0|1,0,1]=4 3341 B12R1.17 NC(CCO)c1cc(O)ccc1 Amb19887678 [0,2,0,0,0,0|1,0,1]=4 3342 B12R1.17 NC(CCO)c1cc(S)ccc1 Amb24655390 [0,2,0,0,0,0|1,0,1]=4 3343 B12R1.17 N[C@@H](CCO)c1cc(Cl)ccc1 Amb19888404 [0,2,0,0,0,0|1,0,1]=4 3344 B12R1.17 N[C@@H](CCO)c1cc(F)ccc1 Amb19888379 [0,2,0,0,0,0|1,0,1]=4 3345 B12R1.17 N[C@@H](CCO)c1cc(O)ccc1 Amb19888375 [0,2,0,0,0,0|1,0,1]=4 3346 B12R1.17 N[C@@H](CCO)c1cc(O)ccc1 Amb19929578 [0,2,0,0,0,0|1,0,1]=4 3347 B12R1.17 N[C@@H](CCO)c1cc(S)ccc1 Amb24745621 [0,2,0,0,0,0|1,0,1]=4 3348 B12R1.17 N[C@H](CCO)c1cc(Br)ccc1 Amb19887619 [0,2,0,0,0,0|1,0,1]=4 3349 B12R1.17 N[C@H](CCO)c1cc(Br)ccc1 Amb19943918 [0,2,0,0,0,0|1,0,1]=4 3350 B12R1.17 N[C@H](CCO)c1cc(Cl)ccc1 Amb19887652 [0,2,0,0,0,0|1,0,1]=4 3351 B12R1.17 N[C@H](CCO)c1cc(F)ccc1 Amb19887668 [0,2,0,0,0,0|1,0,1]=4 3352 B12R1.17 N[C@H](CCO)c1cc(F)ccc1 Amb19888995 [0,2,0,0,0,0|1,0,1]=4 3353 B12R1.17 N[C@H](CCO)c1cc(O)ccc1 Amb19887679 [0,2,0,0,0,0|1,0,1]=4 3354 B12R1.17 Nc1cccc(c1)C(N)CCO Amb19929590 [0,2,0,0,0,0|1,0,1]=4 3355 B12R1.17 Nc1cccc(c1)C(N)CCO Amb22235814 [0,2,0,0,0,0|1,0,1]=4 3356 B12R1.17 Nc1cccc(c1)[C@H](N)CCO Amb19887593 [0,2,0,0,0,0|1,0,1]=4 3357 B12R1.17 OCCC(Cl)c1cc(F)ccc1 Amb24444966 [0,2,0,0,0,0|1,0,1]=4 3358 B12R1.17 OCCC(O)c1cccc(Br)c1 Amb24513513 [0,2,0,0,0,0|1,0,1]=4 3359 B12R1.17 OCCC(O)c1cccc(F)c1 Amb24406026 [0,2,0,0,0,0|1,0,1]=4 3360 B12R1.17 OCCC(c1cccc(c1)C)C Amb17232501 [0,2,0,0,0,0|1,0,1]=4 3361 B12R1.17 OCCC(c1cccc(c1)C)N Amb17103954 [0,2,0,0,0,0|1,0,1]=4 3362 B12R1.17 OCCC(c1cccc(c1)Cl)C Amb17234166 [0,2,0,0,0,0|1,0,1]=4 3363 B12R1.17 OCCC(c1cccc(c1)Cl)N Amb2417047 [0,2,0,0,0,0|1,0,1]=4 3364 B12R1.17 OCCC(c1cccc(c1)F)C Amb17232674 [0,2,0,0,0,0|1,0,1]=4 3365 B12R1.17 OCC[C@@H](O)c1cccc(Cl)c1 Amb25049479 [0,2,0,0,0,0|1,0,1]=4 3366 B12R1.17 OCC[C@@H](O)c1cccc(F)c1 Amb24405405 [0,2,0,0,0,0|1,0,1]=4 3367 B12R1.17 ONCC(c1cccc(c1)Br)O Amb17345006 [0,2,0,0,0,0|0,0,2]=4 3368 B12R1.17 ONCC(c1cccc(c1)C)O Amb17334703 [0,2,0,0,0,0|0,0,2]=4 3369 B12R1.17 ONCC(c1cccc(c1)Cl)O Amb17335948 [0,2,0,0,0,0|0,0,2]=4 3370 B12R1.17 ONCC(c1cccc(c1)O)O Amb17334759 [0,2,0,0,0,0|0,0,2]=4 3371 B12R1.17 O\N=C\C(=O)c1cccc(F)c1 Amb25143495 [0,2,0,0,0,0|0,0,1]=3 3372 B12R1.17 Oc1cc(ccc1)C(=O)\C=N\O Amb25706998 [0,2,0,0,0,0|0,0,1]=3 3373 B12R1.17 Oc1cccc(c1)C(O)CCO Amb24430894 [0,2,0,0,0,0|1,0,1]=4 3374 B12R1.17 Oc1cccc(c1)[C@@H](O)CCO Amb24686857 [0,2,0,0,0,0|1,0,1]=4 3375 B12R1.17 Oc1cccc(c1)[C@H](O)CCO Amb25797566 [0,2,0,0,0,0|1,0,1]=4 3376 B12R1.30 C#C\C=C\C(O)c1ccccc1 Amb24352319 [0,2,0,0,0,0|2,0,0]=4 3377 B12R1.30 C#C\C=C\[C@@H](O)c1ccccc1 Amb24354449 [0,2,0,0,0,0|2,0,0]=4 3378 B12R1.30 C=C=CCC(Cl)c1ccccc1 Amb25700989 [0,2,0,0,0,0|2,0,0]=4 3379 B12R1.30 C=C\C=C\C(O)c1ccccc1 Amb25816538 [0,2,0,0,0,0|2,0,0]=4 3380 B12R1.30 CC(=C=CCO)c1ccccc1 Amb25855530 [0,2,0,0,0,0|1,0,1]=4 3381 B12R1.30 CC(C#CCO)c1ccccc1 Amb24457769 [0,2,0,0,0,0|1,0,1]=4 3382 B12R1.30 CC(CN=C=S)c1ccccc1 Amb25102676 [0,2,0,0,0,0|0,1,1]=4 3383 B12R1.30 CC(C\C=N\N)c1ccccc1 Amb24685554 [0,2,0,0,0,0|1,0,0]=3 3384 B12R1.30 CC(OCCO)c1ccccc1 Amb24103429 [0,2,0,0,0,0|1,0,1]=4 3385 B12R1.30 CC(\C=C\C#N)c1ccccc1 Amb18644939 [0,2,0,0,0,0|2,0,0]=4 3386 B12R1.30 CC(\C=C\C=O)c1ccccc1 Amb24554527 [0,2,0,0,0,0|1,0,1]=4 3387 B12R1.30 CC(\C=C\CCl)c1ccccc1 Amb25776220 [0,2,0,0,0,0|2,0,0]=4 3388 B12R1.30 CC(\C=C\CN)c1ccccc1 Amb24702766 [0,2,0,0,0,0|2,0,0]=4 3389 B12R1.30 CC(\N=C\CCl)c1ccccc1 Amb24558631 [0,2,0,0,0,0|2,0,0]=4 3390 B12R1.30 CC=C=CC(N)c1ccccc1 Amb25679572 [0,2,0,0,0,0|2,0,0]=4 3391 B12R1.30 CC=C=C[C@H](N)c1ccccc1 Amb25771886 [0,2,0,0,0,0|2,0,0]=4 3392 B12R1.30 CC=CCC(C)c1ccccc1 Amb24062990 [0,2,0,0,0,0|2,0,0]=4 3393 B12R1.30 CC\C=C/C(N)c1ccccc1 Amb25696046 [0,2,0,0,0,0|2,0,0]=4 3394 B12R1.30 CC\C=C\C(O)c1ccccc1 Amb22546781 [0,2,0,0,0,0|2,0,0]=4 3395 B12R1.30 CC\C=N\C(C)c1ccccc1 Amb24436889 [0,2,0,0,0,0|2,0,0]=4 3396 B12R1.30 CN=C=CC(=O)c1ccccc1 Amb24497080 [0,2,0,0,0,0|1,0,1]=4 3397 B12R1.30 CN\N=C\C(=O)c1ccccc1 Amb25202730 [0,2,0,0,0,0|1,0,1]=4 3398 B12R1.30 CN\N=C\C(C)c1ccccc1 Amb24476432 [0,2,0,0,0,0|1,0,0]=3 3399 B12R1.30 COCCC(O)c1ccccc1 Amb18788453 [0,2,0,0,0,0|1,0,1]=4 3400 B12R1.30 CO\C=C/C(=O)c1ccccc1 Amb24523909 [0,2,0,0,0,0|1,0,1]=4 3401 B12R1.30 CO\C=C\C(=O)c1ccccc1 Amb24370151 [0,2,0,0,0,0|1,0,1]=4 3402 B12R1.30 CO\C=C\C(O)c1ccccc1 Amb25204750 [0,2,0,0,0,0|1,0,0]=3 3403 B12R1.30 CO\N=C\C(=O)c1ccccc1 Amb24512562 [0,2,0,0,0,0|0,0,1]=3 3404 B12R1.30 CO\N=C\C(C)c1ccccc1 Amb24403672 [0,2,0,0,0,0|0,0,0]=2 3405 B12R1.30 CO\N=C\C(O)c1ccccc1 Amb25788975 [0,2,0,0,0,0|0,0,0]=2 3406 B12R1.30 CO\N=C\[C@@H](O)c1ccccc1 Amb24592391 [0,2,0,0,0,0|0,0,0]=2 3407 B12R1.30 C[C@@H](CN=C=S)c1ccccc1 Amb19892937 [0,2,0,0,0,0|0,1,1]=4 3408 B12R1.30 C[C@@H](\N=C\CCl)c1ccccc1 Amb25187511 [0,2,0,0,0,0|2,0,0]=4 3409 B12R1.30 C[C@H](CN=C=S)c1ccccc1 Amb19892936 [0,2,0,0,0,0|0,1,1]=4 3410 B12R1.30 C\C(=C\N=C=O)\c1ccccc1 Amb24726981 [0,2,0,0,0,0|0,0,2]=4 3411 B12R1.30 C\C=C/CC(=O)c1ccccc1 Amb24594702 [0,2,0,0,0,0|2,0,0]=4 3412 B12R1.30 C\C=C/NC(C)c1ccccc1 Amb25158747 [0,2,0,0,0,0|2,0,0]=4 3413 B12R1.30 C\C=C\CN(C)c1ccccc1 Amb22546831 [0,2,0,0,0,0|2,0,0]=4 3414 B12R1.30 C\C=N\CC(O)c1ccccc1 Amb25256333 [0,2,0,0,0,0|1,0,1]=4 3415 B12R1.30 C\N=C\CC(=O)c1ccccc1 Amb25834458 [0,2,0,0,0,0|1,0,0]=3 3416 B12R1.30 ClC\C=C\C(Cl)c1ccccc1 Amb24642037 [0,2,0,0,0,0|2,0,0]=4 3417 B12R1.30 N#C\C=C\C(O)c1ccccc1 Amb18645174 [0,2,0,0,0,0|2,0,0]=4 3418 B12R1.30 NC(\C=C\CO)c1ccccc1 Amb25312103 [0,2,0,0,0,0|1,0,0]=3 3419 B12R1.30 N[C@@H](CCCO)c1ccccc1 Amb23440411 [0,2,0,0,0,0|1,0,1]=4 3420 B12R1.30 O=C=NCC(Cl)c1ccccc1 Amb24692969 [0,2,0,0,0,0|0,0,2]=4 3421 B12R1.30 O=C=N\C=C(\Cl)/c1ccccc1 Amb24375430 [0,2,0,0,0,0|0,0,2]=4 3422 B12R1.30 OC(C\C=C/Cl)c1ccccc1 Amb25109311 [0,2,0,0,0,0|2,0,0]=4 3423 B12R1.30 OC(\C=C\C=O)c1ccccc1 Amb18645664 [0,2,0,0,0,0|1,0,1]=4 3424 B12R1.30 OCC#C[C@H](O)c1ccccc1 Amb24588419 [0,2,0,0,0,0|1,0,1]=4 3425 B12R1.30 OCCCC(=O)c1ccccc1 Amb17334609 [0,2,0,0,0,0|1,0,1]=4 3426 B12R1.30 OCCCC(c1ccccc1)O Amb17334675 [0,2,0,0,0,0|1,0,1]=4 3427 B12R1.30 OCCNC(c1ccccc1)C Amb2092663 [0,2,0,0,0,0|1,0,1]=4 3428 B12R1.30 OCC\C=C(\Cl)/c1ccccc1 Amb25204635 [0,2,0,0,0,0|1,0,1]=4 3429 B12R1.30 OC\C=C\C(=O)c1ccccc1 Amb24706829 [0,2,0,0,0,0|1,0,1]=4 3430 B12R1.30 OC\C=C\C(O)c1ccccc1 Amb25071691 [0,2,0,0,0,0|1,0,0]=3 3431 B12R1.30 OC\C=C\[C@@H](O)c1ccccc1 Amb25285682 [0,2,0,0,0,0|1,0,0]=3 3432 B12R1.30 O[C@H](C\C=C/Cl)c1ccccc1 Amb25751194 [0,2,0,0,0,0|2,0,0]=4 3433 B12R1.30 O\N=C/CC(=O)c1ccccc1 Amb25833653 [0,2,0,0,0,0|0,0,0]=2 3434 B12R1.30 O\N=C\C=C(/Cl)\c1ccccc1 Amb22224815 [0,2,0,0,0,0|0,0,1]=3 3435 B12R1.30 O\N=C\CC(=O)c1cc[n]cc1 Amb24566035 [0,2,0,0,0,0|1,0,0]=3 3436 B12R1.30 O\N=C\CC(O)c1ccccc1 Amb25156836 [0,2,0,0,0,0|0,0,0]=2 3437 B12R1.30 O\N=C\NC(=S)c1ccccc1 Amb2430373 [0,2,0,0,0,0|0,0,1]=3 3438 B12R1.30 [N-]=[N+]=NCC(Cl)c1ccccc1 Amb25276328 [0,2,0,0,0,0|1,0,1]=4 3439 B12R1.30 [N-]=[N+]=NCC(N)c1ccccc1 Amb25694755 [0,2,0,0,0,0|1,0,1]=4 3440 B12R1.30 [N-]=[N+]=NCC(O)c1ccccc1 Amb18792465 [0,2,0,0,0,0|1,0,1]=4 3441 B12R1.30 [N-]=[N+]=NC[C@@H](N)c1ccccc1 Amb24398753 [0,2,0,0,0,0|1,0,1]=4 3442 B12R1.30 [N-]=[N+]=NC[C@H](O)c1ccccc1 Amb25102649 [0,2,0,0,0,0|1,0,1]=4 3443 B12R1.30 [Na]O\C=C\C(=O)c1ccccc1 Amb2370899 [0,2,0,0,0,0|1,0,1]=4 3444 B12R1.34 C#CC(=O)C(N)c1ccccc1 Amb24460507 [0,2,0,0,0,0|2,0,0]=4 3445 B12R1.34 C#CC(=O)C(O)c1ccccc1 Amb25373683 [0,2,0,0,0,0|2,0,0]=4 3446 B12R1.34 C#CC(=O)[C@H](N)c1ccccc1 Amb24426693 [0,2,0,0,0,0|2,0,0]=4 3447 B12R1.34 C=C(C#N)C(N)c1ccccc1 Amb25732983 [0,2,0,0,0,0|2,0,0]=4 3448 B12R1.34 C=C(C=C)C(O)c1ccccc1 Amb25334723 [0,2,0,0,0,0|2,0,0]=4 3449 B12R1.34 C=C(C=C)[C@@H](O)c1ccccc1 Amb25215362 [0,2,0,0,0,0|2,0,0]=4 3450 B12R1.34 C=C(C=O)C(O)c1ccccc1 Amb18645656 [0,2,0,0,0,0|1,0,1]=4 3451 B12R1.34 C=C(CO)C(=O)c1ccccc1 Amb24645413 [0,2,0,0,0,0|1,0,1]=4 3452 B12R1.34 C=C(CO)C(O)c1ccccc1 Amb24671500 [0,2,0,0,0,0|1,0,0]=3 3453 B12R1.34 C=C(CO)S(=O)c1ccccc1 Amb24497581 [0,2,0,0,0,0|2,0,0]=4 3454 B12R1.34 C=CC(=O)[C@H](F)c1ccccc1 Amb24676844 [0,2,0,0,0,0|2,0,0]=4 3455 B12R1.34 CC(=C=C)[C@H](O)c1ccccc1 Amb24352242 [0,2,0,0,0,0|2,0,0]=4 3456 B12R1.34 CC(C(=O)C=C)c1ccccc1 Amb24537754 [0,2,0,0,0,0|2,0,0]=4 3457 B12R1.34 CC(C(=O)CBr)c1ccccc1 Amb25134301 [0,2,0,0,0,0|2,0,0]=4 3458 B12R1.34 CC(C(=O)CCl)c1ccccc1 Amb25150842 [0,2,0,0,0,0|2,0,0]=4 3459 B12R1.34 CC(C(=O)CN)c1ccccc1 Amb24535411 [0,2,0,0,0,0|2,0,0]=4 3460 B12R1.34 CC(C(=O)NO)c1ccccc1 Amb25800798 [0,2,0,0,0,0|0,0,1]=3 3461 B12R1.34 CC(C(F)CO)c1ccccc1 Amb25316277 [0,2,0,0,0,0|1,0,1]=4 3462 B12R1.34 CC(C(N)CO)c1ccccc1 Amb18975503 [0,2,0,0,0,0|1,0,1]=4 3463 B12R1.34 CC(C(N)CO)c1ccccc1 Amb19349648 [0,2,0,0,0,0|1,0,1]=4 3464 B12R1.34 CC(CO)C(N)c1ccccc1 Amb18646383 [0,2,0,0,0,0|1,0,1]=4 3465 B12R1.34 CC(CO)C(O)c1ccccc1 Amb25220934 [0,2,0,0,0,0|1,0,1]=4 3466 B12R1.34 CC(CO)[C@@H](O)c1ccccc1 Amb25832639 [0,2,0,0,0,0|1,0,1]=4 3467 B12R1.34 CC(\C(\N)=N\O)c1ccccc1 Amb24595995 [0,2,0,0,0,0|0,0,0]=2 3468 B12R1.34 CC(c1ccccc1)N(C)N=O Amb24408926 [0,2,0,0,0,0|1,0,1]=4 3469 B12R1.34 CC(c1ccccc1)\C(\N)=N\N Amb25159879 [0,2,0,0,0,0|1,0,0]=3 3470 B12R1.34 CCC(=C)C(C)c1ccccc1 Amb24617256 [0,2,0,0,0,0|2,0,0]=4 3471 B12R1.34 CCC(=C)[C@@H](O)c1ccccc1 Amb25356347 [0,2,0,0,0,0|2,0,0]=4 3472 B12R1.34 CCC(=O)C(c1ccccc1)Br Amb17596238 [0,2,0,0,0,0|2,0,0]=4 3473 B12R1.34 CCC(=O)[C@@H](C)c1ccccc1 Amb25706991 [0,2,0,0,0,0|2,0,0]=4 3474 B12R1.34 CCC(=O)[C@H](C)c1ccccc1 Amb25730209 [0,2,0,0,0,0|2,0,0]=4 3475 B12R1.34 CCC(=O)[C@H](N)c1ccccc1 Amb25757342 [0,2,0,0,0,0|2,0,0]=4 3476 B12R1.34 CN(C(N)=NO)c1ccccc1 Amb18800911 [0,2,0,0,0,0|1,0,0]=3 3477 B12R1.34 CN(N=O)C(O)c1ccccc1 Amb25343971 [0,2,0,0,0,0|1,0,1]=4 3478 B12R1.34 CNC(=O)C(c1ccccc1)N Amb10609276 [0,2,0,0,0,0|1,0,1]=4 3479 B12R1.34 CNC(=O)C(c1ccccc1)O Amb17400179 [0,2,0,0,0,0|1,0,1]=4 3480 B12R1.34 CNC(=O)[C@@H](C)c1ccccc1 Amb24682080 [0,2,0,0,0,0|1,0,1]=4 3481 B12R1.34 CNC(=O)[C@H](C)c1ccccc1 Amb25277288 [0,2,0,0,0,0|1,0,1]=4 3482 B12R1.34 CNC(=O)[C@H](N)c1ccccc1 Amb24678684 [0,2,0,0,0,0|1,0,1]=4 3483 B12R1.34 CNC(=O)[C@H](O)c1ccccc1 Amb25792321 [0,2,0,0,0,0|1,0,1]=4 3484 B12R1.34 CNC(=O)[C@H](c1ccccc1)N Amb17232478 [0,2,0,0,0,0|1,0,1]=4 3485 B12R1.34 CNC(=S)C(C)c1ccccc1 Amb24756688 [0,2,0,0,0,0|1,0,1]=4 3486 B12R1.34 CNC(=S)[C@@H](C)c1ccccc1 Amb24383001 [0,2,0,0,0,0|1,0,1]=4 3487 B12R1.34 COC(=N)C(C)c1ccccc1 Amb24095998 [0,2,0,0,0,0|2,0,0]=4 3488 B12R1.34 COC(=N)C(N)c1ccccc1 Amb22471822 [0,2,0,0,0,0|2,0,0]=4 3489 B12R1.34 COC(=N)[C@H](O)c1ccccc1 Amb25832728 [0,2,0,0,0,0|2,0,0]=4 3490 B12R1.34 COC(=O)C(F)c1ccccc1 Amb24179152 [0,2,0,0,0,0|2,0,0]=4 3491 B12R1.34 COC(=O)C(O)c1ccccc1 Amb22500374 [0,2,0,0,0,0|2,0,0]=4 3492 B12R1.34 COC(=O)C(c1ccccc1)C Amb16185437 [0,2,0,0,0,0|2,0,0]=4 3493 B12R1.34 COC(=O)C(c1ccccc1)Cl Amb1212399 [0,2,0,0,0,0|2,0,0]=4 3494 B12R1.34 COC(=O)C(c1ccccc1)N Amb1196141 [0,2,0,0,0,0|2,0,0]=4 3495 B12R1.34 COC(=O)C(c1ccccc1)N Amb1911591 [0,2,0,0,0,0|2,0,0]=4 3496 B12R1.34 COC(=O)[C@@H](C)c1ccccc1 Amb24704365 [0,2,0,0,0,0|2,0,0]=4 3497 B12R1.34 COC(=O)[C@H](Cl)c1ccccc1 Amb25210876 [0,2,0,0,0,0|2,0,0]=4 3498 B12R1.34 COC(=O)[C@H](N)c1ccccc1 Amb20240647 [0,2,0,0,0,0|2,0,0]=4 3499 B12R1.34 C[C@@H](C(=O)NN)c1ccccc1 Amb25361548 [0,2,0,0,0,0|1,0,1]=4 3500 B12R1.34 C[C@@H](C(=O)NO)c1ccccc1 Amb24722255 [0,2,0,0,0,0|0,0,1]=3 3501 B12R1.34 C[C@@H](CO)C(O)c1ccccc1 Amb25769383 [0,2,0,0,0,0|1,0,1]=4 3502 B12R1.34 C[C@@H](CO)[C@@H](N)c1ccccc1 Amb25152441 [0,2,0,0,0,0|1,0,1]=4 3503 B12R1.34 C[C@@H](CO)[C@@H](O)c1ccccc1 Amb24497744 [0,2,0,0,0,0|1,0,1]=4 3504 B12R1.34 C[C@@H](CO)[C@H](N)c1ccccc1 Amb25320937 [0,2,0,0,0,0|1,0,1]=4 3505 B12R1.34 C[C@@H](CO)[C@H](O)c1ccccc1 Amb24412993 [0,2,0,0,0,0|1,0,1]=4 3506 B12R1.34 C[C@@H]([C@@H](F)CO)c1ccccc1 Amb24362837 [0,2,0,0,0,0|1,0,1]=4 3507 B12R1.34 C[C@@H]([C@@H](O)CO)c1ccccc1 Amb24662545 [0,2,0,0,0,0|1,0,1]=4 3508 B12R1.34 C[C@H](C(=C)C=O)c1ccccc1 Amb25800041 [0,2,0,0,0,0|1,0,1]=4 3509 B12R1.34 C[C@H](C(=O)NO)c1ccccc1 Amb24459061 [0,2,0,0,0,0|0,0,1]=3 3510 B12R1.34 C[C@H](CO)[C@@H](N)c1ccccc1 Amb24373854 [0,2,0,0,0,0|1,0,1]=4 3511 B12R1.34 C[C@H](CO)[C@@H](O)c1ccccc1 Amb25687837 [0,2,0,0,0,0|1,0,1]=4 3512 B12R1.34 C[C@H](CO)[C@H](O)c1ccccc1 Amb24448086 [0,2,0,0,0,0|1,0,1]=4 3513 B12R1.34 C[C@H](NO)[C@H](O)c1ccccc1 Amb24475112 [0,2,0,0,0,0|0,0,2]=4 3514 B12R1.34 C[C@H]([C@H](N)CO)c1ccccc1 Amb24427355 [0,2,0,0,0,0|1,0,1]=4 3515 B12R1.34 C[C@H]([C@H](O)CO)c1ccccc1 Amb24735213 [0,2,0,0,0,0|1,0,1]=4 3516 B12R1.34 C\C(=C(\F)/CO)\c1ccccc1 Amb24412960 [0,2,0,0,0,0|1,0,1]=4 3517 B12R1.34 C\C(=C\O)\C(=O)c1ccccc1 Amb24725291 [0,2,0,0,0,0|1,0,1]=4 3518 B12R1.34 C\C(=N/C)\C(N)c1ccccc1 Amb24100399 [0,2,0,0,0,0|1,0,0]=3 3519 B12R1.34 C\C(=N/N)\C(C)c1ccccc1 Amb25271286 [0,2,0,0,0,0|1,0,0]=3 3520 B12R1.34 C\C(=N/O)\C(C)c1ccccc1 Amb24518613 [0,2,0,0,0,0|0,0,0]=2 3521 B12R1.34 C\C(=N\C)\C(N)c1ccccc1 Amb24493500 [0,2,0,0,0,0|1,0,0]=3 3522 B12R1.34 C\C(=N\N)\C(=O)c1ccccc1 Amb24745786 [0,2,0,0,0,0|1,0,1]=4 3523 B12R1.34 C\C(=N\O)\C(O)c1ccc[n]c1 Amb24387728 [0,2,0,0,0,0|1,0,0]=3 3524 B12R1.34 C\C(\CO)=C(\O)/c1ccccc1 Amb24520521 [0,2,0,0,0,0|1,0,1]=4 3525 B12R1.34 C\C=C(/Cl)\C(Cl)c1ccccc1 Amb24728456 [0,2,0,0,0,0|2,0,0]=4 3526 B12R1.34 C\C=C(\Cl)/C(Cl)c1ccccc1 Amb24593524 [0,2,0,0,0,0|2,0,0]=4 3527 B12R1.34 C\C=C(\Cl)/C(O)c1ccccc1 Amb25092807 [0,2,0,0,0,0|2,0,0]=4 3528 B12R1.34 NC(=S=O)C(N)c1ccccc1 Amb24739656 [0,2,0,0,0,0|1,0,1]=4 3529 B12R1.34 NC(C(=O)CCl)c1ccccc1 Amb24341671 [0,2,0,0,0,0|2,0,0]=4 3530 B12R1.34 NC(C(O)CO)c1ccccc1 Amb18646773 [0,2,0,0,0,0|1,0,1]=4 3531 B12R1.34 NC(CO)C(Cl)c1ccccc1 Amb25159303 [0,2,0,0,0,0|1,0,1]=4 3532 B12R1.34 NC(CO)C(F)c1ccccc1 Amb25299166 [0,2,0,0,0,0|1,0,1]=4 3533 B12R1.34 NC(CO)[C@H](O)c1ccccc1 Amb25247266 [0,2,0,0,0,0|1,0,1]=4 3534 B12R1.34 NNC(=O)C(F)c1ccccc1 Amb25799083 [0,2,0,0,0,0|1,0,1]=4 3535 B12R1.34 NNC(=O)C(N)c1ccccc1 Amb18061964 [0,2,0,0,0,0|1,0,1]=4 3536 B12R1.34 NNC(=O)C(S)c1ccccc1 Amb24716717 [0,2,0,0,0,0|1,0,1]=4 3537 B12R1.34 NNC(=O)C(c1ccccc1)O Amb1786264 [0,2,0,0,0,0|1,0,1]=4 3538 B12R1.34 NNC(=O)[C@@H](O)c1ccccc1 Amb22587557 [0,2,0,0,0,0|1,0,1]=4 3539 B12R1.34 NNC(=O)[C@H](O)c1ccccc1 Amb25121730 [0,2,0,0,0,0|1,0,1]=4 3540 B12R1.34 N[C@@H](C(=O)C#N)c1ccccc1 Amb24483753 [0,2,0,0,0,0|2,0,0]=4 3541 B12R1.34 N[C@@H](C(=O)NO)c1ccccc1 Amb25061821 [0,2,0,0,0,0|0,0,1]=3 3542 B12R1.34 N[C@@H](CO)C(O)c1ccccc1 Amb24739572 [0,2,0,0,0,0|1,0,1]=4 3543 B12R1.34 N[C@@H](CO)[C@H](O)c1ccccc1 Amb24487235 [0,2,0,0,0,0|1,0,1]=4 3544 B12R1.34 N[C@H](CO)[C@@H](O)c1ccccc1 Amb25789451 [0,2,0,0,0,0|1,0,1]=4 3545 B12R1.34 N[C@H]([C@H](N)CO)c1ccccc1 Amb24558772 [0,2,0,0,0,0|1,0,1]=4 3546 B12R1.34 N\C(=N\O)\C(O)c1cc[n]cc1 Amb24652342 [0,2,0,0,0,0|1,0,0]=3 3547 B12R1.34 N\C(=N\O)\C(O)c1ccc[n]c1 Amb25101564 [0,2,0,0,0,0|1,0,0]=3 3548 B12R1.34 N\C(=N\O)\C(O)c1ccccc1 Amb22052910 [0,2,0,0,0,0|0,0,0]=2 3549 B12R1.34 O=C(CCl)C(F)c1ccccc1 Amb24390277 [0,2,0,0,0,0|2,0,0]=4 3550 B12R1.34 O=C(O[SiH3])C(Cl)c1ccccc1 Amb25313110 [0,2,0,0,0,0|2,0,0]=4 3551 B12R1.34 OC(CO)C(F)c1ccccc1 Amb25792385 [0,2,0,0,0,0|1,0,1]=4 3552 B12R1.34 OC(c1ccccc1)\C(\F)=C\F Amb25317636 [0,2,0,0,0,0|2,0,0]=4 3553 B12R1.34 OCC(=O)C(O)c1ccc[n]c1 Amb25059701 [0,2,0,0,0,0|2,0,0]=4 3554 B12R1.34 OCC(=O)C(O)c1ccccc1 Amb24364158 [0,2,0,0,0,0|1,0,0]=3 3555 B12R1.34 OCC(=O)[C@@H](O)c1ccccc1 Amb24357245 [0,2,0,0,0,0|1,0,0]=3 3556 B12R1.34 OCC(C(c1ccccc1)O)Br Amb17596330 [0,2,0,0,0,0|1,0,1]=4 3557 B12R1.34 OCC(C(c1ccccc1)O)Cl Amb17594842 [0,2,0,0,0,0|1,0,1]=4 3558 B12R1.34 OCC(Cl)C(Cl)c1ccccc1 Amb25759065 [0,2,0,0,0,0|1,0,1]=4 3559 B12R1.34 OC[C@@H](O)C(O)c1ccccc1 Amb25332503 [0,2,0,0,0,0|1,0,1]=4 3560 B12R1.34 OC[C@@H](O)[C@H](O)c1ccccc1 Amb24496901 [0,2,0,0,0,0|1,0,1]=4 3561 B12R1.34 OC[C@H](Cl)[C@H](Cl)c1ccccc1 Amb25678650 [0,2,0,0,0,0|1,0,1]=4 3562 B12R1.34 OC[C@H](O)[C@@H](O)c1ccccc1 Amb25816355 [0,2,0,0,0,0|1,0,1]=4 3563 B12R1.34 OC[C@H](O)[C@H](O)c1ccccc1 Amb24735337 [0,2,0,0,0,0|1,0,1]=4 3564 B12R1.34 ONC(=O)C(Cl)c1ccccc1 Amb25361902 [0,2,0,0,0,0|0,0,1]=3 3565 B12R1.34 ONC(=O)C(F)c1ccccc1 Amb25777677 [0,2,0,0,0,0|0,0,1]=3 3566 B12R1.34 ONC(=O)C(O)c1ccc[n]c1 Amb25279670 [0,2,0,0,0,0|1,0,1]=4 3567 B12R1.34 ONC(=O)C(c1ccccc1)N Amb2430893 [0,2,0,0,0,0|0,0,1]=3 3568 B12R1.34 ONC(=O)[C@@H](O)c1ccccc1 Amb25071532 [0,2,0,0,0,0|0,0,1]=3 3569 B12R1.34 ONC(=O)[C@H](O)c1ccccc1 Amb25787201 [0,2,0,0,0,0|0,0,1]=3 3570 B12R1.34 O[C@@H](CO)[C@@H](F)c1ccccc1 Amb25206688 [0,2,0,0,0,0|1,0,1]=4 3571 B12R1.34 O[C@@H](CO)[C@H](F)c1ccccc1 Amb25157359 [0,2,0,0,0,0|1,0,1]=4 3572 B12R1.34 O[C@@H]([C@@H](Cl)CO)c1ccccc1 Amb25321935 [0,2,0,0,0,0|1,0,1]=4 3573 B12R1.34 O[C@H](c1ccccc1)C(=O)N=O Amb25157813 [0,2,0,0,0,0|0,0,1]=3 3574 B12R1.34 O[C@H](c1ccccc1)\C(\F)=C\F Amb25157818 [0,2,0,0,0,0|2,0,0]=4 3575 B12R1.34 O\C(=C/O)\C(=O)c1ccccc1 Amb24662497 [0,2,0,0,0,0|1,0,1]=4 3576 B12R1.34 O\C(=C\O)\C(=O)c1ccccc1 Amb25358915 [0,2,0,0,0,0|1,0,1]=4 3577 B12R1.34 O\C(=N\O)\C(=O)c1ccccc1 Amb25326728 [0,2,0,0,0,0|0,0,1]=3 3578 B12R1.34 O\N=C(\Cl)/C(=O)c1ccccc1 Amb24100191 [0,2,0,0,0,0|0,0,1]=3 3579 B12R1.39 CC(C)(CCO)c1ccccc1 Amb23440831 [0,2,0,0,0,0|1,0,1]=4 3580 B12R1.39 CC(N)(CCO)c1ccccc1 Amb18862633 [0,2,0,0,0,0|1,0,1]=4 3581 B12R1.39 CC(O)(CCO)c1ccccc1 Amb25716950 [0,2,0,0,0,0|1,0,1]=4 3582 B12R1.39 CC(O)(\C=C\Cl)c1ccccc1 Amb25257949 [0,2,0,0,0,0|2,0,0]=4 3583 B12R1.39 CC(S)(CCO)c1ccccc1 Amb24630816 [0,2,0,0,0,0|1,0,1]=4 3584 B12R1.39 C[C@@](N)(CCO)c1ccccc1 Amb25097043 [0,2,0,0,0,0|1,0,1]=4 3585 B12R1.39 C[C@](S)(CCO)c1ccccc1 Amb25120134 [0,2,0,0,0,0|1,0,1]=4 3586 B12R1.39 NC(O)(CCO)c1ccccc1 Amb24431011 [0,2,0,0,0,0|1,0,1]=4 3587 B12R1.39 N[C@](O)(CCO)c1ccccc1 Amb25356322 [0,2,0,0,0,0|1,0,1]=4 3588 B12R1.107 Br\C(=C/C(=O)O)\c1ccccc1 Amb10069265 [0,2,0,0,0,0|1,0,1]=4 3589 B12R1.107 CC(C)=CC(N)c1ccccc1 Amb24355884 [0,2,0,0,0,0|2,0,0]=4 3590 B12R1.107 CC(CB(O)O)c1ccccc1 Amb24725059 [0,2,0,0,0,0|1,0,1]=4 3591 B12R1.107 CC(CC(O)O)c1ccccc1 Amb25092014 [0,2,0,0,0,0|1,0,1]=4 3592 B12R1.107 CC(CS(O)=O)c1ccccc1 Amb24557264 [0,2,0,0,0,0|1,0,1]=4 3593 B12R1.107 CC(O)CC(N)c1ccccc1 Amb18646382 [0,2,0,0,0,0|1,0,1]=4 3594 B12R1.107 CC(O)CC(P)c1ccccc1 Amb25157842 [0,2,0,0,0,0|1,0,1]=4 3595 B12R1.107 CC(O)CC(S)c1ccccc1 Amb24525704 [0,2,0,0,0,0|1,0,1]=4 3596 B12R1.107 CC(O)C[C@H](O)c1ccccc1 Amb24355251 [0,2,0,0,0,0|1,0,1]=4 3597 B12R1.107 CC(c1ccccc1)CC(=O)O Amb1207393 [0,2,0,0,0,0|1,0,1]=4 3598 B12R1.107 C[C@@H](O)C[C@@H](N)c1ccccc1 Amb24634311 [0,2,0,0,0,0|1,0,1]=4 3599 B12R1.107 C[C@@H](O)C[C@H](N)c1ccccc1 Amb24711221 [0,2,0,0,0,0|1,0,1]=4 3600 B12R1.107 C[C@@H](c1ccccc1)CC(=O)O Amb10844340 [0,2,0,0,0,0|1,0,1]=4 3601 B12R1.107 C[C@H](C[C@H](C)O)c1ccccc1 Amb25741359 [0,2,0,0,0,0|1,0,1]=4 3602 B12R1.107 C[C@H](O)CC(N)c1ccccc1 Amb24608910 [0,2,0,0,0,0|1,0,1]=4 3603 B12R1.107 C[C@H](O)CC(O)c1ccccc1 Amb25846972 [0,2,0,0,0,0|1,0,1]=4 3604 B12R1.107 C[C@H](O)C[C@@H](N)c1ccccc1 Amb25152440 [0,2,0,0,0,0|1,0,1]=4 3605 B12R1.107 C[C@H](O)C[C@@H](O)c1ccccc1 Amb24431811 [0,2,0,0,0,0|1,0,1]=4 3606 B12R1.107 C[C@H](O)C[C@H](S)c1ccccc1 Amb24398074 [0,2,0,0,0,0|1,0,1]=4 3607 B12R1.107 C[C@H](c1ccccc1)CC(=O)O Amb10844379 [0,2,0,0,0,0|1,0,1]=4 3608 B12R1.107 C\C(=C\C(C)O)\c1ccccc1 Amb25823380 [0,2,0,0,0,0|1,0,1]=4 3609 B12R1.107 C\C(=C\C(O)=O)\c1ccccc1 Amb24271190 [0,2,0,0,0,0|1,0,1]=4 3610 B12R1.107 C\C(\Cl)=C\C(Cl)c1ccccc1 Amb25277290 [0,2,0,0,0,0|2,0,0]=4 3611 B12R1.107 C\C(\Cl)=C\C(O)c1ccccc1 Amb25681436 [0,2,0,0,0,0|2,0,0]=4 3612 B12R1.107 Cl\C(=C/C(=O)O)\c1ccccc1 Amb17594707 [0,2,0,0,0,0|1,0,1]=4 3613 B12R1.107 NC(CB(O)O)c1ccccc1 Amb24658322 [0,2,0,0,0,0|1,0,1]=4 3614 B12R1.107 NC(c1ccccc1)CC(=O)O Amb1048120 [0,2,0,0,0,0|1,0,1]=4 3615 B12R1.107 N\C(=C/C(O)=O)\c1ccccc1 Amb22054873 [0,2,0,0,0,0|1,0,1]=4 3616 B12R1.107 N\C(=C\C(O)=O)\c1ccccc1 Amb25274098 [0,2,0,0,0,0|1,0,1]=4 3617 B12R1.107 OB(O)OC(O)c1ccccc1 Amb24343472 [0,2,0,0,0,0|2,0,0]=4 3618 B12R1.107 OB(O)\C=C(\Br)/c1ccccc1 Amb24690203 [0,2,0,0,0,0|1,0,1]=4 3619 B12R1.107 OC(=O)CC(Cl)c1ccccc1 Amb18120400 [0,2,0,0,0,0|1,0,1]=4 3620 B12R1.107 OC(=O)CC(F)c1ccccc1 Amb24554792 [0,2,0,0,0,0|1,0,1]=4 3621 B12R1.107 OC(=O)CC(S)c1ccccc1 Amb18303085 [0,2,0,0,0,0|1,0,1]=4 3622 B12R1.107 OC(=O)\C=C(\F)/c1ccccc1 Amb24426178 [0,2,0,0,0,0|1,0,1]=4 3623 B12R1.107 OC(c1ccccc1)CC(O)C Amb1110547 [0,2,0,0,0,0|1,0,1]=4 3624 B12R1.107 O[C@H](OP(O)O)c1ccccc1 Amb24675416 [0,2,0,0,0,0|1,1,0]=4 3625 B12R1.308 C=C=CC(O)c1ccccc1O Amb25205882 [0,2,0,0,0,0|2,0,0]=4 3626 B12R1.308 C[C@H](CCO)c1ccccc1O Amb24686462 [0,2,0,0,0,0|1,0,1]=4 3627 B12R1.308 C\C(=C/CO)\c1ccccc1Br Amb24438353 [0,2,0,0,0,0|1,0,1]=4 3628 B12R1.308 C\C(=C\CO)\c1ccccc1Br Amb24623710 [0,2,0,0,0,0|1,0,1]=4 3629 B12R1.308 C\C(=C\CO)\c1ccccc1Cl Amb25209579 [0,2,0,0,0,0|1,0,1]=4 3630 B12R1.308 C\C(=C\CO)\c1ccccc1F Amb24420735 [0,2,0,0,0,0|1,0,1]=4 3631 B12R1.308 C\C(=C\CO)\c1ccccc1O Amb18646033 [0,2,0,0,0,0|1,0,1]=4 3632 B12R1.308 C\C=C/C(C)c1ccccc1O Amb25059645 [0,2,0,0,0,0|2,0,0]=4 3633 B12R1.308 C\C=C\C(C)c1ccccc1N Amb18645537 [0,2,0,0,0,0|2,0,0]=4 3634 B12R1.308 C\C=C\C(C)c1ccccc1O Amb24608614 [0,2,0,0,0,0|2,0,0]=4 3635 B12R1.308 C\C=C\C(O)c1ccccc1O Amb24378436 [0,2,0,0,0,0|2,0,0]=4 3636 B12R1.308 Cc1ccccc1C(=O)\C=N\O Amb24706809 [0,2,0,0,0,0|0,0,1]=3 3637 B12R1.308 Cc1ccccc1C(Cl)CCO Amb24692648 [0,2,0,0,0,0|1,0,1]=4 3638 B12R1.308 Cc1ccccc1C(O)C=C=C Amb25334725 [0,2,0,0,0,0|2,0,0]=4 3639 B12R1.308 Cc1ccccc1C(O)\C=C\C Amb25112696 [0,2,0,0,0,0|2,0,0]=4 3640 B12R1.308 Cc1ccccc1[C@@H](N)CCO Amb24393358 [0,2,0,0,0,0|1,0,1]=4 3641 B12R1.308 Cc1ccccc1[C@@H](O)C=C=C Amb25156851 [0,2,0,0,0,0|2,0,0]=4 3642 B12R1.308 NC(CCO)c1ccccc1Br Amb18297962 [0,2,0,0,0,0|1,0,1]=4 3643 B12R1.308 NC(CCO)c1ccccc1Cl Amb19888406 [0,2,0,0,0,0|1,0,1]=4 3644 B12R1.308 NC(CCO)c1ccccc1I Amb25729935 [0,2,0,0,0,0|1,0,1]=4 3645 B12R1.308 NC(CCO)c1ccccc1O Amb24487329 [0,2,0,0,0,0|1,0,1]=4 3646 B12R1.308 NC(CCO)c1ccccc1S Amb24488674 [0,2,0,0,0,0|1,0,1]=4 3647 B12R1.308 N[C@@H](CCO)c1ccccc1Br Amb25140602 [0,2,0,0,0,0|1,0,1]=4 3648 B12R1.308 N[C@@H](CCO)c1ccccc1Cl Amb19888408 [0,2,0,0,0,0|1,0,1]=4 3649 B12R1.308 N[C@@H](CCO)c1ccccc1S Amb25791527 [0,2,0,0,0,0|1,0,1]=4 3650 B12R1.308 N[C@H](CCO)c1ccccc1Br Amb25301240 [0,2,0,0,0,0|1,0,1]=4 3651 B12R1.308 N[C@H](CCO)c1ccccc1Cl Amb19887650 [0,2,0,0,0,0|1,0,1]=4 3652 B12R1.308 N[C@H](CCO)c1ccccc1S Amb25694372 [0,2,0,0,0,0|1,0,1]=4 3653 B12R1.308 Nc1ccccc1C(N)CCO Amb22235813 [0,2,0,0,0,0|1,0,1]=4 3654 B12R1.308 Nc1ccccc1[C@H](N)CCO Amb19887576 [0,2,0,0,0,0|1,0,1]=4 3655 B12R1.308 OCCC(O)c1ccccc1Br Amb24668754 [0,2,0,0,0,0|1,0,1]=4 3656 B12R1.308 OCCC(O)c1ccccc1Cl Amb25275717 [0,2,0,0,0,0|1,0,1]=4 3657 B12R1.308 OCCC(O)c1ccccc1F Amb24649873 [0,2,0,0,0,0|1,0,1]=4 3658 B12R1.308 OCCC(c1ccccc1C)C Amb17232499 [0,2,0,0,0,0|1,0,1]=4 3659 B12R1.308 OCCC(c1ccccc1C)N Amb17103953 [0,2,0,0,0,0|1,0,1]=4 3660 B12R1.308 OCCC(c1ccccc1Cl)C Amb17234164 [0,2,0,0,0,0|1,0,1]=4 3661 B12R1.308 OCCC(c1ccccc1Cl)N Amb1993960 [0,2,0,0,0,0|1,0,1]=4 3662 B12R1.308 OCCC(c1ccccc1F)C Amb17232671 [0,2,0,0,0,0|1,0,1]=4 3663 B12R1.308 OCCC(c1ccccc1F)N Amb2408130 [0,2,0,0,0,0|1,0,1]=4 3664 B12R1.308 OCC[C@@H](O)c1ccccc1F Amb25308216 [0,2,0,0,0,0|1,0,1]=4 3665 B12R1.308 OCC[C@H](O)c1ccccc1Br Amb24385097 [0,2,0,0,0,0|1,0,1]=4 3666 B12R1.308 OCC[C@H](O)c1ccccc1Cl Amb24748463 [0,2,0,0,0,0|1,0,1]=4 3667 B12R1.308 OCC[C@H](O)c1ccccc1F Amb25353877 [0,2,0,0,0,0|1,0,1]=4 3668 B12R1.308 ONCC(c1ccccc1C)O Amb17334702 [0,2,0,0,0,0|0,0,2]=4 3669 B12R1.308 ONCC(c1ccccc1Cl)O Amb17335947 [0,2,0,0,0,0|0,0,2]=4 3670 B12R1.308 ONCC(c1ccccc1F)O Amb17334837 [0,2,0,0,0,0|0,0,2]=4 3671 B12R1.308 O\N=C\C(=O)c1ccccc1Br Amb24400242 [0,2,0,0,0,0|0,0,1]=3 3672 B12R1.308 O\N=C\C(=O)c1ccccc1Cl Amb24349760 [0,2,0,0,0,0|0,0,1]=3 3673 B12R1.308 Oc1ccccc1C(=O)\C=C/O Amb25712234 [0,2,0,0,0,0|1,0,1]=4 3674 B12R1.308 Oc1ccccc1C(=O)\C=C\O Amb24617224 [0,2,0,0,0,0|1,0,1]=4 3675 B12R1.308 Oc1ccccc1C(=O)\C=N\O Amb25730162 [0,2,0,0,0,0|0,0,1]=3 3676 B12R1.308 Oc1ccccc1\C(\Cl)=C/CO Amb24655131 [0,2,0,0,0,0|1,0,1]=4 3677 B12R1.25 Cc1c(Cl)cccc1CCCO Amb23537657 [0,2,0,0,0,0|1,0,1]=4 3678 B12R1.25 Cc1c(F)cccc1CCCO Amb23590885 [0,2,0,0,0,0|1,0,1]=4 3679 B12R1.25 Cc1c(F)cccc1\C=C\CO Amb23442807 [0,2,0,0,0,0|1,0,1]=4 3680 B12R1.25 Cc1cccc(CCCO)c1Br Amb25159971 [0,2,0,0,0,0|1,0,1]=4 3681 B12R1.25 Cc1cccc(CCCO)c1C Amb23537989 [0,2,0,0,0,0|1,0,1]=4 3682 B12R1.25 Cc1cccc(CCCO)c1O Amb24671286 [0,2,0,0,0,0|1,0,1]=4 3683 B12R1.25 Cc1cccc(C\C=C\C)c1O Amb24617775 [0,2,0,0,0,0|2,0,0]=4 3684 B12R1.25 Cc1cccc(C\C=C\Cl)c1O Amb18648712 [0,2,0,0,0,0|2,0,0]=4 3685 B12R1.25 Cc1cccc(\C=C/CO)c1O Amb24497313 [0,2,0,0,0,0|1,0,1]=4 3686 B12R1.25 Cc1cccc(\C=C\CO)c1C Amb25139939 [0,2,0,0,0,0|1,0,1]=4 3687 B12R1.25 Cc1cccc(\C=C\CO)c1F Amb24473288 [0,2,0,0,0,0|1,0,1]=4 3688 B12R1.25 OCCCc1cccc(Cl)c1F Amb24402092 [0,2,0,0,0,0|1,0,1]=4 3689 B12R1.25 OCCCc1cccc(F)c1Br Amb25834826 [0,2,0,0,0,0|1,0,1]=4 3690 B12R1.25 OCCCc1cccc(F)c1Cl Amb25136399 [0,2,0,0,0,0|1,0,1]=4 3691 B12R1.25 OCCCc1cccc(F)c1F Amb18802844 [0,2,0,0,0,0|1,0,1]=4 3692 B12R1.25 OCCCc1cccc(O)c1O Amb25063876 [0,2,0,0,0,0|1,0,1]=4 3693 B12R1.25 OCCCc1cccc(c1Cl)Cl Amb17605780 [0,2,0,0,0,0|1,0,1]=4 3694 B12R1.25 OC\C=C\c1cccc(Cl)c1Cl Amb23555632 [0,2,0,0,0,0|1,0,1]=4 3695 B12R1.25 OC\C=C\c1cccc(Cl)c1F Amb24581201 [0,2,0,0,0,0|1,0,1]=4 3696 B12R1.25 OC\C=C\c1cccc(F)c1F Amb24593079 [0,2,0,0,0,0|1,0,1]=4 3697 B12R1.25 Oc1c(C\C=C\Cl)cccc1Cl Amb24388652 [0,2,0,0,0,0|2,0,0]=4 3698 B12R1.25 Oc1c(Cl)cccc1CCCO Amb25098650 [0,2,0,0,0,0|1,0,1]=4 3699 B12R1.25 Oc1c(F)cccc1CCCO Amb24551042 [0,2,0,0,0,0|1,0,1]=4 3700 B12R1.25 Oc1cccc(\C=C\CO)c1Cl Amb24456130 [0,2,0,0,0,0|1,0,1]=4 3701 B12R1.121 C=C=CCc1ccccc1CO Amb24100353 [0,2,0,0,0,0|2,0,0]=4 3702 B12R1.121 COc1ccccc1N\C=N\O Amb24664387 [0,2,0,0,0,0|1,0,0]=3 3703 B12R1.121 C\C=C/Cc1ccccc1C=O Amb25224450 [0,2,0,0,0,0|2,0,0]=4 3704 B12R1.121 C\C=C/Cc1ccccc1CO Amb24069147 [0,2,0,0,0,0|2,0,0]=4 3705 B12R1.121 C\C=C\Cc1ccccc1C=O Amb18126263 [0,2,0,0,0,0|2,0,0]=4 3706 B12R1.121 C\N=C/1\C=CC=CN1C\C=N\O Amb24689310 [0,2,0,0,0,0|1,0,0]=3 3707 B12R1.121 C\N=C/Cc1ccccc1OC Amb25152286 [0,2,0,0,0,0|1,0,0]=3 3708 B12R1.121 C\N=C\1/C=CC=CN1C\C=N\O Amb24060001 [0,2,0,0,0,0|1,0,0]=3 3709 B12R1.121 N#Cc1ccccc1\C=C\CO Amb18645181 [0,2,0,0,0,0|1,0,1]=4 3710 B12R1.121 NCc1ccccc1\C=C\CO Amb24575002 [0,2,0,0,0,0|1,0,1]=4 3711 B12R1.121 OC\C=C\c1ccccc1C=O Amb24629278 [0,2,0,0,0,0|1,0,1]=4 3712 B12R1.121 OC\C=C\c1ccccc1OC Amb1110152 [0,2,0,0,0,0|1,0,1]=4 3713 B12R1.125 CC(C)=CCc1ccccc1N Amb18645540 [0,2,0,0,0,0|2,0,0]=4 3714 B12R1.125 CC(C)=CCc1ccccc1O Amb24357144 [0,2,0,0,0,0|2,0,0]=4 3715 B12R1.125 CC(CCc1ccccc1O)O Amb17507249 [0,2,0,0,0,0|1,0,1]=4 3716 B12R1.125 CC(O)CCc1ccccc1Br Amb25763352 [0,2,0,0,0,0|1,0,1]=4 3717 B12R1.125 CC(O)CCc1ccccc1Cl Amb19075162 [0,2,0,0,0,0|1,0,1]=4 3718 B12R1.125 CC(O)CCc1ccccc1F Amb18805845 [0,2,0,0,0,0|1,0,1]=4 3719 B12R1.125 CC(O)CCc1ccccc1N Amb24485690 [0,2,0,0,0,0|1,0,1]=4 3720 B12R1.125 CC(O)\C=C\c1ccccc1Br Amb25086864 [0,2,0,0,0,0|1,0,1]=4 3721 B12R1.125 C\C(\Cl)=C\Cc1ccccc1O Amb24614705 [0,2,0,0,0,0|2,0,0]=4 3722 B12R1.125 Cc1ccccc1CCC(C)O Amb18800836 [0,2,0,0,0,0|1,0,1]=4 3723 B12R1.125 Cc1ccccc1\C=C\B(O)O Amb22011802 [0,2,0,0,0,0|1,0,1]=4 3724 B12R1.125 Nc1ccccc1/C=C/C(O)=O Amb17777291 [0,2,0,0,0,0|1,0,1]=4 3725 B12R1.125 Nc1ccccc1CCC(O)=O Amb24118035 [0,2,0,0,0,0|1,0,1]=4 3726 B12R1.125 OB(O)\C=C\c1ccccc1Br Amb25364964 [0,2,0,0,0,0|1,0,1]=4 3727 B12R1.125 OB(O)\C=C\c1ccccc1Cl Amb25788046 [0,2,0,0,0,0|1,0,1]=4 3728 B12R1.125 OB(O)\C=C\c1ccccc1F Amb25709562 [0,2,0,0,0,0|1,0,1]=4 3729 B12R1.125 OC(=O)CCc1ccccc1Cl Amb1209214 [0,2,0,0,0,0|1,0,1]=4 3730 B12R1.125 OC(=O)CCc1ccccc1I Amb10071543 [0,2,0,0,0,0|1,0,1]=4 3731 B12R1.125 OC(=O)CCc1ccccc1N Amb17477727 [0,2,0,0,0,0|1,0,1]=4 3732 B12R1.125 OC(=O)CCc1ccccc1O Amb1211927 [0,2,0,0,0,0|1,0,1]=4 3733 B12R1.125 OC(=O)CCc1ccccc1S Amb18648646 [0,2,0,0,0,0|1,0,1]=4 3734 B12R1.125 OC(=O)\C=C/c1ccccc1Cl Amb10070070 [0,2,0,0,0,0|1,0,1]=4 3735 B12R1.125 OC(=O)\C=C\c1ccccc1I Amb22584152 [0,2,0,0,0,0|1,0,1]=4 3736 B12R1.125 OC(=O)\C=C\c1ccccc1O Amb1935207 [0,2,0,0,0,0|1,0,1]=4 3737 B12R1.125 OC(=O)\C=C\c1ccccc1S Amb18128711 [0,2,0,0,0,0|1,0,1]=4 3738 B12R1.267 C=C\C=C/Cc1ccccc1O Amb25834462 [0,2,0,0,0,0|2,0,0]=4 3739 B12R1.267 C=C\C=C\Cc1ccccc1N Amb18126196 [0,2,0,0,0,0|2,0,0]=4 3740 B12R1.267 C=C\C=C\Cc1ccccc1O Amb25179650 [0,2,0,0,0,0|2,0,0]=4 3741 B12R1.267 CC\C=C\Cc1ccccc1O Amb25730107 [0,2,0,0,0,0|2,0,0]=4 3742 B12R1.267 COCOCc1ccccc1Br Amb21964629 [0,2,0,0,0,0|2,0,0]=4 3743 B12R1.267 C\C=C/CNc1ccccc1F Amb24072922 [0,2,0,0,0,0|2,0,0]=4 3744 B12R1.267 C\C=C\CCc1ccccc1N Amb25233153 [0,2,0,0,0,0|2,0,0]=4 3745 B12R1.267 C\C=C\CCc1ccccc1O Amb24676835 [0,2,0,0,0,0|2,0,0]=4 3746 B12R1.267 C\C=C\CNc1ccccc1Br Amb25073121 [0,2,0,0,0,0|2,0,0]=4 3747 B12R1.267 C\C=C\CNc1ccccc1F Amb24365712 [0,2,0,0,0,0|2,0,0]=4 3748 B12R1.267 C\C=C\CNc1ccccc1I Amb24739328 [0,2,0,0,0,0|2,0,0]=4 3749 B12R1.267 C\C=C\CNc1ccccc1N Amb24588670 [0,2,0,0,0,0|2,0,0]=4 3750 B12R1.267 C\C=C\COc1ccccc1F Amb24388004 [0,2,0,0,0,0|2,0,0]=4 3751 B12R1.267 C\C=C\COc1ccccc1I Amb25841807 [0,2,0,0,0,0|2,0,0]=4 3752 B12R1.267 C\C=C\COc1ccccc1N Amb18290042 [0,2,0,0,0,0|2,0,0]=4 3753 B12R1.267 C\C=C\CSc1ccccc1Cl Amb25345653 [0,2,0,0,0,0|2,0,0]=4 3754 B12R1.267 C\C=C\CSc1ccccc1F Amb25188271 [0,2,0,0,0,0|2,0,0]=4 3755 B12R1.267 C\C=C\CSc1ccccc1O Amb24422451 [0,2,0,0,0,0|2,0,0]=4 3756 B12R1.267 Cc1cc[n]cc1CC\C=N\N Amb25323420 [0,2,0,0,0,0|2,0,0]=4 3757 B12R1.267 Cc1ccccc1CCC=CC Amb22347883 [0,2,0,0,0,0|2,0,0]=4 3758 B12R1.267 Cc1ccccc1C\C=C\C=O Amb24497170 [0,2,0,0,0,0|1,0,1]=4 3759 B12R1.267 Cc1ccccc1C\C=C\CO Amb24592563 [0,2,0,0,0,0|1,0,0]=3 3760 B12R1.267 Cc1ccccc1NCCN=C Amb24406582 [0,2,0,0,0,0|1,0,1]=4 3761 B12R1.267 Cc1ccccc1N\C=N\C#N Amb24444364 [0,2,0,0,0,0|2,0,0]=4 3762 B12R1.267 Cc1ccccc1S\C=C\CO Amb24412213 [0,2,0,0,0,0|1,0,1]=4 3763 B12R1.267 Cl\C=C\COc1ccccc1I Amb24410456 [0,2,0,0,0,0|2,0,0]=4 3764 B12R1.267 Clc1ccccc1C\C=C\CCl Amb24519629 [0,2,0,0,0,0|2,0,0]=4 3765 B12R1.267 Clc1ccccc1SC\C=C\Cl Amb25797074 [0,2,0,0,0,0|2,0,0]=4 3766 B12R1.267 N#C\N=C\Nc1ccccc1Cl Amb25674365 [0,2,0,0,0,0|2,0,0]=4 3767 B12R1.267 N#C\N=C\Nc1ccccc1O Amb24391479 [0,2,0,0,0,0|2,0,0]=4 3768 B12R1.267 NOCCCc1ccccc1C Amb17089549 [0,2,0,0,0,0|1,0,1]=4 3769 B12R1.267 NOCCCc1ccccc1Cl Amb17089558 [0,2,0,0,0,0|1,0,1]=4 3770 B12R1.267 NOCCCc1ccccc1F Amb17089552 [0,2,0,0,0,0|1,0,1]=4 3771 B12R1.267 Nc1ccccc1OC\C=C\Br Amb24749836 [0,2,0,0,0,0|2,0,0]=4 3772 B12R1.267 Nc1ccccc1OC\C=C\Cl Amb18971536 [0,2,0,0,0,0|2,0,0]=4 3773 B12R1.267 Nc1ccccc1\C=C\CCO Amb24623669 [0,2,0,0,0,0|1,0,1]=4 3774 B12R1.267 O=C=NCCc1ccccc1C Amb17232365 [0,2,0,0,0,0|0,0,2]=4 3775 B12R1.267 O=C=NCCc1ccccc1Cl Amb17233866 [0,2,0,0,0,0|0,0,2]=4 3776 B12R1.267 O=C=N\C=C\c1ccccc1Cl Amb25101906 [0,2,0,0,0,0|0,0,2]=4 3777 B12R1.267 O=C=N\C=C\c1ccccc1F Amb23569113 [0,2,0,0,0,0|0,0,2]=4 3778 B12R1.267 OCCCNc1ccccc1Br Amb17306220 [0,2,0,0,0,0|1,0,1]=4 3779 B12R1.267 OCCCNc1ccccc1C Amb17306598 [0,2,0,0,0,0|1,0,1]=4 3780 B12R1.267 OCCCNc1ccccc1Cl Amb17306039 [0,2,0,0,0,0|1,0,1]=4 3781 B12R1.267 OCCCNc1ccccc1F Amb17306155 [0,2,0,0,0,0|1,0,1]=4 3782 B12R1.267 OCCNCc1ccccc1Cl Amb13949019 [0,2,0,0,0,0|1,0,1]=4 3783 B12R1.267 OCCNCc1ccccc1I Amb21861540 [0,2,0,0,0,0|1,0,1]=4 3784 B12R1.267 OCC\C=C\c1ccccc1Cl Amb25670027 [0,2,0,0,0,0|1,0,1]=4 3785 B12R1.267 OCC\C=C\c1ccccc1F Amb25221113 [0,2,0,0,0,0|1,0,1]=4 3786 B12R1.267 ONCCOc1ccccc1Br Amb17088423 [0,2,0,0,0,0|0,0,2]=4 3787 B12R1.267 ONCCOc1ccccc1C Amb17088414 [0,2,0,0,0,0|0,0,2]=4 3788 B12R1.267 ONCCOc1ccccc1Cl Amb17088420 [0,2,0,0,0,0|0,0,2]=4 3789 B12R1.267 ONCCOc1ccccc1F Amb17088417 [0,2,0,0,0,0|0,0,2]=4 3790 B12R1.267 Oc1ccccc1CCN=C=O Amb25267891 [0,2,0,0,0,0|0,0,2]=4 3791 B12R1.267 Oc1ccccc1C\C=C\C=O Amb25075559 [0,2,0,0,0,0|1,0,1]=4 3792 B12R1.267 S=C=NCCc1ccccc1C Amb17233308 [0,2,0,0,0,0|0,1,1]=4 3793 B12R1.267 S=C=NCCc1ccccc1Cl Amb17236675 [0,2,0,0,0,0|0,1,1]=4 3794 B12R1.371 C#CC(=O)Cc1ccccc1Br Amb24483898 [0,2,0,0,0,0|2,0,0]=4 3795 B12R1.371 C=C(Cc1ccccc1Cl)C=O Amb25373181 [0,2,0,0,0,0|1,0,1]=4 3796 B12R1.371 C=C(Cc1ccccc1F)C=O Amb25674264 [0,2,0,0,0,0|1,0,1]=4 3797 B12R1.371 C=CC(=O)Cc1ccccc1Cl Amb24350181 [0,2,0,0,0,0|2,0,0]=4 3798 B12R1.371 CC(CO)Cc1ccccc1Br Amb25208316 [0,2,0,0,0,0|1,0,1]=4 3799 B12R1.371 CC(CO)Cc1ccccc1Cl Amb25039912 [0,2,0,0,0,0|1,0,1]=4 3800 B12R1.371 CCC(=O)Cc1ccccc1Br Amb19148340 [0,2,0,0,0,0|2,0,0]=4 3801 B12R1.371 CCC(=O)Cc1ccccc1C Amb17138542 [0,2,0,0,0,0|2,0,0]=4 3802 B12R1.371 CCC(=O)Cc1ccccc1Cl Amb17139041 [0,2,0,0,0,0|2,0,0]=4 3803 B12R1.371 CCC(=O)Cc1ccccc1F Amb17138603 [0,2,0,0,0,0|2,0,0]=4 3804 B12R1.371 CCC(=O)Cc1ccccc1O Amb18646038 [0,2,0,0,0,0|2,0,0]=4 3805 B12R1.371 CN(Cc1ccccc1O)N=O Amb25780455 [0,2,0,0,0,0|1,0,1]=4 3806 B12R1.371 CNC(=N)Cc1ccccc1F Amb24483570 [0,2,0,0,0,0|1,0,1]=4 3807 B12R1.371 CNC(=O)Cc1ccccc1Br Amb22001453 [0,2,0,0,0,0|1,0,1]=4 3808 B12R1.371 CNC(=O)Cc1ccccc1C Amb2106609 [0,2,0,0,0,0|1,0,1]=4 3809 B12R1.371 CNC(=O)Cc1ccccc1Cl Amb23014080 [0,2,0,0,0,0|1,0,1]=4 3810 B12R1.371 CNC(=O)Cc1ccccc1F Amb23014294 [0,2,0,0,0,0|1,0,1]=4 3811 B12R1.371 CNC(=O)Cc1ccccc1N Amb1114729 [0,2,0,0,0,0|1,0,1]=4 3812 B12R1.371 COC(=N)Cc1ccccc1Cl Amb19074651 [0,2,0,0,0,0|2,0,0]=4 3813 B12R1.371 COC(=N)Cc1ccccc1F Amb18792903 [0,2,0,0,0,0|2,0,0]=4 3814 B12R1.371 COC(=O)Cc1ccccc1I Amb22749395 [0,2,0,0,0,0|2,0,0]=4 3815 B12R1.371 COC(=O)Cc1ccccc1N Amb20623565 [0,2,0,0,0,0|2,0,0]=4 3816 B12R1.371 C[C@@H](Cc1ccccc1O)CO Amb24633514 [0,2,0,0,0,0|1,0,1]=4 3817 B12R1.371 C[C@H](CO)Cc1ccccc1Cl Amb25157925 [0,2,0,0,0,0|1,0,1]=4 3818 B12R1.371 C[C@H](CO)Cc1ccccc1F Amb25837933 [0,2,0,0,0,0|1,0,1]=4 3819 B12R1.371 C[C@H](Cc1ccccc1O)CO Amb25094364 [0,2,0,0,0,0|1,0,1]=4 3820 B12R1.371 C\C(\CO)=C/c1ccccc1O Amb25838654 [0,2,0,0,0,0|1,0,1]=4 3821 B12R1.371 C\C(\CO)=C\c1ccccc1Br Amb25335085 [0,2,0,0,0,0|1,0,1]=4 3822 B12R1.371 C\C(\CO)=C\c1ccccc1Cl Amb24557711 [0,2,0,0,0,0|1,0,1]=4 3823 B12R1.371 C\C(\CO)=C\c1ccccc1F Amb24700903 [0,2,0,0,0,0|1,0,1]=4 3824 B12R1.371 C\C(\CO)=C\c1ccccc1O Amb18646032 [0,2,0,0,0,0|1,0,1]=4 3825 B12R1.371 C\C(\Cc1ccccc1Cl)=N\N Amb25106628 [0,2,0,0,0,0|1,0,0]=3 3826 B12R1.371 C\C(\Cc1ccccc1Cl)=N\O Amb25290972 [0,2,0,0,0,0|0,0,0]=2 3827 B12R1.371 C\C(\Cc1ccccc1F)=N\O Amb25252610 [0,2,0,0,0,0|0,0,0]=2 3828 B12R1.371 C\C(\Cc1ccccc1I)=N\N Amb24525431 [0,2,0,0,0,0|1,0,0]=3 3829 B12R1.371 C\C(\Cc1ccccc1O)=C/C Amb25130619 [0,2,0,0,0,0|2,0,0]=4 3830 B12R1.371 C\C(\Cc1ccccc1O)=C\C Amb24380771 [0,2,0,0,0,0|2,0,0]=4 3831 B12R1.371 C\C(\Cc1ccccc1O)=N\O Amb25211004 [0,2,0,0,0,0|0,0,0]=2 3832 B12R1.371 Cc1[n]cccc1CC(=O)NO Amb24448842 [0,2,0,0,0,0|1,0,1]=4 3833 B12R1.371 Cc1[n]cccc1C\C(\N)=N\O Amb25683975 [0,2,0,0,0,0|1,0,0]=3 3834 B12R1.371 Cc1[n]cccc1N\C(\N)=N\O Amb25751512 [0,2,0,0,0,0|2,0,0]=4 3835 B12R1.371 Cc1cc[n]cc1C\C(\N)=N\O Amb25268577 [0,2,0,0,0,0|1,0,0]=3 3836 B12R1.371 Cc1ccc[n]c1C\C(\N)=N\O Amb25098173 [0,2,0,0,0,0|1,0,0]=3 3837 B12R1.371 Cc1ccccc1CC(=N)OC Amb18798191 [0,2,0,0,0,0|2,0,0]=4 3838 B12R1.371 Cc1ccccc1CC(=O)C#C Amb25209391 [0,2,0,0,0,0|2,0,0]=4 3839 B12R1.371 Cc1ccccc1CC(=O)C=C Amb25678802 [0,2,0,0,0,0|2,0,0]=4 3840 B12R1.371 Cc1ccccc1CC(=O)CN Amb18829246 [0,2,0,0,0,0|2,0,0]=4 3841 B12R1.371 Cc1ccccc1CC(=O)CO Amb18563611 [0,2,0,0,0,0|1,0,0]=3 3842 B12R1.371 Cc1ccccc1CC(C)CO Amb25152371 [0,2,0,0,0,0|1,0,1]=4 3843 B12R1.371 Cc1ccccc1CC(N)=NN Amb18788207 [0,2,0,0,0,0|1,0,0]=3 3844 B12R1.371 Cc1ccccc1CC(O)CO Amb24615514 [0,2,0,0,0,0|1,0,1]=4 3845 B12R1.371 Cc1ccccc1C\C(\C)=N/N Amb24458307 [0,2,0,0,0,0|1,0,0]=3 3846 B12R1.371 Cc1ccccc1NC(=S)NO Amb24342052 [0,2,0,0,0,0|1,0,1]=4 3847 B12R1.371 Cc1ccccc1NC(N)=NO Amb18800914 [0,2,0,0,0,0|1,0,0]=3 3848 B12R1.371 Cc1ccccc1SC(=C)CO Amb25271481 [0,2,0,0,0,0|2,0,0]=4 3849 B12R1.371 Cc1ccccc1\C=C(\F)/CO Amb24407513 [0,2,0,0,0,0|1,0,1]=4 3850 B12R1.371 N=C(CN1C=CC=CC1=O)NO Amb22497561 [0,2,0,0,0,0|1,0,1]=4 3851 B12R1.371 NC(CO)Cc1ccccc1Br Amb18747032 [0,2,0,0,0,0|1,0,1]=4 3852 B12R1.371 NC(CO)Cc1ccccc1I Amb25200271 [0,2,0,0,0,0|1,0,1]=4 3853 B12R1.371 NC(Cc1[n]c[n]cc1O)=NO Amb24695921 [0,2,0,0,0,0|2,0,0]=4 3854 B12R1.371 NC(Cc1ccccc1Cl)=NN Amb19045351 [0,2,0,0,0,0|1,0,0]=3 3855 B12R1.371 NC(Cc1ccccc1O)CO Amb18827210 [0,2,0,0,0,0|1,0,1]=4 3856 B12R1.371 NC(Nc1ccccc1Cl)=NO Amb19075681 [0,2,0,0,0,0|1,0,0]=3 3857 B12R1.371 NC(Nc1ccccc1F)=NO Amb18185590 [0,2,0,0,0,0|1,0,0]=3 3858 B12R1.371 NCC(=O)Cc1ccccc1Br Amb25667280 [0,2,0,0,0,0|2,0,0]=4 3859 B12R1.371 NCC(=O)Cc1ccccc1Cl Amb18909368 [0,2,0,0,0,0|2,0,0]=4 3860 B12R1.371 NCC(=O)Cc1ccccc1F Amb18827239 [0,2,0,0,0,0|2,0,0]=4 3861 B12R1.371 NNC(=O)Cc1ccccc1Br Amb22484618 [0,2,0,0,0,0|1,0,1]=4 3862 B12R1.371 NNC(=O)Cc1ccccc1F Amb1126168 [0,2,0,0,0,0|1,0,1]=4 3863 B12R1.371 NNC(=O)Cc1ccccc1I Amb25334643 [0,2,0,0,0,0|1,0,1]=4 3864 B12R1.371 N[C@@H](CO)Cc1ccccc1Cl Amb25106847 [0,2,0,0,0,0|1,0,1]=4 3865 B12R1.371 N[C@@H](CO)Cc1ccccc1F Amb25331070 [0,2,0,0,0,0|1,0,1]=4 3866 B12R1.371 N[C@H](CO)Cc1ccccc1Br Amb24424605 [0,2,0,0,0,0|1,0,1]=4 3867 B12R1.371 N[C@H](CO)Cc1ccccc1Cl Amb22233157 [0,2,0,0,0,0|1,0,1]=4 3868 B12R1.371 N[C@H](CO)Cc1ccccc1F Amb25308478 [0,2,0,0,0,0|1,0,1]=4 3869 B12R1.371 N\C(\CN1C=CC=CC1=O)=N/O Amb19226291 [0,2,0,0,0,0|1,0,0]=3 3870 B12R1.371 N\C(\CN1C=CC=CC1=O)=N\O Amb19514267 [0,2,0,0,0,0|1,0,0]=3 3871 B12R1.371 N\C(\Cc1[n]cccc1Br)=N\O Amb25356700 [0,2,0,0,0,0|1,0,0]=3 3872 B12R1.371 N\C(\Cc1ccccc1F)=N\N Amb18788566 [0,2,0,0,0,0|1,0,0]=3 3873 B12R1.371 N\C(\Nc1ccccc1Cl)=N\N Amb25153465 [0,2,0,0,0,0|2,0,0]=4 3874 B12R1.371 N\C(\Nc1ccccc1F)=N\N Amb24675129 [0,2,0,0,0,0|2,0,0]=4 3875 B12R1.371 Nc1ccccc1CC(=O)NN Amb25072774 [0,2,0,0,0,0|1,0,1]=4 3876 B12R1.371 Nc1ccccc1CC(N)CO Amb25712145 [0,2,0,0,0,0|1,0,1]=4 3877 B12R1.371 Nc1ccccc1C[C@H](N)CO Amb22233158 [0,2,0,0,0,0|1,0,1]=4 3878 B12R1.371 O=C(CBr)Cc1ccccc1I Amb25352153 [0,2,0,0,0,0|2,0,0]=4 3879 B12R1.371 O=C(CCl)Cc1ccccc1I Amb25253621 [0,2,0,0,0,0|2,0,0]=4 3880 B12R1.371 O=C(CF)Cc1ccccc1Cl Amb23454831 [0,2,0,0,0,0|2,0,0]=4 3881 B12R1.371 O=C(Cc1ccccc1Cl)CBr Amb25312032 [0,2,0,0,0,0|2,0,0]=4 3882 B12R1.371 OCC(=O)Cc1ccccc1Cl Amb18564303 [0,2,0,0,0,0|1,0,0]=3 3883 B12R1.371 OCC(=O)Cc1ccccc1F Amb18805788 [0,2,0,0,0,0|1,0,0]=3 3884 B12R1.371 OCC(=O)Nc1ccccc1Br Amb1109988 [0,2,0,0,0,0|2,0,0]=4 3885 B12R1.371 OCC(=O)Nc1ccccc1C Amb1110662 [0,2,0,0,0,0|2,0,0]=4 3886 B12R1.371 OCC(=O)Nc1ccccc1Cl Amb1111147 [0,2,0,0,0,0|2,0,0]=4 3887 B12R1.371 OCC(=O)Nc1ccccc1F Amb1109775 [0,2,0,0,0,0|2,0,0]=4 3888 B12R1.371 OCC(=O)Oc1ccccc1Cl Amb25072212 [0,2,0,0,0,0|2,0,0]=4 3889 B12R1.371 OCC(=O)Oc1ccccc1F Amb25122488 [0,2,0,0,0,0|2,0,0]=4 3890 B12R1.371 OCC(=O)Oc1ccccc1I Amb25056604 [0,2,0,0,0,0|2,0,0]=4 3891 B12R1.371 OCC(Cc1ccccc1C)N Amb17062685 [0,2,0,0,0,0|1,0,1]=4 3892 B12R1.371 OCC(Cc1ccccc1Cl)N Amb17062694 [0,2,0,0,0,0|1,0,1]=4 3893 B12R1.371 OCC(Cc1ccccc1F)N Amb17062688 [0,2,0,0,0,0|1,0,1]=4 3894 B12R1.371 O\N=C(\Cc1ccccc1C)/N Amb1118586 [0,2,0,0,0,0|0,0,0]=2 3895 B12R1.371 O\N=C(\Cc1ccccc1Cl)/N Amb10205341 [0,2,0,0,0,0|0,0,0]=2 3896 B12R1.371 Oc1ccccc1CC(=O)CCl Amb25376294 [0,2,0,0,0,0|2,0,0]=4 3897 B12R1.371 Oc1ccccc1CN(O)N=O Amb25287208 [0,2,0,0,0,0|1,0,1]=4 3898 B12R1.371 Oc1ccccc1OC(=O)NO Amb24631630 [0,2,0,0,0,0|1,0,1]=4 3899 B12R1.374 C\C=C\CC1=CC(=O)C=CC1=O Amb25128215 [0,2,0,0,0,0|2,0,0]=4 3900 B12R1.374 C\C=C\Cc1cc(N)ccc1O Amb24341889 [0,2,0,0,0,0|2,0,0]=4 3901 B12R1.374 Cc1cc(CCCO)c(Cl)cc1 Amb25074743 [0,2,0,0,0,0|1,0,1]=4 3902 B12R1.374 Cc1cc(CCCO)c(F)cc1 Amb25148634 [0,2,0,0,0,0|1,0,1]=4 3903 B12R1.374 Cc1cc(C\C=C\C)c(N)cc1 Amb25217587 [0,2,0,0,0,0|2,0,0]=4 3904 B12R1.374 Cc1cc(N\C=N\C)c(C)cc1 Amb25327764 [0,2,0,0,0,0|2,0,0]=4 3905 B12R1.374 Cc1ccc(Cl)cc1CCCO Amb25829954 [0,2,0,0,0,0|1,0,1]=4 3906 B12R1.374 Cc1ccc(Cl)cc1\C=C\CO Amb25721181 [0,2,0,0,0,0|1,0,1]=4 3907 B12R1.374 Cc1ccc(F)cc1\C=C\CO Amb25364684 [0,2,0,0,0,0|1,0,1]=4 3908 B12R1.374 Cc1ccc(O)c(CCCO)c1 Amb18646539 [0,2,0,0,0,0|1,0,1]=4 3909 B12R1.374 Cc1ccc(O)c(\C=C\CO)c1 Amb18646066 [0,2,0,0,0,0|1,0,1]=4 3910 B12R1.374 Cc1ccc(cc1CCCO)C Amb17400156 [0,2,0,0,0,0|1,0,1]=4 3911 B12R1.374 Nc1cc(\C=C\CO)c(N)cc1 Amb25366505 [0,2,0,0,0,0|1,0,1]=4 3912 B12R1.374 OCC=Cc1cc(F)ccc1F Amb24082691 [0,2,0,0,0,0|1,0,1]=4 3913 B12R1.374 OCCCc1cc(Br)ccc1F Amb25669437 [0,2,0,0,0,0|1,0,1]=4 3914 B12R1.374 OCCCc1cc(Cl)ccc1F Amb18863273 [0,2,0,0,0,0|1,0,1]=4 3915 B12R1.374 OCCCc1cc(F)ccc1Cl Amb25271650 [0,2,0,0,0,0|1,0,1]=4 3916 B12R1.374 OCCCc1cc(F)ccc1F Amb17605791 [0,2,0,0,0,0|1,0,1]=4 3917 B12R1.374 OC\C=C\c1cc(Br)ccc1Cl Amb24461355 [0,2,0,0,0,0|1,0,1]=4 3918 B12R1.374 OC\C=C\c1cc(Br)ccc1F Amb25742275 [0,2,0,0,0,0|1,0,1]=4 3919 B12R1.374 OC\C=C\c1cc(Cl)ccc1Cl Amb23442825 [0,2,0,0,0,0|1,0,1]=4 3920 B12R1.374 OC\C=C\c1cc(F)ccc1F Amb24404057 [0,2,0,0,0,0|1,0,1]=4 3921 B12R1.374 Oc1cc(C\C=C\Cl)c(O)cc1 Amb24652640 [0,2,0,0,0,0|2,0,0]=4 3922 B12R1.374 Oc1ccc(Cl)cc1CCCO Amb25762478 [0,2,0,0,0,0|1,0,1]=4 3923 B12R1.374 Oc1ccc(Cl)cc1C\C=C\Cl Amb24573539 [0,2,0,0,0,0|2,0,0]=4 3924 B12R1.374 Oc1ccc(Cl)cc1\C=C\CO Amb18649021 [0,2,0,0,0,0|1,0,1]=4 3925 B12R1.374 Oc1ccc(F)c(CCCO)c1 Amb24588858 [0,2,0,0,0,0|1,0,1]=4 3926 B12R1.374 Oc1ccc(F)cc1CCCO Amb24377655 [0,2,0,0,0,0|1,0,1]=4 3927 B12R1.1631 Cc1cccc(Cl)c1CCCO Amb25791304 [0,2,0,0,0,0|1,0,1]=4 3928 B12R1.1631 OCCCc1c(Cl)cccc1Br Amb25829173 [0,2,0,0,0,0|1,0,1]=4 3929 B12R1.1631 OCCCc1c(Cl)cccc1Cl Amb24356168 [0,2,0,0,0,0|1,0,1]=4 3930 B12R1.1631 OCCCc1c(F)cccc1Cl Amb17089506 [0,2,0,0,0,0|1,0,1]=4 3931 B12R1.1631 OCCCc1c(F)cccc1F Amb24447301 [0,2,0,0,0,0|1,0,1]=4 3932 B12R1.1631 OCNCc1c(Cl)cccc1Cl Amb24567203 [0,2,0,0,0,0|2,0,0]=4 3933 B12R1.1631 OC\C=C\c1c(F)cccc1F Amb23442862 [0,2,0,0,0,0|1,0,1]=4 3934 B12R1.1631 Oc1cccc(Cl)c1CCCO Amb24416761 [0,2,0,0,0,0|1,0,1]=4 3935 B12R1.28 COC\C=C\c1cccc(Br)c1 Amb25245073 [0,2,0,0,0,0|1,0,1]=4 3936 B12R1.28 C\C=C\CNc1cccc(I)c1 Amb25232855 [0,2,0,0,0,0|2,0,0]=4 3937 B12R1.28 C\C=C\COc1cccc(N)c1 Amb18971501 [0,2,0,0,0,0|2,0,0]=4 3938 B12R1.28 Cc1cc(\C=C\CCO)ccc1 Amb25333403 [0,2,0,0,0,0|1,0,1]=4 3939 B12R1.28 Cc1cc(ccc1)NC\C=C/Cl Amb25751198 [0,2,0,0,0,0|2,0,0]=4 3940 B12R1.28 Cl\C=C\CNc1cccc(Br)c1 Amb25363084 [0,2,0,0,0,0|2,0,0]=4 3941 B12R1.28 Cl\C=C\COc1cccc(I)c1 Amb24467213 [0,2,0,0,0,0|2,0,0]=4 3942 B12R1.28 Cl\C=C\CSc1cccc(Br)c1 Amb24388230 [0,2,0,0,0,0|2,0,0]=4 3943 B12R1.28 Clc1cccc(c1)OC\C=C\Cl Amb25125538 [0,2,0,0,0,0|2,0,0]=4 3944 B12R1.28 Clc1cccc(c1)SC\C=C\Cl Amb24721263 [0,2,0,0,0,0|2,0,0]=4 3945 B12R1.28 Fc1cc(ccc1)NC\C=C\Cl Amb24709921 [0,2,0,0,0,0|2,0,0]=4 3946 B12R1.28 N#C\N=C\Nc1cccc(Cl)c1 Amb24424348 [0,2,0,0,0,0|2,0,0]=4 3947 B12R1.28 NOCCCc1cccc(c1)Br Amb17089578 [0,2,0,0,0,0|1,0,1]=4 3948 B12R1.28 NOCCCc1cccc(c1)C Amb17089550 [0,2,0,0,0,0|1,0,1]=4 3949 B12R1.28 NOCCCc1cccc(c1)Cl Amb17089559 [0,2,0,0,0,0|1,0,1]=4 3950 B12R1.28 NOCCCc1cccc(c1)O Amb17089577 [0,2,0,0,0,0|1,0,1]=4 3951 B12R1.28 N\N=C\CCc1c[n]cc(F)c1 Amb25048181 [0,2,0,0,0,0|2,0,0]=4 3952 B12R1.28 Nc1cc(ccc1)OC\C=C\Cl Amb18971499 [0,2,0,0,0,0|2,0,0]=4 3953 B12R1.28 O=C=NCCc1cccc(F)c1 Amb24392961 [0,2,0,0,0,0|0,0,2]=4 3954 B12R1.28 O=C=NCCc1cccc(c1)Br Amb17247243 [0,2,0,0,0,0|0,0,2]=4 3955 B12R1.28 O=C=NCCc1cccc(c1)C Amb17232366 [0,2,0,0,0,0|0,0,2]=4 3956 B12R1.28 O=C=N\C=C\c1cccc(Cl)c1 Amb25246678 [0,2,0,0,0,0|0,0,2]=4 3957 B12R1.28 O=C=N\C=C\c1cccc(F)c1 Amb23569112 [0,2,0,0,0,0|0,0,2]=4 3958 B12R1.28 OCCCCc1cccc(Br)c1 Amb20668830 [0,2,0,0,0,0|1,0,1]=4 3959 B12R1.28 OCCCNc1cccc(I)c1 Amb25091300 [0,2,0,0,0,0|1,0,1]=4 3960 B12R1.28 OCCCNc1cccc(c1)Br Amb17306225 [0,2,0,0,0,0|1,0,1]=4 3961 B12R1.28 OCCCNc1cccc(c1)C Amb17306565 [0,2,0,0,0,0|1,0,1]=4 3962 B12R1.28 OCCCNc1cccc(c1)Cl Amb17307144 [0,2,0,0,0,0|1,0,1]=4 3963 B12R1.28 OCCCNc1cccc(c1)F Amb17306246 [0,2,0,0,0,0|1,0,1]=4 3964 B12R1.28 OCCNCc1cccc(Cl)c1 Amb22284257 [0,2,0,0,0,0|1,0,1]=4 3965 B12R1.28 OCCNCc1cccc(F)c1 Amb24271193 [0,2,0,0,0,0|1,0,1]=4 3966 B12R1.28 OCCOCc1cccc(c1)Cl Amb2438435 [0,2,0,0,0,0|1,0,1]=4 3967 B12R1.28 OCC\C=C\c1cc(Cl)ccc1 Amb25357329 [0,2,0,0,0,0|1,0,1]=4 3968 B12R1.28 OCC\C=C\c1cc(F)ccc1 Amb25157956 [0,2,0,0,0,0|1,0,1]=4 3969 B12R1.28 OC\C=C\Cc1cc(Cl)ccc1 Amb25725507 [0,2,0,0,0,0|1,0,0]=3 3970 B12R1.28 ONCCOc1cccc(c1)Br Amb17088424 [0,2,0,0,0,0|0,0,2]=4 3971 B12R1.28 ONCCOc1cccc(c1)C Amb17088415 [0,2,0,0,0,0|0,0,2]=4 3972 B12R1.28 ONCCOc1cccc(c1)Cl Amb17088421 [0,2,0,0,0,0|0,0,2]=4 3973 B12R1.28 ONCCOc1cccc(c1)F Amb17088418 [0,2,0,0,0,0|0,0,2]=4 3974 B12R1.28 Oc1cc(CCN=C=O)ccc1 Amb24636993 [0,2,0,0,0,0|0,0,2]=4 3975 B12R1.28 S=C=NCCc1cccc(c1)Br Amb17255960 [0,2,0,0,0,0|0,1,1]=4 3976 B12R1.28 S=C=NCCc1cccc(c1)C Amb17233309 [0,2,0,0,0,0|0,1,1]=4 3977 B12R1.50 C#CC(=O)Cc1cccc(Br)c1 Amb25042972 [0,2,0,0,0,0|2,0,0]=4 3978 B12R1.50 C=CC(=O)Cc1cccc(Br)c1 Amb24450582 [0,2,0,0,0,0|2,0,0]=4 3979 B12R1.50 C=CC(=O)Cc1cccc(N)c1 Amb25809299 [0,2,0,0,0,0|2,0,0]=4 3980 B12R1.50 CC(CO)Cc1cc(Br)ccc1 Amb25729945 [0,2,0,0,0,0|1,0,1]=4 3981 B12R1.50 CC(CO)Cc1cc(Cl)ccc1 Amb25212222 [0,2,0,0,0,0|1,0,1]=4 3982 B12R1.50 CC(CO)Cc1cc(F)ccc1 Amb25228330 [0,2,0,0,0,0|1,0,1]=4 3983 B12R1.50 CC(Cc1cc(O)ccc1)CO Amb24579423 [0,2,0,0,0,0|1,0,1]=4 3984 B12R1.50 CC(Cc1cccc(F)c1)NO Amb25056304 [0,2,0,0,0,0|0,0,2]=4 3985 B12R1.50 CCC(=O)Cc1cccc(c1)Br Amb17477613 [0,2,0,0,0,0|2,0,0]=4 3986 B12R1.50 CCC(=O)Cc1cccc(c1)C Amb17138543 [0,2,0,0,0,0|2,0,0]=4 3987 B12R1.50 CCC(=O)Cc1cccc(c1)Cl Amb17139042 [0,2,0,0,0,0|2,0,0]=4 3988 B12R1.50 CCC(=O)Cc1cccc(c1)F Amb17138604 [0,2,0,0,0,0|2,0,0]=4 3989 B12R1.50 CN(Cc1cccc(Cl)c1)N=O Amb25053417 [0,2,0,0,0,0|1,0,1]=4 3990 B12R1.50 CNC(=N)Cc1cccc(Br)c1 Amb25830995 [0,2,0,0,0,0|1,0,1]=4 3991 B12R1.50 CNC(=O)Cc1cccc(Br)c1 Amb23111023 [0,2,0,0,0,0|1,0,1]=4 3992 B12R1.50 CNC(=O)Cc1cccc(Cl)c1 Amb22984156 [0,2,0,0,0,0|1,0,1]=4 3993 B12R1.50 CNC(=O)Cc1cccc(O)c1 Amb18788342 [0,2,0,0,0,0|1,0,1]=4 3994 B12R1.50 CNC(=O)Cc1cccc(c1)C Amb2106610 [0,2,0,0,0,0|1,0,1]=4 3995 B12R1.50 COC(=N)Cc1cccc(Br)c1 Amb25046776 [0,2,0,0,0,0|2,0,0]=4 3996 B12R1.50 COC(=N)Cc1cccc(Cl)c1 Amb19057373 [0,2,0,0,0,0|2,0,0]=4 3997 B12R1.50 COC(=N)Cc1cccc(F)c1 Amb18788552 [0,2,0,0,0,0|2,0,0]=4 3998 B12R1.50 COC(=O)Cc1cccc(S)c1 Amb22490996 [0,2,0,0,0,0|2,0,0]=4 3999 B12R1.50 COC(=O)Cc1cccc(c1)N Amb10071208 [0,2,0,0,0,0|2,0,0]=4 4000 B12R1.50 C\C(\CO)=C\c1cc(O)ccc1 Amb25369722 [0,2,0,0,0,0|1,0,1]=4 4001 B12R1.50 C\C(\Cc1cc(O)ccc1)=N/O Amb24487234 [0,2,0,0,0,0|0,0,0]=2 4002 B12R1.50 C\C(\Cc1cc(O)ccc1)=N\O Amb25227653 [0,2,0,0,0,0|0,0,0]=2 4003 B12R1.50 C\C(\Cc1cccc(Br)c1)=N\O Amb24634595 [0,2,0,0,0,0|0,0,0]=2 4004 B12R1.50 C\C(\Cc1cccc(Cl)c1)=N\N Amb24636219 [0,2,0,0,0,0|1,0,0]=3 4005 B12R1.50 C\C(\Cc1cccc(F)c1)=N\N Amb25725343 [0,2,0,0,0,0|1,0,0]=3 4006 B12R1.50 C\C(\Cc1cccc(F)c1)=N\O Amb25225688 [0,2,0,0,0,0|0,0,0]=2 4007 B12R1.50 Cc1cc(CC(=N)OC)ccc1 Amb18798192 [0,2,0,0,0,0|2,0,0]=4 4008 B12R1.50 Cc1cc(CC(=O)C=C)ccc1 Amb25278058 [0,2,0,0,0,0|2,0,0]=4 4009 B12R1.50 Cc1cc(CC(=O)CBr)ccc1 Amb25089939 [0,2,0,0,0,0|2,0,0]=4 4010 B12R1.50 Cc1cc(CC(=O)CN)ccc1 Amb18829247 [0,2,0,0,0,0|2,0,0]=4 4011 B12R1.50 Cc1cc(CC(=O)CO)ccc1 Amb18563612 [0,2,0,0,0,0|1,0,0]=3 4012 B12R1.50 Cc1cc(CC(=O)NO)ccc1 Amb18798398 [0,2,0,0,0,0|0,0,1]=3 4013 B12R1.50 Cc1cc(CC(N)=NN)ccc1 Amb18798212 [0,2,0,0,0,0|1,0,0]=3 4014 B12R1.50 Cc1cc(CC(O)CO)ccc1 Amb24397224 [0,2,0,0,0,0|1,0,1]=4 4015 B12R1.50 Cc1cc(C[C@@H](N)CO)ccc1 Amb24362986 [0,2,0,0,0,0|1,0,1]=4 4016 B12R1.50 Cc1cc(ccc1)NC(N)=NO Amb18800913 [0,2,0,0,0,0|1,0,0]=3 4017 B12R1.50 Cc1cc(ccc1)OC(=O)CO Amb25160233 [0,2,0,0,0,0|2,0,0]=4 4018 B12R1.50 Cc1cccc(CC(C)CO)c1 Amb24341616 [0,2,0,0,0,0|1,0,1]=4 4019 B12R1.50 Cc1cccc(C\C(\C)=N\O)c1 Amb24487383 [0,2,0,0,0,0|0,0,0]=2 4020 B12R1.50 Cc1cccc(C\C(\N)=N\O)[n]1 Amb25102864 [0,2,0,0,0,0|1,0,0]=3 4021 B12R1.50 NC(CO)Cc1cc(F)ccc1 Amb22751648 [0,2,0,0,0,0|1,0,1]=4 4022 B12R1.50 NC(CO)Cc1cc(I)ccc1 Amb24694473 [0,2,0,0,0,0|1,0,1]=4 4023 B12R1.50 NC(Nc1cccc(Cl)c1)=NO Amb19075679 [0,2,0,0,0,0|1,0,0]=3 4024 B12R1.50 NC(Nc1cccc(F)c1)=NO Amb18806076 [0,2,0,0,0,0|1,0,0]=3 4025 B12R1.50 NCC(=O)Cc1cc(Br)ccc1 Amb18160371 [0,2,0,0,0,0|2,0,0]=4 4026 B12R1.50 NCC(=O)Cc1cc(Cl)ccc1 Amb18823030 [0,2,0,0,0,0|2,0,0]=4 4027 B12R1.50 NCC(=O)Cc1cc(F)ccc1 Amb18199528 [0,2,0,0,0,0|2,0,0]=4 4028 B12R1.50 NCC(=O)Cc1cc(O)ccc1 Amb18251724 [0,2,0,0,0,0|2,0,0]=4 4029 B12R1.50 NNC(=O)Cc1cccc(I)c1 Amb25092748 [0,2,0,0,0,0|1,0,1]=4 4030 B12R1.50 NNC(=O)Cc1cccc(O)c1 Amb18788433 [0,2,0,0,0,0|1,0,1]=4 4031 B12R1.50 NNC(=O)Cc1cccc(c1)C Amb10075484 [0,2,0,0,0,0|1,0,1]=4 4032 B12R1.50 N[C@@H](Cc1cc(O)ccc1)CO Amb22233156 [0,2,0,0,0,0|1,0,1]=4 4033 B12R1.50 N[C@H](CO)Cc1cc(Cl)ccc1 Amb22233154 [0,2,0,0,0,0|1,0,1]=4 4034 B12R1.50 N\C(\Cc1c[n]cc(Br)c1)=N\O Amb24399589 [0,2,0,0,0,0|1,0,0]=3 4035 B12R1.50 N\C(\Cc1cc(O)ccc1)=N\O Amb25103462 [0,2,0,0,0,0|0,0,0]=2 4036 B12R1.50 N\C(\Cc1cccc(Br)c1)=N\N Amb25149906 [0,2,0,0,0,0|1,0,0]=3 4037 B12R1.50 N\C(\Cc1cccc(Cl)c1)=N\N Amb19045348 [0,2,0,0,0,0|1,0,0]=3 4038 B12R1.50 N\C(\Cc1cccc(F)c1)=N\N Amb18788562 [0,2,0,0,0,0|1,0,0]=3 4039 B12R1.50 N\C(\Cc1cccc(O)[n]1)=N\O Amb24514716 [0,2,0,0,0,0|1,0,0]=3 4040 B12R1.50 N\C(\Nc1cccc(Br)c1)=N\N Amb24342105 [0,2,0,0,0,0|2,0,0]=4 4041 B12R1.50 N\C(\Nc1cccc(I)c1)=N\N Amb24732785 [0,2,0,0,0,0|2,0,0]=4 4042 B12R1.50 Nc1cc(ccc1)NC(=N)NO Amb24610737 [0,2,0,0,0,0|1,0,1]=4 4043 B12R1.50 Nc1cccc(C[C@H](N)CO)c1 Amb22233155 [0,2,0,0,0,0|1,0,1]=4 4044 B12R1.50 Nc1cccc(C\C(\N)=N/O)c1 Amb24711722 [0,2,0,0,0,0|0,0,0]=2 4045 B12R1.50 O=C(CF)Cc1cc(Cl)ccc1 Amb23454832 [0,2,0,0,0,0|2,0,0]=4 4046 B12R1.50 O=C(Cc1cc(Br)ccc1)CBr Amb22233785 [0,2,0,0,0,0|2,0,0]=4 4047 B12R1.50 O=C(Cc1cccc(Br)c1)C=O Amb24402453 [0,2,0,0,0,0|1,0,1]=4 4048 B12R1.50 O=C(Cc1cccc(Cl)c1)CBr Amb24627962 [0,2,0,0,0,0|2,0,0]=4 4049 B12R1.50 OCC(=O)Cc1cc(Br)ccc1 Amb18572003 [0,2,0,0,0,0|1,0,0]=3 4050 B12R1.50 OCC(=O)Cc1cc(Cl)ccc1 Amb18564304 [0,2,0,0,0,0|1,0,0]=3 4051 B12R1.50 OCC(=O)Cc1cc(F)ccc1 Amb25232023 [0,2,0,0,0,0|1,0,0]=3 4052 B12R1.50 OCC(=O)Nc1cccc(c1)Cl Amb1110353 [0,2,0,0,0,0|2,0,0]=4 4053 B12R1.50 OCC(=O)Nc1cccc(c1)F Amb1110282 [0,2,0,0,0,0|2,0,0]=4 4054 B12R1.50 OCC(=O)Oc1cccc(Cl)c1 Amb25043439 [0,2,0,0,0,0|2,0,0]=4 4055 B12R1.50 OCC(Cc1cccc(c1)Br)N Amb17062712 [0,2,0,0,0,0|1,0,1]=4 4056 B12R1.50 OCC(Cc1cccc(c1)C)N Amb17062686 [0,2,0,0,0,0|1,0,1]=4 4057 B12R1.50 OCC(Cc1cccc(c1)Cl)N Amb17062695 [0,2,0,0,0,0|1,0,1]=4 4058 B12R1.50 OCC(Cc1cccc(c1)O)N Amb17062711 [0,2,0,0,0,0|1,0,1]=4 4059 B12R1.50 OCC(O)Cc1cccc(Cl)c1 Amb25281635 [0,2,0,0,0,0|1,0,1]=4 4060 B12R1.50 OCC(S)Cc1cc(F)ccc1 Amb25177551 [0,2,0,0,0,0|1,0,1]=4 4061 B12R1.50 ONC(=O)Cc1cccc(Br)c1 Amb25751442 [0,2,0,0,0,0|0,0,1]=3 4062 B12R1.50 ONC(=O)Cc1cccc(Cl)c1 Amb19075673 [0,2,0,0,0,0|0,0,1]=3 4063 B12R1.50 O\N=C(\Cc1cccc(c1)Cl)/N Amb1117604 [0,2,0,0,0,0|0,0,0]=2 4064 B12R1.50 Oc1cc(CC(=O)NO)ccc1 Amb18788532 [0,2,0,0,0,0|0,0,1]=3 4065 B12R1.50 Oc1cccc(CC(O)CO)c1 Amb24497069 [0,2,0,0,0,0|1,0,1]=4 4066 B12R1.100 Cc1cc(CCCO)cc(C)c1 Amb18798360 [0,2,0,0,0,0|1,0,1]=4 4067 B12R1.100 Cc1cc(N\C=N\O)[n]c(C)c1 Amb24743699 [0,2,0,0,0,0|2,0,0]=4 4068 B12R1.100 Cc1cc(\C=C\CO)cc(C)c1 Amb23555572 [0,2,0,0,0,0|1,0,1]=4 4069 B12R1.100 OCCCc1cc(Cl)cc(Br)c1 Amb25150113 [0,2,0,0,0,0|1,0,1]=4 4070 B12R1.100 OCCCc1cc(Cl)cc(c1)Cl Amb17605792 [0,2,0,0,0,0|1,0,1]=4 4071 B12R1.100 OCCCc1cc(F)cc(Br)c1 Amb24453157 [0,2,0,0,0,0|1,0,1]=4 4072 B12R1.100 OCCCc1cc(F)cc(Cl)c1 Amb24673776 [0,2,0,0,0,0|1,0,1]=4 4073 B12R1.100 OCCCc1cc(F)cc(F)c1 Amb24094063 [0,2,0,0,0,0|1,0,1]=4 4074 B12R1.100 OCCCc1cc(O)cc(O)c1 Amb24674121 [0,2,0,0,0,0|1,0,1]=4 4075 B12R1.100 OC\C=C\c1cc(F)cc(Cl)c1 Amb24446625 [0,2,0,0,0,0|1,0,1]=4 4076 B12R1.100 OC\C=C\c1cc(F)cc(F)c1 Amb19889731 [0,2,0,0,0,0|1,0,1]=4 4077 B12R1.100 Oc1cc(\C=C\CO)cc(F)c1 Amb24673086 [0,2,0,0,0,0|1,0,1]=4 4078 B12R1.226 CC(C)=CCc1cccc(O)c1 Amb24341888 [0,2,0,0,0,0|2,0,0]=4 4079 B12R1.226 CC(CCc1cccc(c1)C)O Amb17507253 [0,2,0,0,0,0|1,0,1]=4 4080 B12R1.226 CC(O)CCc1cc(O)ccc1 Amb25251886 [0,2,0,0,0,0|1,0,1]=4 4081 B12R1.226 CC(O)CCc1cccc(Cl)c1 Amb19075161 [0,2,0,0,0,0|1,0,1]=4 4082 B12R1.226 CC(O)CCc1cccc(F)c1 Amb18805846 [0,2,0,0,0,0|1,0,1]=4 4083 B12R1.226 CC(O)\C=C\c1cc(O)ccc1 Amb25065736 [0,2,0,0,0,0|1,0,1]=4 4084 B12R1.226 CC(O)\C=C\c1cccc(Br)c1 Amb25098989 [0,2,0,0,0,0|1,0,1]=4 4085 B12R1.226 CC(O)\C=C\c1cccc(Cl)c1 Amb24590748 [0,2,0,0,0,0|1,0,1]=4 4086 B12R1.226 CC(O)\C=C\c1cccc(F)c1 Amb25730368 [0,2,0,0,0,0|1,0,1]=4 4087 B12R1.226 Cc1cc(CCB(O)O)ccc1 Amb25790748 [0,2,0,0,0,0|1,0,1]=4 4088 B12R1.226 Cc1cc(\C=C\B(O)O)ccc1 Amb24487550 [0,2,0,0,0,0|1,0,1]=4 4089 B12R1.226 Cc1cccc(c1)\C=C\C(C)O Amb25683937 [0,2,0,0,0,0|1,0,1]=4 4090 B12R1.226 Cc1cccc(c1)\C=C\[C@@H](C)O Amb24404792 [0,2,0,0,0,0|1,0,1]=4 4091 B12R1.226 Cc1cccc(c1)\C=C\[C@H](C)O Amb25725509 [0,2,0,0,0,0|1,0,1]=4 4092 B12R1.226 OB(O)CCc1cccc(F)c1 Amb24392487 [0,2,0,0,0,0|1,0,1]=4 4093 B12R1.226 OB(O)\C=C\c1cccc(Br)c1 Amb25208384 [0,2,0,0,0,0|1,0,1]=4 4094 B12R1.226 OB(\C=C\c1cccc(c1)Cl)O Amb10603469 [0,2,0,0,0,0|1,0,1]=4 4095 B12R1.226 OC(=O)CCc1cccc(c1)Br Amb1209216 [0,2,0,0,0,0|1,0,1]=4 4096 B12R1.226 OC(=O)CCc1cccc(c1)C Amb1106242 [0,2,0,0,0,0|1,0,1]=4 4097 B12R1.226 OC(=O)CCc1cccc(c1)Cl Amb1672952 [0,2,0,0,0,0|1,0,1]=4 4098 B12R1.226 OC(=O)CCc1cccc(c1)F Amb1091868 [0,2,0,0,0,0|1,0,1]=4 4099 B12R1.226 OC(=O)CCc1cccc(c1)I Amb16232982 [0,2,0,0,0,0|1,0,1]=4 4100 B12R1.226 OC(=O)\C=C/c1cccc(c1)F Amb16185904 [0,2,0,0,0,0|1,0,1]=4 4101 B12R1.226 OC(=O)\C=C\c1cccc(c1)Br Amb1207365 [0,2,0,0,0,0|1,0,1]=4 4102 B12R1.226 OC(=O)\C=C\c1cccc(c1)C Amb1212079 [0,2,0,0,0,0|1,0,1]=4 4103 B12R1.226 OC(=O)\C=C\c1cccc(c1)Cl Amb1209598 [0,2,0,0,0,0|1,0,1]=4 4104 B12R1.226 OC(=O)\C=C\c1cccc(c1)F Amb1210956 [0,2,0,0,0,0|1,0,1]=4 4105 B12R1.226 OC(=O)\C=C\c1cccc(c1)I Amb2236388 [0,2,0,0,0,0|1,0,1]=4 4106 B12R1.226 OC(=O)\C=C\c1cccc(c1)N Amb1197625 [0,2,0,0,0,0|1,0,1]=4 4107 B12R1.226 OC(=O)\C=C\c1cccc(c1)O Amb1137756 [0,2,0,0,0,0|1,0,1]=4 4108 B12R1.226 Oc1cccc(c1)\C=C/C(O)=O Amb24584528 [0,2,0,0,0,0|1,0,1]=4 4109 B12R1.382 C#Cc1cccc(CCCO)c1 Amb24388502 [0,2,0,0,0,0|1,0,1]=4 4110 B12R1.382 CCc1cccc(N\C=N\O)[n]1 Amb24656804 [0,2,0,0,0,0|2,0,0]=4 4111 B12R1.382 COc1cccc(\C=C\CO)c1 Amb23442965 [0,2,0,0,0,0|1,0,1]=4 4112 B12R1.382 C\C=C/Cc1cc(C=O)ccc1 Amb25674458 [0,2,0,0,0,0|2,0,0]=4 4113 B12R1.382 C\C=C\Cc1cc(C=O)ccc1 Amb24641602 [0,2,0,0,0,0|2,0,0]=4 4114 B12R1.382 C\C=C\Cc1cc(CO)ccc1 Amb24698707 [0,2,0,0,0,0|2,0,0]=4 4115 B12R1.382 N#Cc1cccc(\C=C\CO)c1 Amb18645175 [0,2,0,0,0,0|1,0,1]=4 4116 B12R1.382 OCCCc1cccc(c1)C#N Amb17605790 [0,2,0,0,0,0|1,0,1]=4 4117 B12R1.382 OCCCc1cccc(c1)OC Amb13883640 [0,2,0,0,0,0|1,0,1]=4 4118 B12R1.382 O\N=C\Nc1cc(CCl)cc[n]1 Amb24441596 [0,2,0,0,0,0|2,0,0]=4 4119 B12R1.8 C=C=CCNCc1ccccc1 Amb25775091 [0,2,0,0,0,0|2,0,0]=4 4120 B12R1.8 C=C\C=C\CCc1ccccc1 Amb20248567 [0,2,0,0,0,0|2,0,0]=4 4121 B12R1.8 C=C\C=C\CNc1ccccc1 Amb25312011 [0,2,0,0,0,0|2,0,0]=4 4122 B12R1.8 C=C\C=C\NCc1ccccc1 Amb24512239 [0,2,0,0,0,0|2,0,0]=4 4123 B12R1.8 CCC\C=C/Cc1ccccc1 Amb22546636 [0,2,0,0,0,0|2,0,0]=4 4124 B12R1.8 CCC\C=N\Cc1ccccc1 Amb10562392 [0,2,0,0,0,0|2,0,0]=4 4125 B12R1.8 CCOCCCc1ccccc1 Amb24063530 [0,2,0,0,0,0|1,0,1]=4 4126 B12R1.8 CCO\N=C\Nc1ccccc1 Amb25696637 [0,2,0,0,0,0|1,0,0]=3 4127 B12R1.8 CC\C=C\NCc1ccccc1 Amb24519259 [0,2,0,0,0,0|2,0,0]=4 4128 B12R1.8 CC\C=N\OCc1ccccc1 Amb24395281 [0,2,0,0,0,0|2,0,0]=4 4129 B12R1.8 CN\N=C\C=Cc1ccccc1 Amb25807249 [0,2,0,0,0,0|1,0,1]=4 4130 B12R1.8 COCCCNc1ccccc1 Amb17232551 [0,2,0,0,0,0|1,0,1]=4 4131 B12R1.8 COCCCOc1ccccc1 Amb23450364 [0,2,0,0,0,0|1,0,1]=4 4132 B12R1.8 CS\C=C/CNc1ccccc1 Amb25312228 [0,2,0,0,0,0|1,1,0]=4 4133 B12R1.8 CS\C=C\CNc1ccccc1 Amb25167583 [0,2,0,0,0,0|1,1,0]=4 4134 B12R1.8 C\C=C\CNCc1ccccc1 Amb18645560 [0,2,0,0,0,0|2,0,0]=4 4135 B12R1.8 Cl\C=C/COCc1ccccc1 Amb24711309 [0,2,0,0,0,0|2,0,0]=4 4136 B12R1.8 N#C\C=C\CCc1ccccc1 Amb17477529 [0,2,0,0,0,0|2,0,0]=4 4137 B12R1.8 N#C\C=C\NCc1ccccc1 Amb25072771 [0,2,0,0,0,0|2,0,0]=4 4138 B12R1.8 N#C\C=N\OCc1ccccc1 Amb25283807 [0,2,0,0,0,0|2,0,0]=4 4139 B12R1.8 NC\C=C\CNc1ccccc1 Amb25046454 [0,2,0,0,0,0|2,0,0]=4 4140 B12R1.8 NOCCOCc1ccccc1 Amb22896393 [0,2,0,0,0,0|1,0,1]=4 4141 B12R1.8 NOCC\C=C\c1ccccc1 Amb18563583 [0,2,0,0,0,0|1,0,1]=4 4142 B12R1.8 O=C=NCCOc1ccccc1 Amb13783673 [0,2,0,0,0,0|0,0,2]=4 4143 B12R1.8 O=C=N\C=C\Sc1ccccc1 Amb24670372 [0,2,0,0,0,0|0,0,2]=4 4144 B12R1.8 O=COCCCc1ccccc1 Amb22229401 [0,2,0,0,0,0|1,0,1]=4 4145 B12R1.8 O=C\C=C\NCc1ccccc1 Amb18645517 [0,2,0,0,0,0|1,0,1]=4 4146 B12R1.8 O=C\C=C\OCc1ccccc1 Amb18645661 [0,2,0,0,0,0|1,0,1]=4 4147 B12R1.8 O=C\C=N\OCc1ccccc1 Amb24540826 [0,2,0,0,0,0|1,0,1]=4 4148 B12R1.8 OCC#CCNc1ccccc1 Amb25758889 [0,2,0,0,0,0|1,0,1]=4 4149 B12R1.8 OCCCC#Cc1ccccc1 Amb22730795 [0,2,0,0,0,0|1,0,1]=4 4150 B12R1.8 OCCCNCc1ccccc1 Amb2221510 [0,2,0,0,0,0|1,0,1]=4 4151 B12R1.8 OCCNCCc1ccccc1 Amb2119205 [0,2,0,0,0,0|0,0,2]=4 4152 B12R1.8 OCCN\C=C\c1ccccc1 Amb25087866 [0,2,0,0,0,0|0,0,2]=4 4153 B12R1.8 OCC\C=N\Nc1ccccc1 Amb25846258 [0,2,0,0,0,0|2,0,0]=4 4154 B12R1.8 OCOCOCc1ccccc1 Amb25803238 [0,2,0,0,0,0|1,0,1]=4 4155 B12R1.8 OC\C=C\C#Cc1ccccc1 Amb17593957 [0,2,0,0,0,0|1,0,1]=4 4156 B12R1.8 OC\C=C\C=Cc1ccccc1 Amb24700798 [0,2,0,0,0,0|1,0,1]=4 4157 B12R1.8 O\C=C\NCCc1ccccc1 Amb24721604 [0,2,0,0,0,0|1,0,0]=3 4158 B12R1.8 S=C=NCCOc1ccccc1 Amb17233560 [0,2,0,0,0,0|0,1,1]=4 4159 B12R1.8 S=C=NCCSc1ccccc1 Amb2371165 [0,2,0,0,0,0|0,1,1]=4 4160 B12R1.8 [N-]=[N+]=NCCCc1ccccc1 Amb10572439 [0,2,0,0,0,0|1,0,1]=4 4161 B12R1.8 [N-]=[N+]=NC\C=C\c1ccccc1 Amb18787840 [0,2,0,0,0,0|1,0,1]=4 4162 B12R1.8 [N-]=[N+]=N\C=C/Cc1ccccc1 Amb25241596 [0,2,0,0,0,0|1,0,0]=3 4163 B12R1.8 [N-]=[N+]=N\C=C\Cc1ccccc1 Amb24593881 [0,2,0,0,0,0|1,0,0]=3 4164 B12R1.27 BrCC(=O)NCc1ccccc1 Amb2221074 [0,2,0,0,0,0|2,0,0]=4 4165 B12R1.27 C#CC(=O)CCc1ccccc1 Amb24483845 [0,2,0,0,0,0|2,0,0]=4 4166 B12R1.27 C#CC(=O)CNc1ccccc1 Amb24359731 [0,2,0,0,0,0|2,0,0]=4 4167 B12R1.27 C#CC(=O)COc1ccccc1 Amb24483847 [0,2,0,0,0,0|2,0,0]=4 4168 B12R1.27 C#CC(=O)NCc1ccccc1 Amb10572437 [0,2,0,0,0,0|2,0,0]=4 4169 B12R1.27 C#CC(=O)OCc1ccccc1 Amb24057136 [0,2,0,0,0,0|2,0,0]=4 4170 B12R1.27 C#CC(O)CCc1ccccc1 Amb25024201 [0,2,0,0,0,0|1,0,1]=4 4171 B12R1.27 C#C[C@@H](O)\C=C\c1ccccc1 Amb24592205 [0,2,0,0,0,0|1,0,1]=4 4172 B12R1.27 C#C[C@H](O)CCc1ccccc1 Amb25266374 [0,2,0,0,0,0|1,0,1]=4 4173 B12R1.27 C=C(CNc1ccccc1)C#N Amb18645075 [0,2,0,0,0,0|2,0,0]=4 4174 B12R1.27 C=C(CO)C#Cc1ccccc1 Amb24497788 [0,2,0,0,0,0|1,0,1]=4 4175 B12R1.27 C=C(CO)CNc1ccccc1 Amb24537817 [0,2,0,0,0,0|1,0,0]=3 4176 B12R1.27 C=C(COc1ccccc1)C#N Amb25739080 [0,2,0,0,0,0|2,0,0]=4 4177 B12R1.27 C=CC(=O)CCc1ccccc1 Amb10562280 [0,2,0,0,0,0|2,0,0]=4 4178 B12R1.27 C=CC(=O)NCc1ccccc1 Amb1196142 [0,2,0,0,0,0|2,0,0]=4 4179 B12R1.27 C=CC(=O)OCc1ccccc1 Amb10807780 [0,2,0,0,0,0|2,0,0]=4 4180 B12R1.27 CC(C=Cc1ccccc1)=NO Amb24101081 [0,2,0,0,0,0|0,0,1]=3 4181 B12R1.27 CC(CO)OCc1ccccc1 Amb25667474 [0,2,0,0,0,0|1,0,1]=4 4182 B12R1.27 CC(CO)\C=C\c1ccccc1 Amb25378732 [0,2,0,0,0,0|1,0,1]=4 4183 B12R1.27 CC(CO)\C=N\c1ccccc1 Amb20248421 [0,2,0,0,0,0|2,0,0]=4 4184 B12R1.27 CCC(=C)CNc1ccccc1 Amb25093473 [0,2,0,0,0,0|2,0,0]=4 4185 B12R1.27 CCC(=N)NCc1ccccc1 Amb24388885 [0,2,0,0,0,0|2,0,0]=4 4186 B12R1.27 CCC(CCc1ccccc1)O Amb17138574 [0,2,0,0,0,0|1,0,1]=4 4187 B12R1.27 CCC(O)OCc1ccccc1 Amb25793622 [0,2,0,0,0,0|2,0,0]=4 4188 B12R1.27 CCC(O)\C=C\c1ccccc1 Amb22546605 [0,2,0,0,0,0|1,0,1]=4 4189 B12R1.27 CCC(O)\C=N\c1ccccc1 Amb25333476 [0,2,0,0,0,0|2,0,0]=4 4190 B12R1.27 CC[C@@H](O)\C=C\c1ccccc1 Amb25320497 [0,2,0,0,0,0|1,0,1]=4 4191 B12R1.27 CN(CNc1ccccc1)N=O Amb25690722 [0,2,0,0,0,0|1,0,1]=4 4192 B12R1.27 CN=C(N)NCc1c[n]ccc1 Amb20631270 [0,2,0,0,0,0|2,0,0]=4 4193 B12R1.27 CNC(=N)COc1ccccc1 Amb25336063 [0,2,0,0,0,0|1,0,1]=4 4194 B12R1.27 CNC(=N)CSc1ccccc1 Amb24485624 [0,2,0,0,0,0|1,0,1]=4 4195 B12R1.27 CNC(=N)NCc1ccccc1 Amb18798221 [0,2,0,0,0,0|1,0,1]=4 4196 B12R1.27 CNC(=O)NCc1ccccc1 Amb2132763 [0,2,0,0,0,0|1,0,1]=4 4197 B12R1.27 COC(=N)CNc1ccccc1 Amb24597022 [0,2,0,0,0,0|2,0,0]=4 4198 B12R1.27 COC(=N)COc1ccccc1 Amb18798404 [0,2,0,0,0,0|2,0,0]=4 4199 B12R1.27 COC(=O)OCc1ccccc1 Amb25034726 [0,2,0,0,0,0|2,0,0]=4 4200 B12R1.27 CSC(=N)NCc1ccccc1 Amb25760156 [0,2,0,0,0,0|2,0,0]=4 4201 B12R1.27 CSC(=O)NCc1ccccc1 Amb24495681 [0,2,0,0,0,0|2,0,0]=4 4202 B12R1.27 C[C@@H](CO)NCc1ccccc1 Amb19301927 [0,2,0,0,0,0|1,0,1]=4 4203 B12R1.27 C[C@@H](CO)\C=C\c1ccccc1 Amb25127764 [0,2,0,0,0,0|1,0,1]=4 4204 B12R1.27 C[C@H](CO)NCc1ccccc1 Amb19375302 [0,2,0,0,0,0|1,0,1]=4 4205 B12R1.27 C[C@H](CO)OCc1ccccc1 Amb25694316 [0,2,0,0,0,0|1,0,1]=4 4206 B12R1.27 C\C(=C\O)\C#Cc1ccccc1 Amb24379979 [0,2,0,0,0,0|1,0,1]=4 4207 B12R1.27 C\C(=N/O)\N=C\c1ccccc1 Amb21847007 [0,2,0,0,0,0|0,0,1]=3 4208 B12R1.27 C\C(=N/O)\N=N\c1ccccc1 Amb22731704 [0,2,0,0,0,0|1,0,0]=3 4209 B12R1.27 C\C(\C=O)=C/Cc1ccccc1 Amb18645371 [0,2,0,0,0,0|1,0,1]=4 4210 B12R1.27 C\C(\C=O)=C\Cc1ccccc1 Amb24418390 [0,2,0,0,0,0|1,0,1]=4 4211 B12R1.27 C\C(\CCc1ccccc1)=N\O Amb24638706 [0,2,0,0,0,0|0,0,0]=2 4212 B12R1.27 C\C(\CCl)=C\Cc1ccccc1 Amb25279568 [0,2,0,0,0,0|2,0,0]=4 4213 B12R1.27 C\C(\CN)=C\Cc1ccccc1 Amb24438874 [0,2,0,0,0,0|2,0,0]=4 4214 B12R1.27 C\C(\CNc1ccccc1)=C\C Amb24636864 [0,2,0,0,0,0|2,0,0]=4 4215 B12R1.27 C\C(\CO)=N\Nc1ccccc1 Amb24619168 [0,2,0,0,0,0|2,0,0]=4 4216 B12R1.27 C\C(\COc1ccccc1)=C\Cl Amb25241242 [0,2,0,0,0,0|2,0,0]=4 4217 B12R1.27 C\C(\NCc1ccccc1)=N\O Amb25083251 [0,2,0,0,0,0|0,0,0]=2 4218 B12R1.27 C\N=C(\SCc1ccccc1)/N Amb11238902 [0,2,0,0,0,0|1,0,0]=3 4219 B12R1.27 ClCC(=O)CCc1ccccc1 Amb17139043 [0,2,0,0,0,0|2,0,0]=4 4220 B12R1.27 ClCC(=O)COc1ccccc1 Amb17139095 [0,2,0,0,0,0|2,0,0]=4 4221 B12R1.27 Cl\C(\CCl)=C/Cc1ccccc1 Amb25803609 [0,2,0,0,0,0|2,0,0]=4 4222 B12R1.27 Cl\C(\CCl)=N/Cc1ccccc1 Amb24540801 [0,2,0,0,0,0|2,0,0]=4 4223 B12R1.27 Cl\C(\CSc1ccccc1)=C\Cl Amb24496037 [0,2,0,0,0,0|2,0,0]=4 4224 B12R1.27 N#CC(=O)CCc1ccccc1 Amb25143496 [0,2,0,0,0,0|2,0,0]=4 4225 B12R1.27 N#CC(O)CCc1ccccc1 Amb18177732 [0,2,0,0,0,0|1,0,1]=4 4226 B12R1.27 N#C[C@@H](O)CCc1ccccc1 Amb25073440 [0,2,0,0,0,0|1,0,1]=4 4227 B12R1.27 N#C[C@@H](O)\C=C\c1ccccc1 Amb24581221 [0,2,0,0,0,0|1,0,1]=4 4228 B12R1.27 N#C[C@H](O)CCc1ccccc1 Amb24344695 [0,2,0,0,0,0|1,0,1]=4 4229 B12R1.27 N#C[C@H](O)\C=C\c1ccccc1 Amb25371981 [0,2,0,0,0,0|1,0,1]=4 4230 B12R1.27 N=C(CF)NCc1ccccc1 Amb24392158 [0,2,0,0,0,0|2,0,0]=4 4231 B12R1.27 N=C(CS)NCc1ccccc1 Amb24664256 [0,2,0,0,0,0|1,1,0]=4 4232 B12R1.27 NC(CO)CNc1ccccc1 Amb25674165 [0,2,0,0,0,0|1,0,1]=4 4233 B12R1.27 NC(CO)COc1ccccc1 Amb18563798 [0,2,0,0,0,0|1,0,1]=4 4234 B12R1.27 NC(CO)\C=C\c1ccccc1 Amb25201509 [0,2,0,0,0,0|1,0,1]=4 4235 B12R1.27 NC(COc1ccccc1)=NN Amb18788366 [0,2,0,0,0,0|1,0,0]=3 4236 B12R1.27 NC(NCc1c[n]ccc1)=NO Amb18801032 [0,2,0,0,0,0|1,0,0]=3 4237 B12R1.27 NC(NCc1cc[n]cc1)=NO Amb18801031 [0,2,0,0,0,0|1,0,0]=3 4238 B12R1.27 NC(NCc1cccc[n]1)=NO Amb18801030 [0,2,0,0,0,0|1,0,0]=3 4239 B12R1.27 NC(NCc1ccccc1)=NO Amb18800915 [0,2,0,0,0,0|0,0,0]=2 4240 B12R1.27 NC(\C=C\c1c[n]ccc1)=NO Amb25122837 [0,2,0,0,0,0|1,0,1]=4 4241 B12R1.27 NCC(=O)CCc1ccccc1 Amb18563587 [0,2,0,0,0,0|2,0,0]=4 4242 B12R1.27 NCC(=O)OCc1ccccc1 Amb1207685 [0,2,0,0,0,0|2,0,0]=4 4243 B12R1.27 NCC(=O)OCc1ccccc1 Amb1808695 [0,2,0,0,0,0|2,0,0]=4 4244 B12R1.27 NCC(=O)OCc1ccccc1 Amb2228429 [0,2,0,0,0,0|2,0,0]=4 4245 B12R1.27 NCC(O)\C=C\c1ccccc1 Amb18126377 [0,2,0,0,0,0|1,0,1]=4 4246 B12R1.27 NC\C(\F)=C\Cc1ccccc1 Amb24743578 [0,2,0,0,0,0|2,0,0]=4 4247 B12R1.27 NN=C([S-])SCc1ccccc1 Amb22446067 [0,2,0,0,0,0|1,0,0]=3 4248 B12R1.27 NNC(=O)CCc1ccccc1 Amb1130599 [0,2,0,0,0,0|1,0,1]=4 4249 B12R1.27 NNC(=O)CNc1ccccc1 Amb1104534 [0,2,0,0,0,0|1,0,1]=4 4250 B12R1.27 NNC(=O)SCc1ccccc1 Amb24423487 [0,2,0,0,0,0|1,0,1]=4 4251 B12R1.27 NNC(=S)NCc1ccccc1 Amb1636204 [0,2,0,0,0,0|1,0,1]=4 4252 B12R1.27 N[C@@H](CO)\C=C\c1ccccc1 Amb24565958 [0,2,0,0,0,0|1,0,1]=4 4253 B12R1.27 N\C(=N\N)\SCc1cccc[n]1 Amb24485673 [0,2,0,0,0,0|2,0,0]=4 4254 B12R1.27 N\C(\C=Cc1ccccc1)=N\O Amb25065269 [0,2,0,0,0,0|0,0,1]=3 4255 B12R1.27 N\C(\CCc1c[n]ccc1)=N/O Amb24678911 [0,2,0,0,0,0|1,0,0]=3 4256 B12R1.27 N\C(\CCc1cc[n]cc1)=N/O Amb18792640 [0,2,0,0,0,0|1,0,0]=3 4257 B12R1.27 N\C(\CCc1cccc[n]1)=N/O Amb18792639 [0,2,0,0,0,0|1,0,0]=3 4258 B12R1.27 N\C(\CCc1ccccc1)=N\N Amb18788201 [0,2,0,0,0,0|1,0,0]=3 4259 B12R1.27 N\C(\CCc1ccccc1)=N\O Amb22053006 [0,2,0,0,0,0|0,0,0]=2 4260 B12R1.27 N\C(\CNc1ccccc1)=N\O Amb24614329 [0,2,0,0,0,0|0,0,0]=2 4261 B12R1.27 N\C(\NCc1c[n]cc[n]1)=N/O Amb25337592 [0,2,0,0,0,0|2,0,0]=4 4262 B12R1.27 N\C(\NNc1ccccc1)=N\O Amb24485684 [0,2,0,0,0,0|1,0,0]=3 4263 B12R1.27 O=C(C=O)OCc1ccccc1 Amb18645967 [0,2,0,0,0,0|1,0,1]=4 4264 B12R1.27 O=C(CBr)CCc1ccccc1 Amb20171375 [0,2,0,0,0,0|2,0,0]=4 4265 B12R1.27 O=C(CBr)COc1ccccc1 Amb20668077 [0,2,0,0,0,0|2,0,0]=4 4266 B12R1.27 O=C(CI)NCc1ccccc1 Amb24084424 [0,2,0,0,0,0|2,0,0]=4 4267 B12R1.27 O=C(CI)OCc1ccccc1 Amb25144488 [0,2,0,0,0,0|2,0,0]=4 4268 B12R1.27 O=C(NCl)NCc1ccccc1 Amb22735087 [0,2,0,0,0,0|1,0,1]=4 4269 B12R1.27 O=C(NCl)OCc1ccccc1 Amb21948731 [0,2,0,0,0,0|1,0,1]=4 4270 B12R1.27 O=C\C(\F)=C/Cc1ccccc1 Amb24540284 [0,2,0,0,0,0|1,0,1]=4 4271 B12R1.27 OC(CF)\C=C\c1ccccc1 Amb25284420 [0,2,0,0,0,0|1,0,1]=4 4272 B12R1.27 OCC(=O)C#Cc1ccccc1 Amb25094460 [0,2,0,0,0,0|1,0,1]=4 4273 B12R1.27 OCC(=O)CCc1cc[n]cc1 Amb18563675 [0,2,0,0,0,0|2,0,0]=4 4274 B12R1.27 OCC(=O)CCc1ccc[n]c1 Amb18563674 [0,2,0,0,0,0|2,0,0]=4 4275 B12R1.27 OCC(=O)CCc1cccc[n]1 Amb18563673 [0,2,0,0,0,0|2,0,0]=4 4276 B12R1.27 OCC(=O)CCc1ccccc1 Amb18563609 [0,2,0,0,0,0|1,0,0]=3 4277 B12R1.27 OCC(=O)COc1ccccc1 Amb18563713 [0,2,0,0,0,0|1,0,0]=3 4278 B12R1.27 OCC(=O)NCc1ccccc1 Amb1111331 [0,2,0,0,0,0|1,0,0]=3 4279 B12R1.27 OCC(=O)NCc1ccccn1 Amb17334667 [0,2,0,0,0,0|2,0,0]=4 4280 B12R1.27 OCC(=O)NCc1cccnc1 Amb17334668 [0,2,0,0,0,0|2,0,0]=4 4281 B12R1.27 OCC(=O)NCc1ccncc1 Amb17334669 [0,2,0,0,0,0|2,0,0]=4 4282 B12R1.27 OCC(=O)\C=C\c1ccccc1 Amb25142729 [0,2,0,0,0,0|1,0,1]=4 4283 B12R1.27 OCC(CNc1ccccc1)O Amb17307124 [0,2,0,0,0,0|1,0,1]=4 4284 B12R1.27 OCC(COc1ccccc1)C Amb17232599 [0,2,0,0,0,0|1,0,1]=4 4285 B12R1.27 OCC(CSc1ccccc1)Cl Amb10553704 [0,2,0,0,0,0|1,0,1]=4 4286 B12R1.27 OCC(Cl)\C=C\c1ccccc1 Amb24711501 [0,2,0,0,0,0|1,0,1]=4 4287 B12R1.27 OCC(O)\C=C\c1ccccc1 Amb24496400 [0,2,0,0,0,0|1,0,1]=4 4288 B12R1.27 OC[C@@H](COc1ccccc1)O Amb10982588 [0,2,0,0,0,0|1,0,1]=4 4289 B12R1.27 OC[C@@H](O)CNc1ccccc1 Amb18792912 [0,2,0,0,0,0|1,0,1]=4 4290 B12R1.27 OC[C@@H](O)\C=C\c1ccccc1 Amb24371109 [0,2,0,0,0,0|1,0,1]=4 4291 B12R1.27 OC[C@@H](OCc1ccccc1)C Amb17609287 [0,2,0,0,0,0|1,0,1]=4 4292 B12R1.27 OC\C(=C/Cc1ccccc1)\C Amb17594048 [0,2,0,0,0,0|1,0,0]=3 4293 B12R1.27 OC\C(\F)=C\Cc1ccccc1 Amb24661184 [0,2,0,0,0,0|1,0,0]=3 4294 B12R1.27 ONC(=O)CCc1cc[n]cc1 Amb24577197 [0,2,0,0,0,0|1,0,1]=4 4295 B12R1.27 ONC(=O)CCc1ccc[n]c1 Amb24413046 [0,2,0,0,0,0|1,0,1]=4 4296 B12R1.27 ONC(=O)CCc1cccc[n]1 Amb24703542 [0,2,0,0,0,0|1,0,1]=4 4297 B12R1.27 ONC(=O)OCc1ccccc1 Amb2445312 [0,2,0,0,0,0|0,0,1]=3 4298 B12R1.27 ONC(=S)NCc1ccccc1 Amb25823184 [0,2,0,0,0,0|0,0,1]=3 4299 B12R1.27 O[C@H](CCl)\C=C\c1ccccc1 Amb24565740 [0,2,0,0,0,0|1,0,1]=4 4300 B12R1.27 O[C@H](CF)\C=C\c1ccccc1 Amb24497699 [0,2,0,0,0,0|1,0,1]=4 4301 B12R1.27 O\C(\C=O)=C/Nc1ccccc1 Amb25187506 [0,2,0,0,0,0|2,0,0]=4 4302 B12R1.27 O\N=C(\CCc1ccccc1)/N Amb1115853 [0,2,0,0,0,0|0,0,0]=2 4303 B12R1.27 O\N=C(\COc1ccccc1)/N Amb1154723 [0,2,0,0,0,0|0,0,0]=2 4304 B12R1.27 [NH4]OP(=O)OCc1ccccc1 Amb22346178 [0,2,0,0,0,0|1,1,0]=4 4305 B12R1.32 C#CCC(=O)Cc1ccccc1 Amb18799925 [0,2,0,0,0,0|2,0,0]=4 4306 B12R1.32 C=C(Cc1ccccc1)N=[N+]=[N-] Amb25207816 [0,2,0,0,0,0|1,0,0]=3 4307 B12R1.32 C=C(N=C=O)Sc1ccccc1 Amb24653764 [0,2,0,0,0,0|1,0,1]=4 4308 B12R1.32 C=C=CC(=O)Cc1ccccc1 Amb25713668 [0,2,0,0,0,0|2,0,0]=4 4309 B12R1.32 C=C=CC(O)Cc1ccccc1 Amb24420844 [0,2,0,0,0,0|2,0,0]=4 4310 B12R1.32 C=C=C[C@H](O)Cc1ccccc1 Amb25158000 [0,2,0,0,0,0|2,0,0]=4 4311 B12R1.32 C=COC(=O)Cc1ccccc1 Amb17934203 [0,2,0,0,0,0|2,0,0]=4 4312 B12R1.32 C=NNC(=O)Nc1ccccc1 Amb24488786 [0,2,0,0,0,0|2,0,0]=4 4313 B12R1.32 C=NOC(=O)Nc1ccccc1 Amb24420620 [0,2,0,0,0,0|2,0,0]=4 4314 B12R1.32 CC(Cc1ccccc1)N=C=O Amb17103991 [0,2,0,0,0,0|0,0,2]=4 4315 B12R1.32 CC(Cc1ccccc1)N=C=S Amb18790890 [0,2,0,0,0,0|0,1,1]=4 4316 B12R1.32 CC(Cc1ccccc1)N=[N+]=[N-] Amb25249262 [0,2,0,0,0,0|1,0,1]=4 4317 B12R1.32 CCNC(=S)Cc1ccccc1 Amb24066800 [0,2,0,0,0,0|1,0,1]=4 4318 B12R1.32 CCOC(=N)Cc1ccccc1 Amb20673132 [0,2,0,0,0,0|2,0,0]=4 4319 B12R1.32 CC\N=C(\N)/Cc1ccccc1 Amb23569052 [0,2,0,0,0,0|1,0,0]=3 4320 B12R1.32 COCC(N)Cc1ccccc1 Amb20623561 [0,2,0,0,0,0|1,0,1]=4 4321 B12R1.32 CONC(=O)Cc1ccccc1 Amb16969924 [0,2,0,0,0,0|0,0,1]=3 4322 B12R1.32 CONC(=O)Oc1ccccc1 Amb16969957 [0,2,0,0,0,0|1,0,1]=4 4323 B12R1.32 CONC(=S)Nc1ccccc1 Amb24497042 [0,2,0,0,0,0|1,0,1]=4 4324 B12R1.32 CO\N=C(\N)/Cc1c[n]ccc1 Amb25669996 [0,2,0,0,0,0|1,0,0]=3 4325 B12R1.32 C[C@@H](CCO)Nc1ccccc1 Amb25124401 [0,2,0,0,0,0|1,0,1]=4 4326 B12R1.32 C[C@@H](Cc1ccccc1)N=[N+]=[N-] Amb24356215 [0,2,0,0,0,0|1,0,1]=4 4327 B12R1.32 C[C@H](CCO)Nc1ccccc1 Amb25324766 [0,2,0,0,0,0|1,0,1]=4 4328 B12R1.32 C[C@H](Cc1ccccc1)N=[N+]=[N-] Amb25667629 [0,2,0,0,0,0|1,0,1]=4 4329 B12R1.32 C\C(=C/c1ccccc1)\N=[N+]=[N-] Amb25689477 [0,2,0,0,0,0|1,0,1]=4 4330 B12R1.32 C\C(=C\c1ccccc1)\N=C=O Amb25231758 [0,2,0,0,0,0|0,0,2]=4 4331 B12R1.32 C\C(\CCO)=C\c1ccccc1 Amb24576953 [0,2,0,0,0,0|1,0,1]=4 4332 B12R1.32 C\C(\Cc1cc[n]cc1)=N\OC Amb25763716 [0,2,0,0,0,0|1,0,0]=3 4333 B12R1.32 C\C(\Cc1ccccc1)=C/C=O Amb18645380 [0,2,0,0,0,0|1,0,1]=4 4334 B12R1.32 C\C(\Cc1ccccc1)=C\C#N Amb24595292 [0,2,0,0,0,0|2,0,0]=4 4335 B12R1.32 C\C(\Cc1ccccc1)=C\CN Amb25669583 [0,2,0,0,0,0|2,0,0]=4 4336 B12R1.32 C\C=C\C(N)Cc1ccccc1 Amb25142747 [0,2,0,0,0,0|2,0,0]=4 4337 B12R1.32 C\C=C\[C@@H](O)Cc1ccccc1 Amb25741490 [0,2,0,0,0,0|2,0,0]=4 4338 B12R1.32 C\C=C\[C@H](O)Cc1ccccc1 Amb24353018 [0,2,0,0,0,0|2,0,0]=4 4339 B12R1.32 Cl\C(\Cc1ccccc1)=C/CCl Amb25035226 [0,2,0,0,0,0|2,0,0]=4 4340 B12R1.32 Cl\C(\Cc1ccccc1)=C\CCl Amb24563867 [0,2,0,0,0,0|2,0,0]=4 4341 B12R1.32 N#CCC(=O)Cc1ccccc1 Amb17232286 [0,2,0,0,0,0|2,0,0]=4 4342 B12R1.32 N#CNC(=O)Cc1ccccc1 Amb25149956 [0,2,0,0,0,0|1,0,1]=4 4343 B12R1.32 N=C(Cc1ccccc1)NC#N Amb25289104 [0,2,0,0,0,0|1,0,1]=4 4344 B12R1.32 NN(CCO)Cc1ccccc1 Amb18646608 [0,2,0,0,0,0|1,0,1]=4 4345 B12R1.32 NOCC(=O)Nc1ccccc1 Amb24596278 [0,2,0,0,0,0|2,0,0]=4 4346 B12R1.32 NOCC(=O)Oc1ccccc1 Amb24096859 [0,2,0,0,0,0|2,0,0]=4 4347 B12R1.32 N\N=C\C(=O)Cc1ccccc1 Amb25046103 [0,2,0,0,0,0|1,0,0]=3 4348 B12R1.32 N\N=C\C(Br)=Cc1ccccc1 Amb24406450 [0,2,0,0,0,0|1,0,1]=4 4349 B12R1.32 O=C(Cc1c[n]ccc1)N=C=O Amb25071469 [0,2,0,0,0,0|1,0,1]=4 4350 B12R1.32 O=C(Cc1cccc[n]1)N=C=O Amb25204303 [0,2,0,0,0,0|1,0,1]=4 4351 B12R1.32 O=C(Cc1cccc[n]1)N=C=S Amb25675541 [0,2,0,0,0,0|1,1,0]=4 4352 B12R1.32 O=C(Cc1ccccc1)\C=C\Cl Amb25216983 [0,2,0,0,0,0|2,0,0]=4 4353 B12R1.32 O=C(N=C=O)Oc1ccccc1 Amb22348017 [0,2,0,0,0,0|1,0,1]=4 4354 B12R1.32 O=C(Nc1ccccc1)N=C=S Amb24724734 [0,2,0,0,0,0|1,1,0]=4 4355 B12R1.32 O=C=NC(=O)Cc1ccccc1 Amb17232352 [0,2,0,0,0,0|0,0,1]=3 4356 B12R1.32 OCCC(Cc1ccccc1)C Amb17232486 [0,2,0,0,0,0|1,0,1]=4 4357 B12R1.32 OCCC(O)Cc1ccccc1 Amb22491209 [0,2,0,0,0,0|1,0,1]=4 4358 B12R1.32 OCCC(O)Nc1ccccc1 Amb25060097 [0,2,0,0,0,0|1,0,1]=4 4359 B12R1.32 OCCC(Oc1ccccc1)C Amb17232598 [0,2,0,0,0,0|1,0,1]=4 4360 B12R1.32 OCCN(O)Cc1ccccc1 Amb25284514 [0,2,0,0,0,0|1,0,1]=4 4361 B12R1.32 OCNC(=O)C[n+]1ccccc1 Amb25046777 [0,2,0,0,0,0|1,0,1]=4 4362 B12R1.32 OCNC(=O)Oc1ccccc1 Amb10552983 [0,2,0,0,0,0|1,0,1]=4 4363 B12R1.32 ON=CC(Cl)=Cc1ccccc1 Amb24061196 [0,2,0,0,0,0|0,0,1]=3 4364 B12R1.32 ONCC(=O)Nc1ccccc1 Amb24495972 [0,2,0,0,0,0|1,0,1]=4 4365 B12R1.32 O\C=C/C(=S)Nc1ccccc1 Amb24495245 [0,2,0,0,0,0|1,0,1]=4 4366 B12R1.32 O\C=C\C(=O)Cc1ccccc1 Amb25093804 [0,2,0,0,0,0|1,0,0]=3 4367 B12R1.32 O\C=C\C(=S)Nc1ccccc1 Amb24592387 [0,2,0,0,0,0|1,0,1]=4 4368 B12R1.32 O\N=C\C(=O)Cc1ccccc1 Amb24577781 [0,2,0,0,0,0|0,0,0]=2 4369 B12R1.32 O\N=C\C(=O)Nc1ccccc1 Amb1205570 [0,2,0,0,0,0|0,0,1]=3 4370 B12R1.32 O\N=C\C(Br)=Cc1ccccc1 Amb25852504 [0,2,0,0,0,0|0,0,1]=3 4371 B12R1.32 O\N=C\C(Cl)=Cc1ccccc1 Amb25855465 [0,2,0,0,0,0|0,0,1]=3 4372 B12R1.32 O\N=C\C(O)Cc1ccccc1 Amb25136306 [0,2,0,0,0,0|0,0,0]=2 4373 B12R1.32 S=C(Cc1ccccc1)S[Mg]Cl Amb22264564 [0,2,0,0,0,0|2,0,0]=4 4374 B12R1.32 S=C(N=C=S)Oc1ccccc1 Amb25783083 [0,2,0,0,0,0|1,1,0]=4 4375 B12R1.32 [K]ONC(=O)Cc1ccccc1 Amb10558422 [0,2,0,0,0,0|0,0,1]=3 4376 B12R1.32 [N-]=[N+]=NC(=O)Nc1ccccc1 Amb25233093 [0,2,0,0,0,0|2,0,0]=4 4377 B12R1.252 CC(=O)\C=C\Cc1ccccc1 Amb25179518 [0,2,0,0,0,0|1,0,1]=4 4378 B12R1.252 CC(C)=CCCc1ccccc1 Amb17843373 [0,2,0,0,0,0|2,0,0]=4 4379 B12R1.252 CC(C)=NNCc1ccccc1 Amb24421246 [0,2,0,0,0,0|2,0,0]=4 4380 B12R1.252 CC(CCCc1ccccc1)O Amb17138575 [0,2,0,0,0,0|1,0,1]=4 4381 B12R1.252 CC(Cl)\C=C\Cc1ccccc1 Amb25724973 [0,2,0,0,0,0|2,0,0]=4 4382 B12R1.252 CC(N)=N\C=C\c1ccccc1 Amb25273902 [0,2,0,0,0,0|1,0,1]=4 4383 B12R1.252 CC(O)C=C=Cc1ccccc1 Amb24431362 [0,2,0,0,0,0|1,0,1]=4 4384 B12R1.252 CC(O)CCNc1ccccc1 Amb25376877 [0,2,0,0,0,0|1,0,1]=4 4385 B12R1.252 CC(O)C\C=C\c1ccccc1 Amb24645318 [0,2,0,0,0,0|1,0,1]=4 4386 B12R1.252 CC(O)\C=N\Nc1ccccc1 Amb25816526 [0,2,0,0,0,0|2,0,0]=4 4387 B12R1.252 CN(C)\C=N\Cc1ccccc1 Amb25686859 [0,2,0,0,0,0|1,0,1]=4 4388 B12R1.252 CN(C)\N=C\Nc1ccccc1 Amb25365010 [0,2,0,0,0,0|2,0,0]=4 4389 B12R1.252 C[C@@H](O)CNCc1ccccc1 Amb25708513 [0,2,0,0,0,0|1,0,1]=4 4390 B12R1.252 C[C@@H](O)COCc1ccccc1 Amb22169747 [0,2,0,0,0,0|1,0,1]=4 4391 B12R1.252 C[C@@H](O)C\C=C\c1ccccc1 Amb25846224 [0,2,0,0,0,0|1,0,1]=4 4392 B12R1.252 C[C@@H](O)\C=C\Sc1ccccc1 Amb25052220 [0,2,0,0,0,0|1,0,1]=4 4393 B12R1.252 C[C@@H](O)\C=N\Nc1ccccc1 Amb24608055 [0,2,0,0,0,0|2,0,0]=4 4394 B12R1.252 C[C@H](Cl)\C=N\Cc1ccccc1 Amb25279567 [0,2,0,0,0,0|2,0,0]=4 4395 B12R1.252 C[C@H](O)COCc1ccccc1 Amb22044890 [0,2,0,0,0,0|1,0,1]=4 4396 B12R1.252 C[C@H](O)C\C=C\c1ccccc1 Amb25080010 [0,2,0,0,0,0|1,0,1]=4 4397 B12R1.252 C[C@H](O)\C=N\Nc1ccccc1 Amb25816090 [0,2,0,0,0,0|2,0,0]=4 4398 B12R1.252 ClC(Cl)=CCNc1ccccc1 Amb25160645 [0,2,0,0,0,0|2,0,0]=4 4399 B12R1.252 NC(=O)\C=C\Cc1ccccc1 Amb25148586 [0,2,0,0,0,0|1,0,1]=4 4400 B12R1.252 OB(O)CCCc1ccccc1 Amb21928056 [0,2,0,0,0,0|1,0,1]=4 4401 B12R1.252 OB(O)\C=C\Cc1cc[n]cc1 Amb24642319 [0,2,0,0,0,0|2,0,0]=4 4402 B12R1.252 OB(O)\C=C\Cc1ccccc1 Amb21856558 [0,2,0,0,0,0|1,0,0]=3 4403 B12R1.252 OC(=O)C=C=Cc1ccccc1 Amb25102534 [0,2,0,0,0,0|1,0,1]=4 4404 B12R1.252 OC(=O)CCC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22056045 [0,2,0,0,0,0|1,0,1]=4 4405 B12R1.252 OC(=O)CCCc1ccccc1 Amb2388283 [0,2,0,0,0,0|1,0,1]=4 4406 B12R1.252 OC(=O)CCNc1ccccc1 Amb1207377 [0,2,0,0,0,0|1,0,1]=4 4407 B12R1.252 OC(=O)CCOc1ccccc1 Amb1206804 [0,2,0,0,0,0|1,0,1]=4 4408 B12R1.252 OC(=O)CCSc1ccccc1 Amb1036581 [0,2,0,0,0,0|1,0,1]=4 4409 B12R1.252 OC(=O)C[NH2+]Cc1ccccc1 Amb24113880 [0,2,0,0,0,0|1,0,1]=4 4410 B12R1.252 OC(=O)\C=C\Cc1ccc[n]c1 Amb25849857 [0,2,0,0,0,0|2,0,0]=4 4411 B12R1.252 OC(=O)\C=C\Cc1cccc[n]1 Amb25696841 [0,2,0,0,0,0|2,0,0]=4 4412 B12R1.252 OC(=O)\C=C\Nc1ccccc1 Amb25315667 [0,2,0,0,0,0|1,0,1]=4 4413 B12R1.252 OC(=O)\C=C\Oc1ccccc1 Amb18645970 [0,2,0,0,0,0|1,0,1]=4 4414 B12R1.252 OC(=O)\C=C\Sc1ccccc1 Amb1661597 [0,2,0,0,0,0|1,0,1]=4 4415 B12R1.252 OC(=O)\C=N/Cc1ccccc1 Amb24068312 [0,2,0,0,0,0|1,0,0]=3 4416 B12R1.252 OC(=O)\C=N/Nc1ccccc1 Amb24068313 [0,2,0,0,0,0|2,0,0]=4 4417 B12R1.252 OC(=O)\C=N\Nc1ccccc1 Amb17594064 [0,2,0,0,0,0|2,0,0]=4 4418 B12R1.43 Br[C@@H](C(=O)O)Cc1ccccc1 Amb17610062 [0,2,0,0,0,0|1,0,1]=4 4419 B12R1.43 Br[C@H](C(=O)O)Cc1ccccc1 Amb17610063 [0,2,0,0,0,0|1,0,1]=4 4420 B12R1.43 C=C(Cc1ccccc1)C(N)=O Amb24634331 [0,2,0,0,0,0|1,0,1]=4 4421 B12R1.43 C=C(Cc1ccccc1)C(N)=S Amb24359154 [0,2,0,0,0,0|1,1,0]=4 4422 B12R1.43 C=C(F)C(=O)Cc1ccccc1 Amb25205433 [0,2,0,0,0,0|2,0,0]=4 4423 B12R1.43 C=C(Oc1ccccc1)C(O)=O Amb24692764 [0,2,0,0,0,0|2,0,0]=4 4424 B12R1.43 CC(=O)C(=O)Cc1ccccc1 Amb23603619 [0,2,0,0,0,0|1,0,1]=4 4425 B12R1.43 CC(C(=O)Cc1ccccc1)Cl Amb10609316 [0,2,0,0,0,0|2,0,0]=4 4426 B12R1.43 CC(C(=O)Nc1ccccc1)O Amb1230509 [0,2,0,0,0,0|2,0,0]=4 4427 B12R1.43 CC(C(O)C)Cc1ccccc1 Amb17232485 [0,2,0,0,0,0|1,0,1]=4 4428 B12R1.43 CC(N)C(=O)Cc1ccccc1 Amb18829240 [0,2,0,0,0,0|2,0,0]=4 4429 B12R1.43 CC(O)C(=C)Cc1ccccc1 Amb25155687 [0,2,0,0,0,0|1,0,0]=3 4430 B12R1.43 CC(O)C(=O)Cc1ccc[n]c1 Amb24344752 [0,2,0,0,0,0|2,0,0]=4 4431 B12R1.43 CC(O)C(=O)Cc1cccc[n]1 Amb25205815 [0,2,0,0,0,0|2,0,0]=4 4432 B12R1.43 CC(O)C(=O)Cc1ccccc1 Amb24487306 [0,2,0,0,0,0|1,0,0]=3 4433 B12R1.43 CC(O)C(=O)Oc1ccccc1 Amb25154221 [0,2,0,0,0,0|2,0,0]=4 4434 B12R1.43 CC(O)C(Cl)Cc1ccccc1 Amb25082706 [0,2,0,0,0,0|1,0,1]=4 4435 B12R1.43 CC(O)C(N)Cc1ccccc1 Amb18646379 [0,2,0,0,0,0|1,0,1]=4 4436 B12R1.43 CC(O)C(O)Cc1ccccc1 Amb25159724 [0,2,0,0,0,0|1,0,1]=4 4437 B12R1.43 CC(O)[C@@H](N)Cc1ccccc1 Amb24682603 [0,2,0,0,0,0|1,0,1]=4 4438 B12R1.43 CC(O)[C@@H](O)Cc1ccccc1 Amb24354395 [0,2,0,0,0,0|1,0,1]=4 4439 B12R1.43 CC(O)[C@H](N)Cc1ccccc1 Amb25730054 [0,2,0,0,0,0|1,0,1]=4 4440 B12R1.43 CN(C(=O)Cc1ccccc1)C Amb1803686 [0,2,0,0,0,0|1,0,1]=4 4441 B12R1.43 CN(C(=S)Cc1ccccc1)C Amb1078624 [0,2,0,0,0,0|1,0,1]=4 4442 B12R1.43 CN(C)C(=N)Cc1ccccc1 Amb23447116 [0,2,0,0,0,0|1,0,1]=4 4443 B12R1.43 C[C@@H](C(=O)O)Cc1ccccc1 Amb10844541 [0,2,0,0,0,0|1,0,1]=4 4444 B12R1.43 C[C@@H](Cc1ccccc1)C(C)O Amb25769503 [0,2,0,0,0,0|1,0,1]=4 4445 B12R1.43 C[C@@H](Cc1ccccc1)[C@@H](C)O Amb25795494 [0,2,0,0,0,0|1,0,1]=4 4446 B12R1.43 C[C@@H](O)C(=O)Cc1ccccc1 Amb25792955 [0,2,0,0,0,0|1,0,0]=3 4447 B12R1.43 C[C@@H](O)C(=O)Nc1ccccc1 Amb25229042 [0,2,0,0,0,0|2,0,0]=4 4448 B12R1.43 C[C@@H](O)C(=O)Oc1ccccc1 Amb25763938 [0,2,0,0,0,0|2,0,0]=4 4449 B12R1.43 C[C@@H](O)C(=O)Sc1ccccc1 Amb25847054 [0,2,0,0,0,0|2,0,0]=4 4450 B12R1.43 C[C@@H](O)[C@@H](O)Cc1ccccc1 Amb25847064 [0,2,0,0,0,0|1,0,1]=4 4451 B12R1.43 C[C@@H](O)[C@H](Cl)Cc1ccccc1 Amb25823111 [0,2,0,0,0,0|1,0,1]=4 4452 B12R1.43 C[C@@H](O)[C@H](N)Cc1ccccc1 Amb24664138 [0,2,0,0,0,0|1,0,1]=4 4453 B12R1.43 C[C@H](C(=O)O)Cc1ccccc1 Amb10844540 [0,2,0,0,0,0|1,0,1]=4 4454 B12R1.43 C[C@H](Cc1ccccc1)[C@@H](C)O Amb25157972 [0,2,0,0,0,0|1,0,1]=4 4455 B12R1.43 C[C@H](Cc1ccccc1)[C@H](C)O Amb25769397 [0,2,0,0,0,0|1,0,1]=4 4456 B12R1.43 C[C@H](O)C(=O)Cc1ccccc1 Amb25143432 [0,2,0,0,0,0|1,0,0]=3 4457 B12R1.43 C[C@H](O)C(=O)Oc1ccccc1 Amb25769345 [0,2,0,0,0,0|2,0,0]=4 4458 B12R1.43 C[C@H](O)[C@@H](N)Cc1ccccc1 Amb25690953 [0,2,0,0,0,0|1,0,1]=4 4459 B12R1.43 C[C@H](O)[C@@H](O)Cc1ccccc1 Amb24496614 [0,2,0,0,0,0|1,0,1]=4 4460 B12R1.43 C[C@H](O)[C@H](N)Cc1ccccc1 Amb25375788 [0,2,0,0,0,0|1,0,1]=4 4461 B12R1.43 C\C(=C/c1ccccc1)\C(=O)O Amb2099512 [0,2,0,0,0,0|1,0,1]=4 4462 B12R1.43 C\C(=C/c1ccccc1)\[C@@H](C)O Amb25816522 [0,2,0,0,0,0|1,0,1]=4 4463 B12R1.43 C\C(=C\c1ccccc1)\C(O)=O Amb24603461 [0,2,0,0,0,0|1,0,1]=4 4464 B12R1.43 C\C(=N\c1ccccc1)\C(O)=O Amb24068331 [0,2,0,0,0,0|2,0,0]=4 4465 B12R1.43 ClC(C(=O)O)Cc1ccccc1 Amb17204339 [0,2,0,0,0,0|1,0,1]=4 4466 B12R1.43 N=C(Nc1ccccc1)C(O)=O Amb18645991 [0,2,0,0,0,0|2,0,0]=4 4467 B12R1.43 NC(=Cc1ccccc1)C(O)=O Amb24081025 [0,2,0,0,0,0|1,0,1]=4 4468 B12R1.43 NC(C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22367486 [0,2,0,0,0,0|1,0,1]=4 4469 B12R1.43 NC(Cc1ccccc1)C(O)=O Amb19958284 [0,2,0,0,0,0|1,0,1]=4 4470 B12R1.43 NC(Cc1ccccc1)P(O)O Amb25227409 [0,2,0,0,0,0|0,1,1]=4 4471 B12R1.43 NC(Cc1ccccc1)[13C](O)=O Amb22363196 [0,2,0,0,0,0|1,0,1]=4 4472 B12R1.43 NC([13CH2]c1ccccc1)C(O)=O Amb22363309 [0,2,0,0,0,0|1,0,1]=4 4473 B12R1.43 N[13C@@H](Cc1ccccc1)C(O)=O Amb22351319 [0,2,0,0,0,0|1,0,1]=4 4474 B12R1.43 N[13CH](Cc1ccccc1)C(O)=O Amb22367538 [0,2,0,0,0,0|1,0,1]=4 4475 B12R1.43 N[14CH]([14CH2]c1ccccc1)[14C](O)=O Amb22352760 [0,2,0,0,0,0|1,0,1]=4 4476 B12R1.43 N[C@@H](C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22353689 [0,2,0,0,0,0|1,0,1]=4 4477 B12R1.43 N[C@@H](Cc1ccccc1)B(O)O Amb25366514 [0,2,0,0,0,0|1,0,1]=4 4478 B12R1.43 N[C@@H](Cc1ccccc1)C(O)=O Amb22351110 [0,2,0,0,0,0|1,0,1]=4 4479 B12R1.43 N[C@@H](Cc1ccccc1)P(O)O Amb25828976 [0,2,0,0,0,0|0,1,1]=4 4480 B12R1.43 N[C@H](Cc1ccccc1)P(O)=O Amb24355910 [0,2,0,0,0,0|0,1,1]=4 4481 B12R1.43 O=C(C(=O)O)Cc1ccncc1 Amb17477816 [0,2,0,0,0,0|2,0,0]=4 4482 B12R1.43 O=C(Cc1ccccc1)C(F)F Amb18180246 [0,2,0,0,0,0|2,0,0]=4 4483 B12R1.43 OB(O)C(Cl)Cc1ccccc1 Amb24419999 [0,2,0,0,0,0|1,0,1]=4 4484 B12R1.43 OB(O)[C@H](Cl)Cc1ccccc1 Amb25779933 [0,2,0,0,0,0|1,0,1]=4 4485 B12R1.43 OB(O)\C(\F)=C\c1ccccc1 Amb25667549 [0,2,0,0,0,0|1,0,1]=4 4486 B12R1.43 OC(=O)C(=O)Cc1ccccn1 Amb17477815 [0,2,0,0,0,0|2,0,0]=4 4487 B12R1.43 OC(=O)C(=O)Cc1cccnc1 Amb17232515 [0,2,0,0,0,0|2,0,0]=4 4488 B12R1.43 OC(=O)C(=S)Cc1cccc[n]1 Amb25059246 [0,2,0,0,0,0|2,0,0]=4 4489 B12R1.43 OC(=O)C(Cc1ccccc1)Br Amb16210937 [0,2,0,0,0,0|1,0,1]=4 4490 B12R1.43 OC(=O)C(F)=Cc1ccccc1 Amb24093652 [0,2,0,0,0,0|1,0,1]=4 4491 B12R1.43 OC(=O)C(S)Cc1ccccc1 Amb18289035 [0,2,0,0,0,0|1,0,1]=4 4492 B12R1.43 OC(=O)[C@@H](Cl)Cc1ccccc1 Amb24707843 [0,2,0,0,0,0|1,0,1]=4 4493 B12R1.43 OC(=O)[C@@H](S)Cc1ccccc1 Amb25124079 [0,2,0,0,0,0|1,0,1]=4 4494 B12R1.43 OC(=O)[C@H](Cl)Cc1ccccc1 Amb22225171 [0,2,0,0,0,0|1,0,1]=4 4495 B12R1.43 OC(=O)[C@H](F)Cc1ccccc1 Amb25061394 [0,2,0,0,0,0|1,0,1]=4 4496 B12R1.43 OC(=O)\C(\Cl)=C/c1ccccc1 Amb18648695 [0,2,0,0,0,0|1,0,1]=4 4497 B12R1.43 OC(=O)\C(\Cl)=C\c1ccccc1 Amb19651416 [0,2,0,0,0,0|1,0,1]=4 4498 B12R1.43 OC(=S)C(I)Cc1ccccc1 Amb24061263 [0,2,0,0,0,0|1,0,1]=4 4499 B12R1.43 OC(Cl)C(=O)Oc1ccccc1 Amb24658483 [0,2,0,0,0,0|2,0,0]=4 4500 B12R1.43 OC(S)C(=O)Oc1ccccc1 Amb25285714 [0,2,0,0,0,0|2,0,0]=4 4501 B12R1.43 O\C(=C/c1ccccc1)\C(O)=O Amb18645966 [0,2,0,0,0,0|1,0,1]=4 4502 B12R1.43 S=C(C(=O)O)Nc1ccccc1 Amb10558556 [0,2,0,0,0,0|2,0,0]=4 4503 B12R1.43 S\C(=C/c1ccccc1)\C(=O)O Amb1250109 [0,2,0,0,0,0|1,0,1]=4 4504 B12R1.43 S\C(=C\c1ccccc1)\C(=O)O Amb2550972 [0,2,0,0,0,0|1,0,1]=4 4505 B12R1.43 [15NH2]C(Cc1ccccc1)C(O)=O Amb22338047 [0,2,0,0,0,0|1,0,1]=4 4506 B12R1.43 [O-]C(=O)C(=O)Cc1ccccc1 Amb19884048 [0,2,0,0,0,0|1,0,1]=4 4507 B12R1.118 C#CC(CO)Cc1ccccc1 Amb25105982 [0,2,0,0,0,0|1,0,1]=4 4508 B12R1.118 C=C=C(CCl)Cc1ccccc1 Amb25211674 [0,2,0,0,0,0|2,0,0]=4 4509 B12R1.118 C=C=C(CO)Cc1ccccc1 Amb25777134 [0,2,0,0,0,0|1,0,0]=3 4510 B12R1.118 C=C=C(Cc1ccccc1)C=O Amb25123884 [0,2,0,0,0,0|1,0,1]=4 4511 B12R1.118 CCC(Nc1ccccc1)=NN Amb18788210 [0,2,0,0,0,0|2,0,0]=4 4512 B12R1.118 CCN(Cc1ccccc1)N=O Amb24376725 [0,2,0,0,0,0|1,0,1]=4 4513 B12R1.118 CC\C(\Cc1ccccc1)=N\N Amb25057429 [0,2,0,0,0,0|1,0,0]=3 4514 B12R1.118 CC\C(\Nc1ccccc1)=N\O Amb24356045 [0,2,0,0,0,0|1,0,0]=3 4515 B12R1.118 CN[C@@H](CO)Cc1ccccc1 Amb22745072 [0,2,0,0,0,0|1,0,1]=4 4516 B12R1.118 CN\C(=N\C)\Sc1ccccc1 Amb24451577 [0,2,0,0,0,0|2,0,0]=4 4517 B12R1.118 CN\C(\Cc1ccccc1)=N/N Amb18788196 [0,2,0,0,0,0|1,0,0]=3 4518 B12R1.118 CN\C(\Cc1ccccc1)=N\O Amb25376955 [0,2,0,0,0,0|0,0,0]=2 4519 B12R1.118 CN\C(\Nc1ccccc1)=N\N Amb25256907 [0,2,0,0,0,0|2,0,0]=4 4520 B12R1.118 C\C=C(/Cc1ccccc1)\C=O Amb18645376 [0,2,0,0,0,0|1,0,1]=4 4521 B12R1.118 C\C=C(\Cc1ccccc1)/C=O Amb25743406 [0,2,0,0,0,0|1,0,1]=4 4522 B12R1.118 C\N=C(\Cc1ccc[n]c1)/NC Amb24062496 [0,2,0,0,0,0|2,0,0]=4 4523 B12R1.118 N#CC(CO)Cc1ccccc1 Amb18110109 [0,2,0,0,0,0|1,0,1]=4 4524 B12R1.118 N#C\C(=C/O)\Sc1ccccc1 Amb25687961 [0,2,0,0,0,0|2,0,0]=4 4525 B12R1.118 N#C\C(\Cc1ccc[n]c1)=C/O Amb25357837 [0,2,0,0,0,0|2,0,0]=4 4526 B12R1.118 NCC(CO)Cc1ccccc1 Amb22899484 [0,2,0,0,0,0|1,0,1]=4 4527 B12R1.118 N\C=C(\Cc1ccccc1)/C#N Amb24743507 [0,2,0,0,0,0|2,0,0]=4 4528 B12R1.118 O=C\C(\Cc1ccccc1)=C/Cl Amb25300287 [0,2,0,0,0,0|1,0,1]=4 4529 B12R1.118 OCC(CO)=Cc1ccccc1 Amb25077955 [0,2,0,0,0,0|1,0,1]=4 4530 B12R1.118 OC\C(\Cc1ccccc1)=C\F Amb25037074 [0,2,0,0,0,0|1,0,0]=3 4531 B12R1.118 OC\C(\Cc1ccccc1)=N\O Amb25052256 [0,2,0,0,0,0|0,0,0]=2 4532 B12R1.118 O\C=C(/C=O)\Oc1ccccc1 Amb24625847 [0,2,0,0,0,0|2,0,0]=4 4533 B12R1.118 O\C=C(/Cc1cccnc1)\C#N Amb10605347 [0,2,0,0,0,0|2,0,0]=4 4534 B12R1.118 O\C=C(\Cc1ccncc1)/C#N Amb10605342 [0,2,0,0,0,0|2,0,0]=4 4535 B12R1.194 CC(C)(Cc1ccccc1)N=O Amb22055953 [0,2,0,0,0,0|0,0,2]=4 4536 B12R1.194 CC(C)(Cc1ccccc1)NO Amb24411489 [0,2,0,0,0,0|0,0,2]=4 4537 B12R1.194 CC(Cl)(CO)Cc1ccccc1 Amb25115909 [0,2,0,0,0,0|1,0,1]=4 4538 B12R1.194 CC(N)(CO)Cc1ccccc1 Amb19001800 [0,2,0,0,0,0|1,0,1]=4 4539 B12R1.194 C[C@@](O)(Cc1ccccc1)CO Amb25817130 [0,2,0,0,0,0|1,0,1]=4 4540 B12R1.194 C[C@](O)(Cc1ccccc1)CO Amb24474165 [0,2,0,0,0,0|1,0,1]=4 4541 B12R1.194 OCC(F)(Cl)Cc1ccccc1 Amb25182929 [0,2,0,0,0,0|1,0,1]=4 4542 B12R1.194 OCC(F)(F)Cc1ccccc1 Amb25847026 [0,2,0,0,0,0|1,0,1]=4 4543 B12R1.194 ONC(Cc1ccccc1)(C)C Amb17615684 [0,2,0,0,0,0|0,0,2]=4 4544 B12R1.891 CC(C)(O)CCc1ccccc1 Amb18540684 [0,2,0,0,0,0|1,0,1]=4 4545 B12R1.891 OP(=O)(\C=C\c1ccccc1)O Amb1041442 [0,2,0,0,0,0|0,1,1]=4 4546 B12R1.891 OS(=O)(=O)/C=C/c1ccccc1 Amb17672591 [0,2,0,0,0,0|1,0,1]=4 4547 B12R1.891 OS(=O)(=O)CCc1ccccc1 Amb19866568 [0,2,0,0,0,0|1,0,1]=4 4548 B12R1.891 OS(=O)(=O)NCc1ccccc1 Amb22551828 [0,2,0,0,0,0|2,0,0]=4 4549 B12R1.891 OS(=O)(=O)\C=C\c1ccccc1 Amb22364622 [0,2,0,0,0,0|1,0,1]=4 4550 B12R1.891 OS(=O)(=O)\C=C\c1ccccc1 Amb22364623 [0,2,0,0,0,0|1,0,1]=4 4551 B10R1.172 C=Cc1cccc(CO)c1 Amb24405968 [0,0,1,1,0,0|1,0,1]=4 4552 B10R2.6 C1N=C1c2ccc[n]c2 Amb24085198 [1,0,0,1,0,0|2,0,0]=4 4553 B10R2.6 C1NC1c2ccccc2 Amb25082886 [1,0,0,1,0,0|0,0,2]=4 4554 B10R2.6 C1O[C@@H]1c2c[n]ccc2 Amb25758556 [1,0,0,1,0,0|1,0,1]=4 4555 B10R2.6 C1O[C@@H]1c2cc[n]cc2 Amb24103202 [1,0,0,1,0,0|1,0,1]=4 4556 B10R2.6 C1O[C@@H]1c2cccc[n]2 Amb24481607 [1,0,0,1,0,0|1,0,1]=4 4557 B10R2.6 C1O[C@H]1c2cc[n]cc2 Amb24103149 [1,0,0,1,0,0|1,0,1]=4 4558 B10R2.6 C1O[C@H]1c2cccc[n]2 Amb24101968 [1,0,0,1,0,0|1,0,1]=4 4559 B10R2.6 C1SC1c2ccccc2 Amb17666888 [1,0,0,1,0,0|0,1,1]=4 4560 B10R2.6 C=1NC1c2ccccc2 Amb25848069 [1,0,0,1,0,0|0,0,2]=4 4561 B10R2.6 O1CC1c2ccncc2 Amb17090250 [1,0,0,1,0,0|1,0,1]=4 4562 B10R2.6 c1[n]cccc1N2C=N2 Amb24085124 [1,0,0,1,0,0|2,0,0]=4 4563 B10R2.6 c1ccc(cn1)C2CO2 Amb17090249 [1,0,0,1,0,0|1,0,1]=4 4564 B10R2.6 c1ccc(nc1)C2CO2 Amb17090248 [1,0,0,1,0,0|1,0,1]=4 4565 B10R2.7 C1=NN=C2C=CC=CC21 Amb22500164 [1,0,0,1,0,0|1,0,1]=4 4566 B10R2.7 C1=Nc2c(C1)cncn2 Amb17611612 [1,0,0,1,0,0|2,0,0]=4 4567 B10R2.7 C1C=C2N=CN=C2C=C1 Amb24090171 [1,0,0,1,0,0|1,0,1]=4 4568 B10R2.7 C1C=CC=C2N=CN=C21 Amb24079300 [1,0,0,1,0,0|1,0,1]=4 4569 B10R2.7 C1C=Cc2[n]cccc21 Amb22496284 [1,0,0,1,0,0|2,0,0]=4 4570 B10R2.7 C1C=Cc2ccc[n]c21 Amb21963524 [1,0,0,1,0,0|2,0,0]=4 4571 B10R2.7 C1C=NC2=COC=CN21 Amb24078850 [1,0,0,1,0,0|2,0,0]=4 4572 B10R2.7 C1C=Nc2[n]cccc21 Amb21927360 [1,0,0,1,0,0|1,0,0]=3 4573 B10R2.7 C1C=Nc2ccc[n]c21 Amb24099986 [1,0,0,1,0,0|1,0,0]=3 4574 B10R2.7 C1CN2C=CC=CC2=N1 Amb24101571 [1,0,0,1,0,0|1,0,1]=4 4575 B10R2.7 C1COc2[n]cccc21 Amb25337454 [1,0,0,1,0,0|1,0,1]=4 4576 B10R2.7 C1COc2c[n]ccc21 Amb22372207 [1,0,0,1,0,0|1,0,1]=4 4577 B10R2.7 C1COc2cc[n]cc21 Amb24101562 [1,0,0,1,0,0|1,0,1]=4 4578 B10R2.7 C1COc2ccc[n]c21 Amb23455396 [1,0,0,1,0,0|1,0,1]=4 4579 B10R2.7 C1CPc2ccccc21 Amb24477880 [1,0,0,1,0,0|0,1,1]=4 4580 B10R2.7 C1CSc2ccccc21 Amb24101549 [1,0,0,1,0,0|0,1,1]=4 4581 B10R2.7 C1C[n+]2ccccc2O1 Amb22364467 [1,0,0,1,0,0|1,0,1]=4 4582 B10R2.7 C1N=Cc2cc[n]cc21 Amb25032262 [1,0,0,1,0,0|2,0,0]=4 4583 B10R2.7 C1N=Cc2ccc[n]c21 Amb25798436 [1,0,0,1,0,0|2,0,0]=4 4584 B10R2.7 C1N=Cc2ccccc21 Amb20241766 [1,0,0,1,0,0|1,0,0]=3 4585 B10R2.7 C1N=Nc2cc[n]cc21 Amb24082892 [1,0,0,1,0,0|2,0,0]=4 4586 B10R2.7 C1N=Nc2ccc[n]c21 Amb22490407 [1,0,0,1,0,0|2,0,0]=4 4587 B10R2.7 C1N=c2ccccc2=N1 Amb24100741 [1,0,0,1,0,0|1,0,1]=4 4588 B10R2.7 C1NCc2ccccc12 Amb17739945 [1,0,0,1,0,0|1,0,1]=4 4589 B10R2.7 C1ON=c2cccc[n]21 Amb24078828 [1,0,0,1,0,0|2,0,0]=4 4590 B10R2.7 C1OSc2ccccc21 Amb25250664 [1,0,0,1,0,0|1,1,0]=4 4591 B10R2.7 C1Oc2ccccc2S1 Amb21963815 [1,0,0,1,0,0|1,0,1]=4 4592 B10R2.7 C1SCc2ccccc21 Amb21962922 [1,0,0,1,0,0|2,0,0]=4 4593 B10R2.7 [bH]1oc2ccccc2o1 Amb22731069 [1,0,0,1,0,0|2,0,0]=4 4594 B10R2.7 c1[nH]c2[n]cccc2[n]1 Amb22756777 [1,0,0,1,0,0|2,0,0]=4 4595 B10R2.7 c1[nH]c2ccccc2[p]1 Amb24340147 [1,0,0,1,0,0|1,0,1]=4 4596 B10R2.7 c1[nH]ccc2[n][n]cc21 Amb25086359 [1,0,0,1,0,0|2,0,0]=4 4597 B10R2.7 c1[nH]ccc2[n]ccc21 Amb25785260 [1,0,0,1,0,0|1,0,1]=4 4598 B10R2.7 c1[n][n]c2cccc[n]21 Amb22042412 [1,0,0,1,0,0|2,0,0]=4 4599 B10R2.7 c1[n][s]c2[n]cccc21 Amb22496195 [1,0,0,1,0,0|1,1,0]=4 4600 B10R2.7 c1[n]c2[n]cccc2[s]1 Amb22002122 [1,0,0,1,0,0|2,0,0]=4 4601 B10R2.7 c1[n]c2ccc[n]c2o1 Amb18100438 [1,0,0,1,0,0|2,0,0]=4 4602 B10R2.7 c1[n]c2cccc[n]2[n]1 Amb22496795 [1,0,0,1,0,0|2,0,0]=4 4603 B10R2.7 c1[n]c2ccccc2[se]1 Amb22346204 [1,0,0,1,0,0|1,0,0]=3 4604 B10R2.7 c1[n]c[n]c2c[n]oc21 Amb24570799 [1,0,0,1,0,0|2,0,0]=4 4605 B10R2.7 c1[n]ccc2[n]c[s]c21 Amb21864880 [1,0,0,1,0,0|2,0,0]=4 4606 B10R2.7 c1[n]ccc2[n]coc21 Amb24098524 [1,0,0,1,0,0|2,0,0]=4 4607 B10R2.7 c1[n]ccc2[s]c[n]c21 Amb20248470 [1,0,0,1,0,0|2,0,0]=4 4608 B10R2.7 c1[n]ccc2o[n][n]c21 Amb25100775 [1,0,0,1,0,0|2,0,0]=4 4609 B10R2.7 c1[n]ccc2oc[n]c21 Amb24478645 [1,0,0,1,0,0|2,0,0]=4 4610 B10R2.7 c1[n]ccc2occc21 Amb19895064 [1,0,0,1,0,0|1,0,1]=4 4611 B10R2.7 c1[n]oc2[n]c[n]cc21 Amb24546053 [1,0,0,1,0,0|2,0,0]=4 4612 B10R2.7 c1[n]oc2c[n]ccc21 Amb25305567 [1,0,0,1,0,0|1,0,0]=3 4613 B10R2.7 c1[n]oc2ccc[n]c21 Amb25146891 [1,0,0,1,0,0|1,0,0]=3 4614 B10R2.7 c1[s][n]c2ccccc21 Amb25336989 [1,0,0,1,0,0|1,0,1]=4 4615 B10R2.7 c1[s]cc2ccccc21 Amb24066379 [1,0,0,1,0,0|2,0,0]=4 4616 B10R2.7 c1c[nH]c2c(c1)cnn2 Amb17608608 [1,0,0,1,0,0|2,0,0]=4 4617 B10R2.7 c1cc[n]c2occc21 Amb21963452 [1,0,0,1,0,0|1,0,1]=4 4618 B10R2.7 c1ccc2N=S=Nc2c1 Amb17755407 [1,0,0,1,0,0|2,0,0]=4 4619 B10R2.7 c1ccc2N=[Se]=Nc2c1 Amb17683892 [1,0,0,1,0,0|2,0,0]=4 4620 B10R2.7 c1ccc2[n+](c1)OCC2 Amb10560834 [1,0,0,1,0,0|1,0,1]=4 4621 B10R2.7 c1ccc2c(c1)C=CC2 Amb2383760 [1,0,0,1,0,0|1,0,0]=3 4622 B10R2.7 c1ccc2c(c1)NCC2 Amb1869493 [1,0,0,1,0,0|0,0,2]=4 4623 B10R2.7 c1ccc2c(c1)[nH+]cs2 Amb16205278 [1,0,0,1,0,0|1,0,1]=4 4624 B10R2.7 c1ccc2c(c1)[nH+]cs2 Amb16205847 [1,0,0,1,0,0|1,0,1]=4 4625 B10R2.7 c1ccc2c(c1)[nH+]n[nH]2 Amb10553250 [1,0,0,1,0,0|2,0,0]=4 4626 B10R2.7 c1ccc2c(c1)[nH+]n[nH]2 Amb10566511 [1,0,0,1,0,0|2,0,0]=4 4627 B10R2.7 c1ccc2c(c1)[nH+]n[nH]2 Amb10575340 [1,0,0,1,0,0|2,0,0]=4 4628 B10R2.7 c1ccc2c(c1)[nH]nc2 Amb1323321 [1,0,0,1,0,0|1,0,0]=3 4629 B10R2.7 c1ccc2c(c1)[nH]nn2 Amb10553984 [1,0,0,1,0,0|2,0,0]=4 4630 B10R2.7 c1ccc2c(c1)[nH]nn2 Amb1158937 [1,0,0,1,0,0|2,0,0]=4 4631 B10R2.7 c1ccc2c(c1)nn[n-]2 Amb10557777 [1,0,0,1,0,0|2,0,0]=4 4632 B10R2.7 c1ccc2c(c1)nn[n-]2 Amb10557779 [1,0,0,1,0,0|2,0,0]=4 4633 B10R2.7 c1ccc2c(c1)nsn2 Amb1151192 [1,0,0,1,0,0|2,0,0]=4 4634 B10R2.7 c1ccc2c(c1)onc2 Amb1233398 [1,0,0,1,0,0|0,0,0]=2 4635 B10R2.7 c1ccc2n(c1)ccn2 Amb2235938 [1,0,0,1,0,0|1,0,1]=4 4636 B10R2.7 c1ccc2n(c1)cnc2 Amb10070943 [1,0,0,1,0,0|2,0,0]=4 4637 B10R2.7 c1ccc2n(c1)cnn2 Amb17597649 [1,0,0,1,0,0|2,0,0]=4 4638 B10R2.7 c1ccc2n(c1)ncc2 Amb10604230 [1,0,0,1,0,0|1,0,1]=4 4639 B10R2.7 c1ccc2n(c1)ncn2 Amb10067452 [1,0,0,1,0,0|2,0,0]=4 4640 B10R2.7 c1cnc2c(c1)[nH]nc2 Amb16185746 [1,0,0,1,0,0|2,0,0]=4 4641 B10R2.7 c1cnc2c(c1)nc[nH]2 Amb2423657 [1,0,0,1,0,0|2,0,0]=4 4642 B10R2.7 c1cnc2c(c1)ncs2 Amb16231378 [1,0,0,1,0,0|2,0,0]=4 4643 B10R2.7 c1cnc2c(c1)occ2 Amb16185654 [1,0,0,1,0,0|1,0,1]=4 4644 B10R2.7 c1cnc2c(c1)ocn2 Amb17194206 [1,0,0,1,0,0|2,0,0]=4 4645 B10R2.7 c1ncc2c(c1)[nH]cn2 Amb13891875 [1,0,0,1,0,0|2,0,0]=4 4646 B10R2.7 c1ncc2c(c1)[nH]nc2 Amb16185747 [1,0,0,1,0,0|2,0,0]=4 4647 B10R2.7 c1ncc2c(c1)cco2 Amb10067356 [1,0,0,1,0,0|1,0,1]=4 4648 B10R2.7 c1occ2ccccc21 Amb25709480 [1,0,0,1,0,0|2,0,0]=4 4649 B10R2.7 c:1:[n]:[n]:c-2:[nH]:c:c:c:c21 Amb19130604 [1,0,0,1,0,0|2,0,0]=4 4650 B10R2.7 c:1:c:c:[nH]:c-2:[n]:c:c:c21 Amb22489484 [1,0,0,1,0,0|1,0,1]=4 4651 B10R2.320 BrC1=Cc2ccccc21 Amb20248944 [1,0,0,1,0,0|1,0,1]=4 4652 B10R2.320 CC1Cc2ccccc12 Amb17778870 [1,0,0,1,0,0|1,0,1]=4 4653 B10R2.320 ClC1=Cc2ccccc21 Amb24402931 [1,0,0,1,0,0|1,0,1]=4 4654 B10R2.320 ClC1Cc2ccccc12 Amb17778800 [1,0,0,1,0,0|1,0,1]=4 4655 B10R2.320 O=C1Cc2[n]cccc21 Amb24061107 [1,0,0,1,0,0|1,0,1]=4 4656 B10R2.320 O=C1Cc2c[n]ccc21 Amb24587705 [1,0,0,1,0,0|1,0,1]=4 4657 B10R2.320 O=C1Cc2ccc[n]c21 Amb24479915 [1,0,0,1,0,0|1,0,1]=4 4658 B10R2.320 OC1=Cc2ccccc21 Amb22002555 [1,0,0,1,0,0|0,0,1]=3 4659 B10R2.320 OC1Cc2c[n]ccc21 Amb24478648 [1,0,0,1,0,0|1,0,1]=4 4660 B10R2.320 OC1Cc2ccccc12 Amb17778676 [1,0,0,1,0,0|0,0,1]=3 4661 B10R2.320 O[C@@H]1Cc2ccccc21 Amb25676494 [1,0,0,1,0,0|0,0,1]=3 4662 B10R2.320 O[C@H]1Cc2ccccc21 Amb24704470 [1,0,0,1,0,0|0,0,1]=3 4663 B10R2.320 [NH3+]C1Cc2ccccc12 Amb17778877 [1,0,0,1,0,0|0,0,2]=4 4664 B12R2.41 C1C=CC=Cc2[n]c[n]cc21 Amb24090174 [0,0,0,1,0,1|2,0,0]=4 4665 B12R2.41 C1C=NC=C2SC=CC=CN21 Amb24066306 [0,0,0,1,0,1|2,0,0]=4 4666 B12R2.41 C1N=CN=C2C=CC=CC=C21 Amb24079308 [0,0,0,1,0,1|2,0,0]=4 4667 B12R2.41 C=1N=CNC2=CC=CC=NC21 Amb25736260 [0,0,0,1,0,1|2,0,0]=4 4668 B12R2.41 C=1N=CNC2=CC=NC=CC21 Amb25087784 [0,0,0,1,0,1|2,0,0]=4 4669 B12R2.41 c1[n]ccc2OC=CC=Cc21 Amb25148311 [0,0,0,1,0,1|1,0,1]=4 4670 B12R2.586 OC1CCC2=CC=CC=CC21 Amb25056856 [0,0,0,1,0,1|1,0,1]=4 4671 B12R2.586 OC1CCC=2CC=CC=CC21 Amb24466334 [0,0,0,1,0,1|1,0,1]=4 4672 B12R2.24 Brc1[n]c2ccccc2[n][n]1 Amb18773542 [0,1,0,1,0,0|2,0,0]=4 4673 B12R2.24 Brc1[n]c2ccccc2c[n]1 Amb23399840 [0,1,0,1,0,0|2,0,0]=4 4674 B12R2.24 Brc1cc2OC=COc2cc1 Amb25147864 [0,1,0,1,0,0|2,0,0]=4 4675 B12R2.24 Brc1cc2[n][n]ccc2cc1 Amb22276042 [0,1,0,1,0,0|1,0,1]=4 4676 B12R2.24 Brc1cc2[n]c[n][n]c2cc1 Amb23504040 [0,1,0,1,0,0|2,0,0]=4 4677 B12R2.24 Brc1cc2c[n]ccc2cc1 Amb22276934 [0,1,0,1,0,0|1,0,1]=4 4678 B12R2.24 Brc1cc2cc[n][n]c2cc1 Amb20241324 [0,1,0,1,0,0|1,0,1]=4 4679 B12R2.24 Brc1cc2cc[n]cc2cc1 Amb24183290 [0,1,0,1,0,0|1,0,1]=4 4680 B12R2.24 Brc1ccc2CCCOc2c1 Amb23440336 [0,1,0,1,0,0|1,0,1]=4 4681 B12R2.24 Brc1ccc2CCN=Cc2c1 Amb22490212 [0,1,0,1,0,0|1,0,1]=4 4682 B12R2.24 Brc1ccc2OCC=Cc2c1 Amb22231978 [0,1,0,1,0,0|1,0,1]=4 4683 B12R2.24 Brc1ccc2c(c1)COCO2 Amb16231031 [0,1,0,1,0,0|2,0,0]=4 4684 B12R2.24 Brc1ccc2c(c1)cncn2 Amb10975973 [0,1,0,1,0,0|2,0,0]=4 4685 B12R2.24 Brc1ccc2c(c1)ncnc2 Amb10975967 [0,1,0,1,0,0|2,0,0]=4 4686 B12R2.24 Brc1nnc2c(c1)cccc2 Amb10602274 [0,1,0,1,0,0|1,0,1]=4 4687 B12R2.24 C=C1Cc2ccccc2CC1 Amb25151359 [0,1,0,1,0,0|2,0,0]=4 4688 B12R2.24 C=C1Cc2ccccc2OC1 Amb25087646 [0,1,0,1,0,0|1,0,0]=3 4689 B12R2.24 CC1C=Cc2ccccc2O1 Amb24715788 [0,1,0,1,0,0|1,0,1]=4 4690 B12R2.24 CC1CCc2ccccc2O1 Amb19515436 [0,1,0,1,0,0|1,0,1]=4 4691 B12R2.24 CC1Cc2ccccc2OC1 Amb25189640 [0,1,0,1,0,0|1,0,1]=4 4692 B12R2.24 CC=1COc2ccccc2C1 Amb24484437 [0,1,0,1,0,0|1,0,1]=4 4693 B12R2.24 CC=1Cc2ccccc2ON1 Amb25077210 [0,1,0,1,0,0|0,0,0]=2 4694 B12R2.24 C[C@@H]1Cc2ccccc2C=N1 Amb22747779 [0,1,0,1,0,0|1,0,1]=4 4695 B12R2.24 C[C@H]1Cc2ccccc2C=N1 Amb25056784 [0,1,0,1,0,0|1,0,1]=4 4696 B12R2.24 Cc1[n]c2ccccc2c[n]1 Amb23400987 [0,1,0,1,0,0|2,0,0]=4 4697 B12R2.24 Cc1cc2COCOc2cc1 Amb24648861 [0,1,0,1,0,0|2,0,0]=4 4698 B12R2.24 Cc1cc2[n]c[n]cc2cc1 Amb23402209 [0,1,0,1,0,0|2,0,0]=4 4699 B12R2.24 Cc1cc2c[n]ccc2cc1 Amb18349166 [0,1,0,1,0,0|1,0,1]=4 4700 B12R2.24 Cc1cc2cc[n][n]c2cc1 Amb21858505 [0,1,0,1,0,0|1,0,1]=4 4701 B12R2.24 Cc1cc2ccccc2[n][n]1 Amb24062163 [0,1,0,1,0,0|1,0,1]=4 4702 B12R2.24 Cc1ccc2CCN=Cc2c1 Amb22500760 [0,1,0,1,0,0|1,0,1]=4 4703 B12R2.24 Cc1ccc2CCN=Cc2c1 Amb22500763 [0,1,0,1,0,0|1,0,1]=4 4704 B12R2.24 Cc1ccc2OCC=Cc2c1 Amb23441455 [0,1,0,1,0,0|1,0,1]=4 4705 B12R2.24 Cc1ccc2c(c1)CCCO2 Amb13951730 [0,1,0,1,0,0|1,0,1]=4 4706 B12R2.24 Cc1ccc2c(c1)ccnc2 Amb10071945 [0,1,0,1,0,0|1,0,1]=4 4707 B12R2.24 Cc1ccc2c(c1)cncn2 Amb15693132 [0,1,0,1,0,0|2,0,0]=4 4708 B12R2.24 ClC1=CCc2c(N1)cccc2 Amb15691607 [0,1,0,1,0,0|2,0,0]=4 4709 B12R2.24 ClC1CCc2ccccc2O1 Amb24509296 [0,1,0,1,0,0|1,0,1]=4 4710 B12R2.24 ClC=1COc2ccccc2N1 Amb18118341 [0,1,0,1,0,0|2,0,0]=4 4711 B12R2.24 Clc1[n]c2ccccc2[n][n]1 Amb25824203 [0,1,0,1,0,0|2,0,0]=4 4712 B12R2.24 Clc1cc2CCCOc2cc1 Amb22498254 [0,1,0,1,0,0|1,0,1]=4 4713 B12R2.24 Clc1cc2CCN=Cc2cc1 Amb24649802 [0,1,0,1,0,0|1,0,1]=4 4714 B12R2.24 Clc1cc2OCC=Cc2cc1 Amb24349799 [0,1,0,1,0,0|1,0,1]=4 4715 B12R2.24 Clc1cc2[n][n]ccc2cc1 Amb22752658 [0,1,0,1,0,0|1,0,1]=4 4716 B12R2.24 Clc1cc2cc[n][n]c2cc1 Amb22233949 [0,1,0,1,0,0|1,0,1]=4 4717 B12R2.24 Clc1cc2ccccc2[n][n]1 Amb22523503 [0,1,0,1,0,0|1,0,1]=4 4718 B12R2.24 Clc1ccc2CCCOc2c1 Amb25103951 [0,1,0,1,0,0|1,0,1]=4 4719 B12R2.24 Clc1ccc2OCC=Cc2c1 Amb22586260 [0,1,0,1,0,0|1,0,1]=4 4720 B12R2.24 Clc1ccc2c(c1)OCC=N2 Amb10603916 [0,1,0,1,0,0|2,0,0]=4 4721 B12R2.24 Clc1ccc2c(c1)ccnc2 Amb10603859 [0,1,0,1,0,0|1,0,1]=4 4722 B12R2.24 Clc1ccc2ncncc2c1 Amb17943286 [0,1,0,1,0,0|2,0,0]=4 4723 B12R2.24 Clc1ncc2c(c1)cccc2 Amb10071462 [0,1,0,1,0,0|1,0,1]=4 4724 B12R2.24 Fc1[n]c2ccccc2c[n]1 Amb24097068 [0,1,0,1,0,0|2,0,0]=4 4725 B12R2.24 Fc1cc2CCCOc2cc1 Amb21864763 [0,1,0,1,0,0|1,0,1]=4 4726 B12R2.24 Fc1cc2CCN=Cc2cc1 Amb24091693 [0,1,0,1,0,0|1,0,1]=4 4727 B12R2.24 Fc1cc2OCC=Cc2cc1 Amb24485991 [0,1,0,1,0,0|1,0,1]=4 4728 B12R2.24 Fc1cc2[n][n]ccc2cc1 Amb24092090 [0,1,0,1,0,0|1,0,1]=4 4729 B12R2.24 Fc1cc2c[n]c[n]c2cc1 Amb23401598 [0,1,0,1,0,0|2,0,0]=4 4730 B12R2.24 Fc1cc2c[n]ccc2cc1 Amb19100617 [0,1,0,1,0,0|1,0,1]=4 4731 B12R2.24 Fc1cc2cc[n][n]c2cc1 Amb22233954 [0,1,0,1,0,0|1,0,1]=4 4732 B12R2.24 Fc1cc2cc[n]cc2cc1 Amb19958275 [0,1,0,1,0,0|1,0,1]=4 4733 B12R2.24 Fc1cc2ccccc2c[n]1 Amb20621378 [0,1,0,1,0,0|1,0,1]=4 4734 B12R2.24 Fc1ccc2CCCOc2c1 Amb25065166 [0,1,0,1,0,0|1,0,1]=4 4735 B12R2.24 Fc1ccc2CCN=Cc2c1 Amb24092083 [0,1,0,1,0,0|1,0,1]=4 4736 B12R2.24 Fc1ccc2OCC=Cc2c1 Amb25770785 [0,1,0,1,0,0|1,0,1]=4 4737 B12R2.24 Ic1cc2CCCOc2cc1 Amb22498253 [0,1,0,1,0,0|1,0,1]=4 4738 B12R2.24 Ic1cc2[n]c[n]cc2cc1 Amb23402211 [0,1,0,1,0,0|2,0,0]=4 4739 B12R2.24 Ic1cc2c[n]c[n]c2cc1 Amb19957516 [0,1,0,1,0,0|2,0,0]=4 4740 B12R2.24 Ic1cc2c[n]ccc2cc1 Amb22170101 [0,1,0,1,0,0|1,0,1]=4 4741 B12R2.24 Ic1cc2cc[n][n]c2cc1 Amb22751176 [0,1,0,1,0,0|1,0,1]=4 4742 B12R2.24 Ic1cc2ccccc2c[n]1 Amb22170100 [0,1,0,1,0,0|1,0,1]=4 4743 B12R2.24 Ic1ccc2c(c1)ccnc2 Amb10070847 [0,1,0,1,0,0|1,0,1]=4 4744 B12R2.24 NC1C=Cc2ccccc2O1 Amb24618074 [0,1,0,1,0,0|1,0,1]=4 4745 B12R2.24 NC1COc2c(C1)cccc2 Amb2383393 [0,1,0,1,0,0|1,0,1]=4 4746 B12R2.24 NC=1COc2ccccc2N1 Amb18124903 [0,1,0,1,0,0|2,0,0]=4 4747 B12R2.24 N[C@@H]1Cc2ccccc2OC1 Amb22756584 [0,1,0,1,0,0|1,0,1]=4 4748 B12R2.24 N[C@H]1Cc2ccccc2OC1 Amb23385337 [0,1,0,1,0,0|1,0,1]=4 4749 B12R2.24 N[C@H]1Cc2ccccc2OC1 Amb24485980 [0,1,0,1,0,0|1,0,1]=4 4750 B12R2.24 Nc1cc2N=CCOc2cc1 Amb24093681 [0,1,0,1,0,0|2,0,0]=4 4751 B12R2.24 Nc1cc2OC=COc2cc1 Amb25808195 [0,1,0,1,0,0|2,0,0]=4 4752 B12R2.24 Nc1cc2[n][n]ccc2cc1 Amb21857232 [0,1,0,1,0,0|1,0,1]=4 4753 B12R2.24 Nc1cc2[n]c[n][n]c2cc1 Amb24060373 [0,1,0,1,0,0|2,0,0]=4 4754 B12R2.24 Nc1cc2[n]c[n]cc2cc1 Amb22001709 [0,1,0,1,0,0|2,0,0]=4 4755 B12R2.24 Nc1cc2cc[n][n]c2cc1 Amb21857010 [0,1,0,1,0,0|1,0,1]=4 4756 B12R2.24 Nc1ccc2CCCOc2c1 Amb25324386 [0,1,0,1,0,0|1,0,1]=4 4757 B12R2.24 Nc1ccc2CCN=Cc2c1 Amb25145814 [0,1,0,1,0,0|1,0,1]=4 4758 B12R2.24 Nc1ccc2COCOc2c1 Amb24509308 [0,1,0,1,0,0|2,0,0]=4 4759 B12R2.24 Nc1ccc2OCC=Cc2c1 Amb23441460 [0,1,0,1,0,0|1,0,1]=4 4760 B12R2.24 Nc1ccc2c(c1)CCCO2 Amb13952453 [0,1,0,1,0,0|1,0,1]=4 4761 B12R2.24 Nc1ccc2ncncc2c1 Amb17935799 [0,1,0,1,0,0|2,0,0]=4 4762 B12R2.24 O=C1C=C2CN=CC=C2C=C1 Amb24407165 [0,1,0,1,0,0|1,0,1]=4 4763 B12R2.24 O=C1C=Cc2ccccc2O1 Amb18511466 [0,1,0,1,0,0|1,0,1]=4 4764 B12R2.24 O=C1CCc2c(C1)cccc2 Amb2383557 [0,1,0,1,0,0|2,0,0]=4 4765 B12R2.24 O=C1COc2c(C1)cccc2 Amb15692703 [0,1,0,1,0,0|1,0,0]=3 4766 B12R2.24 O=C1COc2c(N1)cccc2 Amb1011836 [0,1,0,1,0,0|2,0,0]=4 4767 B12R2.24 O=C1Cc2ccccc2CO1 Amb17750259 [0,1,0,1,0,0|2,0,0]=4 4768 B12R2.24 O=C1Cc2ccccc2N=C1 Amb24078566 [0,1,0,1,0,0|2,0,0]=4 4769 B12R2.24 O=C1Cc2ccccc2NC1 Amb18202302 [0,1,0,1,0,0|2,0,0]=4 4770 B12R2.24 O=C1Cc2ccccc2NN1 Amb24583135 [0,1,0,1,0,0|1,0,1]=4 4771 B12R2.24 O=C1Cc2ccccc2SC1 Amb22231635 [0,1,0,1,0,0|1,1,0]=4 4772 B12R2.24 O=C1N=Cc2ccccc2O1 Amb22054765 [0,1,0,1,0,0|2,0,0]=4 4773 B12R2.24 O=C1Nc2ccccc2C=N1 Amb20653982 [0,1,0,1,0,0|2,0,0]=4 4774 B12R2.24 O=C1Nc2ccccc2C=N1 Amb22752711 [0,1,0,1,0,0|2,0,0]=4 4775 B12R2.24 O=C1OCc2ccccc2O1 Amb24536007 [0,1,0,1,0,0|2,0,0]=4 4776 B12R2.24 O=c1ccc2c(o1)cccc2 Amb1802468 [0,1,0,1,0,0|1,0,1]=4 4777 B12R2.24 O=c1ncc2c([nH]1)cccc2 Amb2569659 [0,1,0,1,0,0|2,0,0]=4 4778 B12R2.24 OC1=COc2ccccc2O1 Amb24060689 [0,1,0,1,0,0|2,0,0]=4 4779 B12R2.24 OC1C=Cc2ccccc2O1 Amb21964141 [0,1,0,1,0,0|1,0,1]=4 4780 B12R2.24 OC1CCc2ccccc2O1 Amb22230405 [0,1,0,1,0,0|1,0,1]=4 4781 B12R2.24 OC1Cc2ccccc2OC1 Amb22498287 [0,1,0,1,0,0|1,0,1]=4 4782 B12R2.24 OC1OCc2c(C1)cccc2 Amb17593730 [0,1,0,1,0,0|2,0,0]=4 4783 B12R2.24 OC=1COc2ccccc2C1 Amb22498277 [0,1,0,1,0,0|1,0,1]=4 4784 B12R2.24 OC=1COc2ccccc2N1 Amb22330533 [0,1,0,1,0,0|2,0,0]=4 4785 B12R2.24 ON1Cc2ccccc2CC1 Amb24533074 [0,1,0,1,0,0|0,0,2]=4 4786 B12R2.24 O[13c]1[13cH][13c]2[13cH][13cH][13cH][13cH][13c]2[13cH][13cH]1 Amb22055903 [0,1,0,1,0,0|1,0,1]=4 4787 B12R2.24 O[C@@H]1Cc2ccccc2CC1 Amb25149682 [0,1,0,1,0,0|1,0,1]=4 4788 B12R2.24 O[C@H]1Cc2ccccc2C=C1 Amb25792328 [0,1,0,1,0,0|1,0,1]=4 4789 B12R2.24 O[C@H]1Cc2ccccc2CC1 Amb25043599 [0,1,0,1,0,0|1,0,1]=4 4790 B12R2.24 Oc1cc2CCCOc2cc1 Amb18243510 [0,1,0,1,0,0|1,0,1]=4 4791 B12R2.24 Oc1cc2CCN=Cc2cc1 Amb25073966 [0,1,0,1,0,0|1,0,1]=4 4792 B12R2.24 Oc1cc2[n][n]ccc2cc1 Amb25319976 [0,1,0,1,0,0|1,0,1]=4 4793 B12R2.24 Oc1cc2[n]c[n]cc2cc1 Amb24066333 [0,1,0,1,0,0|2,0,0]=4 4794 B12R2.24 Oc1cc2c[n]ccc2cc1 Amb19373209 [0,1,0,1,0,0|1,0,1]=4 4795 B12R2.24 Oc1cc2ccccc2cc1 Amb21973568 [0,1,0,1,0,0|1,0,1]=4 4796 B12R2.24 Oc1ccc2CCCOc2c1 Amb18125116 [0,1,0,1,0,0|1,0,1]=4 4797 B12R2.24 Oc1ccc2COCOc2c1 Amb25802023 [0,1,0,1,0,0|2,0,0]=4 4798 B12R2.24 Oc1ccc2OCC=Cc2c1 Amb18124873 [0,1,0,1,0,0|1,0,1]=4 4799 B12R2.24 Oc1ccc2c(c1)ccnc2 Amb10067627 [0,1,0,1,0,0|1,0,1]=4 4800 B12R2.24 Oc1ccc2c(c1)cncc2 Amb1152014 [0,1,0,1,0,0|1,0,1]=4 4801 B12R2.24 Oc1ccc2c(n1)cccc2 Amb1818223 [0,1,0,1,0,0|1,0,1]=4 4802 B12R2.24 Oc1ncc2c(c1)cccc2 Amb10068513 [0,1,0,1,0,0|1,0,1]=4 4803 B12R2.24 Oc1ncc2c(n1)cccc2 Amb1971493 [0,1,0,1,0,0|2,0,0]=4 4804 B12R2.24 Oc1nnc2c(c1)cccc2 Amb10552926 [0,1,0,1,0,0|1,0,1]=4 4805 B12R2.24 S=C1C=Cc2ccccc2O1 Amb21884783 [0,1,0,1,0,0|1,0,1]=4 4806 B12R2.24 S=C1CCc2ccccc2O1 Amb24104591 [0,1,0,1,0,0|1,0,1]=4 4807 B12R2.24 S=C1COc2c(N1)cccc2 Amb10070958 [0,1,0,1,0,0|2,0,0]=4 4808 B12R2.24 S=C1Cc2ccccc2CN1 Amb24538124 [0,1,0,1,0,0|1,0,1]=4 4809 B12R2.24 Sc1[n]c2ccccc2[n][n]1 Amb25842639 [0,1,0,1,0,0|2,0,0]=4 4810 B12R2.24 Sc1cc2CCCOc2cc1 Amb18180108 [0,1,0,1,0,0|1,0,1]=4 4811 B12R2.24 Sc1cc2c[n]ccc2cc1 Amb25150431 [0,1,0,1,0,0|1,0,1]=4 4812 B12R2.24 Sc1cc2ccccc2c[n]1 Amb24624669 [0,1,0,1,0,0|1,0,1]=4 4813 B12R2.79 Cc1ccc(cc1)C2CC2O Amb24527656 [0,1,0,1,0,0|1,0,1]=4 4814 B12R2.79 OC1CC1c2ccc(F)cc2 Amb24639281 [0,1,0,1,0,0|1,0,1]=4 4815 B12R2.132 CC1=CCc2ccc(Cl)cc21 Amb25857141 [0,1,0,1,0,0|2,0,0]=4 4816 B12R2.132 Cc1cc2B(O)OCc2cc1 Amb25777120 [0,1,0,1,0,0|2,0,0]=4 4817 B12R2.132 Cc1cc2C(O)OCc2cc1 Amb25151988 [0,1,0,1,0,0|2,0,0]=4 4818 B12R2.132 Cc1cc2c(cc1)[nH]c[n+]2O Amb25189520 [0,1,0,1,0,0|1,0,1]=4 4819 B12R2.132 Cc1ccc2CC[C@H](O)c2c1 Amb25337667 [0,1,0,1,0,0|1,0,1]=4 4820 B12R2.132 Cc1ccc2c(c1)C(O)CC2 Amb17087924 [0,1,0,1,0,0|1,0,1]=4 4821 B12R2.132 Fc1ccc2c(c1)C(O)CC2 Amb17087925 [0,1,0,1,0,0|1,0,1]=4 4822 B12R2.132 Nc1cc2B(O)OCc2cc1 Amb21963523 [0,1,0,1,0,0|2,0,0]=4 4823 B12R2.132 Nc1ccc2CCC(O)c2c1 Amb22490266 [0,1,0,1,0,0|1,0,1]=4 4824 B12R2.132 Nc1ccc2CC[C@H](O)c2c1 Amb24363627 [0,1,0,1,0,0|1,0,1]=4 4825 B12R2.132 Nc1ccc2c(c1)B(O)OC2 Amb10068944 [0,1,0,1,0,0|2,0,0]=4 4826 B12R2.132 OB1OCc2ccc(Br)cc21 Amb24672400 [0,1,0,1,0,0|2,0,0]=4 4827 B12R2.132 OB1OCc2ccc(Cl)cc21 Amb25330321 [0,1,0,1,0,0|2,0,0]=4 4828 B12R2.132 OB1OCc2ccc(F)cc21 Amb22497413 [0,1,0,1,0,0|2,0,0]=4 4829 B12R2.132 OC1CCc2ccc(Br)cc12 Amb17779324 [0,1,0,1,0,0|1,0,1]=4 4830 B12R2.132 OC1CCc2ccc(I)cc21 Amb25119131 [0,1,0,1,0,0|1,0,1]=4 4831 B12R2.132 OC1OCc2ccc(Br)cc21 Amb22751581 [0,1,0,1,0,0|2,0,0]=4 4832 B12R2.132 O[C@@H]1CCc2ccc(Br)cc21 Amb25147882 [0,1,0,1,0,0|1,0,1]=4 4833 B12R2.132 O[C@H]1CCc2ccc(Br)cc21 Amb25149044 [0,1,0,1,0,0|1,0,1]=4 4834 B12R2.132 O[C@H]1CCc2ccc(Cl)cc21 Amb25169483 [0,1,0,1,0,0|1,0,1]=4 4835 B12R2.132 O[C@H]1CCc2ccc(I)cc21 Amb25084197 [0,1,0,1,0,0|1,0,1]=4 4836 B12R2.132 O[n+]1c[nH]c2ccc(F)cc12 Amb24443092 [0,1,0,1,0,0|1,0,1]=4 4837 B12R2.132 Oc1c[nH]c2ccc(Br)cc21 Amb22736747 [0,1,0,1,0,0|2,0,0]=4 4838 B12R2.132 Oc1c[nH]c2ccc(Cl)cc21 Amb25152744 [0,1,0,1,0,0|2,0,0]=4 4839 B12R2.132 Oc1c[nH]c2ccc(F)cc21 Amb25684717 [0,1,0,1,0,0|2,0,0]=4 4840 B12R2.132 Oc1c[nH]c2ccc(I)cc21 Amb24067430 [0,1,0,1,0,0|2,0,0]=4 4841 B12R2.132 Oc1c[s]c2ccc(Br)cc21 Amb25300704 [0,1,0,1,0,0|2,0,0]=4 4842 B12R2.132 Oc1c[s]c2ccc(Cl)cc21 Amb25377298 [0,1,0,1,0,0|2,0,0]=4 4843 B12R2.132 Oc1c[s]c2ccc(I)cc21 Amb24708439 [0,1,0,1,0,0|2,0,0]=4 4844 B12R2.132 Oc1cc2c(cc1)[s]cc2O Amb25377349 [0,1,0,1,0,0|2,0,0]=4 4845 B12R2.132 Oc1cc2c(cc[n]2O)cc1 Amb25320792 [0,1,0,1,0,0|0,0,2]=4 4846 B12R2.132 Oc1ccc2CCC(O)c2c1 Amb25209331 [0,1,0,1,0,0|1,0,1]=4 4847 B12R2.132 Oc1ccc2COB(O)c2c1 Amb21964578 [0,1,0,1,0,0|2,0,0]=4 4848 B12R2.294 Clc1ccc(CC2CO2)cc1 Amb24712110 [0,1,0,1,0,0|1,0,1]=4 4849 B12R2.294 Fc1ccc(CC2CO2)cc1 Amb24390098 [0,1,0,1,0,0|1,0,1]=4 4850 B12R2.294 Oc1ccc(CC2CO2)cc1 Amb25338853 [0,1,0,1,0,0|1,0,1]=4 4851 B12R2.1175 O=C1C=CC2(CC=NO2)C=C1 Amb24456589 [0,1,0,1,0,0|0,0,1]=3 4852 B12R2.2302 Brc1ccc(cc1)C2CCO2 Amb24414336 [0,1,0,1,0,0|1,0,1]=4 4853 B12R2.2302 Clc1ccc(cc1)C2CCO2 Amb24369540 [0,1,0,1,0,0|1,0,1]=4 4854 B12R2.2302 Nc1ccc(cc1)C2CCO2 Amb25705796 [0,1,0,1,0,0|1,0,1]=4 4855 B12R2.2 C1C=CC(N1)c2ccccc2 Amb25087257 [0,1,0,1,0,0|2,0,0]=4 4856 B12R2.2 C1C=CCP1c2ccccc2 Amb25736369 [0,1,0,1,0,0|2,0,0]=4 4857 B12R2.2 C1C=COC1c2ccccc2 Amb24081226 [0,1,0,1,0,0|1,0,0]=3 4858 B12R2.2 C1C=NC(N1)c2ccccc2 Amb25145901 [0,1,0,1,0,0|2,0,0]=4 4859 B12R2.2 C1C=NC(S1)c2ccccc2 Amb25375170 [0,1,0,1,0,0|1,1,0]=4 4860 B12R2.2 C1C=NNC1c2cc[n]cc2 Amb25151828 [0,1,0,1,0,0|2,0,0]=4 4861 B12R2.2 C1C=NOC1c2cccc[n]2 Amb24100585 [0,1,0,1,0,0|1,0,0]=3 4862 B12R2.2 C1CN(C=N1)c2ccccc2 Amb22527125 [0,1,0,1,0,0|1,0,1]=4 4863 B12R2.2 C1COC(C1)c2ccccc2 Amb17334283 [0,1,0,1,0,0|1,0,1]=4 4864 B12R2.2 C1COC(N1)c2ccccc2 Amb17334284 [0,1,0,1,0,0|1,0,1]=4 4865 B12R2.2 C1N=CNC1c2c[n]ccc2 Amb24085256 [0,1,0,1,0,0|2,0,0]=4 4866 B12R2.2 C1NC(CO1)c2ccccc2 Amb25258799 [0,1,0,1,0,0|2,0,0]=4 4867 B12R2.2 C1NCC(O1)c2ccccc2 Amb18065307 [0,1,0,1,0,0|0,0,2]=4 4868 B12R2.2 C1OC=NC1c2ccccc2 Amb20247138 [0,1,0,1,0,0|2,0,0]=4 4869 B12R2.2 C1OCCC1c2ccccc2 Amb21960825 [0,1,0,1,0,0|1,0,1]=4 4870 B12R2.2 C1OCOC1c2ccccc2 Amb24101078 [0,1,0,1,0,0|1,0,1]=4 4871 B12R2.2 N1=CN(CC1)c2ccccc2 Amb16226120 [0,1,0,1,0,0|1,0,1]=4 4872 B12R2.2 c1[nH][n]cc1-c2ccccc2 Amb23438813 [0,1,0,1,0,0|1,0,1]=4 4873 B12R2.2 c1[nH]c([n][n]1)-c2ccccc2 Amb22359237 [0,1,0,1,0,0|1,0,1]=4 4874 B12R2.2 c1[n][n][n]([n]1)-c2ccccc2 Amb25779582 [0,1,0,1,0,0|2,0,0]=4 4875 B12R2.2 c1[n][n]c([s]1)-c2ccccc2 Amb24084931 [0,1,0,1,0,0|1,0,1]=4 4876 B12R2.2 c1[n][s]c([n]1)-c2ccccc2 Amb25265111 [0,1,0,1,0,0|0,1,1]=4 4877 B12R2.2 c1[n]cccc1-c2[n]c[n]o2 Amb24085082 [0,1,0,1,0,0|1,0,1]=4 4878 B12R2.2 c1[n]cccc1-c2c[n]o[n]2 Amb24085083 [0,1,0,1,0,0|1,0,1]=4 4879 B12R2.2 c1[n]cccc1-c2cc[n]o2 Amb24085086 [0,1,0,1,0,0|1,0,1]=4 4880 B12R2.2 c1[n]oc([n]1)-c2cc[n]cc2 Amb24102622 [0,1,0,1,0,0|1,0,1]=4 4881 B12R2.2 c1c[n]ccc1-c2cc[n]o2 Amb23441711 [0,1,0,1,0,0|1,0,1]=4 4882 B12R2.2 c1ccc(cc1)c2ccn[nH]2 Amb10235721 [0,1,0,1,0,0|1,0,1]=4 4883 B12R2.2 c1ccc(cc1)c2ccno2 Amb2191136 [0,1,0,1,0,0|0,0,1]=3 4884 B12R2.2 c1ccc(cc1)c2cncs2 Amb15691616 [0,1,0,1,0,0|0,1,1]=4 4885 B12R2.2 c1ccc(cc1)c2ncno2 Amb10552927 [0,1,0,1,0,0|0,0,1]=3 4886 B12R2.2 c1ccc(cc1)n2cncc2 Amb2413300 [0,1,0,1,0,0|1,0,1]=4 4887 B12R2.2 c1ccc(cc1)n2cncn2 Amb2237267 [0,1,0,1,0,0|2,0,0]=4 4888 B12R2.2 c1ccc(cc1)n2cnnn2 Amb2222042 [0,1,0,1,0,0|2,0,0]=4 4889 B12R2.2 c1cccc([n]1)C2NC=CO2 Amb24070044 [0,1,0,1,0,0|2,0,0]=4 4890 B12R2.2 c1ccccc1-c2cc[n][s]2 Amb24082008 [0,1,0,1,0,0|0,1,1]=4 4891 B12R2.2 c1ccccc1-c2cco[n]2 Amb19887522 [0,1,0,1,0,0|1,0,1]=4 4892 B12R2.2 c1ccccc1C2C=CC=C2 Amb24351108 [0,1,0,1,0,0|2,0,0]=4 4893 B12R2.2 c1ccccc1C2NC=CO2 Amb20621985 [0,1,0,1,0,0|1,0,0]=3 4894 B12R2.2 c1nocc1-c2ccccc2 Amb17777666 [0,1,0,1,0,0|0,0,1]=3 4895 B12R2.22 OC1CC(=C1)c2ccccc2 Amb25198298 [0,1,0,1,0,0|1,0,1]=4 4896 B12R2.22 OC1CC(C1)c2ccccc2 Amb20627950 [0,1,0,1,0,0|1,0,1]=4 4897 B12R2.22 O[C@@H]1C[C@H](C1)c2ccccc2 Amb25749083 [0,1,0,1,0,0|1,0,1]=4 4898 B12R2.27 COC1OC1c2ccccc2 Amb24613179 [0,1,0,1,0,0|2,0,0]=4 4899 B12R2.27 OCC1CC1c2ccccc2 Amb17605543 [0,1,0,1,0,0|1,0,1]=4 4900 B12R2.27 OCC1OC1c2ccccc2 Amb24063567 [0,1,0,1,0,0|1,0,1]=4 4901 B12R2.27 OC[C@H]1O[C@@H]1c2ccccc2 Amb20242388 [0,1,0,1,0,0|1,0,1]=4 4902 B12R2.116 CC1(CCO1)c2ccccc2 Amb22497354 [0,1,0,1,0,0|1,0,1]=4 4903 B12R2.931 NOCC1Cc2ccccc21 Amb24340346 [0,1,0,1,0,0|1,0,1]=4 4904 B12R2.931 O=C=NC1Cc2ccccc21 Amb25149119 [0,1,0,1,0,0|0,0,2]=4 4905 B12R2.931 OCCC1=Cc2ccccc21 Amb24414369 [0,1,0,1,0,0|1,0,1]=4 4906 B12R2.1081 Brc1c[n][n]c2ccccc21 Amb22586082 [0,1,0,1,0,0|1,0,1]=4 4907 B12R2.1081 Brc1cccc2C=CCOc21 Amb25032493 [0,1,0,1,0,0|1,0,1]=4 4908 B12R2.1081 Brc1cccc2CCCOc21 Amb18769314 [0,1,0,1,0,0|1,0,1]=4 4909 B12R2.1081 Brc1cccc2OCCCc21 Amb24081434 [0,1,0,1,0,0|1,0,1]=4 4910 B12R2.1081 Brc1cccc2[n][n]ccc21 Amb22276043 [0,1,0,1,0,0|1,0,1]=4 4911 B12R2.1081 Brc1cccc2c1cncn2 Amb10602884 [0,1,0,1,0,0|2,0,0]=4 4912 B12R2.1081 Brc1cccc2c[n]c[n]c21 Amb21858228 [0,1,0,1,0,0|2,0,0]=4 4913 B12R2.1081 Brc1cccc2cc[n][n]c21 Amb21964130 [0,1,0,1,0,0|1,0,1]=4 4914 B12R2.1081 Brc1cccc2cc[n]cc21 Amb24184018 [0,1,0,1,0,0|1,0,1]=4 4915 B12R2.1081 Brc1ncnc2c1cccc2 Amb10602647 [0,1,0,1,0,0|2,0,0]=4 4916 B12R2.1081 CC1=CCCc2c1cccc2 Amb2439915 [0,1,0,1,0,0|2,0,0]=4 4917 B12R2.1081 CC1=CCOc2ccccc21 Amb25694360 [0,1,0,1,0,0|1,0,1]=4 4918 B12R2.1081 CC1=COCc2ccccc21 Amb24436497 [0,1,0,1,0,0|2,0,0]=4 4919 B12R2.1081 CC1=NCCc2ccccc12 Amb17940779 [0,1,0,1,0,0|1,0,1]=4 4920 B12R2.1081 CC1NCOc2ccccc21 Amb24637522 [0,1,0,1,0,0|2,0,0]=4 4921 B12R2.1081 CC1OCOc2ccccc21 Amb24070527 [0,1,0,1,0,0|2,0,0]=4 4922 B12R2.1081 Cc1[n]ccc2ccccc21 Amb24074119 [0,1,0,1,0,0|1,0,1]=4 4923 B12R2.1081 Cc1c[n][n]c2ccccc21 Amb21964128 [0,1,0,1,0,0|1,0,1]=4 4924 B12R2.1081 Cc1cccc2C=CCOc21 Amb23441445 [0,1,0,1,0,0|1,0,1]=4 4925 B12R2.1081 Cc1cccc2C=NCCc21 Amb25852737 [0,1,0,1,0,0|1,0,1]=4 4926 B12R2.1081 Cc1cccc2CCCOc21 Amb25797643 [0,1,0,1,0,0|1,0,1]=4 4927 B12R2.1081 Cc1cccc2CCN=Cc21 Amb25721127 [0,1,0,1,0,0|1,0,1]=4 4928 B12R2.1081 Cc1cccc2OCC=Cc21 Amb24484436 [0,1,0,1,0,0|1,0,1]=4 4929 B12R2.1081 Cc1cccc2[n]c[n]cc21 Amb24090247 [0,1,0,1,0,0|2,0,0]=4 4930 B12R2.1081 Cc1cccc2c1ccnc2 Amb2447327 [0,1,0,1,0,0|1,0,1]=4 4931 B12R2.1081 Cc1cccc2c1cncc2 Amb10070397 [0,1,0,1,0,0|1,0,1]=4 4932 B12R2.1081 Cc1cccc2c1nncc2 Amb15691610 [0,1,0,1,0,0|1,0,1]=4 4933 B12R2.1081 Cc1cccc2c[n]c[n]c21 Amb22500783 [0,1,0,1,0,0|2,0,0]=4 4934 B12R2.1081 Cc1cncc2c1cccc2 Amb15691609 [0,1,0,1,0,0|1,0,1]=4 4935 B12R2.1081 Cc1nccc2ccccc12 Amb17672018 [0,1,0,1,0,0|1,0,1]=4 4936 B12R2.1081 Cc1ncnc2c1cccc2 Amb10573340 [0,1,0,1,0,0|2,0,0]=4 4937 B12R2.1081 ClC1=NOCc2ccccc21 Amb25111999 [0,1,0,1,0,0|2,0,0]=4 4938 B12R2.1081 Clc1cccc2C=CCOc21 Amb22586336 [0,1,0,1,0,0|1,0,1]=4 4939 B12R2.1081 Clc1cccc2CCN=Cc21 Amb24578663 [0,1,0,1,0,0|1,0,1]=4 4940 B12R2.1081 Clc1cccc2OCCCc21 Amb25308190 [0,1,0,1,0,0|1,0,1]=4 4941 B12R2.1081 Clc1cccc2[n]c[n]cc21 Amb22641427 [0,1,0,1,0,0|2,0,0]=4 4942 B12R2.1081 Clc1cccc2c1ccnc2 Amb10067233 [0,1,0,1,0,0|1,0,1]=4 4943 B12R2.1081 Clc1cccc2c1cncc2 Amb10067628 [0,1,0,1,0,0|1,0,1]=4 4944 B12R2.1081 Clc1nccc2c1cccc2 Amb2196515 [0,1,0,1,0,0|1,0,1]=4 4945 B12R2.1081 Clc1ncnc2c1cccc2 Amb10552924 [0,1,0,1,0,0|2,0,0]=4 4946 B12R2.1081 Clc1ncnc2c1cccc2 Amb1107717 [0,1,0,1,0,0|2,0,0]=4 4947 B12R2.1081 FC1CCOc2ccccc21 Amb24396221 [0,1,0,1,0,0|1,0,1]=4 4948 B12R2.1081 Fc1[n]c[n]c2ccccc21 Amb20669977 [0,1,0,1,0,0|2,0,0]=4 4949 B12R2.1081 Fc1[n]ccc2ccccc21 Amb24673352 [0,1,0,1,0,0|1,0,1]=4 4950 B12R2.1081 Fc1c[n]cc2ccccc21 Amb22396493 [0,1,0,1,0,0|1,0,1]=4 4951 B12R2.1081 Fc1cccc2C=CCOc21 Amb22586337 [0,1,0,1,0,0|1,0,1]=4 4952 B12R2.1081 Fc1cccc2C=NCCc21 Amb24563509 [0,1,0,1,0,0|1,0,1]=4 4953 B12R2.1081 Fc1cccc2CCCOc21 Amb24554425 [0,1,0,1,0,0|1,0,1]=4 4954 B12R2.1081 Fc1cccc2OC=CCc21 Amb25243428 [0,1,0,1,0,0|1,0,0]=3 4955 B12R2.1081 Fc1cccc2OCCCc21 Amb25084997 [0,1,0,1,0,0|1,0,1]=4 4956 B12R2.1081 Fc1cccc2[n]c[n]cc21 Amb24071402 [0,1,0,1,0,0|2,0,0]=4 4957 B12R2.1081 Fc1cccc2c1ccnc2 Amb10573349 [0,1,0,1,0,0|1,0,1]=4 4958 B12R2.1081 Fc1cccc2c1cncc2 Amb10839616 [0,1,0,1,0,0|1,0,1]=4 4959 B12R2.1081 Fc1cccc2c[n]c[n]c21 Amb22498029 [0,1,0,1,0,0|2,0,0]=4 4960 B12R2.1081 Fc1cccc2cc[n][n]c21 Amb24092308 [0,1,0,1,0,0|1,0,1]=4 4961 B12R2.1081 Ic1cccc2OCCCc21 Amb24707108 [0,1,0,1,0,0|1,0,1]=4 4962 B12R2.1081 Ic1cccc2cc[n]cc21 Amb22495459 [0,1,0,1,0,0|1,0,1]=4 4963 B12R2.1081 NC1=NCCc2ccccc21 Amb18644285 [0,1,0,1,0,0|1,0,1]=4 4964 B12R2.1081 NC1C=CCc2ccccc21 Amb18124751 [0,1,0,1,0,0|2,0,0]=4 4965 B12R2.1081 NC1CCOc2c1cccc2 Amb1107562 [0,1,0,1,0,0|1,0,1]=4 4966 B12R2.1081 N[C@@H]1CCOc2c1cccc2 Amb13953038 [0,1,0,1,0,0|1,0,1]=4 4967 B12R2.1081 N[C@@H]1CCOc2ccccc21 Amb19515762 [0,1,0,1,0,0|1,0,1]=4 4968 B12R2.1081 N[C@H]1CCOc2c1cccc2 Amb13953039 [0,1,0,1,0,0|1,0,1]=4 4969 B12R2.1081 N[C@H]1CCOc2ccccc21 Amb24052964 [0,1,0,1,0,0|1,0,1]=4 4970 B12R2.1081 Nc1c[n]cc2ccccc21 Amb22276925 [0,1,0,1,0,0|1,0,1]=4 4971 B12R2.1081 Nc1cccc2CC=CSc21 Amb25080918 [0,1,0,1,0,0|1,1,0]=4 4972 B12R2.1081 Nc1cccc2NN=CCc21 Amb18644332 [0,1,0,1,0,0|1,0,0]=3 4973 B12R2.1081 Nc1cccc2OCC=Nc21 Amb24093680 [0,1,0,1,0,0|2,0,0]=4 4974 B12R2.1081 Nc1cccc2[n][n]ccc21 Amb21857231 [0,1,0,1,0,0|1,0,1]=4 4975 B12R2.1081 Nc1cccc2[n]c[n]cc21 Amb24071664 [0,1,0,1,0,0|2,0,0]=4 4976 B12R2.1081 Nc1cccc2c1C=CCO2 Amb17569992 [0,1,0,1,0,0|1,0,1]=4 4977 B12R2.1081 Nc1cccc2c1CC=CC2 Amb17593645 [0,1,0,1,0,0|2,0,0]=4 4978 B12R2.1081 Nc1cccc2c1CCCO2 Amb17570000 [0,1,0,1,0,0|1,0,1]=4 4979 B12R2.1081 Nc1cccc2c1COCO2 Amb17570009 [0,1,0,1,0,0|2,0,0]=4 4980 B12R2.1081 Nc1cccc2c1OCC=C2 Amb17569990 [0,1,0,1,0,0|1,0,1]=4 4981 B12R2.1081 Nc1cccc2c1OCCC2 Amb17569999 [0,1,0,1,0,0|1,0,1]=4 4982 B12R2.1081 Nc1cccc2c1OCOC2 Amb17570008 [0,1,0,1,0,0|2,0,0]=4 4983 B12R2.1081 Nc1cccc2c1ccnc2 Amb1157144 [0,1,0,1,0,0|1,0,1]=4 4984 B12R2.1081 Nc1cccc2cc[n][n]c21 Amb21857233 [0,1,0,1,0,0|1,0,1]=4 4985 B12R2.1081 Nc1cccc2cc[n]cc21 Amb22756321 [0,1,0,1,0,0|1,0,1]=4 4986 B12R2.1081 Nc1ncnc2c1cccc2 Amb1154616 [0,1,0,1,0,0|2,0,0]=4 4987 B12R2.1081 O=C1C=CC=C2NC=NC=C21 Amb24617550 [0,1,0,1,0,0|2,0,0]=4 4988 B12R2.1081 O=C1C=CCc2c1cccc2 Amb2388336 [0,1,0,1,0,0|1,0,1]=4 4989 B12R2.1081 O=C1C=COc2ccccc21 Amb19894749 [0,1,0,1,0,0|1,0,1]=4 4990 B12R2.1081 O=C1C=NCc2ccccc21 Amb25717685 [0,1,0,1,0,0|1,0,1]=4 4991 B12R2.1081 O=C1C=NNc2ccccc21 Amb18528334 [0,1,0,1,0,0|1,0,1]=4 4992 B12R2.1081 O=C1C=NOc2ccccc21 Amb25713023 [0,1,0,1,0,0|0,0,1]=3 4993 B12R2.1081 OB1OCCc2c1cccc2 Amb10070693 [0,1,0,1,0,0|1,0,1]=4 4994 B12R2.1081 OC1=C2C=CC=CN2CC=C1 Amb17835332 [0,1,0,1,0,0|2,0,0]=4 4995 B12R2.1081 OC1=CNNc2ccccc21 Amb22057612 [0,1,0,1,0,0|2,0,0]=4 4996 B12R2.1081 OC1=COCc2c1cccc2 Amb10603427 [0,1,0,1,0,0|1,0,0]=3 4997 B12R2.1081 OC1C=COc2ccccc21 Amb25758786 [0,1,0,1,0,0|1,0,0]=3 4998 B12R2.1081 OC1CC=Cc2ccccc21 Amb25122696 [0,1,0,1,0,0|1,0,1]=4 4999 B12R2.1081 OC1CCCc2c1cccc2 Amb1151324 [0,1,0,1,0,0|1,0,1]=4 5000 B12R2.1081 OC1CCNc2c1cccc2 Amb10553386 [0,1,0,1,0,0|1,0,1]=4 5001 B12R2.1081 OC1CCNc2ccccc21 Amb22276045 [0,1,0,1,0,0|1,0,1]=4 5002 B12R2.1081 OC1CCNc2ccccc21 Amb22497677 [0,1,0,1,0,0|1,0,1]=4 5003 B12R2.1081 OC1CNCc2c1cccc2 Amb16233378 [0,1,0,1,0,0|1,0,1]=4 5004 B12R2.1081 OC1CNCc2ccccc21 Amb22587041 [0,1,0,1,0,0|1,0,1]=4 5005 B12R2.1081 OC1COCc2ccccc21 Amb20171360 [0,1,0,1,0,0|1,0,1]=4 5006 B12R2.1081 OC1ON=Cc2ccccc21 Amb25129790 [0,1,0,1,0,0|2,0,0]=4 5007 B12R2.1081 ON1CCCc2ccccc12 Amb24085481 [0,1,0,1,0,0|0,0,2]=4 5008 B12R2.1081 O[13c]1[13cH][13cH][13cH][13c]2[13c]1[13cH][13cH][13cH][13cH]2 Amb17618239 [0,1,0,1,0,0|1,0,1]=4 5009 B12R2.1081 O[14c]1cccc2ccccc12 Amb22352351 [0,1,0,1,0,0|1,0,1]=4 5010 B12R2.1081 O[C@@H]1C=CCc2ccccc21 Amb25149702 [0,1,0,1,0,0|1,0,0]=3 5011 B12R2.1081 O[C@@H]1C=COc2ccccc21 Amb25108504 [0,1,0,1,0,0|1,0,0]=3 5012 B12R2.1081 O[C@@H]1CCCc2ccccc21 Amb22337827 [0,1,0,1,0,0|1,0,1]=4 5013 B12R2.1081 O[C@@H]1CCSc2c1cccc2 Amb13952924 [0,1,0,1,0,0|1,0,1]=4 5014 B12R2.1081 O[C@@H]1CNCc2ccccc21 Amb24746212 [0,1,0,1,0,0|1,0,1]=4 5015 B12R2.1081 O[C@@H]1COCc2ccccc21 Amb22748516 [0,1,0,1,0,0|1,0,1]=4 5016 B12R2.1081 O[C@H]1CCCc2ccccc21 Amb22336192 [0,1,0,1,0,0|1,0,1]=4 5017 B12R2.1081 O[C@H]1CCSc2c1cccc2 Amb13952926 [0,1,0,1,0,0|1,0,1]=4 5018 B12R2.1081 O[C@H]1CNCc2ccccc21 Amb24533225 [0,1,0,1,0,0|1,0,1]=4 5019 B12R2.1081 O[C@H]1COCc2ccccc21 Amb25748982 [0,1,0,1,0,0|1,0,1]=4 5020 B12R2.1081 Oc1[n]c[n]c2c[n]ccc21 Amb22274464 [0,1,0,1,0,0|2,0,0]=4 5021 B12R2.1081 Oc1[n]c[n]c2ccc[n]c21 Amb22727893 [0,1,0,1,0,0|2,0,0]=4 5022 B12R2.1081 Oc1[n]ccc2ccc[n]c21 Amb18644258 [0,1,0,1,0,0|1,0,1]=4 5023 B12R2.1081 Oc1[n]ccc2ccccc21 Amb22347767 [0,1,0,1,0,0|0,0,1]=3 5024 B12R2.1081 Oc1c[n]cc2ccccc21 Amb21964404 [0,1,0,1,0,0|1,0,1]=4 5025 B12R2.1081 Oc1cc[n]c2ccccc21 Amb22450352 [0,1,0,1,0,0|1,0,1]=4 5026 B12R2.1081 Oc1cccc2CCCOc21 Amb25142441 [0,1,0,1,0,0|1,0,1]=4 5027 B12R2.1081 Oc1cccc2OCC=Cc21 Amb18124878 [0,1,0,1,0,0|1,0,1]=4 5028 B12R2.1081 Oc1cccc2OCOCc21 Amb24566795 [0,1,0,1,0,0|2,0,0]=4 5029 B12R2.1081 Oc1cccc2c1cncn2 Amb10552923 [0,1,0,1,0,0|2,0,0]=4 5030 B12R2.1081 Oc1cccc2c1ncnc2 Amb10552925 [0,1,0,1,0,0|2,0,0]=4 5031 B12R2.1081 Oc1cccc2cc[n][n]c21 Amb24601328 [0,1,0,1,0,0|1,0,1]=4 5032 B12R2.1081 Oc1cncc2c1cccc2 Amb10553148 [0,1,0,1,0,0|1,0,1]=4 5033 B12R2.1081 Oc1cnnc2c1cccc2 Amb2371264 [0,1,0,1,0,0|1,0,1]=4 5034 B12R2.1081 S=C1C=NNc2ccccc21 Amb18043628 [0,1,0,1,0,0|1,0,1]=4 5035 B12R2.1081 Sc1cnnc2c1cccc2 Amb2371342 [0,1,0,1,0,0|1,0,1]=4 5036 B12R2.1081 Sc1ncnc2c1cccc2 Amb1104189 [0,1,0,1,0,0|1,1,0]=4 5037 B12R2.1081 [NH3+]C1CCOc2ccccc21 Amb21862674 [0,1,0,1,0,0|1,0,1]=4 5038 B12R2.2028 CC1=CC(C)c2ccccc12 Amb24641446 [0,1,0,1,0,0|2,0,0]=4 5039 B12R2.2028 CC1=CC(O)c2ccccc12 Amb17778893 [0,1,0,1,0,0|1,0,1]=4 5040 B12R2.2028 CC1=C[C@@H](Br)c2ccccc21 Amb25827191 [0,1,0,1,0,0|2,0,0]=4 5041 B12R2.2028 CC1C=C(Cl)c2ccccc12 Amb17778911 [0,1,0,1,0,0|2,0,0]=4 5042 B12R2.2028 CC1C=C(O)c2cc[n]cc21 Amb24092212 [0,1,0,1,0,0|2,0,0]=4 5043 B12R2.2028 CC1CC(O)c2ccccc21 Amb25709313 [0,1,0,1,0,0|1,0,1]=4 5044 B12R2.2028 C[C@@H]1CC(O)c2ccccc21 Amb25188702 [0,1,0,1,0,0|1,0,1]=4 5045 B12R2.2028 C[C@H]1CC(O)c2ccccc21 Amb24533800 [0,1,0,1,0,0|1,0,1]=4 5046 B12R2.2028 C[C@H]1C[C@@H](O)c2ccccc21 Amb24740911 [0,1,0,1,0,0|1,0,1]=4 5047 B12R2.2028 C[n]1cc(O)c2ccccc12 Amb24069283 [0,1,0,1,0,0|2,0,0]=4 5048 B12R2.2028 N[C@@H]1CC(O)c2ccccc21 Amb25317541 [0,1,0,1,0,0|1,0,1]=4 5049 B12R2.2028 N[C@@H]1C[C@@H](O)c2ccccc21 Amb25213011 [0,1,0,1,0,0|1,0,1]=4 5050 B12R2.2028 N[C@@H]1C[C@H](O)c2ccccc21 Amb24657326 [0,1,0,1,0,0|1,0,1]=4 5051 B12R2.2028 N[C@H]1CC(O)c2ccccc21 Amb25716664 [0,1,0,1,0,0|1,0,1]=4 5052 B12R2.2028 OC1CC(c2c1cccc2)N Amb17470387 [0,1,0,1,0,0|1,0,1]=4 5053 B12R2.2028 OC1CC(c2c1cccc2)O Amb1110942 [0,1,0,1,0,0|1,0,1]=4 5054 B12R2.2028 OC1NC(O)c2ccccc21 Amb24441685 [0,1,0,1,0,0|2,0,0]=4 5055 B12R2.2028 O[C@H]1C[C@@H](O)c2ccccc12 Amb17938072 [0,1,0,1,0,0|1,0,1]=4 5056 B12R2.2028 O[C@H]1C[C@@H](c2c1cccc2)O Amb10068281 [0,1,0,1,0,0|1,0,1]=4 5057 B12R2.2047 CC1C(CO)c2ccccc21 Amb24541544 [0,1,0,1,0,0|1,0,1]=4 5058 B12R2.2075 FC(C1CO1)c2ccccc2 Amb24611783 [0,1,0,1,0,0|1,0,1]=4 5059 B12R2.2075 O[C@@H]([C@H]1CO1)c2ccccc2 Amb24700386 [0,1,0,1,0,0|1,0,1]=4 5060 B12R2.2075 O[C@H]([C@@H]1CO1)c2ccccc2 Amb24718405 [0,1,0,1,0,0|1,0,1]=4 5061 B12R2.32 CSC=1Cc2ccccc2N1 Amb24474025 [0,1,0,1,0,0|2,0,0]=4 5062 B12R2.32 ClCC=1Cc2ccccc2C1 Amb24359917 [0,1,0,1,0,0|2,0,0]=4 5063 B12R2.32 N#CC=1Cc2ccccc2C1 Amb18643732 [0,1,0,1,0,0|2,0,0]=4 5064 B12R2.32 NCC=1Cc2ccccc2C1 Amb25178878 [0,1,0,1,0,0|2,0,0]=4 5065 B12R2.32 NN=C1Cc2ccccc2C1 Amb25279861 [0,1,0,1,0,0|1,0,0]=3 5066 B12R2.32 NNC=1Cc2ccccc2N1 Amb18644335 [0,1,0,1,0,0|1,0,1]=4 5067 B12R2.32 N\N=C\1/Nc2ccccc2S1 Amb22357567 [0,1,0,1,0,0|2,0,0]=4 5068 B12R2.32 N\N=c\1/sc2c([nH]1)cccc2 Amb17621879 [0,1,0,1,0,0|2,0,0]=4 5069 B12R2.32 O=CC=1Cc2ccccc2C1 Amb18644150 [0,1,0,1,0,0|1,0,1]=4 5070 B12R2.32 O=CC=1Cc2ccccc2N1 Amb24078943 [0,1,0,1,0,0|1,0,1]=4 5071 B12R2.32 O=Nc1[n]c2ccccc2[s]1 Amb24518886 [0,1,0,1,0,0|1,0,1]=4 5072 B12R2.32 OCC1Cc2ccccc2C1 Amb19516120 [0,1,0,1,0,0|1,0,1]=4 5073 B12R2.32 OCC1Cc2ccccc2S1 Amb24513744 [0,1,0,1,0,0|1,0,1]=4 5074 B12R2.32 OCC=1Cc2ccccc2C1 Amb22494117 [0,1,0,1,0,0|1,0,0]=3 5075 B12R2.32 OC[C@@H]1Cc2ccccc2N1 Amb22336386 [0,1,0,1,0,0|1,0,1]=4 5076 B12R2.32 OC[C@H]1Cc2ccccc2N1 Amb24746775 [0,1,0,1,0,0|1,0,1]=4 5077 B12R2.32 OCc1cc2c(o1)cccc2 Amb1156663 [0,1,0,1,0,0|1,0,1]=4 5078 B12R2.32 O\N=C/1\Cc2ccccc2O1 Amb24727728 [0,1,0,1,0,0|0,0,0]=2 5079 B12R2.32 [N-]=[N+]=C1Cc2ccccc2N1 Amb24651394 [0,1,0,1,0,0|1,0,1]=4 5080 B12R2.115 Cc1ccccc1C2CC2O Amb24526800 [0,1,0,1,0,0|1,0,1]=4 5081 B12R2.196 CC1=CCc2c(F)cccc21 Amb25114614 [0,1,0,1,0,0|2,0,0]=4 5082 B12R2.196 Cc1cccc2B(O)OCc21 Amb24591278 [0,1,0,1,0,0|2,0,0]=4 5083 B12R2.196 Cc1cccc2c(O)c[s]c21 Amb25237723 [0,1,0,1,0,0|2,0,0]=4 5084 B12R2.196 OC1CCc2c(Br)cccc21 Amb20171517 [0,1,0,1,0,0|1,0,1]=4 5085 B12R2.196 OC1CCc2c1cccc2C Amb17087931 [0,1,0,1,0,0|1,0,1]=4 5086 B12R2.196 OC1CCc2c1cccc2Cl Amb17087934 [0,1,0,1,0,0|1,0,1]=4 5087 B12R2.196 OC1CCc2c1cccc2F Amb17087933 [0,1,0,1,0,0|1,0,1]=4 5088 B12R2.196 OC1OCc2c(F)cccc21 Amb25266840 [0,1,0,1,0,0|2,0,0]=4 5089 B12R2.196 O[C@@H]1CCc2c(Br)cccc21 Amb22756414 [0,1,0,1,0,0|1,0,1]=4 5090 B12R2.196 O[C@@H]1CCc2c(F)cccc21 Amb24432762 [0,1,0,1,0,0|1,0,1]=4 5091 B12R2.196 O[C@@H]1CCc2c1cccc2Cl Amb13953026 [0,1,0,1,0,0|1,0,1]=4 5092 B12R2.196 O[C@H]1CCc2c1cccc2Cl Amb13953025 [0,1,0,1,0,0|1,0,1]=4 5093 B12R2.196 Oc1c[nH]c2c(Cl)cccc21 Amb24067436 [0,1,0,1,0,0|2,0,0]=4 5094 B12R2.196 Oc1c[s]c2c(Br)cccc21 Amb24086473 [0,1,0,1,0,0|2,0,0]=4 5095 B12R2.196 Oc1cccc2B(O)OCc12 Amb25319915 [0,1,0,1,0,0|2,0,0]=4 5096 B12R2.196 Oc1cccc2C(O)CCc12 Amb18179372 [0,1,0,1,0,0|1,0,1]=4 5097 B12R2.196 Oc1cccc2[C@@H](O)CCc12 Amb25032411 [0,1,0,1,0,0|1,0,1]=4 5098 B12R2.196 Oc1cccc2c1occ2O Amb24061734 [0,1,0,1,0,0|2,0,0]=4 5099 B12R2.225 Cc1ccccc1CC2CO2 Amb25122222 [0,1,0,1,0,0|1,0,1]=4 5100 B12R2.225 Clc1ccccc1CC2CO2 Amb25094935 [0,1,0,1,0,0|1,0,1]=4 5101 B12R2.225 Oc1ccccc1CC2CO2 Amb24364096 [0,1,0,1,0,0|1,0,1]=4 5102 B12R2.225 Oc1ccccc1C[C@@H]2CO2 Amb24724020 [0,1,0,1,0,0|1,0,1]=4 5103 B12R2.80 OC1CC1c2cc(F)ccc2 Amb24756969 [0,1,0,1,0,0|1,0,1]=4 5104 B12R2.203 Cc1cccc2CCC(O)c21 Amb22886909 [0,1,0,1,0,0|1,0,1]=4 5105 B12R2.203 Cc1cccc2CC[C@@H](O)c21 Amb25032595 [0,1,0,1,0,0|1,0,1]=4 5106 B12R2.203 Cc1cccc2CC[C@H](O)c21 Amb24412154 [0,1,0,1,0,0|1,0,1]=4 5107 B12R2.203 Cc1cccc2COB(O)c21 Amb25726432 [0,1,0,1,0,0|2,0,0]=4 5108 B12R2.203 Nc1cccc2[n]c[n](O)c21 Amb24391185 [0,1,0,1,0,0|1,0,1]=4 5109 B12R2.203 OB1OCc2cccc(Br)c21 Amb24340409 [0,1,0,1,0,0|2,0,0]=4 5110 B12R2.203 OB1OCc2cccc(Cl)c21 Amb24644214 [0,1,0,1,0,0|2,0,0]=4 5111 B12R2.203 OC1CCc2cccc(Br)c21 Amb24439435 [0,1,0,1,0,0|1,0,1]=4 5112 B12R2.203 Oc1cccc2CCC(O)c12 Amb18125105 [0,1,0,1,0,0|1,0,1]=4 5113 B12R2.203 Oc1cccc2CC[C@@H](O)c12 Amb24449232 [0,1,0,1,0,0|1,0,1]=4 5114 B12R2.203 Oc1cccc2CC[C@H](O)c12 Amb24746238 [0,1,0,1,0,0|1,0,1]=4 5115 B12R2.203 Oc1cccc2COB(O)c12 Amb24396270 [0,1,0,1,0,0|2,0,0]=4 5116 B12R2.203 Oc1cccc2cc[n](O)c12 Amb24561147 [0,1,0,1,0,0|0,0,2]=4 5117 B12R2.612 Cc1cc2CCC(O)c2cc1 Amb21964865 [0,1,0,1,0,0|1,0,1]=4 5118 B12R2.612 Cc1cc2[s]cc(O)c2cc1 Amb25208551 [0,1,0,1,0,0|2,0,0]=4 5119 B12R2.612 Cc1ccc2B(O)OCc2c1 Amb25771094 [0,1,0,1,0,0|2,0,0]=4 5120 B12R2.612 Cc1ccc2C(O)OCc2c1 Amb24354413 [0,1,0,1,0,0|2,0,0]=4 5121 B12R2.612 Clc1ccc2c(c1)CC[C@@H]2O Amb13953030 [0,1,0,1,0,0|1,0,1]=4 5122 B12R2.612 Clc1ccc2c(c1)CC[C@H]2O Amb13953029 [0,1,0,1,0,0|1,0,1]=4 5123 B12R2.612 Fc1ccc2c(c1)CC[C@@H]2O Amb13953033 [0,1,0,1,0,0|1,0,1]=4 5124 B12R2.612 Fc1ccc2c(c1)CC[C@H]2O Amb13953035 [0,1,0,1,0,0|1,0,1]=4 5125 B12R2.612 Nc1cc2CCC(O)c2cc1 Amb24386265 [0,1,0,1,0,0|1,0,1]=4 5126 B12R2.612 Nc1cc2CC[C@@H](O)c2cc1 Amb24474275 [0,1,0,1,0,0|1,0,1]=4 5127 B12R2.612 Nc1cc2CC[C@H](O)c2cc1 Amb24733416 [0,1,0,1,0,0|1,0,1]=4 5128 B12R2.612 Nc1cc2[s]cc(O)c2cc1 Amb25185341 [0,1,0,1,0,0|2,0,0]=4 5129 B12R2.612 OB1OCc2cc(Cl)ccc21 Amb24271171 [0,1,0,1,0,0|2,0,0]=4 5130 B12R2.612 OB1OCc2cc(F)ccc21 Amb22740055 [0,1,0,1,0,0|2,0,0]=4 5131 B12R2.612 OC1CCc2cc(Cl)ccc21 Amb22001631 [0,1,0,1,0,0|1,0,1]=4 5132 B12R2.612 OC1CCc2cc(F)ccc21 Amb22756387 [0,1,0,1,0,0|1,0,1]=4 5133 B12R2.612 OC1OCc2cc(Cl)ccc21 Amb22751579 [0,1,0,1,0,0|2,0,0]=4 5134 B12R2.612 O[C@@H]1CCc2cc(Br)ccc21 Amb22886733 [0,1,0,1,0,0|1,0,1]=4 5135 B12R2.612 O[C@H]1CCc2cc(Br)ccc21 Amb24420879 [0,1,0,1,0,0|1,0,1]=4 5136 B12R2.612 Oc1c[nH]c2cc(Br)ccc21 Amb22001897 [0,1,0,1,0,0|2,0,0]=4 5137 B12R2.612 Oc1c[nH]c2cc(Cl)ccc21 Amb24067431 [0,1,0,1,0,0|2,0,0]=4 5138 B12R2.612 Oc1c[nH]c2cc(F)ccc21 Amb25143984 [0,1,0,1,0,0|2,0,0]=4 5139 B12R2.612 Oc1c[s]c2cc(Cl)ccc21 Amb25233165 [0,1,0,1,0,0|2,0,0]=4 5140 B12R2.612 Oc1cc2[s]cc(O)c2cc1 Amb24467044 [0,1,0,1,0,0|2,0,0]=4 5141 B12R2.612 Oc1cc2occ(O)c2cc1 Amb24061705 [0,1,0,1,0,0|2,0,0]=4 5142 B12R2.612 Oc1ccc2B(O)OCc2c1 Amb24665939 [0,1,0,1,0,0|2,0,0]=4 5143 B12R2.612 Oc1ccc2C(O)CCc2c1 Amb22001818 [0,1,0,1,0,0|1,0,1]=4 5144 B12R2.1286 Fc1cc(CC2CO2)ccc1 Amb24558530 [0,1,0,1,0,0|1,0,1]=4 5145 B12R2.1 COC1=CCc2ccccc12 Amb17778910 [0,1,0,1,0,0|1,0,0]=3 5146 B12R2.1 COC1=NCc2ccccc12 Amb24527731 [0,1,0,1,0,0|2,0,0]=4 5147 B12R2.1 COC1OCc2ccccc21 Amb24323529 [0,1,0,1,0,0|2,0,0]=4 5148 B12R2.1 CO[n]1ccc2ccccc12 Amb24117866 [0,1,0,1,0,0|0,0,2]=4 5149 B12R2.1 COc1c[nH]c2ccccc12 Amb22489959 [0,1,0,1,0,0|2,0,0]=4 5150 B12R2.1 C\C=C\1/CNc2ccccc21 Amb25858232 [0,1,0,1,0,0|2,0,0]=4 5151 B12R2.1 Cl\C=C/1\CCc2ccccc21 Amb24519209 [0,1,0,1,0,0|2,0,0]=4 5152 B12R2.1 N#CC1=CCc2c1cccc2 Amb17231929 [0,1,0,1,0,0|2,0,0]=4 5153 B12R2.1 NCC1=CCc2ccccc12 Amb18560208 [0,1,0,1,0,0|2,0,0]=4 5154 B12R2.1 NNC1=NCc2ccccc12 Amb18124833 [0,1,0,1,0,0|1,0,1]=4 5155 B12R2.1 NOC1CCc2ccccc21 Amb25808729 [0,1,0,1,0,0|1,0,1]=4 5156 B12R2.1 N\N=C/1\CCc2c1cccc2 Amb2384463 [0,1,0,1,0,0|1,0,0]=3 5157 B12R2.1 N\N=C/1\CSc2[n]cccc12 Amb24586591 [0,1,0,1,0,0|2,0,0]=4 5158 B12R2.1 O=CC1=CCc2ccccc12 Amb18644151 [0,1,0,1,0,0|1,0,1]=4 5159 B12R2.1 O=NN1CCc2ccccc12 Amb17689298 [0,1,0,1,0,0|0,0,2]=4 5160 B12R2.1 O=N[n]1ccc2ccccc12 Amb25267949 [0,1,0,1,0,0|0,0,2]=4 5161 B12R2.1 O=Nc1c[nH]c2ccccc12 Amb17940483 [0,1,0,1,0,0|0,0,2]=4 5162 B12R2.1 OCC1=CCc2ccccc12 Amb25797665 [0,1,0,1,0,0|1,0,0]=3 5163 B12R2.1 OCC1CCc2ccccc21 Amb19329220 [0,1,0,1,0,0|1,0,1]=4 5164 B12R2.1 OCC1CNc2ccccc21 Amb18063448 [0,1,0,1,0,0|1,0,1]=4 5165 B12R2.1 OCC1COc2ccccc21 Amb22224879 [0,1,0,1,0,0|1,0,1]=4 5166 B12R2.1 OCC1CSc2ccccc21 Amb24615579 [0,1,0,1,0,0|1,0,1]=4 5167 B12R2.1 OCC1NCc2ccccc21 Amb25736151 [0,1,0,1,0,0|1,0,1]=4 5168 B12R2.1 OC[C@@H]1COc2ccccc21 Amb24487044 [0,1,0,1,0,0|1,0,1]=4 5169 B12R2.1 OC[C@H]1OCc2ccccc21 Amb24412216 [0,1,0,1,0,0|1,0,1]=4 5170 B12R2.1 OC[n]1ccc2ccccc12 Amb25374111 [0,1,0,1,0,0|0,0,2]=4 5171 B12R2.1 OCc1[n]oc2ccccc21 Amb22498744 [0,1,0,1,0,0|2,0,0]=4 5172 B12R2.1 OCc1c[nH]c2c1cccc2 Amb1153804 [0,1,0,1,0,0|1,0,1]=4 5173 B12R2.1 OCc1c[nH]c2c1cccc2 Amb16231311 [0,1,0,1,0,0|1,0,1]=4 5174 B12R2.1 OCc1coc2c1cccc2 Amb10572402 [0,1,0,1,0,0|1,0,1]=4 5175 B12R2.1 OCc1n[nH]c2c1cccc2 Amb1070698 [0,1,0,1,0,0|2,0,0]=4 5176 B12R2.1 OCn1cnc2c1cccc2 Amb1151978 [0,1,0,1,0,0|1,0,1]=4 5177 B12R2.1 ONc1[n]oc2ccccc21 Amb25151938 [0,1,0,1,0,0|1,0,1]=4 5178 B12R2.1 O\N=C/1\C=Nc2ccccc12 Amb25288455 [0,1,0,1,0,0|0,0,1]=3 5179 B12R2.1 O\N=C/1\CCc2[n]cccc12 Amb24068690 [0,1,0,1,0,0|1,0,0]=3 5180 B12R2.1 O\N=C/1\CCc2cc[n]cc12 Amb24612371 [0,1,0,1,0,0|1,0,0]=3 5181 B12R2.1 O\N=C/1\CCc2ccccc21 Amb24121339 [0,1,0,1,0,0|0,0,0]=2 5182 B12R2.1 O\N=C/1\CSc2ccccc21 Amb24611046 [0,1,0,1,0,0|0,0,0]=2 5183 B12R2.1 O\N=C\1/CCc2ccccc21 Amb22731286 [0,1,0,1,0,0|0,0,0]=2 5184 B12R2.1 O\N=C\1/COc2ccccc21 Amb19650724 [0,1,0,1,0,0|0,0,0]=2 5185 B12R2.1 O\N=C\1/NCc2ccccc12 Amb24746464 [0,1,0,1,0,0|0,0,0]=2 5186 B12R2.11 OC1CC1Cc2ccccc2 Amb25145316 [0,1,0,1,0,0|1,0,1]=4 5187 B12R2.11 OC1CC1Sc2ccccc2 Amb25788139 [0,1,0,1,0,0|1,0,1]=4 5188 B12R2.11 O[C@H]1C[C@@H]1Cc2ccccc2 Amb25326057 [0,1,0,1,0,0|1,0,1]=4 5189 B12R2.11 O[C@H]1C[C@@H]1Sc2ccccc2 Amb24745857 [0,1,0,1,0,0|1,0,1]=4 5190 B12R2.23 BrC1COC1c2ccccc2 Amb24484887 [0,1,0,1,0,0|1,0,1]=4 5191 B12R2.23 Br[C@@H]1CO[C@H]1c2ccccc2 Amb25198843 [0,1,0,1,0,0|1,0,1]=4 5192 B12R2.23 O=C1CCC1c2ccccc2 Amb19515483 [0,1,0,1,0,0|2,0,0]=4 5193 B12R2.23 O=C1CNC1c2ccccc2 Amb24449898 [0,1,0,1,0,0|2,0,0]=4 5194 B12R2.23 O=C1COC1c2ccccc2 Amb23456091 [0,1,0,1,0,0|1,0,0]=3 5195 B12R2.23 OC1CCC1c2ccccc2 Amb19374437 [0,1,0,1,0,0|1,0,1]=4 5196 B12R2.23 OC1CNC1c2ccccc2 Amb25680030 [0,1,0,1,0,0|1,0,1]=4 5197 B12R2.23 O[C@@H]1CC[C@H]1c2ccccc2 Amb24620488 [0,1,0,1,0,0|1,0,1]=4 5198 B12R2.23 O[C@@H]1CS[C@H]1c2ccccc2 Amb25334761 [0,1,0,1,0,0|1,0,1]=4 5199 B12R2.23 O[C@H]1CS[C@H]1c2ccccc2 Amb25176781 [0,1,0,1,0,0|1,0,1]=4 5200 B12R2.2057 C(Oc1ccccc1)C2CO2 Amb22366990 [0,1,0,1,0,0|1,0,1]=4 5201 B12R2.2057 C1C=C1CNc2ccccc2 Amb25824311 [0,1,0,1,0,0|2,0,0]=4 5202 B12R2.2057 C1OC1CCc2ccccc2 Amb24105379 [0,1,0,1,0,0|1,0,1]=4 5203 B12R2.2057 C1OC1\C=C\c2ccccc2 Amb24418540 [0,1,0,1,0,0|1,0,1]=4 5204 B12R2.2057 C1O[C@@H]1CSc2ccccc2 Amb25680899 [0,1,0,1,0,0|1,0,1]=4 5205 B12R2.2057 C1O[C@@H]1OCc2ccccc2 Amb24631881 [0,1,0,1,0,0|1,0,1]=4 5206 B12R2.2058 C1N=CN1Cc2ccccc2 Amb25709568 [0,1,0,1,0,0|1,0,0]=3 5207 B12R2.18 C=C1Cc2ccccc2C1=O Amb18062660 [0,1,0,1,0,0|1,0,1]=4 5208 B12R2.18 C=C1Cc2ccccc2C1O Amb25045696 [0,1,0,1,0,0|1,0,0]=3 5209 B12R2.18 C=C1Oc2ccccc2C1O Amb25852741 [0,1,0,1,0,0|2,0,0]=4 5210 B12R2.18 CC1=Cc2ccccc2C1O Amb17778950 [0,1,0,1,0,0|1,0,1]=4 5211 B12R2.18 CC1C(=O)Cc2ccccc21 Amb20622460 [0,1,0,1,0,0|2,0,0]=4 5212 B12R2.18 CC=1c2ccccc2CC1C Amb21948330 [0,1,0,1,0,0|2,0,0]=4 5213 B12R2.18 NC1Cc2ccccc2C1O Amb20623676 [0,1,0,1,0,0|1,0,1]=4 5214 B12R2.18 N[C@@H]1Cc2ccccc2C1O Amb25209005 [0,1,0,1,0,0|1,0,1]=4 5215 B12R2.18 N[C@@H]1Cc2ccccc2[C@@H]1O Amb24501357 [0,1,0,1,0,0|1,0,1]=4 5216 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb22388538 [0,1,0,1,0,0|1,0,1]=4 5217 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb25379044 [0,1,0,1,0,0|1,0,1]=4 5218 B12R2.18 N[C@H]1Cc2ccccc2[C@H]1O Amb24540566 [0,1,0,1,0,0|1,0,1]=4 5219 B12R2.18 Nc1[n]c2ccccc2[n]1O Amb24429903 [0,1,0,1,0,0|1,0,1]=4 5220 B12R2.18 O=C1Cc2c(N1C)cccc2 Amb1398903 [0,1,0,1,0,0|1,0,1]=4 5221 B12R2.18 O=C1Cc2c(N1N)cccc2 Amb10560115 [0,1,0,1,0,0|1,0,1]=4 5222 B12R2.18 O=C1Cc2ccccc2C1Br Amb21987890 [0,1,0,1,0,0|2,0,0]=4 5223 B12R2.18 O=C1Cc2ccccc2C1F Amb25142685 [0,1,0,1,0,0|2,0,0]=4 5224 B12R2.18 O=C1Cc2ccccc2C1[Na] Amb24605330 [0,1,0,1,0,0|2,0,0]=4 5225 B12R2.18 OC1C(=O)Oc2ccccc21 Amb24102222 [0,1,0,1,0,0|2,0,0]=4 5226 B12R2.18 OC1C(Br)Cc2c1cccc2 Amb1159074 [0,1,0,1,0,0|1,0,1]=4 5227 B12R2.18 OC1C(F)Cc2ccccc21 Amb24423988 [0,1,0,1,0,0|1,0,1]=4 5228 B12R2.18 OC1C(N)Cc2c1cccc2 Amb2383051 [0,1,0,1,0,0|1,0,1]=4 5229 B12R2.18 OC1Cc2ccccc2C1O Amb24323306 [0,1,0,1,0,0|1,0,1]=4 5230 B12R2.18 ON1C(=O)Cc2ccc[n]c12 Amb24082462 [0,1,0,1,0,0|1,0,1]=4 5231 B12R2.18 ON1C(=O)Cc2ccccc12 Amb17940424 [0,1,0,1,0,0|0,0,1]=3 5232 B12R2.18 O[C@@H]1C(Br)Cc2ccccc21 Amb25061997 [0,1,0,1,0,0|1,0,1]=4 5233 B12R2.18 O[C@@H]1Cc2ccccc2[C@@H]1O Amb22800784 [0,1,0,1,0,0|1,0,1]=4 5234 B12R2.18 O[C@@H]1[C@@H](F)Cc2ccccc21 Amb25200299 [0,1,0,1,0,0|1,0,1]=4 5235 B12R2.18 O[C@@H]1[C@H](F)Cc2ccccc21 Amb25176954 [0,1,0,1,0,0|1,0,1]=4 5236 B12R2.18 O[C@H]1C(=O)Nc2ccccc21 Amb25152859 [0,1,0,1,0,0|2,0,0]=4 5237 B12R2.18 O[C@H]1Cc2ccccc2[C@H]1O Amb22230411 [0,1,0,1,0,0|1,0,1]=4 5238 B12R2.18 O[C@H]1[C@H](Cl)Cc2ccccc21 Amb24519428 [0,1,0,1,0,0|1,0,1]=4 5239 B12R2.18 O[C@H]1[C@H](O)Cc2c1cccc2 Amb10982589 [0,1,0,1,0,0|1,0,1]=4 5240 B12R2.18 O[n]1c(Br)[n]c2ccccc12 Amb24472376 [0,1,0,1,0,0|1,0,1]=4 5241 B12R2.18 Oc1c(Br)[s]c2ccccc21 Amb25309520 [0,1,0,1,0,0|2,0,0]=4 5242 B12R2.18 Oc1c(S)[nH]c2ccccc21 Amb24085063 [0,1,0,1,0,0|2,0,0]=4 5243 B12R2.18 Oc1c(S)[s]c2ccccc21 Amb24518700 [0,1,0,1,0,0|2,0,0]=4 5244 B12R2.18 Oc1c2ccccc2oc1O Amb24060920 [0,1,0,1,0,0|2,0,0]=4 5245 B12R2.18 [NH3+][C@@H]1Cc2ccccc2[C@H]1O Amb22224837 [0,1,0,1,0,0|1,0,1]=4 5246 B12R2.37 CC1C(O)C1c2ccccc2 Amb24457875 [0,1,0,1,0,0|1,0,1]=4 5247 B12R2.37 OC=1C(=O)C1c2ccccc2 Amb24631580 [0,1,0,1,0,0|1,0,1]=4 5248 B12R2.94 FC1(Cc2ccccc2)N=N1 Amb24425472 [0,1,0,1,0,0|1,0,1]=4 5249 B12R2.3511 COC(=O)C1c2ccccc21 Amb25270277 [0,1,0,1,0,0|2,0,0]=4 5250 B12R2.92 CC1(O)OC1c2ccccc2 Amb24353312 [0,1,0,1,0,0|2,0,0]=4 5251 B12R2.2403 N[C@]1(O)CCc2ccccc12 Amb24472858 [0,1,0,1,0,0|1,0,1]=4 5252 B12R2.2403 OP1(=O)OCc2ccccc12 Amb25149207 [0,1,0,1,0,0|1,1,0]=4 5253 B12R2.3190 CC(O)C1Cc2ccccc21 Amb24538275 [0,1,0,1,0,0|1,0,1]=4 5254 B12R2.3190 C[C@@H](O)C1Cc2ccccc21 Amb25151401 [0,1,0,1,0,0|1,0,1]=4 5255 B12R2.3190 C[C@H](O)C1Cc2ccccc21 Amb25172779 [0,1,0,1,0,0|1,0,1]=4 5256 B12R2.3190 OC(=O)C1=Cc2c1cccc2 Amb17593654 [0,1,0,1,0,0|1,0,1]=4 5257 B12R3.12 c1ccc2c(c1)C3OC3C2 Amb1131588 [0,0,0,2,0,0|1,0,1]=4 5258 B12R3.1604 C1C=2COC3=CN1C=CC23 Amb24100739 [0,0,0,2,0,0|2,0,0]=4 5259 B8R1.8 C=CCc1c[nH]cc1 Amb24426386 [1,0,0,0,1,0|2,0,0]=4 5260 B8R1.8 C=CCc1ccc[nH]1 Amb25075519 [1,0,0,0,1,0|2,0,0]=4 5261 B8R1.8 C=CCc1cocc1 Amb24729373 [1,0,0,0,1,0|2,0,0]=4 5262 B8R1.8 C\N=C\c1c[nH]cc1 Amb24621844 [1,0,0,0,1,0|2,0,0]=4 5263 B8R1.8 C\N=C\c1ccco1 Amb25186851 [1,0,0,0,1,0|2,0,0]=4 5264 B8R1.8 N=CCc1c[n]c[nH]1 Amb25163733 [1,0,0,0,1,0|2,0,0]=4 5265 B8R1.8 N\N=C\c1c[nH]cc1 Amb25185315 [1,0,0,0,1,0|2,0,0]=4 5266 B8R1.8 N\N=C\c1ccc[nH]1 Amb25090365 [1,0,0,0,1,0|2,0,0]=4 5267 B8R1.8 N\N=C\c1ccco1 Amb24370911 [1,0,0,0,1,0|2,0,0]=4 5268 B8R1.8 O=CC[n]1cccc1 Amb18203408 [1,0,0,0,1,0|1,0,1]=4 5269 B8R1.8 O=CCc1ccc[nH]1 Amb24763675 [1,0,0,0,1,0|1,0,1]=4 5270 B8R1.8 O=CCc1ccco1 Amb17089526 [1,0,0,0,1,0|1,0,1]=4 5271 B8R1.8 O=CCc1cccs1 Amb17089527 [1,0,0,0,1,0|1,0,1]=4 5272 B8R1.8 O=CCc1cocc1 Amb18641576 [1,0,0,0,1,0|1,0,1]=4 5273 B8R1.8 OCCC1=CCC=C1 Amb25700126 [1,0,0,0,1,0|0,0,2]=4 5274 B8R1.8 OCCC1C=CC=C1 Amb25356398 [1,0,0,0,1,0|0,0,2]=4 5275 B8R1.8 OCCC=1CC=CC1 Amb25795365 [1,0,0,0,1,0|0,0,2]=4 5276 B8R1.8 OCCc1c[nH]cc1 Amb18860246 [1,0,0,0,1,0|1,0,1]=4 5277 B8R1.8 OCCc1ccc[nH]1 Amb17593146 [1,0,0,0,1,0|1,0,1]=4 5278 B8R1.8 OCCc1ccco1 Amb17089516 [1,0,0,0,1,0|1,0,1]=4 5279 B8R1.8 OCCc1cccs1 Amb2099445 [1,0,0,0,1,0|1,0,1]=4 5280 B8R1.8 OCCc1cocc1 Amb25802261 [1,0,0,0,1,0|1,0,1]=4 5281 B8R1.8 ON=Cc1c[n]c[nH]1 Amb24394914 [1,0,0,0,1,0|2,0,0]=4 5282 B8R1.8 ON=Cc1c[n]c[s]1 Amb24469825 [1,0,0,0,1,0|2,0,0]=4 5283 B8R1.8 ON=Cc1c[s]c[n]1 Amb25074840 [1,0,0,0,1,0|2,0,0]=4 5284 B8R1.8 ONCc1c[nH]cc1 Amb25677397 [1,0,0,0,1,0|1,0,1]=4 5285 B8R1.8 ONCc1ccc[nH]1 Amb25071150 [1,0,0,0,1,0|1,0,1]=4 5286 B8R1.8 ONCc1ccc[s]1 Amb23449451 [1,0,0,0,1,0|1,0,1]=4 5287 B8R1.8 ONCc1ccco1 Amb23449450 [1,0,0,0,1,0|1,0,1]=4 5288 B8R1.8 O\N=C/c1ccco1 Amb10068736 [1,0,0,0,1,0|1,0,0]=3 5289 B8R1.8 O\N=C\C=1CC=CC1 Amb24748669 [1,0,0,0,1,0|0,0,1]=3 5290 B8R1.8 O\N=C\c1[n]cc[s]1 Amb22736216 [1,0,0,0,1,0|2,0,0]=4 5291 B8R1.8 O\N=C\c1c[nH]c[n]1 Amb21953000 [1,0,0,0,1,0|2,0,0]=4 5292 B8R1.8 O\N=C\c1c[nH]cc1 Amb22491065 [1,0,0,0,1,0|1,0,0]=3 5293 B8R1.8 O\N=C\c1c[n]c[s]1 Amb24524534 [1,0,0,0,1,0|2,0,0]=4 5294 B12R1.329 OCCCC=1C=CC=CC=CC1 Amb25225983 [0,0,0,0,0,2|1,0,1]=4